A0A5K4F4C0_SCHMA Loading...

Matrix-remodeling-associated protein 7 helical domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F4C0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 164 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
1M38.6Very low46.3Very low241 Ų241112 Ų112100%1.18758%0.579SS**  0115.40-74.6-177.7177.300105.9S3M1-S3 PolarHBondContact O-N 3.41Å
2E40Very low47.5Very low189 Ų189106.5 Ų106.588%0.88356%0.558SS**  trans-68125174.9-75.2175161.400108.8K4E2-K4 PolarHBondContact O-N 2.99Å
3S46.2Very low48.6Very low89 Ų89105.4 Ų105.462%0.62256%0.558SS**  trans-60.9104.3172.4-49.10000107.9M1 H5M1-S3 PolarHBondContact O-N 3.41Å; S3-H5 VanDerWaalsContact C-N 3.34Å; S3-H5 PolarHBondContact O-CD2 2.91Å; S3-H5 PolarHBondContact O-N 3.37Å
4K44.1Very low49.6Very low204 Ų204109.1 Ų109.189%0.88757%0.571SS**  trans-6896.6172.8-74-175.1178.3-1790107.7E2E2-K4 PolarHBondContact O-N 2.99Å
5H43.3Very low50.3Low111 Ų111108.5 Ų108.551%0.51456%0.564SS.*  trans-66.7134.8175.1-69-69000109.7S3 F9S3-H5 VanDerWaalsContact C-N 3.34Å; S3-H5 PolarHBondContact O-CD2 2.91Å; S3-H5 PolarHBondContact O-N 3.37Å; H5-F9 HydrophobicContact CB-CB 4.38Å
6H44.1Very low50.8Low45 Ų45102.1 Ų102.121%0.20853%0.531CS..  trans-58.3141.7174.4-169.9-98.9000109.7S8 F9 E138H6-S8 PolarHBondContact CE1-OG 3.25Å; H6-S8 VanDerWaalsContact CE1-OG 3.28Å; H6-S8 WeakPolarHBondContact ND1-CB 3.49Å; H6-S8 PolarHBondContact ND1-N 3.39Å; H6-S8 PolarHBondContact ND1-OG 3.46Å; H6-S8 PolarHBondContact O-N 3.13Å; H6-F9 PolarHBondContact O-N 3.04Å; H6-E138 IonicContact CD2-OE2 2.91Å; H6-E138 IonicContact CE1-OE2 3.8Å; H6-E138 PolarHBondContact CE1-OE2 3.26Å; H6-E138 IonicContact NE2-OE1 2.73Å; H6-E138 IonicContact NE2-OE2 3.67Å; H6-E138 PolarHBondContact NE2-OE2 2.71Å
7P49Very low51.5Low92 Ų92102.1 Ų102.160%0.59753%0.527SS*.Hα-helixtrans-48.5-31.3-179.7-30.335.7000114.4F9 V10P7-F9 PolarHBondContact O-N 2.84Å; P7-V10 VanDerWaalsContact O-CB 3.3Å; P7-V10 WeakPolarHBondContact O-CB 3.44Å; P7-V10 PolarHBondContact O-N 3.39Å
8S46Very low52.2Low22 Ų22104 Ų10415%0.15453%0.531CS..Hα-helixtrans-62.3-21.4176-53.70000114.5H6 K135H6-S8 PolarHBondContact CE1-OG 3.25Å; H6-S8 VanDerWaalsContact CE1-OG 3.28Å; H6-S8 WeakPolarHBondContact ND1-CB 3.49Å; H6-S8 PolarHBondContact ND1-N 3.39Å; H6-S8 PolarHBondContact ND1-OG 3.46Å; H6-S8 PolarHBondContact O-N 3.13Å; S8-K135 WeakPolarHBondContact OG-CE 3.34Å
9F46.8Very low52.5Low35 Ų35101.2 Ų101.215%0.15452%0.516CS..Hα-helixtrans-95.4-10.1171-78.3-75.3000113.5H5 H6 P7 N11 F16 L139 S142H5-F9 HydrophobicContact CB-CB 4.38Å; H6-F9 PolarHBondContact O-N 3.04Å; P7-F9 PolarHBondContact O-N 2.84Å; F9-N11 PolarHBondContact O-N 3.34Å; F9-F16 HydrophobicContact CD1-CB 4.46Å; F9-F16 HydrophobicContact CE1-CB 4.17Å; F9-F16 HydrophobicContact CE1-CD1 4.18Å; F9-F16 AromaticContact CE1-CD2 3.98Å; F9-F16 HydrophobicContact CE1-CD2 3.98Å; F9-F16 HydrophobicContact CE1-CE2 4.36Å; F9-F16 AromaticContact CE1-CG 3.85Å; F9-F16 HydrophobicContact CE1-CG 3.85Å; F9-F16 AromaticContact CZ-CD2 3.9Å; F9-F16 HydrophobicContact CZ-CD2 3.9Å; F9-F16 AromaticContact CZ-CE2 3.91Å; F9-F16 HydrophobicContact CZ-CE2 3.91Å; F9-F16 HydrophobicContact CZ-CG 4.22Å; F9-F16 HydrophobicContact CZ-CZ 4.24Å; F9-L139 HydrophobicContact CD2-CD2 3.41Å; F9-L139 VanDerWaalsContact CD2-CD2 3.41Å; F9-L139 HydrophobicContact CE1-CD2 4.35Å; F9-L139 HydrophobicContact CE2-CB 3.84Å; F9-L139 HydrophobicContact CE2-CD2 3.08Å; F9-L139 HydrophobicContact CE2-CG 4.05Å; F9-L139 VanDerWaalsContact CE2-O 3.3Å; F9-L139 WeakPolarHBondContact CE2-O 3.47Å; F9-L139 HydrophobicContact CG-CD2 4.17Å; F9-L139 HydrophobicContact CZ-CB 4.28Å; F9-L139 HydrophobicContact CZ-CD2 3.62Å; F9-S142 WeakPolarHBondContact CD2-OG 2.97Å; F9-S142 WeakPolarHBondContact CE2-OG 3.04Å
10V52Low52.9Low102 Ų10297 Ų9762%0.61850%0.495SS*.Hα-helixtrans-65.9-22.5-175.4175.50000111.6P7P7-V10 VanDerWaalsContact O-CB 3.3Å; P7-V10 WeakPolarHBondContact O-CB 3.44Å; P7-V10 PolarHBondContact O-N 3.39Å
11N59.2Low53.2Low102 Ų10295.5 Ų95.555%0.54549%0.493SS..SBendtrans-96.1-22.1-175.2-65.6-12.2000115.1F9 E15F9-N11 PolarHBondContact O-N 3.34Å; N11-E15 HydrophobicContact CB-CB 4.36Å; N11-E15 HydrophobicContact CB-CG 4.08Å; N11-E15 WeakPolarHBondContact CB-OE2 3.2Å; N11-E15 PolarHBondContact ND2-OE2 3.33Å
12S60.8Low54.1Low46 Ų4690.5 Ų90.532%0.32247%0.467SS..  trans149157.4167.954.70000111.2E14 E15 F16S12-E14 PolarHBondContact O-N 3.22Å; S12-E14 PolarHBondContact OG-N 3.21Å; S12-E15 PolarHBondContact O-N 3.35Å; S12-E15 PolarHBondContact OG-N 3.47Å; S12-E15 VanDerWaalsContact OG-N 3.17Å; S12-F16 PolarHBondContact O-N 3.2Å
13T62Low54.9Low92 Ų9282.5 Ų82.556%0.56443%0.432SS*.Hα-helixtrans-54.1-30166.1-45.60000112.2F16 H17T13-F16 WeakPolarHBondContact O-CB 3.39Å; T13-F16 PolarHBondContact O-N 3.34Å; T13-H17 PolarHBondContact O-CD2 3.39Å; T13-H17 PolarHBondContact O-N 3.01Å
14E62Low55.2Low158 Ų15882.3 Ų82.374%0.73843%0.429SS*.Hα-helixtrans-70-43.1179.5-169.1168.5-170.300112.3S12 F16 H17 K18S12-E14 PolarHBondContact O-N 3.22Å; S12-E14 PolarHBondContact OG-N 3.21Å; E14-F16 VanDerWaalsContact C-N 3.27Å; E14-F16 PolarHBondContact O-N 3.26Å; E14-H17 PolarHBondContact O-N 2.81Å; E14-K18 WeakPolarHBondContact O-CB 3.3Å; E14-K18 PolarHBondContact O-N 2.94Å
15E60.3Low55.5Low99 Ų9973.7 Ų73.746%0.46339%0.391SS..Hα-helixtrans-62-36.7172-78.4-157.2178.200112.2N11 S12 K18 L19N11-E15 HydrophobicContact CB-CB 4.36Å; N11-E15 HydrophobicContact CB-CG 4.08Å; N11-E15 WeakPolarHBondContact CB-OE2 3.2Å; N11-E15 PolarHBondContact ND2-OE2 3.33Å; S12-E15 PolarHBondContact O-N 3.35Å; S12-E15 PolarHBondContact OG-N 3.47Å; S12-E15 VanDerWaalsContact OG-N 3.17Å; E15-K18 WeakPolarHBondContact O-CB 3.43Å; E15-K18 PolarHBondContact O-N 2.91Å; E15-L19 WeakPolarHBondContact O-CB 3.36Å; E15-L19 PolarHBondContact O-N 2.78Å
16F59.2Low55.9Low7 Ų769.4 Ų69.43%0.03137%0.372CS..Hα-helixtrans-61.8-47.1174169.5-103.2000111.8F9 S12 T13 E14 K18 L19 L20 L139 Y147F9-F16 HydrophobicContact CD1-CB 4.46Å; F9-F16 HydrophobicContact CE1-CB 4.17Å; F9-F16 HydrophobicContact CE1-CD1 4.18Å; F9-F16 AromaticContact CE1-CD2 3.98Å; F9-F16 HydrophobicContact CE1-CD2 3.98Å; F9-F16 HydrophobicContact CE1-CE2 4.36Å; F9-F16 AromaticContact CE1-CG 3.85Å; F9-F16 HydrophobicContact CE1-CG 3.85Å; F9-F16 AromaticContact CZ-CD2 3.9Å; F9-F16 HydrophobicContact CZ-CD2 3.9Å; F9-F16 AromaticContact CZ-CE2 3.91Å; F9-F16 HydrophobicContact CZ-CE2 3.91Å; F9-F16 HydrophobicContact CZ-CG 4.22Å; F9-F16 HydrophobicContact CZ-CZ 4.24Å; S12-F16 PolarHBondContact O-N 3.2Å; T13-F16 WeakPolarHBondContact O-CB 3.39Å; T13-F16 PolarHBondContact O-N 3.34Å; E14-F16 VanDerWaalsContact C-N 3.27Å; E14-F16 PolarHBondContact O-N 3.26Å; F16-K18 VanDerWaalsContact C-N 3.26Å; F16-K18 PolarHBondContact O-N 3.49Å; F16-L19 PolarHBondContact O-N 2.99Å; F16-L20 HydrophobicContact CD1-CD1 4Å; F16-L20 HydrophobicContact CD2-CG 4.41Å; F16-L20 HydrophobicContact CE1-CD1 3.3Å; F16-L20 HydrophobicContact CE1-CG 4.17Å; F16-L20 HydrophobicContact CE2-CD1 3.92Å; F16-L20 HydrophobicContact CE2-CG 3.99Å; F16-L20 HydrophobicContact CZ-CD1 3.28Å; F16-L20 HydrophobicContact CZ-CD2 4.49Å; F16-L20 HydrophobicContact CZ-CG 3.88Å; F16-L20 WeakPolarHBondContact O-CB 2.98Å; F16-L20 PolarHBondContact O-N 2.88Å; F16-L139 HydrophobicContact CD2-CD1 3.84Å; F16-L139 HydrophobicContact CD2-CD2 3.57Å; F16-L139 HydrophobicContact CD2-CG 4.18Å; F16-L139 HydrophobicContact CE2-CB 3.9Å; F16-L139 HydrophobicContact CE2-CD1 3.74Å; F16-L139 HydrophobicContact CE2-CD2 3.84Å; F16-L139 HydrophobicContact CE2-CG 4.03Å; F16-Y147 VanDerWaalsContact CE1-OH 3.28Å; F16-Y147 WeakPolarHBondContact CE1-OH 2.83Å
17H61.6Low56Low101 Ų10170.8 Ų70.847%0.46839%0.386SS..Hα-helixtrans-61.7-35.7174.5-79.1-62.8000112.4T13 E14 S21T13-H17 PolarHBondContact O-CD2 3.39Å; T13-H17 PolarHBondContact O-N 3.01Å; E14-H17 PolarHBondContact O-N 2.81Å; H17-S21 VanDerWaalsContact O-CB 3.31Å; H17-S21 WeakPolarHBondContact O-CB 3.49Å; H17-S21 PolarHBondContact O-N 3.17Å; H17-S21 PolarHBondContact O-OG 2.84Å
18K64.2Low55.7Low137 Ų13769.6 Ų69.660%0.59637%0.374SS*.Hα-helixtrans-65.2-47175.2-167.5176.9-178.1-179.90111.5E14 E15 F16 S21 Q22E14-K18 WeakPolarHBondContact O-CB 3.3Å; E14-K18 PolarHBondContact O-N 2.94Å; E15-K18 WeakPolarHBondContact O-CB 3.43Å; E15-K18 PolarHBondContact O-N 2.91Å; F16-K18 VanDerWaalsContact C-N 3.26Å; F16-K18 PolarHBondContact O-N 3.49Å; K18-S21 PolarHBondContact O-N 2.94Å; K18-S21 PolarHBondContact O-OG 3.06Å; K18-Q22 WeakPolarHBondContact O-CG 3.43Å; K18-Q22 PolarHBondContact O-N 3.4Å
19L59Low55.5Low50 Ų5072.4 Ų72.426%0.26239%0.387SS..Hα-helixtrans-60.9-47176-174.675.2000111.2E15 F16 S21 Q22 C23 K135 L139E15-L19 WeakPolarHBondContact O-CB 3.36Å; E15-L19 PolarHBondContact O-N 2.78Å; F16-L19 PolarHBondContact O-N 2.99Å; L19-S21 VanDerWaalsContact C-N 3.31Å; L19-S21 PolarHBondContact O-N 3.29Å; L19-Q22 WeakPolarHBondContact O-CB 3.3Å; L19-Q22 PolarHBondContact O-N 3.27Å; L19-Q22 VanDerWaalsContact O-N 3.15Å; L19-C23 PolarHBondContact O-N 2.85Å; L19-K135 HydrophobicContact CD2-CD 3.83Å; L19-K135 HydrophobicContact CD2-CG 4.44Å; L19-L139 HydrophobicContact CD2-CD1 4.07Å
20L59.8Low55.4Low18 Ų1876 Ų769%0.09440%0.404CS..Hα-helixtrans-58.5-43.3174.8-84.9-173.3000111.3F16 Q22 C23 M26 L136F16-L20 HydrophobicContact CD1-CD1 4Å; F16-L20 HydrophobicContact CD2-CG 4.41Å; F16-L20 HydrophobicContact CE1-CD1 3.3Å; F16-L20 HydrophobicContact CE1-CG 4.17Å; F16-L20 HydrophobicContact CE2-CD1 3.92Å; F16-L20 HydrophobicContact CE2-CG 3.99Å; F16-L20 HydrophobicContact CZ-CD1 3.28Å; F16-L20 HydrophobicContact CZ-CD2 4.49Å; F16-L20 HydrophobicContact CZ-CG 3.88Å; F16-L20 WeakPolarHBondContact O-CB 2.98Å; F16-L20 PolarHBondContact O-N 2.88Å; L20-Q22 PolarHBondContact O-N 3.24Å; L20-C23 WeakPolarHBondContact O-CA 3.43Å; L20-C23 WeakPolarHBondContact O-CB 3.37Å; L20-C23 PolarHBondContact O-N 3.38Å; L20-M26 HydrophobicContact CB-CE 4.3Å; L20-M26 HydrophobicContact CB-CG 3.9Å; L20-M26 HydrophobicContact CB-SD 4.43Å; L20-M26 HydrophobicContact CD1-CE 4.28Å; L20-M26 HydrophobicContact CD1-SD 4.43Å; L20-M26 HydrophobicContact CD2-CG 4.29Å; L20-M26 HydrophobicContact CD2-SD 4.46Å; L20-M26 WeakPolarHBondContact O-CB 3.37Å; L20-M26 WeakPolarHBondContact O-CG 3.22Å; L20-L136 HydrophobicContact CD2-CD1 3.9Å
21S59Low55Low65 Ų6574.6 Ų74.646%0.45540%0.399SS..Hα-helixtrans-63.3-24.6179.174.80000113.8H17 K18 L19 C23H17-S21 VanDerWaalsContact O-CB 3.31Å; H17-S21 WeakPolarHBondContact O-CB 3.49Å; H17-S21 PolarHBondContact O-N 3.17Å; H17-S21 PolarHBondContact O-OG 2.84Å; K18-S21 PolarHBondContact O-N 2.94Å; K18-S21 PolarHBondContact O-OG 3.06Å; L19-S21 VanDerWaalsContact C-N 3.31Å; L19-S21 PolarHBondContact O-N 3.29Å; S21-C23 VanDerWaalsContact C-N 3.31Å
22Q58.6Low54.3Low136 Ų13672.3 Ų72.364%0.63639%0.391SS*.Hα-helixtrans-77-20.1173.4-66.9171.9-13.500112K18 L19 L20K18-Q22 WeakPolarHBondContact O-CG 3.43Å; K18-Q22 PolarHBondContact O-N 3.4Å; L19-Q22 WeakPolarHBondContact O-CB 3.3Å; L19-Q22 PolarHBondContact O-N 3.27Å; L19-Q22 VanDerWaalsContact O-N 3.15Å; L20-Q22 PolarHBondContact O-N 3.24Å
23C55.8Low53.3Low22 Ų2276 Ų7615%0.14940%0.403CS..SBendtrans-70.2126.1175.1-61.80000109.9L19 L20 S21 F25 M26L19-C23 PolarHBondContact O-N 2.85Å; L20-C23 WeakPolarHBondContact O-CA 3.43Å; L20-C23 WeakPolarHBondContact O-CB 3.37Å; L20-C23 PolarHBondContact O-N 3.38Å; S21-C23 VanDerWaalsContact C-N 3.31Å; C23-F25 HydrophobicContact CB-CD1 3.92Å; C23-F25 HydrophobicContact CB-CD2 4.31Å; C23-F25 HydrophobicContact CB-CE1 3.45Å; C23-F25 VanDerWaalsContact CB-CE1 3.45Å; C23-F25 HydrophobicContact CB-CE2 3.87Å; C23-F25 HydrophobicContact CB-CG 4.32Å; C23-F25 HydrophobicContact CB-CZ 3.41Å; C23-F25 VanDerWaalsContact CB-CZ 3.41Å; C23-F25 PolarHBondContact O-N 2.83Å; C23-M26 PolarHBondContact O-N 3.27Å
24P51.9Low52.4Low85 Ų8578.6 Ų78.655%0.55241%0.412SS*.THydrogen-bonded Turntrans-53.2-28.3-176.1-27.533000114.6
25F50.7Low51.2Low23 Ų2375.6 Ų75.610%0.10140%0.401CS..THydrogen-bonded Turntrans-79.9-19.1-178.357.3-101.8000114.8C23 S27 I28 I29 L136 M159 Y163C23-F25 HydrophobicContact CB-CD1 3.92Å; C23-F25 HydrophobicContact CB-CD2 4.31Å; C23-F25 HydrophobicContact CB-CE1 3.45Å; C23-F25 VanDerWaalsContact CB-CE1 3.45Å; C23-F25 HydrophobicContact CB-CE2 3.87Å; C23-F25 HydrophobicContact CB-CG 4.32Å; C23-F25 HydrophobicContact CB-CZ 3.41Å; C23-F25 VanDerWaalsContact CB-CZ 3.41Å; C23-F25 PolarHBondContact O-N 2.83Å; F25-S27 VanDerWaalsContact C-N 3.28Å; F25-S27 PolarHBondContact O-N 3.2Å; F25-I28 WeakPolarHBondContact O-CA 3.39Å; F25-I28 WeakPolarHBondContact O-CB 3.46Å; F25-I28 PolarHBondContact O-N 3.28Å; F25-I29 HydrophobicContact CD2-CD1 4.09Å; F25-I29 PolarHBondContact O-N 3.37Å; F25-L136 HydrophobicContact CZ-CD2 4.1Å; F25-M159 HydrophobicContact CD1-SD 3.99Å; F25-M159 HydrophobicContact CE1-SD 4.09Å; F25-M159 HydrophobicContact CG-SD 4.4Å; F25-Y163 HydrophobicContact CD1-CE2 4.25Å; F25-Y163 WeakPolarHBondContact CD1-OH 3.32Å
26M51.7Low49.9Very low21 Ų2177.9 Ų77.910%0.10341%0.409CS..Hα-helixtrans-68.9-28.3-177.2-85-63.1-67.600113.3L20 C23 I28 I29 Q30L20-M26 HydrophobicContact CB-CE 4.3Å; L20-M26 HydrophobicContact CB-CG 3.9Å; L20-M26 HydrophobicContact CB-SD 4.43Å; L20-M26 HydrophobicContact CD1-CE 4.28Å; L20-M26 HydrophobicContact CD1-SD 4.43Å; L20-M26 HydrophobicContact CD2-CG 4.29Å; L20-M26 HydrophobicContact CD2-SD 4.46Å; L20-M26 WeakPolarHBondContact O-CB 3.37Å; L20-M26 WeakPolarHBondContact O-CG 3.22Å; C23-M26 PolarHBondContact O-N 3.27Å; M26-I28 PolarHBondContact O-N 3.07Å; M26-I28 VanDerWaalsContact O-N 3.16Å; M26-I29 PolarHBondContact O-N 3.21Å; M26-I29 HydrophobicContact SD-CB 3.99Å; M26-I29 HydrophobicContact SD-CD1 3.85Å; M26-I29 HydrophobicContact SD-CG1 4.37Å; M26-I29 HydrophobicContact SD-CG2 4.33Å; M26-Q30 HydrophobicContact CE-CG 4.17Å; M26-Q30 WeakPolarHBondContact O-CB 3.16Å; M26-Q30 WeakPolarHBondContact O-CG 3.21Å; M26-Q30 PolarHBondContact O-N 3.45Å
27S47.6Very low48.9Very low73 Ų7387.5 Ų87.551%0.5145%0.451SS..Hα-helixtrans-53-34.5168.3-60.20000111.6F25 S31F25-S27 VanDerWaalsContact C-N 3.28Å; F25-S27 PolarHBondContact O-N 3.2Å; S27-S31 PolarHBondContact O-N 3.28Å; S27-S31 PolarHBondContact O-OG 2.96Å
28I40.9Very low47.6Very low68 Ų6891.5 Ų91.535%0.34947%0.467SS..Hα-helixtrans-80.8-43.6-179.2-57.2170.3000110.8F25 M26 S31 S32F25-I28 WeakPolarHBondContact O-CA 3.39Å; F25-I28 WeakPolarHBondContact O-CB 3.46Å; F25-I28 PolarHBondContact O-N 3.28Å; M26-I28 PolarHBondContact O-N 3.07Å; M26-I28 VanDerWaalsContact O-N 3.16Å; I28-S31 VanDerWaalsContact O-CB 3.32Å; I28-S31 WeakPolarHBondContact O-CB 3.06Å; I28-S31 PolarHBondContact O-N 2.85Å; I28-S32 PolarHBondContact O-N 3.17Å; I28-S32 VanDerWaalsContact O-N 3.12Å
29I41.8Very low45.9Very low80 Ų8091.3 Ų91.341%0.4147%0.471SS..Hα-helixtrans-63.6-43.6177.8-61.7179.9000110.9F25 M26 S31 S32 E33F25-I29 HydrophobicContact CD2-CD1 4.09Å; F25-I29 PolarHBondContact O-N 3.37Å; M26-I29 PolarHBondContact O-N 3.21Å; M26-I29 HydrophobicContact SD-CB 3.99Å; M26-I29 HydrophobicContact SD-CD1 3.85Å; M26-I29 HydrophobicContact SD-CG1 4.37Å; M26-I29 HydrophobicContact SD-CG2 4.33Å; I29-S31 VanDerWaalsContact C-N 3.27Å; I29-S31 PolarHBondContact O-N 3.27Å; I29-S32 WeakPolarHBondContact O-CB 2.93Å; I29-S32 PolarHBondContact O-N 3.24Å; I29-S32 PolarHBondContact O-OG 3.18Å; I29-E33 PolarHBondContact O-N 3.44Å
30Q44.6Very low44.4Very low110 Ų11096.4 Ų96.451%0.51450%0.499SS..Hα-helixtrans-64.2-32.6175.8-69.7-179.61.100112.2M26 S32 E33M26-Q30 HydrophobicContact CE-CG 4.17Å; M26-Q30 WeakPolarHBondContact O-CB 3.16Å; M26-Q30 WeakPolarHBondContact O-CG 3.21Å; M26-Q30 PolarHBondContact O-N 3.45Å; Q30-S32 PolarHBondContact O-N 2.83Å; Q30-E33 PolarHBondContact O-N 3.21Å
31S44Very low43Very low73 Ų73104.9 Ų104.951%0.5154%0.535SS..Hα-helixtrans-63.8-32.7172-57.90000112.1S27 I28 I29S27-S31 PolarHBondContact O-N 3.28Å; S27-S31 PolarHBondContact O-OG 2.96Å; I28-S31 VanDerWaalsContact O-CB 3.32Å; I28-S31 WeakPolarHBondContact O-CB 3.06Å; I28-S31 PolarHBondContact O-N 2.85Å; I29-S31 VanDerWaalsContact C-N 3.27Å; I29-S31 PolarHBondContact O-N 3.27Å
32S45.3Very low41.6Very low55 Ų55111.1 Ų111.139%0.38555%0.554SS.*Hα-helixtrans-79-23.5-177.675.10000114.3I28 I29 Q30 I34 N35I28-S32 PolarHBondContact O-N 3.17Å; I28-S32 VanDerWaalsContact O-N 3.12Å; I29-S32 WeakPolarHBondContact O-CB 2.93Å; I29-S32 PolarHBondContact O-N 3.24Å; I29-S32 PolarHBondContact O-OG 3.18Å; Q30-S32 PolarHBondContact O-N 2.83Å; S32-I34 PolarHBondContact O-N 3.45Å; S32-N35 PolarHBondContact O-N 3.39Å
33E39.2Very low40.2Very low123 Ų123114.8 Ų114.858%0.57556%0.563SS**Hα-helixtrans-64.4-24.7176.8-70.3-125.2126.500112.5I29 Q30 N35 K36I29-E33 PolarHBondContact O-N 3.44Å; Q30-E33 PolarHBondContact O-N 3.21Å; E33-N35 PolarHBondContact O-N 2.94Å; E33-K36 IonicContact OE1-NZ 3.07Å; E33-K36 PolarHBondContact OE1-NZ 3.05Å
34I42.9Very low38.8Very low146 Ų146123 Ų12375%0.74960%0.597SS**THydrogen-bonded Turntrans-65.6-20.6172.7-60.4174.9000111.5S32S32-I34 PolarHBondContact O-N 3.45Å
35N36.6Very low37.7Very low95 Ų95124.2 Ų124.251%0.50860%0.603SS.*THydrogen-bonded Turntrans-1092.6-172.9-85.3-40.4000116.4S32 E33 K37 K38S32-N35 PolarHBondContact O-N 3.39Å; E33-N35 PolarHBondContact O-N 2.94Å; N35-K37 PolarHBondContact O-N 2.7Å; N35-K38 PolarHBondContact O-N 3.31Å
36K34.2Very low36.6Very low147 Ų147132.4 Ų132.464%0.63964%0.638SS**THydrogen-bonded Turntrans-61-10.6179.5-76.6-178.1178.9169.80114.9E33E33-K36 IonicContact OE1-NZ 3.07Å; E33-K36 PolarHBondContact OE1-NZ 3.05Å
37K37.7Very low35.4Very low209 Ų209137.7 Ų137.791%0.90967%0.666SS**THydrogen-bonded Turntrans-83.6-0.9176.6-75.1-169.7178179.70116.1N35N35-K37 PolarHBondContact O-N 2.7Å
38K34.2Very low34.5Very low185 Ų185142.4 Ų142.480%0.80468%0.677SS**SBendtrans-134.25.1-174.6-75.2-173.1-180174.90118.1N35 N40N35-K38 PolarHBondContact O-N 3.31Å; K38-N40 PolarHBondContact O-N 2.76Å
39I29.1Very low34Very low133 Ų133146 Ų14668%0.68270%0.698SS**  trans-89.565.6176.2-45.5177.8000109.5
40N27.6Very low33.4Very low157 Ų157148.7 Ų148.784%0.8472%0.718SS**  trans-136.248.6170-134.8-0.5000110K38K38-N40 PolarHBondContact O-N 2.76Å
41K29.5Very low32.6Very low196 Ų196148.6 Ų148.685%0.85273%0.725SS**SBendtrans-142.890.5171.4-73.8-168.6177.5173.80111.4
42K30.2Very low31.9Very low196 Ų196152.9 Ų152.985%0.85274%0.741SS**  trans34.398.7142.5-67.1-178.7176.8178.30115.6K44K42-K44 PolarHBondContact O-N 3.5Å
43Y27.8Very low31Very low213 Ų213157 Ų15784%0.83575%0.754SS**  trans-59.284153.4-63.5-89000109.1T45Y43-T45 VanDerWaalsContact C-N 3.26Å; Y43-T45 PolarHBondContact O-N 3.17Å
44K27.8Very low30.5Very low195 Ų195158.9 Ų158.985%0.84877%0.768SS**  trans-83.687157.7-106.8-174.3175.4-175.30106.2K42 K46K42-K44 PolarHBondContact O-N 3.5Å; K44-K46 PolarHBondContact O-N 2.91Å; K44-K46 VanDerWaalsContact O-N 3.09Å
45T28.5Very low29.9Very low111 Ų111160.8 Ų160.868%0.68177%0.773SS**  trans-38.2107.4163.612.60000110.4Y43 L47Y43-T45 VanDerWaalsContact C-N 3.26Å; Y43-T45 PolarHBondContact O-N 3.17Å; T45-L47 HydrophobicContact CG2-CD1 3.98Å
46K27.2Very low29.4Very low194 Ų194163.5 Ų163.584%0.84378%0.783SS**  trans-96.380.5146.6-79.8-174.3177.2179.90105.7K44 K48K44-K46 PolarHBondContact O-N 2.91Å; K44-K46 VanDerWaalsContact O-N 3.09Å; K46-K48 VanDerWaalsContact C-N 3.29Å; K46-K48 PolarHBondContact O-N 3.42Å
47L26.8Very low29.3Very low133 Ų133164.6 Ų164.670%0.69680%0.795SS**  trans-64.197.6162.8-134.691.9000105.3T45T45-L47 HydrophobicContact CG2-CD1 3.98Å
48K28Very low28.8Very low171 Ų171162 Ų16274%0.74379%0.79SS**  trans-118.594.8165-88.8-167.6170.7-165.40106.4K46 T50K46-K48 VanDerWaalsContact C-N 3.29Å; K46-K48 PolarHBondContact O-N 3.42Å; K48-T50 PolarHBondContact O-N 3.1Å
49D30.6Very low28.5Very low145 Ų145159.3 Ų159.378%0.77579%0.785SS**SBendtrans53.449.2143.3-49.5-32.4000118.9
50T29Very low28.3Very low135 Ų135160.5 Ų160.583%0.82879%0.787SS**  trans-134.661.5155.849.50000110.6K48K48-T50 PolarHBondContact O-N 3.1Å
51T28.3Very low28.3Very low108 Ų108160.3 Ų160.366%0.66379%0.786SS**  trans-129.977.1170.334.80000109.4
52L28.4Very low28.2Very low163 Ų163158.6 Ų158.685%0.85379%0.786SS**SBendtrans-170.380.3151.5-136.582.3000111.9
53H27Very low28Very low142 Ų142157.3 Ų157.366%0.65778%0.784SS**SBendtrans-157.2-15.7146.7-138.754.9000116.2H55H53-H55 VanDerWaalsContact C-N 3.27Å; H53-H55 PolarHBondContact O-N 3.32Å
54N29.9Very low27.9Very low163 Ų163153.8 Ų153.887%0.87278%0.784SS**THydrogen-bonded Turntrans-85.215.1-175.7-72-0.9000115.5
55H29.4Very low27.7Very low185 Ų185152.3 Ų152.386%0.85679%0.785SS**THydrogen-bonded Turntrans-115.511.4175.4-100.6-57.9000115.4H53H53-H55 VanDerWaalsContact C-N 3.27Å; H53-H55 PolarHBondContact O-N 3.32Å
56Q27.2Very low27.6Very low152 Ų152152.8 Ų152.871%0.7178%0.783SS**SBendtrans-112.621.7177.2-92.5175.3-37.100114.8
57L30.9Very low27.5Very low171 Ų171151.7 Ų151.790%0.89578%0.781SS**SBendtrans-100.45.9171-116.3120.4000114.5
58L28.5Very low27.6Very low155 Ų155151 Ų15181%0.81279%0.788SS**SBendtrans-114.43.7-178.5-98.1166.4000115.9
59N26.1Very low27.5Very low128 Ų128152.6 Ų152.668%0.68479%0.794SS**SBendtrans-137.1120.3171.2-99.93.9000111.5
60E24.8Very low27.4Very low158 Ų158153.5 Ų153.574%0.73880%0.799SS**  trans69.3100148.8-59.9168.4-163.700114.9
61N28.3Very low27.3Very low152 Ų152156.3 Ų156.381%0.81380%0.8SS**  -17268126.9-82.5-27.3000109.4
62N27.2Very low27.4Very low160 Ų160155.4 Ų155.486%0.85680%0.798SS**  trans-61.9136.3133.9-80.1-37.4000106.2
63E25.6Very low27.3Very low170 Ų170155.3 Ų155.379%0.79480%0.799SS**SBendtrans84.678.7179.1-52.4-175163.500116.3
64T26.3Very low27.4Very low139 Ų139156.6 Ų156.685%0.85381%0.805SS**  173.693.598.328.70000110.2N66T64-N66 PolarHBondContact O-N 3.05Å; T64-N66 VanDerWaalsContact O-N 3.17Å
65L24.5Very low27.2Very low163 Ų163158.2 Ų158.285%0.85380%0.804SS**  trans-58.6105.6156.2-178.278.3000108.3
66N26.2Very low27.1Very low121 Ų121158.6 Ų158.665%0.64781%0.806SS**  trans-179.1111.1135.3-92.6-35.7000113.6T64T64-N66 PolarHBondContact O-N 3.05Å; T64-N66 VanDerWaalsContact O-N 3.17Å
67Q24.2Very low27.1Very low171 Ų171159.8 Ų159.880%0.79981%0.812SS**  trans64.4104.8130.5-58.5175.63800119.5
68S28.4Very low26.8Very low120 Ų120159.7 Ų159.784%0.83981%0.807SS**  -160.6123.5115.955.20000111.2
69K26.5Very low26.7Very low203 Ų203159 Ų15988%0.88380%0.802SS**  trans-53.6135.9167.1-78.4157.8167.7161.50110.3
70D28.1Very low26.6Very low164 Ų164158.6 Ų158.688%0.87780%0.799SS**  trans-143136.5139.1-123.2-25.3000110.8
71K27.6Very low26.8Very low194 Ų194158 Ų15884%0.84380%0.799SS**  trans-78.8121.6-169.5-62.9174.6174.8-178.10109.3
72S30.7Very low26.7Very low89 Ų89159 Ų15962%0.62280%0.797SS**  trans-119.6106.9158.457.50000109.2E74S72-E74 PolarHBondContact O-N 2.81Å
73D25.6Very low26.7Very low162 Ų162159 Ų15987%0.86680%0.797SS**  trans-64.384.3164.9-70.7-46.7000108.5
74E28.8Very low27Very low169 Ų169158 Ų15879%0.7980%0.795SS**  trans-96.1111.6172.9-78.7-174.2170.400110.1S72 E76S72-E74 PolarHBondContact O-N 2.81Å; E74-E76 PolarHBondContact O-N 3.26Å
75K26.4Very low26.9Very low196 Ų196160.6 Ų160.685%0.85279%0.794SS**  trans-59.4126.4-176.8-66170.1177.8174.50110.5E77K75-E77 PolarHBondContact O-N 3.09Å
76E27.6Very low27.1Very low194 Ų194160.3 Ų160.391%0.90779%0.792SS**  trans-61.3113.6170.5-66.7178.5159.100109.9E74 E78E74-E76 PolarHBondContact O-N 3.26Å; E76-E78 PolarHBondContact O-N 3.17Å
77E27.3Very low27.1Very low177 Ų177160.7 Ų160.783%0.82780%0.798SS**  trans-79.2104.9171.1-72.9-171.8165.100109.9K75 I79K75-E77 PolarHBondContact O-N 3.09Å; E77-I79 PolarHBondContact O-N 2.86Å
78E24.4Very low27.5Very low169 Ų169159.9 Ų159.979%0.7980%0.8SS**  trans-76101.9173.5-167.1179.8-170.600110.3E76 I80E76-E78 PolarHBondContact O-N 3.17Å; E78-I80 HydrophobicContact CG-CG1 4.32Å; E78-I80 PolarHBondContact O-N 3.49Å; E78-I80 VanDerWaalsContact O-N 3.16Å
79I26.4Very low27.5Very low139 Ų139163 Ų16371%0.71380%0.798SS**  trans-81.493.1177.8-56.5175.8000109.4E77 I81E77-I79 PolarHBondContact O-N 2.86Å; I79-I81 HydrophobicContact CG2-CG1 4.15Å; I79-I81 PolarHBondContact O-N 3.4Å
80I24.7Very low27.6Very low121 Ų121162 Ų16262%0.62180%0.797SS**  trans-76.3103.8172.8-58.9174.8000109.5E78 K82E78-I80 HydrophobicContact CG-CG1 4.32Å; E78-I80 PolarHBondContact O-N 3.49Å; E78-I80 VanDerWaalsContact O-N 3.16Å; I80-K82 HydrophobicContact CG2-CG 4.22Å; I80-K82 PolarHBondContact O-N 3.39Å
81I28.7Very low27.9Very low145 Ų145158.1 Ų158.174%0.74478%0.779SS**  trans-8393.1175.8-54.5175.2000108.8I79I79-I81 HydrophobicContact CG2-CG1 4.15Å; I79-I81 PolarHBondContact O-N 3.4Å
82K25.7Very low28.5Very low174 Ų174154.4 Ų154.476%0.75777%0.773SS**  trans-87.5114.5168.4-86.3-179177.7177.10110.7I80 I84I80-K82 HydrophobicContact CG2-CG 4.22Å; I80-K82 PolarHBondContact O-N 3.39Å; K82-I84 PolarHBondContact O-N 2.85Å; K82-I84 VanDerWaalsContact O-N 3.13Å
83D27.9Very low29Very low160 Ų160155.8 Ų155.886%0.85677%0.773SS**  trans1.286.9162.1-59.1-42000116.6K85D83-K85 PolarHBondContact O-N 2.91Å; D83-K85 VanDerWaalsContact O-N 3.14Å
84I30.8Very low29.6Very low148 Ų148152.3 Ų152.376%0.75975%0.754SS**  trans-76.2103.5174.8-62.4175.3000109.1K82 I86K82-I84 PolarHBondContact O-N 2.85Å; K82-I84 VanDerWaalsContact O-N 3.13Å; I84-I86 PolarHBondContact O-N 3.24Å
85K24.3Very low30Very low193 Ų193148.1 Ų148.184%0.83974%0.741SS**  trans-70.2105.2166.3-149.2174.9-170.8177.60108.3D83 V87D83-K85 PolarHBondContact O-N 2.91Å; D83-K85 VanDerWaalsContact O-N 3.14Å; K85-V87 PolarHBondContact O-N 3.24Å
86I29.6Very low30.5Very low158 Ų158143 Ų14381%0.8173%0.726SS**  trans-66.996.8-177.5-59.7170.7000109.4I84I84-I86 PolarHBondContact O-N 3.24Å
87V26Very low31.4Very low128 Ų128139.2 Ų139.278%0.77671%0.711SS**  trans-92.6113.1167.91780000108.2K85 K89K85-V87 PolarHBondContact O-N 3.24Å; V87-K89 PolarHBondContact O-N 3.01Å; V87-K89 VanDerWaalsContact O-N 3.12Å
88N31.4Very low31.9Very low154 Ų154137.5 Ų137.582%0.82470%0.697SS**  trans-65.499.3-173.8-156.75.6000111.5
89K28.1Very low32.5Very low187 Ų187133.6 Ų133.681%0.81368%0.682SS**  trans-149.183.1163.6-111-176.8-177.5-179.60111.4V87 T91V87-K89 PolarHBondContact O-N 3.01Å; V87-K89 VanDerWaalsContact O-N 3.12Å; K89-T91 PolarHBondContact O-N 3.15Å
90Q30Very low33.3Very low181 Ų181132.3 Ų132.385%0.84668%0.676SS**  trans49.460.7134.2-143.7160.629.500117.7
91T33Very low34Very low83 Ų83128.3 Ų128.351%0.50966%0.659SS.*  trans-124.787.1157.839.80000109.9K89 N93 D94K89-T91 PolarHBondContact O-N 3.15Å; T91-N93 PolarHBondContact O-N 2.87Å; T91-N93 VanDerWaalsContact O-N 3.09Å; T91-D94 WeakPolarHBondContact CB-OD2 3.33Å; T91-D94 PolarHBondContact O-N 3.37Å; T91-D94 PolarHBondContact OG1-OD2 3.27Å
92T42.2Very low34.3Very low115 Ų115123.9 Ų123.971%0.70664%0.636SS**THydrogen-bonded Turntrans-64.7-9.5-179.249.60000114.4
93N40.7Very low35.4Very low118 Ų118117.6 Ų117.663%0.63162%0.615SS**THydrogen-bonded Turntrans-85.5-26.4177.3-68.7-7.8000112.4T91 T95 T96T91-N93 PolarHBondContact O-N 2.87Å; T91-N93 VanDerWaalsContact O-N 3.09Å; N93-T95 VanDerWaalsContact C-N 3.34Å; N93-T95 PolarHBondContact O-N 3.5Å; N93-T96 PolarHBondContact O-OG1 3.11Å
94D37.4Very low36.4Very low89 Ų89113.2 Ų113.248%0.47660%0.597SS.*Hα-helixtrans-74.1-30.4-176.4-62.6-24.6000110.9T91 T96 I97 Y98T91-D94 WeakPolarHBondContact CB-OD2 3.33Å; T91-D94 PolarHBondContact O-N 3.37Å; T91-D94 PolarHBondContact OG1-OD2 3.27Å; D94-T96 PolarHBondContact O-N 3Å; D94-I97 PolarHBondContact O-N 3Å; D94-Y98 WeakPolarHBondContact O-CB 2.87Å; D94-Y98 PolarHBondContact O-N 3.34Å
95T36.7Very low37.3Very low82 Ų82111.1 Ų111.150%0.50359%0.586SS.*Hα-helixtrans-67.2-37.7-178.8-390000112.6N93 Y98 L99N93-T95 VanDerWaalsContact C-N 3.34Å; N93-T95 PolarHBondContact O-N 3.5Å; T95-Y98 PolarHBondContact O-N 3.42Å; T95-L99 WeakPolarHBondContact O-CG 3.28Å; T95-L99 PolarHBondContact O-N 2.85Å
96T38.1Very low39.1Very low87 Ų87107.1 Ų107.153%0.53457%0.568SS.*Hα-helixtrans-69.1-39.2175.830.40000112.3N93 D94 Y98 L99 N100N93-T96 PolarHBondContact O-OG1 3.11Å; D94-T96 PolarHBondContact O-N 3Å; T96-Y98 VanDerWaalsContact C-N 3.31Å; T96-L99 PolarHBondContact O-N 2.99Å; T96-N100 PolarHBondContact O-N 2.64Å; T96-N100 VanDerWaalsContact O-N 3.14Å
97I45Very low40.6Very low115 Ų115101.7 Ų101.759%0.5954%0.539SS*.Hα-helixtrans-67.3-38.6173.6-62.9174.1000109.6D94 N100 S101D94-I97 PolarHBondContact O-N 3Å; I97-N100 PolarHBondContact O-N 3.27Å; I97-S101 VanDerWaalsContact O-CB 3.24Å; I97-S101 WeakPolarHBondContact O-CB 3.43Å; I97-S101 PolarHBondContact O-N 3.22Å; I97-S101 PolarHBondContact O-OG 3.36Å
98Y39.1Very low42.4Very low141 Ų14198.5 Ų98.555%0.55352%0.522SS*.Hα-helixtrans-67.8-33.2178.7-172.6-109.2000113.1D94 T95 T96 S101 L102D94-Y98 WeakPolarHBondContact O-CB 2.87Å; D94-Y98 PolarHBondContact O-N 3.34Å; T95-Y98 PolarHBondContact O-N 3.42Å; T96-Y98 VanDerWaalsContact C-N 3.31Å; Y98-S101 WeakPolarHBondContact CA-OG 3.28Å; Y98-S101 PolarHBondContact O-OG 2.87Å; Y98-L102 HydrophobicContact CD1-CD1 3.45Å; Y98-L102 VanDerWaalsContact CD1-CD1 3.45Å; Y98-L102 HydrophobicContact CD1-CG 4.22Å; Y98-L102 HydrophobicContact CE1-CD1 3.14Å; Y98-L102 HydrophobicContact CE1-CG 3.91Å; Y98-L102 HydrophobicContact CE2-CD1 4.48Å; Y98-L102 HydrophobicContact CE2-CG 4.41Å; Y98-L102 HydrophobicContact CG-CD1 4.26Å; Y98-L102 WeakPolarHBondContact O-CB 3.5Å; Y98-L102 WeakPolarHBondContact O-CD1 3.42Å; Y98-L102 VanDerWaalsContact O-CG 3.25Å; Y98-L102 WeakPolarHBondContact O-CG 3.44Å; Y98-L102 PolarHBondContact O-N 3.48Å
99L36.7Very low44.1Very low88 Ų8899.6 Ų99.646%0.46152%0.515SS..Hα-helixtrans-75.4-41.1174.8-73.6173.8000111.9T95 T96 S101 L102 S103T95-L99 WeakPolarHBondContact O-CG 3.28Å; T95-L99 PolarHBondContact O-N 2.85Å; T96-L99 PolarHBondContact O-N 2.99Å; L99-S101 VanDerWaalsContact C-N 3.28Å; L99-S101 PolarHBondContact O-N 3.36Å; L99-L102 HydrophobicContact CD2-CD1 4.27Å; L99-L102 PolarHBondContact O-N 3.45Å; L99-S103 PolarHBondContact O-N 3.21Å; L99-S103 PolarHBondContact O-OG 2.86Å
100N42.5Very low45.8Very low111 Ų11194.4 Ų94.459%0.59450%0.495SS*.Hα-helixtrans-65.5-35.1172.8-73.8-10.9000111.3T96 I97 S103 S104T96-N100 PolarHBondContact O-N 2.64Å; T96-N100 VanDerWaalsContact O-N 3.14Å; I97-N100 PolarHBondContact O-N 3.27Å; N100-S103 PolarHBondContact O-OG 3.31Å; N100-S104 WeakPolarHBondContact O-CB 3.43Å; N100-S104 PolarHBondContact O-N 2.92Å; N100-S104 PolarHBondContact O-OG 3.03Å
101S40.5Very low47.7Very low37 Ų3789.6 Ų89.626%0.25947%0.472SS..Hα-helixtrans-72.7-40.7173.278.80000110.5I97 Y98 L99 S103 S104 I105I97-S101 VanDerWaalsContact O-CB 3.24Å; I97-S101 WeakPolarHBondContact O-CB 3.43Å; I97-S101 PolarHBondContact O-N 3.22Å; I97-S101 PolarHBondContact O-OG 3.36Å; Y98-S101 WeakPolarHBondContact CA-OG 3.28Å; Y98-S101 PolarHBondContact O-OG 2.87Å; L99-S101 VanDerWaalsContact C-N 3.28Å; L99-S101 PolarHBondContact O-N 3.36Å; S101-S103 PolarHBondContact O-N 3.17Å; S101-S104 PolarHBondContact O-N 2.94Å; S101-I105 WeakPolarHBondContact O-CA 3.17Å; S101-I105 WeakPolarHBondContact O-CB 3.42Å; S101-I105 VanDerWaalsContact O-CD1 3.26Å; S101-I105 WeakPolarHBondContact O-CD1 3.49Å; S101-I105 WeakPolarHBondContact O-CG1 3.43Å; S101-I105 PolarHBondContact O-N 3.19Å
102L34.9Very low49.4Very low52 Ų5289.9 Ų89.927%0.27247%0.47SS..Hα-helixtrans-62.4-42.3175.7-89.1164.4000112.3Y98 L99 K106Y98-L102 HydrophobicContact CD1-CD1 3.45Å; Y98-L102 VanDerWaalsContact CD1-CD1 3.45Å; Y98-L102 HydrophobicContact CD1-CG 4.22Å; Y98-L102 HydrophobicContact CE1-CD1 3.14Å; Y98-L102 HydrophobicContact CE1-CG 3.91Å; Y98-L102 HydrophobicContact CE2-CD1 4.48Å; Y98-L102 HydrophobicContact CE2-CG 4.41Å; Y98-L102 HydrophobicContact CG-CD1 4.26Å; Y98-L102 WeakPolarHBondContact O-CB 3.5Å; Y98-L102 WeakPolarHBondContact O-CD1 3.42Å; Y98-L102 VanDerWaalsContact O-CG 3.25Å; Y98-L102 WeakPolarHBondContact O-CG 3.44Å; Y98-L102 PolarHBondContact O-N 3.48Å; L99-L102 HydrophobicContact CD2-CD1 4.27Å; L99-L102 PolarHBondContact O-N 3.45Å; L102-K106 VanDerWaalsContact O-CB 3.27Å; L102-K106 WeakPolarHBondContact O-CB 3.39Å; L102-K106 WeakPolarHBondContact O-CG 3.33Å; L102-K106 PolarHBondContact O-N 3.3Å
103S49.1Very low50.8Low43 Ų4388.8 Ų88.830%0.30146%0.457SS..Hα-helixtrans-65.9-45.9175.462.30000110.6L99 N100 S101 K106 K107L99-S103 PolarHBondContact O-N 3.21Å; L99-S103 PolarHBondContact O-OG 2.86Å; N100-S103 PolarHBondContact O-OG 3.31Å; S101-S103 PolarHBondContact O-N 3.17Å; S103-K106 PolarHBondContact O-N 3.02Å; S103-K107 WeakPolarHBondContact O-CB 3.49Å; S103-K107 PolarHBondContact O-N 3.17Å
104S49.3Very low52.3Low68 Ų6884.2 Ų84.248%0.47643%0.432SS..Hα-helixtrans-71.4-37-178.7-55.50000113.5N100 S101 K107 S108N100-S104 WeakPolarHBondContact O-CB 3.43Å; N100-S104 PolarHBondContact O-N 2.92Å; N100-S104 PolarHBondContact O-OG 3.03Å; S101-S104 PolarHBondContact O-N 2.94Å; S104-K107 PolarHBondContact O-N 3.39Å; S104-S108 WeakPolarHBondContact O-CB 3.38Å; S104-S108 PolarHBondContact O-N 3.47Å; S104-S108 PolarHBondContact O-OG 3.25Å
105I48.4Very low54.1Low103 Ų10383.7 Ų83.753%0.52843%0.429SS..Hα-helixtrans-68.8-39.8176.5-69.2162.7000109.6S101 S108 R109S101-I105 WeakPolarHBondContact O-CA 3.17Å; S101-I105 WeakPolarHBondContact O-CB 3.42Å; S101-I105 VanDerWaalsContact O-CD1 3.26Å; S101-I105 WeakPolarHBondContact O-CD1 3.49Å; S101-I105 WeakPolarHBondContact O-CG1 3.43Å; S101-I105 PolarHBondContact O-N 3.19Å; I105-S108 PolarHBondContact O-OG 3.21Å; I105-R109 VanDerWaalsContact O-CB 3.28Å; I105-R109 WeakPolarHBondContact O-CB 2.99Å; I105-R109 PolarHBondContact O-N 2.83Å; I105-R109 VanDerWaalsContact O-N 3.13Å
106K63.5Low56.2Low110 Ų11086.7 Ų86.748%0.47844%0.435SS..Hα-helixtrans-66.4-44.3172.9-76.1179.6-179.6-173.40110.7L102 S103 R109 L110L102-K106 VanDerWaalsContact O-CB 3.27Å; L102-K106 WeakPolarHBondContact O-CB 3.39Å; L102-K106 WeakPolarHBondContact O-CG 3.33Å; L102-K106 PolarHBondContact O-N 3.3Å; S103-K106 PolarHBondContact O-N 3.02Å; K106-R109 PolarHBondContact O-N 3.15Å; K106-L110 HydrophobicContact CB-CD1 4.47Å; K106-L110 WeakPolarHBondContact O-CB 3.18Å; K106-L110 WeakPolarHBondContact O-CD1 3.47Å; K106-L110 PolarHBondContact O-N 3.21Å
107K61Low58Low44 Ų4485.4 Ų85.419%0.19142%0.424CS..Hα-helixtrans-62.6-49.2179.8-175.7176.9178.3174.70112.4S103 S104 R109 L110 F111 H161 L164S103-K107 WeakPolarHBondContact O-CB 3.49Å; S103-K107 PolarHBondContact O-N 3.17Å; S104-K107 PolarHBondContact O-N 3.39Å; K107-R109 VanDerWaalsContact C-N 3.29Å; K107-R109 PolarHBondContact O-N 3.41Å; K107-L110 PolarHBondContact O-N 3.49Å; K107-F111 VanDerWaalsContact O-CB 3.31Å; K107-F111 WeakPolarHBondContact O-CB 3.16Å; K107-F111 PolarHBondContact O-N 2.86Å; K107-H161 VanDerWaalsContact CD-O 3.26Å; K107-H161 WeakPolarHBondContact CD-O 3.31Å; K107-H161 VanDerWaalsContact CE-O 3.25Å; K107-H161 WeakPolarHBondContact CE-O 3.35Å; K107-H161 PolarHBondContact NZ-O 2.66Å; K107-L164 WeakPolarHBondContact CE-O 3.1Å; K107-L164 WeakPolarHBondContact CE-OXT 3.14Å; K107-L164 PolarHBondContact NZ-OXT 3.16Å
108S63.7Low59.7Low61 Ų6182.5 Ų82.543%0.42742%0.415SS..Hα-helixtrans-61.8-39.3177.665.30000111.6S104 I105 F111 N112S104-S108 WeakPolarHBondContact O-CB 3.38Å; S104-S108 PolarHBondContact O-N 3.47Å; S104-S108 PolarHBondContact O-OG 3.25Å; I105-S108 PolarHBondContact O-OG 3.21Å; S108-F111 PolarHBondContact O-N 3.24Å; S108-N112 VanDerWaalsContact O-CB 3.32Å; S108-N112 WeakPolarHBondContact O-CB 3.36Å; S108-N112 PolarHBondContact O-N 3.01Å; S108-N112 PolarHBondContact O-ND2 2.92Å; S108-N112 PolarHBondContact O-OD1 3.13Å
109R65.9Low61.8Low177 Ų17781.5 Ų81.567%0.66842%0.418SS*.Hα-helixtrans-64.3-47.6173.9-172.8175.6-179.6172.80.5111.7I105 K106 K107 F111 N112 E113I105-R109 VanDerWaalsContact O-CB 3.28Å; I105-R109 WeakPolarHBondContact O-CB 2.99Å; I105-R109 PolarHBondContact O-N 2.83Å; I105-R109 VanDerWaalsContact O-N 3.13Å; K106-R109 PolarHBondContact O-N 3.15Å; K107-R109 VanDerWaalsContact C-N 3.29Å; K107-R109 PolarHBondContact O-N 3.41Å; R109-F111 VanDerWaalsContact C-N 3.33Å; R109-F111 PolarHBondContact O-N 2.94Å; R109-N112 PolarHBondContact O-N 2.9Å; R109-E113 WeakPolarHBondContact O-CG 3.05Å; R109-E113 PolarHBondContact O-N 3.26Å
110L65.1Low64Low77 Ų7783.4 Ų83.440%0.40343%0.429SS..Hα-helixtrans-60.4-43.8176.6-97.1106.4000111.6K106 K107 N112 E113 F114 Y163K106-L110 HydrophobicContact CB-CD1 4.47Å; K106-L110 WeakPolarHBondContact O-CB 3.18Å; K106-L110 WeakPolarHBondContact O-CD1 3.47Å; K106-L110 PolarHBondContact O-N 3.21Å; K107-L110 PolarHBondContact O-N 3.49Å; L110-N112 VanDerWaalsContact C-N 3.34Å; L110-N112 PolarHBondContact O-N 3.43Å; L110-E113 PolarHBondContact O-N 3.28Å; L110-F114 VanDerWaalsContact O-CB 3.3Å; L110-F114 WeakPolarHBondContact O-CB 3.4Å; L110-F114 PolarHBondContact O-N 3.46Å; L110-Y163 HydrophobicContact CD2-CD1 3.82Å; L110-Y163 HydrophobicContact CD2-CE1 4.06Å
111F69.3Low65.8Low81 Ų8182.6 Ų82.636%0.35542%0.421SS..Hα-helixtrans-60.8-44.7176.7-178.2-104.5000111.3K107 S108 R109 F114 N115 L164K107-F111 VanDerWaalsContact O-CB 3.31Å; K107-F111 WeakPolarHBondContact O-CB 3.16Å; K107-F111 PolarHBondContact O-N 2.86Å; S108-F111 PolarHBondContact O-N 3.24Å; R109-F111 VanDerWaalsContact C-N 3.33Å; R109-F111 PolarHBondContact O-N 2.94Å; F111-F114 PolarHBondContact O-N 2.99Å; F111-N115 WeakPolarHBondContact CD1-ND2 3.43Å; F111-N115 WeakPolarHBondContact CE1-ND2 3.42Å; F111-N115 WeakPolarHBondContact CZ-ND2 3.31Å; F111-N115 WeakPolarHBondContact O-CB 3.47Å; F111-N115 VanDerWaalsContact O-CG 3.28Å; F111-N115 PolarHBondContact O-N 3.33Å; F111-N115 PolarHBondContact O-ND2 3.34Å; F111-N115 VanDerWaalsContact O-ND2 3.08Å; F111-L164 HydrophobicContact CD2-CD2 4.22Å; F111-L164 HydrophobicContact CE2-CD2 4.39Å
112N69.1Low67.5Low89 Ų8982.7 Ų82.748%0.47642%0.418SS..Hα-helixtrans-64.8-41.1176.5-70.7-13000112.2S108 R109 L110 N115 K116S108-N112 VanDerWaalsContact O-CB 3.32Å; S108-N112 WeakPolarHBondContact O-CB 3.36Å; S108-N112 PolarHBondContact O-N 3.01Å; S108-N112 PolarHBondContact O-ND2 2.92Å; S108-N112 PolarHBondContact O-OD1 3.13Å; R109-N112 PolarHBondContact O-N 2.9Å; L110-N112 VanDerWaalsContact C-N 3.34Å; L110-N112 PolarHBondContact O-N 3.43Å; N112-N115 PolarHBondContact O-N 2.9Å; N112-K116 VanDerWaalsContact O-CG 3.29Å; N112-K116 WeakPolarHBondContact O-CG 3.31Å; N112-K116 PolarHBondContact O-N 2.92Å
113E71.3Confident69.5Low92 Ų9284 Ų8443%0.4343%0.425SS..Hα-helixtrans-66.6-39.9175-66.6-54.4127.300111.7R109 L110 N115 K116 L117R109-E113 WeakPolarHBondContact O-CG 3.05Å; R109-E113 PolarHBondContact O-N 3.26Å; L110-E113 PolarHBondContact O-N 3.28Å; E113-N115 PolarHBondContact O-N 2.9Å; E113-K116 WeakPolarHBondContact O-CB 3.32Å; E113-K116 PolarHBondContact O-N 3.19Å; E113-K116 IonicContact OE1-NZ 3.9Å; E113-K116 PolarHBondContact OE1-NZ 2.94Å; E113-K116 IonicContact OE2-NZ 3.83Å; E113-L117 PolarHBondContact O-N 3.16Å
114F72.6Confident70.8Confident22 Ų2288.1 Ų88.110%0.09644%0.439CS..Hα-helixtrans-61.8-42.8175.4-176.5-95.7000111.6L110 F111 K116 L117 Q122 E125L110-F114 VanDerWaalsContact O-CB 3.3Å; L110-F114 WeakPolarHBondContact O-CB 3.4Å; L110-F114 PolarHBondContact O-N 3.46Å; F111-F114 PolarHBondContact O-N 2.99Å; F114-K116 PolarHBondContact O-N 3.48Å; F114-L117 HydrophobicContact CD2-CD1 4.23Å; F114-L117 VanDerWaalsContact O-CB 3.27Å; F114-L117 WeakPolarHBondContact O-CB 3.47Å; F114-L117 PolarHBondContact O-N 2.92Å; F114-L117 VanDerWaalsContact O-N 3.14Å; F114-Q122 HydrophobicContact CD1-CG 4.25Å; F114-Q122 HydrophobicContact CE1-CB 4.09Å; F114-Q122 HydrophobicContact CE1-CG 3.81Å; F114-Q122 HydrophobicContact CE2-CB 4.1Å; F114-Q122 HydrophobicContact CE2-CG 4.13Å; F114-Q122 HydrophobicContact CZ-CB 3.61Å; F114-Q122 HydrophobicContact CZ-CG 3.75Å; F114-Q122 WeakPolarHBondContact O-CG 3.4Å; F114-Q122 PolarHBondContact O-NE2 2.65Å; F114-E125 HydrophobicContact CD2-CG 4.01Å; F114-E125 HydrophobicContact CE2-CB 4.06Å; F114-E125 HydrophobicContact CE2-CG 3.83Å
115N75.2Confident72Confident77 Ų7788.6 Ų88.641%0.41243%0.434SS..Hα-helixtrans-73.1-13.6177.9-68.4-35.7000114F111 N112 E113 L117F111-N115 WeakPolarHBondContact CD1-ND2 3.43Å; F111-N115 WeakPolarHBondContact CE1-ND2 3.42Å; F111-N115 WeakPolarHBondContact CZ-ND2 3.31Å; F111-N115 WeakPolarHBondContact O-CB 3.47Å; F111-N115 VanDerWaalsContact O-CG 3.28Å; F111-N115 PolarHBondContact O-N 3.33Å; F111-N115 PolarHBondContact O-ND2 3.34Å; F111-N115 VanDerWaalsContact O-ND2 3.08Å; N112-N115 PolarHBondContact O-N 2.9Å; E113-N115 PolarHBondContact O-N 2.9Å; N115-L117 VanDerWaalsContact C-N 3.34Å
116K81Confident73.4Confident146 Ų14685.9 Ų85.964%0.63542%0.421SS*.Hα-helixtrans-79.6-19.9170.7-73.6170.3-172.11760112.4N112 E113 F114N112-K116 VanDerWaalsContact O-CG 3.29Å; N112-K116 WeakPolarHBondContact O-CG 3.31Å; N112-K116 PolarHBondContact O-N 2.92Å; E113-K116 WeakPolarHBondContact O-CB 3.32Å; E113-K116 PolarHBondContact O-N 3.19Å; E113-K116 IonicContact OE1-NZ 3.9Å; E113-K116 PolarHBondContact OE1-NZ 2.94Å; E113-K116 IonicContact OE2-NZ 3.83Å; F114-K116 PolarHBondContact O-N 3.48Å
117L75.1Confident74.1Confident59 Ų5986 Ų8631%0.30942%0.423SS..SBendtrans-67.6148.2175.5-61.3177.2000110.1E113 F114 N115 E121 Q122E113-L117 PolarHBondContact O-N 3.16Å; F114-L117 HydrophobicContact CD2-CD1 4.23Å; F114-L117 VanDerWaalsContact O-CB 3.27Å; F114-L117 WeakPolarHBondContact O-CB 3.47Å; F114-L117 PolarHBondContact O-N 2.92Å; F114-L117 VanDerWaalsContact O-N 3.14Å; N115-L117 VanDerWaalsContact C-N 3.34Å; L117-E121 HydrophobicContact CB-CB 3.85Å; L117-E121 HydrophobicContact CD1-CB 4.43Å; L117-E121 HydrophobicContact CD2-CB 4.3Å; L117-E121 HydrophobicContact CG-CB 4.42Å; L117-Q122 HydrophobicContact CB-CG 3.76Å; L117-Q122 PolarHBondContact O-NE2 3.24Å
118S80.5Confident74.7Confident55 Ų5587.5 Ų87.539%0.38543%0.433SS..  trans-62.8162.516865.80000111.1D120 E121 Q122S118-D120 VanDerWaalsContact C-N 3.25Å; S118-D120 PolarHBondContact O-N 3.12Å; S118-E121 WeakPolarHBondContact CB-OE2 3.18Å; S118-E121 PolarHBondContact N-OE2 3.3Å; S118-E121 PolarHBondContact O-N 3.39Å; S118-E121 VanDerWaalsContact OG-CD 3.23Å; S118-E121 VanDerWaalsContact OG-CG 3.26Å; S118-E121 WeakPolarHBondContact OG-CG 3.5Å; S118-E121 PolarHBondContact OG-N 3.19Å; S118-E121 PolarHBondContact OG-OE2 2.89Å; S118-Q122 WeakPolarHBondContact O-CG 3.2Å; S118-Q122 PolarHBondContact O-N 3.34Å
119L84.4Confident75.1Confident120 Ų12085.8 Ų85.863%0.62842%0.417SS*.Hα-helixtrans-58.4-39.2-179.5-176.662.3000112.3Q122 N123L119-Q122 PolarHBondContact O-N 3.2Å; L119-N123 WeakPolarHBondContact O-CB 3.43Å; L119-N123 PolarHBondContact O-N 3.32Å; L119-N123 PolarHBondContact O-ND2 2.79Å; L119-N123 VanDerWaalsContact O-ND2 3.13Å
120D82.4Confident75.5Confident128 Ų12882.8 Ų82.868%0.68441%0.406SS*.Hα-helixtrans-66.9-42.5178.9-66.9-27.1000111.5S118 N123 E124S118-D120 VanDerWaalsContact C-N 3.25Å; S118-D120 PolarHBondContact O-N 3.12Å; D120-N123 WeakPolarHBondContact O-CB 3.48Å; D120-N123 PolarHBondContact O-N 3.19Å; D120-E124 PolarHBondContact O-N 3.21Å
121E79.2Confident75.9Confident93 Ų9385.3 Ų85.344%0.43541%0.414SS..Hα-helixtrans-65.8-38.9175.7-71.9166.414100111.9L117 S118 N123 E124 E125L117-E121 HydrophobicContact CB-CB 3.85Å; L117-E121 HydrophobicContact CD1-CB 4.43Å; L117-E121 HydrophobicContact CD2-CB 4.3Å; L117-E121 HydrophobicContact CG-CB 4.42Å; S118-E121 WeakPolarHBondContact CB-OE2 3.18Å; S118-E121 PolarHBondContact N-OE2 3.3Å; S118-E121 PolarHBondContact O-N 3.39Å; S118-E121 VanDerWaalsContact OG-CD 3.23Å; S118-E121 VanDerWaalsContact OG-CG 3.26Å; S118-E121 WeakPolarHBondContact OG-CG 3.5Å; S118-E121 PolarHBondContact OG-N 3.19Å; S118-E121 PolarHBondContact OG-OE2 2.89Å; E121-N123 VanDerWaalsContact C-N 3.31Å; E121-N123 PolarHBondContact O-N 2.62Å; E121-E124 PolarHBondContact O-N 3.02Å; E121-E125 WeakPolarHBondContact O-CB 3.27Å; E121-E125 PolarHBondContact O-N 3.43Å
122Q75.9Confident76.1Confident39 Ų3986.9 Ų86.918%0.18242%0.423CS..Hα-helixtrans-62.2-41.1173.7-72.4-177.736.400111.4F114 L117 S118 L119 N126F114-Q122 HydrophobicContact CD1-CG 4.25Å; F114-Q122 HydrophobicContact CE1-CB 4.09Å; F114-Q122 HydrophobicContact CE1-CG 3.81Å; F114-Q122 HydrophobicContact CE2-CB 4.1Å; F114-Q122 HydrophobicContact CE2-CG 4.13Å; F114-Q122 HydrophobicContact CZ-CB 3.61Å; F114-Q122 HydrophobicContact CZ-CG 3.75Å; F114-Q122 WeakPolarHBondContact O-CG 3.4Å; F114-Q122 PolarHBondContact O-NE2 2.65Å; L117-Q122 HydrophobicContact CB-CG 3.76Å; L117-Q122 PolarHBondContact O-NE2 3.24Å; S118-Q122 WeakPolarHBondContact O-CG 3.2Å; S118-Q122 PolarHBondContact O-N 3.34Å; L119-Q122 PolarHBondContact O-N 3.2Å; Q122-N126 VanDerWaalsContact O-CB 3.31Å; Q122-N126 WeakPolarHBondContact O-CB 3.46Å; Q122-N126 PolarHBondContact O-N 3.28Å; Q122-N126 PolarHBondContact O-ND2 3.23Å
123N77Confident76.4Confident80 Ų8083.2 Ų83.243%0.42840%0.403SS..Hα-helixtrans-64.8-43.7176.2-70.4-28.5000111.3L119 D120 E121 N126 E127L119-N123 WeakPolarHBondContact O-CB 3.43Å; L119-N123 PolarHBondContact O-N 3.32Å; L119-N123 PolarHBondContact O-ND2 2.79Å; L119-N123 VanDerWaalsContact O-ND2 3.13Å; D120-N123 WeakPolarHBondContact O-CB 3.48Å; D120-N123 PolarHBondContact O-N 3.19Å; E121-N123 VanDerWaalsContact C-N 3.31Å; E121-N123 PolarHBondContact O-N 2.62Å; N123-N126 PolarHBondContact O-N 3.43Å; N123-E127 WeakPolarHBondContact O-CB 3.33Å; N123-E127 WeakPolarHBondContact O-CG 2.77Å; N123-E127 PolarHBondContact O-N 3.43Å
124E76.5Confident76.6Confident129 Ų12982.2 Ų82.260%0.60340%0.4SS*.Hα-helixtrans-61.7-46.2176.2-174.5174.7-169.600111.9D120 E121 N126 E127 L128D120-E124 PolarHBondContact O-N 3.21Å; E121-E124 PolarHBondContact O-N 3.02Å; E124-N126 VanDerWaalsContact C-N 3.34Å; E124-N126 PolarHBondContact O-N 3.01Å; E124-E127 PolarHBondContact O-N 3.2Å; E124-L128 HydrophobicContact CG-CD1 4.21Å; E124-L128 WeakPolarHBondContact O-CB 3.49Å; E124-L128 VanDerWaalsContact O-CG 3.32Å; E124-L128 WeakPolarHBondContact O-CG 3.31Å; E124-L128 PolarHBondContact O-N 2.91Å
125E76.2Confident76.7Confident78 Ų7884.8 Ų84.836%0.36441%0.412SS..Hα-helixtrans-62.5-40.8176.7176.862.2-160.800111.4F114 E121 L128 R129F114-E125 HydrophobicContact CD2-CG 4.01Å; F114-E125 HydrophobicContact CE2-CB 4.06Å; F114-E125 HydrophobicContact CE2-CG 3.83Å; E121-E125 WeakPolarHBondContact O-CB 3.27Å; E121-E125 PolarHBondContact O-N 3.43Å; E125-L128 PolarHBondContact O-N 3.14Å; E125-R129 VanDerWaalsContact O-CB 3.27Å; E125-R129 WeakPolarHBondContact O-CB 3.25Å; E125-R129 PolarHBondContact O-N 2.81Å; E125-R129 IonicContact OE1-NH2 2.7Å
126N77Confident76.7Confident47 Ų4782.4 Ų82.425%0.25140%0.399SS..Hα-helixtrans-62.5-46175-79.2-29.8000111.6Q122 N123 E124 L128 R129 Y130Q122-N126 VanDerWaalsContact O-CB 3.31Å; Q122-N126 WeakPolarHBondContact O-CB 3.46Å; Q122-N126 PolarHBondContact O-N 3.28Å; Q122-N126 PolarHBondContact O-ND2 3.23Å; N123-N126 PolarHBondContact O-N 3.43Å; E124-N126 VanDerWaalsContact C-N 3.34Å; E124-N126 PolarHBondContact O-N 3.01Å; N126-L128 PolarHBondContact O-N 3.32Å; N126-R129 WeakPolarHBondContact O-CB 3.48Å; N126-R129 PolarHBondContact O-N 3.31Å; N126-Y130 WeakPolarHBondContact O-CD2 3.36Å; N126-Y130 PolarHBondContact O-N 2.88Å
127E77.4Confident76.5Confident111 Ų11178.7 Ų78.752%0.51938%0.381SS..Hα-helixtrans-61.2-43.8176.8-77.9-62.4136.800112N123 E124 R129 Y130 K131N123-E127 WeakPolarHBondContact O-CB 3.33Å; N123-E127 WeakPolarHBondContact O-CG 2.77Å; N123-E127 PolarHBondContact O-N 3.43Å; E124-E127 PolarHBondContact O-N 3.2Å; E127-R129 VanDerWaalsContact C-N 3.33Å; E127-R129 PolarHBondContact O-N 2.88Å; E127-Y130 PolarHBondContact O-N 3.48Å; E127-K131 WeakPolarHBondContact O-CG 3.32Å; E127-K131 PolarHBondContact O-N 3.48Å
128L73.2Confident76.5Confident76 Ų7679.8 Ų79.840%0.39839%0.385SS..Hα-helixtrans-62.1-42.9175.1-72.8172.8000111.3E124 E125 N126 K131 Q132E124-L128 HydrophobicContact CG-CD1 4.21Å; E124-L128 WeakPolarHBondContact O-CB 3.49Å; E124-L128 VanDerWaalsContact O-CG 3.32Å; E124-L128 WeakPolarHBondContact O-CG 3.31Å; E124-L128 PolarHBondContact O-N 2.91Å; E125-L128 PolarHBondContact O-N 3.14Å; N126-L128 PolarHBondContact O-N 3.32Å; L128-K131 PolarHBondContact O-N 2.82Å; L128-Q132 WeakPolarHBondContact O-CG 2.93Å; L128-Q132 PolarHBondContact O-N 3.08Å
129R73.1Confident75.9Confident26 Ų2677.3 Ų77.310%0.09837%0.367CS..Hα-helixtrans-61.6-49.1176.3-177178-66.7173.22.3111.2E125 N126 E127 K131 Q132 L133E125-R129 VanDerWaalsContact O-CB 3.27Å; E125-R129 WeakPolarHBondContact O-CB 3.25Å; E125-R129 PolarHBondContact O-N 2.81Å; E125-R129 IonicContact OE1-NH2 2.7Å; N126-R129 WeakPolarHBondContact O-CB 3.48Å; N126-R129 PolarHBondContact O-N 3.31Å; E127-R129 VanDerWaalsContact C-N 3.33Å; E127-R129 PolarHBondContact O-N 2.88Å; R129-K131 VanDerWaalsContact C-N 3.3Å; R129-K131 PolarHBondContact O-N 3.37Å; R129-Q132 PolarHBondContact O-N 2.81Å; R129-Q132 VanDerWaalsContact O-N 3.11Å; R129-L133 HydrophobicContact CG-CD1 4.09Å; R129-L133 HydrophobicContact CG-CG 4.35Å; R129-L133 VanDerWaalsContact O-CG 3.31Å; R129-L133 WeakPolarHBondContact O-CG 3.26Å; R129-L133 PolarHBondContact O-N 3.5Å
130Y73.7Confident75.3Confident113 Ų11372.5 Ų72.544%0.44334%0.342SS..Hα-helixtrans-58.5-41.7177.1-85.6-68.7000112.1N126 E127 Q132 L133 N134 I156N126-Y130 WeakPolarHBondContact O-CD2 3.36Å; N126-Y130 PolarHBondContact O-N 2.88Å; E127-Y130 PolarHBondContact O-N 3.48Å; Y130-Q132 VanDerWaalsContact C-N 3.35Å; Y130-Q132 PolarHBondContact O-N 3.48Å; Y130-L133 PolarHBondContact O-N 3.48Å; Y130-N134 WeakPolarHBondContact O-CB 3.39Å; Y130-N134 PolarHBondContact O-N 2.79Å; Y130-N134 PolarHBondContact O-ND2 3.38Å; Y130-I156 HydrophobicContact CE1-CD1 4.13Å
131K74.2Confident74.9Confident130 Ų13069.2 Ų69.257%0.56532%0.322SS*.Hα-helixtrans-60.6-42.3174.5-73.7171.2-174.41700112.4E127 L128 R129 K135E127-K131 WeakPolarHBondContact O-CG 3.32Å; E127-K131 PolarHBondContact O-N 3.48Å; L128-K131 PolarHBondContact O-N 2.82Å; R129-K131 VanDerWaalsContact C-N 3.3Å; R129-K131 PolarHBondContact O-N 3.37Å; K131-K135 PolarHBondContact O-N 3.37Å
132Q73.7Confident74.7Confident115 Ų11565.8 Ų65.854%0.53731%0.309SS..Hα-helixtrans-66.8-40176.9-70.4175.92.100112L128 R129 Y130 K135 L136L128-Q132 WeakPolarHBondContact O-CG 2.93Å; L128-Q132 PolarHBondContact O-N 3.08Å; R129-Q132 PolarHBondContact O-N 2.81Å; R129-Q132 VanDerWaalsContact O-N 3.11Å; Y130-Q132 VanDerWaalsContact C-N 3.35Å; Y130-Q132 PolarHBondContact O-N 3.48Å; Q132-K135 PolarHBondContact O-N 2.9Å; Q132-L136 PolarHBondContact O-N 3.05Å
133L75.7Confident74.7Confident12 Ų1266.4 Ų66.46%0.06331%0.314CS..Hα-helixtrans-65.8-42176.3-67.7177.4000111.9R129 Y130 K135 L136 Y137 I155 I156 M159R129-L133 HydrophobicContact CG-CD1 4.09Å; R129-L133 HydrophobicContact CG-CG 4.35Å; R129-L133 VanDerWaalsContact O-CG 3.31Å; R129-L133 WeakPolarHBondContact O-CG 3.26Å; R129-L133 PolarHBondContact O-N 3.5Å; Y130-L133 PolarHBondContact O-N 3.48Å; L133-K135 VanDerWaalsContact C-N 3.32Å; L133-K135 PolarHBondContact O-N 3.48Å; L133-L136 PolarHBondContact O-N 2.66Å; L133-Y137 WeakPolarHBondContact O-CB 3.21Å; L133-Y137 PolarHBondContact O-N 2.99Å; L133-I155 HydrophobicContact CD2-CG2 4.18Å; L133-I156 HydrophobicContact CD1-CG1 4.14Å; L133-M159 HydrophobicContact CD2-CB 3.89Å; L133-M159 HydrophobicContact CD2-CG 3.58Å
134N74.3Confident74.5Confident70 Ų7065.6 Ų65.637%0.37431%0.313SS..Hα-helixtrans-57.3-46.8172.2-81.3-28.4000111Y130 L136 Y137 E138 I152Y130-N134 WeakPolarHBondContact O-CB 3.39Å; Y130-N134 PolarHBondContact O-N 2.79Å; Y130-N134 PolarHBondContact O-ND2 3.38Å; N134-L136 VanDerWaalsContact C-N 3.32Å; N134-L136 PolarHBondContact O-N 3.2Å; N134-Y137 WeakPolarHBondContact O-CB 3.27Å; N134-Y137 PolarHBondContact O-N 3.3Å; N134-Y137 VanDerWaalsContact O-N 3.17Å; N134-E138 WeakPolarHBondContact O-CG 2.95Å; N134-E138 PolarHBondContact O-N 3.45Å; N134-I152 WeakPolarHBondContact OD1-CD1 3.43Å
135K75.5Confident74.5Confident77 Ų7768.6 Ų68.634%0.33533%0.326SS..Hα-helixtrans-61-42177.5-168175.1-176.4-174.40111.5S8 L19 K131 Q132 L133 L139S8-K135 WeakPolarHBondContact OG-CE 3.34Å; L19-K135 HydrophobicContact CD2-CD 3.83Å; L19-K135 HydrophobicContact CD2-CG 4.44Å; K131-K135 PolarHBondContact O-N 3.37Å; Q132-K135 PolarHBondContact O-N 2.9Å; L133-K135 VanDerWaalsContact C-N 3.32Å; L133-K135 PolarHBondContact O-N 3.48Å; K135-L139 HydrophobicContact CG-CD1 4.1Å; K135-L139 WeakPolarHBondContact O-CB 3.3Å; K135-L139 WeakPolarHBondContact O-CD1 3.45Å; K135-L139 WeakPolarHBondContact O-CG 3.15Å; K135-L139 PolarHBondContact O-N 3.31Å
136L74.2Confident74.4Confident26 Ų2670.8 Ų70.814%0.13634%0.337CS..Hα-helixtrans-63.8-41.6175.6-177.264.8000111.9L20 F25 Q132 L133 N134 L139 I140 I155L20-L136 HydrophobicContact CD2-CD1 3.9Å; F25-L136 HydrophobicContact CZ-CD2 4.1Å; Q132-L136 PolarHBondContact O-N 3.05Å; L133-L136 PolarHBondContact O-N 2.66Å; N134-L136 VanDerWaalsContact C-N 3.32Å; N134-L136 PolarHBondContact O-N 3.2Å; L136-L139 WeakPolarHBondContact O-CB 3.25Å; L136-L139 PolarHBondContact O-N 2.75Å; L136-I140 HydrophobicContact CD1-CD1 4.29Å; L136-I140 HydrophobicContact CG-CD1 4.01Å; L136-I140 WeakPolarHBondContact O-CG1 3.31Å; L136-I140 PolarHBondContact O-N 3.14Å; L136-I155 HydrophobicContact CD2-CG2 4.01Å
137Y76.8Confident74Confident69 Ų6972 Ų7227%0.27134%0.339SS..Hα-helixtrans-62.2-51.2175.9170.9-106.8000111.8L133 N134 L139 I140 Q141 L150 I152 I155L133-Y137 WeakPolarHBondContact O-CB 3.21Å; L133-Y137 PolarHBondContact O-N 2.99Å; N134-Y137 WeakPolarHBondContact O-CB 3.27Å; N134-Y137 PolarHBondContact O-N 3.3Å; N134-Y137 VanDerWaalsContact O-N 3.17Å; Y137-L139 PolarHBondContact O-N 3.49Å; Y137-I140 PolarHBondContact O-N 3.49Å; Y137-Q141 HydrophobicContact CD1-CG 4.44Å; Y137-Q141 HydrophobicContact CD2-CG 3.97Å; Y137-Q141 HydrophobicContact CE1-CG 4.03Å; Y137-Q141 HydrophobicContact CE2-CG 3.51Å; Y137-Q141 HydrophobicContact CG-CG 4.42Å; Y137-Q141 WeakPolarHBondContact O-CB 3.2Å; Y137-Q141 WeakPolarHBondContact O-CG 3.17Å; Y137-Q141 PolarHBondContact O-N 2.89Å; Y137-L150 WeakPolarHBondContact CE2-O 3.1Å; Y137-I152 HydrophobicContact CD1-CB 4.19Å; Y137-I152 HydrophobicContact CD1-CD1 4.42Å; Y137-I152 HydrophobicContact CD2-CB 3.79Å; Y137-I152 HydrophobicContact CD2-CG1 4.48Å; Y137-I152 HydrophobicContact CE1-CB 4.41Å; Y137-I152 HydrophobicContact CE2-CB 4.03Å; Y137-I152 HydrophobicContact CG-CB 3.86Å; Y137-I152 HydrophobicContact CG-CD1 4.43Å; Y137-I152 HydrophobicContact CG-CG1 4.17Å; Y137-I155 HydrophobicContact CD2-CD1 3.73Å; Y137-I155 HydrophobicContact CG-CD1 4.22Å
138E75.4Confident73.5Confident82 Ų8268.4 Ų68.438%0.38333%0.331SS..Hα-helixtrans-56.6-38.6175.9-72.5171.5154.500111.4H6 N134 Q141 S142H6-E138 IonicContact CD2-OE2 2.91Å; H6-E138 IonicContact CE1-OE2 3.8Å; H6-E138 PolarHBondContact CE1-OE2 3.26Å; H6-E138 IonicContact NE2-OE1 2.73Å; H6-E138 IonicContact NE2-OE2 3.67Å; H6-E138 PolarHBondContact NE2-OE2 2.71Å; N134-E138 WeakPolarHBondContact O-CG 2.95Å; N134-E138 PolarHBondContact O-N 3.45Å; E138-Q141 PolarHBondContact O-N 2.87Å; E138-S142 WeakPolarHBondContact O-CB 3.26Å; E138-S142 PolarHBondContact O-N 2.7Å
139L68.5Low73.3Confident3 Ų373 Ų732%0.01635%0.35CS..Hα-helixtrans-63.8-52.7176.8-75.8161.8000111.1F9 F16 L19 K135 L136 Y137 Q141 S142F9-L139 HydrophobicContact CD2-CD2 3.41Å; F9-L139 VanDerWaalsContact CD2-CD2 3.41Å; F9-L139 HydrophobicContact CE1-CD2 4.35Å; F9-L139 HydrophobicContact CE2-CB 3.84Å; F9-L139 HydrophobicContact CE2-CD2 3.08Å; F9-L139 HydrophobicContact CE2-CG 4.05Å; F9-L139 VanDerWaalsContact CE2-O 3.3Å; F9-L139 WeakPolarHBondContact CE2-O 3.47Å; F9-L139 HydrophobicContact CG-CD2 4.17Å; F9-L139 HydrophobicContact CZ-CB 4.28Å; F9-L139 HydrophobicContact CZ-CD2 3.62Å; F16-L139 HydrophobicContact CD2-CD1 3.84Å; F16-L139 HydrophobicContact CD2-CD2 3.57Å; F16-L139 HydrophobicContact CD2-CG 4.18Å; F16-L139 HydrophobicContact CE2-CB 3.9Å; F16-L139 HydrophobicContact CE2-CD1 3.74Å; F16-L139 HydrophobicContact CE2-CD2 3.84Å; F16-L139 HydrophobicContact CE2-CG 4.03Å; L19-L139 HydrophobicContact CD2-CD1 4.07Å; K135-L139 HydrophobicContact CG-CD1 4.1Å; K135-L139 WeakPolarHBondContact O-CB 3.3Å; K135-L139 WeakPolarHBondContact O-CD1 3.45Å; K135-L139 WeakPolarHBondContact O-CG 3.15Å; K135-L139 PolarHBondContact O-N 3.31Å; L136-L139 WeakPolarHBondContact O-CB 3.25Å; L136-L139 PolarHBondContact O-N 2.75Å; Y137-L139 PolarHBondContact O-N 3.49Å; L139-Q141 VanDerWaalsContact C-N 3.27Å; L139-Q141 PolarHBondContact O-N 3.44Å; L139-S142 PolarHBondContact O-N 2.75Å; L139-S142 VanDerWaalsContact O-N 3.13Å; L139-S142 PolarHBondContact O-OG 3.31Å
140I72Confident73.2Confident19 Ų1974.8 Ų74.810%0.09736%0.361CS..Hα-helixtrans-56.8-43.3177.7-74.8165.9000111.1L136 Y137 S142 N143 Y147 L150 I155L136-I140 HydrophobicContact CD1-CD1 4.29Å; L136-I140 HydrophobicContact CG-CD1 4.01Å; L136-I140 WeakPolarHBondContact O-CG1 3.31Å; L136-I140 PolarHBondContact O-N 3.14Å; Y137-I140 PolarHBondContact O-N 3.49Å; I140-S142 VanDerWaalsContact C-N 3.3Å; I140-S142 PolarHBondContact O-N 2.74Å; I140-N143 CarbonylContact O-C 3.6Å; I140-N143 PolarHBondContact O-N 3.34Å; I140-Y147 HydrophobicContact CG1-CG 4.29Å; I140-L150 HydrophobicContact CD1-CD1 4.36Å; I140-L150 HydrophobicContact CG2-CB 4.12Å; I140-L150 HydrophobicContact CG2-CD1 4.13Å; I140-I155 HydrophobicContact CD1-CD1 3.64Å; I140-I155 HydrophobicContact CD1-CG1 4.24Å
141Q73.2Confident73.1Confident58 Ų5872.5 Ų72.527%0.27136%0.359SS..Hα-helixtrans-68.3-25.9180-72.9-62.9-39.500113.9Y137 E138 L139 N143 P144 L150Y137-Q141 HydrophobicContact CD1-CG 4.44Å; Y137-Q141 HydrophobicContact CD2-CG 3.97Å; Y137-Q141 HydrophobicContact CE1-CG 4.03Å; Y137-Q141 HydrophobicContact CE2-CG 3.51Å; Y137-Q141 HydrophobicContact CG-CG 4.42Å; Y137-Q141 WeakPolarHBondContact O-CB 3.2Å; Y137-Q141 WeakPolarHBondContact O-CG 3.17Å; Y137-Q141 PolarHBondContact O-N 2.89Å; E138-Q141 PolarHBondContact O-N 2.87Å; L139-Q141 VanDerWaalsContact C-N 3.27Å; L139-Q141 PolarHBondContact O-N 3.44Å; Q141-N143 VanDerWaalsContact C-N 3.27Å; Q141-N143 PolarHBondContact O-N 3.02Å; Q141-P144 WeakPolarHBondContact O-CD 3.41Å; Q141-L150 PolarHBondContact NE2-O 3.35Å
142S75Confident72.9Confident22 Ų2268.3 Ų68.315%0.15434%0.342CS..Hα-helixtrans-78.4-11.1177.573.70000114F9 E138 L139 I140F9-S142 WeakPolarHBondContact CD2-OG 2.97Å; F9-S142 WeakPolarHBondContact CE2-OG 3.04Å; E138-S142 WeakPolarHBondContact O-CB 3.26Å; E138-S142 PolarHBondContact O-N 2.7Å; L139-S142 PolarHBondContact O-N 2.75Å; L139-S142 VanDerWaalsContact O-N 3.13Å; L139-S142 PolarHBondContact O-OG 3.31Å; I140-S142 VanDerWaalsContact C-N 3.3Å; I140-S142 PolarHBondContact O-N 2.74Å
143N75.6Confident72.8Confident52 Ų5268 Ų6828%0.27835%0.345SS..  trans-140.268.6172.9-165.8-7.5000111.8I140 Q141 E145 Q146 Y147I140-N143 CarbonylContact O-C 3.6Å; I140-N143 PolarHBondContact O-N 3.34Å; Q141-N143 VanDerWaalsContact C-N 3.27Å; Q141-N143 PolarHBondContact O-N 3.02Å; N143-E145 PolarHBondContact O-N 3.17Å; N143-Q146 PolarHBondContact ND2-OE1 2.69Å; N143-Q146 PolarHBondContact O-N 3.45Å; N143-Y147 HydrophobicContact CB-CD2 4.3Å; N143-Y147 HydrophobicContact CB-CE2 4.33Å; N143-Y147 WeakPolarHBondContact O-CD2 3.4Å; N143-Y147 PolarHBondContact O-N 3.5Å
144P73Confident72.5Confident63 Ų6370.8 Ų70.841%0.40936%0.359SS..Hα-helixtrans-67.4-22-175.528.6-34.4000112.7Q141 Q146 G148Q141-P144 WeakPolarHBondContact O-CD 3.41Å; P144-Q146 VanDerWaalsContact C-N 3.26Å; P144-Q146 PolarHBondContact O-N 3.21Å; P144-G148 WeakPolarHBondContact O-CA 3.4Å; P144-G148 PolarHBondContact O-N 3.09Å
145E76.8Confident72.3Confident191 Ų19168 Ų6889%0.89334%0.344SS*.Hα-helixtrans-63.3-33.9176.4-64.2-174.4178.400112.1N143N143-E145 PolarHBondContact O-N 3.17Å
146Q73.9Confident72Confident124 Ų12465.6 Ų65.658%0.57934%0.335SS*.Hα-helixtrans-88.3-37.3-178.9-174.1172.3-1.100113N143 P144N143-Q146 PolarHBondContact ND2-OE1 2.69Å; N143-Q146 PolarHBondContact O-N 3.45Å; P144-Q146 VanDerWaalsContact C-N 3.26Å; P144-Q146 PolarHBondContact O-N 3.21Å
147Y67.9Low71.7Confident74 Ų7470.8 Ų70.829%0.2936%0.359SS..Hα-helixtrans-110.6-8.2-169.5-59.2-67.1000114.4F16 I140 N143F16-Y147 VanDerWaalsContact CE1-OH 3.28Å; F16-Y147 WeakPolarHBondContact CE1-OH 2.83Å; I140-Y147 HydrophobicContact CG1-CG 4.29Å; N143-Y147 HydrophobicContact CB-CD2 4.3Å; N143-Y147 HydrophobicContact CB-CE2 4.33Å; N143-Y147 WeakPolarHBondContact O-CD2 3.4Å; N143-Y147 PolarHBondContact O-N 3.5Å
148G67.6Low71.2Confident34 Ų3473.1 Ų73.135%0.35137%0.372SS..  trans74.2175.6-170.600000112.7P144 L150P144-G148 WeakPolarHBondContact O-CA 3.4Å; P144-G148 PolarHBondContact O-N 3.09Å; G148-L150 PolarHBondContact O-N 2.81Å
149Q70.1Confident70.7Confident173 Ų17370.3 Ų70.381%0.80836%0.359SS*.  trans-90.294.3178.1-158.7167.213.400109.1
150L69.3Low70.4Confident63 Ų6373.1 Ų73.133%0.3337%0.374SS..  trans-103.5128.9177.4-71.5164.2000109.7Y137 I140 Q141 G148 N154 I155Y137-L150 WeakPolarHBondContact CE2-O 3.1Å; I140-L150 HydrophobicContact CD1-CD1 4.36Å; I140-L150 HydrophobicContact CG2-CB 4.12Å; I140-L150 HydrophobicContact CG2-CD1 4.13Å; Q141-L150 PolarHBondContact NE2-O 3.35Å; G148-L150 PolarHBondContact O-N 2.81Å; L150-N154 HydrophobicContact CD2-CB 4.22Å; L150-I155 HydrophobicContact CB-CG1 4.42Å
151T72.3Confident69.8Low65 Ų6578.2 Ų78.240%0.39940%0.397SS..  trans-71.2159.9170.259.60000110.3D153 N154 I155T151-D153 PolarHBondContact O-N 3.46Å; T151-N154 PolarHBondContact O-N 3.18Å; T151-N154 PolarHBondContact OG1-N 3.33Å; T151-N154 PolarHBondContact OG1-ND2 2.88Å; T151-N154 PolarHBondContact OG1-OD1 3.2Å; T151-I155 PolarHBondContact O-N 3.17Å
152I70.6Confident68.8Low42 Ų4279 Ų7922%0.21540%0.4CS..Hα-helixtrans-60.7-36.5173.7-170.5167.6000111.2N134 Y137 N154 I155 I156N134-I152 WeakPolarHBondContact OD1-CD1 3.43Å; Y137-I152 HydrophobicContact CD1-CB 4.19Å; Y137-I152 HydrophobicContact CD1-CD1 4.42Å; Y137-I152 HydrophobicContact CD2-CB 3.79Å; Y137-I152 HydrophobicContact CD2-CG1 4.48Å; Y137-I152 HydrophobicContact CE1-CB 4.41Å; Y137-I152 HydrophobicContact CE2-CB 4.03Å; Y137-I152 HydrophobicContact CG-CB 3.86Å; Y137-I152 HydrophobicContact CG-CD1 4.43Å; Y137-I152 HydrophobicContact CG-CG1 4.17Å; I152-N154 VanDerWaalsContact C-N 3.33Å; I152-N154 PolarHBondContact O-N 3.29Å; I152-I155 WeakPolarHBondContact O-CB 3.47Å; I152-I155 PolarHBondContact O-N 3.45Å; I152-I156 HydrophobicContact CD1-CD1 4.43Å; I152-I156 HydrophobicContact CG1-CD1 3.89Å; I152-I156 HydrophobicContact CG1-CG1 4.26Å; I152-I156 WeakPolarHBondContact O-CG1 3.25Å; I152-I156 PolarHBondContact O-N 2.89Å
153D71.7Confident67.7Low109 Ų10979.2 Ų79.258%0.58340%0.398SS*.Hα-helixtrans-60.7-41.6177.1-57.1-38.2000111.6T151 I155 I156 E157T151-D153 PolarHBondContact O-N 3.46Å; D153-I155 VanDerWaalsContact C-N 3.28Å; D153-I155 PolarHBondContact O-N 3.35Å; D153-I156 PolarHBondContact O-N 3.13Å; D153-E157 WeakPolarHBondContact O-CB 3.16Å; D153-E157 PolarHBondContact O-N 3.19Å
154N69.3Low66.2Low70 Ų7081.3 Ų81.337%0.37441%0.408SS..Hα-helixtrans-61.9-38.1175.4-69.5-4.2000111.4L150 T151 I152 Q158L150-N154 HydrophobicContact CD2-CB 4.22Å; T151-N154 PolarHBondContact O-N 3.18Å; T151-N154 PolarHBondContact OG1-N 3.33Å; T151-N154 PolarHBondContact OG1-ND2 2.88Å; T151-N154 PolarHBondContact OG1-OD1 3.2Å; I152-N154 VanDerWaalsContact C-N 3.33Å; I152-N154 PolarHBondContact O-N 3.29Å; N154-Q158 WeakPolarHBondContact O-CB 3.32Å; N154-Q158 WeakPolarHBondContact O-CG 3.27Å; N154-Q158 PolarHBondContact O-N 3.26Å; N154-Q158 VanDerWaalsContact O-N 3.1Å
155I69.9Low65.8Low11 Ų1182.2 Ų82.26%0.05641%0.408CS..Hα-helixtrans-69.6-44.7177.7-63.9170.3000110L133 L136 Y137 I140 L150 T151 I152 D153 Q158 M159L133-I155 HydrophobicContact CD2-CG2 4.18Å; L136-I155 HydrophobicContact CD2-CG2 4.01Å; Y137-I155 HydrophobicContact CD2-CD1 3.73Å; Y137-I155 HydrophobicContact CG-CD1 4.22Å; I140-I155 HydrophobicContact CD1-CD1 3.64Å; I140-I155 HydrophobicContact CD1-CG1 4.24Å; L150-I155 HydrophobicContact CB-CG1 4.42Å; T151-I155 PolarHBondContact O-N 3.17Å; I152-I155 WeakPolarHBondContact O-CB 3.47Å; I152-I155 PolarHBondContact O-N 3.45Å; D153-I155 VanDerWaalsContact C-N 3.28Å; D153-I155 PolarHBondContact O-N 3.35Å; I155-Q158 PolarHBondContact O-N 2.71Å; I155-M159 HydrophobicContact CG2-CG 4.26Å; I155-M159 VanDerWaalsContact O-CB 3.28Å; I155-M159 WeakPolarHBondContact O-CB 3.32Å; I155-M159 WeakPolarHBondContact O-CG 3.34Å; I155-M159 PolarHBondContact O-N 3.28Å
156I69Low65.3Low28 Ų2876.5 Ų76.514%0.14438%0.383CS..Hα-helixtrans-60.6-46.5177.5-68.9166.5000110.3Y130 L133 I152 D153 Q158 M159 N160Y130-I156 HydrophobicContact CE1-CD1 4.13Å; L133-I156 HydrophobicContact CD1-CG1 4.14Å; I152-I156 HydrophobicContact CD1-CD1 4.43Å; I152-I156 HydrophobicContact CG1-CD1 3.89Å; I152-I156 HydrophobicContact CG1-CG1 4.26Å; I152-I156 WeakPolarHBondContact O-CG1 3.25Å; I152-I156 PolarHBondContact O-N 2.89Å; D153-I156 PolarHBondContact O-N 3.13Å; I156-Q158 PolarHBondContact O-N 2.73Å; I156-M159 CarbonylContact O-C 3.38Å; I156-M159 PolarHBondContact O-N 3.12Å; I156-M159 VanDerWaalsContact O-N 3.17Å; I156-N160 WeakPolarHBondContact O-CB 3.24Å; I156-N160 VanDerWaalsContact O-CG 3.28Å; I156-N160 PolarHBondContact O-N 2.95Å
157E68.7Low64.8Low135 Ų13573.8 Ų73.863%0.63137%0.372SS*.Hα-helixtrans-60-49178.7-174-176.7-175.500111.6D153 M159 N160 H161D153-E157 WeakPolarHBondContact O-CB 3.16Å; D153-E157 PolarHBondContact O-N 3.19Å; E157-M159 PolarHBondContact O-N 3.13Å; E157-N160 PolarHBondContact O-N 3.48Å; E157-H161 PolarHBondContact O-N 3.25Å
158Q64.7Low64.6Low118 Ų11873.8 Ų73.855%0.55138%0.376SS*.Hα-helixtrans-62.4-33.6177.3-69.3-69.1-14.600111.6N154 I155 I156 H161 F162N154-Q158 WeakPolarHBondContact O-CB 3.32Å; N154-Q158 WeakPolarHBondContact O-CG 3.27Å; N154-Q158 PolarHBondContact O-N 3.26Å; N154-Q158 VanDerWaalsContact O-N 3.1Å; I155-Q158 PolarHBondContact O-N 2.71Å; I156-Q158 PolarHBondContact O-N 2.73Å; Q158-H161 WeakPolarHBondContact O-CB 3.26Å; Q158-F162 WeakPolarHBondContact O-CD2 3.29Å; Q158-F162 VanDerWaalsContact O-CE2 3.31Å; Q158-F162 WeakPolarHBondContact O-CE2 3.28Å
159M65.2Low64.4Low22 Ų2276.3 Ų76.311%0.10838%0.378CS..Hα-helixtrans-81.8-36.3-179.4-70.2-66.110500113.4F25 L133 I155 I156 E157 H161 F162 Y163F25-M159 HydrophobicContact CD1-SD 3.99Å; F25-M159 HydrophobicContact CE1-SD 4.09Å; F25-M159 HydrophobicContact CG-SD 4.4Å; L133-M159 HydrophobicContact CD2-CB 3.89Å; L133-M159 HydrophobicContact CD2-CG 3.58Å; I155-M159 HydrophobicContact CG2-CG 4.26Å; I155-M159 VanDerWaalsContact O-CB 3.28Å; I155-M159 WeakPolarHBondContact O-CB 3.32Å; I155-M159 WeakPolarHBondContact O-CG 3.34Å; I155-M159 PolarHBondContact O-N 3.28Å; I156-M159 CarbonylContact O-C 3.38Å; I156-M159 PolarHBondContact O-N 3.12Å; I156-M159 VanDerWaalsContact O-N 3.17Å; E157-M159 PolarHBondContact O-N 3.13Å; M159-H161 PolarHBondContact O-N 3.14Å; M159-H161 VanDerWaalsContact O-N 3.17Å; M159-F162 HydrophobicContact CE-CD2 3.58Å; M159-F162 HydrophobicContact CE-CE2 3.81Å; M159-F162 PolarHBondContact O-N 3.26Å; M159-F162 HydrophobicContact SD-CD2 4.47Å; M159-Y163 WeakPolarHBondContact O-CD2 3.45Å; M159-Y163 PolarHBondContact O-N 3.33Å; M159-Y163 HydrophobicContact SD-CE2 4.29Å
160N63.4Low64Low63 Ų6369.9 Ų69.934%0.33735%0.349SS..Hα-helixtrans-54.7-35.9171.2-76.9-17.9000110.4I156 E157 F162 Y163 L164I156-N160 WeakPolarHBondContact O-CB 3.24Å; I156-N160 VanDerWaalsContact O-CG 3.28Å; I156-N160 PolarHBondContact O-N 2.95Å; E157-N160 PolarHBondContact O-N 3.48Å; N160-F162 PolarHBondContact O-N 2.93Å; N160-Y163 PolarHBondContact O-N 3.23Å; N160-L164 PolarHBondContact O-N 3.21Å
161H59.3Low63.7Low126 Ų12670.4 Ų70.458%0.58335%0.351SS*.Hα-helixtrans-58.4-29.9174.3-16776.4000114.1K107 E157 Q158 M159K107-H161 VanDerWaalsContact CD-O 3.26Å; K107-H161 WeakPolarHBondContact CD-O 3.31Å; K107-H161 VanDerWaalsContact CE-O 3.25Å; K107-H161 WeakPolarHBondContact CE-O 3.35Å; K107-H161 PolarHBondContact NZ-O 2.66Å; E157-H161 PolarHBondContact O-N 3.25Å; Q158-H161 WeakPolarHBondContact O-CB 3.26Å; M159-H161 PolarHBondContact O-N 3.14Å; M159-H161 VanDerWaalsContact O-N 3.17Å
162F52.4Low63Low74 Ų7470.8 Ų70.833%0.32535%0.347SS..Hα-helixtrans-92.6-23-179.2-67.5-75.6000114.2Q158 M159 N160Q158-F162 WeakPolarHBondContact O-CD2 3.29Å; Q158-F162 VanDerWaalsContact O-CE2 3.31Å; Q158-F162 WeakPolarHBondContact O-CE2 3.28Å; M159-F162 HydrophobicContact CE-CD2 3.58Å; M159-F162 HydrophobicContact CE-CE2 3.81Å; M159-F162 PolarHBondContact O-N 3.26Å; M159-F162 HydrophobicContact SD-CD2 4.47Å; N160-F162 PolarHBondContact O-N 2.93Å
163Y50.6Low62.4Low27 Ų2773.2 Ų73.211%0.10636%0.358CS..Hα-helixtrans-114.2-21.3-169.5-71.9-83000115.7F25 L110 M159 N160F25-Y163 HydrophobicContact CD1-CE2 4.25Å; F25-Y163 WeakPolarHBondContact CD1-OH 3.32Å; L110-Y163 HydrophobicContact CD2-CD1 3.82Å; L110-Y163 HydrophobicContact CD2-CE1 4.06Å; M159-Y163 WeakPolarHBondContact O-CD2 3.45Å; M159-Y163 PolarHBondContact O-N 3.33Å; M159-Y163 HydrophobicContact SD-CE2 4.29Å; N160-Y163 PolarHBondContact O-N 3.23Å
164L44.1Very low61.5Low95 Ų9569.9 Ų69.950%0.49734%0.338SS..  trans-128.40-177.1-71.6173.2000112.3K107 F111 N160K107-L164 WeakPolarHBondContact CE-O 3.1Å; K107-L164 WeakPolarHBondContact CE-OXT 3.14Å; K107-L164 PolarHBondContact NZ-OXT 3.16Å; F111-L164 HydrophobicContact CD2-CD2 4.22Å; F111-L164 HydrophobicContact CE2-CD2 4.39Å; N160-L164 PolarHBondContact O-N 3.21Å

Retrieved 164 of 164 residues in 58.6 ms (Link to these results)

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