A0A077Z8L1_TRITR Loading...

HLH domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z8L1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 159 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M49.9Very low49.4Very low232 Ų232127.2 Ų127.2100%1.14372%0.716SS**  0114.20-74.1-178.4-179.200107.2
2F38.6Very low50.3Low212 Ų212123 Ų12393%0.9370%0.695SS**  trans-179.1102.8140.1-99.1-70000104.7
3E37.5Very low52.2Low178 Ų178120.2 Ų120.283%0.83268%0.677SS**  trans-61.7136.6179.5-62.5-166.6153.800109.5V5E3-V5 PolarHBondContact O-N 3.31Å; E3-V5 VanDerWaalsContact O-N 3.12Å
4P52.3Low54.1Low112 Ų112116.4 Ų116.473%0.72766%0.663SS**  trans-66.7117.3171.228.2-29.5000106.9I6P4-I6 PolarHBondContact O-N 3.2Å
5V49.3Very low56.1Low137 Ų137111.3 Ų111.383%0.8364%0.637SS**  trans-49.1113.5165.9171.50000106.4E3 G7E3-V5 PolarHBondContact O-N 3.31Å; E3-V5 VanDerWaalsContact O-N 3.12Å; V5-G7 PolarHBondContact O-N 3.41Å
6I49.3Very low58Low160 Ų160107.4 Ų107.482%0.82162%0.616SS**  trans-68.769.7-179.8-55.5176.9000106.9P4 N8P4-I6 PolarHBondContact O-N 3.2Å; I6-N8 PolarHBondContact O-N 3.22Å
7G50Low59.9Low45 Ų45106.1 Ų106.146%0.46461%0.606SS.*  trans-80.770.7177.600000108.8V5 V9V5-G7 PolarHBondContact O-N 3.41Å; G7-V9 WeakPolarHBondContact O-CG2 3.41Å; G7-V9 PolarHBondContact O-N 3.33Å
8N50.7Low61.7Low112 Ų112109.2 Ų109.260%0.59961%0.607SS**SBendtrans45.234.2163.7-151.312.2000116I6 G10 T11 V12I6-N8 PolarHBondContact O-N 3.22Å; N8-G10 VanDerWaalsContact C-N 3.29Å; N8-G10 PolarHBondContact O-N 3.09Å; N8-T11 PolarHBondContact ND2-OG1 3.45Å; N8-T11 PolarHBondContact O-N 3.33Å; N8-T11 PolarHBondContact O-OG1 3.08Å; N8-T11 VanDerWaalsContact O-OG1 3.11Å; N8-V12 VanDerWaalsContact O-CG2 3.3Å; N8-V12 WeakPolarHBondContact O-CG2 3.38Å
9V53.8Low63.2Low75 Ų75109.7 Ų109.746%0.45560%0.602SS.*Hα-helixtrans-61.3-33.5-166.8172.50000112.3G7 T11 V12 D13G7-V9 WeakPolarHBondContact O-CG2 3.41Å; G7-V9 PolarHBondContact O-N 3.33Å; V9-T11 VanDerWaalsContact C-N 3.32Å; V9-T11 PolarHBondContact O-N 3.47Å; V9-V12 PolarHBondContact O-N 3.48Å; V9-D13 WeakPolarHBondContact CG1-OD2 3.36Å; V9-D13 VanDerWaalsContact O-CB 3.26Å; V9-D13 WeakPolarHBondContact O-CB 3.39Å; V9-D13 VanDerWaalsContact O-CG 3.32Å; V9-D13 PolarHBondContact O-N 3Å
10G54.1Low64.8Low58 Ų58110.5 Ų110.560%0.59860%0.599SS**Hα-helixtrans-63.9-30-178.600000115.1N8 S14N8-G10 VanDerWaalsContact C-N 3.29Å; N8-G10 PolarHBondContact O-N 3.09Å; G10-S14 WeakPolarHBondContact O-CB 3.48Å; G10-S14 PolarHBondContact O-N 3.35Å; G10-S14 PolarHBondContact O-OG 3.44Å
11T57.8Low66.1Low78 Ų78112 Ų11248%0.47960%0.602SS.*Hα-helixtrans-84.6-34.9177.163.50000112N8 V9 S14 S15N8-T11 PolarHBondContact ND2-OG1 3.45Å; N8-T11 PolarHBondContact O-N 3.33Å; N8-T11 PolarHBondContact O-OG1 3.08Å; N8-T11 VanDerWaalsContact O-OG1 3.11Å; V9-T11 VanDerWaalsContact C-N 3.32Å; V9-T11 PolarHBondContact O-N 3.47Å; T11-S14 PolarHBondContact O-OG 3.19Å; T11-S15 WeakPolarHBondContact O-CB 3.42Å; T11-S15 PolarHBondContact O-N 3.35Å
12V60.6Low68.3Low77 Ų77104.7 Ų104.747%0.46757%0.571SS.*Hα-helixtrans-74.8-40.8179.3-145.50000110.8N8 V9 S15 T16N8-V12 VanDerWaalsContact O-CG2 3.3Å; N8-V12 WeakPolarHBondContact O-CG2 3.38Å; V9-V12 PolarHBondContact O-N 3.48Å; V12-S15 PolarHBondContact O-N 2.99Å; V12-T16 WeakPolarHBondContact O-CB 3.48Å; V12-T16 PolarHBondContact O-N 2.98Å; V12-T16 PolarHBondContact O-OG1 3.06Å
13D74.6Confident71Confident86 Ų86101 Ų10146%0.4656%0.556SS.*Hα-helixtrans-66.7-46.8178-74.4-7.5000111.3V9 S15 T16 D17V9-D13 WeakPolarHBondContact CG1-OD2 3.36Å; V9-D13 VanDerWaalsContact O-CB 3.26Å; V9-D13 WeakPolarHBondContact O-CB 3.39Å; V9-D13 VanDerWaalsContact O-CG 3.32Å; V9-D13 PolarHBondContact O-N 3Å; D13-S15 PolarHBondContact O-N 2.91Å; D13-T16 CarbonylContact O-C 3.55Å; D13-T16 PolarHBondContact O-N 3.46Å; D13-D17 WeakPolarHBondContact O-CB 3.49Å; D13-D17 VanDerWaalsContact O-CG 3.3Å; D13-D17 PolarHBondContact O-N 3.33Å
14S79.2Confident73.8Confident68 Ų6898.7 Ų98.748%0.47655%0.549SS..Hα-helixtrans-63.8-39.9175.659.30000112.8G10 T11 T16 D17 R18G10-S14 WeakPolarHBondContact O-CB 3.48Å; G10-S14 PolarHBondContact O-N 3.35Å; G10-S14 PolarHBondContact O-OG 3.44Å; T11-S14 PolarHBondContact O-OG 3.19Å; S14-T16 VanDerWaalsContact C-N 3.33Å; S14-D17 PolarHBondContact O-N 3.43Å; S14-R18 VanDerWaalsContact O-CB 3.3Å; S14-R18 WeakPolarHBondContact O-CB 3.09Å; S14-R18 PolarHBondContact O-N 3.26Å
15S83.5Confident75.9Confident39 Ų39100.1 Ų100.127%0.27354%0.543SS..Hα-helixtrans-64.1-40.5173.5-175.80000111.4T11 V12 D13 K19T11-S15 WeakPolarHBondContact O-CB 3.42Å; T11-S15 PolarHBondContact O-N 3.35Å; V12-S15 PolarHBondContact O-N 2.99Å; D13-S15 PolarHBondContact O-N 2.91Å; S15-K19 VanDerWaalsContact O-CG 3.28Å; S15-K19 WeakPolarHBondContact O-CG 3.46Å; S15-K19 PolarHBondContact O-N 3.49Å
16T86.8Confident78.2Confident50 Ų5097 Ų9731%0.30753%0.527SS..Hα-helixtrans-67.7-41.3177.7-62.20000111.1V12 D13 S14 K19 K20V12-T16 WeakPolarHBondContact O-CB 3.48Å; V12-T16 PolarHBondContact O-N 2.98Å; V12-T16 PolarHBondContact O-OG1 3.06Å; D13-T16 CarbonylContact O-C 3.55Å; D13-T16 PolarHBondContact O-N 3.46Å; S14-T16 VanDerWaalsContact C-N 3.33Å; T16-K19 WeakPolarHBondContact O-CB 3.14Å; T16-K19 PolarHBondContact O-N 3.35Å; T16-K20 VanDerWaalsContact O-CG 3.31Å; T16-K20 WeakPolarHBondContact O-CG 3.47Å; T16-K20 PolarHBondContact O-N 3Å
17D91Very high80.6Confident84 Ų8492.2 Ų92.245%0.44950%0.501SS..Hα-helixtrans-69.1-38.9176.8-73-16.9000111.8D13 S14 K19 K20 Q21D13-D17 WeakPolarHBondContact O-CB 3.49Å; D13-D17 VanDerWaalsContact O-CG 3.3Å; D13-D17 PolarHBondContact O-N 3.33Å; S14-D17 PolarHBondContact O-N 3.43Å; D17-K19 VanDerWaalsContact C-N 3.34Å; D17-K19 PolarHBondContact O-N 3.37Å; D17-K20 PolarHBondContact O-N 2.85Å; D17-K20 IonicContact OD1-NZ 3.13Å; D17-K20 PolarHBondContact OD1-NZ 2.97Å; D17-Q21 WeakPolarHBondContact O-CB 3.36Å; D17-Q21 PolarHBondContact O-N 2.92Å
18R90.9Very high82.8Confident162 Ų16296.9 Ų96.961%0.61151%0.509SS*.Hα-helixtrans-60.3-43.9170.2-173.2173.763.8108-0.5111.4S14 Q21 V22S14-R18 VanDerWaalsContact O-CB 3.3Å; S14-R18 WeakPolarHBondContact O-CB 3.09Å; S14-R18 PolarHBondContact O-N 3.26Å; R18-Q21 PolarHBondContact O-N 2.92Å; R18-V22 VanDerWaalsContact O-CG2 3.32Å; R18-V22 WeakPolarHBondContact O-CG2 3.4Å; R18-V22 PolarHBondContact O-N 3Å
19K91.9Very high85.1Confident120 Ų12097.3 Ų97.352%0.52251%0.509SS..Hα-helixtrans-60.6-47.9174-73.8172.9-173.5178.40111.2S15 T16 D17 Q21 V22 H23S15-K19 VanDerWaalsContact O-CG 3.28Å; S15-K19 WeakPolarHBondContact O-CG 3.46Å; S15-K19 PolarHBondContact O-N 3.49Å; T16-K19 WeakPolarHBondContact O-CB 3.14Å; T16-K19 PolarHBondContact O-N 3.35Å; D17-K19 VanDerWaalsContact C-N 3.34Å; D17-K19 PolarHBondContact O-N 3.37Å; K19-Q21 VanDerWaalsContact C-N 3.32Å; K19-Q21 PolarHBondContact O-N 3.3Å; K19-V22 PolarHBondContact O-N 3.49Å; K19-H23 PolarHBondContact O-CD2 2.91Å; K19-H23 PolarHBondContact O-N 3.49Å
20K93.5Very high87.2Confident125 Ų12599.9 Ų99.954%0.54351%0.51SS..Hα-helixtrans-57.3-44.4176.6-71.9172.2-168.8152.50111.6T16 D17 H23 L24T16-K20 VanDerWaalsContact O-CG 3.31Å; T16-K20 WeakPolarHBondContact O-CG 3.47Å; T16-K20 PolarHBondContact O-N 3Å; D17-K20 PolarHBondContact O-N 2.85Å; D17-K20 IonicContact OD1-NZ 3.13Å; D17-K20 PolarHBondContact OD1-NZ 2.97Å; K20-H23 PolarHBondContact O-N 2.8Å; K20-L24 WeakPolarHBondContact O-CB 3.39Å; K20-L24 PolarHBondContact O-N 3.37Å
21Q93.4Very high89.3Confident142 Ų142104.3 Ų104.366%0.66451%0.509SS*.Hα-helixtrans-63.8-43.2178.8-170.2-17816.200111.8D17 R18 K19 L24 K25D17-Q21 WeakPolarHBondContact O-CB 3.36Å; D17-Q21 PolarHBondContact O-N 2.92Å; R18-Q21 PolarHBondContact O-N 2.92Å; K19-Q21 VanDerWaalsContact C-N 3.32Å; K19-Q21 PolarHBondContact O-N 3.3Å; Q21-L24 PolarHBondContact O-N 2.94Å; Q21-K25 WeakPolarHBondContact O-CB 3.32Å; Q21-K25 PolarHBondContact O-N 3.41Å
22V94.9Very high91.2Very high79 Ų79104.9 Ų104.948%0.47951%0.506SS..Hα-helixtrans-62.8-46.1174.5172.60000110.7R18 K19 L24 K25 C26R18-V22 VanDerWaalsContact O-CG2 3.32Å; R18-V22 WeakPolarHBondContact O-CG2 3.4Å; R18-V22 PolarHBondContact O-N 3Å; K19-V22 PolarHBondContact O-N 3.49Å; V22-L24 VanDerWaalsContact C-N 3.35Å; V22-L24 PolarHBondContact O-N 3.39Å; V22-K25 WeakPolarHBondContact O-CB 3.46Å; V22-K25 PolarHBondContact O-N 3.28Å; V22-C26 PolarHBondContact O-N 3.2Å; V22-C26 PolarHBondContact O-SG 3.42Å
23H96.6Very high93Very high134 Ų134104.3 Ų104.362%0.6251%0.509SS*.Hα-helixtrans-58.7-44.2176.3-81.7-67.7000112.3K19 K20 K25 C26 E27K19-H23 PolarHBondContact O-CD2 2.91Å; K19-H23 PolarHBondContact O-N 3.49Å; K20-H23 PolarHBondContact O-N 2.8Å; H23-K25 VanDerWaalsContact C-N 3.35Å; H23-K25 PolarHBondContact O-N 3.38Å; H23-C26 PolarHBondContact O-N 3.18Å; H23-E27 WeakPolarHBondContact O-CB 3.45Å; H23-E27 PolarHBondContact O-N 2.96Å
24L96.1Very high94.1Very high130 Ų130103.9 Ų103.968%0.68151%0.506SS*.Hα-helixtrans-64.1-40.2177.3-174.262.5000111.8K20 Q21 V22 E27 K28K20-L24 WeakPolarHBondContact O-CB 3.39Å; K20-L24 PolarHBondContact O-N 3.37Å; Q21-L24 PolarHBondContact O-N 2.94Å; V22-L24 VanDerWaalsContact C-N 3.35Å; V22-L24 PolarHBondContact O-N 3.39Å; L24-E27 PolarHBondContact O-N 3.11Å; L24-K28 WeakPolarHBondContact O-CB 2.85Å; L24-K28 PolarHBondContact O-N 2.94Å
25K96.9Very high94.8Very high142 Ų142106.3 Ų106.362%0.61751%0.508SS*.Hα-helixtrans-61.5-49173.8-177-178.3177.3-177.60111.1Q21 V22 H23 E27 K28 M29Q21-K25 WeakPolarHBondContact O-CB 3.32Å; Q21-K25 PolarHBondContact O-N 3.41Å; V22-K25 WeakPolarHBondContact O-CB 3.46Å; V22-K25 PolarHBondContact O-N 3.28Å; H23-K25 VanDerWaalsContact C-N 3.35Å; H23-K25 PolarHBondContact O-N 3.38Å; K25-E27 PolarHBondContact O-N 2.9Å; K25-K28 PolarHBondContact O-N 2.98Å; K25-M29 HydrophobicContact CG-SD 4.41Å; K25-M29 WeakPolarHBondContact O-CG 3.02Å; K25-M29 PolarHBondContact O-N 3.32Å
26C97.8Very high95.5Very high72 Ų72107.8 Ų107.849%0.48652%0.515SS..Hα-helixtrans-60.8-43.2178-69.30000111.9V22 H23 K28 M29 R30V22-C26 PolarHBondContact O-N 3.2Å; V22-C26 PolarHBondContact O-SG 3.42Å; H23-C26 PolarHBondContact O-N 3.18Å; C26-K28 PolarHBondContact O-N 2.93Å; C26-M29 PolarHBondContact O-N 3.47Å; C26-R30 PolarHBondContact O-N 3.37Å
27E98.1Very high95.8Very high58 Ų58106.6 Ų106.627%0.27151%0.513SS..Hα-helixtrans-65.3-38.7177.717759-17000111.9H23 L24 K25 R30 R31H23-E27 WeakPolarHBondContact O-CB 3.45Å; H23-E27 PolarHBondContact O-N 2.96Å; L24-E27 PolarHBondContact O-N 3.11Å; K25-E27 PolarHBondContact O-N 2.9Å; E27-R30 PolarHBondContact O-N 2.91Å; E27-R30 IonicContact OE1-CZ 3.73Å; E27-R30 IonicContact OE1-NE 3.86Å; E27-R30 IonicContact OE1-NH2 3.18Å; E27-R30 PolarHBondContact OE1-NH2 3.11Å; E27-R30 IonicContact OE2-CZ 3.38Å; E27-R30 IonicContact OE2-NE 2.78Å; E27-R30 PolarHBondContact OE2-NE 3.49Å; E27-R30 IonicContact OE2-NH2 2.78Å; E27-R30 PolarHBondContact OE2-NH2 3.39Å; E27-R30 VanDerWaalsContact OE2-NH2 3.13Å; E27-R31 WeakPolarHBondContact O-CG 3.11Å; E27-R31 PolarHBondContact O-N 2.9Å; E27-R31 IonicContact OE1-CZ 2.8Å; E27-R31 IonicContact OE1-NE 2.88Å; E27-R31 PolarHBondContact OE1-NE 3.01Å; E27-R31 IonicContact OE1-NH2 2.83Å; E27-R31 PolarHBondContact OE1-NH2 3.34Å
28K97.8Very high95.9Very high144 Ų144105 Ų10563%0.62650%0.501SS*.Hα-helixtrans-61.5-46.6172.4-173.7176.5179.6179.70111L24 K25 C26 R30 R31 E32L24-K28 WeakPolarHBondContact O-CB 2.85Å; L24-K28 PolarHBondContact O-N 2.94Å; K25-K28 PolarHBondContact O-N 2.98Å; C26-K28 PolarHBondContact O-N 2.93Å; K28-R30 VanDerWaalsContact C-N 3.34Å; K28-R30 PolarHBondContact O-N 3.49Å; K28-R31 PolarHBondContact O-N 3.33Å; K28-E32 WeakPolarHBondContact O-CG 3.11Å; K28-E32 PolarHBondContact O-N 2.87Å
29M97.9Very high95.9Very high121 Ų121101.3 Ų101.360%0.59649%0.493SS*.Hα-helixtrans-61.4-41.6177.2-70.1-179.265.800112.2K25 C26 R31 E32 A33K25-M29 HydrophobicContact CG-SD 4.41Å; K25-M29 WeakPolarHBondContact O-CG 3.02Å; K25-M29 PolarHBondContact O-N 3.32Å; C26-M29 PolarHBondContact O-N 3.47Å; M29-R31 PolarHBondContact O-N 3.22Å; M29-E32 PolarHBondContact O-N 3.45Å; M29-A33 WeakPolarHBondContact O-CB 3.29Å; M29-A33 PolarHBondContact O-N 3.12Å
30R98.3Very high96Very high128 Ų128101.1 Ų101.148%0.48349%0.494SS..Hα-helixtrans-60.5-43.1175.1-169.4-173.870.885.51.8111.8C26 E27 K28 A33 I34C26-R30 PolarHBondContact O-N 3.37Å; E27-R30 PolarHBondContact O-N 2.91Å; E27-R30 IonicContact OE1-CZ 3.73Å; E27-R30 IonicContact OE1-NE 3.86Å; E27-R30 IonicContact OE1-NH2 3.18Å; E27-R30 PolarHBondContact OE1-NH2 3.11Å; E27-R30 IonicContact OE2-CZ 3.38Å; E27-R30 IonicContact OE2-NE 2.78Å; E27-R30 PolarHBondContact OE2-NE 3.49Å; E27-R30 IonicContact OE2-NH2 2.78Å; E27-R30 PolarHBondContact OE2-NH2 3.39Å; E27-R30 VanDerWaalsContact OE2-NH2 3.13Å; K28-R30 VanDerWaalsContact C-N 3.34Å; K28-R30 PolarHBondContact O-N 3.49Å; R30-A33 PolarHBondContact O-N 3.44Å; R30-I34 HydrophobicContact CG-CD1 4.29Å; R30-I34 WeakPolarHBondContact O-CG1 3.33Å; R30-I34 PolarHBondContact O-N 3.33Å
31R98Very high95.8Very high152 Ų15297.5 Ų97.557%0.57448%0.481SS*.Hα-helixtrans-65.2-43.7177.6-74.1176.2-173.5-95.6-6.4112.5E27 K28 M29 I34 K35E27-R31 WeakPolarHBondContact O-CG 3.11Å; E27-R31 PolarHBondContact O-N 2.9Å; E27-R31 IonicContact OE1-CZ 2.8Å; E27-R31 IonicContact OE1-NE 2.88Å; E27-R31 PolarHBondContact OE1-NE 3.01Å; E27-R31 IonicContact OE1-NH2 2.83Å; E27-R31 PolarHBondContact OE1-NH2 3.34Å; K28-R31 PolarHBondContact O-N 3.33Å; M29-R31 PolarHBondContact O-N 3.22Å; R31-I34 PolarHBondContact O-N 3.25Å; R31-K35 WeakPolarHBondContact O-CB 3.43Å; R31-K35 PolarHBondContact O-N 2.91Å
32E98.1Very high95.5Very high89 Ų8995.9 Ų95.942%0.41647%0.471SS..Hα-helixtrans-63.9-42.3176-67.2-51.7134.300111.1K28 M29 I34 K35 V36K28-E32 WeakPolarHBondContact O-CG 3.11Å; K28-E32 PolarHBondContact O-N 2.87Å; M29-E32 PolarHBondContact O-N 3.45Å; E32-I34 VanDerWaalsContact C-N 3.35Å; E32-I34 PolarHBondContact O-N 3.45Å; E32-K35 PolarHBondContact O-N 3.21Å; E32-V36 VanDerWaalsContact O-CG2 3.3Å; E32-V36 WeakPolarHBondContact O-CG2 3.34Å; E32-V36 PolarHBondContact O-N 2.97Å
33A98Very high95.1Very high65 Ų6598.6 Ų98.654%0.53748%0.483SS..Hα-helixtrans-59.9-42.8175.400000112.5M29 R30 V36 G37M29-A33 WeakPolarHBondContact O-CB 3.29Å; M29-A33 PolarHBondContact O-N 3.12Å; R30-A33 PolarHBondContact O-N 3.44Å; A33-V36 PolarHBondContact O-N 3.4Å; A33-G37 PolarHBondContact O-N 2.99Å
34I96.7Very high94.7Very high77 Ų7798.6 Ų98.640%0.39549%0.485SS..Hα-helixtrans-63.7-44.4175.4-70.6168.4000110.9R30 R31 E32 V36 G37 Y38R30-I34 HydrophobicContact CG-CD1 4.29Å; R30-I34 WeakPolarHBondContact O-CG1 3.33Å; R30-I34 PolarHBondContact O-N 3.33Å; R31-I34 PolarHBondContact O-N 3.25Å; E32-I34 VanDerWaalsContact C-N 3.35Å; E32-I34 PolarHBondContact O-N 3.45Å; I34-V36 VanDerWaalsContact C-N 3.34Å; I34-V36 PolarHBondContact O-N 3.03Å; I34-G37 PolarHBondContact O-N 3.48Å; I34-Y38 HydrophobicContact CG2-CD2 3.78Å; I34-Y38 HydrophobicContact CG2-CE2 3.69Å; I34-Y38 VanDerWaalsContact O-CD2 3.3Å; I34-Y38 WeakPolarHBondContact O-CD2 3.05Å; I34-Y38 PolarHBondContact O-N 2.95Å
35K95.6Very high94.2Very high119 Ų11993 Ų9352%0.51746%0.456SS..Hα-helixtrans-61.7-42.2178.8-177.2-177.3174.1-169.30111.7R31 E32 Y38 N39R31-K35 WeakPolarHBondContact O-CB 3.43Å; R31-K35 PolarHBondContact O-N 2.91Å; E32-K35 PolarHBondContact O-N 3.21Å; K35-Y38 PolarHBondContact O-N 3.26Å; K35-N39 PolarHBondContact O-N 2.94Å; K35-N39 VanDerWaalsContact O-N 3.12Å; K35-N39 PolarHBondContact O-ND2 3.32Å
36V96.2Very high93.6Very high71 Ų7189.8 Ų89.843%0.4345%0.449SS..Hα-helixtrans-60.2-48.7173.1170.70000110.3E32 A33 I34 Y38 N39 E40E32-V36 VanDerWaalsContact O-CG2 3.3Å; E32-V36 WeakPolarHBondContact O-CG2 3.34Å; E32-V36 PolarHBondContact O-N 2.97Å; A33-V36 PolarHBondContact O-N 3.4Å; I34-V36 VanDerWaalsContact C-N 3.34Å; I34-V36 PolarHBondContact O-N 3.03Å; V36-Y38 VanDerWaalsContact C-N 3.29Å; V36-Y38 PolarHBondContact O-N 3.46Å; V36-N39 WeakPolarHBondContact O-CA 3.49Å; V36-N39 WeakPolarHBondContact O-CB 3.41Å; V36-N39 PolarHBondContact O-N 3.35Å; V36-E40 HydrophobicContact CG1-CG 4.28Å; V36-E40 WeakPolarHBondContact CG1-OE1 3.42Å; V36-E40 WeakPolarHBondContact O-CG 3.18Å; V36-E40 PolarHBondContact O-N 3.38Å
37G94.2Very high92.6Very high24 Ų2492.5 Ų92.525%0.24747%0.466CS..Hα-helixtrans-58.8-36.8177.800000113.7A33 I34 L41A33-G37 PolarHBondContact O-N 2.99Å; I34-G37 PolarHBondContact O-N 3.48Å; G37-L41 WeakPolarHBondContact O-CB 3.41Å; G37-L41 VanDerWaalsContact O-CG 3.23Å; G37-L41 WeakPolarHBondContact O-CG 3.25Å; G37-L41 PolarHBondContact O-N 3.02Å
38Y93.8Very high91.5Very high51 Ų5198.3 Ų98.320%0.249%0.493CS..Hα-helixtrans-66.5-37.1172.7-87.4-73.3000113.2I34 K35 V36 K42 N58 I61 L62I34-Y38 HydrophobicContact CG2-CD2 3.78Å; I34-Y38 HydrophobicContact CG2-CE2 3.69Å; I34-Y38 VanDerWaalsContact O-CD2 3.3Å; I34-Y38 WeakPolarHBondContact O-CD2 3.05Å; I34-Y38 PolarHBondContact O-N 2.95Å; K35-Y38 PolarHBondContact O-N 3.26Å; V36-Y38 VanDerWaalsContact C-N 3.29Å; V36-Y38 PolarHBondContact O-N 3.46Å; Y38-K42 VanDerWaalsContact O-CB 3.27Å; Y38-K42 WeakPolarHBondContact O-CB 3.37Å; Y38-K42 PolarHBondContact O-N 2.96Å; Y38-N58 HydrophobicContact CD1-CB 4.41Å; Y38-N58 HydrophobicContact CE1-CB 3.64Å; Y38-N58 WeakPolarHBondContact CE1-O 3.46Å; Y38-I61 HydrophobicContact CD1-CB 4.1Å; Y38-I61 HydrophobicContact CD1-CD1 4.05Å; Y38-I61 HydrophobicContact CD1-CG2 3.89Å; Y38-I61 HydrophobicContact CE1-CB 4.35Å; Y38-I61 HydrophobicContact CE1-CG2 4.44Å; Y38-L62 HydrophobicContact CE1-CD1 4.43Å; Y38-L62 HydrophobicContact CE1-CD2 3.96Å; Y38-L62 HydrophobicContact CE1-CG 3.84Å; Y38-L62 WeakPolarHBondContact OH-CD1 3.31Å
39N91.2Very high90.1Very high84 Ų8491.7 Ų91.745%0.44947%0.465SS..Hα-helixtrans-67.8-45.9175.9-70-25.7000110.9K35 V36 L41 K42 D43K35-N39 PolarHBondContact O-N 2.94Å; K35-N39 VanDerWaalsContact O-N 3.12Å; K35-N39 PolarHBondContact O-ND2 3.32Å; V36-N39 WeakPolarHBondContact O-CA 3.49Å; V36-N39 WeakPolarHBondContact O-CB 3.41Å; V36-N39 PolarHBondContact O-N 3.35Å; N39-L41 PolarHBondContact O-N 3.25Å; N39-K42 CarbonylContact O-C 3.55Å; N39-K42 WeakPolarHBondContact O-CA 3.47Å; N39-K42 WeakPolarHBondContact O-CB 3.37Å; N39-K42 PolarHBondContact O-N 3.24Å; N39-D43 VanDerWaalsContact O-CG 3.3Å; N39-D43 PolarHBondContact O-N 2.89Å
40E92.3Very high88.7Confident116 Ų11687.6 Ų87.654%0.54245%0.451SS..Hα-helixtrans-58.7-45.4175.6-69.1173.518000111.9V36 K42 D43 M44V36-E40 HydrophobicContact CG1-CG 4.28Å; V36-E40 WeakPolarHBondContact CG1-OE1 3.42Å; V36-E40 WeakPolarHBondContact O-CG 3.18Å; V36-E40 PolarHBondContact O-N 3.38Å; E40-K42 VanDerWaalsContact C-N 3.26Å; E40-K42 PolarHBondContact O-N 2.84Å; E40-D43 PolarHBondContact O-N 3.37Å; E40-M44 WeakPolarHBondContact O-CG 3.4Å; E40-M44 PolarHBondContact O-N 3.41Å; E40-M44 VanDerWaalsContact O-N 3.14Å
41L90.1Very high87.3Confident50 Ų5085.2 Ų85.226%0.26245%0.452SS..Hα-helixtrans-61.4-36.7174.7-74.5172.1000111.9G37 N39 M44 L45 I61 L62G37-L41 WeakPolarHBondContact O-CB 3.41Å; G37-L41 VanDerWaalsContact O-CG 3.23Å; G37-L41 WeakPolarHBondContact O-CG 3.25Å; G37-L41 PolarHBondContact O-N 3.02Å; N39-L41 PolarHBondContact O-N 3.25Å; L41-M44 HydrophobicContact CD2-CE 3.8Å; L41-M44 PolarHBondContact O-N 3.03Å; L41-L45 VanDerWaalsContact O-CD1 3.31Å; L41-L45 WeakPolarHBondContact O-CD1 3.37Å; L41-L45 VanDerWaalsContact O-CG 3.31Å; L41-L45 WeakPolarHBondContact O-CG 3.31Å; L41-L45 PolarHBondContact O-N 3.25Å; L41-I61 HydrophobicContact CB-CG2 3.6Å; L41-I61 HydrophobicContact CD1-CG2 4.3Å; L41-L62 HydrophobicContact CD1-CD2 4.13Å
42K88Confident86.1Confident107 Ų10785 Ų8547%0.46547%0.468SS..Hα-helixtrans-68.6-37.1177.2-171.5-176.4174-166.20112.3Y38 N39 E40 M44 L45 L56Y38-K42 VanDerWaalsContact O-CB 3.27Å; Y38-K42 WeakPolarHBondContact O-CB 3.37Å; Y38-K42 PolarHBondContact O-N 2.96Å; N39-K42 CarbonylContact O-C 3.55Å; N39-K42 WeakPolarHBondContact O-CA 3.47Å; N39-K42 WeakPolarHBondContact O-CB 3.37Å; N39-K42 PolarHBondContact O-N 3.24Å; E40-K42 VanDerWaalsContact C-N 3.26Å; E40-K42 PolarHBondContact O-N 2.84Å; K42-M44 VanDerWaalsContact C-N 3.31Å; K42-L45 WeakPolarHBondContact O-CB 3.44Å; K42-L45 PolarHBondContact O-N 3.4Å; K42-L56 HydrophobicContact CG-CD1 4.25Å
43D86.6Confident84.8Confident136 Ų13684.7 Ų84.773%0.72749%0.488SS*.Hα-helixtrans-70.2-30.4177.4-64.4-20.7000112N39 E40 L45N39-D43 VanDerWaalsContact O-CG 3.3Å; N39-D43 PolarHBondContact O-N 2.89Å; E40-D43 PolarHBondContact O-N 3.37Å; D43-L45 VanDerWaalsContact C-N 3.26Å; D43-L45 PolarHBondContact O-N 2.67Å
44M86.2Confident83.7Confident134 Ų13490.1 Ų90.166%0.6650%0.496SS*.THydrogen-bonded Turntrans-76.3-11.6173.5-68.1-169.5-70.100113.8E40 L41 K42E40-M44 WeakPolarHBondContact O-CG 3.4Å; E40-M44 PolarHBondContact O-N 3.41Å; E40-M44 VanDerWaalsContact O-N 3.14Å; L41-M44 HydrophobicContact CD2-CE 3.8Å; L41-M44 PolarHBondContact O-N 3.03Å; K42-M44 VanDerWaalsContact C-N 3.31Å
45L86.2Confident82.9Confident13 Ų1396 Ų967%0.06852%0.519CS..SBendtrans-83.3143.4179-79157.3000110.4L41 K42 D43 A49 I61 R64 I68L41-L45 VanDerWaalsContact O-CD1 3.31Å; L41-L45 WeakPolarHBondContact O-CD1 3.37Å; L41-L45 VanDerWaalsContact O-CG 3.31Å; L41-L45 WeakPolarHBondContact O-CG 3.31Å; L41-L45 PolarHBondContact O-N 3.25Å; K42-L45 WeakPolarHBondContact O-CB 3.44Å; K42-L45 PolarHBondContact O-N 3.4Å; D43-L45 VanDerWaalsContact C-N 3.26Å; D43-L45 PolarHBondContact O-N 2.67Å; L45-A49 HydrophobicContact CB-CB 4.43Å; L45-I61 HydrophobicContact CD1-CB 4.39Å; L45-I61 HydrophobicContact CD1-CG1 4.46Å; L45-I61 HydrophobicContact CD1-CG2 4.02Å; L45-R64 HydrophobicContact CD1-CB 4.44Å; L45-R64 HydrophobicContact CD2-CB 3.24Å; L45-R64 HydrophobicContact CD2-CG 4.22Å; L45-R64 HydrophobicContact CG-CB 4.49Å; L45-I68 HydrophobicContact CD2-CD1 3.5Å; L45-I68 HydrophobicContact CG-CD1 4.34Å
46P84.9Confident82.3Confident74 Ų7491.7 Ų91.748%0.48150%0.501SS..  trans-55.3141.7173.5-25.433.8000111.5E48 A49P46-E48 PolarHBondContact O-N 3.39Å; P46-A49 WeakPolarHBondContact O-CB 3.27Å; P46-A49 PolarHBondContact O-N 3.39Å
47P75.7Confident81.9Confident129 Ų12992.4 Ų92.484%0.83851%0.506SS*.G310 helixtrans-61.7-30.4-177.722.1-32.1000113A49P47-A49 PolarHBondContact O-N 2.94Å; P47-A49 VanDerWaalsContact O-N 3.12Å
48E74.9Confident81.7Confident180 Ų18095.8 Ų95.884%0.84152%0.518SS*.G310 helixtrans-64.9-6.9172.6-62.3-86.3145.900113.4P46 A50P46-E48 PolarHBondContact O-N 3.39Å; E48-A50 VanDerWaalsContact C-N 3.31Å; E48-A50 PolarHBondContact O-N 2.9Å
49A69.4Low81.5Confident5 Ų596.8 Ų96.84%0.04154%0.537CS..G310 helixtrans-67.1-31.2-173.300000113.2L45 P46 P47 L56 R64L45-A49 HydrophobicContact CB-CB 4.43Å; P46-A49 WeakPolarHBondContact O-CB 3.27Å; P46-A49 PolarHBondContact O-N 3.39Å; P47-A49 PolarHBondContact O-N 2.94Å; P47-A49 VanDerWaalsContact O-N 3.12Å; A49-L56 HydrophobicContact CB-CD1 4.47Å; A49-R64 PolarHBondContact O-NH1 3.24Å; A49-R64 PolarHBondContact O-NH2 3.02Å
50A68.2Low81.4Confident36 Ų3694 Ų9430%0.29852%0.524SS..SBendtrans-83.6123.3176.300000109.4E48 V52 L56E48-A50 VanDerWaalsContact C-N 3.31Å; E48-A50 PolarHBondContact O-N 2.9Å; A50-V52 PolarHBondContact O-N 3Å; A50-L56 HydrophobicContact CB-CD1 4.42Å; A50-L56 HydrophobicContact CB-CD2 4.18Å; A50-L56 HydrophobicContact CB-CG 3.92Å
51P69.4Low81.3Confident78 Ų7888.9 Ų88.951%0.50650%0.5SS..PPolyproline II helixtrans-53136167-19.630.5000109.1G53 Y54P51-G53 PolarHBondContact O-N 3.28Å; P51-Y54 HydrophobicContact CB-CD2 4.17Å; P51-Y54 PolarHBondContact O-N 2.99Å
52V72.9Confident81.4Confident148 Ų14890.6 Ų90.690%0.89751%0.509SS*.THydrogen-bonded Turntrans-48.5118.8-178.5-179.80000109.6A50A50-V52 PolarHBondContact O-N 3Å
53G70.5Confident81.6Confident82 Ų8292.8 Ų92.885%0.84552%0.515SS*.THydrogen-bonded Turntrans90.8-4.3178.900000116.9P51P51-G53 PolarHBondContact O-N 3.28Å
54Y75.3Confident81.6Confident178 Ų17890.6 Ų90.670%0.69850%0.497SS*.  trans-112.8134.7179.6-68.3-88.8000112.9P51P51-Y54 HydrophobicContact CB-CD2 4.17Å; P51-Y54 PolarHBondContact O-N 2.99Å
55K79.3Confident81.8Confident202 Ų20285 Ų8588%0.87847%0.473SS*.PPolyproline II helixtrans-70136.2170.7-64.9-178.3-178.1178.30109.5T57K55-T57 PolarHBondContact O-N 3.34Å
56L82.7Confident82Confident27 Ų2788.6 Ų88.614%0.14149%0.491CS..PPolyproline II helixtrans-61126.7170.3-71.3170.8000110K42 A49 A50 I61K42-L56 HydrophobicContact CG-CD1 4.25Å; A49-L56 HydrophobicContact CB-CD1 4.47Å; A50-L56 HydrophobicContact CB-CD1 4.42Å; A50-L56 HydrophobicContact CB-CD2 4.18Å; A50-L56 HydrophobicContact CB-CG 3.92Å; L56-I61 HydrophobicContact CB-CD1 4.21Å; L56-I61 HydrophobicContact CB-CG1 3.89Å; L56-I61 HydrophobicContact CD1-CG1 4.49Å
57T88.8Confident82.3Confident87 Ų8789.9 Ų89.953%0.53449%0.49SS..PPolyproline II helixtrans-75.2151.617463.40000110.2K55 A59 S60 I61K55-T57 PolarHBondContact O-N 3.34Å; T57-A59 PolarHBondContact O-N 3.46Å; T57-S60 PolarHBondContact N-OG 2.94Å; T57-S60 PolarHBondContact O-N 3.33Å; T57-S60 PolarHBondContact O-OG 3.07Å; T57-S60 WeakPolarHBondContact OG1-CB 3.44Å; T57-S60 PolarHBondContact OG1-N 2.9Å; T57-S60 PolarHBondContact OG1-OG 3.48Å; T57-I61 PolarHBondContact O-N 3.44Å
58N89.5Confident82.9Confident95 Ų9586.9 Ų86.951%0.50847%0.467SS..Hα-helixtrans-53.5-39.3176.2-70.93.4000112.3Y38 I61 L62Y38-N58 HydrophobicContact CD1-CB 4.41Å; Y38-N58 HydrophobicContact CE1-CB 3.64Å; Y38-N58 WeakPolarHBondContact CE1-O 3.46Å; N58-I61 PolarHBondContact O-N 3.46Å; N58-L62 WeakPolarHBondContact O-CG 3.49Å; N58-L62 PolarHBondContact O-N 3.1Å; N58-L62 VanDerWaalsContact O-N 3.11Å
59A90Very high83.7Confident71 Ų7186.9 Ų86.959%0.58746%0.459SS*.Hα-helixtrans-62.1-42.8175.600000112.1T57 L62 Y63T57-A59 PolarHBondContact O-N 3.46Å; A59-L62 PolarHBondContact O-N 2.91Å; A59-Y63 WeakPolarHBondContact O-CB 3.46Å; A59-Y63 PolarHBondContact O-N 3.33Å
60S89Confident84.7Confident27 Ų2792.2 Ų92.219%0.18948%0.481CS..Hα-helixtrans-66.8-38178.272.80000112.8T57 Y63 R64T57-S60 PolarHBondContact N-OG 2.94Å; T57-S60 PolarHBondContact O-N 3.33Å; T57-S60 PolarHBondContact O-OG 3.07Å; T57-S60 WeakPolarHBondContact OG1-CB 3.44Å; T57-S60 PolarHBondContact OG1-N 2.9Å; T57-S60 PolarHBondContact OG1-OG 3.48Å; S60-Y63 PolarHBondContact O-N 3.42Å; S60-R64 WeakPolarHBondContact O-CB 3.48Å; S60-R64 VanDerWaalsContact O-CG 3.24Å; S60-R64 WeakPolarHBondContact O-CG 3.39Å; S60-R64 PolarHBondContact O-N 3.21Å
61I90.3Very high85.9Confident8 Ų893.2 Ų93.24%0.04148%0.484CS..Hα-helixtrans-62-48176.4-64168.7000109.7Y38 L41 L45 L56 T57 N58 G65Y38-I61 HydrophobicContact CD1-CB 4.1Å; Y38-I61 HydrophobicContact CD1-CD1 4.05Å; Y38-I61 HydrophobicContact CD1-CG2 3.89Å; Y38-I61 HydrophobicContact CE1-CB 4.35Å; Y38-I61 HydrophobicContact CE1-CG2 4.44Å; L41-I61 HydrophobicContact CB-CG2 3.6Å; L41-I61 HydrophobicContact CD1-CG2 4.3Å; L45-I61 HydrophobicContact CD1-CB 4.39Å; L45-I61 HydrophobicContact CD1-CG1 4.46Å; L45-I61 HydrophobicContact CD1-CG2 4.02Å; L56-I61 HydrophobicContact CB-CD1 4.21Å; L56-I61 HydrophobicContact CB-CG1 3.89Å; L56-I61 HydrophobicContact CD1-CG1 4.49Å; T57-I61 PolarHBondContact O-N 3.44Å; N58-I61 PolarHBondContact O-N 3.46Å; I61-G65 PolarHBondContact O-N 3.35Å
62L91.8Very high87Confident86 Ų8694.5 Ų94.545%0.4549%0.486SS..Hα-helixtrans-62.4-48178.2-68.4179.8000112.2Y38 L41 N58 A59 R64 G65 M66Y38-L62 HydrophobicContact CE1-CD1 4.43Å; Y38-L62 HydrophobicContact CE1-CD2 3.96Å; Y38-L62 HydrophobicContact CE1-CG 3.84Å; Y38-L62 WeakPolarHBondContact OH-CD1 3.31Å; L41-L62 HydrophobicContact CD1-CD2 4.13Å; N58-L62 WeakPolarHBondContact O-CG 3.49Å; N58-L62 PolarHBondContact O-N 3.1Å; N58-L62 VanDerWaalsContact O-N 3.11Å; A59-L62 PolarHBondContact O-N 2.91Å; L62-R64 PolarHBondContact O-N 3.01Å; L62-G65 PolarHBondContact O-N 3.11Å; L62-M66 WeakPolarHBondContact O-CB 3.43Å; L62-M66 PolarHBondContact O-N 3.34Å
63Y91.2Very high88Confident152 Ų15292 Ų9260%0.59647%0.466SS*.Hα-helixtrans-60.5-47.5-179178.2-96.9000111.6A59 S60 M66 H67A59-Y63 WeakPolarHBondContact O-CB 3.46Å; A59-Y63 PolarHBondContact O-N 3.33Å; S60-Y63 PolarHBondContact O-N 3.42Å; Y63-M66 HydrophobicContact CD2-CE 4.36Å; Y63-M66 PolarHBondContact O-N 3.17Å; Y63-H67 WeakPolarHBondContact O-CB 3.37Å; Y63-H67 PolarHBondContact O-N 2.99Å
64R88.2Confident89.1Confident90 Ų9094 Ų9434%0.3446%0.456SS..Hα-helixtrans-70.8-40.5-179.2-65176.9-178.1-124.58.3112.1L45 A49 S60 L62 M66 H67 I68L45-R64 HydrophobicContact CD1-CB 4.44Å; L45-R64 HydrophobicContact CD2-CB 3.24Å; L45-R64 HydrophobicContact CD2-CG 4.22Å; L45-R64 HydrophobicContact CG-CB 4.49Å; A49-R64 PolarHBondContact O-NH1 3.24Å; A49-R64 PolarHBondContact O-NH2 3.02Å; S60-R64 WeakPolarHBondContact O-CB 3.48Å; S60-R64 VanDerWaalsContact O-CG 3.24Å; S60-R64 WeakPolarHBondContact O-CG 3.39Å; S60-R64 PolarHBondContact O-N 3.21Å; L62-R64 PolarHBondContact O-N 3.01Å; R64-M66 VanDerWaalsContact C-N 3.33Å; R64-M66 PolarHBondContact O-N 3.41Å; R64-H67 PolarHBondContact O-N 3.26Å; R64-H67 VanDerWaalsContact O-N 3.17Å; R64-I68 WeakPolarHBondContact O-CB 3.44Å; R64-I68 WeakPolarHBondContact O-CG1 3.45Å; R64-I68 PolarHBondContact O-N 3.23Å
65G89Confident90Very high16 Ų1690.6 Ų90.617%0.16545%0.449CS..Hα-helixtrans-60.2-43.1174.600000112I61 L62 R69I61-G65 PolarHBondContact O-N 3.35Å; L62-G65 PolarHBondContact O-N 3.11Å; G65-R69 WeakPolarHBondContact O-CB 3.26Å; G65-R69 PolarHBondContact O-N 3.03Å
66M91.1Very high90.8Very high90 Ų9084.4 Ų84.444%0.44343%0.429SS..Hα-helixtrans-62-44.5172.4-178.7-17563.200111.6L62 Y63 R64 R69 K70L62-M66 WeakPolarHBondContact O-CB 3.43Å; L62-M66 PolarHBondContact O-N 3.34Å; Y63-M66 HydrophobicContact CD2-CE 4.36Å; Y63-M66 PolarHBondContact O-N 3.17Å; R64-M66 VanDerWaalsContact C-N 3.33Å; R64-M66 PolarHBondContact O-N 3.41Å; M66-R69 PolarHBondContact O-N 3.46Å; M66-K70 HydrophobicContact CG-CD 4.23Å; M66-K70 WeakPolarHBondContact O-CB 3.4Å; M66-K70 WeakPolarHBondContact O-CG 3.46Å; M66-K70 PolarHBondContact O-N 3.33Å
67H90Very high91.3Very high100 Ų10086.5 Ų86.546%0.46345%0.445SS..Hα-helixtrans-62.4-49.7179.4-175.7-87000111.7Y63 R64 R69 K70 V71Y63-H67 WeakPolarHBondContact O-CB 3.37Å; Y63-H67 PolarHBondContact O-N 2.99Å; R64-H67 PolarHBondContact O-N 3.26Å; R64-H67 VanDerWaalsContact O-N 3.17Å; H67-R69 VanDerWaalsContact C-N 3.32Å; H67-R69 PolarHBondContact O-N 2.96Å; H67-K70 PolarHBondContact O-N 2.97Å; H67-V71 WeakPolarHBondContact O-CG2 3.1Å; H67-V71 PolarHBondContact O-N 3.16Å
68I89.8Confident91.5Very high66 Ų6685.3 Ų85.334%0.33844%0.439SS..Hα-helixtrans-59.1-44.6177.1-69.4169.8000110.5L45 R64 K70 V71 L72L45-I68 HydrophobicContact CD2-CD1 3.5Å; L45-I68 HydrophobicContact CG-CD1 4.34Å; R64-I68 WeakPolarHBondContact O-CB 3.44Å; R64-I68 WeakPolarHBondContact O-CG1 3.45Å; R64-I68 PolarHBondContact O-N 3.23Å; I68-K70 PolarHBondContact O-N 3.4Å; I68-V71 PolarHBondContact O-N 2.99Å; I68-L72 VanDerWaalsContact O-CB 3.28Å; I68-L72 WeakPolarHBondContact O-CB 3.5Å; I68-L72 PolarHBondContact O-N 3.46Å
69R90.8Very high91.8Very high180 Ų18086.4 Ų86.468%0.67944%0.444SS*.Hα-helixtrans-60.8-43.5176.3-176.7173.7-177.1139.90.9112.1G65 M66 H67 L72 I73G65-R69 WeakPolarHBondContact O-CB 3.26Å; G65-R69 PolarHBondContact O-N 3.03Å; M66-R69 PolarHBondContact O-N 3.46Å; H67-R69 VanDerWaalsContact C-N 3.32Å; H67-R69 PolarHBondContact O-N 2.96Å; R69-L72 PolarHBondContact O-N 3.37Å; R69-I73 HydrophobicContact CG-CD1 3.98Å; R69-I73 VanDerWaalsContact O-CG1 3.25Å; R69-I73 WeakPolarHBondContact O-CG1 3.33Å; R69-I73 PolarHBondContact O-N 3.01Å
70K91.7Very high92Very high118 Ų11885.8 Ų85.851%0.51344%0.439SS..Hα-helixtrans-61.7-46.9176.1-75.8178.8178.4-177.30111.3M66 H67 I68 I73 I74M66-K70 HydrophobicContact CG-CD 4.23Å; M66-K70 WeakPolarHBondContact O-CB 3.4Å; M66-K70 WeakPolarHBondContact O-CG 3.46Å; M66-K70 PolarHBondContact O-N 3.33Å; H67-K70 PolarHBondContact O-N 2.97Å; I68-K70 PolarHBondContact O-N 3.4Å; K70-I73 PolarHBondContact O-N 3.49Å; K70-I74 VanDerWaalsContact O-CG1 3.28Å; K70-I74 WeakPolarHBondContact O-CG1 3.4Å; K70-I74 PolarHBondContact O-N 3.39Å
71V92.2Very high92.3Very high57 Ų5791 Ų9135%0.34546%0.458SS..Hα-helixtrans-61.9-46.5177.7172.80000110.9H67 I68 I73 I74 L75H67-V71 WeakPolarHBondContact O-CG2 3.1Å; H67-V71 PolarHBondContact O-N 3.16Å; I68-V71 PolarHBondContact O-N 2.99Å; V71-I73 VanDerWaalsContact C-N 3.32Å; V71-I73 PolarHBondContact O-N 3Å; V71-I74 PolarHBondContact O-N 2.91Å; V71-I74 VanDerWaalsContact O-N 3.16Å; V71-L75 HydrophobicContact CG1-CD1 3.67Å; V71-L75 HydrophobicContact CG1-CG 4.15Å; V71-L75 WeakPolarHBondContact O-CB 3.49Å; V71-L75 WeakPolarHBondContact O-CG 3.39Å; V71-L75 PolarHBondContact O-N 3.01Å
72L93Very high92.6Very high105 Ų10596 Ų9655%0.5548%0.484SS..Hα-helixtrans-57.7-45177.2-176.369.9000111.4I68 R69 L75 V76I68-L72 VanDerWaalsContact O-CB 3.28Å; I68-L72 WeakPolarHBondContact O-CB 3.5Å; I68-L72 PolarHBondContact O-N 3.46Å; R69-L72 PolarHBondContact O-N 3.37Å; L72-L75 PolarHBondContact O-N 3.28Å; L72-V76 HydrophobicContact CD1-CG2 3.57Å; L72-V76 HydrophobicContact CG-CG2 4.22Å; L72-V76 VanDerWaalsContact O-CB 3.27Å; L72-V76 WeakPolarHBondContact O-CB 3.41Å; L72-V76 WeakPolarHBondContact O-CG2 3.44Å; L72-V76 PolarHBondContact O-N 3.35Å
73I93.9Very high92.8Very high94 Ų9494.6 Ų94.648%0.48249%0.485SS..Hα-helixtrans-61.8-46176.6-70.6166.5000110.6R69 K70 V71 L75 S77R69-I73 HydrophobicContact CG-CD1 3.98Å; R69-I73 VanDerWaalsContact O-CG1 3.25Å; R69-I73 WeakPolarHBondContact O-CG1 3.33Å; R69-I73 PolarHBondContact O-N 3.01Å; K70-I73 PolarHBondContact O-N 3.49Å; V71-I73 VanDerWaalsContact C-N 3.32Å; V71-I73 PolarHBondContact O-N 3Å; I73-L75 VanDerWaalsContact C-N 3.33Å; I73-L75 PolarHBondContact O-N 3.46Å; I73-S77 WeakPolarHBondContact O-CB 3.42Å; I73-S77 PolarHBondContact O-N 3.02Å
74I94.4Very high93.1Very high124 Ų12489.9 Ų89.964%0.63648%0.478SS*.Hα-helixtrans-64.2-38-178.9-69165.8000111.7K70 V71 P78K70-I74 VanDerWaalsContact O-CG1 3.28Å; K70-I74 WeakPolarHBondContact O-CG1 3.4Å; K70-I74 PolarHBondContact O-N 3.39Å; V71-I74 PolarHBondContact O-N 2.91Å; V71-I74 VanDerWaalsContact O-N 3.16Å; I74-P78 WeakPolarHBondContact O-CD 3.4Å; I74-P78 WeakPolarHBondContact O-CG 3.27Å
75L94.1Very high93.4Very high107 Ų10789.1 Ų89.156%0.5648%0.478SS*.Hα-helixtrans-81.7-41.9-177.7-64.9179.9000113.1V71 L72 I73 I79V71-L75 HydrophobicContact CG1-CD1 3.67Å; V71-L75 HydrophobicContact CG1-CG 4.15Å; V71-L75 WeakPolarHBondContact O-CB 3.49Å; V71-L75 WeakPolarHBondContact O-CG 3.39Å; V71-L75 PolarHBondContact O-N 3.01Å; L72-L75 PolarHBondContact O-N 3.28Å; I73-L75 VanDerWaalsContact C-N 3.33Å; I73-L75 PolarHBondContact O-N 3.46Å; L75-I79 WeakPolarHBondContact O-CD1 3.31Å
76V94.3Very high93.8Very high73 Ų7394.5 Ų94.544%0.44250%0.497SS..Hα-helixtrans-89.2-35-171.6179.80000112.4L72 I79 A80L72-V76 HydrophobicContact CD1-CG2 3.57Å; L72-V76 HydrophobicContact CG-CG2 4.22Å; L72-V76 VanDerWaalsContact O-CB 3.27Å; L72-V76 WeakPolarHBondContact O-CB 3.41Å; L72-V76 WeakPolarHBondContact O-CG2 3.44Å; L72-V76 PolarHBondContact O-N 3.35Å; V76-I79 PolarHBondContact O-N 2.96Å; V76-A80 WeakPolarHBondContact O-CB 3.48Å; V76-A80 PolarHBondContact O-N 3.44Å
77S93.4Very high94.1Very high70 Ų7094.6 Ų94.649%0.4950%0.499SS..Hα-helixtrans-53.1-48.8179.3-174.20000113.8I73 I79 A80 F81I73-S77 WeakPolarHBondContact O-CB 3.42Å; I73-S77 PolarHBondContact O-N 3.02Å; S77-I79 VanDerWaalsContact C-N 3.35Å; S77-I79 PolarHBondContact O-N 3.21Å; S77-A80 PolarHBondContact O-N 3.39Å; S77-F81 VanDerWaalsContact O-CB 3.31Å; S77-F81 WeakPolarHBondContact O-CB 3.25Å; S77-F81 PolarHBondContact O-N 2.9Å
78P93.9Very high94.4Very high62 Ų6296.3 Ų96.340%0.40351%0.505SS..Hα-helixtrans-65.4-37.2-179.924.9-34.3000112.7I74 F81 I82I74-P78 WeakPolarHBondContact O-CD 3.4Å; I74-P78 WeakPolarHBondContact O-CG 3.27Å; P78-F81 PolarHBondContact O-N 3.4Å; P78-I82 WeakPolarHBondContact O-CD1 3.47Å; P78-I82 VanDerWaalsContact O-CG1 3.25Å; P78-I82 WeakPolarHBondContact O-CG1 3.37Å; P78-I82 PolarHBondContact O-N 3.42Å
79I94.9Very high94.8Very high119 Ų11999.6 Ų99.661%0.6152%0.517SS*.Hα-helixtrans-66.4-46.6178.8-59169.9000110L75 V76 S77 F81 I82 A83L75-I79 WeakPolarHBondContact O-CD1 3.31Å; V76-I79 PolarHBondContact O-N 2.96Å; S77-I79 VanDerWaalsContact C-N 3.35Å; S77-I79 PolarHBondContact O-N 3.21Å; I79-F81 VanDerWaalsContact C-N 3.31Å; I79-F81 PolarHBondContact O-N 2.94Å; I79-I82 PolarHBondContact O-N 3.14Å; I79-A83 WeakPolarHBondContact O-CB 3.38Å; I79-A83 PolarHBondContact O-N 3.49Å
80A94.8Very high95.1Very high58 Ų5895.2 Ų95.248%0.47951%0.506SS..Hα-helixtrans-61.8-40.2176.600000111.8V76 S77 A83 A84V76-A80 WeakPolarHBondContact O-CB 3.48Å; V76-A80 PolarHBondContact O-N 3.44Å; S77-A80 PolarHBondContact O-N 3.39Å; A80-A83 PolarHBondContact O-N 3.47Å; A80-A84 WeakPolarHBondContact O-CB 3.34Å; A80-A84 PolarHBondContact O-N 3.42Å
81F96.2Very high95.3Very high135 Ų13595.8 Ų95.859%0.59251%0.509SS*.Hα-helixtrans-63.4-47.9176.8-179-99.6000112.2S77 P78 I79 A83 A84 E85S77-F81 VanDerWaalsContact O-CB 3.31Å; S77-F81 WeakPolarHBondContact O-CB 3.25Å; S77-F81 PolarHBondContact O-N 2.9Å; P78-F81 PolarHBondContact O-N 3.4Å; I79-F81 VanDerWaalsContact C-N 3.31Å; I79-F81 PolarHBondContact O-N 2.94Å; F81-A83 VanDerWaalsContact C-N 3.35Å; F81-A83 PolarHBondContact O-N 2.99Å; F81-A84 PolarHBondContact O-N 2.86Å; F81-E85 HydrophobicContact CE1-CG 4.07Å; F81-E85 HydrophobicContact CE2-CG 4.37Å; F81-E85 HydrophobicContact CZ-CG 3.98Å; F81-E85 PolarHBondContact O-N 2.8Å
82I96.2Very high95.5Very high113 Ų11397.8 Ų97.858%0.57952%0.517SS*.Hα-helixtrans-62.1-43.3178-67.8163.8000110.9P78 I79 A84 E85 F86P78-I82 WeakPolarHBondContact O-CD1 3.47Å; P78-I82 VanDerWaalsContact O-CG1 3.25Å; P78-I82 WeakPolarHBondContact O-CG1 3.37Å; P78-I82 PolarHBondContact O-N 3.42Å; I79-I82 PolarHBondContact O-N 3.14Å; I82-A84 VanDerWaalsContact C-N 3.34Å; I82-A84 PolarHBondContact O-N 3.43Å; I82-E85 PolarHBondContact O-N 2.9Å; I82-F86 WeakPolarHBondContact O-CB 3.28Å; I82-F86 PolarHBondContact O-N 2.98Å
83A96.2Very high95.7Very high57 Ų5795.9 Ų95.947%0.47151%0.51SS..Hα-helixtrans-61.7-41.6177.800000112.1I79 A80 F81 F86 L87I79-A83 WeakPolarHBondContact O-CB 3.38Å; I79-A83 PolarHBondContact O-N 3.49Å; A80-A83 PolarHBondContact O-N 3.47Å; F81-A83 VanDerWaalsContact C-N 3.35Å; F81-A83 PolarHBondContact O-N 2.99Å; A83-F86 PolarHBondContact O-N 3.38Å; A83-L87 WeakPolarHBondContact O-CB 3.33Å; A83-L87 PolarHBondContact O-N 3.34Å
84A96.3Very high95.8Very high54 Ų5497.6 Ų97.645%0.44652%0.516SS..Hα-helixtrans-64.2-44.4176.800000112.1A80 F81 I82 L87 K88A80-A84 WeakPolarHBondContact O-CB 3.34Å; A80-A84 PolarHBondContact O-N 3.42Å; F81-A84 PolarHBondContact O-N 2.86Å; I82-A84 VanDerWaalsContact C-N 3.34Å; I82-A84 PolarHBondContact O-N 3.43Å; A84-L87 PolarHBondContact O-N 3.46Å; A84-K88 WeakPolarHBondContact O-CB 3.49Å; A84-K88 PolarHBondContact O-N 2.99Å
85E96.4Very high95.9Very high74 Ų7497.8 Ų97.835%0.34651%0.512SS..Hα-helixtrans-65.6-39.9177.4-75.7-63.4111.200112.1F81 I82 K88 K89F81-E85 HydrophobicContact CE1-CG 4.07Å; F81-E85 HydrophobicContact CE2-CG 4.37Å; F81-E85 HydrophobicContact CZ-CG 3.98Å; F81-E85 PolarHBondContact O-N 2.8Å; I82-E85 PolarHBondContact O-N 2.9Å; E85-K88 PolarHBondContact O-N 3.42Å; E85-K89 WeakPolarHBondContact O-CG 3.48Å; E85-K89 PolarHBondContact O-N 3.16Å
86F97.1Very high96Very high129 Ų12997.7 Ų97.757%0.56651%0.509SS*.Hα-helixtrans-63.4-45.6175.3-175.5-108000111.6I82 A83 K88 K89 L90I82-F86 WeakPolarHBondContact O-CB 3.28Å; I82-F86 PolarHBondContact O-N 2.98Å; A83-F86 PolarHBondContact O-N 3.38Å; F86-K88 VanDerWaalsContact C-N 3.29Å; F86-K88 PolarHBondContact O-N 2.9Å; F86-K89 WeakPolarHBondContact O-CB 2.91Å; F86-K89 PolarHBondContact O-N 3.22Å; F86-K89 VanDerWaalsContact O-N 3.16Å; F86-L90 HydrophobicContact CD1-CD1 3.9Å; F86-L90 HydrophobicContact CD1-CG 4.36Å; F86-L90 HydrophobicContact CE1-CD1 3.47Å; F86-L90 VanDerWaalsContact CE1-CD1 3.47Å; F86-L90 HydrophobicContact CE1-CD2 4.44Å; F86-L90 HydrophobicContact CE1-CG 4.03Å; F86-L90 HydrophobicContact CZ-CD1 4Å; F86-L90 HydrophobicContact CZ-CD2 4.13Å; F86-L90 HydrophobicContact CZ-CG 4.16Å; F86-L90 WeakPolarHBondContact O-CG 3.1Å; F86-L90 PolarHBondContact O-N 2.98Å
87L97Very high96.1Very high92 Ų9299.5 Ų99.548%0.48251%0.512SS..Hα-helixtrans-59.9-40.4175.8-178.961.9000111.9A83 A84 L90 K91A83-L87 WeakPolarHBondContact O-CB 3.33Å; A83-L87 PolarHBondContact O-N 3.34Å; A84-L87 PolarHBondContact O-N 3.46Å; L87-L90 PolarHBondContact O-N 3.27Å; L87-K91 WeakPolarHBondContact O-CG 3.3Å; L87-K91 PolarHBondContact O-N 3.27Å; L87-K91 VanDerWaalsContact O-N 3.07Å
88K96.8Very high96.3Very high135 Ų13599.8 Ų99.859%0.58751%0.514SS*.Hα-helixtrans-62.9-42176-176.8-178.6175.6-174.10111.9A84 E85 F86 K91 L92A84-K88 WeakPolarHBondContact O-CB 3.49Å; A84-K88 PolarHBondContact O-N 2.99Å; E85-K88 PolarHBondContact O-N 3.42Å; F86-K88 VanDerWaalsContact C-N 3.29Å; F86-K88 PolarHBondContact O-N 2.9Å; K88-K91 PolarHBondContact O-N 2.87Å; K88-L92 PolarHBondContact O-N 3.03Å; K88-L92 VanDerWaalsContact O-N 3.11Å
89K96.7Very high96.4Very high136 Ų136101.1 Ų101.159%0.59152%0.515SS*.Hα-helixtrans-62.6-45.9175.7-73.1178.7-177.9-172.70111.7E85 F86 K91 L92 T93E85-K89 WeakPolarHBondContact O-CG 3.48Å; E85-K89 PolarHBondContact O-N 3.16Å; F86-K89 WeakPolarHBondContact O-CB 2.91Å; F86-K89 PolarHBondContact O-N 3.22Å; F86-K89 VanDerWaalsContact O-N 3.16Å; K89-K91 PolarHBondContact O-N 3.38Å; K89-L92 PolarHBondContact O-N 2.99Å; K89-L92 VanDerWaalsContact O-N 3.17Å; K89-T93 PolarHBondContact O-N 3.43Å; K89-T93 PolarHBondContact O-OG1 3.47Å
90L97.3Very high96.5Very high88 Ų88101.1 Ų101.146%0.46151%0.513SS..Hα-helixtrans-58.4-47177.6-70.7179.1000112F86 L87 L92 T93 E94F86-L90 HydrophobicContact CD1-CD1 3.9Å; F86-L90 HydrophobicContact CD1-CG 4.36Å; F86-L90 HydrophobicContact CE1-CD1 3.47Å; F86-L90 VanDerWaalsContact CE1-CD1 3.47Å; F86-L90 HydrophobicContact CE1-CD2 4.44Å; F86-L90 HydrophobicContact CE1-CG 4.03Å; F86-L90 HydrophobicContact CZ-CD1 4Å; F86-L90 HydrophobicContact CZ-CD2 4.13Å; F86-L90 HydrophobicContact CZ-CG 4.16Å; F86-L90 WeakPolarHBondContact O-CG 3.1Å; F86-L90 PolarHBondContact O-N 2.98Å; L87-L90 PolarHBondContact O-N 3.27Å; L90-L92 VanDerWaalsContact C-N 3.28Å; L90-L92 PolarHBondContact O-N 3.38Å; L90-T93 PolarHBondContact O-N 3.41Å; L90-E94 WeakPolarHBondContact O-CB 3.49Å; L90-E94 PolarHBondContact O-N 3.21Å
91K96.8Very high96.5Very high129 Ų129103.9 Ų103.956%0.56152%0.518SS*.Hα-helixtrans-61.1-35.5177.1-74-176176.6-174.40113.1L87 K88 K89 K95L87-K91 WeakPolarHBondContact O-CG 3.3Å; L87-K91 PolarHBondContact O-N 3.27Å; L87-K91 VanDerWaalsContact O-N 3.07Å; K88-K91 PolarHBondContact O-N 2.87Å; K89-K91 PolarHBondContact O-N 3.38Å; K91-K95 WeakPolarHBondContact O-CB 3.48Å; K91-K95 PolarHBondContact O-N 2.88Å; K91-K95 VanDerWaalsContact O-N 3.1Å
92L96.9Very high96.5Very high99 Ų99101.1 Ų101.152%0.51852%0.515SS..Hα-helixtrans-68.3-44.2177-17763.3000111.2K88 K89 L90 K95 Q96K88-L92 PolarHBondContact O-N 3.03Å; K88-L92 VanDerWaalsContact O-N 3.11Å; K89-L92 PolarHBondContact O-N 2.99Å; K89-L92 VanDerWaalsContact O-N 3.17Å; L90-L92 VanDerWaalsContact C-N 3.28Å; L90-L92 PolarHBondContact O-N 3.38Å; L92-K95 PolarHBondContact O-N 3.35Å; L92-Q96 WeakPolarHBondContact O-CG 3.38Å; L92-Q96 PolarHBondContact O-N 2.97Å
93T96.6Very high96.5Very high65 Ų65102 Ų10240%0.39952%0.515SS..Hα-helixtrans-63.7-43.4176.9-59.20000111.7K89 L90 K95 Q96 Q97K89-T93 PolarHBondContact O-N 3.43Å; K89-T93 PolarHBondContact O-OG1 3.47Å; L90-T93 PolarHBondContact O-N 3.41Å; T93-K95 VanDerWaalsContact C-N 3.32Å; T93-K95 PolarHBondContact O-N 2.93Å; T93-Q96 PolarHBondContact O-N 3.45Å; T93-Q97 HydrophobicContact CG2-CG 4.5Å; T93-Q97 WeakPolarHBondContact O-CG 3.43Å; T93-Q97 PolarHBondContact O-N 3.17Å
94E96.1Very high96.5Very high130 Ų130103.8 Ų103.861%0.60752%0.516SS*.Hα-helixtrans-57.5-46175.1-178.7-173.2-169.200111.4L90 Q96 Q97 S98L90-E94 WeakPolarHBondContact O-CB 3.49Å; L90-E94 PolarHBondContact O-N 3.21Å; E94-Q96 PolarHBondContact O-N 2.82Å; E94-Q97 PolarHBondContact O-N 3.31Å; E94-S98 WeakPolarHBondContact O-CB 3.27Å; E94-S98 PolarHBondContact O-N 3.12Å
95K96Very high96.5Very high128 Ų128106.2 Ų106.256%0.55752%0.518SS*.Hα-helixtrans-61.3-43.9176.8-175.5178.6176.1-177.40112K91 L92 T93 S98 E99K91-K95 WeakPolarHBondContact O-CB 3.48Å; K91-K95 PolarHBondContact O-N 2.88Å; K91-K95 VanDerWaalsContact O-N 3.1Å; L92-K95 PolarHBondContact O-N 3.35Å; T93-K95 VanDerWaalsContact C-N 3.32Å; T93-K95 PolarHBondContact O-N 2.93Å; K95-S98 PolarHBondContact O-N 3.36Å; K95-E99 WeakPolarHBondContact CE-OE1 3.33Å; K95-E99 WeakPolarHBondContact O-CG 3.43Å; K95-E99 PolarHBondContact O-N 2.89Å
96Q96.6Very high96.4Very high106 Ų106106 Ų10650%0.49553%0.525SS..Hα-helixtrans-61.2-44.7177.6-73.5172-24.200111.7L92 T93 E94 E99 E100L92-Q96 WeakPolarHBondContact O-CG 3.38Å; L92-Q96 PolarHBondContact O-N 2.97Å; T93-Q96 PolarHBondContact O-N 3.45Å; E94-Q96 PolarHBondContact O-N 2.82Å; Q96-E99 PolarHBondContact O-N 2.86Å; Q96-E100 PolarHBondContact O-N 3.41Å
97Q96.6Very high96.2Very high111 Ų111105.9 Ų105.952%0.51953%0.526SS..Hα-helixtrans-64.4-41.3176.9-71.3177.3-35.300111.7T93 E94 E99 E100 I101T93-Q97 HydrophobicContact CG2-CG 4.5Å; T93-Q97 WeakPolarHBondContact O-CG 3.43Å; T93-Q97 PolarHBondContact O-N 3.17Å; E94-Q97 PolarHBondContact O-N 3.31Å; Q97-E99 VanDerWaalsContact C-N 3.34Å; Q97-E99 PolarHBondContact O-N 3.2Å; Q97-E100 PolarHBondContact O-N 2.98Å; Q97-I101 WeakPolarHBondContact O-CB 3.31Å; Q97-I101 VanDerWaalsContact O-CG1 3.26Å; Q97-I101 WeakPolarHBondContact O-CG1 3.33Å; Q97-I101 PolarHBondContact O-N 3.48Å
98S96.3Very high96.2Very high76 Ų76106.2 Ų106.253%0.53153%0.528SS..Hα-helixtrans-61.8-40.9175.8175.80000112.4E94 K95 S102E94-S98 WeakPolarHBondContact O-CB 3.27Å; E94-S98 PolarHBondContact O-N 3.12Å; K95-S98 PolarHBondContact O-N 3.36Å; S98-S102 WeakPolarHBondContact O-CB 3.25Å; S98-S102 PolarHBondContact O-N 3.03Å
99E96.2Very high96Very high90 Ų90102.4 Ų102.442%0.42152%0.516SS..Hα-helixtrans-66.3-39.7175.5-73.1174.8-167.700112.1K95 Q96 Q97 S102 K103K95-E99 WeakPolarHBondContact CE-OE1 3.33Å; K95-E99 WeakPolarHBondContact O-CG 3.43Å; K95-E99 PolarHBondContact O-N 2.89Å; Q96-E99 PolarHBondContact O-N 2.86Å; Q97-E99 VanDerWaalsContact C-N 3.34Å; Q97-E99 PolarHBondContact O-N 3.2Å; E99-S102 PolarHBondContact O-N 3.36Å; E99-K103 WeakPolarHBondContact O-CG 3.41Å; E99-K103 PolarHBondContact O-N 3.37Å
100E96.7Very high95.8Very high119 Ų11998.2 Ų98.256%0.55651%0.507SS*.Hα-helixtrans-65.7-44.3176.5-172.6174-170.200112Q96 Q97 S102 K103 L104Q96-E100 PolarHBondContact O-N 3.41Å; Q97-E100 PolarHBondContact O-N 2.98Å; E100-S102 VanDerWaalsContact C-N 3.3Å; E100-S102 PolarHBondContact O-N 3.44Å; E100-K103 PolarHBondContact O-N 3.23Å; E100-L104 HydrophobicContact CG-CD1 4.17Å; E100-L104 WeakPolarHBondContact O-CG 3.31Å; E100-L104 PolarHBondContact O-N 3.45Å
101I96.3Very high95.6Very high115 Ų11599.2 Ų99.259%0.5951%0.512SS*.Hα-helixtrans-59.2-43.2174.3-70.3166.2000110.4Q97 L104 H105Q97-I101 WeakPolarHBondContact O-CB 3.31Å; Q97-I101 VanDerWaalsContact O-CG1 3.26Å; Q97-I101 WeakPolarHBondContact O-CG1 3.33Å; Q97-I101 PolarHBondContact O-N 3.48Å; I101-L104 PolarHBondContact O-N 2.93Å; I101-H105 VanDerWaalsContact O-CB 3.27Å; I101-H105 WeakPolarHBondContact O-CB 3.36Å; I101-H105 PolarHBondContact O-N 2.99Å
102S95.5Very high95.3Very high77 Ų7798.1 Ų98.154%0.53851%0.509SS..Hα-helixtrans-62.3-43.4177.8-1760000112.2S98 E99 E100 H105 S106S98-S102 WeakPolarHBondContact O-CB 3.25Å; S98-S102 PolarHBondContact O-N 3.03Å; E99-S102 PolarHBondContact O-N 3.36Å; E100-S102 VanDerWaalsContact C-N 3.3Å; E100-S102 PolarHBondContact O-N 3.44Å; S102-H105 PolarHBondContact O-N 3.12Å; S102-S106 PolarHBondContact O-N 2.88Å
103K96.4Very high95Very high132 Ų13297.8 Ų97.857%0.57451%0.507SS*.Hα-helixtrans-60.1-51.1174.4-72.9173-175.4172.60111.7E99 E100 H105 S106 Q107E99-K103 WeakPolarHBondContact O-CG 3.41Å; E99-K103 PolarHBondContact O-N 3.37Å; E100-K103 PolarHBondContact O-N 3.23Å; K103-H105 VanDerWaalsContact C-N 3.3Å; K103-H105 PolarHBondContact O-N 3.11Å; K103-S106 PolarHBondContact O-N 2.93Å; K103-S106 PolarHBondContact O-OG 3.46Å; K103-Q107 WeakPolarHBondContact O-CG 3.28Å; K103-Q107 PolarHBondContact O-N 3.47Å
104L96.5Very high94.7Very high95 Ų9598.8 Ų98.850%0.49751%0.508SS..Hα-helixtrans-60-41.2178-74164.9000111.8E100 I101 Q107 L108E100-L104 HydrophobicContact CG-CD1 4.17Å; E100-L104 WeakPolarHBondContact O-CG 3.31Å; E100-L104 PolarHBondContact O-N 3.45Å; I101-L104 PolarHBondContact O-N 2.93Å; L104-Q107 PolarHBondContact O-N 3.47Å; L104-L108 WeakPolarHBondContact O-CB 2.98Å; L104-L108 PolarHBondContact O-N 3.48Å
105H95.5Very high94.4Very high105 Ų10594.6 Ų94.649%0.48649%0.493SS..Hα-helixtrans-61.5-46.4176.5-176.368.6000111.6I101 S102 K103 Q107 L108 V109I101-H105 VanDerWaalsContact O-CB 3.27Å; I101-H105 WeakPolarHBondContact O-CB 3.36Å; I101-H105 PolarHBondContact O-N 2.99Å; S102-H105 PolarHBondContact O-N 3.12Å; K103-H105 VanDerWaalsContact C-N 3.3Å; K103-H105 PolarHBondContact O-N 3.11Å; H105-Q107 VanDerWaalsContact C-N 3.31Å; H105-Q107 PolarHBondContact O-N 3.48Å; H105-L108 PolarHBondContact O-N 3.43Å; H105-V109 WeakPolarHBondContact O-CG2 3.47Å; H105-V109 PolarHBondContact O-N 3.17Å
106S94Very high94Very high70 Ų7093.9 Ų93.949%0.4949%0.492SS..Hα-helixtrans-60.5-37.917569.70000113.4S102 K103 A110S102-S106 PolarHBondContact O-N 2.88Å; K103-S106 PolarHBondContact O-N 2.93Å; K103-S106 PolarHBondContact O-OG 3.46Å; S106-A110 WeakPolarHBondContact O-CB 3.5Å; S106-A110 PolarHBondContact O-N 2.92Å
107Q94.7Very high93.6Very high126 Ų12692.5 Ų92.559%0.58949%0.488SS*.Hα-helixtrans-67.3-42.2175.9-72.4176.8-5.300111.6K103 L104 H105 A110 L111K103-Q107 WeakPolarHBondContact O-CG 3.28Å; K103-Q107 PolarHBondContact O-N 3.47Å; L104-Q107 PolarHBondContact O-N 3.47Å; H105-Q107 VanDerWaalsContact C-N 3.31Å; H105-Q107 PolarHBondContact O-N 3.48Å; Q107-A110 PolarHBondContact O-N 2.79Å; Q107-L111 WeakPolarHBondContact O-CB 3.33Å; Q107-L111 PolarHBondContact O-N 3.01Å
108L95.1Very high93.1Very high99 Ų9995.2 Ų95.252%0.51849%0.494SS..Hα-helixtrans-61.2-47.4176.5-173.8156.6000110.9L104 H105 A110 L111 Q112L104-L108 WeakPolarHBondContact O-CB 2.98Å; L104-L108 PolarHBondContact O-N 3.48Å; H105-L108 PolarHBondContact O-N 3.43Å; L108-A110 VanDerWaalsContact C-N 3.35Å; L108-A110 PolarHBondContact O-N 3.05Å; L108-L111 PolarHBondContact O-N 2.97Å; L108-Q112 WeakPolarHBondContact O-CB 3.42Å; L108-Q112 PolarHBondContact O-N 3.06Å
109V93.6Very high92.6Very high54 Ų5493.8 Ų93.833%0.32749%0.487SS..Hα-helixtrans-62-42.3177.3172.40000111.2H105 L111 Q112 I113H105-V109 WeakPolarHBondContact O-CG2 3.47Å; H105-V109 PolarHBondContact O-N 3.17Å; V109-L111 PolarHBondContact O-N 2.92Å; V109-Q112 PolarHBondContact O-N 3.3Å; V109-I113 HydrophobicContact CG1-CD1 4.07Å; V109-I113 VanDerWaalsContact O-CG1 3.31Å; V109-I113 WeakPolarHBondContact O-CG1 3.38Å; V109-I113 PolarHBondContact O-N 3.48Å
110A92.3Very high92Very high49 Ų4994.1 Ų94.141%0.40549%0.488SS..Hα-helixtrans-61.3-44.1176.200000111.9S106 Q107 L108 I113 I114S106-A110 WeakPolarHBondContact O-CB 3.5Å; S106-A110 PolarHBondContact O-N 2.92Å; Q107-A110 PolarHBondContact O-N 2.79Å; L108-A110 VanDerWaalsContact C-N 3.35Å; L108-A110 PolarHBondContact O-N 3.05Å; A110-I113 PolarHBondContact O-N 2.96Å; A110-I114 WeakPolarHBondContact O-CG1 3.3Å; A110-I114 PolarHBondContact O-N 2.89Å; A110-I114 VanDerWaalsContact O-N 3.11Å
111L92.5Very high91.3Very high108 Ų10893 Ų9357%0.56549%0.485SS*.Hα-helixtrans-64.4-42.1176.9-174.961.2000111.6Q107 L108 V109 I113 I114 C115Q107-L111 WeakPolarHBondContact O-CB 3.33Å; Q107-L111 PolarHBondContact O-N 3.01Å; L108-L111 PolarHBondContact O-N 2.97Å; V109-L111 PolarHBondContact O-N 2.92Å; L111-I113 VanDerWaalsContact C-N 3.31Å; L111-I113 PolarHBondContact O-N 3.29Å; L111-I114 WeakPolarHBondContact O-CB 3.39Å; L111-I114 PolarHBondContact O-N 3.26Å; L111-I114 VanDerWaalsContact O-N 3.11Å; L111-C115 PolarHBondContact O-N 3.5Å; L111-C115 PolarHBondContact O-SG 2.97Å
112Q91.6Very high90.4Very high107 Ų10790.2 Ų90.250%0.548%0.479SS..Hα-helixtrans-59-41175.9-176176.8-0.600112.1L108 V109 C115 Q116L108-Q112 WeakPolarHBondContact O-CB 3.42Å; L108-Q112 PolarHBondContact O-N 3.06Å; V109-Q112 PolarHBondContact O-N 3.3Å; Q112-C115 PolarHBondContact O-N 3.33Å; Q112-Q116 WeakPolarHBondContact O-CB 3.32Å; Q112-Q116 PolarHBondContact O-N 3.45Å
113I90.7Very high89.6Confident92 Ų9291.7 Ų91.747%0.47248%0.484SS..Hα-helixtrans-63.7-42.1175-67.5164.3000110.9V109 A110 L111 Q116 N117V109-I113 HydrophobicContact CG1-CD1 4.07Å; V109-I113 VanDerWaalsContact O-CG1 3.31Å; V109-I113 WeakPolarHBondContact O-CG1 3.38Å; V109-I113 PolarHBondContact O-N 3.48Å; A110-I113 PolarHBondContact O-N 2.96Å; L111-I113 VanDerWaalsContact C-N 3.31Å; L111-I113 PolarHBondContact O-N 3.29Å; I113-Q116 PolarHBondContact O-N 3.47Å; I113-N117 WeakPolarHBondContact O-CB 3.48Å; I113-N117 PolarHBondContact O-N 3.39Å; I113-N117 PolarHBondContact O-ND2 3.41Å
114I90.6Very high88.5Confident85 Ų8592.6 Ų92.644%0.43649%0.49SS..Hα-helixtrans-61.7-51.9177.6-67.9166.3000110.1A110 L111 Q116 N117 Y118A110-I114 WeakPolarHBondContact O-CG1 3.3Å; A110-I114 PolarHBondContact O-N 2.89Å; A110-I114 VanDerWaalsContact O-N 3.11Å; L111-I114 WeakPolarHBondContact O-CB 3.39Å; L111-I114 PolarHBondContact O-N 3.26Å; L111-I114 VanDerWaalsContact O-N 3.11Å; I114-Q116 VanDerWaalsContact C-N 3.31Å; I114-Q116 PolarHBondContact O-N 3Å; I114-N117 PolarHBondContact O-N 2.93Å; I114-Y118 HydrophobicContact CG2-CD2 3.64Å; I114-Y118 HydrophobicContact CG2-CE2 3.7Å; I114-Y118 WeakPolarHBondContact O-CD2 3.23Å; I114-Y118 PolarHBondContact O-N 3.28Å
115C88.7Confident87.3Confident42 Ų4295.6 Ų95.628%0.28450%0.499SS..Hα-helixtrans-54.8-46.3176.9-72.20000111.8L111 Q112 N117 Y118 A119 E143L111-C115 PolarHBondContact O-N 3.5Å; L111-C115 PolarHBondContact O-SG 2.97Å; Q112-C115 PolarHBondContact O-N 3.33Å; C115-N117 PolarHBondContact O-N 3.4Å; C115-Y118 PolarHBondContact O-N 2.69Å; C115-A119 WeakPolarHBondContact O-CB 3.24Å; C115-A119 PolarHBondContact O-N 3.06Å; C115-E143 VanDerWaalsContact CB-OE1 3.25Å; C115-E143 WeakPolarHBondContact CB-OE1 3.34Å; C115-E143 PolarHBondContact SG-OE1 3.23Å
116Q88.5Confident85.6Confident113 Ų11395.1 Ų95.153%0.52850%0.5SS..Hα-helixtrans-61.7-43.8177.8-174.469.4-4.800112.3Q112 I113 I114 A119 Q120Q112-Q116 WeakPolarHBondContact O-CB 3.32Å; Q112-Q116 PolarHBondContact O-N 3.45Å; I113-Q116 PolarHBondContact O-N 3.47Å; I114-Q116 VanDerWaalsContact C-N 3.31Å; I114-Q116 PolarHBondContact O-N 3Å; Q116-A119 PolarHBondContact O-N 3.23Å; Q116-Q120 WeakPolarHBondContact O-CG 3.37Å; Q116-Q120 PolarHBondContact O-N 3.33Å
117N87.6Confident83.8Confident77 Ų7797.4 Ų97.441%0.41251%0.514SS..Hα-helixtrans-63.9-42.5177-70.9-20000111.6I113 I114 C115 Q120 M121I113-N117 WeakPolarHBondContact O-CB 3.48Å; I113-N117 PolarHBondContact O-N 3.39Å; I113-N117 PolarHBondContact O-ND2 3.41Å; I114-N117 PolarHBondContact O-N 2.93Å; C115-N117 PolarHBondContact O-N 3.4Å; N117-Q120 PolarHBondContact O-N 2.97Å; N117-M121 VanDerWaalsContact O-CG 3.32Å; N117-M121 WeakPolarHBondContact O-CG 3.4Å; N117-M121 PolarHBondContact O-N 2.87Å
118Y87.1Confident81.8Confident169 Ų16995.9 Ų95.966%0.66352%0.517SS*.Hα-helixtrans-62.7-42.9175.8-91.7-81.9000112I114 C115 Q120 M121 A122I114-Y118 HydrophobicContact CG2-CD2 3.64Å; I114-Y118 HydrophobicContact CG2-CE2 3.7Å; I114-Y118 WeakPolarHBondContact O-CD2 3.23Å; I114-Y118 PolarHBondContact O-N 3.28Å; C115-Y118 PolarHBondContact O-N 2.69Å; Y118-Q120 PolarHBondContact O-N 2.99Å; Y118-M121 PolarHBondContact O-N 3.21Å; Y118-A122 WeakPolarHBondContact O-CB 3.38Å; Y118-A122 PolarHBondContact O-N 3.42Å
119A83.9Confident79.6Confident45 Ų4596 Ų9637%0.37251%0.513SS..Hα-helixtrans-60.4-44.5175.600000111.7C115 Q116 A122 V123C115-A119 WeakPolarHBondContact O-CB 3.24Å; C115-A119 PolarHBondContact O-N 3.06Å; Q116-A119 PolarHBondContact O-N 3.23Å; A119-A122 PolarHBondContact O-N 2.95Å; A119-V123 WeakPolarHBondContact O-CG2 3.33Å; A119-V123 PolarHBondContact O-N 3.19Å
120Q84.7Confident77.4Confident97 Ų97101.3 Ų101.345%0.45354%0.54SS..Hα-helixtrans-63.8-43.4177-72.7179.4-12.900112.7Q116 N117 Y118 A122 V123 Q124Q116-Q120 WeakPolarHBondContact O-CG 3.37Å; Q116-Q120 PolarHBondContact O-N 3.33Å; N117-Q120 PolarHBondContact O-N 2.97Å; Y118-Q120 PolarHBondContact O-N 2.99Å; Q120-A122 VanDerWaalsContact C-N 3.32Å; Q120-A122 PolarHBondContact O-N 3.38Å; Q120-V123 PolarHBondContact O-N 3.32Å; Q120-Q124 WeakPolarHBondContact O-CG 3.33Å; Q120-Q124 PolarHBondContact O-N 2.87Å
121M82.6Confident75.2Confident97 Ų97104.6 Ų104.648%0.47856%0.555SS.*Hα-helixtrans-64.2-35.4177.1-71.3-179.873.200112.6N117 Y118 K125N117-M121 VanDerWaalsContact O-CG 3.32Å; N117-M121 WeakPolarHBondContact O-CG 3.4Å; N117-M121 PolarHBondContact O-N 2.87Å; Y118-M121 PolarHBondContact O-N 3.21Å; M121-K125 WeakPolarHBondContact O-CB 3.46Å; M121-K125 WeakPolarHBondContact O-CG 3.39Å; M121-K125 PolarHBondContact O-N 3.26Å
122A77.5Confident72.7Confident56 Ų56106 Ų10646%0.46356%0.562SS.*Hα-helixtrans-65.1-43176.600000111.9Y118 A119 Q120 N126Y118-A122 WeakPolarHBondContact O-CB 3.38Å; Y118-A122 PolarHBondContact O-N 3.42Å; A119-A122 PolarHBondContact O-N 2.95Å; Q120-A122 VanDerWaalsContact C-N 3.32Å; Q120-A122 PolarHBondContact O-N 3.38Å; A122-N126 PolarHBondContact O-N 2.96Å
123V77.2Confident70.3Confident108 Ų108108.7 Ų108.766%0.65558%0.575SS**Hα-helixtrans-66.1-42.4175.9175.70000111.3A119 Q120 N126A119-V123 WeakPolarHBondContact O-CG2 3.33Å; A119-V123 PolarHBondContact O-N 3.19Å; Q120-V123 PolarHBondContact O-N 3.32Å; V123-N126 CarbonylContact O-C 3.43Å; V123-N126 PolarHBondContact O-N 3.42Å
124Q74.8Confident68.4Low151 Ų151110.2 Ų110.271%0.70659%0.589SS**Hα-helixtrans-67.4-38.1-179.7-74177.32.800113.6Q120 N126Q120-Q124 WeakPolarHBondContact O-CG 3.33Å; Q120-Q124 PolarHBondContact O-N 2.87Å; Q124-N126 VanDerWaalsContact C-N 3.35Å
125K70.8Confident66.3Low158 Ų158113.2 Ų113.269%0.68761%0.605SS**Hα-helixtrans-73.1-26.5179.5-77.8-175.8178-177.80113.2M121M121-K125 WeakPolarHBondContact O-CB 3.46Å; M121-K125 WeakPolarHBondContact O-CG 3.39Å; M121-K125 PolarHBondContact O-N 3.26Å
126N59.5Low64.4Low94 Ų94114.9 Ų114.950%0.50362%0.615SS.*  trans-125.777.4-177.8-66.2-42000111.1A122 V123 Q124 S128 F129A122-N126 PolarHBondContact O-N 2.96Å; V123-N126 CarbonylContact O-C 3.43Å; V123-N126 PolarHBondContact O-N 3.42Å; Q124-N126 VanDerWaalsContact C-N 3.35Å; N126-S128 PolarHBondContact O-N 3.48Å; N126-F129 HydrophobicContact CB-CB 4.32Å; N126-F129 WeakPolarHBondContact O-CB 3.39Å; N126-F129 PolarHBondContact O-N 2.86Å
127P55.5Low62.6Low119 Ų119112 Ų11277%0.77361%0.61SS**THydrogen-bonded Turntrans-66.3-14.6172.226.6-32.9000113.1
128S52.4Low60.7Low93 Ų93111.9 Ų111.965%0.6561%0.613SS**THydrogen-bonded Turntrans-95.323.1176.6-47.30000113.9N126 D130 T131N126-S128 PolarHBondContact O-N 3.48Å; S128-D130 PolarHBondContact O-N 3.49Å; S128-D130 VanDerWaalsContact O-N 3.09Å; S128-T131 PolarHBondContact O-N 2.94Å; S128-T131 PolarHBondContact O-OG1 3.13Å
129F50.6Low59Low101 Ų101112.1 Ų112.144%0.44361%0.614SS.*G310 helixtrans-66.8-5.5-175.7-169.3-104.3000114.9N126 T131 L140N126-F129 HydrophobicContact CB-CB 4.32Å; N126-F129 WeakPolarHBondContact O-CB 3.39Å; N126-F129 PolarHBondContact O-N 2.86Å; F129-T131 PolarHBondContact O-N 2.78Å; F129-L140 HydrophobicContact CE1-CD1 4.23Å; F129-L140 HydrophobicContact CZ-CD1 4.11Å
130D46.4Very low57.5Low167 Ų167114 Ų11489%0.89362%0.618SS**G310 helixtrans-66.5-10.9172.4-88.4-16.6000114.1S128S128-D130 PolarHBondContact O-N 3.49Å; S128-D130 VanDerWaalsContact O-N 3.09Å
131T45.4Very low55.9Low118 Ų118116.3 Ų116.372%0.72463%0.627SS**G310 helixtrans-112.99.8-176.657.50000115.9S128 F129S128-T131 PolarHBondContact O-N 2.94Å; S128-T131 PolarHBondContact O-OG1 3.13Å; F129-T131 PolarHBondContact O-N 2.78Å
132L41Very low54.6Low136 Ų136119 Ų11971%0.71264%0.636SS**  trans-10574.1171.5-100.6141.4000110.7
133E40.7Very low53.6Low165 Ų165120.8 Ų120.877%0.77163%0.634SS**  trans-52.2134.8158.8-75-175.2148.400111.1
134T50.9Low52.8Low124 Ų124121.9 Ų121.976%0.76164%0.636SS**SBendtrans103.6-12.1138.652.60000124.9
135D46.9Very low52Low147 Ų147118.7 Ų118.779%0.78663%0.626SS**SBendtrans-128.8-8178.1-96.4-24.3000119
136T47.9Very low51.7Low78 Ų78113.7 Ų113.748%0.47961%0.609SS.*SBendtrans-114.41.117853.40000114.8P138 Y139 L140T136-P138 VanDerWaalsContact C-N 3.29Å; T136-Y139 PolarHBondContact O-N 2.78Å; T136-L140 PolarHBondContact O-N 2.8Å
137A51.7Low51.9Low53 Ų53111.8 Ų111.844%0.43860%0.602SS.*Hα-helixtrans-50.8-33.4170.400000115.6Y139 K141A137-Y139 VanDerWaalsContact C-N 3.32Å; A137-Y139 PolarHBondContact O-N 2.83Å; A137-K141 WeakPolarHBondContact O-CB 3.44Å; A137-K141 WeakPolarHBondContact O-CG 3.39Å; A137-K141 PolarHBondContact O-N 3.45Å; A137-K141 VanDerWaalsContact O-N 3.08Å
138P47.1Very low52.4Low73 Ų73112.7 Ų112.747%0.47459%0.594SS.*Hα-helixtrans-66.8-31.2174.822.8-32.2000113.1T136 F142T136-P138 VanDerWaalsContact C-N 3.29Å; P138-F142 WeakPolarHBondContact O-CB 3.48Å; P138-F142 PolarHBondContact O-N 3.05Å
139Y51.2Low53.4Low174 Ų174112 Ų11268%0.68259%0.585SS**Hα-helixtrans-71.7-44.7179.6-76.7-86.4000111.8T136 A137 F142 E143T136-Y139 PolarHBondContact O-N 2.78Å; A137-Y139 VanDerWaalsContact C-N 3.32Å; A137-Y139 PolarHBondContact O-N 2.83Å; Y139-F142 PolarHBondContact O-N 3.47Å; Y139-E143 WeakPolarHBondContact O-CB 3.36Å; Y139-E143 PolarHBondContact O-N 2.76Å
140L53Low54.2Low86 Ų86113.4 Ų113.445%0.4559%0.592SS.*Hα-helixtrans-67.6-35.2176-80.7155000112.5F129 T136 E143 L144F129-L140 HydrophobicContact CE1-CD1 4.23Å; F129-L140 HydrophobicContact CZ-CD1 4.11Å; T136-L140 PolarHBondContact O-N 2.8Å; L140-E143 PolarHBondContact O-N 3.15Å; L140-L144 WeakPolarHBondContact O-CB 3.35Å; L140-L144 PolarHBondContact O-N 2.88Å
141K51.5Low55.5Low145 Ų145109.9 Ų109.963%0.6357%0.573SS**Hα-helixtrans-66.5-40.6172.1-78176.5179.6177.50111.5A137 V145A137-K141 WeakPolarHBondContact O-CB 3.44Å; A137-K141 WeakPolarHBondContact O-CG 3.39Å; A137-K141 PolarHBondContact O-N 3.45Å; A137-K141 VanDerWaalsContact O-N 3.08Å; K141-V145 WeakPolarHBondContact O-CB 3.3Å; K141-V145 WeakPolarHBondContact O-CG2 3.32Å; K141-V145 PolarHBondContact O-N 2.75Å
142F54Low56.9Low152 Ų152109 Ų10967%0.66756%0.564SS**Hα-helixtrans-62-46.9172.4-106.6-93.5000111P138 Y139 L144 V145 V146P138-F142 WeakPolarHBondContact O-CB 3.48Å; P138-F142 PolarHBondContact O-N 3.05Å; Y139-F142 PolarHBondContact O-N 3.47Å; F142-L144 VanDerWaalsContact C-N 3.33Å; F142-L144 PolarHBondContact O-N 3.45Å; F142-V145 PolarHBondContact O-N 3.26Å; F142-V146 HydrophobicContact CD1-CG2 3.77Å; F142-V146 HydrophobicContact CE1-CG2 4.4Å; F142-V146 WeakPolarHBondContact O-CB 3.45Å; F142-V146 WeakPolarHBondContact O-CG2 3.41Å; F142-V146 PolarHBondContact O-N 2.92Å
143E57.4Low58.4Low94 Ų94106 Ų10644%0.43955%0.551SS.*Hα-helixtrans-63.6-32.7-179-153.890.6-154.700113.3C115 Y139 L140 P147C115-E143 VanDerWaalsContact CB-OE1 3.25Å; C115-E143 WeakPolarHBondContact CB-OE1 3.34Å; C115-E143 PolarHBondContact SG-OE1 3.23Å; Y139-E143 WeakPolarHBondContact O-CB 3.36Å; Y139-E143 PolarHBondContact O-N 2.76Å; L140-E143 PolarHBondContact O-N 3.15Å; E143-P147 WeakPolarHBondContact O-CD 3.28Å; E143-P147 WeakPolarHBondContact O-CG 3.38Å
144L59.3Low59.8Low132 Ų132105 Ų10569%0.69154%0.541SS*.Hα-helixtrans-86.9-36.3177.7-108.8123.7000113.6L140 F142L140-L144 WeakPolarHBondContact O-CB 3.35Å; L140-L144 PolarHBondContact O-N 2.88Å; F142-L144 VanDerWaalsContact C-N 3.33Å; F142-L144 PolarHBondContact O-N 3.45Å
145V59.7Low60.8Low83 Ų83104.5 Ų104.550%0.50353%0.53SS..Hα-helixtrans-76.3-38-178173.40000110.6K141 F142 K148 V149K141-V145 WeakPolarHBondContact O-CB 3.3Å; K141-V145 WeakPolarHBondContact O-CG2 3.32Å; K141-V145 PolarHBondContact O-N 2.75Å; F142-V145 PolarHBondContact O-N 3.26Å; V145-K148 PolarHBondContact O-N 3.41Å; V145-V149 HydrophobicContact CG1-CG2 3.78Å; V145-V149 VanDerWaalsContact O-CG2 3.29Å; V145-V149 WeakPolarHBondContact O-CG2 3.31Å; V145-V149 PolarHBondContact O-N 3.27Å
146V62.9Low62.2Low53 Ų53101.5 Ų101.532%0.32152%0.52SS..Hα-helixtrans-61.8-49.8-175.21710000112.2F142 K148 V149 F150F142-V146 HydrophobicContact CD1-CG2 3.77Å; F142-V146 HydrophobicContact CE1-CG2 4.4Å; F142-V146 WeakPolarHBondContact O-CB 3.45Å; F142-V146 WeakPolarHBondContact O-CG2 3.41Å; F142-V146 PolarHBondContact O-N 2.92Å; V146-K148 VanDerWaalsContact C-N 3.33Å; V146-K148 PolarHBondContact O-N 3.27Å; V146-V149 PolarHBondContact O-N 3.46Å; V146-F150 HydrophobicContact CG1-CD2 3.45Å; V146-F150 VanDerWaalsContact CG1-CD2 3.45Å; V146-F150 HydrophobicContact CG1-CE2 3.27Å; V146-F150 WeakPolarHBondContact O-CB 3.44Å; V146-F150 WeakPolarHBondContact O-CD2 3.34Å; V146-F150 PolarHBondContact O-N 3.47Å
147P63.8Low63.2Low55 Ų55106 Ų10636%0.35753%0.534SS..Hα-helixtrans-59.3-42.5175.2-23.833.9000112.5E143 V149 F150 D151E143-P147 WeakPolarHBondContact O-CD 3.28Å; E143-P147 WeakPolarHBondContact O-CG 3.38Å; P147-V149 PolarHBondContact O-N 2.83Å; P147-F150 PolarHBondContact O-N 3.17Å; P147-D151 WeakPolarHBondContact O-CB 3.12Å; P147-D151 VanDerWaalsContact O-CG 3.31Å; P147-D151 PolarHBondContact O-N 2.84Å
148K67.4Low63.5Low138 Ų138108.6 Ų108.660%0.654%0.539SS*.Hα-helixtrans-65.2-42.3-179.3-168.4176.4-179.7179.60112.4V145 V146 F150 D151 D152V145-K148 PolarHBondContact O-N 3.41Å; V146-K148 VanDerWaalsContact C-N 3.33Å; V146-K148 PolarHBondContact O-N 3.27Å; K148-F150 VanDerWaalsContact C-N 3.31Å; K148-F150 PolarHBondContact O-N 2.88Å; K148-D151 PolarHBondContact O-N 3.11Å; K148-D152 WeakPolarHBondContact O-CB 3.44Å; K148-D152 PolarHBondContact O-N 3.28Å
149V71.8Confident63.5Low78 Ų78115.8 Ų115.847%0.47357%0.566SS.*Hα-helixtrans-64.5-38.7175172.90000110.6V145 V146 P147 V153V145-V149 HydrophobicContact CG1-CG2 3.78Å; V145-V149 VanDerWaalsContact O-CG2 3.29Å; V145-V149 WeakPolarHBondContact O-CG2 3.31Å; V145-V149 PolarHBondContact O-N 3.27Å; V146-V149 PolarHBondContact O-N 3.46Å; P147-V149 PolarHBondContact O-N 2.83Å; V149-V153 HydrophobicContact CG1-CG2 4.48Å; V149-V153 WeakPolarHBondContact O-CB 3.26Å; V149-V153 WeakPolarHBondContact O-CG2 3.14Å; V149-V153 PolarHBondContact O-N 2.85Å
150F67.3Low64.1Low130 Ų130112.9 Ų112.957%0.5756%0.56SS**Hα-helixtrans-68.1-41.7176.4-80.9-61.2000112.8V146 P147 K148 V153 Y154V146-F150 HydrophobicContact CG1-CD2 3.45Å; V146-F150 VanDerWaalsContact CG1-CD2 3.45Å; V146-F150 HydrophobicContact CG1-CE2 3.27Å; V146-F150 WeakPolarHBondContact O-CB 3.44Å; V146-F150 WeakPolarHBondContact O-CD2 3.34Å; V146-F150 PolarHBondContact O-N 3.47Å; P147-F150 PolarHBondContact O-N 3.17Å; K148-F150 VanDerWaalsContact C-N 3.31Å; K148-F150 PolarHBondContact O-N 2.88Å; F150-V153 PolarHBondContact O-N 3.28Å; F150-Y154 WeakPolarHBondContact O-CB 3.3Å; F150-Y154 PolarHBondContact O-N 2.65Å
151D73.8Confident64.7Low94 Ų94114.3 Ų114.350%0.50357%0.566SS.*Hα-helixtrans-62.8-45.1175.4-73-23.7000110.9P147 K148 V153 Y154 Q155P147-D151 WeakPolarHBondContact O-CB 3.12Å; P147-D151 VanDerWaalsContact O-CG 3.31Å; P147-D151 PolarHBondContact O-N 2.84Å; K148-D151 PolarHBondContact O-N 3.11Å; D151-V153 PolarHBondContact O-N 3.11Å; D151-Y154 PolarHBondContact O-N 3.42Å; D151-Q155 VanDerWaalsContact O-CG 3.31Å; D151-Q155 WeakPolarHBondContact O-CG 3.39Å; D151-Q155 PolarHBondContact O-N 2.8Å
152D75Confident65.4Low99 Ų99112.6 Ų112.653%0.52956%0.562SS.*Hα-helixtrans-62.2-42177.6-71.3-19.4000111.7K148 Q155 S156K148-D152 WeakPolarHBondContact O-CB 3.44Å; K148-D152 PolarHBondContact O-N 3.28Å; D152-Q155 PolarHBondContact O-N 2.88Å; D152-S156 WeakPolarHBondContact O-CB 2.95Å; D152-S156 PolarHBondContact O-N 2.99Å
153V73.6Confident66.1Low73 Ų73110.2 Ų110.244%0.44256%0.556SS.*Hα-helixtrans-68.1-33.7176.1170.70000112.1V149 F150 D151 S156V149-V153 HydrophobicContact CG1-CG2 4.48Å; V149-V153 WeakPolarHBondContact O-CB 3.26Å; V149-V153 WeakPolarHBondContact O-CG2 3.14Å; V149-V153 PolarHBondContact O-N 2.85Å; F150-V153 PolarHBondContact O-N 3.28Å; D151-V153 PolarHBondContact O-N 3.11Å; V153-S156 PolarHBondContact O-OG 2.93Å
154Y69.9Low66.6Low144 Ų144111.3 Ų111.357%0.56556%0.564SS**Hα-helixtrans-69.6-46.6175.8-172.6-98.7000110.9F150 D151 S156 K157 L158F150-Y154 WeakPolarHBondContact O-CB 3.3Å; F150-Y154 PolarHBondContact O-N 2.65Å; D151-Y154 PolarHBondContact O-N 3.42Å; Y154-S156 VanDerWaalsContact C-N 3.34Å; Y154-S156 PolarHBondContact O-N 2.7Å; Y154-K157 PolarHBondContact O-N 3.12Å; Y154-L158 HydrophobicContact CD1-CD1 3.68Å; Y154-L158 HydrophobicContact CE1-CD1 3.31Å
155Q72.8Confident67.1Low114 Ų114109.9 Ų109.953%0.53356%0.555SS.*Hα-helixtrans-64.6-35.5177.4-66.4-60.6-26.300112.4D151 D152 K157 L158D151-Q155 VanDerWaalsContact O-CG 3.31Å; D151-Q155 WeakPolarHBondContact O-CG 3.39Å; D151-Q155 PolarHBondContact O-N 2.8Å; D152-Q155 PolarHBondContact O-N 2.88Å; Q155-K157 PolarHBondContact O-N 2.8Å; Q155-L158 PolarHBondContact O-N 3.23Å
156S75.8Confident67.6Low83 Ų83111.8 Ų111.858%0.5856%0.559SS**THydrogen-bonded Turntrans-68.9-17.6-18083.20000114.4D152 V153 Y154D152-S156 WeakPolarHBondContact O-CB 2.95Å; D152-S156 PolarHBondContact O-N 2.99Å; V153-S156 PolarHBondContact O-OG 2.93Å; Y154-S156 VanDerWaalsContact C-N 3.34Å; Y154-S156 PolarHBondContact O-N 2.7Å
157K67.4Low68Low174 Ų174116.3 Ų116.376%0.75758%0.577SS**THydrogen-bonded Turntrans-99.2-5.4179.4-73.7-171.8178.6-174.40113.9Y154 Q155 H159Y154-K157 PolarHBondContact O-N 3.12Å; Q155-K157 PolarHBondContact O-N 2.8Å; K157-H159 VanDerWaalsContact C-N 3.34Å
158L58.8Low68.4Low107 Ų107121.4 Ų121.456%0.5660%0.595SS**  trans-86.3-5.5177.3-101.2141.8000113.2Y154 Q155Y154-L158 HydrophobicContact CD1-CD1 3.68Å; Y154-L158 HydrophobicContact CE1-CD1 3.31Å; Q155-L158 PolarHBondContact O-N 3.23Å
159H46.8Very low68.4Low223 Ų223119.9 Ų119.9100%1.03260%0.595SS**  trans-117.40172-68.2-66.3000110.5K157K157-H159 VanDerWaalsContact C-N 3.34Å

Retrieved 159 of 159 residues in 72.9 ms (Link to these results)