G4VM07_SCHMA Loading...

Putative organic solute transporter

AlphaFold DB , UniProt , Accession G4VM07, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 414 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
1M41.2Very low47.7Very low246 Ų246126.5 Ų126.5100%1.21267%0.667SS**  080.30-147.6173.6-141.200107
2T41.3Very low48.1Very low134 Ų134125.4 Ų125.482%0.82266%0.661SS**  trans-100.6103.6-177.240.60000108
3L40.3Very low48.8Very low124 Ų124124.1 Ų124.165%0.64965%0.654SS**  trans171107.2148.2-93.1152.9000109.1E6L3-E6 HydrophobicContact CD2-CB 4.48Å; L3-E6 HydrophobicContact CD2-CG 4.11Å
4P51.3Low49.2Very low104 Ų104122.3 Ų122.368%0.67565%0.645SS**  trans-126.83.914519.6-0.4000113.9E6P4-E6 PolarHBondContact O-N 3.46Å
5Y52Low49.7Very low198 Ų198121.5 Ų121.578%0.77664%0.642SS**Hα-helixtrans-73.2-28.8-174.4-155.8-98.1000114S9Y5-S9 PolarHBondContact O-N 2.74Å
6E48.5Very low50.2Low137 Ų137117.7 Ų117.764%0.6463%0.628SS**Hα-helixtrans-71.7-29.8179.9-79.5-179.6151.400113.7L3 P4 T10L3-E6 HydrophobicContact CD2-CB 4.48Å; L3-E6 HydrophobicContact CD2-CG 4.11Å; P4-E6 PolarHBondContact O-N 3.46Å; E6-T10 WeakPolarHBondContact O-CG2 3.25Å; E6-T10 PolarHBondContact O-N 3.37Å; E6-T10 VanDerWaalsContact O-N 3.11Å; E6-T10 PolarHBondContact O-OG1 3.03Å
7I51Low50.4Low127 Ų127118.7 Ų118.765%0.65163%0.628SS**Hα-helixtrans-72.8-36.6-178.1-55.3175.5000110.8T10 A11I7-T10 WeakPolarHBondContact CA-OG1 3.35Å; I7-T10 PolarHBondContact O-OG1 3.14Å; I7-A11 WeakPolarHBondContact O-CB 3.21Å; I7-A11 PolarHBondContact O-N 3.2Å; I7-A11 VanDerWaalsContact O-N 3.08Å
8Q45.2Very low50.8Low141 Ų141118.1 Ų118.166%0.65962%0.623SS**Hα-helixtrans-72-39.1179.1-161.7114.16.900111.8A11 L12Q8-A11 PolarHBondContact O-N 3.49Å; Q8-L12 PolarHBondContact O-N 3.17Å
9S48.8Very low51.1Low59 Ų59113.4 Ų113.441%0.41361%0.606SS.*Hα-helixtrans-67.3-41.2179-152.40000111.4Y5 L12 L13Y5-S9 PolarHBondContact O-N 2.74Å; S9-L12 PolarHBondContact O-N 3.03Å; S9-L13 WeakPolarHBondContact O-CB 3.38Å; S9-L13 VanDerWaalsContact O-CG 3.23Å; S9-L13 WeakPolarHBondContact O-CG 3.44Å; S9-L13 PolarHBondContact O-N 2.94Å
10T52.9Low51.7Low75 Ų75113 Ų11346%0.4660%0.604SS.*Hα-helixtrans-66.4-37174.448.40000112.7E6 I7 N14E6-T10 WeakPolarHBondContact O-CG2 3.25Å; E6-T10 PolarHBondContact O-N 3.37Å; E6-T10 VanDerWaalsContact O-N 3.11Å; E6-T10 PolarHBondContact O-OG1 3.03Å; I7-T10 WeakPolarHBondContact CA-OG1 3.35Å; I7-T10 PolarHBondContact O-OG1 3.14Å; T10-N14 VanDerWaalsContact O-CB 3.28Å; T10-N14 WeakPolarHBondContact O-CB 3.34Å; T10-N14 PolarHBondContact O-N 3.02Å
11A51.7Low52Low46 Ų46109.1 Ų109.138%0.3858%0.584SS.*Hα-helixtrans-67.8-40.417600000113.2I7 Q8 N14 N15I7-A11 WeakPolarHBondContact O-CB 3.21Å; I7-A11 PolarHBondContact O-N 3.2Å; I7-A11 VanDerWaalsContact O-N 3.08Å; Q8-A11 PolarHBondContact O-N 3.49Å; A11-N14 PolarHBondContact O-N 3.43Å; A11-N15 WeakPolarHBondContact O-CB 3.33Å; A11-N15 PolarHBondContact O-N 2.93Å
12L53.2Low52.8Low114 Ų11499.7 Ų99.760%0.59754%0.543SS*.Hα-helixtrans-70.1-39.6175.5-72.9174.8000112.1Q8 S9 N15 S16Q8-L12 PolarHBondContact O-N 3.17Å; S9-L12 PolarHBondContact O-N 3.03Å; L12-N15 PolarHBondContact O-N 3.02Å; L12-S16 WeakPolarHBondContact O-CB 3.29Å; L12-S16 PolarHBondContact O-N 3.36Å; L12-S16 PolarHBondContact O-OG 3.41Å
13L56.9Low53.7Low108 Ų108100 Ų10057%0.56553%0.533SS*.Hα-helixtrans-62.3-44.9171.8-73.7171.2000110.7S9 S16 H17S9-L13 WeakPolarHBondContact O-CB 3.38Å; S9-L13 VanDerWaalsContact O-CG 3.23Å; S9-L13 WeakPolarHBondContact O-CG 3.44Å; S9-L13 PolarHBondContact O-N 2.94Å; L13-S16 WeakPolarHBondContact CA-OG 3.3Å; L13-S16 PolarHBondContact O-N 3.36Å; L13-S16 PolarHBondContact O-OG 3.2Å; L13-H17 WeakPolarHBondContact O-CB 3.35Å; L13-H17 PolarHBondContact O-N 3.35Å
14N53.8Low54.7Low99 Ų99102.2 Ų102.253%0.52953%0.532SS..Hα-helixtrans-62-47.2175.3-82.40.1000112T10 A11 S16 H17 I18T10-N14 VanDerWaalsContact O-CB 3.28Å; T10-N14 WeakPolarHBondContact O-CB 3.34Å; T10-N14 PolarHBondContact O-N 3.02Å; A11-N14 PolarHBondContact O-N 3.43Å; N14-S16 PolarHBondContact O-N 3.49Å; N14-H17 PolarHBondContact O-N 3.23Å; N14-I18 HydrophobicContact CB-CD1 4.39Å; N14-I18 VanDerWaalsContact O-CB 3.26Å; N14-I18 WeakPolarHBondContact O-CB 3.38Å; N14-I18 WeakPolarHBondContact O-CD1 3.02Å; N14-I18 WeakPolarHBondContact O-CG1 3.07Å; N14-I18 PolarHBondContact O-N 3.19Å
15N57.6Low55.2Low111 Ų11197.4 Ų97.459%0.59450%0.501SS*.Hα-helixtrans-65.7-37.6-179.8-78.7-10.4000112.7A11 L12 G19A11-N15 WeakPolarHBondContact O-CB 3.33Å; A11-N15 PolarHBondContact O-N 2.93Å; L12-N15 PolarHBondContact O-N 3.02Å; N15-G19 PolarHBondContact O-N 2.99Å
16S57.6Low55.7Low60 Ų6090 Ų9042%0.4248%0.479SS..Hα-helixtrans-70.4-38.3174.8580000112L12 L13 N14 G19 N20L12-S16 WeakPolarHBondContact O-CB 3.29Å; L12-S16 PolarHBondContact O-N 3.36Å; L12-S16 PolarHBondContact O-OG 3.41Å; L13-S16 WeakPolarHBondContact CA-OG 3.3Å; L13-S16 PolarHBondContact O-N 3.36Å; L13-S16 PolarHBondContact O-OG 3.2Å; N14-S16 PolarHBondContact O-N 3.49Å; S16-G19 PolarHBondContact O-N 3.47Å; S16-N20 VanDerWaalsContact O-CB 3.31Å; S16-N20 WeakPolarHBondContact O-CB 3.32Å; S16-N20 PolarHBondContact O-N 3.42Å; S16-N20 PolarHBondContact O-ND2 3.45Å
17H54.2Low56.5Low135 Ų13589.9 Ų89.963%0.62548%0.478SS*.Hα-helixtrans-67.3-47.9175.6-148.3-68.6000111.1L13 N14 G19 N20 T21L13-H17 WeakPolarHBondContact O-CB 3.35Å; L13-H17 PolarHBondContact O-N 3.35Å; N14-H17 PolarHBondContact O-N 3.23Å; H17-G19 VanDerWaalsContact C-N 3.32Å; H17-G19 PolarHBondContact O-N 3.13Å; H17-N20 PolarHBondContact O-N 3.29Å; H17-T21 WeakPolarHBondContact O-CB 3.23Å; H17-T21 PolarHBondContact O-N 2.86Å; H17-T21 PolarHBondContact O-OG1 2.91Å
18I56.6Low57.3Low108 Ų10887.4 Ų87.455%0.55446%0.464SS*.Hα-helixtrans-58.8-44.7174.1-67.5163.5000110.3N14 T21 S22N14-I18 HydrophobicContact CB-CD1 4.39Å; N14-I18 VanDerWaalsContact O-CB 3.26Å; N14-I18 WeakPolarHBondContact O-CB 3.38Å; N14-I18 WeakPolarHBondContact O-CD1 3.02Å; N14-I18 WeakPolarHBondContact O-CG1 3.07Å; N14-I18 PolarHBondContact O-N 3.19Å; I18-T21 PolarHBondContact O-N 3.16Å; I18-S22 VanDerWaalsContact O-CB 3.26Å; I18-S22 WeakPolarHBondContact O-CB 3.24Å; I18-S22 PolarHBondContact O-N 3.41Å
19G56.9Low58.5Low29 Ų2981.5 Ų81.530%0.29944%0.436SS..Hα-helixtrans-63-41177.200000113.1N15 S16 H17 K23N15-G19 PolarHBondContact O-N 2.99Å; S16-G19 PolarHBondContact O-N 3.47Å; H17-G19 VanDerWaalsContact C-N 3.32Å; H17-G19 PolarHBondContact O-N 3.13Å; G19-K23 WeakPolarHBondContact O-CB 3.39Å; G19-K23 VanDerWaalsContact O-CG 3.25Å; G19-K23 WeakPolarHBondContact O-CG 3.47Å; G19-K23 PolarHBondContact O-N 3.37Å; G19-K23 VanDerWaalsContact O-N 3.07Å
20N62.8Low59.6Low105 Ų10584.3 Ų84.356%0.56145%0.445SS*.Hα-helixtrans-70.1-41.5176.1-74.5-13.1000112.1S16 H17 K23 R24S16-N20 VanDerWaalsContact O-CB 3.31Å; S16-N20 WeakPolarHBondContact O-CB 3.32Å; S16-N20 PolarHBondContact O-N 3.42Å; S16-N20 PolarHBondContact O-ND2 3.45Å; H17-N20 PolarHBondContact O-N 3.29Å; N20-K23 PolarHBondContact O-N 3.49Å; N20-R24 WeakPolarHBondContact O-CB 3.46Å; N20-R24 PolarHBondContact O-N 2.93Å
21T57.7Low60.8Low31 Ų3186 Ų8619%0.1945%0.447CS..Hα-helixtrans-65.1-46.8177.3-510000110.9H17 I18 K23 R24 V25 V265 P267H17-T21 WeakPolarHBondContact O-CB 3.23Å; H17-T21 PolarHBondContact O-N 2.86Å; H17-T21 PolarHBondContact O-OG1 2.91Å; I18-T21 PolarHBondContact O-N 3.16Å; T21-K23 VanDerWaalsContact C-N 3.32Å; T21-K23 PolarHBondContact O-N 2.85Å; T21-R24 PolarHBondContact O-N 3.43Å; T21-V25 PolarHBondContact O-N 2.8Å; T21-V265 WeakPolarHBondContact CG2-O 3.21Å; T21-P267 VanDerWaalsContact CG2-CD 3.4Å; T21-P267 HydrophobicContact CG2-CG 3.74Å
22S58.4Low62.2Low49 Ų4984.2 Ų84.234%0.34343%0.431SS..Hα-helixtrans-61.3-39.4177.2-1800000112.1I18 S26I18-S22 VanDerWaalsContact O-CB 3.26Å; I18-S22 WeakPolarHBondContact O-CB 3.24Å; I18-S22 PolarHBondContact O-N 3.41Å; S22-S26 WeakPolarHBondContact O-CB 3.42Å; S22-S26 PolarHBondContact O-N 3.06Å; S22-S26 PolarHBondContact O-OG 2.74Å
23K60.3Low63.3Low139 Ų13980.9 Ų80.960%0.60441%0.412SS*.Hα-helixtrans-63.8-50.7173-79.6177.5179.9179.80112.5G19 N20 T21 V25 S26 E27G19-K23 WeakPolarHBondContact O-CB 3.39Å; G19-K23 VanDerWaalsContact O-CG 3.25Å; G19-K23 WeakPolarHBondContact O-CG 3.47Å; G19-K23 PolarHBondContact O-N 3.37Å; G19-K23 VanDerWaalsContact O-N 3.07Å; N20-K23 PolarHBondContact O-N 3.49Å; T21-K23 VanDerWaalsContact C-N 3.32Å; T21-K23 PolarHBondContact O-N 2.85Å; K23-V25 VanDerWaalsContact C-N 3.3Å; K23-V25 PolarHBondContact O-N 2.81Å; K23-S26 WeakPolarHBondContact O-CB 2.95Å; K23-S26 PolarHBondContact O-N 2.56Å; K23-S26 VanDerWaalsContact O-N 3.17Å; K23-E27 WeakPolarHBondContact O-CG 3.25Å; K23-E27 PolarHBondContact O-N 2.7Å
24R61.4Low64.6Low171 Ų17177.2 Ų77.265%0.64540%0.396SS*.Hα-helixtrans-57.4-43.1179.9179-177.5-94.4-176.2-8.4111.5N20 T21 E27 E28N20-R24 WeakPolarHBondContact O-CB 3.46Å; N20-R24 PolarHBondContact O-N 2.93Å; T21-R24 PolarHBondContact O-N 3.43Å; R24-E27 WeakPolarHBondContact O-CB 3.12Å; R24-E27 PolarHBondContact O-N 3Å; R24-E28 WeakPolarHBondContact O-CG 3.44Å; R24-E28 PolarHBondContact O-N 3.28Å
25V61.6Low66.1Low3 Ų379.6 Ų79.62%0.01840%0.401CS..Hα-helixtrans-70.3-38177.9173.60000112.8T21 K23 E27 E28 F29 L266 P267 L269 V277T21-V25 PolarHBondContact O-N 2.8Å; K23-V25 VanDerWaalsContact C-N 3.3Å; K23-V25 PolarHBondContact O-N 2.81Å; V25-E27 PolarHBondContact O-N 2.63Å; V25-E28 PolarHBondContact O-N 3.29Å; V25-F29 WeakPolarHBondContact O-CB 3.41Å; V25-F29 PolarHBondContact O-N 3.06Å; V25-L266 HydrophobicContact CG2-CD2 4.37Å; V25-P267 HydrophobicContact CB-CG 3.97Å; V25-P267 WeakPolarHBondContact CG1-O 3.44Å; V25-P267 VanDerWaalsContact CG2-CD 3.44Å; V25-P267 HydrophobicContact CG2-CG 3.7Å; V25-L269 HydrophobicContact CG1-CD1 4.49Å; V25-V277 HydrophobicContact CG1-CG1 4.2Å
26S62.1Low67.5Low43 Ų4384.5 Ų84.530%0.30141%0.411SS..Hα-helixtrans-59.4-38.8173.1-58.10000111.2S22 K23 L30 L269S22-S26 WeakPolarHBondContact O-CB 3.42Å; S22-S26 PolarHBondContact O-N 3.06Å; S22-S26 PolarHBondContact O-OG 2.74Å; K23-S26 WeakPolarHBondContact O-CB 2.95Å; K23-S26 PolarHBondContact O-N 2.56Å; K23-S26 VanDerWaalsContact O-N 3.17Å; S26-L30 WeakPolarHBondContact O-CB 3.43Å; S26-L30 PolarHBondContact O-N 3.4Å; S26-L269 WeakPolarHBondContact OG-CD2 3.42Å
27E65.6Low69Low134 Ų13481.8 Ų81.863%0.62639%0.393SS*.Hα-helixtrans-66.7-43.4173.7-70.8175.1179.300112.5K23 R24 V25 L30 F31K23-E27 WeakPolarHBondContact O-CG 3.25Å; K23-E27 PolarHBondContact O-N 2.7Å; R24-E27 WeakPolarHBondContact O-CB 3.12Å; R24-E27 PolarHBondContact O-N 3Å; V25-E27 PolarHBondContact O-N 2.63Å; E27-L30 PolarHBondContact O-N 3.07Å; E27-F31 VanDerWaalsContact O-CB 3.25Å; E27-F31 WeakPolarHBondContact O-CB 3.48Å; E27-F31 PolarHBondContact O-N 3.49Å
28E67.7Low70.7Confident75 Ų7576 Ų7635%0.3537%0.366SS..Hα-helixtrans-64.6-44.3177.5-74.9175.9-17700112.4R24 V25 F31 L32R24-E28 WeakPolarHBondContact O-CG 3.44Å; R24-E28 PolarHBondContact O-N 3.28Å; V25-E28 PolarHBondContact O-N 3.29Å; E28-F31 WeakPolarHBondContact O-CB 3.47Å; E28-F31 PolarHBondContact O-N 2.98Å; E28-L32 WeakPolarHBondContact O-CG 3.41Å; E28-L32 PolarHBondContact O-N 2.86Å
29F70.1Confident72.4Confident17 Ų1774.8 Ų74.88%0.07536%0.364CS..Hα-helixtrans-67.9-42.7176.5-172-104.5000111.6V25 F31 L32 E33 L269 T272 V277V25-F29 WeakPolarHBondContact O-CB 3.41Å; V25-F29 PolarHBondContact O-N 3.06Å; F29-F31 PolarHBondContact O-N 3.02Å; F29-L32 PolarHBondContact O-N 3.2Å; F29-L32 VanDerWaalsContact O-N 3.15Å; F29-E33 HydrophobicContact CD1-CG 4.21Å; F29-E33 HydrophobicContact CE1-CG 3.91Å; F29-E33 WeakPolarHBondContact CE1-OE1 3.4Å; F29-E33 HydrophobicContact CZ-CG 4.2Å; F29-E33 WeakPolarHBondContact CZ-OE1 3.47Å; F29-E33 WeakPolarHBondContact O-CG 3.11Å; F29-E33 PolarHBondContact O-N 3.01Å; F29-L269 HydrophobicContact CB-CD1 3.39Å; F29-L269 HydrophobicContact CD1-CD1 3.49Å; F29-L269 VanDerWaalsContact CD1-CD1 3.49Å; F29-L269 HydrophobicContact CD2-CD1 4.1Å; F29-L269 HydrophobicContact CE1-CD1 4.24Å; F29-L269 HydrophobicContact CG-CD1 3.38Å; F29-T272 HydrophobicContact CE2-CG2 4.21Å; F29-T272 HydrophobicContact CZ-CG2 4.03Å; F29-V277 HydrophobicContact CD2-CB 4.32Å; F29-V277 HydrophobicContact CD2-CG1 4.33Å; F29-V277 HydrophobicContact CD2-CG2 3.72Å; F29-V277 HydrophobicContact CE2-CG2 4.24Å; F29-V277 HydrophobicContact CG-CG2 4.36Å
30L71.5Confident74.2Confident118 Ų11878.3 Ų78.362%0.61837%0.371SS*.Hα-helixtrans-60-36.4173.3-176.569.8000111.3S26 E27 S34S26-L30 WeakPolarHBondContact O-CB 3.43Å; S26-L30 PolarHBondContact O-N 3.4Å; E27-L30 PolarHBondContact O-N 3.07Å; L30-S34 WeakPolarHBondContact O-CB 3.48Å; L30-S34 PolarHBondContact O-N 3.37Å
31F79.5Confident75.7Confident112 Ų11273.3 Ų73.349%0.49134%0.344SS..Hα-helixtrans-65.1-45.7174.2175.5-98.5000111.6E27 E28 F29 E33 S34 A37 F284E27-F31 VanDerWaalsContact O-CB 3.25Å; E27-F31 WeakPolarHBondContact O-CB 3.48Å; E27-F31 PolarHBondContact O-N 3.49Å; E28-F31 WeakPolarHBondContact O-CB 3.47Å; E28-F31 PolarHBondContact O-N 2.98Å; F29-F31 PolarHBondContact O-N 3.02Å; F31-E33 VanDerWaalsContact C-N 3.33Å; F31-E33 PolarHBondContact O-N 2.83Å; F31-S34 WeakPolarHBondContact O-CB 3.3Å; F31-S34 PolarHBondContact O-N 3.43Å; F31-S34 PolarHBondContact O-OG 3.24Å; F31-A37 HydrophobicContact CD1-CB 4.45Å; F31-A37 HydrophobicContact CE1-CB 4.15Å; F31-A37 HydrophobicContact CZ-CB 4.21Å; F31-A37 WeakPolarHBondContact O-CB 3.38Å; F31-F284 HydrophobicContact CE1-CE2 4.01Å; F31-F284 HydrophobicContact CE1-CZ 4.08Å; F31-F284 HydrophobicContact CZ-CZ 4.49Å
32L79.7Confident77.5Confident7 Ų772 Ų724%0.03734%0.337CS..Hα-helixtrans-64.3-36.1177-70.9172000112.9E28 F29 S34 I281 F284E28-L32 WeakPolarHBondContact O-CG 3.41Å; E28-L32 PolarHBondContact O-N 2.86Å; F29-L32 PolarHBondContact O-N 3.2Å; F29-L32 VanDerWaalsContact O-N 3.15Å; L32-S34 PolarHBondContact O-N 3.47Å; L32-I281 HydrophobicContact CD1-CG1 3.7Å; L32-F284 HydrophobicContact CD2-CB 3.65Å; L32-F284 HydrophobicContact CD2-CD2 3.89Å; L32-F284 HydrophobicContact CD2-CG 3.9Å
33E76.3Confident79.3Confident44 Ų4475 Ų7521%0.20635%0.349CS..Hα-helixtrans-74.7-14.9172.6-69.7-157.8157.100113.7F29 F31 K35 K94F29-E33 HydrophobicContact CD1-CG 4.21Å; F29-E33 HydrophobicContact CE1-CG 3.91Å; F29-E33 WeakPolarHBondContact CE1-OE1 3.4Å; F29-E33 HydrophobicContact CZ-CG 4.2Å; F29-E33 WeakPolarHBondContact CZ-OE1 3.47Å; F29-E33 WeakPolarHBondContact O-CG 3.11Å; F29-E33 PolarHBondContact O-N 3.01Å; F31-E33 VanDerWaalsContact C-N 3.33Å; F31-E33 PolarHBondContact O-N 2.83Å; E33-K35 PolarHBondContact O-N 3.42Å; E33-K94 IonicContact OE1-NZ 3.15Å; E33-K94 WeakPolarHBondContact OE2-CE 3.38Å; E33-K94 IonicContact OE2-NZ 3.23Å; E33-K94 PolarHBondContact OE2-NZ 2.83Å
34S84.6Confident81.1Confident32 Ų3269.2 Ų69.222%0.22433%0.325CS..SBendtrans-62.7138-176.980.10000110.2L30 F31 L32 W36 A37 Q38L30-S34 WeakPolarHBondContact O-CB 3.48Å; L30-S34 PolarHBondContact O-N 3.37Å; F31-S34 WeakPolarHBondContact O-CB 3.3Å; F31-S34 PolarHBondContact O-N 3.43Å; F31-S34 PolarHBondContact O-OG 3.24Å; L32-S34 PolarHBondContact O-N 3.47Å; S34-W36 PolarHBondContact O-N 3.39Å; S34-W36 VanDerWaalsContact O-N 3.14Å; S34-A37 PolarHBondContact O-N 3.11Å; S34-A37 VanDerWaalsContact O-N 3.09Å; S34-A37 WeakPolarHBondContact OG-CB 3.44Å; S34-A37 PolarHBondContact OG-N 3.23Å; S34-A37 VanDerWaalsContact OG-N 3.15Å; S34-Q38 PolarHBondContact O-N 3.5Å
35K85.2Confident82.8Confident148 Ų14861.1 Ų61.164%0.64329%0.294SS*.Hα-helixtrans-57.6-30.6176.7-64.7-58.1-178.7-171.70112.1E33 V39E33-K35 PolarHBondContact O-N 3.42Å; K35-V39 WeakPolarHBondContact O-CB 3.48Å; K35-V39 WeakPolarHBondContact O-CG2 3.27Å; K35-V39 PolarHBondContact O-N 3.47Å
36W88.2Confident84.5Confident214 Ų21465.5 Ų65.581%0.81131%0.313SS*.Hα-helixtrans-65.3-46.9175.3-74.6114.2000112.8S34 Q38 V39 F40S34-W36 PolarHBondContact O-N 3.39Å; S34-W36 VanDerWaalsContact O-N 3.14Å; W36-Q38 PolarHBondContact O-N 2.93Å; W36-V39 PolarHBondContact O-N 3.28Å; W36-F40 VanDerWaalsContact O-CB 3.22Å; W36-F40 WeakPolarHBondContact O-CB 3.48Å; W36-F40 PolarHBondContact O-N 3.35Å
37A88.4Confident86.2Confident4 Ų466.8 Ų66.83%0.03332%0.32CS..Hα-helixtrans-64-41.4178.500000112F31 S34 F40 T41 F284F31-A37 HydrophobicContact CD1-CB 4.45Å; F31-A37 HydrophobicContact CE1-CB 4.15Å; F31-A37 HydrophobicContact CZ-CB 4.21Å; F31-A37 WeakPolarHBondContact O-CB 3.38Å; S34-A37 PolarHBondContact O-N 3.11Å; S34-A37 VanDerWaalsContact O-N 3.09Å; S34-A37 WeakPolarHBondContact OG-CB 3.44Å; S34-A37 PolarHBondContact OG-N 3.23Å; S34-A37 VanDerWaalsContact OG-N 3.15Å; A37-F40 PolarHBondContact O-N 2.92Å; A37-T41 WeakPolarHBondContact O-CB 3.39Å; A37-T41 WeakPolarHBondContact O-CG2 3.23Å; A37-T41 PolarHBondContact O-N 2.87Å; A37-T41 PolarHBondContact O-OG1 3.35Å; A37-F284 HydrophobicContact CB-CE2 4.36Å
38Q90Very high87.7Confident14 Ų1460.4 Ų60.47%0.06529%0.29CS..Hα-helixtrans-64.5-40.3176.7-67.4-178.4-18.100112.7S34 W36 T41 G42 W87 L90 L91S34-Q38 PolarHBondContact O-N 3.5Å; W36-Q38 PolarHBondContact O-N 2.93Å; Q38-T41 PolarHBondContact O-OG1 3.43Å; Q38-G42 PolarHBondContact O-N 2.77Å; Q38-W87 PolarHBondContact O-NE1 3.47Å; Q38-L90 PolarHBondContact NE2-O 2.83Å; Q38-L90 VanDerWaalsContact NE2-O 3.15Å; Q38-L91 HydrophobicContact CB-CD2 4.05Å; Q38-L91 HydrophobicContact CG-CD2 4.23Å
39V93Very high89.1Confident82 Ų8258.2 Ų58.250%0.49728%0.28SS..Hα-helixtrans-70-43.8176.1169.50000110.8K35 W36 G42 L43K35-V39 WeakPolarHBondContact O-CB 3.48Å; K35-V39 WeakPolarHBondContact O-CG2 3.27Å; K35-V39 PolarHBondContact O-N 3.47Å; W36-V39 PolarHBondContact O-N 3.28Å; V39-G42 PolarHBondContact O-N 2.81Å; V39-L43 HydrophobicContact CG1-CD1 4.22Å; V39-L43 HydrophobicContact CG1-CG 4.5Å; V39-L43 WeakPolarHBondContact O-CG 3.34Å; V39-L43 PolarHBondContact O-N 3.1Å
40F94.3Very high90.4Very high102 Ų10262.1 Ų62.145%0.44731%0.305SS..Hα-helixtrans-62.1-51.7179.2172.9-108.1000111.9W36 A37 G42 L43 V44 F284 L288W36-F40 VanDerWaalsContact O-CB 3.22Å; W36-F40 WeakPolarHBondContact O-CB 3.48Å; W36-F40 PolarHBondContact O-N 3.35Å; A37-F40 PolarHBondContact O-N 2.92Å; F40-G42 VanDerWaalsContact C-N 3.27Å; F40-G42 PolarHBondContact O-N 3.09Å; F40-L43 PolarHBondContact O-N 2.86Å; F40-V44 HydrophobicContact CE1-CG2 4.44Å; F40-V44 HydrophobicContact CE2-CG2 4.13Å; F40-V44 HydrophobicContact CZ-CG2 4.09Å; F40-V44 WeakPolarHBondContact O-CG2 3.08Å; F40-V44 PolarHBondContact O-N 3.03Å; F40-F284 HydrophobicContact CD1-CE2 4.36Å; F40-F284 HydrophobicContact CD1-CZ 4.35Å; F40-F284 HydrophobicContact CE1-CZ 4.31Å; F40-L288 HydrophobicContact CE1-CD2 3.81Å; F40-L288 HydrophobicContact CZ-CD2 4.11Å
41T94.6Very high91.6Very high0 Ų058.6 Ų58.60%029%0.287CS..Hα-helixtrans-61.3-37.2175.4490000111.9A37 Q38 V44 A45 L90 F284 C287A37-T41 WeakPolarHBondContact O-CB 3.39Å; A37-T41 WeakPolarHBondContact O-CG2 3.23Å; A37-T41 PolarHBondContact O-N 2.87Å; A37-T41 PolarHBondContact O-OG1 3.35Å; Q38-T41 PolarHBondContact O-OG1 3.43Å; T41-V44 PolarHBondContact O-N 3.06Å; T41-A45 VanDerWaalsContact O-CB 3.22Å; T41-A45 WeakPolarHBondContact O-CB 3.48Å; T41-A45 PolarHBondContact O-N 2.94Å; T41-L90 HydrophobicContact CG2-CD1 3.85Å; T41-F284 HydrophobicContact CG2-CD2 3.23Å; T41-F284 HydrophobicContact CG2-CE2 3.42Å; T41-F284 VanDerWaalsContact CG2-CE2 3.42Å; T41-F284 HydrophobicContact CG2-CG 4.05Å; T41-F284 HydrophobicContact CG2-CZ 4.38Å; T41-C287 HydrophobicContact CG2-CB 4.24Å
42G95.3Very high92.4Very high4 Ų453.3 Ų53.34%0.04126%0.263CS..Hα-helixtrans-58.7-51.8172.400000112.5Q38 V39 F40 V44 A45 F46 W87Q38-G42 PolarHBondContact O-N 2.77Å; V39-G42 PolarHBondContact O-N 2.81Å; F40-G42 VanDerWaalsContact C-N 3.27Å; F40-G42 PolarHBondContact O-N 3.09Å; G42-V44 VanDerWaalsContact C-N 3.29Å; G42-V44 PolarHBondContact O-N 3.43Å; G42-A45 PolarHBondContact O-N 3.2Å; G42-F46 WeakPolarHBondContact O-CB 3.49Å; G42-F46 WeakPolarHBondContact O-CD2 3.43Å; G42-F46 PolarHBondContact O-N 3.41Å; G42-W87 VanDerWaalsContact CA-NE1 3.26Å
43L96.8Very high93.2Very high113 Ų11355.7 Ų55.759%0.59228%0.28SS*.Hα-helixtrans-57.5-42.8177.6-71.9172.4000111.9V39 F40 T47V39-L43 HydrophobicContact CG1-CD1 4.22Å; V39-L43 HydrophobicContact CG1-CG 4.5Å; V39-L43 WeakPolarHBondContact O-CG 3.34Å; V39-L43 PolarHBondContact O-N 3.1Å; F40-L43 PolarHBondContact O-N 2.86Å; L43-T47 WeakPolarHBondContact O-CB 3.06Å; L43-T47 PolarHBondContact O-N 2.81Å; L43-T47 PolarHBondContact O-OG1 3.09Å
44V96.9Very high94Very high16 Ų1657.8 Ų57.810%0.09729%0.289CS..Hα-helixtrans-64.3-49.1177172.90000111.3F40 T41 G42 T47 A48 C287 L288 L291F40-V44 HydrophobicContact CE1-CG2 4.44Å; F40-V44 HydrophobicContact CE2-CG2 4.13Å; F40-V44 HydrophobicContact CZ-CG2 4.09Å; F40-V44 WeakPolarHBondContact O-CG2 3.08Å; F40-V44 PolarHBondContact O-N 3.03Å; T41-V44 PolarHBondContact O-N 3.06Å; G42-V44 VanDerWaalsContact C-N 3.29Å; G42-V44 PolarHBondContact O-N 3.43Å; V44-T47 PolarHBondContact O-N 3.39Å; V44-A48 PolarHBondContact O-N 3.42Å; V44-C287 VanDerWaalsContact CG1-O 3.31Å; V44-C287 WeakPolarHBondContact CG1-O 3.29Å; V44-L288 HydrophobicContact CG1-CD2 4.09Å; V44-L288 HydrophobicContact CG2-CD2 4.17Å; V44-L291 HydrophobicContact CG1-CB 3.7Å; V44-L291 HydrophobicContact CG1-CD2 3.89Å; V44-L291 HydrophobicContact CG1-CG 4.37Å
45A96.5Very high94.5Very high1 Ų156.3 Ų56.31%0.00828%0.279CS..Hα-helixtrans-61.2-46.9179.700000111.7T41 G42 T47 A48 I49 A83 W87T41-A45 VanDerWaalsContact O-CB 3.22Å; T41-A45 WeakPolarHBondContact O-CB 3.48Å; T41-A45 PolarHBondContact O-N 2.94Å; G42-A45 PolarHBondContact O-N 3.2Å; A45-T47 VanDerWaalsContact C-N 3.33Å; A45-T47 PolarHBondContact O-N 2.58Å; A45-A48 WeakPolarHBondContact O-CB 3.5Å; A45-A48 PolarHBondContact O-N 2.97Å; A45-I49 WeakPolarHBondContact O-CD1 3.48Å; A45-I49 VanDerWaalsContact O-CG1 3.25Å; A45-I49 WeakPolarHBondContact O-CG1 3.19Å; A45-I49 PolarHBondContact O-N 3.03Å; A45-A83 HydrophobicContact CB-CB 4.04Å; A45-W87 HydrophobicContact CB-CB 4.08Å
46F97.5Very high94.8Very high95 Ų9549.7 Ų49.742%0.41725%0.251SS..Hα-helixtrans-64.8-36176.5-81-69.4000112.5G42 I49 V50 W87G42-F46 WeakPolarHBondContact O-CB 3.49Å; G42-F46 WeakPolarHBondContact O-CD2 3.43Å; G42-F46 PolarHBondContact O-N 3.41Å; F46-I49 HydrophobicContact CD1-CD1 4.24Å; F46-I49 PolarHBondContact O-N 2.85Å; F46-V50 VanDerWaalsContact O-CG2 3.3Å; F46-V50 WeakPolarHBondContact O-CG2 3.48Å; F46-V50 PolarHBondContact O-N 3.44Å; F46-W87 HydrophobicContact CE2-CD2 4.29Å; F46-W87 AromaticContact CE2-CE3 3.98Å; F46-W87 HydrophobicContact CE2-CE3 3.98Å; F46-W87 AromaticContact CE2-CH2 3.56Å; F46-W87 HydrophobicContact CE2-CH2 3.56Å; F46-W87 AromaticContact CE2-CZ2 3.88Å; F46-W87 HydrophobicContact CE2-CZ2 3.88Å; F46-W87 AromaticContact CE2-CZ3 3.61Å; F46-W87 HydrophobicContact CE2-CZ3 3.61Å; F46-W87 HydrophobicContact CZ-CE3 4.17Å; F46-W87 AromaticContact CZ-CH2 3.83Å; F46-W87 HydrophobicContact CZ-CH2 3.83Å; F46-W87 AromaticContact CZ-CZ3 3.59Å; F46-W87 HydrophobicContact CZ-CZ3 3.59Å
47T97.9Very high95Very high71 Ų7142.5 Ų42.544%0.43622%0.224SC..Hα-helixtrans-63-45.4173.8-58.10000110.8L43 V44 A45 I49 V50 I51 L291L43-T47 WeakPolarHBondContact O-CB 3.06Å; L43-T47 PolarHBondContact O-N 2.81Å; L43-T47 PolarHBondContact O-OG1 3.09Å; V44-T47 PolarHBondContact O-N 3.39Å; A45-T47 VanDerWaalsContact C-N 3.33Å; A45-T47 PolarHBondContact O-N 2.58Å; T47-I49 PolarHBondContact O-N 2.98Å; T47-V50 PolarHBondContact O-N 3.23Å; T47-I51 HydrophobicContact CG2-CD1 3.97Å; T47-I51 VanDerWaalsContact O-CG1 3.3Å; T47-I51 WeakPolarHBondContact O-CG1 3.4Å; T47-I51 PolarHBondContact O-N 3.06Å; T47-L291 HydrophobicContact CG2-CD1 3.83Å
48A97.4Very high95.1Very high0 Ų043.8 Ų43.80%023%0.23CC..Hα-helixtrans-59.3-45.9175.300000111.8V44 A45 V50 I51 T52 V79 M290 L291V44-A48 PolarHBondContact O-N 3.42Å; A45-A48 WeakPolarHBondContact O-CB 3.5Å; A45-A48 PolarHBondContact O-N 2.97Å; A48-V50 PolarHBondContact O-N 3.25Å; A48-I51 PolarHBondContact O-N 3.37Å; A48-T52 PolarHBondContact O-N 3.26Å; A48-T52 PolarHBondContact O-OG1 3.44Å; A48-V79 HydrophobicContact CB-CG1 4.05Å; A48-M290 HydrophobicContact CB-CB 4.47Å; A48-L291 HydrophobicContact CB-CB 4.23Å; A48-L291 HydrophobicContact CB-CD1 4.25Å
49I97.6Very high95.1Very high29 Ų2943.1 Ų43.115%0.14923%0.227CC..Hα-helixtrans-57.6-49.9176-69.3161000110.5A45 F46 T47 I51 T52 C53 P80 A83 F84A45-I49 WeakPolarHBondContact O-CD1 3.48Å; A45-I49 VanDerWaalsContact O-CG1 3.25Å; A45-I49 WeakPolarHBondContact O-CG1 3.19Å; A45-I49 PolarHBondContact O-N 3.03Å; F46-I49 HydrophobicContact CD1-CD1 4.24Å; F46-I49 PolarHBondContact O-N 2.85Å; T47-I49 PolarHBondContact O-N 2.98Å; I49-I51 PolarHBondContact O-N 2.83Å; I49-T52 PolarHBondContact O-N 3.39Å; I49-C53 VanDerWaalsContact O-CB 3.23Å; I49-C53 WeakPolarHBondContact O-CB 3.29Å; I49-C53 PolarHBondContact O-N 3.44Å; I49-C53 PolarHBondContact O-SG 2.78Å; I49-P80 HydrophobicContact CG1-CB 4.22Å; I49-P80 HydrophobicContact CG2-CB 4.49Å; I49-A83 HydrophobicContact CD1-CB 4.34Å; I49-A83 HydrophobicContact CG1-CB 4.09Å; I49-F84 HydrophobicContact CD1-CB 4.05Å
50V97.7Very high94.9Very high98 Ų9839.7 Ų39.759%0.59421%0.206SC*.Hα-helixtrans-60.9-44.6-179.21690000111.4F46 T47 A48 T52 H54F46-V50 VanDerWaalsContact O-CG2 3.3Å; F46-V50 WeakPolarHBondContact O-CG2 3.48Å; F46-V50 PolarHBondContact O-N 3.44Å; T47-V50 PolarHBondContact O-N 3.23Å; A48-V50 PolarHBondContact O-N 3.25Å; V50-T52 PolarHBondContact O-N 2.69Å; V50-H54 VanDerWaalsContact O-CB 3.29Å; V50-H54 WeakPolarHBondContact O-CB 3.29Å; V50-H54 PolarHBondContact O-N 3.5Å
51I96.8Very high94.5Very high45 Ų4537 Ų3723%0.23120%0.195CC..Hα-helixtrans-60.1-47.5178.1-69.2167.8000110.7T47 A48 I49 H54 Q55 L291T47-I51 HydrophobicContact CG2-CD1 3.97Å; T47-I51 VanDerWaalsContact O-CG1 3.3Å; T47-I51 WeakPolarHBondContact O-CG1 3.4Å; T47-I51 PolarHBondContact O-N 3.06Å; A48-I51 PolarHBondContact O-N 3.37Å; I49-I51 PolarHBondContact O-N 2.83Å; I51-H54 PolarHBondContact O-N 3.06Å; I51-Q55 PolarHBondContact O-N 3Å; I51-L291 HydrophobicContact CD1-CD1 4.01Å
52T96.2Very high94Very high0 Ų038.8 Ų38.80%021%0.205CC..Hα-helixtrans-74-38.6-177.6-58.10000112.5A48 I49 V50 H54 Q55 I56 L76 V79 P80 S294A48-T52 PolarHBondContact O-N 3.26Å; A48-T52 PolarHBondContact O-OG1 3.44Å; I49-T52 PolarHBondContact O-N 3.39Å; V50-T52 PolarHBondContact O-N 2.69Å; T52-H54 VanDerWaalsContact C-N 3.3Å; T52-H54 PolarHBondContact O-N 2.71Å; T52-Q55 CarbonylContact O-C 3.58Å; T52-Q55 WeakPolarHBondContact O-CA 3.34Å; T52-Q55 WeakPolarHBondContact O-CB 3.37Å; T52-Q55 PolarHBondContact O-N 3.43Å; T52-Q55 VanDerWaalsContact O-N 3.09Å; T52-I56 HydrophobicContact CG2-CD1 4.09Å; T52-I56 HydrophobicContact CG2-CG1 4.41Å; T52-I56 WeakPolarHBondContact O-CG1 3.29Å; T52-I56 PolarHBondContact O-N 2.98Å; T52-L76 HydrophobicContact CG2-CB 4.02Å; T52-L76 WeakPolarHBondContact CG2-O 3.2Å; T52-V79 HydrophobicContact CG2-CB 4.3Å; T52-V79 WeakPolarHBondContact OG1-CG1 3.44Å; T52-P80 HydrophobicContact CG2-CG 3.86Å; T52-S294 WeakPolarHBondContact OG1-CB 3.45Å
53C95.5Very high93.4Very high58 Ų5840.4 Ų40.439%0.39221%0.21SC..Hα-helixtrans-60.9-40.5172.8-74.90000111.4I49 Q55 I56 Y57I49-C53 VanDerWaalsContact O-CB 3.23Å; I49-C53 WeakPolarHBondContact O-CB 3.29Å; I49-C53 PolarHBondContact O-N 3.44Å; I49-C53 PolarHBondContact O-SG 2.78Å; C53-Q55 VanDerWaalsContact C-N 3.34Å; C53-I56 PolarHBondContact O-N 3.33Å; C53-Y57 WeakPolarHBondContact O-CB 3.36Å; C53-Y57 PolarHBondContact O-N 3.15Å
54H94.8Very high92.7Very high87 Ų8738.1 Ų38.140%0.40320%0.201SC..Hα-helixtrans-61.8-42.1172.1173.3-119.9000111.6V50 I51 T52 Y57 L58 R298V50-H54 VanDerWaalsContact O-CB 3.29Å; V50-H54 WeakPolarHBondContact O-CB 3.29Å; V50-H54 PolarHBondContact O-N 3.5Å; I51-H54 PolarHBondContact O-N 3.06Å; T52-H54 VanDerWaalsContact C-N 3.3Å; T52-H54 PolarHBondContact O-N 2.71Å; H54-Y57 PolarHBondContact O-N 3.17Å; H54-L58 WeakPolarHBondContact O-CG 3.26Å; H54-L58 PolarHBondContact O-N 3.2Å; H54-R298 PolarHBondContact ND1-NH1 3.17Å
55Q93.5Very high92.1Very high2 Ų239.3 Ų39.31%0.00921%0.209CC..Hα-helixtrans-63.4-43.4175-173.1-177.2-5.600112.6I51 T52 C53 Y57 L58 H59 L76 L297 F301I51-Q55 PolarHBondContact O-N 3Å; T52-Q55 CarbonylContact O-C 3.58Å; T52-Q55 WeakPolarHBondContact O-CA 3.34Å; T52-Q55 WeakPolarHBondContact O-CB 3.37Å; T52-Q55 PolarHBondContact O-N 3.43Å; T52-Q55 VanDerWaalsContact O-N 3.09Å; C53-Q55 VanDerWaalsContact C-N 3.34Å; Q55-Y57 VanDerWaalsContact C-N 3.33Å; Q55-Y57 PolarHBondContact O-N 2.96Å; Q55-L58 PolarHBondContact O-N 3.48Å; Q55-H59 PolarHBondContact O-CD2 3.38Å; Q55-H59 VanDerWaalsContact O-CD2 3.29Å; Q55-H59 PolarHBondContact O-N 3.36Å; Q55-H59 VanDerWaalsContact O-N 3.07Å; Q55-L76 HydrophobicContact CB-CD1 4.47Å; Q55-L76 HydrophobicContact CG-CD1 3.82Å; Q55-L76 HydrophobicContact CG-CD2 4.48Å; Q55-L297 PolarHBondContact NE2-O 3.09Å; Q55-F301 PolarHBondContact NE2-O 3.29Å
56I93Very high91.6Very high8 Ų842.1 Ų42.14%0.04123%0.227CC..Hα-helixtrans-59.5-47.3175.3-69.8166.1000109.6T52 C53 L58 H59 L60 V73 L76 F77T52-I56 HydrophobicContact CG2-CD1 4.09Å; T52-I56 HydrophobicContact CG2-CG1 4.41Å; T52-I56 WeakPolarHBondContact O-CG1 3.29Å; T52-I56 PolarHBondContact O-N 2.98Å; C53-I56 PolarHBondContact O-N 3.33Å; I56-L58 VanDerWaalsContact C-N 3.31Å; I56-L58 PolarHBondContact O-N 2.96Å; I56-H59 PolarHBondContact O-N 3.44Å; I56-H59 VanDerWaalsContact O-N 3.09Å; I56-L60 HydrophobicContact CG2-CD1 3.75Å; I56-L60 HydrophobicContact CG2-CG 4.23Å; I56-L60 VanDerWaalsContact O-CG 3.3Å; I56-L60 WeakPolarHBondContact O-CG 3.43Å; I56-L60 PolarHBondContact O-N 3.35Å; I56-V73 HydrophobicContact CG2-CG1 4.05Å; I56-L76 HydrophobicContact CD1-CB 4.05Å; I56-L76 HydrophobicContact CG1-CB 3.68Å; I56-L76 HydrophobicContact CG1-CD1 3.95Å; I56-L76 HydrophobicContact CG1-CG 4.49Å; I56-F77 HydrophobicContact CD1-CD1 3.88Å; I56-F77 HydrophobicContact CD1-CD2 4.32Å; I56-F77 HydrophobicContact CD1-CE1 3.84Å; I56-F77 HydrophobicContact CD1-CE2 4.3Å; I56-F77 HydrophobicContact CD1-CG 4.11Å; I56-F77 HydrophobicContact CD1-CZ 4.06Å; I56-F77 HydrophobicContact CG2-CZ 4.34Å
57Y91.2Very high91.1Very high64 Ų6442.1 Ų42.125%0.25123%0.232SC..Hα-helixtrans-56.2-44.7175.5171.4-98.3000112C53 H54 Q55 H59 L60 I61 F338 P340C53-Y57 WeakPolarHBondContact O-CB 3.36Å; C53-Y57 PolarHBondContact O-N 3.15Å; H54-Y57 PolarHBondContact O-N 3.17Å; Q55-Y57 VanDerWaalsContact C-N 3.33Å; Q55-Y57 PolarHBondContact O-N 2.96Å; Y57-H59 VanDerWaalsContact C-N 3.3Å; Y57-H59 PolarHBondContact O-N 3.38Å; Y57-L60 PolarHBondContact O-N 3.18Å; Y57-L60 VanDerWaalsContact O-N 3.09Å; Y57-I61 HydrophobicContact CD1-CD1 4.38Å; Y57-I61 HydrophobicContact CD1-CG2 4.36Å; Y57-I61 HydrophobicContact CD2-CG2 4.03Å; Y57-I61 HydrophobicContact CE1-CD1 3.9Å; Y57-I61 HydrophobicContact CE1-CG2 3.9Å; Y57-I61 HydrophobicContact CE2-CG2 3.53Å; Y57-I61 HydrophobicContact CG-CG2 4.42Å; Y57-I61 VanDerWaalsContact CZ-CG2 3.45Å; Y57-I61 WeakPolarHBondContact O-CG2 3.36Å; Y57-I61 PolarHBondContact O-N 3.22Å; Y57-F338 WeakPolarHBondContact OH-CD2 3.17Å; Y57-F338 PolarHBondContact OH-O 3.34Å; Y57-P340 HydrophobicContact CE2-CG 4.45Å
58L90.4Very high90.6Very high31 Ų3139.5 Ų39.516%0.16222%0.215CC..Hα-helixtrans-62-33.6176.7-70.1175.5000113.5H54 Q55 I56 I61 N62H54-L58 WeakPolarHBondContact O-CG 3.26Å; H54-L58 PolarHBondContact O-N 3.2Å; Q55-L58 PolarHBondContact O-N 3.48Å; I56-L58 VanDerWaalsContact C-N 3.31Å; I56-L58 PolarHBondContact O-N 2.96Å; L58-I61 HydrophobicContact CD2-CD1 3.84Å; L58-I61 WeakPolarHBondContact O-CG1 3.5Å; L58-N62 WeakPolarHBondContact O-CB 3.41Å; L58-N62 PolarHBondContact O-N 3.32Å; L58-N62 PolarHBondContact O-ND2 3.45Å
59H90Very high90.2Very high0 Ų039.5 Ų39.50%022%0.215CC..Hα-helixtrans-72-35.9172.4-81.5-72.2000112.3Q55 I56 Y57 N62 Y63 Q69 V73 F301 Y306Q55-H59 PolarHBondContact O-CD2 3.38Å; Q55-H59 VanDerWaalsContact O-CD2 3.29Å; Q55-H59 PolarHBondContact O-N 3.36Å; Q55-H59 VanDerWaalsContact O-N 3.07Å; I56-H59 PolarHBondContact O-N 3.44Å; I56-H59 VanDerWaalsContact O-N 3.09Å; Y57-H59 VanDerWaalsContact C-N 3.3Å; Y57-H59 PolarHBondContact O-N 3.38Å; H59-N62 CarbonylContact O-C 3.35Å; H59-Y63 PolarHBondContact O-N 2.87Å; H59-Q69 PolarHBondContact O-NE2 3.22Å; H59-V73 HydrophobicContact CB-CG2 4.1Å; H59-F301 PolarHBondContact NE2-O 3.31Å; H59-Y306 AromaticContact CE1-CD2 3.69Å; H59-Y306 AromaticContact CE1-CE2 3.73Å; H59-Y306 AromaticContact ND1-CD2 3.6Å; H59-Y306 AromaticContact ND1-CE2 3.89Å
60L88.6Confident89.8Confident10 Ų1040.3 Ų40.35%0.05222%0.216CC..Hα-helixtrans-74.7-33.1-179.5-66.8171.8000113.4I56 Y57 Y63 P340 S344 L348I56-L60 HydrophobicContact CG2-CD1 3.75Å; I56-L60 HydrophobicContact CG2-CG 4.23Å; I56-L60 VanDerWaalsContact O-CG 3.3Å; I56-L60 WeakPolarHBondContact O-CG 3.43Å; I56-L60 PolarHBondContact O-N 3.35Å; Y57-L60 PolarHBondContact O-N 3.18Å; Y57-L60 VanDerWaalsContact O-N 3.09Å; L60-Y63 WeakPolarHBondContact O-CB 3.33Å; L60-P340 HydrophobicContact CB-CB 4.45Å; L60-S344 VanDerWaalsContact O-CB 3.29Å; L60-S344 WeakPolarHBondContact O-CB 3.2Å; L60-L348 HydrophobicContact CD1-CD1 3.79Å; L60-L348 HydrophobicContact CD2-CB 4.44Å
61I86.1Confident89.6Confident45 Ų4536.5 Ų36.523%0.23119%0.191CC..Hα-helixtrans-74.9-33.2174.267.3-179.3000111.7Y57 L58Y57-I61 HydrophobicContact CD1-CD1 4.38Å; Y57-I61 HydrophobicContact CD1-CG2 4.36Å; Y57-I61 HydrophobicContact CD2-CG2 4.03Å; Y57-I61 HydrophobicContact CE1-CD1 3.9Å; Y57-I61 HydrophobicContact CE1-CG2 3.9Å; Y57-I61 HydrophobicContact CE2-CG2 3.53Å; Y57-I61 HydrophobicContact CG-CG2 4.42Å; Y57-I61 VanDerWaalsContact CZ-CG2 3.45Å; Y57-I61 WeakPolarHBondContact O-CG2 3.36Å; Y57-I61 PolarHBondContact O-N 3.22Å; L58-I61 HydrophobicContact CD2-CD1 3.84Å; L58-I61 WeakPolarHBondContact O-CG1 3.5Å
62N83.5Confident89.3Confident37 Ų3734.4 Ų34.420%0.19818%0.18CC..THydrogen-bonded Turntrans-103.352.4178.9-56.5-59.6000110.2L58 H59 T64 Q69 Y306 I307L58-N62 WeakPolarHBondContact O-CB 3.41Å; L58-N62 PolarHBondContact O-N 3.32Å; L58-N62 PolarHBondContact O-ND2 3.45Å; H59-N62 CarbonylContact O-C 3.35Å; N62-T64 VanDerWaalsContact C-N 3.35Å; N62-T64 PolarHBondContact O-N 3.09Å; N62-Q69 PolarHBondContact O-NE2 3.32Å; N62-Q69 PolarHBondContact O-OE1 3.07Å; N62-Y306 WeakPolarHBondContact O-CB 3.41Å; N62-I307 HydrophobicContact CB-CG1 4.1Å
63Y82.9Confident89.2Confident39 Ų3934.4 Ų34.415%0.15318%0.18CC..  trans-85.773.5-172.5-159.3-114.2000111.4H59 L60 P66 Q69 S347H59-Y63 PolarHBondContact O-N 2.87Å; L60-Y63 WeakPolarHBondContact O-CB 3.33Å; Y63-P66 HydrophobicContact CD1-CB 4.35Å; Y63-P66 HydrophobicContact CE1-CB 3.46Å; Y63-P66 VanDerWaalsContact CE1-CB 3.46Å; Y63-P66 VanDerWaalsContact CZ-CA 3.41Å; Y63-P66 WeakPolarHBondContact OH-CA 3.38Å; Y63-P66 VanDerWaalsContact OH-CB 3.23Å; Y63-P66 WeakPolarHBondContact OH-CB 3.31Å; Y63-P66 PolarHBondContact OH-O 3.5Å; Y63-Q69 VanDerWaalsContact CA-OE1 3.31Å; Y63-Q69 HydrophobicContact CD2-CB 3.93Å; Y63-Q69 HydrophobicContact CE2-CB 3.55Å; Y63-S347 VanDerWaalsContact CZ-CB 3.42Å; Y63-S347 VanDerWaalsContact OH-CB 3.27Å; Y63-S347 WeakPolarHBondContact OH-CB 3Å; Y63-S347 PolarHBondContact OH-OG 3.43Å
64T83.4Confident89.1Confident65 Ų6531.7 Ų31.740%0.39916%0.162SC..  trans-91.1-38.1-176.348.20000113.4N62 P66 Y306N62-T64 VanDerWaalsContact C-N 3.35Å; N62-T64 PolarHBondContact O-N 3.09Å; T64-P66 VanDerWaalsContact O-CD 3.3Å; T64-P66 WeakPolarHBondContact O-CD 3.44Å; T64-Y306 WeakPolarHBondContact CG2-O 3.43Å; T64-Y306 WeakPolarHBondContact OG1-CA 3.48Å; T64-Y306 WeakPolarHBondContact OG1-CB 3.41Å; T64-Y306 PolarHBondContact OG1-O 3.13Å
65C84.6Confident89Confident40 Ų4027.7 Ų27.727%0.2714%0.143SC..  trans-11882-177-68.60000110.1N67 E68 Q69 Y306C65-N67 VanDerWaalsContact C-N 3.28Å; C65-N67 PolarHBondContact O-N 2.75Å; C65-E68 PolarHBondContact O-N 3.36Å; C65-Q69 WeakPolarHBondContact O-CB 3.42Å; C65-Q69 WeakPolarHBondContact O-CG 3.41Å; C65-Q69 PolarHBondContact O-N 2.81Å; C65-Y306 HydrophobicContact CB-CD1 3.93Å; C65-Y306 HydrophobicContact CB-CE1 3.76Å
66P85.7Confident89Confident60 Ų6027.6 Ų27.639%0.3914%0.143SC..Hα-helixtrans-60.4-36.1-171.521.5-34000114.2Y63 T64 E68 R70Y63-P66 HydrophobicContact CD1-CB 4.35Å; Y63-P66 HydrophobicContact CE1-CB 3.46Å; Y63-P66 VanDerWaalsContact CE1-CB 3.46Å; Y63-P66 VanDerWaalsContact CZ-CA 3.41Å; Y63-P66 WeakPolarHBondContact OH-CA 3.38Å; Y63-P66 VanDerWaalsContact OH-CB 3.23Å; Y63-P66 WeakPolarHBondContact OH-CB 3.31Å; Y63-P66 PolarHBondContact OH-O 3.5Å; T64-P66 VanDerWaalsContact O-CD 3.3Å; T64-P66 WeakPolarHBondContact O-CD 3.44Å; P66-E68 VanDerWaalsContact C-N 3.34Å; P66-E68 PolarHBondContact O-N 3.29Å; P66-R70 VanDerWaalsContact O-CB 3.23Å; P66-R70 WeakPolarHBondContact O-CB 3.4Å; P66-R70 PolarHBondContact O-N 3.07Å; P66-R70 VanDerWaalsContact O-N 3.09Å
67N85.4Confident89.1Confident96 Ų9628.6 Ų28.651%0.51315%0.147SC..Hα-helixtrans-60.7-41.7-178.4-64.1-21.7000111.9C65 W71C65-N67 VanDerWaalsContact C-N 3.28Å; C65-N67 PolarHBondContact O-N 2.75Å; N67-W71 PolarHBondContact O-NE1 2.96Å
68E87.7Confident89.2Confident15 Ų1525.8 Ų25.87%0.0714%0.136CC..Hα-helixtrans-84.2-49.4178.5-59.5176.9179.500111.8C65 P66 R70 W71 V72 L120 E123 Y124 Y306 P406C65-E68 PolarHBondContact O-N 3.36Å; P66-E68 VanDerWaalsContact C-N 3.34Å; P66-E68 PolarHBondContact O-N 3.29Å; E68-R70 PolarHBondContact O-N 3.2Å; E68-W71 PolarHBondContact O-N 2.87Å; E68-V72 PolarHBondContact O-N 3.32Å; E68-L120 HydrophobicContact CB-CD1 4.14Å; E68-E123 HydrophobicContact CG-CB 4.44Å; E68-Y124 HydrophobicContact CB-CE1 4.23Å; E68-Y124 HydrophobicContact CG-CD1 4.03Å; E68-Y124 HydrophobicContact CG-CE1 4.04Å; E68-Y124 WeakPolarHBondContact OE2-CE1 3.2Å; E68-Y306 VanDerWaalsContact OE2-CE1 3.29Å; E68-Y306 WeakPolarHBondContact OE2-CE1 3.47Å; E68-Y306 PolarHBondContact OE2-OH 3.28Å; E68-P406 WeakPolarHBondContact OE1-CG 3.37Å
69Q89.2Confident89.4Confident0 Ų024.3 Ų24.30%013%0.128CC..Hα-helixtrans-64.3-28.8-171.3-70.4-178.6-7500112.1H59 N62 Y63 C65 W71 V72 V73 Y306H59-Q69 PolarHBondContact O-NE2 3.22Å; N62-Q69 PolarHBondContact O-NE2 3.32Å; N62-Q69 PolarHBondContact O-OE1 3.07Å; Y63-Q69 VanDerWaalsContact CA-OE1 3.31Å; Y63-Q69 HydrophobicContact CD2-CB 3.93Å; Y63-Q69 HydrophobicContact CE2-CB 3.55Å; C65-Q69 WeakPolarHBondContact O-CB 3.42Å; C65-Q69 WeakPolarHBondContact O-CG 3.41Å; C65-Q69 PolarHBondContact O-N 2.81Å; Q69-W71 VanDerWaalsContact C-N 3.31Å; Q69-W71 PolarHBondContact O-N 3.46Å; Q69-V72 PolarHBondContact O-N 3.41Å; Q69-V73 WeakPolarHBondContact O-CB 3.23Å; Q69-V73 VanDerWaalsContact O-CG2 3.26Å; Q69-V73 WeakPolarHBondContact O-CG2 3.49Å; Q69-V73 PolarHBondContact O-N 3.39Å; Q69-Y306 HydrophobicContact CG-CD1 3.73Å; Q69-Y306 HydrophobicContact CG-CD2 3.91Å; Q69-Y306 HydrophobicContact CG-CE1 3.65Å; Q69-Y306 HydrophobicContact CG-CE2 3.81Å; Q69-Y306 HydrophobicContact CG-CG 3.87Å; Q69-Y306 VanDerWaalsContact NE2-CG 3.32Å
70R90.6Very high89.7Confident46 Ų4625 Ų2517%0.17413%0.133CC..Hα-helixtrans-57.2-44.6172.8-176.4-178.3-179-158.30.2111.5P66 E68 R74 D350 D356P66-R70 VanDerWaalsContact O-CB 3.23Å; P66-R70 WeakPolarHBondContact O-CB 3.4Å; P66-R70 PolarHBondContact O-N 3.07Å; P66-R70 VanDerWaalsContact O-N 3.09Å; E68-R70 PolarHBondContact O-N 3.2Å; R70-R74 VanDerWaalsContact CZ-NH2 3.32Å; R70-R74 WeakPolarHBondContact O-CG 3.36Å; R70-R74 PolarHBondContact O-N 3.46Å; R70-R74 VanDerWaalsContact O-N 3.16Å; R70-D350 PolarHBondContact NE-O 3.01Å; R70-D350 PolarHBondContact NH2-O 3.28Å; R70-D356 IonicContact CZ-OD1 3.62Å; R70-D356 IonicContact CZ-OD2 2.95Å; R70-D356 IonicContact NE-OD2 3.82Å; R70-D356 IonicContact NH1-OD1 3.71Å; R70-D356 PolarHBondContact NH1-OD1 2.97Å; R70-D356 VanDerWaalsContact NH1-OD1 3.17Å; R70-D356 IonicContact NH1-OD2 3.17Å; R70-D356 PolarHBondContact NH1-OD2 3.41Å; R70-D356 VanDerWaalsContact NH2-CG 3.33Å; R70-D356 IonicContact NH2-OD1 3.17Å; R70-D356 PolarHBondContact NH2-OD1 3.12Å; R70-D356 IonicContact NH2-OD2 2.71Å; R70-D356 PolarHBondContact NH2-OD2 3.27Å
71W92Very high89.9Confident18 Ų1826.4 Ų26.47%0.06814%0.14CC..Hα-helixtrans-73.7-38.2177.9-58.4113.8000112.4N67 E68 Q69 V73 R74 I75 Y115 L120 D356N67-W71 PolarHBondContact O-NE1 2.96Å; E68-W71 PolarHBondContact O-N 2.87Å; Q69-W71 VanDerWaalsContact C-N 3.31Å; Q69-W71 PolarHBondContact O-N 3.46Å; W71-V73 VanDerWaalsContact C-N 3.33Å; W71-V73 PolarHBondContact O-N 2.79Å; W71-R74 WeakPolarHBondContact O-CB 3.45Å; W71-R74 PolarHBondContact O-N 3.5Å; W71-I75 WeakPolarHBondContact O-CG1 3.02Å; W71-I75 PolarHBondContact O-N 3.38Å; W71-Y115 AromaticContact CH2-CE1 3.73Å; W71-Y115 HydrophobicContact CH2-CE1 3.73Å; W71-Y115 HydrophobicContact CZ3-CD1 4.16Å; W71-Y115 AromaticContact CZ3-CE1 3.64Å; W71-Y115 HydrophobicContact CZ3-CE1 3.64Å; W71-L120 HydrophobicContact CB-CB 3.8Å; W71-L120 HydrophobicContact CB-CD1 4.1Å; W71-L120 HydrophobicContact CB-CG 4.45Å; W71-L120 HydrophobicContact CG-CB 4.41Å; W71-D356 HydrophobicContact CH2-CB 4.12Å
72V91.5Very high90.3Very high1 Ų124.4 Ų24.41%0.00613%0.129CC..Hα-helixtrans-57.8-48.6173.4175.70000110.2E68 Q69 R74 I75 L76 L120 F301E68-V72 PolarHBondContact O-N 3.32Å; Q69-V72 PolarHBondContact O-N 3.41Å; V72-R74 VanDerWaalsContact C-N 3.31Å; V72-R74 PolarHBondContact O-N 3.35Å; V72-I75 WeakPolarHBondContact O-CB 3.32Å; V72-I75 PolarHBondContact O-N 3.11Å; V72-L76 HydrophobicContact CG1-CD1 4.12Å; V72-L76 HydrophobicContact CG1-CG 4.3Å; V72-L76 WeakPolarHBondContact O-CG 3.26Å; V72-L76 PolarHBondContact O-N 2.83Å; V72-L120 HydrophobicContact CG2-CD1 3.92Å; V72-L120 HydrophobicContact CG2-CD2 3.83Å; V72-F301 HydrophobicContact CG1-CB 3.83Å; V72-F301 HydrophobicContact CG1-CD1 4.13Å; V72-F301 HydrophobicContact CG1-CG 4.09Å; V72-F301 HydrophobicContact CG2-CD1 4.14Å
73V93Very high90.8Very high1 Ų122.6 Ų22.61%0.00612%0.12CC..Hα-helixtrans-60.7-40178171.60000111.3I56 H59 Q69 W71 I75 L76 F77 T351I56-V73 HydrophobicContact CG2-CG1 4.05Å; H59-V73 HydrophobicContact CB-CG2 4.1Å; Q69-V73 WeakPolarHBondContact O-CB 3.23Å; Q69-V73 VanDerWaalsContact O-CG2 3.26Å; Q69-V73 WeakPolarHBondContact O-CG2 3.49Å; Q69-V73 PolarHBondContact O-N 3.39Å; W71-V73 VanDerWaalsContact C-N 3.33Å; W71-V73 PolarHBondContact O-N 2.79Å; V73-I75 VanDerWaalsContact C-N 3.34Å; V73-I75 PolarHBondContact O-N 2.98Å; V73-L76 PolarHBondContact O-N 2.96Å; V73-F77 HydrophobicContact CG1-CD2 3.78Å; V73-F77 HydrophobicContact CG1-CE2 3.45Å; V73-F77 VanDerWaalsContact CG1-CE2 3.45Å; V73-F77 HydrophobicContact CG1-CZ 4.5Å; V73-F77 WeakPolarHBondContact O-CD2 3.23Å; V73-F77 PolarHBondContact O-N 3.22Å; V73-T351 HydrophobicContact CB-CG2 4.4Å; V73-T351 HydrophobicContact CG1-CG2 3.82Å
74R93.3Very high91.4Very high1 Ų124.8 Ų24.80%0.00413%0.13CC..Hα-helixtrans-57.3-46171.7-72.1172.1170.4165.6-5111.5R70 W71 V72 L76 F77 Y109 F112 D350 T351 N353 D356R70-R74 VanDerWaalsContact CZ-NH2 3.32Å; R70-R74 WeakPolarHBondContact O-CG 3.36Å; R70-R74 PolarHBondContact O-N 3.46Å; R70-R74 VanDerWaalsContact O-N 3.16Å; W71-R74 WeakPolarHBondContact O-CB 3.45Å; W71-R74 PolarHBondContact O-N 3.5Å; V72-R74 VanDerWaalsContact C-N 3.31Å; V72-R74 PolarHBondContact O-N 3.35Å; R74-L76 VanDerWaalsContact C-N 3.35Å; R74-L76 PolarHBondContact O-N 3.45Å; R74-F77 PolarHBondContact O-N 3.17Å; R74-Y109 PolarHBondContact O-OH 3.47Å; R74-F112 HydrophobicContact CB-CE1 4.07Å; R74-F112 HydrophobicContact CG-CE1 3.87Å; R74-F112 HydrophobicContact CG-CZ 4.02Å; R74-D350 PolarHBondContact NH2-O 2.96Å; R74-T351 HydrophobicContact CB-CG2 4.27Å; R74-T351 HydrophobicContact CG-CG2 3.37Å; R74-T351 WeakPolarHBondContact CG-O 3.31Å; R74-T351 PolarHBondContact NE-O 3.08Å; R74-T351 PolarHBondContact NH2-O 2.98Å; R74-N353 PolarHBondContact NH2-O 3.45Å; R74-D356 IonicContact CZ-OD2 2.91Å; R74-D356 VanDerWaalsContact CZ-OD2 3.25Å; R74-D356 IonicContact NH1-OD2 2.77Å; R74-D356 PolarHBondContact NH1-OD2 3.25Å; R74-D356 IonicContact NH2-OD2 2.89Å; R74-D356 PolarHBondContact NH2-OD2 3.5Å
75I93Very high91.8Very high2 Ų223.2 Ų23.21%0.0112%0.119CC..Hα-helixtrans-64.2-41.7178.6-64.7161.1000111.2W71 V72 V73 F77 Y78 V113 F117 L120 V243 L297 F301W71-I75 WeakPolarHBondContact O-CG1 3.02Å; W71-I75 PolarHBondContact O-N 3.38Å; V72-I75 WeakPolarHBondContact O-CB 3.32Å; V72-I75 PolarHBondContact O-N 3.11Å; V73-I75 VanDerWaalsContact C-N 3.34Å; V73-I75 PolarHBondContact O-N 2.98Å; I75-F77 VanDerWaalsContact C-N 3.31Å; I75-F77 PolarHBondContact O-N 3.47Å; I75-Y78 WeakPolarHBondContact O-CB 3.34Å; I75-Y78 PolarHBondContact O-N 3.05Å; I75-Y78 VanDerWaalsContact O-N 3.13Å; I75-V113 HydrophobicContact CB-CG2 4.28Å; I75-V113 HydrophobicContact CG1-CG2 4.2Å; I75-V113 HydrophobicContact CG2-CG2 4.2Å; I75-F117 HydrophobicContact CD1-CB 4.09Å; I75-F117 HydrophobicContact CD1-CD2 4.05Å; I75-F117 HydrophobicContact CG1-CB 4.5Å; I75-L120 HydrophobicContact CD1-CB 4.42Å; I75-L120 HydrophobicContact CD1-CD2 3.7Å; I75-V243 HydrophobicContact CG2-CG2 3.89Å; I75-L297 HydrophobicContact CG2-CD2 4.17Å; I75-F301 HydrophobicContact CD1-CZ 4.36Å; I75-F301 HydrophobicContact CG2-CE2 4.14Å; I75-F301 HydrophobicContact CG2-CZ 4.49Å
76L94.1Very high92.2Very high0 Ų021.3 Ų21.30%011%0.106CC..Hα-helixtrans-63.9-34.7179.7-66.6179.5000112.7T52 Q55 I56 V72 V73 R74 Y78 V79 P80 L297T52-L76 HydrophobicContact CG2-CB 4.02Å; T52-L76 WeakPolarHBondContact CG2-O 3.2Å; Q55-L76 HydrophobicContact CB-CD1 4.47Å; Q55-L76 HydrophobicContact CG-CD1 3.82Å; Q55-L76 HydrophobicContact CG-CD2 4.48Å; I56-L76 HydrophobicContact CD1-CB 4.05Å; I56-L76 HydrophobicContact CG1-CB 3.68Å; I56-L76 HydrophobicContact CG1-CD1 3.95Å; I56-L76 HydrophobicContact CG1-CG 4.49Å; V72-L76 HydrophobicContact CG1-CD1 4.12Å; V72-L76 HydrophobicContact CG1-CG 4.3Å; V72-L76 WeakPolarHBondContact O-CG 3.26Å; V72-L76 PolarHBondContact O-N 2.83Å; V73-L76 PolarHBondContact O-N 2.96Å; R74-L76 VanDerWaalsContact C-N 3.35Å; R74-L76 PolarHBondContact O-N 3.45Å; L76-Y78 PolarHBondContact O-N 3.41Å; L76-V79 PolarHBondContact O-N 2.84Å; L76-P80 WeakPolarHBondContact O-CD 3.49Å; L76-L297 HydrophobicContact CD2-CB 3.86Å; L76-L297 HydrophobicContact CD2-CD1 4.28Å; L76-L297 HydrophobicContact CD2-CG 4.48Å
77F94.3Very high92.5Very high30 Ų3020.7 Ų20.713%0.13210%0.096CC..THydrogen-bonded Turntrans-62.1-12.8176-87-62.2000114.2I56 V73 R74 I75 V79 P80 I81 Y109 T351 F352I56-F77 HydrophobicContact CD1-CD1 3.88Å; I56-F77 HydrophobicContact CD1-CD2 4.32Å; I56-F77 HydrophobicContact CD1-CE1 3.84Å; I56-F77 HydrophobicContact CD1-CE2 4.3Å; I56-F77 HydrophobicContact CD1-CG 4.11Å; I56-F77 HydrophobicContact CD1-CZ 4.06Å; I56-F77 HydrophobicContact CG2-CZ 4.34Å; V73-F77 HydrophobicContact CG1-CD2 3.78Å; V73-F77 HydrophobicContact CG1-CE2 3.45Å; V73-F77 VanDerWaalsContact CG1-CE2 3.45Å; V73-F77 HydrophobicContact CG1-CZ 4.5Å; V73-F77 WeakPolarHBondContact O-CD2 3.23Å; V73-F77 PolarHBondContact O-N 3.22Å; R74-F77 PolarHBondContact O-N 3.17Å; I75-F77 VanDerWaalsContact C-N 3.31Å; I75-F77 PolarHBondContact O-N 3.47Å; F77-V79 PolarHBondContact O-N 3.41Å; F77-P80 WeakPolarHBondContact O-CD 3.2Å; F77-I81 HydrophobicContact CB-CD1 4.35Å; F77-I81 WeakPolarHBondContact O-CB 3.29Å; F77-I81 WeakPolarHBondContact O-CD1 3.41Å; F77-I81 VanDerWaalsContact O-CG1 3.27Å; F77-I81 WeakPolarHBondContact O-CG1 3.5Å; F77-I81 PolarHBondContact O-N 2.78Å; F77-Y109 HydrophobicContact CB-CE1 4.42Å; F77-Y109 WeakPolarHBondContact CB-OH 3.1Å; F77-T351 HydrophobicContact CD2-CG2 4Å; F77-T351 HydrophobicContact CE2-CG2 4.06Å; F77-F352 AromaticContact CD1-CZ 3.96Å; F77-F352 HydrophobicContact CD1-CZ 3.96Å; F77-F352 HydrophobicContact CD2-CE1 4.36Å; F77-F352 HydrophobicContact CD2-CE2 4.42Å; F77-F352 AromaticContact CD2-CZ 3.85Å; F77-F352 HydrophobicContact CD2-CZ 3.85Å; F77-F352 HydrophobicContact CE1-CE2 4.39Å; F77-F352 AromaticContact CE1-CZ 3.71Å; F77-F352 HydrophobicContact CE1-CZ 3.71Å; F77-F352 HydrophobicContact CE2-CE1 4.49Å; F77-F352 AromaticContact CE2-CE2 3.79Å; F77-F352 HydrophobicContact CE2-CE2 3.79Å; F77-F352 AromaticContact CE2-CZ 3.58Å; F77-F352 HydrophobicContact CE2-CZ 3.58Å; F77-F352 HydrophobicContact CG-CE1 4.4Å; F77-F352 HydrophobicContact CG-CZ 4.04Å; F77-F352 AromaticContact CZ-CE2 3.78Å; F77-F352 HydrophobicContact CZ-CE2 3.78Å; F77-F352 AromaticContact CZ-CZ 3.51Å; F77-F352 HydrophobicContact CZ-CZ 3.51Å
78Y93.6Very high92.8Very high4 Ų417.5 Ų17.52%0.0168%0.078CC..Hα-helixtrans-55.8-49.4173.1-173.4-90.5000112.2I75 L76 I81 Y82 Y109 V113 V246 V247 M290I75-Y78 WeakPolarHBondContact O-CB 3.34Å; I75-Y78 PolarHBondContact O-N 3.05Å; I75-Y78 VanDerWaalsContact O-N 3.13Å; L76-Y78 PolarHBondContact O-N 3.41Å; Y78-I81 PolarHBondContact O-N 3.19Å; Y78-Y82 HydrophobicContact CD1-CD2 4.16Å; Y78-Y82 HydrophobicContact CD1-CG 4.35Å; Y78-Y82 AromaticContact CD2-CD2 3.88Å; Y78-Y82 HydrophobicContact CD2-CD2 3.88Å; Y78-Y82 AromaticContact CD2-CE2 3.63Å; Y78-Y82 HydrophobicContact CD2-CE2 3.63Å; Y78-Y82 HydrophobicContact CE1-CD1 4.07Å; Y78-Y82 AromaticContact CE1-CD2 3.95Å; Y78-Y82 HydrophobicContact CE1-CD2 3.95Å; Y78-Y82 HydrophobicContact CE1-CE1 4.31Å; Y78-Y82 HydrophobicContact CE1-CE2 4.18Å; Y78-Y82 AromaticContact CE1-CG 3.9Å; Y78-Y82 HydrophobicContact CE1-CG 3.9Å; Y78-Y82 AromaticContact CE2-CD2 3.69Å; Y78-Y82 HydrophobicContact CE2-CD2 3.69Å; Y78-Y82 HydrophobicContact CE2-CE1 4.12Å; Y78-Y82 AromaticContact CE2-CE2 3.15Å; Y78-Y82 HydrophobicContact CE2-CE2 3.15Å; Y78-Y82 HydrophobicContact CE2-CG 4.35Å; Y78-Y82 AromaticContact CE2-CZ 3.4Å; Y78-Y82 VanDerWaalsContact CE2-CZ 3.4Å; Y78-Y82 HydrophobicContact CG-CD2 4.12Å; Y78-Y82 HydrophobicContact CG-CE2 4.34Å; Y78-Y82 AromaticContact CZ-CD1 3.87Å; Y78-Y82 AromaticContact CZ-CD2 3.74Å; Y78-Y82 AromaticContact CZ-CE1 3.64Å; Y78-Y82 AromaticContact CZ-CE2 3.49Å; Y78-Y82 VanDerWaalsContact CZ-CE2 3.49Å; Y78-Y82 AromaticContact CZ-CG 3.93Å; Y78-Y82 AromaticContact CZ-CZ 3.43Å; Y78-Y82 VanDerWaalsContact CZ-CZ 3.43Å; Y78-Y82 WeakPolarHBondContact O-CB 3.14Å; Y78-Y82 WeakPolarHBondContact O-CD2 3.34Å; Y78-Y82 PolarHBondContact O-N 3.48Å; Y78-Y82 WeakPolarHBondContact OH-CE1 3.12Å; Y78-Y82 VanDerWaalsContact OH-CZ 3.28Å; Y78-Y109 AromaticContact CD2-CD1 3.97Å; Y78-Y109 HydrophobicContact CD2-CD1 3.97Å; Y78-Y109 HydrophobicContact CD2-CE1 4.4Å; Y78-V113 HydrophobicContact CD2-CB 3.76Å; Y78-V113 HydrophobicContact CD2-CG1 3.59Å; Y78-V113 HydrophobicContact CD2-CG2 3.9Å; Y78-V113 HydrophobicContact CE2-CB 4.37Å; Y78-V113 HydrophobicContact CE2-CG1 3.74Å; Y78-V113 HydrophobicContact CG-CG2 4.24Å; Y78-V246 HydrophobicContact CD1-CG1 3.61Å; Y78-V246 HydrophobicContact CE1-CG1 3.19Å; Y78-V247 HydrophobicContact CE2-CG2 4.42Å; Y78-M290 HydrophobicContact CD1-SD 4.13Å; Y78-M290 HydrophobicContact CE1-CE 4.12Å; Y78-M290 HydrophobicContact CE1-SD 3.97Å
79V95.1Very high92.9Very high0 Ų016.8 Ų16.80%08%0.075CC..Hα-helixtrans-63.3-51.3-176.4163.70000112A48 T52 L76 F77 I81 Y82 A83 M290 A293 L297A48-V79 HydrophobicContact CB-CG1 4.05Å; T52-V79 HydrophobicContact CG2-CB 4.3Å; T52-V79 WeakPolarHBondContact OG1-CG1 3.44Å; L76-V79 PolarHBondContact O-N 2.84Å; F77-V79 PolarHBondContact O-N 3.41Å; V79-I81 VanDerWaalsContact C-N 3.33Å; V79-I81 PolarHBondContact O-N 3.16Å; V79-Y82 PolarHBondContact O-N 3.33Å; V79-A83 WeakPolarHBondContact O-CB 3.3Å; V79-A83 PolarHBondContact O-N 3.42Å; V79-M290 HydrophobicContact CG1-CB 4.28Å; V79-M290 HydrophobicContact CG2-SD 4.08Å; V79-A293 HydrophobicContact CG2-CB 3.8Å; V79-L297 HydrophobicContact CG2-CD1 3.54Å
80P95.3Very high92.9Very high15 Ų1517 Ų1710%0.0978%0.076CC..Hα-helixtrans-60-41178.5-27.334.8000113.9I49 T52 L76 F77 F84I49-P80 HydrophobicContact CG1-CB 4.22Å; I49-P80 HydrophobicContact CG2-CB 4.49Å; T52-P80 HydrophobicContact CG2-CG 3.86Å; L76-P80 WeakPolarHBondContact O-CD 3.49Å; F77-P80 WeakPolarHBondContact O-CD 3.2Å; P80-F84 WeakPolarHBondContact O-CB 3.37Å; P80-F84 PolarHBondContact O-N 2.74Å
81I93.9Very high92.8Very high39 Ų3917.7 Ų17.720%0.28%0.083CC..Hα-helixtrans-65.1-51.9179.4-68.6169.4000109.8F77 Y78 V79 F84 E85 Y109F77-I81 HydrophobicContact CB-CD1 4.35Å; F77-I81 WeakPolarHBondContact O-CB 3.29Å; F77-I81 WeakPolarHBondContact O-CD1 3.41Å; F77-I81 VanDerWaalsContact O-CG1 3.27Å; F77-I81 WeakPolarHBondContact O-CG1 3.5Å; F77-I81 PolarHBondContact O-N 2.78Å; Y78-I81 PolarHBondContact O-N 3.19Å; V79-I81 VanDerWaalsContact C-N 3.33Å; V79-I81 PolarHBondContact O-N 3.16Å; I81-F84 PolarHBondContact O-N 3.31Å; I81-E85 HydrophobicContact CG2-CG 4.29Å; I81-E85 VanDerWaalsContact O-CB 3.27Å; I81-E85 WeakPolarHBondContact O-CB 3.2Å; I81-E85 VanDerWaalsContact O-CG 3.22Å; I81-E85 WeakPolarHBondContact O-CG 3.42Å; I81-E85 PolarHBondContact O-N 2.6Å; I81-Y109 HydrophobicContact CD1-CD1 3.94Å; I81-Y109 HydrophobicContact CD1-CD2 3.58Å; I81-Y109 HydrophobicContact CD1-CE1 3.85Å; I81-Y109 HydrophobicContact CD1-CE2 3.45Å; I81-Y109 VanDerWaalsContact CD1-CE2 3.45Å; I81-Y109 HydrophobicContact CD1-CG 3.82Å; I81-Y109 HydrophobicContact CG2-CG 4.46Å
82Y93.6Very high92.4Very high3 Ų320.8 Ų20.81%0.01210%0.097CC..Hα-helixtrans-65.6-42.4-178.7-88.4-113.7000112.5Y78 V79 S86 R106 E110 I286 M290Y78-Y82 HydrophobicContact CD1-CD2 4.16Å; Y78-Y82 HydrophobicContact CD1-CG 4.35Å; Y78-Y82 AromaticContact CD2-CD2 3.88Å; Y78-Y82 HydrophobicContact CD2-CD2 3.88Å; Y78-Y82 AromaticContact CD2-CE2 3.63Å; Y78-Y82 HydrophobicContact CD2-CE2 3.63Å; Y78-Y82 HydrophobicContact CE1-CD1 4.07Å; Y78-Y82 AromaticContact CE1-CD2 3.95Å; Y78-Y82 HydrophobicContact CE1-CD2 3.95Å; Y78-Y82 HydrophobicContact CE1-CE1 4.31Å; Y78-Y82 HydrophobicContact CE1-CE2 4.18Å; Y78-Y82 AromaticContact CE1-CG 3.9Å; Y78-Y82 HydrophobicContact CE1-CG 3.9Å; Y78-Y82 AromaticContact CE2-CD2 3.69Å; Y78-Y82 HydrophobicContact CE2-CD2 3.69Å; Y78-Y82 HydrophobicContact CE2-CE1 4.12Å; Y78-Y82 AromaticContact CE2-CE2 3.15Å; Y78-Y82 HydrophobicContact CE2-CE2 3.15Å; Y78-Y82 HydrophobicContact CE2-CG 4.35Å; Y78-Y82 AromaticContact CE2-CZ 3.4Å; Y78-Y82 VanDerWaalsContact CE2-CZ 3.4Å; Y78-Y82 HydrophobicContact CG-CD2 4.12Å; Y78-Y82 HydrophobicContact CG-CE2 4.34Å; Y78-Y82 AromaticContact CZ-CD1 3.87Å; Y78-Y82 AromaticContact CZ-CD2 3.74Å; Y78-Y82 AromaticContact CZ-CE1 3.64Å; Y78-Y82 AromaticContact CZ-CE2 3.49Å; Y78-Y82 VanDerWaalsContact CZ-CE2 3.49Å; Y78-Y82 AromaticContact CZ-CG 3.93Å; Y78-Y82 AromaticContact CZ-CZ 3.43Å; Y78-Y82 VanDerWaalsContact CZ-CZ 3.43Å; Y78-Y82 WeakPolarHBondContact O-CB 3.14Å; Y78-Y82 WeakPolarHBondContact O-CD2 3.34Å; Y78-Y82 PolarHBondContact O-N 3.48Å; Y78-Y82 WeakPolarHBondContact OH-CE1 3.12Å; Y78-Y82 VanDerWaalsContact OH-CZ 3.28Å; V79-Y82 PolarHBondContact O-N 3.33Å; Y82-S86 WeakPolarHBondContact O-CB 3.18Å; Y82-S86 PolarHBondContact O-N 3.01Å; Y82-S86 PolarHBondContact O-OG 3.25Å; Y82-R106 VanDerWaalsContact CD1-CD 3.43Å; Y82-R106 HydrophobicContact CD1-CG 3.58Å; Y82-R106 HydrophobicContact CD2-CG 3.65Å; Y82-R106 HydrophobicContact CE1-CG 3.45Å; Y82-R106 VanDerWaalsContact CE1-CG 3.45Å; Y82-R106 HydrophobicContact CE2-CG 3.53Å; Y82-R106 WeakPolarHBondContact CE2-O 3.5Å; Y82-R106 HydrophobicContact CG-CG 3.66Å; Y82-R106 VanDerWaalsContact CZ-CG 3.43Å; Y82-R106 PolarHBondContact OH-O 3.38Å; Y82-E110 VanDerWaalsContact OH-CB 3.23Å; Y82-E110 WeakPolarHBondContact OH-CB 3.37Å; Y82-I286 HydrophobicContact CD1-CG2 4.18Å; Y82-M290 VanDerWaalsContact CB-SD 3.59Å; Y82-M290 HydrophobicContact CG-SD 4.36Å
83A95.2Very high91.7Very high0 Ų021 Ų210%010%0.098CC..Hα-helixtrans-62.9-45.2179.200000111.6A45 I49 V79 W87 M290A45-A83 HydrophobicContact CB-CB 4.04Å; I49-A83 HydrophobicContact CD1-CB 4.34Å; I49-A83 HydrophobicContact CG1-CB 4.09Å; V79-A83 WeakPolarHBondContact O-CB 3.3Å; V79-A83 PolarHBondContact O-N 3.42Å; A83-W87 VanDerWaalsContact O-CB 3.3Å; A83-W87 WeakPolarHBondContact O-CB 3.23Å; A83-W87 PolarHBondContact O-N 2.85Å; A83-W87 VanDerWaalsContact O-N 3.13Å; A83-M290 HydrophobicContact CB-CB 3.92Å; A83-M290 HydrophobicContact CB-CG 4.17Å
84F94.5Very high90.5Very high85 Ų8526.2 Ų26.237%0.37312%0.121SC..Hα-helixtrans-69.3-50.1-179.6-177.6-105000112I49 P80 I81 S86 W87 L88I49-F84 HydrophobicContact CD1-CB 4.05Å; P80-F84 WeakPolarHBondContact O-CB 3.37Å; P80-F84 PolarHBondContact O-N 2.74Å; I81-F84 PolarHBondContact O-N 3.31Å; F84-S86 PolarHBondContact O-N 2.94Å; F84-W87 HydrophobicContact CD2-CE3 4.15Å; F84-W87 HydrophobicContact CD2-CZ3 4.33Å; F84-W87 HydrophobicContact CE2-CE3 4.2Å; F84-W87 AromaticContact CE2-CZ3 3.97Å; F84-W87 HydrophobicContact CE2-CZ3 3.97Å; F84-W87 PolarHBondContact O-N 3.38Å; F84-L88 HydrophobicContact CE1-CD2 4.07Å; F84-L88 HydrophobicContact CZ-CD2 4.42Å; F84-L88 WeakPolarHBondContact O-CB 3.4Å; F84-L88 PolarHBondContact O-N 3.48Å
85E92.7Very high89.3Confident32 Ų3231.4 Ų31.415%0.1515%0.145CC..Hα-helixtrans-64.7-40.3-178.5-68.6-66.6161.100111.7I81 L88 S89 F102 R106I81-E85 HydrophobicContact CG2-CG 4.29Å; I81-E85 VanDerWaalsContact O-CB 3.27Å; I81-E85 WeakPolarHBondContact O-CB 3.2Å; I81-E85 VanDerWaalsContact O-CG 3.22Å; I81-E85 WeakPolarHBondContact O-CG 3.42Å; I81-E85 PolarHBondContact O-N 2.6Å; E85-L88 PolarHBondContact O-N 3.39Å; E85-S89 VanDerWaalsContact O-CB 3.23Å; E85-S89 WeakPolarHBondContact O-CB 3.28Å; E85-S89 PolarHBondContact O-N 3.48Å; E85-F102 WeakPolarHBondContact OE2-CB 3.33Å; E85-F102 WeakPolarHBondContact OE2-CD1 3.41Å; E85-R106 HydrophobicContact CB-CB 4.17Å; E85-R106 HydrophobicContact CG-CB 4.48Å
86S92.1Very high88Confident0 Ų036.9 Ų36.90%017%0.17CC..Hα-helixtrans-67.4-39.1175.7-78.60000112.9Y82 F84 S89 L90 R106 N283 I286Y82-S86 WeakPolarHBondContact O-CB 3.18Å; Y82-S86 PolarHBondContact O-N 3.01Å; Y82-S86 PolarHBondContact O-OG 3.25Å; F84-S86 PolarHBondContact O-N 2.94Å; S86-S89 WeakPolarHBondContact O-CB 3.38Å; S86-S89 PolarHBondContact O-N 2.94Å; S86-L90 WeakPolarHBondContact O-CG 3.44Å; S86-L90 PolarHBondContact O-N 3.23Å; S86-L90 VanDerWaalsContact O-N 3.09Å; S86-R106 PolarHBondContact OG-NH1 2.92Å; S86-N283 WeakPolarHBondContact CA-OD1 3.46Å; S86-N283 WeakPolarHBondContact CB-OD1 3.47Å; S86-N283 PolarHBondContact OG-OD1 2.99Å; S86-I286 VanDerWaalsContact OG-CG2 3.28Å; S86-I286 WeakPolarHBondContact OG-CG2 3.02Å
87W93.4Very high86.7Confident47 Ų4740 Ų4018%0.17819%0.187CC..Hα-helixtrans-64.3-42.2173.1172.363.1000111.7Q38 G42 A45 F46 A83 F84 S89 L90 L91Q38-W87 PolarHBondContact O-NE1 3.47Å; G42-W87 VanDerWaalsContact CA-NE1 3.26Å; A45-W87 HydrophobicContact CB-CB 4.08Å; F46-W87 HydrophobicContact CE2-CD2 4.29Å; F46-W87 AromaticContact CE2-CE3 3.98Å; F46-W87 HydrophobicContact CE2-CE3 3.98Å; F46-W87 AromaticContact CE2-CH2 3.56Å; F46-W87 HydrophobicContact CE2-CH2 3.56Å; F46-W87 AromaticContact CE2-CZ2 3.88Å; F46-W87 HydrophobicContact CE2-CZ2 3.88Å; F46-W87 AromaticContact CE2-CZ3 3.61Å; F46-W87 HydrophobicContact CE2-CZ3 3.61Å; F46-W87 HydrophobicContact CZ-CE3 4.17Å; F46-W87 AromaticContact CZ-CH2 3.83Å; F46-W87 HydrophobicContact CZ-CH2 3.83Å; F46-W87 AromaticContact CZ-CZ3 3.59Å; F46-W87 HydrophobicContact CZ-CZ3 3.59Å; A83-W87 VanDerWaalsContact O-CB 3.3Å; A83-W87 WeakPolarHBondContact O-CB 3.23Å; A83-W87 PolarHBondContact O-N 2.85Å; A83-W87 VanDerWaalsContact O-N 3.13Å; F84-W87 HydrophobicContact CD2-CE3 4.15Å; F84-W87 HydrophobicContact CD2-CZ3 4.33Å; F84-W87 HydrophobicContact CE2-CE3 4.2Å; F84-W87 AromaticContact CE2-CZ3 3.97Å; F84-W87 HydrophobicContact CE2-CZ3 3.97Å; F84-W87 PolarHBondContact O-N 3.38Å; W87-S89 VanDerWaalsContact C-N 3.34Å; W87-S89 PolarHBondContact O-N 3.1Å; W87-L90 WeakPolarHBondContact O-CB 3.14Å; W87-L90 PolarHBondContact O-N 3.13Å; W87-L91 HydrophobicContact CD2-CD1 4.3Å; W87-L91 HydrophobicContact CH2-CD1 3.96Å; W87-L91 HydrophobicContact CZ2-CD1 3.69Å; W87-L91 HydrophobicContact CZ3-CD1 4.36Å; W87-L91 PolarHBondContact O-N 2.83Å
88L91.5Very high85.7Confident29 Ų2944.8 Ų44.815%0.15221%0.205CC..Hα-helixtrans-63.3-42.2176.7-165.160.9000111.4F84 E85 L90 L91 F92 F102F84-L88 HydrophobicContact CE1-CD2 4.07Å; F84-L88 HydrophobicContact CZ-CD2 4.42Å; F84-L88 WeakPolarHBondContact O-CB 3.4Å; F84-L88 PolarHBondContact O-N 3.48Å; E85-L88 PolarHBondContact O-N 3.39Å; L88-L90 VanDerWaalsContact C-N 3.3Å; L88-L90 PolarHBondContact O-N 3.23Å; L88-L91 HydrophobicContact CD1-CD1 4.37Å; L88-L91 WeakPolarHBondContact O-CB 3.12Å; L88-L91 PolarHBondContact O-N 2.52Å; L88-L91 VanDerWaalsContact O-N 3.07Å; L88-F92 HydrophobicContact CD1-CD2 3.96Å; L88-F92 HydrophobicContact CD1-CE2 3.57Å; L88-F92 HydrophobicContact CG-CD2 4.04Å; L88-F92 HydrophobicContact CG-CE2 4.04Å; L88-F92 WeakPolarHBondContact O-CD2 3.48Å; L88-F92 PolarHBondContact O-N 3.44Å; L88-F92 VanDerWaalsContact O-N 3.16Å; L88-F102 HydrophobicContact CD2-CD1 3.73Å; L88-F102 HydrophobicContact CD2-CE1 3.25Å; L88-F102 HydrophobicContact CD2-CE2 4.49Å; L88-F102 HydrophobicContact CD2-CZ 3.69Å; L88-F102 HydrophobicContact CG-CD1 4.27Å; L88-F102 HydrophobicContact CG-CE1 3.87Å; L88-F102 HydrophobicContact CG-CE2 4.23Å; L88-F102 HydrophobicContact CG-CZ 3.84Å
89S89.4Confident85Confident0 Ų044.8 Ų44.80%021%0.205CC..Hα-helixtrans-55.6-43.1173.7-169.20000111.5E85 S86 W87 L91 F92 L93 Y99 N283E85-S89 VanDerWaalsContact O-CB 3.23Å; E85-S89 WeakPolarHBondContact O-CB 3.28Å; E85-S89 PolarHBondContact O-N 3.48Å; S86-S89 WeakPolarHBondContact O-CB 3.38Å; S86-S89 PolarHBondContact O-N 2.94Å; W87-S89 VanDerWaalsContact C-N 3.34Å; W87-S89 PolarHBondContact O-N 3.1Å; S89-L91 PolarHBondContact O-N 2.76Å; S89-F92 PolarHBondContact O-N 2.93Å; S89-L93 WeakPolarHBondContact O-CG 3.45Å; S89-L93 PolarHBondContact O-N 2.74Å; S89-L93 VanDerWaalsContact O-N 3.17Å; S89-Y99 WeakPolarHBondContact OG-CB 3.45Å; S89-N283 PolarHBondContact OG-ND2 3.23Å; S89-N283 VanDerWaalsContact OG-ND2 3.07Å
90L89Confident84.2Confident3 Ų345.2 Ų45.22%0.01621%0.208CC..Hα-helixtrans-64.1-34.4174.6-68.8173.9000114.1Q38 T41 S86 W87 L88 F92 L93 G280 N283 F284Q38-L90 PolarHBondContact NE2-O 2.83Å; Q38-L90 VanDerWaalsContact NE2-O 3.15Å; T41-L90 HydrophobicContact CG2-CD1 3.85Å; S86-L90 WeakPolarHBondContact O-CG 3.44Å; S86-L90 PolarHBondContact O-N 3.23Å; S86-L90 VanDerWaalsContact O-N 3.09Å; W87-L90 WeakPolarHBondContact O-CB 3.14Å; W87-L90 PolarHBondContact O-N 3.13Å; L88-L90 VanDerWaalsContact C-N 3.3Å; L88-L90 PolarHBondContact O-N 3.23Å; L90-F92 VanDerWaalsContact C-N 3.34Å; L90-L93 HydrophobicContact CD2-CD1 3.79Å; L90-G280 VanDerWaalsContact CD2-O 3.29Å; L90-G280 WeakPolarHBondContact CD2-O 3.38Å; L90-N283 HydrophobicContact CD2-CB 3.81Å; L90-N283 HydrophobicContact CG-CB 3.89Å; L90-F284 HydrophobicContact CD1-CB 4.37Å; L90-F284 HydrophobicContact CD2-CB 4.36Å
91L87.6Confident83.5Confident62 Ų6249.8 Ų49.833%0.32522%0.224SC..Hα-helixtrans-69.1-35.5177.7-67.2179.3000111.9Q38 W87 L88 S89Q38-L91 HydrophobicContact CB-CD2 4.05Å; Q38-L91 HydrophobicContact CG-CD2 4.23Å; W87-L91 HydrophobicContact CD2-CD1 4.3Å; W87-L91 HydrophobicContact CH2-CD1 3.96Å; W87-L91 HydrophobicContact CZ2-CD1 3.69Å; W87-L91 HydrophobicContact CZ3-CD1 4.36Å; W87-L91 PolarHBondContact O-N 2.83Å; L88-L91 HydrophobicContact CD1-CD1 4.37Å; L88-L91 WeakPolarHBondContact O-CB 3.12Å; L88-L91 PolarHBondContact O-N 2.52Å; L88-L91 VanDerWaalsContact O-N 3.07Å; S89-L91 PolarHBondContact O-N 2.76Å
92F83.6Confident83.1Confident82 Ų8250.1 Ų50.136%0.3622%0.224SC..SBendtrans-96.78.3-176.4-72.3-73.8000114.8L88 S89 L90 K94 H95 F102L88-F92 HydrophobicContact CD1-CD2 3.96Å; L88-F92 HydrophobicContact CD1-CE2 3.57Å; L88-F92 HydrophobicContact CG-CD2 4.04Å; L88-F92 HydrophobicContact CG-CE2 4.04Å; L88-F92 WeakPolarHBondContact O-CD2 3.48Å; L88-F92 PolarHBondContact O-N 3.44Å; L88-F92 VanDerWaalsContact O-N 3.16Å; S89-F92 PolarHBondContact O-N 2.93Å; L90-F92 VanDerWaalsContact C-N 3.34Å; F92-K94 PolarHBondContact O-N 3.27Å; F92-H95 PolarHBondContact O-N 2.85Å; F92-F102 HydrophobicContact CB-CE2 4.08Å; F92-F102 AromaticContact CD2-CE2 3.64Å; F92-F102 HydrophobicContact CD2-CE2 3.64Å; F92-F102 AromaticContact CD2-CZ 3.9Å; F92-F102 HydrophobicContact CD2-CZ 3.9Å; F92-F102 HydrophobicContact CE2-CE2 4.39Å; F92-F102 HydrophobicContact CE2-CZ 4.2Å; F92-F102 HydrophobicContact CG-CE2 4.06Å
93L77.9Confident82.5Confident5 Ų550.8 Ų50.83%0.02623%0.227CC..THydrogen-bonded Turntrans-52.6-29.4175.8-76.5174.2000113.8S89 L90 H95 T276S89-L93 WeakPolarHBondContact O-CG 3.45Å; S89-L93 PolarHBondContact O-N 2.74Å; S89-L93 VanDerWaalsContact O-N 3.17Å; L90-L93 HydrophobicContact CD2-CD1 3.79Å; L93-H95 VanDerWaalsContact C-N 3.3Å; L93-H95 PolarHBondContact O-N 3.42Å; L93-T276 HydrophobicContact CD2-CG2 4.29Å
94K67.5Low82Confident111 Ų11151.3 Ų51.348%0.48323%0.231SC..THydrogen-bonded Turntrans-72.4-17.6-179.5-66.1-166.5178.8-118.30114.5E33 F92E33-K94 IonicContact OE1-NZ 3.15Å; E33-K94 WeakPolarHBondContact OE2-CE 3.38Å; E33-K94 IonicContact OE2-NZ 3.23Å; E33-K94 PolarHBondContact OE2-NZ 2.83Å; F92-K94 PolarHBondContact O-N 3.27Å
95H68.5Low81.4Confident110 Ų11051.4 Ų51.451%0.50924%0.239SC..SBendtrans-101.9100.8176.4-65.5-2.5000106.3F92 L93 D97 Y98F92-H95 PolarHBondContact O-N 2.85Å; L93-H95 VanDerWaalsContact C-N 3.3Å; L93-H95 PolarHBondContact O-N 3.42Å; H95-D97 PolarHBondContact O-N 3.5Å; H95-Y98 HydrophobicContact CB-CD2 3.41Å; H95-Y98 VanDerWaalsContact CB-CD2 3.41Å; H95-Y98 HydrophobicContact CB-CE2 3.9Å; H95-Y98 HydrophobicContact CB-CG 4.37Å; H95-Y98 PolarHBondContact O-N 3.46Å
96E64.3Low81.1Confident118 Ų11850.2 Ų50.255%0.55123%0.233SC*.THydrogen-bonded Turntrans-48.5-15.3-149.6-70.6177.9175.900117.6
97D67.1Low80.7Confident65 Ų6552.2 Ų52.235%0.34824%0.244SC..THydrogen-bonded Turntrans-135.74.4-178.9-62.6-54000115.8H95 Y99 V100 Q186H95-D97 PolarHBondContact O-N 3.5Å; D97-Y99 VanDerWaalsContact C-N 3.3Å; D97-Y99 PolarHBondContact O-N 3Å; D97-V100 PolarHBondContact O-N 3.2Å; D97-Q186 VanDerWaalsContact CG-NE2 3.33Å; D97-Q186 PolarHBondContact OD1-NE2 3.36Å
98Y74.1Confident80.4Confident131 Ų13152.1 Ų52.151%0.51425%0.25SC..THydrogen-bonded Turntrans-70.4-27.5-176.4-80.1-90.7000113.5H95 V100 Y101 F102H95-Y98 HydrophobicContact CB-CD2 3.41Å; H95-Y98 VanDerWaalsContact CB-CD2 3.41Å; H95-Y98 HydrophobicContact CB-CE2 3.9Å; H95-Y98 HydrophobicContact CB-CG 4.37Å; H95-Y98 PolarHBondContact O-N 3.46Å; Y98-V100 PolarHBondContact O-N 3.37Å; Y98-Y101 HydrophobicContact CD1-CD2 4.49Å; Y98-Y101 PolarHBondContact O-N 3.12Å; Y98-Y101 VanDerWaalsContact O-N 3.12Å; Y98-F102 WeakPolarHBondContact O-CD2 3.17Å
99Y78.7Confident80.4Confident3 Ų352 Ų521%0.01225%0.247CC..Hα-helixtrans-57.6-32.8179.376.2-89.4000112.4S89 D97 Y101 F102 D103 H193 T276 A279S89-Y99 WeakPolarHBondContact OG-CB 3.45Å; D97-Y99 VanDerWaalsContact C-N 3.3Å; D97-Y99 PolarHBondContact O-N 3Å; Y99-Y101 VanDerWaalsContact C-N 3.25Å; Y99-Y101 PolarHBondContact O-N 3.22Å; Y99-F102 PolarHBondContact O-N 3.33Å; Y99-D103 WeakPolarHBondContact O-CB 3.26Å; Y99-D103 VanDerWaalsContact O-CG 3.3Å; Y99-D103 PolarHBondContact O-N 3.49Å; Y99-H193 WeakPolarHBondContact OH-CB 3.32Å; Y99-T276 HydrophobicContact CD1-CG2 4.43Å; Y99-T276 HydrophobicContact CE1-CG2 4.13Å; Y99-A279 HydrophobicContact CD2-CB 3.72Å; Y99-A279 HydrophobicContact CE2-CB 3.46Å; Y99-A279 VanDerWaalsContact CE2-CB 3.46Å
100V78.2Confident80.4Confident9 Ų952.4 Ų52.46%0.05525%0.249CC..Hα-helixtrans-61.7-33.4-179.9-178.20000111.6D97 Y98 S104 T182D97-V100 PolarHBondContact O-N 3.2Å; Y98-V100 PolarHBondContact O-N 3.37Å; V100-S104 VanDerWaalsContact O-CB 3.27Å; V100-S104 WeakPolarHBondContact O-CB 3.3Å; V100-S104 PolarHBondContact O-N 3.03Å; V100-S104 PolarHBondContact O-OG 3.47Å; V100-T182 HydrophobicContact CG1-CG2 4.07Å
101Y81.3Confident80.4Confident112 Ų11252.3 Ų52.344%0.43925%0.249SC..Hα-helixtrans-71.4-45.2178.4-64.2-80.3000111.8Y98 Y99 S104 V105 I183Y98-Y101 HydrophobicContact CD1-CD2 4.49Å; Y98-Y101 PolarHBondContact O-N 3.12Å; Y98-Y101 VanDerWaalsContact O-N 3.12Å; Y99-Y101 VanDerWaalsContact C-N 3.25Å; Y99-Y101 PolarHBondContact O-N 3.22Å; Y101-S104 WeakPolarHBondContact O-CB 3.47Å; Y101-S104 PolarHBondContact O-N 3.2Å; Y101-V105 PolarHBondContact O-N 3.11Å; Y101-V105 VanDerWaalsContact O-N 3.16Å; Y101-I183 HydrophobicContact CD1-CD1 4.43Å; Y101-I183 HydrophobicContact CD1-CG1 4.44Å; Y101-I183 HydrophobicContact CE1-CG1 4.46Å; Y101-I183 HydrophobicContact CE1-CG2 3.99Å
102F84.1Confident80.5Confident45 Ų4550.6 Ų50.620%0.19724%0.239CC..Hα-helixtrans-63.6-45.8176.8-61.9-58.5000111E85 L88 F92 Y98 Y99 S104 V105 R106E85-F102 WeakPolarHBondContact OE2-CB 3.33Å; E85-F102 WeakPolarHBondContact OE2-CD1 3.41Å; L88-F102 HydrophobicContact CD2-CD1 3.73Å; L88-F102 HydrophobicContact CD2-CE1 3.25Å; L88-F102 HydrophobicContact CD2-CE2 4.49Å; L88-F102 HydrophobicContact CD2-CZ 3.69Å; L88-F102 HydrophobicContact CG-CD1 4.27Å; L88-F102 HydrophobicContact CG-CE1 3.87Å; L88-F102 HydrophobicContact CG-CE2 4.23Å; L88-F102 HydrophobicContact CG-CZ 3.84Å; F92-F102 HydrophobicContact CB-CE2 4.08Å; F92-F102 AromaticContact CD2-CE2 3.64Å; F92-F102 HydrophobicContact CD2-CE2 3.64Å; F92-F102 AromaticContact CD2-CZ 3.9Å; F92-F102 HydrophobicContact CD2-CZ 3.9Å; F92-F102 HydrophobicContact CE2-CE2 4.39Å; F92-F102 HydrophobicContact CE2-CZ 4.2Å; F92-F102 HydrophobicContact CG-CE2 4.06Å; Y98-F102 WeakPolarHBondContact O-CD2 3.17Å; Y99-F102 PolarHBondContact O-N 3.33Å; F102-S104 VanDerWaalsContact C-N 3.29Å; F102-S104 PolarHBondContact O-N 3.09Å; F102-V105 PolarHBondContact O-N 3.42Å; F102-R106 WeakPolarHBondContact O-CB 3.3Å; F102-R106 PolarHBondContact O-N 3.3Å
103D82Confident80.9Confident17 Ų1746.8 Ų46.89%0.09122%0.222CC..Hα-helixtrans-59-41.9175.2-72.8-9.9000110.8Y99 V105 R106 D107 N283Y99-D103 WeakPolarHBondContact O-CB 3.26Å; Y99-D103 VanDerWaalsContact O-CG 3.3Å; Y99-D103 PolarHBondContact O-N 3.49Å; D103-V105 PolarHBondContact O-N 2.91Å; D103-R106 PolarHBondContact O-N 2.77Å; D103-R106 IonicContact OD1-CZ 3.25Å; D103-R106 VanDerWaalsContact OD1-CZ 3.23Å; D103-R106 IonicContact OD1-NH1 2.74Å; D103-R106 PolarHBondContact OD1-NH1 2.92Å; D103-R106 VanDerWaalsContact OD1-NH1 3.15Å; D103-R106 IonicContact OD1-NH2 2.76Å; D103-R106 PolarHBondContact OD1-NH2 2.93Å; D103-R106 IonicContact OD2-NH2 2.78Å; D103-D107 WeakPolarHBondContact O-CB 3.36Å; D103-D107 PolarHBondContact O-N 2.94Å; D103-D107 VanDerWaalsContact O-OD1 3.08Å; D103-N283 PolarHBondContact OD1-ND2 3.44Å; D103-N283 PolarHBondContact OD1-OD1 2.72Å
104S83.3Confident81.5Confident11 Ų1146.7 Ų46.78%0.07722%0.222CC..Hα-helixtrans-61.9-39.7178.5-66.60000113.8V100 Y101 F102 C108V100-S104 VanDerWaalsContact O-CB 3.27Å; V100-S104 WeakPolarHBondContact O-CB 3.3Å; V100-S104 PolarHBondContact O-N 3.03Å; V100-S104 PolarHBondContact O-OG 3.47Å; Y101-S104 WeakPolarHBondContact O-CB 3.47Å; Y101-S104 PolarHBondContact O-N 3.2Å; F102-S104 VanDerWaalsContact C-N 3.29Å; F102-S104 PolarHBondContact O-N 3.09Å; S104-C108 PolarHBondContact O-N 3.1Å; S104-C108 PolarHBondContact O-SG 3.06Å
105V82.6Confident82.6Confident88 Ų8841.6 Ų41.653%0.53320%0.2SC..Hα-helixtrans-69.4-49178.1172.30000110.3Y101 F102 D103 D107 C108Y101-V105 PolarHBondContact O-N 3.11Å; Y101-V105 VanDerWaalsContact O-N 3.16Å; F102-V105 PolarHBondContact O-N 3.42Å; D103-V105 PolarHBondContact O-N 2.91Å; V105-D107 VanDerWaalsContact C-N 3.28Å; V105-D107 PolarHBondContact O-N 3.06Å; V105-C108 PolarHBondContact O-N 3.27Å
106R87.4Confident83.7Confident7 Ų736.4 Ų36.43%0.02618%0.175CC..Hα-helixtrans-54.3-47.9175.9178.7-170.170-155.8-10.4111Y82 E85 S86 F102 D103 C108 Y109 E110 N283Y82-R106 VanDerWaalsContact CD1-CD 3.43Å; Y82-R106 HydrophobicContact CD1-CG 3.58Å; Y82-R106 HydrophobicContact CD2-CG 3.65Å; Y82-R106 HydrophobicContact CE1-CG 3.45Å; Y82-R106 VanDerWaalsContact CE1-CG 3.45Å; Y82-R106 HydrophobicContact CE2-CG 3.53Å; Y82-R106 WeakPolarHBondContact CE2-O 3.5Å; Y82-R106 HydrophobicContact CG-CG 3.66Å; Y82-R106 VanDerWaalsContact CZ-CG 3.43Å; Y82-R106 PolarHBondContact OH-O 3.38Å; E85-R106 HydrophobicContact CB-CB 4.17Å; E85-R106 HydrophobicContact CG-CB 4.48Å; S86-R106 PolarHBondContact OG-NH1 2.92Å; F102-R106 WeakPolarHBondContact O-CB 3.3Å; F102-R106 PolarHBondContact O-N 3.3Å; D103-R106 PolarHBondContact O-N 2.77Å; D103-R106 IonicContact OD1-CZ 3.25Å; D103-R106 VanDerWaalsContact OD1-CZ 3.23Å; D103-R106 IonicContact OD1-NH1 2.74Å; D103-R106 PolarHBondContact OD1-NH1 2.92Å; D103-R106 VanDerWaalsContact OD1-NH1 3.15Å; D103-R106 IonicContact OD1-NH2 2.76Å; D103-R106 PolarHBondContact OD1-NH2 2.93Å; D103-R106 IonicContact OD2-NH2 2.78Å; R106-C108 VanDerWaalsContact C-N 3.31Å; R106-C108 PolarHBondContact O-N 2.91Å; R106-Y109 VanDerWaalsContact O-CB 3.3Å; R106-Y109 WeakPolarHBondContact O-CB 3.39Å; R106-Y109 PolarHBondContact O-N 3.27Å; R106-E110 PolarHBondContact O-N 3.46Å; R106-N283 PolarHBondContact NH1-OD1 3.36Å
107D83.6Confident85Confident42 Ų4231 Ų3123%0.22515%0.15CC..Hα-helixtrans-59.3-36.7-179.6-89.734.8000113.2D103 V105 Y109 E110 K175D103-D107 WeakPolarHBondContact O-CB 3.36Å; D103-D107 PolarHBondContact O-N 2.94Å; D103-D107 VanDerWaalsContact O-OD1 3.08Å; V105-D107 VanDerWaalsContact C-N 3.28Å; V105-D107 PolarHBondContact O-N 3.06Å; D107-Y109 PolarHBondContact O-N 2.9Å; D107-E110 WeakPolarHBondContact O-CB 3.31Å; D107-E110 PolarHBondContact O-N 3.06Å; D107-K175 WeakPolarHBondContact O-CE 3.17Å; D107-K175 WeakPolarHBondContact O-CG 3.49Å; D107-K175 WeakPolarHBondContact OD2-CE 3.43Å; D107-K175 IonicContact OD2-NZ 3.87Å; D107-K175 PolarHBondContact OD2-NZ 2.74Å
108C87.7Confident86.2Confident45 Ų4528 Ų2830%0.30413%0.134SC..Hα-helixtrans-62.6-32.3175.4-67.50000112.2S104 V105 R106 E110 A111S104-C108 PolarHBondContact O-N 3.1Å; S104-C108 PolarHBondContact O-SG 3.06Å; V105-C108 PolarHBondContact O-N 3.27Å; R106-C108 VanDerWaalsContact C-N 3.31Å; R106-C108 PolarHBondContact O-N 2.91Å; C108-E110 VanDerWaalsContact C-N 3.3Å; C108-E110 PolarHBondContact O-N 3.39Å; C108-A111 PolarHBondContact O-N 3.37Å
109Y90.3Very high87Confident26 Ų2622.3 Ų22.310%0.10211%0.113CC..Hα-helixtrans-71.8-24.9179-156.8-98.8000112.9R74 F77 Y78 I81 R106 D107 A111 F112 V113R74-Y109 PolarHBondContact O-OH 3.47Å; F77-Y109 HydrophobicContact CB-CE1 4.42Å; F77-Y109 WeakPolarHBondContact CB-OH 3.1Å; Y78-Y109 AromaticContact CD2-CD1 3.97Å; Y78-Y109 HydrophobicContact CD2-CD1 3.97Å; Y78-Y109 HydrophobicContact CD2-CE1 4.4Å; I81-Y109 HydrophobicContact CD1-CD1 3.94Å; I81-Y109 HydrophobicContact CD1-CD2 3.58Å; I81-Y109 HydrophobicContact CD1-CE1 3.85Å; I81-Y109 HydrophobicContact CD1-CE2 3.45Å; I81-Y109 VanDerWaalsContact CD1-CE2 3.45Å; I81-Y109 HydrophobicContact CD1-CG 3.82Å; I81-Y109 HydrophobicContact CG2-CG 4.46Å; R106-Y109 VanDerWaalsContact O-CB 3.3Å; R106-Y109 WeakPolarHBondContact O-CB 3.39Å; R106-Y109 PolarHBondContact O-N 3.27Å; D107-Y109 PolarHBondContact O-N 2.9Å; Y109-A111 VanDerWaalsContact C-N 3.33Å; Y109-A111 PolarHBondContact O-N 2.95Å; Y109-F112 HydrophobicContact CD2-CB 4.46Å; Y109-F112 HydrophobicContact CD2-CD1 4.04Å; Y109-F112 AromaticContact CE2-CD1 3.49Å; Y109-F112 HydrophobicContact CE2-CD1 3.49Å; Y109-F112 VanDerWaalsContact CE2-CD1 3.49Å; Y109-F112 HydrophobicContact CE2-CE1 4.02Å; Y109-F112 HydrophobicContact CE2-CG 4.46Å; Y109-F112 AromaticContact CZ-CD1 3.79Å; Y109-F112 PolarHBondContact O-N 2.9Å; Y109-V113 PolarHBondContact O-N 2.85Å
110E89Confident87.5Confident8 Ų822.2 Ų22.24%0.03711%0.113CC..Hα-helixtrans-53.9-49.3172.4-158.7-172137.900111.6Y82 R106 D107 C108 F112 V113 V114 K175 Y209 V247Y82-E110 VanDerWaalsContact OH-CB 3.23Å; Y82-E110 WeakPolarHBondContact OH-CB 3.37Å; R106-E110 PolarHBondContact O-N 3.46Å; D107-E110 WeakPolarHBondContact O-CB 3.31Å; D107-E110 PolarHBondContact O-N 3.06Å; C108-E110 VanDerWaalsContact C-N 3.3Å; C108-E110 PolarHBondContact O-N 3.39Å; E110-F112 VanDerWaalsContact C-N 3.32Å; E110-F112 PolarHBondContact O-N 3.48Å; E110-V113 VanDerWaalsContact O-CG1 3.28Å; E110-V113 WeakPolarHBondContact O-CG1 3.25Å; E110-V113 PolarHBondContact O-N 2.77Å; E110-V114 WeakPolarHBondContact O-CG2 3.49Å; E110-V114 PolarHBondContact O-N 3.47Å; E110-K175 WeakPolarHBondContact OE2-CE 3.45Å; E110-K175 IonicContact OE2-NZ 2.85Å; E110-K175 PolarHBondContact OE2-NZ 3.11Å; E110-Y209 VanDerWaalsContact CD-OH 3.31Å; E110-Y209 PolarHBondContact OE1-OH 2.89Å; E110-Y209 PolarHBondContact OE2-OH 3.44Å; E110-V247 HydrophobicContact CG-CG1 3.94Å
111A90.1Very high88.1Confident1 Ų122.1 Ų22.11%0.00811%0.113CC..Hα-helixtrans-70-36.4-178.300000111.5C108 Y109 V113 V114 Y115 F171 C172 K175C108-A111 PolarHBondContact O-N 3.37Å; Y109-A111 VanDerWaalsContact C-N 3.33Å; Y109-A111 PolarHBondContact O-N 2.95Å; A111-V113 VanDerWaalsContact C-N 3.32Å; A111-V113 PolarHBondContact O-N 2.75Å; A111-V114 PolarHBondContact O-N 3.37Å; A111-Y115 PolarHBondContact O-N 3.16Å; A111-F171 HydrophobicContact CB-CD1 3.57Å; A111-F171 HydrophobicContact CB-CE1 3.64Å; A111-F171 HydrophobicContact CB-CG 4.28Å; A111-F171 HydrophobicContact CB-CZ 4.39Å; A111-C172 HydrophobicContact CB-CB 4.37Å; A111-C172 PolarHBondContact O-SG 3.21Å; A111-K175 HydrophobicContact CB-CB 3.83Å; A111-K175 HydrophobicContact CB-CG 4.18Å
112F90.3Very high88.4Confident26 Ų2617.2 Ų17.211%0.1149%0.093CC..Hα-helixtrans-62.2-37.4174.8-172.6-112000112.7R74 Y109 E110 S116 M357R74-F112 HydrophobicContact CB-CE1 4.07Å; R74-F112 HydrophobicContact CG-CE1 3.87Å; R74-F112 HydrophobicContact CG-CZ 4.02Å; Y109-F112 HydrophobicContact CD2-CB 4.46Å; Y109-F112 HydrophobicContact CD2-CD1 4.04Å; Y109-F112 AromaticContact CE2-CD1 3.49Å; Y109-F112 HydrophobicContact CE2-CD1 3.49Å; Y109-F112 VanDerWaalsContact CE2-CD1 3.49Å; Y109-F112 HydrophobicContact CE2-CE1 4.02Å; Y109-F112 HydrophobicContact CE2-CG 4.46Å; Y109-F112 AromaticContact CZ-CD1 3.79Å; Y109-F112 PolarHBondContact O-N 2.9Å; E110-F112 VanDerWaalsContact C-N 3.32Å; E110-F112 PolarHBondContact O-N 3.48Å; F112-S116 VanDerWaalsContact O-CB 3.28Å; F112-S116 WeakPolarHBondContact O-CB 3.33Å; F112-S116 PolarHBondContact O-N 2.94Å; F112-S116 PolarHBondContact O-OG 3.42Å; F112-M357 HydrophobicContact CD2-SD 4.43Å
113V91Very high88.6Confident2 Ų218.2 Ų18.21%0.01210%0.099CC..Hα-helixtrans-69.5-40.6177.790.70000111.8I75 Y78 Y109 E110 A111 S116 F117 V247I75-V113 HydrophobicContact CB-CG2 4.28Å; I75-V113 HydrophobicContact CG1-CG2 4.2Å; I75-V113 HydrophobicContact CG2-CG2 4.2Å; Y78-V113 HydrophobicContact CD2-CB 3.76Å; Y78-V113 HydrophobicContact CD2-CG1 3.59Å; Y78-V113 HydrophobicContact CD2-CG2 3.9Å; Y78-V113 HydrophobicContact CE2-CB 4.37Å; Y78-V113 HydrophobicContact CE2-CG1 3.74Å; Y78-V113 HydrophobicContact CG-CG2 4.24Å; Y109-V113 PolarHBondContact O-N 2.85Å; E110-V113 VanDerWaalsContact O-CG1 3.28Å; E110-V113 WeakPolarHBondContact O-CG1 3.25Å; E110-V113 PolarHBondContact O-N 2.77Å; A111-V113 VanDerWaalsContact C-N 3.32Å; A111-V113 PolarHBondContact O-N 2.75Å; V113-S116 PolarHBondContact O-N 2.89Å; V113-F117 WeakPolarHBondContact O-CB 3.27Å; V113-F117 PolarHBondContact O-N 3.42Å; V113-V247 HydrophobicContact CG1-CG2 3.52Å
114V90.3Very high88.8Confident3 Ų318.1 Ų18.12%0.01810%0.097CC..Hα-helixtrans-62.1-45177.4173.20000110.4E110 A111 F117 L118 T168 F171 L220 V247E110-V114 WeakPolarHBondContact O-CG2 3.49Å; E110-V114 PolarHBondContact O-N 3.47Å; A111-V114 PolarHBondContact O-N 3.37Å; V114-F117 PolarHBondContact O-N 3.41Å; V114-L118 PolarHBondContact O-N 2.97Å; V114-L118 VanDerWaalsContact O-N 3.09Å; V114-T168 HydrophobicContact CG1-CG2 3.82Å; V114-F171 HydrophobicContact CB-CD1 4.4Å; V114-F171 HydrophobicContact CB-CE1 4.45Å; V114-F171 HydrophobicContact CG1-CD1 4.4Å; V114-F171 HydrophobicContact CG2-CE1 4.1Å; V114-L220 HydrophobicContact CG1-CD1 3.63Å; V114-L220 HydrophobicContact CG1-CG 4.35Å; V114-V247 HydrophobicContact CG2-CG1 4.01Å; V114-V247 HydrophobicContact CG2-CG2 4.43Å
115Y91.7Very high88.8Confident5 Ų518.2 Ų18.22%0.0210%0.097CC..Hα-helixtrans-65.2-45.5174168.7-102000112.5W71 A111 F117 L118 S119 L169 C172 M357 D360W71-Y115 AromaticContact CH2-CE1 3.73Å; W71-Y115 HydrophobicContact CH2-CE1 3.73Å; W71-Y115 HydrophobicContact CZ3-CD1 4.16Å; W71-Y115 AromaticContact CZ3-CE1 3.64Å; W71-Y115 HydrophobicContact CZ3-CE1 3.64Å; A111-Y115 PolarHBondContact O-N 3.16Å; Y115-F117 PolarHBondContact O-N 3.04Å; Y115-L118 PolarHBondContact O-N 3.29Å; Y115-L118 VanDerWaalsContact O-N 3.12Å; Y115-S119 WeakPolarHBondContact CE2-OG 3.39Å; Y115-S119 PolarHBondContact O-N 3.25Å; Y115-S119 PolarHBondContact O-OG 2.92Å; Y115-L169 HydrophobicContact CD2-CD2 3.86Å; Y115-L169 HydrophobicContact CD2-CG 4.4Å; Y115-L169 HydrophobicContact CE2-CD2 3.78Å; Y115-L169 HydrophobicContact CE2-CG 4.45Å; Y115-C172 WeakPolarHBondContact CB-SG 3.37Å; Y115-M357 HydrophobicContact CD1-CB 4.01Å; Y115-M357 HydrophobicContact CD1-CG 3.99Å; Y115-M357 HydrophobicContact CE1-CB 3.6Å; Y115-M357 HydrophobicContact CE1-CG 3.99Å; Y115-M357 HydrophobicContact CG-CG 4.29Å; Y115-D360 HydrophobicContact CE2-CB 4.33Å; Y115-D360 VanDerWaalsContact OH-CG 3.29Å; Y115-D360 PolarHBondContact OH-OD2 3.07Å
116S91.4Very high88.8Confident0 Ų015.7 Ų15.70%09%0.089CC..Hα-helixtrans-58.5-37.3178.5-63.30000112F112 V113 L120F112-S116 VanDerWaalsContact O-CB 3.28Å; F112-S116 WeakPolarHBondContact O-CB 3.33Å; F112-S116 PolarHBondContact O-N 2.94Å; F112-S116 PolarHBondContact O-OG 3.42Å; V113-S116 PolarHBondContact O-N 2.89Å; S116-L120 WeakPolarHBondContact O-CB 3.3Å; S116-L120 PolarHBondContact O-N 3.11Å
117F91.8Very high88.7Confident6 Ų616.1 Ų16.13%0.02610%0.095CC..Hα-helixtrans-69.4-42176.1179.9-110.5000113.1I75 V113 V114 Y115 L120 C121 L220 F240 V243I75-F117 HydrophobicContact CD1-CB 4.09Å; I75-F117 HydrophobicContact CD1-CD2 4.05Å; I75-F117 HydrophobicContact CG1-CB 4.5Å; V113-F117 WeakPolarHBondContact O-CB 3.27Å; V113-F117 PolarHBondContact O-N 3.42Å; V114-F117 PolarHBondContact O-N 3.41Å; Y115-F117 PolarHBondContact O-N 3.04Å; F117-L120 PolarHBondContact O-N 3.11Å; F117-C121 PolarHBondContact O-N 2.81Å; F117-C121 VanDerWaalsContact O-N 3.11Å; F117-C121 PolarHBondContact O-SG 3.17Å; F117-L220 HydrophobicContact CD1-CD1 4.43Å; F117-L220 HydrophobicContact CD1-CD2 4.31Å; F117-F240 AromaticContact CE1-CD2 3.3Å; F117-F240 HydrophobicContact CE1-CD2 3.3Å; F117-F240 AromaticContact CE1-CE2 3.54Å; F117-F240 HydrophobicContact CE1-CE2 3.54Å; F117-F240 HydrophobicContact CE1-CG 4.03Å; F117-F240 HydrophobicContact CE1-CZ 4.46Å; F117-F240 HydrophobicContact CZ-CB 3.94Å; F117-F240 AromaticContact CZ-CD2 3.4Å; F117-F240 HydrophobicContact CZ-CD2 3.4Å; F117-F240 VanDerWaalsContact CZ-CD2 3.4Å; F117-F240 HydrophobicContact CZ-CE2 4.13Å; F117-F240 AromaticContact CZ-CG 3.92Å; F117-F240 HydrophobicContact CZ-CG 3.92Å; F117-V243 HydrophobicContact CB-CG1 3.96Å; F117-V243 HydrophobicContact CD1-CG1 4.15Å; F117-V243 HydrophobicContact CD2-CB 4.02Å; F117-V243 HydrophobicContact CD2-CG1 3.99Å; F117-V243 HydrophobicContact CD2-CG2 3.8Å; F117-V243 HydrophobicContact CE2-CB 4.2Å; F117-V243 HydrophobicContact CE2-CG2 4.04Å; F117-V243 HydrophobicContact CG-CB 4.23Å; F117-V243 HydrophobicContact CG-CG1 3.74Å; F117-V243 HydrophobicContact CG-CG2 4.42Å
118L91.2Very high88.5Confident2 Ų215.4 Ų15.41%0.019%0.091CC..Hα-helixtrans-59.8-48.7172.9-178.558.6000110.6V114 Y115 L120 C121 Y122 K165 T168 L220 F223V114-L118 PolarHBondContact O-N 2.97Å; V114-L118 VanDerWaalsContact O-N 3.09Å; Y115-L118 PolarHBondContact O-N 3.29Å; Y115-L118 VanDerWaalsContact O-N 3.12Å; L118-L120 VanDerWaalsContact C-N 3.34Å; L118-L120 PolarHBondContact O-N 3.02Å; L118-C121 WeakPolarHBondContact O-CB 3.27Å; L118-C121 PolarHBondContact O-N 3.43Å; L118-Y122 HydrophobicContact CD1-CD2 4.04Å; L118-Y122 HydrophobicContact CD1-CE2 3.62Å; L118-Y122 HydrophobicContact CD2-CE2 4.23Å; L118-Y122 HydrophobicContact CG-CD2 3.96Å; L118-Y122 HydrophobicContact CG-CE2 3.74Å; L118-Y122 WeakPolarHBondContact O-CD2 3.15Å; L118-Y122 PolarHBondContact O-N 2.88Å; L118-K165 HydrophobicContact CD2-CG 4.18Å; L118-T168 HydrophobicContact CB-CG2 4.41Å; L118-T168 HydrophobicContact CD2-CG2 4.1Å; L118-T168 WeakPolarHBondContact CD2-OG1 3.36Å; L118-L220 HydrophobicContact CB-CD2 3.9Å; L118-L220 HydrophobicContact CD1-CD2 3.99Å; L118-L220 HydrophobicContact CG-CD2 4.41Å; L118-F223 HydrophobicContact CD1-CB 4.45Å; L118-F223 HydrophobicContact CD1-CD1 3.98Å; L118-F223 HydrophobicContact CD1-CD2 4.06Å; L118-F223 HydrophobicContact CD1-CE1 4.28Å; L118-F223 HydrophobicContact CD1-CE2 4.31Å; L118-F223 HydrophobicContact CD1-CG 3.87Å; L118-F223 HydrophobicContact CD1-CZ 4.41Å
119S90.9Very high88Confident10 Ų1014.5 Ų14.57%0.079%0.085CC..Hα-helixtrans-61.3-40.3179.5-61.60000112.4Y115 C121 Y122 E123Y115-S119 WeakPolarHBondContact CE2-OG 3.39Å; Y115-S119 PolarHBondContact O-N 3.25Å; Y115-S119 PolarHBondContact O-OG 2.92Å; S119-C121 VanDerWaalsContact C-N 3.29Å; S119-C121 PolarHBondContact O-N 3.2Å; S119-Y122 WeakPolarHBondContact O-CB 3.32Å; S119-Y122 PolarHBondContact O-N 2.89Å; S119-Y122 VanDerWaalsContact O-N 3.11Å; S119-E123 PolarHBondContact O-N 3.11Å
120L90Very high87.5Confident1 Ų115.7 Ų15.71%0.00510%0.096CC..Hα-helixtrans-57.6-43.3172.4178.960.9000111.8E68 W71 V72 I75 S116 F117 L118 Y122 E123 Y124 F301E68-L120 HydrophobicContact CB-CD1 4.14Å; W71-L120 HydrophobicContact CB-CB 3.8Å; W71-L120 HydrophobicContact CB-CD1 4.1Å; W71-L120 HydrophobicContact CB-CG 4.45Å; W71-L120 HydrophobicContact CG-CB 4.41Å; V72-L120 HydrophobicContact CG2-CD1 3.92Å; V72-L120 HydrophobicContact CG2-CD2 3.83Å; I75-L120 HydrophobicContact CD1-CB 4.42Å; I75-L120 HydrophobicContact CD1-CD2 3.7Å; S116-L120 WeakPolarHBondContact O-CB 3.3Å; S116-L120 PolarHBondContact O-N 3.11Å; F117-L120 PolarHBondContact O-N 3.11Å; L118-L120 VanDerWaalsContact C-N 3.34Å; L118-L120 PolarHBondContact O-N 3.02Å; L120-Y122 VanDerWaalsContact C-N 3.29Å; L120-Y122 PolarHBondContact O-N 2.87Å; L120-E123 PolarHBondContact O-N 2.99Å; L120-Y124 HydrophobicContact CD1-CD1 4.34Å; L120-Y124 HydrophobicContact CD1-CD2 4.34Å; L120-Y124 HydrophobicContact CD1-CE1 3.87Å; L120-Y124 HydrophobicContact CD1-CE2 3.87Å; L120-Y124 HydrophobicContact CD2-CE2 3.86Å; L120-Y124 HydrophobicContact CG-CD2 4.05Å; L120-Y124 HydrophobicContact CG-CE2 3.6Å; L120-Y124 PolarHBondContact O-N 3.01Å; L120-F301 HydrophobicContact CD2-CD1 4.42Å; L120-F301 HydrophobicContact CD2-CE1 3.67Å; L120-F301 HydrophobicContact CD2-CZ 4.4Å
121C89.2Confident87Confident8 Ų815.4 Ų15.45%0.05410%0.095CC..Hα-helixtrans-65.1-33.9177.3-58.90000112.5F117 L118 S119 L125 F223F117-C121 PolarHBondContact O-N 2.81Å; F117-C121 VanDerWaalsContact O-N 3.11Å; F117-C121 PolarHBondContact O-SG 3.17Å; L118-C121 WeakPolarHBondContact O-CB 3.27Å; L118-C121 PolarHBondContact O-N 3.43Å; S119-C121 VanDerWaalsContact C-N 3.29Å; S119-C121 PolarHBondContact O-N 3.2Å; C121-L125 WeakPolarHBondContact O-CD1 3.13Å; C121-L125 WeakPolarHBondContact O-CG 3.2Å; C121-L125 PolarHBondContact O-N 3.27Å; C121-F223 HydrophobicContact CB-CD1 4.4Å; C121-F223 HydrophobicContact CB-CE1 3.45Å; C121-F223 VanDerWaalsContact CB-CE1 3.45Å; C121-F223 HydrophobicContact CB-CZ 3.99Å
122Y88.5Confident86.5Confident8 Ų816.4 Ų16.43%0.03110%0.1CC..Hα-helixtrans-64-44172.3-86.8-83.6000111.6L118 S119 L120 L125 G126 G127 E128 I131 L161 K165 F223L118-Y122 HydrophobicContact CD1-CD2 4.04Å; L118-Y122 HydrophobicContact CD1-CE2 3.62Å; L118-Y122 HydrophobicContact CD2-CE2 4.23Å; L118-Y122 HydrophobicContact CG-CD2 3.96Å; L118-Y122 HydrophobicContact CG-CE2 3.74Å; L118-Y122 WeakPolarHBondContact O-CD2 3.15Å; L118-Y122 PolarHBondContact O-N 2.88Å; S119-Y122 WeakPolarHBondContact O-CB 3.32Å; S119-Y122 PolarHBondContact O-N 2.89Å; S119-Y122 VanDerWaalsContact O-N 3.11Å; L120-Y122 VanDerWaalsContact C-N 3.29Å; L120-Y122 PolarHBondContact O-N 2.87Å; Y122-L125 PolarHBondContact O-N 3Å; Y122-G126 PolarHBondContact O-N 2.98Å; Y122-G127 WeakPolarHBondContact O-CA 3.11Å; Y122-G127 PolarHBondContact O-N 2.9Å; Y122-E128 HydrophobicContact CD1-CB 4.43Å; Y122-E128 HydrophobicContact CE1-CB 4.4Å; Y122-E128 HydrophobicContact CE1-CG 4.45Å; Y122-I131 HydrophobicContact CD1-CD1 3.29Å; Y122-I131 HydrophobicContact CE1-CD1 3.62Å; Y122-I131 HydrophobicContact CG-CD1 4.11Å; Y122-L161 HydrophobicContact CE1-CD2 4.36Å; Y122-L161 WeakPolarHBondContact OH-CB 3.44Å; Y122-L161 PolarHBondContact OH-O 3.43Å; Y122-L161 VanDerWaalsContact OH-O 3.11Å; Y122-K165 VanDerWaalsContact CE1-CE 3.48Å; Y122-K165 HydrophobicContact CE2-CD 4.17Å; Y122-K165 HydrophobicContact CE2-CG 3.71Å; Y122-F223 HydrophobicContact CD2-CE2 4.27Å; Y122-F223 HydrophobicContact CD2-CZ 4.34Å; Y122-F223 HydrophobicContact CE1-CE2 4.11Å; Y122-F223 HydrophobicContact CE2-CD2 4.27Å; Y122-F223 AromaticContact CE2-CE2 3.69Å; Y122-F223 HydrophobicContact CE2-CE2 3.69Å; Y122-F223 HydrophobicContact CE2-CZ 4.19Å; Y122-F223 AromaticContact CZ-CE2 3.56Å
123E88.3Confident85.9Confident67 Ų6719.1 Ų19.131%0.31312%0.122SC..Hα-helixtrans-65.2-42.8178.7-67.4-59.9148.300112.3E68 S119 L120 L125 G126E68-E123 HydrophobicContact CG-CB 4.44Å; S119-E123 PolarHBondContact O-N 3.11Å; L120-E123 PolarHBondContact O-N 2.99Å; E123-L125 PolarHBondContact O-N 3.08Å; E123-L125 VanDerWaalsContact O-N 3.12Å; E123-G126 PolarHBondContact O-N 2.83Å
124Y85.8Confident85.2Confident15 Ų1523.2 Ų23.26%0.05914%0.141CC..Hα-helixtrans-58.4-27.1175.6-75.4-30.3000113.7E68 L120 L231 K239E68-Y124 HydrophobicContact CB-CE1 4.23Å; E68-Y124 HydrophobicContact CG-CD1 4.03Å; E68-Y124 HydrophobicContact CG-CE1 4.04Å; E68-Y124 WeakPolarHBondContact OE2-CE1 3.2Å; L120-Y124 HydrophobicContact CD1-CD1 4.34Å; L120-Y124 HydrophobicContact CD1-CD2 4.34Å; L120-Y124 HydrophobicContact CD1-CE1 3.87Å; L120-Y124 HydrophobicContact CD1-CE2 3.87Å; L120-Y124 HydrophobicContact CD2-CE2 3.86Å; L120-Y124 HydrophobicContact CG-CD2 4.05Å; L120-Y124 HydrophobicContact CG-CE2 3.6Å; L120-Y124 PolarHBondContact O-N 3.01Å; Y124-L231 HydrophobicContact CD2-CD2 4.44Å; Y124-K239 HydrophobicContact CE2-CD 4.14Å
125L84.6Confident84.3Confident13 Ų1323.2 Ų23.27%0.06814%0.141CC..THydrogen-bonded Turntrans-94.19179.2-68.6169.7000113.2C121 Y122 E123 G127 C130 I131 F223 T227 I230 L231C121-L125 WeakPolarHBondContact O-CD1 3.13Å; C121-L125 WeakPolarHBondContact O-CG 3.2Å; C121-L125 PolarHBondContact O-N 3.27Å; Y122-L125 PolarHBondContact O-N 3Å; E123-L125 PolarHBondContact O-N 3.08Å; E123-L125 VanDerWaalsContact O-N 3.12Å; L125-G127 VanDerWaalsContact C-N 3.34Å; L125-C130 WeakPolarHBondContact O-CB 3.46Å; L125-C130 PolarHBondContact O-SG 3.31Å; L125-I131 HydrophobicContact CB-CD1 3.68Å; L125-I131 HydrophobicContact CB-CG1 3.3Å; L125-I131 HydrophobicContact CD1-CD1 3.71Å; L125-I131 HydrophobicContact CD1-CG1 3.69Å; L125-I131 HydrophobicContact CG-CD1 4.34Å; L125-I131 HydrophobicContact CG-CG1 4.08Å; L125-F223 HydrophobicContact CD1-CZ 3.98Å; L125-T227 HydrophobicContact CD1-CG2 3.59Å; L125-I230 HydrophobicContact CD2-CB 3.9Å; L125-I230 HydrophobicContact CD2-CG2 3.52Å; L125-L231 HydrophobicContact CD1-CD1 4.17Å; L125-L231 HydrophobicContact CD1-CD2 4.45Å; L125-L231 HydrophobicContact CD1-CG 4.06Å; L125-L231 HydrophobicContact CD2-CD2 4Å; L125-L231 HydrophobicContact CD2-CG 3.73Å; L125-L231 HydrophobicContact CG-CD2 3.93Å; L125-L231 HydrophobicContact CG-CG 3.93Å
126G81.7Confident83.2Confident35 Ų3532.2 Ų32.236%0.36118%0.175SC..THydrogen-bonded Turntrans76.819.6-179.200000114.2Y122 E123Y122-G126 PolarHBondContact O-N 2.98Å; E123-G126 PolarHBondContact O-N 2.83Å
127G84.5Confident81.9Confident16 Ų1635.5 Ų35.517%0.16521%0.209CC..Hα-helixtrans84.4-179.5178.400000114.3Y122 L125 S129 C130 I131Y122-G127 WeakPolarHBondContact O-CA 3.11Å; Y122-G127 PolarHBondContact O-N 2.9Å; L125-G127 VanDerWaalsContact C-N 3.34Å; G127-S129 PolarHBondContact O-N 3.38Å; G127-C130 PolarHBondContact O-N 3.02Å; G127-I131 WeakPolarHBondContact O-CD1 3.44Å; G127-I131 VanDerWaalsContact O-CG1 3.23Å; G127-I131 WeakPolarHBondContact O-CG1 3.1Å; G127-I131 PolarHBondContact O-N 3.48Å
128E80.1Confident80.7Confident27 Ų2740.4 Ų40.413%0.12623%0.227CC..Hα-helixtrans-63.7-36.4-168-172.6170.8151.600114.7Y122 L132 L161 K165 Y369Y122-E128 HydrophobicContact CD1-CB 4.43Å; Y122-E128 HydrophobicContact CE1-CB 4.4Å; Y122-E128 HydrophobicContact CE1-CG 4.45Å; E128-L132 WeakPolarHBondContact O-CB 3.39Å; E128-L132 PolarHBondContact O-N 3.15Å; E128-L161 HydrophobicContact CG-CD1 4.13Å; E128-K165 IonicContact OE2-NZ 3Å; E128-K165 PolarHBondContact OE2-NZ 2.89Å; E128-Y369 WeakPolarHBondContact OE1-CE1 3.38Å; E128-Y369 PolarHBondContact OE1-OH 2.92Å; E128-Y369 PolarHBondContact OE2-OH 3.29Å
129S76.9Confident79.3Confident25 Ų2548 Ų4818%0.17526%0.262CS..Hα-helixtrans-68.6-42.8-179.2-57.30000112.1G127 L132 S133 R376G127-S129 PolarHBondContact O-N 3.38Å; S129-L132 PolarHBondContact O-N 3.22Å; S129-S133 PolarHBondContact O-N 3.47Å; S129-S133 PolarHBondContact O-OG 2.87Å; S129-R376 WeakPolarHBondContact OG-CD 3.43Å; S129-R376 PolarHBondContact OG-NH1 3.36Å
130C79.5Confident77.8Confident52 Ų5248.8 Ų48.835%0.35127%0.266SS..Hα-helixtrans-68.4-40.2179.5-173.20000111.4L125 G127 L132 S133 E134L125-C130 WeakPolarHBondContact O-CB 3.46Å; L125-C130 PolarHBondContact O-SG 3.31Å; G127-C130 PolarHBondContact O-N 3.02Å; C130-L132 VanDerWaalsContact C-N 3.3Å; C130-L132 PolarHBondContact O-N 3.35Å; C130-S133 WeakPolarHBondContact CA-OG 3.27Å; C130-S133 PolarHBondContact O-N 3.43Å; C130-S133 PolarHBondContact O-OG 3.5Å; C130-E134 WeakPolarHBondContact O-CB 3.19Å; C130-E134 PolarHBondContact O-N 3.2Å
131I79.7Confident76.1Confident2 Ų252.2 Ų52.21%0.0129%0.288CS..Hα-helixtrans-57.5-47.8171.5-65168.1000110.1Y122 L125 G127 S133 E134 I135 L161 T227Y122-I131 HydrophobicContact CD1-CD1 3.29Å; Y122-I131 HydrophobicContact CE1-CD1 3.62Å; Y122-I131 HydrophobicContact CG-CD1 4.11Å; L125-I131 HydrophobicContact CB-CD1 3.68Å; L125-I131 HydrophobicContact CB-CG1 3.3Å; L125-I131 HydrophobicContact CD1-CD1 3.71Å; L125-I131 HydrophobicContact CD1-CG1 3.69Å; L125-I131 HydrophobicContact CG-CD1 4.34Å; L125-I131 HydrophobicContact CG-CG1 4.08Å; G127-I131 WeakPolarHBondContact O-CD1 3.44Å; G127-I131 VanDerWaalsContact O-CG1 3.23Å; G127-I131 WeakPolarHBondContact O-CG1 3.1Å; G127-I131 PolarHBondContact O-N 3.48Å; I131-S133 PolarHBondContact O-N 3.22Å; I131-E134 PolarHBondContact O-N 3.48Å; I131-I135 HydrophobicContact CG2-CD1 3.39Å; I131-I135 HydrophobicContact CG2-CG1 4.16Å; I131-I135 WeakPolarHBondContact O-CB 3.42Å; I131-I135 WeakPolarHBondContact O-CG1 3.27Å; I131-I135 PolarHBondContact O-N 2.78Å; I131-L161 HydrophobicContact CB-CD1 4.16Å; I131-L161 HydrophobicContact CG2-CD1 3.63Å; I131-L161 HydrophobicContact CG2-CD2 3.8Å; I131-L161 HydrophobicContact CG2-CG 4.36Å; I131-T227 HydrophobicContact CG2-CG2 4.42Å
132L78.2Confident74.1Confident22 Ų2261 Ų6112%0.11532%0.321CS..Hα-helixtrans-63.4-43-178.9-174.573.2000111.8E128 S129 C130 E134 R136 I158E128-L132 WeakPolarHBondContact O-CB 3.39Å; E128-L132 PolarHBondContact O-N 3.15Å; S129-L132 PolarHBondContact O-N 3.22Å; C130-L132 VanDerWaalsContact C-N 3.3Å; C130-L132 PolarHBondContact O-N 3.35Å; L132-E134 VanDerWaalsContact C-N 3.35Å; L132-E134 PolarHBondContact O-N 2.91Å; L132-R136 WeakPolarHBondContact O-CB 3.37Å; L132-R136 PolarHBondContact O-N 3.43Å; L132-I158 HydrophobicContact CD1-CB 4.49Å; L132-I158 HydrophobicContact CD1-CG1 3.58Å; L132-I158 HydrophobicContact CD2-CD1 3.62Å; L132-I158 HydrophobicContact CD2-CG1 3.3Å; L132-I158 HydrophobicContact CG-CG1 4.04Å
133S78.3Confident72.6Confident82 Ų8262.5 Ų62.557%0.57333%0.332SS*.Hα-helixtrans-63.8-39.6179.458.10000112.4S129 C130 I131S129-S133 PolarHBondContact O-N 3.47Å; S129-S133 PolarHBondContact O-OG 2.87Å; C130-S133 WeakPolarHBondContact CA-OG 3.27Å; C130-S133 PolarHBondContact O-N 3.43Å; C130-S133 PolarHBondContact O-OG 3.5Å; I131-S133 PolarHBondContact O-N 3.22Å
134E75.6Confident70.9Confident88 Ų8869.9 Ų69.941%0.41136%0.357SS..Hα-helixtrans-78.2-29.6-177.4-175.656.1-142.100113C130 I131 L132 R138 I230C130-E134 WeakPolarHBondContact O-CB 3.19Å; C130-E134 PolarHBondContact O-N 3.2Å; I131-E134 PolarHBondContact O-N 3.48Å; L132-E134 VanDerWaalsContact C-N 3.35Å; L132-E134 PolarHBondContact O-N 2.91Å; E134-R138 PolarHBondContact O-NE 3.22Å; E134-R138 IonicContact OE1-CZ 2.71Å; E134-R138 IonicContact OE1-NH2 3.73Å; E134-R138 PolarHBondContact OE1-NH2 2.98Å; E134-I230 HydrophobicContact CB-CD1 3.96Å; E134-I230 HydrophobicContact CG-CB 4.48Å; E134-I230 HydrophobicContact CG-CD1 3.34Å; E134-I230 HydrophobicContact CG-CG1 3.59Å; E134-I230 HydrophobicContact CG-CG2 4.03Å
135I72Confident69.5Low3 Ų372.4 Ų72.42%0.01539%0.388CS..Hα-helixtrans-91.8-22.6-176.5-64.2-172.9000111.5I131 G137 R138 Y156 T227 I230I131-I135 HydrophobicContact CG2-CD1 3.39Å; I131-I135 HydrophobicContact CG2-CG1 4.16Å; I131-I135 WeakPolarHBondContact O-CB 3.42Å; I131-I135 WeakPolarHBondContact O-CG1 3.27Å; I131-I135 PolarHBondContact O-N 2.78Å; I135-G137 PolarHBondContact O-N 3.28Å; I135-G137 VanDerWaalsContact O-N 3.11Å; I135-R138 PolarHBondContact O-N 3.37Å; I135-Y156 HydrophobicContact CB-CD2 4.33Å; I135-Y156 HydrophobicContact CB-CG 4.26Å; I135-Y156 HydrophobicContact CG2-CD1 3.38Å; I135-Y156 HydrophobicContact CG2-CD2 2.94Å; I135-Y156 HydrophobicContact CG2-CE1 3.85Å; I135-Y156 HydrophobicContact CG2-CE2 3.41Å; I135-Y156 VanDerWaalsContact CG2-CE2 3.41Å; I135-Y156 HydrophobicContact CG2-CG 2.89Å; I135-Y156 WeakPolarHBondContact O-CD2 3.22Å; I135-T227 HydrophobicContact CD1-CG2 3.74Å; I135-I230 HydrophobicContact CD1-CD1 3.86Å; I135-I230 HydrophobicContact CG1-CD1 3.27Å
136R69.6Low68.4Low195 Ų19577 Ų7774%0.73641%0.405SS*.THydrogen-bonded Turntrans-54.9118.3178.5-173.8175.2-174.2-173.4-0.3110.7L132L132-R136 WeakPolarHBondContact O-CB 3.37Å; L132-R136 PolarHBondContact O-N 3.43Å
137G64.3Low67.3Low69 Ų6979 Ų7971%0.71141%0.412SS*.THydrogen-bonded Turntrans99.5-10.4179.600000115.3I135I135-G137 PolarHBondContact O-N 3.28Å; I135-G137 VanDerWaalsContact O-N 3.11Å
138R66Low66.3Low108 Ų10878.7 Ų78.741%0.40841%0.407SS..PPolyproline II helixtrans-80.6144.2170.3-61-179.4-172.4-121.85.4110E134 I135 Y156E134-R138 PolarHBondContact O-NE 3.22Å; E134-R138 IonicContact OE1-CZ 2.71Å; E134-R138 IonicContact OE1-NH2 3.73Å; E134-R138 PolarHBondContact OE1-NH2 2.98Å; I135-R138 PolarHBondContact O-N 3.37Å; R138-Y156 HydrophobicContact CB-CD2 3.95Å; R138-Y156 HydrophobicContact CB-CE2 3.68Å; R138-Y156 WeakPolarHBondContact O-CD2 3.35Å; R138-Y156 WeakPolarHBondContact O-CE2 3.45Å
139E61.7Low65.3Low161 Ų16180.3 Ų80.375%0.75242%0.421SS*.PPolyproline II helixtrans-102.2149.8172.557.3178.5175.200111.2
140L59.1Low64.4Low27 Ų2784.6 Ų84.614%0.14145%0.45CS..PPolyproline II helixtrans-66.8126.7174.5-78.9165.6000109.7R142 F151 Y156L140-R142 PolarHBondContact O-N 2.8Å; L140-R142 VanDerWaalsContact O-N 3.13Å; L140-F151 HydrophobicContact CD1-CB 3.83Å; L140-Y156 HydrophobicContact CD2-CE1 4.02Å; L140-Y156 HydrophobicContact CG-CE1 4.38Å
141P54.9Low63.3Low74 Ų7484.7 Ų84.748%0.48144%0.444SS..PPolyproline II helixtrans-62.2121.9169.224.7-30.9000109.3S143P141-S143 PolarHBondContact O-N 3.43Å
142R47.5Very low61.6Low193 Ų19391.7 Ų91.773%0.72847%0.472SS*.PPolyproline II helixtrans-58.1123.2175.7179.4-174-76-173.4-4109.5L140L140-R142 PolarHBondContact O-N 2.8Å; L140-R142 VanDerWaalsContact O-N 3.13Å
143S56.4Low60.2Low39 Ų3996.1 Ų96.127%0.27350%0.496SS..  trans-145120.7167.8179.80000110.2P141 G145 Y146 T148P141-S143 PolarHBondContact O-N 3.43Å; S143-G145 PolarHBondContact O-N 3.03Å; S143-G145 PolarHBondContact OG-N 3.45Å; S143-Y146 PolarHBondContact O-N 3.39Å; S143-Y146 WeakPolarHBondContact OG-CD2 3.28Å; S143-T148 PolarHBondContact N-OG1 3.26Å; S143-T148 PolarHBondContact O-OG1 3.31Å
144W52.5Low58.9Low221 Ų22196 Ų9684%0.83749%0.486SS*.G310 helixtrans-59-33.1171.6-172.4-99.8000111.6Y146 C147 C149W144-Y146 PolarHBondContact O-N 3.44Å; W144-C147 PolarHBondContact O-N 3.05Å; W144-C149 HydrophobicContact CE3-CB 4.38Å; W144-C149 HydrophobicContact CZ3-CB 4.38Å
145G57.1Low57.9Low68 Ų6895.8 Ų95.870%0.70149%0.491SS*.G310 helixtrans-68.7-16.9-178.800000115.1S143S143-G145 PolarHBondContact O-N 3.03Å; S143-G145 PolarHBondContact OG-N 3.45Å
146Y61.8Low57.5Low109 Ų10996.5 Ų96.543%0.42749%0.493SS..G310 helixtrans-108.111.6178-63-61.7000113S143 W144 T148 Y218 V221 L225S143-Y146 PolarHBondContact O-N 3.39Å; S143-Y146 WeakPolarHBondContact OG-CD2 3.28Å; W144-Y146 PolarHBondContact O-N 3.44Å; Y146-T148 PolarHBondContact O-N 3.43Å; Y146-Y218 WeakPolarHBondContact O-CE2 3.33Å; Y146-Y218 PolarHBondContact O-OH 3.21Å; Y146-V221 HydrophobicContact CD1-CG1 4.23Å; Y146-L225 HydrophobicContact CD1-CD1 3.69Å; Y146-L225 HydrophobicContact CD2-CD1 3.65Å; Y146-L225 HydrophobicContact CD2-CD2 4.32Å; Y146-L225 HydrophobicContact CE1-CD1 4.14Å; Y146-L225 HydrophobicContact CE1-CD2 4.36Å; Y146-L225 HydrophobicContact CE2-CD1 4.15Å; Y146-L225 HydrophobicContact CE2-CD2 3.99Å; Y146-L225 HydrophobicContact CG-CD1 3.44Å; Y146-L225 VanDerWaalsContact CG-CD1 3.44Å
147C58.4Low57.4Low77 Ų7788.8 Ų88.852%0.5247%0.468SS..THydrogen-bonded Turntrans52.521.1-175.3-630000114.3W144 C149 Y218W144-C147 PolarHBondContact O-N 3.05Å; C147-C149 PolarHBondContact O-N 2.85Å; C147-C149 VanDerWaalsContact O-N 3.13Å; C147-Y218 HydrophobicContact CB-CE2 4.09Å; C147-Y218 PolarHBondContact O-OH 2.91Å; C147-Y218 VanDerWaalsContact O-OH 3.1Å
148T62.3Low57.9Low10 Ų1087.1 Ų87.16%0.06144%0.442CS..G310 helixtrans-74.30.7178.8560000112.8S143 Y146 C150 F151 L222S143-T148 PolarHBondContact N-OG1 3.26Å; S143-T148 PolarHBondContact O-OG1 3.31Å; Y146-T148 PolarHBondContact O-N 3.43Å; T148-C150 PolarHBondContact O-N 3.46Å; T148-F151 PolarHBondContact O-N 2.94Å; T148-L222 HydrophobicContact CG2-CD2 3.7Å
149C58.9Low58.6Low62 Ų6286.8 Ų86.842%0.41945%0.445SS..G310 helixtrans-58.4-31.1177.357.50000112.9W144 C147 F151W144-C149 HydrophobicContact CE3-CB 4.38Å; W144-C149 HydrophobicContact CZ3-CB 4.38Å; C147-C149 PolarHBondContact O-N 2.85Å; C147-C149 VanDerWaalsContact O-N 3.13Å; C149-F151 VanDerWaalsContact C-N 3.29Å; C149-F151 PolarHBondContact O-N 3.06Å
150C58.9Low59.6Low114 Ų11479.6 Ų79.677%0.7741%0.412SS*.G310 helixtrans-74.5-15.1175.4-61.20000113.9T148T148-C150 PolarHBondContact O-N 3.46Å
151F56.1Low60.8Low55 Ų5578.6 Ų78.624%0.24141%0.407CS..G310 helixtrans-103.820.7-179.4-66.7-80.1000112.7L140 T148 C149 N153 Q154 F163 Y218 L222L140-F151 HydrophobicContact CD1-CB 3.83Å; T148-F151 PolarHBondContact O-N 2.94Å; C149-F151 VanDerWaalsContact C-N 3.29Å; C149-F151 PolarHBondContact O-N 3.06Å; F151-N153 PolarHBondContact O-N 3.13Å; F151-Q154 PolarHBondContact O-N 3.03Å; F151-F163 HydrophobicContact CZ-CE1 4.2Å; F151-Y218 HydrophobicContact CE2-CE1 4.13Å; F151-L222 HydrophobicContact CE2-CD1 3.87Å; F151-L222 HydrophobicContact CZ-CD1 4.17Å
152Y44.2Very low62.1Low148 Ų14877 Ų7758%0.5839%0.391SS*.THydrogen-bonded Turntrans-54130.2178.6-177.2-114.7000111.7Q154Y152-Q154 VanDerWaalsContact C-N 3.25Å; Y152-Q154 PolarHBondContact O-N 3.05Å
153N48.5Very low64.1Low116 Ų11671 Ų7162%0.6237%0.37SS*.THydrogen-bonded Turntrans63.410.2179.6-70.3-0.7000117.5F151 T155F151-N153 PolarHBondContact O-N 3.13Å; N153-T155 PolarHBondContact O-N 2.78Å; N153-T155 VanDerWaalsContact O-N 3.11Å
154Q52Low65.6Low79 Ų7969.2 Ų69.237%0.36936%0.358SS..  trans-75.3109171.9-168.961.5-53.700108.9F151 Y152F151-Q154 PolarHBondContact O-N 3.03Å; Y152-Q154 VanDerWaalsContact C-N 3.25Å; Y152-Q154 PolarHBondContact O-N 3.05Å
155T54.2Low67.4Low83 Ų8360 Ų6051%0.50932%0.323SS..  trans-54.2143.5161.952.60000107.3N153 T157N153-T155 PolarHBondContact O-N 2.78Å; N153-T155 VanDerWaalsContact O-N 3.11Å; T155-T157 WeakPolarHBondContact O-CG2 3.39Å; T155-T157 PolarHBondContact O-N 2.93Å
156Y62.8Low69Low19 Ų1959.3 Ų59.38%0.07530%0.302CS..  trans-57.6104.3173.4-68.6-82.5000110.8I135 R138 L140 F160 A226I135-Y156 HydrophobicContact CB-CD2 4.33Å; I135-Y156 HydrophobicContact CB-CG 4.26Å; I135-Y156 HydrophobicContact CG2-CD1 3.38Å; I135-Y156 HydrophobicContact CG2-CD2 2.94Å; I135-Y156 HydrophobicContact CG2-CE1 3.85Å; I135-Y156 HydrophobicContact CG2-CE2 3.41Å; I135-Y156 VanDerWaalsContact CG2-CE2 3.41Å; I135-Y156 HydrophobicContact CG2-CG 2.89Å; I135-Y156 WeakPolarHBondContact O-CD2 3.22Å; R138-Y156 HydrophobicContact CB-CD2 3.95Å; R138-Y156 HydrophobicContact CB-CE2 3.68Å; R138-Y156 WeakPolarHBondContact O-CD2 3.35Å; R138-Y156 WeakPolarHBondContact O-CE2 3.45Å; L140-Y156 HydrophobicContact CD2-CE1 4.02Å; L140-Y156 HydrophobicContact CG-CE1 4.38Å; Y156-F160 AromaticContact CD1-CD1 3.94Å; Y156-F160 HydrophobicContact CD1-CD1 3.94Å; Y156-F160 HydrophobicContact CD1-CE1 4.18Å; Y156-F160 HydrophobicContact CD1-CG 4.5Å; Y156-F160 HydrophobicContact CE1-CD1 4.37Å; Y156-F160 HydrophobicContact CE1-CE1 4.16Å; Y156-A226 HydrophobicContact CD1-CB 4.25Å; Y156-A226 HydrophobicContact CE1-CB 3.28Å; Y156-A226 VanDerWaalsContact OH-CA 3.23Å; Y156-A226 WeakPolarHBondContact OH-CA 3.17Å
157T68.5Low70.5Confident33 Ų3354.1 Ų54.120%0.20228%0.281CS..  trans-97.7159.4176.356.20000108.6T155 E159 F160T155-T157 WeakPolarHBondContact O-CG2 3.39Å; T155-T157 PolarHBondContact O-N 2.93Å; T157-E159 PolarHBondContact O-N 3.3Å; T157-E159 VanDerWaalsContact O-N 3.08Å; T157-E159 WeakPolarHBondContact OG1-CB 3.33Å; T157-F160 WeakPolarHBondContact O-CB 3.45Å; T157-F160 PolarHBondContact O-N 3.09Å; T157-F160 PolarHBondContact OG1-N 3.12Å
158I75.2Confident72.1Confident34 Ų3450.4 Ų50.417%0.17426%0.257CS..Hα-helixtrans-51.8-29.9166.7-62.2165.8000110.6L132 R162 Y369 T373L132-I158 HydrophobicContact CD1-CB 4.49Å; L132-I158 HydrophobicContact CD1-CG1 3.58Å; L132-I158 HydrophobicContact CD2-CD1 3.62Å; L132-I158 HydrophobicContact CD2-CG1 3.3Å; L132-I158 HydrophobicContact CG-CG1 4.04Å; I158-R162 VanDerWaalsContact O-CB 3.32Å; I158-R162 WeakPolarHBondContact O-CB 3.23Å; I158-R162 PolarHBondContact O-N 3.22Å; I158-Y369 HydrophobicContact CG2-CD1 4.16Å; I158-Y369 HydrophobicContact CG2-CE1 3.65Å; I158-T373 HydrophobicContact CD1-CG2 4.41Å; I158-T373 HydrophobicContact CG2-CG2 4.29Å
159E79.1Confident73.5Confident100 Ų10050.1 Ų50.147%0.46726%0.255SS..Hα-helixtrans-67.3-33.4178.9-56.5-179.8165.900112.9T157 R162 F163T157-E159 PolarHBondContact O-N 3.3Å; T157-E159 VanDerWaalsContact O-N 3.08Å; T157-E159 WeakPolarHBondContact OG1-CB 3.33Å; E159-R162 PolarHBondContact O-N 3.31Å; E159-F163 VanDerWaalsContact O-CB 3.31Å; E159-F163 WeakPolarHBondContact O-CB 3.38Å; E159-F163 PolarHBondContact O-N 3.38Å
160F83.3Confident75.1Confident11 Ų1150 Ų505%0.04825%0.248CC..Hα-helixtrans-66.2-47.6175.6171.4-97.5000111.9Y156 T157 R162 F163 C164 L222 A226Y156-F160 AromaticContact CD1-CD1 3.94Å; Y156-F160 HydrophobicContact CD1-CD1 3.94Å; Y156-F160 HydrophobicContact CD1-CE1 4.18Å; Y156-F160 HydrophobicContact CD1-CG 4.5Å; Y156-F160 HydrophobicContact CE1-CD1 4.37Å; Y156-F160 HydrophobicContact CE1-CE1 4.16Å; T157-F160 WeakPolarHBondContact O-CB 3.45Å; T157-F160 PolarHBondContact O-N 3.09Å; T157-F160 PolarHBondContact OG1-N 3.12Å; F160-R162 VanDerWaalsContact C-N 3.28Å; F160-R162 PolarHBondContact O-N 3.2Å; F160-F163 WeakPolarHBondContact O-CB 3.42Å; F160-F163 PolarHBondContact O-N 3.3Å; F160-C164 PolarHBondContact O-N 2.99Å; F160-C164 PolarHBondContact O-SG 3.48Å; F160-L222 HydrophobicContact CE2-CB 4.01Å; F160-L222 HydrophobicContact CE2-CD1 4.43Å; F160-L222 HydrophobicContact CZ-CB 3.93Å; F160-A226 HydrophobicContact CE1-CB 3.61Å; F160-A226 HydrophobicContact CZ-CB 3.92Å
161L84.3Confident76.7Confident6 Ų644.7 Ų44.73%0.03121%0.212CC..Hα-helixtrans-61.2-41.5175.7-67.6179.8000110.7Y122 E128 I131 C164 K165 F223Y122-L161 HydrophobicContact CE1-CD2 4.36Å; Y122-L161 WeakPolarHBondContact OH-CB 3.44Å; Y122-L161 PolarHBondContact OH-O 3.43Å; Y122-L161 VanDerWaalsContact OH-O 3.11Å; E128-L161 HydrophobicContact CG-CD1 4.13Å; I131-L161 HydrophobicContact CB-CD1 4.16Å; I131-L161 HydrophobicContact CG2-CD1 3.63Å; I131-L161 HydrophobicContact CG2-CD2 3.8Å; I131-L161 HydrophobicContact CG2-CG 4.36Å; L161-C164 PolarHBondContact O-N 2.68Å; L161-K165 PolarHBondContact O-N 3Å; L161-F223 HydrophobicContact CD2-CD2 4.13Å; L161-F223 HydrophobicContact CD2-CE2 3.98Å
162R82.9Confident78.4Confident39 Ų3942.4 Ų42.415%0.14720%0.202CC..Hα-helixtrans-63.4-42.9175.6-162.7-172.6-43154.618.2112.1I158 E159 F160 C164 K165 Q166I158-R162 VanDerWaalsContact O-CB 3.32Å; I158-R162 WeakPolarHBondContact O-CB 3.23Å; I158-R162 PolarHBondContact O-N 3.22Å; E159-R162 PolarHBondContact O-N 3.31Å; F160-R162 VanDerWaalsContact C-N 3.28Å; F160-R162 PolarHBondContact O-N 3.2Å; R162-C164 VanDerWaalsContact C-N 3.3Å; R162-C164 PolarHBondContact O-N 3.48Å; R162-K165 PolarHBondContact O-N 3.42Å; R162-Q166 HydrophobicContact CG-CG 4.22Å; R162-Q166 VanDerWaalsContact O-CB 3.27Å; R162-Q166 WeakPolarHBondContact O-CB 3.3Å; R162-Q166 VanDerWaalsContact O-CG 3.22Å; R162-Q166 WeakPolarHBondContact O-CG 3.46Å; R162-Q166 PolarHBondContact O-N 3.31Å
163F88Confident80.7Confident69 Ų6938.7 Ų38.730%0.30320%0.195SC..Hα-helixtrans-59-43.7175.3171.4-99.5000110.7F151 E159 F160 Q166 A167 L222F151-F163 HydrophobicContact CZ-CE1 4.2Å; E159-F163 VanDerWaalsContact O-CB 3.31Å; E159-F163 WeakPolarHBondContact O-CB 3.38Å; E159-F163 PolarHBondContact O-N 3.38Å; F160-F163 WeakPolarHBondContact O-CB 3.42Å; F160-F163 PolarHBondContact O-N 3.3Å; F163-Q166 PolarHBondContact O-N 3.24Å; F163-A167 WeakPolarHBondContact O-CB 3.03Å; F163-A167 PolarHBondContact O-N 3.46Å; F163-L222 HydrophobicContact CE1-CD1 4.13Å
164C89.2Confident82.8Confident1 Ų135.7 Ų35.71%0.00718%0.179CC..Hα-helixtrans-61.9-47.3177.3-63.40000111.7F160 L161 R162 A167 T168 F223F160-C164 PolarHBondContact O-N 2.99Å; F160-C164 PolarHBondContact O-SG 3.48Å; L161-C164 PolarHBondContact O-N 2.68Å; R162-C164 VanDerWaalsContact C-N 3.3Å; R162-C164 PolarHBondContact O-N 3.48Å; C164-A167 PolarHBondContact O-N 3.25Å; C164-T168 PolarHBondContact O-N 3.42Å; C164-T168 VanDerWaalsContact O-N 3.09Å; C164-T168 PolarHBondContact O-OG1 3.27Å; C164-F223 HydrophobicContact CB-CB 4.28Å; C164-F223 HydrophobicContact CB-CD2 4.47Å
165K89.5Confident84.5Confident26 Ų2632 Ų3211%0.11316%0.161CC..Hα-helixtrans-61.1-49175.2-76.2-174.3178.7177.30112.4L118 Y122 E128 L161 R162 A167 T168 L169L118-K165 HydrophobicContact CD2-CG 4.18Å; Y122-K165 VanDerWaalsContact CE1-CE 3.48Å; Y122-K165 HydrophobicContact CE2-CD 4.17Å; Y122-K165 HydrophobicContact CE2-CG 3.71Å; E128-K165 IonicContact OE2-NZ 3Å; E128-K165 PolarHBondContact OE2-NZ 2.89Å; L161-K165 PolarHBondContact O-N 3Å; R162-K165 PolarHBondContact O-N 3.42Å; K165-A167 VanDerWaalsContact C-N 3.32Å; K165-A167 PolarHBondContact O-N 3.03Å; K165-T168 PolarHBondContact O-N 3.18Å; K165-L169 WeakPolarHBondContact O-CB 3.33Å; K165-L169 VanDerWaalsContact O-CG 3.26Å; K165-L169 WeakPolarHBondContact O-CG 3.43Å; K165-L169 PolarHBondContact O-N 3.23Å
166Q91.1Very high86.2Confident54 Ų5430 Ų3025%0.25215%0.15SC..Hα-helixtrans-59.7-43.2178.8-75.3174.6-15.700111.2R162 F163 T168 L169 Q170 N364 F365R162-Q166 HydrophobicContact CG-CG 4.22Å; R162-Q166 VanDerWaalsContact O-CB 3.27Å; R162-Q166 WeakPolarHBondContact O-CB 3.3Å; R162-Q166 VanDerWaalsContact O-CG 3.22Å; R162-Q166 WeakPolarHBondContact O-CG 3.46Å; R162-Q166 PolarHBondContact O-N 3.31Å; F163-Q166 PolarHBondContact O-N 3.24Å; Q166-T168 VanDerWaalsContact C-N 3.32Å; Q166-T168 PolarHBondContact O-N 3.26Å; Q166-L169 PolarHBondContact O-N 3.13Å; Q166-Q170 WeakPolarHBondContact O-CB 3.3Å; Q166-Q170 PolarHBondContact O-N 3.3Å; Q166-N364 HydrophobicContact CG-CB 4.11Å; Q166-N364 PolarHBondContact NE2-O 2.94Å; Q166-F365 HydrophobicContact CB-CE1 4.42Å; Q166-F365 HydrophobicContact CB-CZ 4.39Å; Q166-F365 HydrophobicContact CG-CE1 4.19Å; Q166-F365 HydrophobicContact CG-CZ 4.4Å
167A92.1Very high87.6Confident0 Ų033.5 Ų33.50%017%0.169CC..Hα-helixtrans-63.7-35.8178.100000112.8F163 C164 K165 Q170 V215 A216 A219F163-A167 WeakPolarHBondContact O-CB 3.03Å; F163-A167 PolarHBondContact O-N 3.46Å; C164-A167 PolarHBondContact O-N 3.25Å; K165-A167 VanDerWaalsContact C-N 3.32Å; K165-A167 PolarHBondContact O-N 3.03Å; A167-Q170 VanDerWaalsContact CA-CD 3.44Å; A167-Q170 WeakPolarHBondContact O-CG 3.02Å; A167-Q170 PolarHBondContact O-NE2 3.33Å; A167-V215 HydrophobicContact CB-CG1 4.14Å; A167-A216 WeakPolarHBondContact O-CB 3.43Å; A167-A219 HydrophobicContact CB-CB 3.38Å
168T92.1Very high88.7Confident0 Ų032.7 Ų32.70%016%0.164CC..Hα-helixtrans-76.4-40.4173.6-610000112.2V114 L118 C164 K165 Q166 Q170 F171 C172V114-T168 HydrophobicContact CG1-CG2 3.82Å; L118-T168 HydrophobicContact CB-CG2 4.41Å; L118-T168 HydrophobicContact CD2-CG2 4.1Å; L118-T168 WeakPolarHBondContact CD2-OG1 3.36Å; C164-T168 PolarHBondContact O-N 3.42Å; C164-T168 VanDerWaalsContact O-N 3.09Å; C164-T168 PolarHBondContact O-OG1 3.27Å; K165-T168 PolarHBondContact O-N 3.18Å; Q166-T168 VanDerWaalsContact C-N 3.32Å; Q166-T168 PolarHBondContact O-N 3.26Å; T168-Q170 VanDerWaalsContact C-N 3.34Å; T168-Q170 PolarHBondContact O-N 3.28Å; T168-F171 WeakPolarHBondContact O-CB 3.47Å; T168-F171 PolarHBondContact O-N 3.22Å; T168-C172 PolarHBondContact O-N 3.09Å; T168-C172 PolarHBondContact O-SG 3.43Å
169L92.3Very high89.4Confident3 Ų331.4 Ų31.42%0.01616%0.158CC..Hα-helixtrans-65.3-36177.8-75.4164.7000112.1Y115 K165 Q166 F171 C172 V173 M357 D360 A361 N364 F365Y115-L169 HydrophobicContact CD2-CD2 3.86Å; Y115-L169 HydrophobicContact CD2-CG 4.4Å; Y115-L169 HydrophobicContact CE2-CD2 3.78Å; Y115-L169 HydrophobicContact CE2-CG 4.45Å; K165-L169 WeakPolarHBondContact O-CB 3.33Å; K165-L169 VanDerWaalsContact O-CG 3.26Å; K165-L169 WeakPolarHBondContact O-CG 3.43Å; K165-L169 PolarHBondContact O-N 3.23Å; Q166-L169 PolarHBondContact O-N 3.13Å; L169-F171 PolarHBondContact O-N 2.81Å; L169-C172 WeakPolarHBondContact O-CB 3.15Å; L169-C172 PolarHBondContact O-N 3.42Å; L169-C172 VanDerWaalsContact O-N 3.13Å; L169-V173 PolarHBondContact O-N 3.43Å; L169-V173 VanDerWaalsContact O-N 3.1Å; L169-M357 HydrophobicContact CD2-CG 3.98Å; L169-D360 HydrophobicContact CD1-CB 4.35Å; L169-D360 HydrophobicContact CD2-CB 4.4Å; L169-A361 HydrophobicContact CD2-CB 4.33Å; L169-N364 HydrophobicContact CD1-CB 4.08Å; L169-F365 HydrophobicContact CB-CE2 4.18Å
170Q93.8Very high89.9Confident59 Ų5931.1 Ų31.128%0.27616%0.159SC..Hα-helixtrans-59.7-37.3175.589.2-150.4-9.200110.6Q166 A167 T168 C172 V173 I174Q166-Q170 WeakPolarHBondContact O-CB 3.3Å; Q166-Q170 PolarHBondContact O-N 3.3Å; A167-Q170 VanDerWaalsContact CA-CD 3.44Å; A167-Q170 WeakPolarHBondContact O-CG 3.02Å; A167-Q170 PolarHBondContact O-NE2 3.33Å; T168-Q170 VanDerWaalsContact C-N 3.34Å; T168-Q170 PolarHBondContact O-N 3.28Å; Q170-C172 VanDerWaalsContact C-N 3.35Å; Q170-V173 PolarHBondContact O-N 2.83Å; Q170-I174 VanDerWaalsContact O-CB 3.31Å; Q170-I174 WeakPolarHBondContact O-CB 3.49Å; Q170-I174 WeakPolarHBondContact O-CG1 3.27Å; Q170-I174 PolarHBondContact O-N 3.29Å
171F92.3Very high90.3Very high4 Ų433.8 Ų33.82%0.01818%0.176CC..Hα-helixtrans-69.8-37179.1178.5-116.8000110.9A111 V114 T168 L169 V173 I174 K175 Y209 S212 A213 A216A111-F171 HydrophobicContact CB-CD1 3.57Å; A111-F171 HydrophobicContact CB-CE1 3.64Å; A111-F171 HydrophobicContact CB-CG 4.28Å; A111-F171 HydrophobicContact CB-CZ 4.39Å; V114-F171 HydrophobicContact CB-CD1 4.4Å; V114-F171 HydrophobicContact CB-CE1 4.45Å; V114-F171 HydrophobicContact CG1-CD1 4.4Å; V114-F171 HydrophobicContact CG2-CE1 4.1Å; T168-F171 WeakPolarHBondContact O-CB 3.47Å; T168-F171 PolarHBondContact O-N 3.22Å; L169-F171 PolarHBondContact O-N 2.81Å; F171-V173 PolarHBondContact O-N 3.18Å; F171-I174 PolarHBondContact O-N 3.46Å; F171-K175 HydrophobicContact CE2-CB 4.45Å; F171-K175 HydrophobicContact CE2-CD 4.07Å; F171-K175 HydrophobicContact CZ-CD 4.07Å; F171-K175 WeakPolarHBondContact O-CB 3.34Å; F171-K175 PolarHBondContact O-N 3.23Å; F171-Y209 HydrophobicContact CE2-CD2 4Å; F171-Y209 AromaticContact CE2-CE2 3.62Å; F171-Y209 HydrophobicContact CE2-CE2 3.62Å; F171-Y209 AromaticContact CZ-CE2 3.92Å; F171-Y209 HydrophobicContact CZ-CE2 3.92Å; F171-S212 WeakPolarHBondContact CA-OG 3.49Å; F171-A213 HydrophobicContact CD2-CB 4.36Å; F171-A213 HydrophobicContact CE2-CB 3.74Å; F171-A213 HydrophobicContact CZ-CB 4.28Å; F171-A216 HydrophobicContact CB-CB 3.61Å; F171-A216 HydrophobicContact CD1-CB 4.28Å; F171-A216 HydrophobicContact CG-CB 3.96Å
172C91.5Very high90.4Very high6 Ų634 Ų344%0.04118%0.177CC..Hα-helixtrans-63.3-26.1173.1-590000114.2A111 Y115 T168 L169 Q170 P176 M357A111-C172 HydrophobicContact CB-CB 4.37Å; A111-C172 PolarHBondContact O-SG 3.21Å; Y115-C172 WeakPolarHBondContact CB-SG 3.37Å; T168-C172 PolarHBondContact O-N 3.09Å; T168-C172 PolarHBondContact O-SG 3.43Å; L169-C172 WeakPolarHBondContact O-CB 3.15Å; L169-C172 PolarHBondContact O-N 3.42Å; L169-C172 VanDerWaalsContact O-N 3.13Å; Q170-C172 VanDerWaalsContact C-N 3.35Å; C172-P176 WeakPolarHBondContact O-CD 3.25Å; C172-P176 VanDerWaalsContact O-CG 3.3Å; C172-P176 WeakPolarHBondContact O-CG 3.34Å; C172-M357 HydrophobicContact CB-CG 4.42Å; C172-M357 HydrophobicContact CB-SD 3.58Å; C172-M357 VanDerWaalsContact CB-SD 3.58Å
173V91.6Very high90.6Very high70 Ų7034.9 Ų34.942%0.42418%0.184SC..Hα-helixtrans-90.3-46.7176175.70000110.9L169 Q170 F171 K175 P176 L177L169-V173 PolarHBondContact O-N 3.43Å; L169-V173 VanDerWaalsContact O-N 3.1Å; Q170-V173 PolarHBondContact O-N 2.83Å; F171-V173 PolarHBondContact O-N 3.18Å; V173-K175 VanDerWaalsContact C-N 3.34Å; V173-K175 PolarHBondContact O-N 3.42Å; V173-P176 WeakPolarHBondContact O-CD 3.41Å; V173-L177 HydrophobicContact CG1-CD1 3.83Å; V173-L177 VanDerWaalsContact O-CG 3.25Å; V173-L177 WeakPolarHBondContact O-CG 3.31Å; V173-L177 PolarHBondContact O-N 2.77Å
174I92.4Very high90.7Very high54 Ų5435.8 Ų35.828%0.27719%0.192SC..Hα-helixtrans-64.1-40.1-177.5-68.2-66.3000111Q170 F171 L177 T178 V208Q170-I174 VanDerWaalsContact O-CB 3.31Å; Q170-I174 WeakPolarHBondContact O-CB 3.49Å; Q170-I174 WeakPolarHBondContact O-CG1 3.27Å; Q170-I174 PolarHBondContact O-N 3.29Å; F171-I174 PolarHBondContact O-N 3.46Å; I174-L177 PolarHBondContact O-N 3.33Å; I174-T178 HydrophobicContact CG2-CG2 3.95Å; I174-T178 WeakPolarHBondContact O-CG2 3.22Å; I174-T178 PolarHBondContact O-N 3.23Å; I174-T178 PolarHBondContact O-OG1 3.43Å; I174-T178 VanDerWaalsContact O-OG1 3.11Å; I174-V208 HydrophobicContact CG2-CG1 3.89Å
175K88.4Confident90.6Very high2 Ų237.8 Ų37.81%0.00920%0.202CC..Hα-helixtrans-61.8-54.9-175.7-173.989.7-172.5-171.30112.3D107 E110 A111 F171 V173 L177 T178 S179 Y209D107-K175 WeakPolarHBondContact O-CE 3.17Å; D107-K175 WeakPolarHBondContact O-CG 3.49Å; D107-K175 WeakPolarHBondContact OD2-CE 3.43Å; D107-K175 IonicContact OD2-NZ 3.87Å; D107-K175 PolarHBondContact OD2-NZ 2.74Å; E110-K175 WeakPolarHBondContact OE2-CE 3.45Å; E110-K175 IonicContact OE2-NZ 2.85Å; E110-K175 PolarHBondContact OE2-NZ 3.11Å; A111-K175 HydrophobicContact CB-CB 3.83Å; A111-K175 HydrophobicContact CB-CG 4.18Å; F171-K175 HydrophobicContact CE2-CB 4.45Å; F171-K175 HydrophobicContact CE2-CD 4.07Å; F171-K175 HydrophobicContact CZ-CD 4.07Å; F171-K175 WeakPolarHBondContact O-CB 3.34Å; F171-K175 PolarHBondContact O-N 3.23Å; V173-K175 VanDerWaalsContact C-N 3.34Å; V173-K175 PolarHBondContact O-N 3.42Å; K175-L177 VanDerWaalsContact C-N 3.29Å; K175-L177 PolarHBondContact O-N 2.99Å; K175-T178 WeakPolarHBondContact CA-OG1 3.49Å; K175-T178 PolarHBondContact O-N 2.78Å; K175-T178 VanDerWaalsContact O-N 3.12Å; K175-T178 PolarHBondContact O-OG1 3.25Å; K175-S179 PolarHBondContact O-N 3.47Å; K175-S179 PolarHBondContact O-OG 3.44Å; K175-Y209 HydrophobicContact CD-CD2 3.5Å; K175-Y209 HydrophobicContact CD-CE2 3.3Å; K175-Y209 PolarHBondContact NZ-OH 3.44Å
176P90.6Very high90.3Very high41 Ų4138.1 Ų38.127%0.26620%0.204SC..Hα-helixtrans-57.8-38.2173.3-25.434.5000113.9C172 V173 S179 I180C172-P176 WeakPolarHBondContact O-CD 3.25Å; C172-P176 VanDerWaalsContact O-CG 3.3Å; C172-P176 WeakPolarHBondContact O-CG 3.34Å; V173-P176 WeakPolarHBondContact O-CD 3.41Å; P176-S179 PolarHBondContact O-N 3.1Å; P176-I180 WeakPolarHBondContact O-CG1 3.16Å; P176-I180 PolarHBondContact O-N 3.25Å
177L92.1Very high90Very high92 Ų9239.5 Ų39.548%0.48222%0.224SC..Hα-helixtrans-62.4-44.3175.9-70.2174.7000111.3V173 I174 K175 S179 I180 V181V173-L177 HydrophobicContact CG1-CD1 3.83Å; V173-L177 VanDerWaalsContact O-CG 3.25Å; V173-L177 WeakPolarHBondContact O-CG 3.31Å; V173-L177 PolarHBondContact O-N 2.77Å; I174-L177 PolarHBondContact O-N 3.33Å; K175-L177 VanDerWaalsContact C-N 3.29Å; K175-L177 PolarHBondContact O-N 2.99Å; L177-S179 VanDerWaalsContact C-N 3.31Å; L177-S179 PolarHBondContact O-N 2.81Å; L177-I180 PolarHBondContact O-N 3.03Å; L177-V181 WeakPolarHBondContact O-CB 3.38Å; L177-V181 VanDerWaalsContact O-CG2 3.24Å; L177-V181 WeakPolarHBondContact O-CG2 3.33Å; L177-V181 PolarHBondContact O-N 2.89Å
178T90.6Very high89.8Confident15 Ų1545 Ų459%0.09225%0.253CS..Hα-helixtrans-63.9-35.6175.652.30000112.3I174 K175 T182 V208I174-T178 HydrophobicContact CG2-CG2 3.95Å; I174-T178 WeakPolarHBondContact O-CG2 3.22Å; I174-T178 PolarHBondContact O-N 3.23Å; I174-T178 PolarHBondContact O-OG1 3.43Å; I174-T178 VanDerWaalsContact O-OG1 3.11Å; K175-T178 WeakPolarHBondContact CA-OG1 3.49Å; K175-T178 PolarHBondContact O-N 2.78Å; K175-T178 VanDerWaalsContact O-N 3.12Å; K175-T178 PolarHBondContact O-OG1 3.25Å; T178-T182 WeakPolarHBondContact O-CB 3.42Å; T178-T182 PolarHBondContact O-N 2.96Å; T178-T182 PolarHBondContact O-OG1 3.1Å; T178-V208 HydrophobicContact CG2-CG1 4.02Å
179S89.7Confident89.3Confident8 Ų847.3 Ų47.36%0.05628%0.277CS..Hα-helixtrans-65.9-45.8174.1-58.70000111.9K175 P176 L177 T182 I183K175-S179 PolarHBondContact O-N 3.47Å; K175-S179 PolarHBondContact O-OG 3.44Å; P176-S179 PolarHBondContact O-N 3.1Å; L177-S179 VanDerWaalsContact C-N 3.31Å; L177-S179 PolarHBondContact O-N 2.81Å; S179-T182 WeakPolarHBondContact O-CB 3.49Å; S179-T182 PolarHBondContact O-N 2.68Å; S179-I183 WeakPolarHBondContact O-CG1 3.28Å; S179-I183 PolarHBondContact O-N 2.99Å
180I90.5Very high88.9Confident94 Ų9450.3 Ų50.348%0.48230%0.295SS..Hα-helixtrans-62.9-46.3177.3-68.3165.3000110.8P176 L177 T182 I183 I184P176-I180 WeakPolarHBondContact O-CG1 3.16Å; P176-I180 PolarHBondContact O-N 3.25Å; L177-I180 PolarHBondContact O-N 3.03Å; I180-T182 VanDerWaalsContact C-N 3.27Å; I180-T182 PolarHBondContact O-N 3.37Å; I180-I183 PolarHBondContact O-N 3.34Å; I180-I184 HydrophobicContact CG2-CD1 3.84Å; I180-I184 WeakPolarHBondContact O-CG1 3.46Å; I180-I184 PolarHBondContact O-N 3.23Å
181V90.7Very high88.3Confident66 Ų6648.3 Ų48.340%0.429%0.285SS..Hα-helixtrans-59.4-40.6176.1168.10000110.7L177 I184 L185 V205L177-V181 WeakPolarHBondContact O-CB 3.38Å; L177-V181 VanDerWaalsContact O-CG2 3.24Å; L177-V181 WeakPolarHBondContact O-CG2 3.33Å; L177-V181 PolarHBondContact O-N 2.89Å; V181-I184 PolarHBondContact O-N 3.26Å; V181-L185 HydrophobicContact CG1-CD1 3.52Å; V181-L185 HydrophobicContact CG1-CG 4.06Å; V181-L185 WeakPolarHBondContact O-CB 3.22Å; V181-L185 WeakPolarHBondContact O-CG 3.06Å; V181-L185 PolarHBondContact O-N 3.46Å; V181-V205 HydrophobicContact CG1-CG2 4.13Å
182T87.5Confident87.4Confident11 Ų1153.4 Ų53.47%0.06731%0.307CS..Hα-helixtrans-59.5-48.4175.8-63.10000111.7V100 T178 S179 I180 I184 L185 Q186 Y191 V205V100-T182 HydrophobicContact CG1-CG2 4.07Å; T178-T182 WeakPolarHBondContact O-CB 3.42Å; T178-T182 PolarHBondContact O-N 2.96Å; T178-T182 PolarHBondContact O-OG1 3.1Å; S179-T182 WeakPolarHBondContact O-CB 3.49Å; S179-T182 PolarHBondContact O-N 2.68Å; I180-T182 VanDerWaalsContact C-N 3.27Å; I180-T182 PolarHBondContact O-N 3.37Å; T182-I184 VanDerWaalsContact C-N 3.34Å; T182-I184 PolarHBondContact O-N 3.24Å; T182-L185 PolarHBondContact O-N 2.64Å; T182-Q186 VanDerWaalsContact O-CB 3.29Å; T182-Q186 WeakPolarHBondContact O-CB 3.48Å; T182-Q186 PolarHBondContact O-N 3.36Å; T182-Y191 HydrophobicContact CG2-CD1 4.47Å; T182-Y191 HydrophobicContact CG2-CD2 4.3Å; T182-Y191 HydrophobicContact CG2-CE1 3.9Å; T182-Y191 HydrophobicContact CG2-CE2 3.69Å; T182-Y191 VanDerWaalsContact CG2-CZ 3.43Å; T182-Y191 WeakPolarHBondContact CG2-OH 3.34Å; T182-V205 WeakPolarHBondContact OG1-CG1 3.43Å
183I87Confident86.4Confident57 Ų5754.7 Ų54.729%0.29231%0.313SS..Hα-helixtrans-60-43.7177.8-66.8166.5000111.2Y101 S179 I180 A187Y101-I183 HydrophobicContact CD1-CD1 4.43Å; Y101-I183 HydrophobicContact CD1-CG1 4.44Å; Y101-I183 HydrophobicContact CE1-CG1 4.46Å; Y101-I183 HydrophobicContact CE1-CG2 3.99Å; S179-I183 WeakPolarHBondContact O-CG1 3.28Å; S179-I183 PolarHBondContact O-N 2.99Å; I180-I183 PolarHBondContact O-N 3.34Å; I183-A187 WeakPolarHBondContact O-CB 3.3Å; I183-A187 PolarHBondContact O-N 3.4Å
184I89.4Confident85.3Confident89 Ų8951.5 Ų51.546%0.45629%0.294SS..Hα-helixtrans-66-46.9179.5-66.9168.6000111.1I180 V181 T182 Q186 A187 I188I180-I184 HydrophobicContact CG2-CD1 3.84Å; I180-I184 WeakPolarHBondContact O-CG1 3.46Å; I180-I184 PolarHBondContact O-N 3.23Å; V181-I184 PolarHBondContact O-N 3.26Å; T182-I184 VanDerWaalsContact C-N 3.34Å; T182-I184 PolarHBondContact O-N 3.24Å; I184-Q186 VanDerWaalsContact C-N 3.3Å; I184-Q186 PolarHBondContact O-N 2.89Å; I184-A187 PolarHBondContact O-N 3.35Å; I184-I188 HydrophobicContact CG2-CD1 3.79Å; I184-I188 WeakPolarHBondContact O-CG1 3.4Å; I184-I188 PolarHBondContact O-N 3.45Å
185L87.1Confident84.3Confident42 Ų4252.7 Ų52.722%0.2230%0.3CS..Hα-helixtrans-67.5-32.8-179.2-66.3172.4000111.8V181 T182 I188 G189 V190 Y191 V205V181-L185 HydrophobicContact CG1-CD1 3.52Å; V181-L185 HydrophobicContact CG1-CG 4.06Å; V181-L185 WeakPolarHBondContact O-CB 3.22Å; V181-L185 WeakPolarHBondContact O-CG 3.06Å; V181-L185 PolarHBondContact O-N 3.46Å; T182-L185 PolarHBondContact O-N 2.64Å; L185-I188 PolarHBondContact O-N 3.25Å; L185-G189 PolarHBondContact O-N 2.85Å; L185-G189 VanDerWaalsContact O-N 3.15Å; L185-V190 HydrophobicContact CB-CG2 4.11Å; L185-V190 HydrophobicContact CD2-CG2 3.61Å; L185-V190 HydrophobicContact CG-CG2 4.48Å; L185-V190 PolarHBondContact O-N 3.24Å; L185-V190 VanDerWaalsContact O-N 3.13Å; L185-Y191 VanDerWaalsContact C-CB 3.48Å; L185-Y191 HydrophobicContact CB-CD2 4.26Å; L185-Y191 HydrophobicContact CB-CG 4.4Å; L185-Y191 HydrophobicContact CD1-CD2 4.46Å; L185-Y191 PolarHBondContact O-N 2.81Å; L185-Y191 VanDerWaalsContact O-N 3.13Å; L185-V205 HydrophobicContact CD1-CG2 4.26Å
186Q84.3Confident83.5Confident33 Ų3356.2 Ų56.215%0.15432%0.316CS..Hα-helixtrans-63.8-47.2171.1-174.574.21800110.6D97 T182 I184 I188 G189 Y191D97-Q186 VanDerWaalsContact CG-NE2 3.33Å; D97-Q186 PolarHBondContact OD1-NE2 3.36Å; T182-Q186 VanDerWaalsContact O-CB 3.29Å; T182-Q186 WeakPolarHBondContact O-CB 3.48Å; T182-Q186 PolarHBondContact O-N 3.36Å; I184-Q186 VanDerWaalsContact C-N 3.3Å; I184-Q186 PolarHBondContact O-N 2.89Å; Q186-I188 PolarHBondContact O-N 3.27Å; Q186-G189 PolarHBondContact O-N 3.24Å; Q186-Y191 PolarHBondContact OE1-O 2.83Å
187A85.1Confident82.8Confident83 Ų8356.5 Ų56.569%0.68632%0.319SS*.Hα-helixtrans-62-30.6178.700000113.3I183 I184 G189I183-A187 WeakPolarHBondContact O-CB 3.3Å; I183-A187 PolarHBondContact O-N 3.4Å; I184-A187 PolarHBondContact O-N 3.35Å; A187-G189 VanDerWaalsContact C-N 3.34Å
188I87.7Confident82.2Confident115 Ų11555.5 Ų55.559%0.5932%0.324SS*.Hα-helixtrans-81.8-13.9175.5-62165.5000111.7I184 L185 Q186 V190I184-I188 HydrophobicContact CG2-CD1 3.79Å; I184-I188 WeakPolarHBondContact O-CG1 3.4Å; I184-I188 PolarHBondContact O-N 3.45Å; L185-I188 PolarHBondContact O-N 3.25Å; Q186-I188 PolarHBondContact O-N 3.27Å; I188-V190 VanDerWaalsContact C-N 3.33Å; I188-V190 HydrophobicContact CB-CG2 4.17Å; I188-V190 HydrophobicContact CG2-CG1 4.1Å; I188-V190 HydrophobicContact CG2-CG2 4.02Å
189G80.3Confident81.8Confident49 Ų4961 Ų6151%0.50536%0.357SS..THydrogen-bonded Turntrans78.810.2-179.300000115L185 Q186 A187L185-G189 PolarHBondContact O-N 2.85Å; L185-G189 VanDerWaalsContact O-N 3.15Å; Q186-G189 PolarHBondContact O-N 3.24Å; A187-G189 VanDerWaalsContact C-N 3.34Å
190V84.7Confident81.5Confident67 Ų6761.1 Ų61.141%0.40636%0.358SS..  trans-94.9-3.3176.5-65.70000113L185 I188 N200 G201L185-V190 HydrophobicContact CB-CG2 4.11Å; L185-V190 HydrophobicContact CD2-CG2 3.61Å; L185-V190 HydrophobicContact CG-CG2 4.48Å; L185-V190 PolarHBondContact O-N 3.24Å; L185-V190 VanDerWaalsContact O-N 3.13Å; I188-V190 VanDerWaalsContact C-N 3.33Å; I188-V190 HydrophobicContact CB-CG2 4.17Å; I188-V190 HydrophobicContact CG2-CG1 4.1Å; I188-V190 HydrophobicContact CG2-CG2 4.02Å; V190-N200 PolarHBondContact O-OD1 3.32Å; V190-G201 PolarHBondContact O-N 3.13Å; V190-G201 VanDerWaalsContact O-N 3.09Å
191Y80.2Confident81.2Confident17 Ų1757.1 Ų57.17%0.06734%0.339CS..  trans-103.5118.9168-169.1-81.6000108.9T182 L185 Q186 H193 N200 Y202 V205T182-Y191 HydrophobicContact CG2-CD1 4.47Å; T182-Y191 HydrophobicContact CG2-CD2 4.3Å; T182-Y191 HydrophobicContact CG2-CE1 3.9Å; T182-Y191 HydrophobicContact CG2-CE2 3.69Å; T182-Y191 VanDerWaalsContact CG2-CZ 3.43Å; T182-Y191 WeakPolarHBondContact CG2-OH 3.34Å; L185-Y191 VanDerWaalsContact C-CB 3.48Å; L185-Y191 HydrophobicContact CB-CD2 4.26Å; L185-Y191 HydrophobicContact CB-CG 4.4Å; L185-Y191 HydrophobicContact CD1-CD2 4.46Å; L185-Y191 PolarHBondContact O-N 2.81Å; L185-Y191 VanDerWaalsContact O-N 3.13Å; Q186-Y191 PolarHBondContact OE1-O 2.83Å; Y191-H193 HydrophobicContact CE1-CB 4.29Å; Y191-N200 WeakPolarHBondContact CA-OD1 3.3Å; Y191-Y202 HydrophobicContact CE1-CD2 4.18Å; Y191-Y202 HydrophobicContact CE2-CD2 4.12Å; Y191-Y202 AromaticContact CZ-CD2 3.65Å; Y191-Y202 WeakPolarHBondContact OH-CD2 3.45Å; Y191-V205 HydrophobicContact CE2-CB 4.34Å; Y191-V205 HydrophobicContact CE2-CG2 4.23Å
192K73.9Confident80.9Confident110 Ų11054.8 Ų54.848%0.47832%0.323SS..  trans-119.9118.2166.4-67.3-173176.7-171.30108G194 I195 N200 Y202K192-G194 PolarHBondContact O-N 3.3Å; K192-I195 HydrophobicContact CB-CB 4.43Å; K192-I195 HydrophobicContact CB-CD1 3.75Å; K192-I195 HydrophobicContact CB-CG1 4.22Å; K192-I195 HydrophobicContact CD-CD1 3.69Å; K192-I195 HydrophobicContact CG-CD1 4.37Å; K192-I195 PolarHBondContact O-N 2.74Å; K192-N200 PolarHBondContact N-OD1 3.33Å; K192-N200 PolarHBondContact O-ND2 2.87Å; K192-Y202 WeakPolarHBondContact O-CB 3.47Å
193H71.5Confident80.8Confident33 Ų3356.6 Ų56.615%0.15333%0.332CS..THydrogen-bonded Turntrans-56.5132.9-179.7-163.185.7000110Y99 Y191 I195 Y202 G275Y99-H193 WeakPolarHBondContact OH-CB 3.32Å; Y191-H193 HydrophobicContact CE1-CB 4.29Å; H193-I195 VanDerWaalsContact C-N 3.32Å; H193-I195 PolarHBondContact O-N 3.44Å; H193-Y202 AromaticContact CE1-CE2 3.84Å; H193-Y202 AromaticContact ND1-CE2 3.81Å; H193-G275 PolarHBondContact CD2-O 2.77Å
194G67.6Low80.9Confident4 Ų460.5 Ų60.54%0.04134%0.344CS..THydrogen-bonded Turntrans85.7-19.8172.800000117.6K192 F196 Y202 E261K192-G194 PolarHBondContact O-N 3.3Å; G194-F196 WeakPolarHBondContact O-CD2 3.25Å; G194-F196 PolarHBondContact O-N 3.5Å; G194-F196 VanDerWaalsContact O-N 3.13Å; G194-Y202 VanDerWaalsContact CA-CE1 3.47Å; G194-E261 WeakPolarHBondContact CA-OE1 3.17Å; G194-E261 WeakPolarHBondContact CA-OE2 3.33Å
195I70.6Confident80.8Confident78 Ų7857 Ų5740%0.433%0.327SS..  trans-79.7102.2178.4-58.2177.5000110.4K192 H193 S197 N200K192-I195 HydrophobicContact CB-CB 4.43Å; K192-I195 HydrophobicContact CB-CD1 3.75Å; K192-I195 HydrophobicContact CB-CG1 4.22Å; K192-I195 HydrophobicContact CD-CD1 3.69Å; K192-I195 HydrophobicContact CG-CD1 4.37Å; K192-I195 PolarHBondContact O-N 2.74Å; H193-I195 VanDerWaalsContact C-N 3.32Å; H193-I195 PolarHBondContact O-N 3.44Å; I195-S197 VanDerWaalsContact C-N 3.25Å; I195-S197 PolarHBondContact O-N 3.43Å; I195-N200 WeakPolarHBondContact CB-ND2 3.27Å; I195-N200 PolarHBondContact O-ND2 3.34Å
196F71.6Confident80.7Confident76 Ų7656.2 Ų56.233%0.33332%0.324SS..  trans-77.369.2173.2-71.5-84.7000112.5G194 Y202 L203 T206 A258 K262G194-F196 WeakPolarHBondContact O-CD2 3.25Å; G194-F196 PolarHBondContact O-N 3.5Å; G194-F196 VanDerWaalsContact O-N 3.13Å; F196-Y202 HydrophobicContact CD1-CE1 4.42Å; F196-Y202 HydrophobicContact CD2-CE1 4.25Å; F196-Y202 HydrophobicContact CE1-CD1 4.39Å; F196-Y202 AromaticContact CE1-CE1 3.93Å; F196-Y202 HydrophobicContact CE1-CE1 3.93Å; F196-Y202 AromaticContact CE2-CE1 3.75Å; F196-Y202 HydrophobicContact CE2-CE1 3.75Å; F196-Y202 HydrophobicContact CZ-CD1 4.42Å; F196-Y202 AromaticContact CZ-CE1 3.58Å; F196-Y202 HydrophobicContact CZ-CE1 3.58Å; F196-L203 HydrophobicContact CD1-CD1 4.45Å; F196-T206 HydrophobicContact CE1-CG2 4.26Å; F196-A258 HydrophobicContact CE2-CB 3.8Å; F196-A258 HydrophobicContact CZ-CB 3.75Å; F196-K262 HydrophobicContact CD2-CB 4.45Å
197S75.8Confident80.9Confident48 Ų4859.1 Ų59.134%0.33634%0.344SS..  trans-109.8144.3171-178.90000110.4I195 T199 N200I195-S197 VanDerWaalsContact C-N 3.25Å; I195-S197 PolarHBondContact O-N 3.43Å; S197-T199 PolarHBondContact O-N 3.5Å; S197-T199 VanDerWaalsContact O-N 3.15Å; S197-T199 PolarHBondContact OG-N 2.86Å; S197-N200 PolarHBondContact O-N 2.8Å
198A81.2Confident81.2Confident71 Ų7158.8 Ų58.859%0.58733%0.333SS*.THydrogen-bonded Turntrans-61.1-19.3173.400000112.7Y204A198-Y204 VanDerWaalsContact O-CE2 3.31Å; A198-Y204 WeakPolarHBondContact O-CE2 3.08Å; A198-Y204 PolarHBondContact O-OH 3.37Å
199T81.6Confident81.2Confident130 Ų13055 Ų5580%0.79831%0.311SS*.THydrogen-bonded Turntrans-84.3-13.1175.5-41.60000112.8S197S197-T199 PolarHBondContact O-N 3.5Å; S197-T199 VanDerWaalsContact O-N 3.15Å; S197-T199 PolarHBondContact OG-N 2.86Å
200N83Confident81.6Confident11 Ų1154 Ų546%0.05930%0.295CS..SBendtrans-99.6135.1-173-173.12.4000111.6V190 Y191 K192 I195 S197 Y202 L203V190-N200 PolarHBondContact O-OD1 3.32Å; Y191-N200 WeakPolarHBondContact CA-OD1 3.3Å; K192-N200 PolarHBondContact N-OD1 3.33Å; K192-N200 PolarHBondContact O-ND2 2.87Å; I195-N200 WeakPolarHBondContact CB-ND2 3.27Å; I195-N200 PolarHBondContact O-ND2 3.34Å; S197-N200 PolarHBondContact O-N 2.8Å; N200-Y202 PolarHBondContact O-N 3.47Å; N200-Y202 PolarHBondContact OD1-N 3.32Å; N200-L203 PolarHBondContact O-N 2.94Å
201G85.2Confident81.8Confident9 Ų952.6 Ų52.69%0.09329%0.294CS..Hα-helixtrans-58.1-28.9176.100000114.3V190 L203 Y204 V205V190-G201 PolarHBondContact O-N 3.13Å; V190-G201 VanDerWaalsContact O-N 3.09Å; G201-L203 VanDerWaalsContact C-N 3.31Å; G201-L203 PolarHBondContact O-N 3.49Å; G201-Y204 PolarHBondContact O-N 3.32Å; G201-V205 WeakPolarHBondContact O-CG2 3.5Å; G201-V205 PolarHBondContact O-N 3.14Å
202Y83.3Confident82.4Confident18 Ų1852.4 Ų52.47%0.07130%0.295CS..Hα-helixtrans-55-42.9-179.8-179.9-110.2000113Y191 K192 H193 G194 F196 N200 T206Y191-Y202 HydrophobicContact CE1-CD2 4.18Å; Y191-Y202 HydrophobicContact CE2-CD2 4.12Å; Y191-Y202 AromaticContact CZ-CD2 3.65Å; Y191-Y202 WeakPolarHBondContact OH-CD2 3.45Å; K192-Y202 WeakPolarHBondContact O-CB 3.47Å; H193-Y202 AromaticContact CE1-CE2 3.84Å; H193-Y202 AromaticContact ND1-CE2 3.81Å; G194-Y202 VanDerWaalsContact CA-CE1 3.47Å; F196-Y202 HydrophobicContact CD1-CE1 4.42Å; F196-Y202 HydrophobicContact CD2-CE1 4.25Å; F196-Y202 HydrophobicContact CE1-CD1 4.39Å; F196-Y202 AromaticContact CE1-CE1 3.93Å; F196-Y202 HydrophobicContact CE1-CE1 3.93Å; F196-Y202 AromaticContact CE2-CE1 3.75Å; F196-Y202 HydrophobicContact CE2-CE1 3.75Å; F196-Y202 HydrophobicContact CZ-CD1 4.42Å; F196-Y202 AromaticContact CZ-CE1 3.58Å; F196-Y202 HydrophobicContact CZ-CE1 3.58Å; N200-Y202 PolarHBondContact O-N 3.47Å; N200-Y202 PolarHBondContact OD1-N 3.32Å; Y202-T206 WeakPolarHBondContact O-CB 2.88Å; Y202-T206 PolarHBondContact O-N 3.38Å; Y202-T206 PolarHBondContact O-OG1 2.95Å
203L85.6Confident83.1Confident49 Ų4947.1 Ų47.126%0.25727%0.272SS..Hα-helixtrans-62.9-46.9-178.9-178.9148.1000111.5F196 N200 G201 T206 V207F196-L203 HydrophobicContact CD1-CD1 4.45Å; N200-L203 PolarHBondContact O-N 2.94Å; G201-L203 VanDerWaalsContact C-N 3.31Å; G201-L203 PolarHBondContact O-N 3.49Å; L203-T206 PolarHBondContact O-N 2.84Å; L203-V207 HydrophobicContact CD2-CG2 4.45Å; L203-V207 VanDerWaalsContact O-CG2 3.31Å; L203-V207 WeakPolarHBondContact O-CG2 3.19Å; L203-V207 PolarHBondContact O-N 3.27Å
204Y89.3Confident83.9Confident138 Ų13851.7 Ų51.754%0.54129%0.291SS..Hα-helixtrans-66.6-46-178.5-65.5-77.8000112A198 G201 T206 V207 V208A198-Y204 VanDerWaalsContact O-CE2 3.31Å; A198-Y204 WeakPolarHBondContact O-CE2 3.08Å; A198-Y204 PolarHBondContact O-OH 3.37Å; G201-Y204 PolarHBondContact O-N 3.32Å; Y204-T206 VanDerWaalsContact C-N 3.31Å; Y204-T206 PolarHBondContact O-N 3.49Å; Y204-V207 PolarHBondContact O-N 2.61Å; Y204-V208 WeakPolarHBondContact O-CG2 3.43Å; Y204-V208 PolarHBondContact O-N 2.81Å
205V87.9Confident85Confident16 Ų1654.3 Ų54.310%0.09731%0.306CS..Hα-helixtrans-59-46.6176.2171.80000110.2V181 T182 L185 Y191 G201 V207 V208 Y209V181-V205 HydrophobicContact CG1-CG2 4.13Å; T182-V205 WeakPolarHBondContact OG1-CG1 3.43Å; L185-V205 HydrophobicContact CD1-CG2 4.26Å; Y191-V205 HydrophobicContact CE2-CB 4.34Å; Y191-V205 HydrophobicContact CE2-CG2 4.23Å; G201-V205 WeakPolarHBondContact O-CG2 3.5Å; G201-V205 PolarHBondContact O-N 3.14Å; V205-V207 PolarHBondContact O-N 2.81Å; V205-V208 PolarHBondContact O-N 3.32Å; V205-Y209 VanDerWaalsContact O-CB 3.28Å; V205-Y209 WeakPolarHBondContact O-CB 3.49Å; V205-Y209 PolarHBondContact O-N 3.27Å
206T84.3Confident86Confident25 Ų2550.6 Ų50.615%0.15329%0.287CS..Hα-helixtrans-60.2-47179.5-60.80000111.1F196 Y202 L203 Y204 N210F196-T206 HydrophobicContact CE1-CG2 4.26Å; Y202-T206 WeakPolarHBondContact O-CB 2.88Å; Y202-T206 PolarHBondContact O-N 3.38Å; Y202-T206 PolarHBondContact O-OG1 2.95Å; L203-T206 PolarHBondContact O-N 2.84Å; Y204-T206 VanDerWaalsContact C-N 3.31Å; Y204-T206 PolarHBondContact O-N 3.49Å; T206-N210 VanDerWaalsContact CG2-ND2 3.25Å; T206-N210 WeakPolarHBondContact CG2-ND2 3.45Å; T206-N210 VanDerWaalsContact O-CB 3.27Å; T206-N210 WeakPolarHBondContact O-CB 3.35Å; T206-N210 PolarHBondContact O-N 3.12Å; T206-N210 PolarHBondContact O-ND2 3.02Å
207V88.2Confident86.7Confident95 Ų9547.7 Ų47.758%0.57628%0.276SS*.Hα-helixtrans-63.4-46179.31700000111.9L203 Y204 V205 G211L203-V207 HydrophobicContact CD2-CG2 4.45Å; L203-V207 VanDerWaalsContact O-CG2 3.31Å; L203-V207 WeakPolarHBondContact O-CG2 3.19Å; L203-V207 PolarHBondContact O-N 3.27Å; Y204-V207 PolarHBondContact O-N 2.61Å; V205-V207 PolarHBondContact O-N 2.81Å; V207-G211 PolarHBondContact O-N 3.4Å
208V91.7Very high87.2Confident75 Ų7548.5 Ų48.546%0.45527%0.272SS..Hα-helixtrans-63.3-46.2179.5171.40000111.1I174 T178 Y204 V205 S212I174-V208 HydrophobicContact CG2-CG1 3.89Å; T178-V208 HydrophobicContact CG2-CG1 4.02Å; Y204-V208 WeakPolarHBondContact O-CG2 3.43Å; Y204-V208 PolarHBondContact O-N 2.81Å; V205-V208 PolarHBondContact O-N 3.32Å; V208-S212 WeakPolarHBondContact O-CB 3.33Å; V208-S212 PolarHBondContact O-N 2.98Å
209Y88.5Confident87.5Confident35 Ų3545.1 Ų45.114%0.13724%0.244CC..Hα-helixtrans-61.6-51.9177.4164.6-115.9000111.5E110 F171 K175 V205 G211 S212 A213 F251E110-Y209 VanDerWaalsContact CD-OH 3.31Å; E110-Y209 PolarHBondContact OE1-OH 2.89Å; E110-Y209 PolarHBondContact OE2-OH 3.44Å; F171-Y209 HydrophobicContact CE2-CD2 4Å; F171-Y209 AromaticContact CE2-CE2 3.62Å; F171-Y209 HydrophobicContact CE2-CE2 3.62Å; F171-Y209 AromaticContact CZ-CE2 3.92Å; F171-Y209 HydrophobicContact CZ-CE2 3.92Å; K175-Y209 HydrophobicContact CD-CD2 3.5Å; K175-Y209 HydrophobicContact CD-CE2 3.3Å; K175-Y209 PolarHBondContact NZ-OH 3.44Å; V205-Y209 VanDerWaalsContact O-CB 3.28Å; V205-Y209 WeakPolarHBondContact O-CB 3.49Å; V205-Y209 PolarHBondContact O-N 3.27Å; Y209-G211 VanDerWaalsContact C-N 3.33Å; Y209-G211 PolarHBondContact O-N 2.92Å; Y209-S212 PolarHBondContact O-N 3.43Å; Y209-A213 HydrophobicContact CE2-CB 4.27Å; Y209-A213 WeakPolarHBondContact O-CB 3.23Å; Y209-A213 PolarHBondContact O-N 3.49Å; Y209-F251 AromaticContact CE1-CD2 3.95Å; Y209-F251 HydrophobicContact CE1-CD2 3.95Å; Y209-F251 HydrophobicContact CE1-CE2 4.07Å; Y209-F251 AromaticContact CZ-CD2 3.98Å
210N87.1Confident87.8Confident30 Ų3039.5 Ų39.516%0.1621%0.209CC..Hα-helixtrans-60.7-43-179.6-82.6-86.5000111.6T206 A213 F214 F251 I255T206-N210 VanDerWaalsContact CG2-ND2 3.25Å; T206-N210 WeakPolarHBondContact CG2-ND2 3.45Å; T206-N210 VanDerWaalsContact O-CB 3.27Å; T206-N210 WeakPolarHBondContact O-CB 3.35Å; T206-N210 PolarHBondContact O-N 3.12Å; T206-N210 PolarHBondContact O-ND2 3.02Å; N210-A213 PolarHBondContact O-N 3.26Å; N210-F214 WeakPolarHBondContact O-CB 3.23Å; N210-F214 WeakPolarHBondContact O-CD2 3.45Å; N210-F214 PolarHBondContact O-N 3.41Å; N210-F251 HydrophobicContact CB-CE2 4.49Å; N210-F251 WeakPolarHBondContact OD1-CE2 3.33Å; N210-F251 WeakPolarHBondContact OD1-CZ 3.49Å; N210-I255 WeakPolarHBondContact OD1-CD1 3.49Å
211G90.1Very high87.9Confident37 Ų3740.1 Ų40.138%0.38121%0.213SC..Hα-helixtrans-60.5-46.1175.700000112.2V207 Y209 F214 V215V207-G211 PolarHBondContact O-N 3.4Å; Y209-G211 VanDerWaalsContact C-N 3.33Å; Y209-G211 PolarHBondContact O-N 2.92Å; G211-F214 PolarHBondContact O-N 3.03Å; G211-V215 WeakPolarHBondContact O-CG2 3.2Å; G211-V215 PolarHBondContact O-N 3.22Å; G211-V215 VanDerWaalsContact O-N 3.14Å
212S92.3Very high87.8Confident12 Ų1239.7 Ų39.78%0.08421%0.208CC..Hα-helixtrans-63.5-44.9177.8-169.30000112.4F171 V208 Y209 V215 A216F171-S212 WeakPolarHBondContact CA-OG 3.49Å; V208-S212 WeakPolarHBondContact O-CB 3.33Å; V208-S212 PolarHBondContact O-N 2.98Å; Y209-S212 PolarHBondContact O-N 3.43Å; S212-V215 PolarHBondContact O-N 3.31Å; S212-A216 PolarHBondContact O-N 3.42Å
213A88.3Confident88Confident0 Ų038.9 Ų38.90%021%0.205CC..Hα-helixtrans-59.9-46.517600000111.2F171 Y209 N210 V215 A216 L217 F251F171-A213 HydrophobicContact CD2-CB 4.36Å; F171-A213 HydrophobicContact CE2-CB 3.74Å; F171-A213 HydrophobicContact CZ-CB 4.28Å; Y209-A213 HydrophobicContact CE2-CB 4.27Å; Y209-A213 WeakPolarHBondContact O-CB 3.23Å; Y209-A213 PolarHBondContact O-N 3.49Å; N210-A213 PolarHBondContact O-N 3.26Å; A213-V215 VanDerWaalsContact C-N 3.35Å; A213-V215 PolarHBondContact O-N 3.16Å; A213-A216 PolarHBondContact O-N 3.28Å; A213-L217 WeakPolarHBondContact O-CB 3.31Å; A213-L217 WeakPolarHBondContact O-CG 3.13Å; A213-L217 PolarHBondContact O-N 3.36Å; A213-F251 HydrophobicContact CB-CD2 4.46Å; A213-F251 HydrophobicContact CB-CE2 4.01Å
214F88.5Confident87.9Confident128 Ų12839 Ų3956%0.56120%0.203SC*.Hα-helixtrans-56.6-46.5177.1-105.5-83.6000112.3N210 G211 Y218 F251N210-F214 WeakPolarHBondContact O-CB 3.23Å; N210-F214 WeakPolarHBondContact O-CD2 3.45Å; N210-F214 PolarHBondContact O-N 3.41Å; G211-F214 PolarHBondContact O-N 3.03Å; F214-Y218 WeakPolarHBondContact O-CB 3.36Å; F214-Y218 PolarHBondContact O-N 2.94Å; F214-F251 HydrophobicContact CD2-CZ 4.31Å; F214-F251 HydrophobicContact CE2-CE1 4.38Å; F214-F251 HydrophobicContact CE2-CZ 4.2Å
215V91.1Very high87.5Confident59 Ų5933.2 Ų33.236%0.35818%0.181SC..Hα-helixtrans-66.9-41.7-179.6-178.80000111.4A167 G211 S212 A213 Y218 A219A167-V215 HydrophobicContact CB-CG1 4.14Å; G211-V215 WeakPolarHBondContact O-CG2 3.2Å; G211-V215 PolarHBondContact O-N 3.22Å; G211-V215 VanDerWaalsContact O-N 3.14Å; S212-V215 PolarHBondContact O-N 3.31Å; A213-V215 VanDerWaalsContact C-N 3.35Å; A213-V215 PolarHBondContact O-N 3.16Å; V215-Y218 PolarHBondContact O-N 2.86Å; V215-A219 WeakPolarHBondContact O-CB 3.47Å; V215-A219 PolarHBondContact O-N 3.18Å
216A90.7Very high87.2Confident0 Ų032.6 Ų32.60%018%0.178CC..Hα-helixtrans-65.5-42.3178.100000112.6A167 F171 S212 A213 A219 L220A167-A216 WeakPolarHBondContact O-CB 3.43Å; F171-A216 HydrophobicContact CB-CB 3.61Å; F171-A216 HydrophobicContact CD1-CB 4.28Å; F171-A216 HydrophobicContact CG-CB 3.96Å; S212-A216 PolarHBondContact O-N 3.42Å; A213-A216 PolarHBondContact O-N 3.28Å; A216-A219 WeakPolarHBondContact O-CB 3.1Å; A216-A219 PolarHBondContact O-N 3.25Å; A216-L220 PolarHBondContact O-N 3.46Å
217L85.9Confident87Confident16 Ų1631.4 Ų31.48%0.08417%0.17CC..Hα-helixtrans-70.8-35.9178.8-67170.9000111.7A213 L220 V221 F248A213-L217 WeakPolarHBondContact O-CB 3.31Å; A213-L217 WeakPolarHBondContact O-CG 3.13Å; A213-L217 PolarHBondContact O-N 3.36Å; L217-L220 HydrophobicContact CD2-CD1 4.28Å; L217-L220 PolarHBondContact O-N 3.32Å; L217-V221 WeakPolarHBondContact O-CG2 3.42Å; L217-V221 PolarHBondContact O-N 3.41Å; L217-F248 HydrophobicContact CB-CE2 3.95Å; L217-F248 HydrophobicContact CB-CZ 3.63Å; L217-F248 HydrophobicContact CD1-CD1 4.27Å; L217-F248 HydrophobicContact CD1-CD2 4.08Å; L217-F248 HydrophobicContact CD1-CE1 3.77Å; L217-F248 HydrophobicContact CD1-CE2 3.58Å; L217-F248 HydrophobicContact CD1-CG 4.46Å; L217-F248 HydrophobicContact CD1-CZ 3.46Å; L217-F248 VanDerWaalsContact CD1-CZ 3.46Å; L217-F248 HydrophobicContact CD2-CD2 3.95Å; L217-F248 HydrophobicContact CD2-CE2 3.28Å; L217-F248 HydrophobicContact CD2-CZ 3.89Å; L217-F248 HydrophobicContact CG-CE2 3.74Å; L217-F248 HydrophobicContact CG-CZ 3.8Å
218Y86.6Confident86.6Confident64 Ų6432.1 Ų32.125%0.25116%0.163SC..Hα-helixtrans-62.1-46171.7179.8-117.3000111.4Y146 C147 F151 F214 V215 L220 V221 L222Y146-Y218 WeakPolarHBondContact O-CE2 3.33Å; Y146-Y218 PolarHBondContact O-OH 3.21Å; C147-Y218 HydrophobicContact CB-CE2 4.09Å; C147-Y218 PolarHBondContact O-OH 2.91Å; C147-Y218 VanDerWaalsContact O-OH 3.1Å; F151-Y218 HydrophobicContact CE2-CE1 4.13Å; F214-Y218 WeakPolarHBondContact O-CB 3.36Å; F214-Y218 PolarHBondContact O-N 2.94Å; V215-Y218 PolarHBondContact O-N 2.86Å; Y218-L220 PolarHBondContact O-N 3.28Å; Y218-V221 PolarHBondContact O-N 3.44Å; Y218-V221 VanDerWaalsContact O-N 3.12Å; Y218-L222 HydrophobicContact CD1-CD1 3.85Å; Y218-L222 HydrophobicContact CD1-CG 4.36Å; Y218-L222 HydrophobicContact CD2-CG 4.49Å; Y218-L222 HydrophobicContact CE1-CD1 3.41Å; Y218-L222 VanDerWaalsContact CE1-CD1 3.41Å; Y218-L222 HydrophobicContact CE1-CD2 4.46Å; Y218-L222 HydrophobicContact CE1-CG 4.03Å; Y218-L222 HydrophobicContact CE2-CD1 4.41Å; Y218-L222 HydrophobicContact CE2-CD2 4.16Å; Y218-L222 HydrophobicContact CE2-CG 4.13Å; Y218-L222 WeakPolarHBondContact O-CG 3.15Å; Y218-L222 PolarHBondContact O-N 3.32Å
219A89.1Confident86Confident0 Ų031.1 Ų31.10%016%0.159CC..Hα-helixtrans-59.5-42.4174.800000112.9A167 V215 A216 V221 L222 F223A167-A219 HydrophobicContact CB-CB 3.38Å; V215-A219 WeakPolarHBondContact O-CB 3.47Å; V215-A219 PolarHBondContact O-N 3.18Å; A216-A219 WeakPolarHBondContact O-CB 3.1Å; A216-A219 PolarHBondContact O-N 3.25Å; A219-V221 VanDerWaalsContact C-N 3.33Å; A219-V221 PolarHBondContact O-N 2.89Å; A219-L222 PolarHBondContact O-N 2.86Å; A219-F223 WeakPolarHBondContact O-CB 3.27Å; A219-F223 PolarHBondContact O-N 2.94Å
220L87Confident85.4Confident13 Ų1331.3 Ų31.37%0.06816%0.162CC..Hα-helixtrans-59.1-43.4172.8-79.7-176.8000112.1V114 F117 L118 A216 L217 Y218 F223 Y224 F240V114-L220 HydrophobicContact CG1-CD1 3.63Å; V114-L220 HydrophobicContact CG1-CG 4.35Å; F117-L220 HydrophobicContact CD1-CD1 4.43Å; F117-L220 HydrophobicContact CD1-CD2 4.31Å; L118-L220 HydrophobicContact CB-CD2 3.9Å; L118-L220 HydrophobicContact CD1-CD2 3.99Å; L118-L220 HydrophobicContact CG-CD2 4.41Å; A216-L220 PolarHBondContact O-N 3.46Å; L217-L220 HydrophobicContact CD2-CD1 4.28Å; L217-L220 PolarHBondContact O-N 3.32Å; Y218-L220 PolarHBondContact O-N 3.28Å; L220-F223 PolarHBondContact O-N 2.97Å; L220-Y224 PolarHBondContact O-N 3.24Å; L220-F240 HydrophobicContact CB-CE2 4.35Å; L220-F240 HydrophobicContact CB-CZ 3.95Å; L220-F240 WeakPolarHBondContact O-CE2 3.41Å; L220-F240 WeakPolarHBondContact O-CZ 3.43Å
221V84.1Confident84.7Confident23 Ų2330 Ų3014%0.13916%0.155CC..Hα-helixtrans-65-44177.8169.60000111Y146 L217 Y218 A219 F223 Y224 L225 F240Y146-V221 HydrophobicContact CD1-CG1 4.23Å; L217-V221 WeakPolarHBondContact O-CG2 3.42Å; L217-V221 PolarHBondContact O-N 3.41Å; Y218-V221 PolarHBondContact O-N 3.44Å; Y218-V221 VanDerWaalsContact O-N 3.12Å; A219-V221 VanDerWaalsContact C-N 3.33Å; A219-V221 PolarHBondContact O-N 2.89Å; V221-F223 VanDerWaalsContact C-N 3.34Å; V221-F223 PolarHBondContact O-N 3.37Å; V221-Y224 PolarHBondContact O-N 2.68Å; V221-L225 HydrophobicContact CG1-CD1 3.98Å; V221-L225 HydrophobicContact CG1-CG 4.33Å; V221-L225 VanDerWaalsContact O-CG 3.31Å; V221-L225 WeakPolarHBondContact O-CG 3.5Å; V221-L225 PolarHBondContact O-N 2.87Å; V221-F240 HydrophobicContact CG2-CE1 4.42Å
222L84.9Confident83.7Confident1 Ų135 Ų351%0.00517%0.168CC..Hα-helixtrans-58.5-47.4175-72.3179000111.1T148 F151 F160 F163 Y218 A219 Y224 L225 A226T148-L222 HydrophobicContact CG2-CD2 3.7Å; F151-L222 HydrophobicContact CE2-CD1 3.87Å; F151-L222 HydrophobicContact CZ-CD1 4.17Å; F160-L222 HydrophobicContact CE2-CB 4.01Å; F160-L222 HydrophobicContact CE2-CD1 4.43Å; F160-L222 HydrophobicContact CZ-CB 3.93Å; F163-L222 HydrophobicContact CE1-CD1 4.13Å; Y218-L222 HydrophobicContact CD1-CD1 3.85Å; Y218-L222 HydrophobicContact CD1-CG 4.36Å; Y218-L222 HydrophobicContact CD2-CG 4.49Å; Y218-L222 HydrophobicContact CE1-CD1 3.41Å; Y218-L222 VanDerWaalsContact CE1-CD1 3.41Å; Y218-L222 HydrophobicContact CE1-CD2 4.46Å; Y218-L222 HydrophobicContact CE1-CG 4.03Å; Y218-L222 HydrophobicContact CE2-CD1 4.41Å; Y218-L222 HydrophobicContact CE2-CD2 4.16Å; Y218-L222 HydrophobicContact CE2-CG 4.13Å; Y218-L222 WeakPolarHBondContact O-CG 3.15Å; Y218-L222 PolarHBondContact O-N 3.32Å; A219-L222 PolarHBondContact O-N 2.86Å; L222-Y224 VanDerWaalsContact C-N 3.33Å; L222-Y224 PolarHBondContact O-N 2.96Å; L222-L225 PolarHBondContact O-N 3.12Å; L222-A226 WeakPolarHBondContact O-CB 3.39Å; L222-A226 PolarHBondContact O-N 3.3Å
223F86.7Confident82.5Confident1 Ų137.4 Ų37.40%0.00418%0.183CC..Hα-helixtrans-59.1-43.8176.8178.6-88000111.7L118 C121 Y122 L125 L161 C164 A219 L220 V221 A226 T227L118-F223 HydrophobicContact CD1-CB 4.45Å; L118-F223 HydrophobicContact CD1-CD1 3.98Å; L118-F223 HydrophobicContact CD1-CD2 4.06Å; L118-F223 HydrophobicContact CD1-CE1 4.28Å; L118-F223 HydrophobicContact CD1-CE2 4.31Å; L118-F223 HydrophobicContact CD1-CG 3.87Å; L118-F223 HydrophobicContact CD1-CZ 4.41Å; C121-F223 HydrophobicContact CB-CD1 4.4Å; C121-F223 HydrophobicContact CB-CE1 3.45Å; C121-F223 VanDerWaalsContact CB-CE1 3.45Å; C121-F223 HydrophobicContact CB-CZ 3.99Å; Y122-F223 HydrophobicContact CD2-CE2 4.27Å; Y122-F223 HydrophobicContact CD2-CZ 4.34Å; Y122-F223 HydrophobicContact CE1-CE2 4.11Å; Y122-F223 HydrophobicContact CE2-CD2 4.27Å; Y122-F223 AromaticContact CE2-CE2 3.69Å; Y122-F223 HydrophobicContact CE2-CE2 3.69Å; Y122-F223 HydrophobicContact CE2-CZ 4.19Å; Y122-F223 AromaticContact CZ-CE2 3.56Å; L125-F223 HydrophobicContact CD1-CZ 3.98Å; L161-F223 HydrophobicContact CD2-CD2 4.13Å; L161-F223 HydrophobicContact CD2-CE2 3.98Å; C164-F223 HydrophobicContact CB-CB 4.28Å; C164-F223 HydrophobicContact CB-CD2 4.47Å; A219-F223 WeakPolarHBondContact O-CB 3.27Å; A219-F223 PolarHBondContact O-N 2.94Å; L220-F223 PolarHBondContact O-N 2.97Å; V221-F223 VanDerWaalsContact C-N 3.34Å; V221-F223 PolarHBondContact O-N 3.37Å; F223-A226 WeakPolarHBondContact O-CB 3.47Å; F223-A226 PolarHBondContact O-N 2.68Å; F223-T227 HydrophobicContact CD1-CG2 4.46Å; F223-T227 HydrophobicContact CD2-CG2 4.32Å; F223-T227 HydrophobicContact CE1-CG2 4.01Å; F223-T227 HydrophobicContact CE2-CG2 3.91Å; F223-T227 HydrophobicContact CZ-CG2 3.75Å; F223-T227 WeakPolarHBondContact O-CB 3.5Å; F223-T227 WeakPolarHBondContact O-CG2 3.38Å; F223-T227 PolarHBondContact O-N 3.48Å; F223-T227 PolarHBondContact O-OG1 3.3Å
224Y83.3Confident81.5Confident52 Ų5238.6 Ų38.620%0.20419%0.189CC..Hα-helixtrans-63.2-47.6176172.2-102.6000112.3L220 V221 L222 A226 T227 R228 P236 A237 F240L220-Y224 PolarHBondContact O-N 3.24Å; V221-Y224 PolarHBondContact O-N 2.68Å; L222-Y224 VanDerWaalsContact C-N 3.33Å; L222-Y224 PolarHBondContact O-N 2.96Å; Y224-A226 PolarHBondContact O-N 2.92Å; Y224-T227 PolarHBondContact O-N 3.31Å; Y224-R228 HydrophobicContact CD2-CB 4.49Å; Y224-R228 HydrophobicContact CE1-CB 4.43Å; Y224-R228 HydrophobicContact CE2-CB 4.16Å; Y224-R228 WeakPolarHBondContact O-CA 3.19Å; Y224-R228 WeakPolarHBondContact O-CB 3.43Å; Y224-R228 PolarHBondContact O-N 3.03Å; Y224-P236 HydrophobicContact CE2-CB 4.3Å; Y224-P236 HydrophobicContact CE2-CG 4.35Å; Y224-A237 WeakPolarHBondContact OH-CB 3.4Å; Y224-F240 HydrophobicContact CD2-CB 4.25Å; Y224-F240 AromaticContact CD2-CD2 3.82Å; Y224-F240 HydrophobicContact CD2-CD2 3.82Å; Y224-F240 HydrophobicContact CD2-CE2 4.36Å; Y224-F240 AromaticContact CD2-CG 3.97Å; Y224-F240 HydrophobicContact CD2-CG 3.97Å; Y224-F240 HydrophobicContact CE2-CB 4.36Å; Y224-F240 HydrophobicContact CE2-CG 4.49Å; Y224-F240 HydrophobicContact CG-CD1 4.42Å; Y224-F240 HydrophobicContact CG-CD2 4.04Å; Y224-F240 HydrophobicContact CG-CE1 4.47Å; Y224-F240 HydrophobicContact CG-CE2 4.15Å; Y224-F240 HydrophobicContact CG-CG 4.22Å; Y224-F240 HydrophobicContact CG-CZ 4.36Å
225L82Confident80.5Confident16 Ų1637.4 Ų37.48%0.08419%0.188CC..Hα-helixtrans-60.2-32.6178.5-69.6173.4000112Y146 V221 L222Y146-L225 HydrophobicContact CD1-CD1 3.69Å; Y146-L225 HydrophobicContact CD2-CD1 3.65Å; Y146-L225 HydrophobicContact CD2-CD2 4.32Å; Y146-L225 HydrophobicContact CE1-CD1 4.14Å; Y146-L225 HydrophobicContact CE1-CD2 4.36Å; Y146-L225 HydrophobicContact CE2-CD1 4.15Å; Y146-L225 HydrophobicContact CE2-CD2 3.99Å; Y146-L225 HydrophobicContact CG-CD1 3.44Å; Y146-L225 VanDerWaalsContact CG-CD1 3.44Å; V221-L225 HydrophobicContact CG1-CD1 3.98Å; V221-L225 HydrophobicContact CG1-CG 4.33Å; V221-L225 VanDerWaalsContact O-CG 3.31Å; V221-L225 WeakPolarHBondContact O-CG 3.5Å; V221-L225 PolarHBondContact O-N 2.87Å; L222-L225 PolarHBondContact O-N 3.12Å
226A80.6Confident79.4Confident3 Ų335.4 Ų35.43%0.02518%0.176CC..Hα-helixtrans-70.4-43.5177.200000113.8Y156 F160 L222 F223 Y224Y156-A226 HydrophobicContact CD1-CB 4.25Å; Y156-A226 HydrophobicContact CE1-CB 3.28Å; Y156-A226 VanDerWaalsContact OH-CA 3.23Å; Y156-A226 WeakPolarHBondContact OH-CA 3.17Å; F160-A226 HydrophobicContact CE1-CB 3.61Å; F160-A226 HydrophobicContact CZ-CB 3.92Å; L222-A226 WeakPolarHBondContact O-CB 3.39Å; L222-A226 PolarHBondContact O-N 3.3Å; F223-A226 WeakPolarHBondContact O-CB 3.47Å; F223-A226 PolarHBondContact O-N 2.68Å; Y224-A226 PolarHBondContact O-N 2.92Å
227T80.4Confident78.4Confident0 Ų037.9 Ų37.90%020%0.197CC..Hα-helixtrans-102.1-9.5-168.655.50000113.2L125 I131 I135 F223 Y224 S229 I230 L231L125-T227 HydrophobicContact CD1-CG2 3.59Å; I131-T227 HydrophobicContact CG2-CG2 4.42Å; I135-T227 HydrophobicContact CD1-CG2 3.74Å; F223-T227 HydrophobicContact CD1-CG2 4.46Å; F223-T227 HydrophobicContact CD2-CG2 4.32Å; F223-T227 HydrophobicContact CE1-CG2 4.01Å; F223-T227 HydrophobicContact CE2-CG2 3.91Å; F223-T227 HydrophobicContact CZ-CG2 3.75Å; F223-T227 WeakPolarHBondContact O-CB 3.5Å; F223-T227 WeakPolarHBondContact O-CG2 3.38Å; F223-T227 PolarHBondContact O-N 3.48Å; F223-T227 PolarHBondContact O-OG1 3.3Å; Y224-T227 PolarHBondContact O-N 3.31Å; T227-S229 PolarHBondContact O-N 3.03Å; T227-I230 PolarHBondContact O-N 3.31Å; T227-L231 PolarHBondContact O-N 3.23Å; T227-L231 WeakPolarHBondContact OG1-CD1 3.38Å
228R80.1Confident77.9Confident110 Ų11041.3 Ų41.342%0.41521%0.214SC..Hα-helixtrans-52.2-36.2-174.163.6-179.1-175.7163.24.9113.5Y224 I230 Q232Y224-R228 HydrophobicContact CD2-CB 4.49Å; Y224-R228 HydrophobicContact CE1-CB 4.43Å; Y224-R228 HydrophobicContact CE2-CB 4.16Å; Y224-R228 WeakPolarHBondContact O-CA 3.19Å; Y224-R228 WeakPolarHBondContact O-CB 3.43Å; Y224-R228 PolarHBondContact O-N 3.03Å; R228-I230 VanDerWaalsContact C-N 3.31Å; R228-I230 PolarHBondContact O-N 3.4Å; R228-Q232 VanDerWaalsContact O-CG 3.32Å; R228-Q232 WeakPolarHBondContact O-CG 3.24Å; R228-Q232 PolarHBondContact O-N 2.91Å
229S77.7Confident77.6Confident53 Ų5339 Ų3937%0.37121%0.205SC..Hα-helixtrans-70-29.4-178.6540000113T227T227-S229 PolarHBondContact O-N 3.03Å
230I75.9Confident77.1Confident39 Ų3939.7 Ų39.720%0.221%0.209CC..Hα-helixtrans-90.7-35.1-179.3-53.2158.7000109.6L125 E134 I135 T227 R228 Q232 P233L125-I230 HydrophobicContact CD2-CB 3.9Å; L125-I230 HydrophobicContact CD2-CG2 3.52Å; E134-I230 HydrophobicContact CB-CD1 3.96Å; E134-I230 HydrophobicContact CG-CB 4.48Å; E134-I230 HydrophobicContact CG-CD1 3.34Å; E134-I230 HydrophobicContact CG-CG1 3.59Å; E134-I230 HydrophobicContact CG-CG2 4.03Å; I135-I230 HydrophobicContact CD1-CD1 3.86Å; I135-I230 HydrophobicContact CG1-CD1 3.27Å; T227-I230 PolarHBondContact O-N 3.31Å; R228-I230 VanDerWaalsContact C-N 3.31Å; R228-I230 PolarHBondContact O-N 3.4Å; I230-Q232 VanDerWaalsContact C-N 3.29Å; I230-Q232 PolarHBondContact O-N 3.24Å; I230-P233 WeakPolarHBondContact O-CD 3.39Å
231L73.6Confident76.8Confident4 Ų441.2 Ų41.22%0.02122%0.223CC..Hα-helixtrans-74.5-14175.7-85.1167.6000113.6Y124 L125 T227 P233 F234 P236Y124-L231 HydrophobicContact CD2-CD2 4.44Å; L125-L231 HydrophobicContact CD1-CD1 4.17Å; L125-L231 HydrophobicContact CD1-CD2 4.45Å; L125-L231 HydrophobicContact CD1-CG 4.06Å; L125-L231 HydrophobicContact CD2-CD2 4Å; L125-L231 HydrophobicContact CD2-CG 3.73Å; L125-L231 HydrophobicContact CG-CD2 3.93Å; L125-L231 HydrophobicContact CG-CG 3.93Å; T227-L231 PolarHBondContact O-N 3.23Å; T227-L231 WeakPolarHBondContact OG1-CD1 3.38Å; L231-P233 VanDerWaalsContact C-N 3.28Å; L231-P233 WeakPolarHBondContact O-CD 3.31Å; L231-P233 VanDerWaalsContact O-N 3.09Å; L231-F234 HydrophobicContact CD2-CD2 4.4Å; L231-F234 PolarHBondContact O-N 3.39Å; L231-P236 HydrophobicContact CB-CB 3.72Å; L231-P236 HydrophobicContact CB-CG 3.68Å; L231-P236 HydrophobicContact CD1-CB 4.3Å; L231-P236 HydrophobicContact CG-CB 4.43Å; L231-P236 WeakPolarHBondContact O-CD 3.4Å; L231-P236 WeakPolarHBondContact O-CG 3.37Å
232Q68.7Low76.8Confident142 Ų14241.1 Ų41.166%0.66422%0.222SC*.G310 helixtrans-44.5-42.2-176.3-97.7-163.7-41.200115R228 I230 F234 D235R228-Q232 VanDerWaalsContact O-CG 3.32Å; R228-Q232 WeakPolarHBondContact O-CG 3.24Å; R228-Q232 PolarHBondContact O-N 2.91Å; I230-Q232 VanDerWaalsContact C-N 3.29Å; I230-Q232 PolarHBondContact O-N 3.24Å; Q232-F234 PolarHBondContact O-N 3.01Å; Q232-F234 VanDerWaalsContact O-N 3.1Å; Q232-D235 PolarHBondContact O-N 3.34Å
233P67Low76.7Confident61 Ų6141.5 Ų41.540%0.39623%0.225SC..G310 helixtrans-62.7-16.7-179.9-21.733.7000114.8I230 L231 I408I230-P233 WeakPolarHBondContact O-CD 3.39Å; L231-P233 VanDerWaalsContact C-N 3.28Å; L231-P233 WeakPolarHBondContact O-CD 3.31Å; L231-P233 VanDerWaalsContact O-N 3.09Å; P233-I408 HydrophobicContact CB-CG1 4.42Å; P233-I408 HydrophobicContact CB-CG2 3.58Å
234F67.6Low76.4Confident26 Ų2645 Ų4511%0.11424%0.24CC..G310 helixtrans-100.513.3-177.5-62.6-78.4000114L231 Q232 K239 P409L231-F234 HydrophobicContact CD2-CD2 4.4Å; L231-F234 PolarHBondContact O-N 3.39Å; Q232-F234 PolarHBondContact O-N 3.01Å; Q232-F234 VanDerWaalsContact O-N 3.1Å; F234-K239 WeakPolarHBondContact O-CE 3.31Å; F234-K239 PolarHBondContact O-NZ 2.81Å; F234-P409 HydrophobicContact CD1-CG 4.23Å; F234-P409 HydrophobicContact CE1-CG 4.24Å
235D67.5Low76.2Confident103 Ų10345.4 Ų45.455%0.55125%0.25SS*.  trans4559.7-172.1-69.7-43.3000112.3Q232 A237 I238Q232-D235 PolarHBondContact O-N 3.34Å; D235-A237 PolarHBondContact O-N 3.23Å; D235-I238 HydrophobicContact CB-CG2 4.25Å; D235-I238 WeakPolarHBondContact O-CG2 3.37Å
236P67.1Low76.2Confident16 Ų1645.4 Ų45.410%0.10425%0.251CS..Hα-helixtrans-71.8-25.9-169.231.9-36000111.5Y224 L231 I238 K239 F240Y224-P236 HydrophobicContact CE2-CB 4.3Å; Y224-P236 HydrophobicContact CE2-CG 4.35Å; L231-P236 HydrophobicContact CB-CB 3.72Å; L231-P236 HydrophobicContact CB-CG 3.68Å; L231-P236 HydrophobicContact CD1-CB 4.3Å; L231-P236 HydrophobicContact CG-CB 4.43Å; L231-P236 WeakPolarHBondContact O-CD 3.4Å; L231-P236 WeakPolarHBondContact O-CG 3.37Å; P236-I238 PolarHBondContact O-N 2.92Å; P236-K239 PolarHBondContact O-N 3.25Å; P236-F240 WeakPolarHBondContact O-CB 3.17Å; P236-F240 PolarHBondContact O-N 3.03Å
237A70.4Confident76.3Confident53 Ų5345.5 Ų45.544%0.43825%0.251SS..Hα-helixtrans-62-42.4-177.100000111.5Y224 D235 A241Y224-A237 WeakPolarHBondContact OH-CB 3.4Å; D235-A237 PolarHBondContact O-N 3.23Å; A237-A241 WeakPolarHBondContact O-CB 3.46Å; A237-A241 PolarHBondContact O-N 3.45Å
238I76.2Confident76.3Confident87 Ų8747.7 Ų47.745%0.44626%0.261SS..Hα-helixtrans-71.3-41.9179.3-164.7165.8000111.1D235 P236 F240 A241 V242D235-I238 HydrophobicContact CB-CG2 4.25Å; D235-I238 WeakPolarHBondContact O-CG2 3.37Å; P236-I238 PolarHBondContact O-N 2.92Å; I238-F240 PolarHBondContact O-N 3.26Å; I238-A241 PolarHBondContact O-N 2.8Å; I238-V242 HydrophobicContact CG1-CG2 4.32Å; I238-V242 WeakPolarHBondContact O-CB 3.43Å; I238-V242 VanDerWaalsContact O-CG2 3.28Å; I238-V242 WeakPolarHBondContact O-CG2 3.39Å; I238-V242 PolarHBondContact O-N 3.32Å
239K80.6Confident76.6Confident15 Ų1546.5 Ų46.57%0.06526%0.262CS..Hα-helixtrans-59.7-49.5175.5-69.4171.3-179.6168.30111.4Y124 F234 P236 V242 V243 A300 F301Y124-K239 HydrophobicContact CE2-CD 4.14Å; F234-K239 WeakPolarHBondContact O-CE 3.31Å; F234-K239 PolarHBondContact O-NZ 2.81Å; P236-K239 PolarHBondContact O-N 3.25Å; K239-V242 PolarHBondContact O-N 3.38Å; K239-V243 WeakPolarHBondContact O-CG2 3.28Å; K239-V243 PolarHBondContact O-N 3.11Å; K239-A300 VanDerWaalsContact CE-O 3.3Å; K239-A300 WeakPolarHBondContact CE-O 3.2Å; K239-A300 HydrophobicContact CG-CB 4.43Å; K239-A300 VanDerWaalsContact CG-O 3.27Å; K239-A300 WeakPolarHBondContact CG-O 3.4Å; K239-F301 HydrophobicContact CB-CE1 4.24Å; K239-F301 HydrophobicContact CB-CZ 4.14Å; K239-F301 HydrophobicContact CD-CD1 4.48Å; K239-F301 HydrophobicContact CD-CE1 4.07Å; K239-F301 HydrophobicContact CG-CD1 4.4Å; K239-F301 HydrophobicContact CG-CE1 3.93Å; K239-F301 HydrophobicContact CG-CZ 4.22Å
240F77.8Confident76.7Confident15 Ų1544.4 Ų44.47%0.06625%0.247CC..Hα-helixtrans-63.8-46.5178-159.9-81.4000110.7F117 L220 V221 Y224 P236 I238 V242 K244F117-F240 AromaticContact CE1-CD2 3.3Å; F117-F240 HydrophobicContact CE1-CD2 3.3Å; F117-F240 AromaticContact CE1-CE2 3.54Å; F117-F240 HydrophobicContact CE1-CE2 3.54Å; F117-F240 HydrophobicContact CE1-CG 4.03Å; F117-F240 HydrophobicContact CE1-CZ 4.46Å; F117-F240 HydrophobicContact CZ-CB 3.94Å; F117-F240 AromaticContact CZ-CD2 3.4Å; F117-F240 HydrophobicContact CZ-CD2 3.4Å; F117-F240 VanDerWaalsContact CZ-CD2 3.4Å; F117-F240 HydrophobicContact CZ-CE2 4.13Å; F117-F240 AromaticContact CZ-CG 3.92Å; F117-F240 HydrophobicContact CZ-CG 3.92Å; L220-F240 HydrophobicContact CB-CE2 4.35Å; L220-F240 HydrophobicContact CB-CZ 3.95Å; L220-F240 WeakPolarHBondContact O-CE2 3.41Å; L220-F240 WeakPolarHBondContact O-CZ 3.43Å; V221-F240 HydrophobicContact CG2-CE1 4.42Å; Y224-F240 HydrophobicContact CD2-CB 4.25Å; Y224-F240 AromaticContact CD2-CD2 3.82Å; Y224-F240 HydrophobicContact CD2-CD2 3.82Å; Y224-F240 HydrophobicContact CD2-CE2 4.36Å; Y224-F240 AromaticContact CD2-CG 3.97Å; Y224-F240 HydrophobicContact CD2-CG 3.97Å; Y224-F240 HydrophobicContact CE2-CB 4.36Å; Y224-F240 HydrophobicContact CE2-CG 4.49Å; Y224-F240 HydrophobicContact CG-CD1 4.42Å; Y224-F240 HydrophobicContact CG-CD2 4.04Å; Y224-F240 HydrophobicContact CG-CE1 4.47Å; Y224-F240 HydrophobicContact CG-CE2 4.15Å; Y224-F240 HydrophobicContact CG-CG 4.22Å; Y224-F240 HydrophobicContact CG-CZ 4.36Å; P236-F240 WeakPolarHBondContact O-CB 3.17Å; P236-F240 PolarHBondContact O-N 3.03Å; I238-F240 PolarHBondContact O-N 3.26Å; F240-V242 PolarHBondContact O-N 3.01Å; F240-K244 HydrophobicContact CD1-CB 4.31Å; F240-K244 HydrophobicContact CD1-CD 4.21Å; F240-K244 HydrophobicContact CE1-CB 4.46Å; F240-K244 HydrophobicContact CE1-CD 3.93Å; F240-K244 WeakPolarHBondContact O-CA 3.34Å; F240-K244 WeakPolarHBondContact O-CB 3.31Å; F240-K244 PolarHBondContact O-N 2.9Å
241A80Confident76.7Confident45 Ų4542.9 Ų42.937%0.37224%0.24SC..Hα-helixtrans-63-39178.800000112.4A237 I238 S245A237-A241 WeakPolarHBondContact O-CB 3.46Å; A237-A241 PolarHBondContact O-N 3.45Å; I238-A241 PolarHBondContact O-N 2.8Å; A241-S245 WeakPolarHBondContact O-CA 3.47Å; A241-S245 WeakPolarHBondContact O-CB 3.46Å; A241-S245 PolarHBondContact O-N 2.86Å; A241-S245 PolarHBondContact O-OG 3.44Å
242V84.3Confident77.1Confident21 Ų2148.8 Ų48.813%0.12726%0.261CS..Hα-helixtrans-69.8-54.1179170.20000110.8I238 K239 F240 K244 S245 V246 A296 L297 A300I238-V242 HydrophobicContact CG1-CG2 4.32Å; I238-V242 WeakPolarHBondContact O-CB 3.43Å; I238-V242 VanDerWaalsContact O-CG2 3.28Å; I238-V242 WeakPolarHBondContact O-CG2 3.39Å; I238-V242 PolarHBondContact O-N 3.32Å; K239-V242 PolarHBondContact O-N 3.38Å; F240-V242 PolarHBondContact O-N 3.01Å; V242-K244 VanDerWaalsContact C-N 3.3Å; V242-K244 PolarHBondContact O-N 3.46Å; V242-S245 PolarHBondContact O-N 3.02Å; V242-V246 HydrophobicContact CG1-CG2 4.49Å; V242-V246 WeakPolarHBondContact O-CB 3.21Å; V242-V246 VanDerWaalsContact O-CG2 3.27Å; V242-V246 WeakPolarHBondContact O-CG2 3.49Å; V242-V246 PolarHBondContact O-N 3.19Å; V242-A296 HydrophobicContact CG1-CB 3.85Å; V242-A296 HydrophobicContact CG2-CB 4.12Å; V242-L297 HydrophobicContact CG1-CD2 3.79Å; V242-L297 HydrophobicContact CG1-CG 4.12Å; V242-A300 HydrophobicContact CB-CB 3.99Å; V242-A300 HydrophobicContact CG1-CB 4.15Å; V242-A300 HydrophobicContact CG2-CB 4.02Å
243V82.6Confident77.8Confident9 Ų942.8 Ų42.86%0.05523%0.233CC..Hα-helixtrans-61.5-43.1179.8176.70000110.7I75 F117 K239 V246 V247 L297 F301I75-V243 HydrophobicContact CG2-CG2 3.89Å; F117-V243 HydrophobicContact CB-CG1 3.96Å; F117-V243 HydrophobicContact CD1-CG1 4.15Å; F117-V243 HydrophobicContact CD2-CB 4.02Å; F117-V243 HydrophobicContact CD2-CG1 3.99Å; F117-V243 HydrophobicContact CD2-CG2 3.8Å; F117-V243 HydrophobicContact CE2-CB 4.2Å; F117-V243 HydrophobicContact CE2-CG2 4.04Å; F117-V243 HydrophobicContact CG-CB 4.23Å; F117-V243 HydrophobicContact CG-CG1 3.74Å; F117-V243 HydrophobicContact CG-CG2 4.42Å; K239-V243 WeakPolarHBondContact O-CG2 3.28Å; K239-V243 PolarHBondContact O-N 3.11Å; V243-V246 PolarHBondContact O-N 2.73Å; V243-V247 WeakPolarHBondContact O-CG2 3.46Å; V243-V247 PolarHBondContact O-N 3.2Å; V243-V247 VanDerWaalsContact O-N 3.14Å; V243-L297 HydrophobicContact CG2-CD2 4.45Å; V243-F301 HydrophobicContact CG2-CE2 3.75Å; V243-F301 HydrophobicContact CG2-CZ 3.78Å
244K80.2Confident78.4Confident76 Ų7640.9 Ų40.933%0.3323%0.225SC..Hα-helixtrans-59.3-54.7174.9-171-173.4-170.2177.10110.8F240 V242 V246 V247 F248F240-K244 HydrophobicContact CD1-CB 4.31Å; F240-K244 HydrophobicContact CD1-CD 4.21Å; F240-K244 HydrophobicContact CE1-CB 4.46Å; F240-K244 HydrophobicContact CE1-CD 3.93Å; F240-K244 WeakPolarHBondContact O-CA 3.34Å; F240-K244 WeakPolarHBondContact O-CB 3.31Å; F240-K244 PolarHBondContact O-N 2.9Å; V242-K244 VanDerWaalsContact C-N 3.3Å; V242-K244 PolarHBondContact O-N 3.46Å; K244-V246 VanDerWaalsContact C-N 3.28Å; K244-V246 PolarHBondContact O-N 3.47Å; K244-V247 PolarHBondContact O-N 2.9Å; K244-F248 HydrophobicContact CB-CD2 4.35Å; K244-F248 HydrophobicContact CB-CE2 4.49Å; K244-F248 HydrophobicContact CD-CD2 4.37Å; K244-F248 HydrophobicContact CD-CE2 3.98Å; K244-F248 HydrophobicContact CD-CZ 4.47Å; K244-F248 VanDerWaalsContact CE-CE2 3.41Å; K244-F248 VanDerWaalsContact CE-CZ 3.43Å; K244-F248 HydrophobicContact CG-CD2 3.32Å; K244-F248 HydrophobicContact CG-CE2 3.25Å; K244-F248 HydrophobicContact CG-CG 4.24Å; K244-F248 HydrophobicContact CG-CZ 4.16Å; K244-F248 WeakPolarHBondContact O-CB 3.25Å; K244-F248 WeakPolarHBondContact O-CD2 3.13Å; K244-F248 PolarHBondContact O-N 3.32Å
245S80.9Confident79Confident59 Ų5941.4 Ų41.441%0.41323%0.228SC..Hα-helixtrans-57.5-43.8-177.6-62.60000111.4A241 V242 F248 L249A241-S245 WeakPolarHBondContact O-CA 3.47Å; A241-S245 WeakPolarHBondContact O-CB 3.46Å; A241-S245 PolarHBondContact O-N 2.86Å; A241-S245 PolarHBondContact O-OG 3.44Å; V242-S245 PolarHBondContact O-N 3.02Å; S245-F248 PolarHBondContact O-N 3.1Å; S245-L249 VanDerWaalsContact O-CB 3.25Å; S245-L249 WeakPolarHBondContact O-CB 3.43Å; S245-L249 WeakPolarHBondContact O-CG 3.14Å; S245-L249 PolarHBondContact O-N 3.18Å
246V81.9Confident79.9Confident16 Ų1640.6 Ų40.610%0.09722%0.223CC..Hα-helixtrans-61.7-48.9-179.4169.90000111.9Y78 V242 V243 K244 C250 M290 A293Y78-V246 HydrophobicContact CD1-CG1 3.61Å; Y78-V246 HydrophobicContact CE1-CG1 3.19Å; V242-V246 HydrophobicContact CG1-CG2 4.49Å; V242-V246 WeakPolarHBondContact O-CB 3.21Å; V242-V246 VanDerWaalsContact O-CG2 3.27Å; V242-V246 WeakPolarHBondContact O-CG2 3.49Å; V242-V246 PolarHBondContact O-N 3.19Å; V243-V246 PolarHBondContact O-N 2.73Å; K244-V246 VanDerWaalsContact C-N 3.28Å; K244-V246 PolarHBondContact O-N 3.47Å; V246-C250 PolarHBondContact O-SG 2.81Å; V246-C250 VanDerWaalsContact O-SG 3.33Å; V246-M290 HydrophobicContact CG1-CE 4.23Å; V246-A293 HydrophobicContact CG1-CB 4.36Å; V246-A293 HydrophobicContact CG2-CB 3.63Å
247V81.5Confident80.6Confident5 Ų540.4 Ų40.43%0.0322%0.222CC..Hα-helixtrans-68.8-40.7179.2176.80000111.4Y78 E110 V113 V114 V243 K244 F251Y78-V247 HydrophobicContact CE2-CG2 4.42Å; E110-V247 HydrophobicContact CG-CG1 3.94Å; V113-V247 HydrophobicContact CG1-CG2 3.52Å; V114-V247 HydrophobicContact CG2-CG1 4.01Å; V114-V247 HydrophobicContact CG2-CG2 4.43Å; V243-V247 WeakPolarHBondContact O-CG2 3.46Å; V243-V247 PolarHBondContact O-N 3.2Å; V243-V247 VanDerWaalsContact O-N 3.14Å; K244-V247 PolarHBondContact O-N 2.9Å; V247-F251 PolarHBondContact O-N 3.23Å
248F81.2Confident81Confident46 Ų4638.2 Ų38.220%0.20220%0.203CC..Hα-helixtrans-71.7-34.9-178.3-88.8-103.6000113.5L217 K244 S245 F251 W252L217-F248 HydrophobicContact CB-CE2 3.95Å; L217-F248 HydrophobicContact CB-CZ 3.63Å; L217-F248 HydrophobicContact CD1-CD1 4.27Å; L217-F248 HydrophobicContact CD1-CD2 4.08Å; L217-F248 HydrophobicContact CD1-CE1 3.77Å; L217-F248 HydrophobicContact CD1-CE2 3.58Å; L217-F248 HydrophobicContact CD1-CG 4.46Å; L217-F248 HydrophobicContact CD1-CZ 3.46Å; L217-F248 VanDerWaalsContact CD1-CZ 3.46Å; L217-F248 HydrophobicContact CD2-CD2 3.95Å; L217-F248 HydrophobicContact CD2-CE2 3.28Å; L217-F248 HydrophobicContact CD2-CZ 3.89Å; L217-F248 HydrophobicContact CG-CE2 3.74Å; L217-F248 HydrophobicContact CG-CZ 3.8Å; K244-F248 HydrophobicContact CB-CD2 4.35Å; K244-F248 HydrophobicContact CB-CE2 4.49Å; K244-F248 HydrophobicContact CD-CD2 4.37Å; K244-F248 HydrophobicContact CD-CE2 3.98Å; K244-F248 HydrophobicContact CD-CZ 4.47Å; K244-F248 VanDerWaalsContact CE-CE2 3.41Å; K244-F248 VanDerWaalsContact CE-CZ 3.43Å; K244-F248 HydrophobicContact CG-CD2 3.32Å; K244-F248 HydrophobicContact CG-CE2 3.25Å; K244-F248 HydrophobicContact CG-CG 4.24Å; K244-F248 HydrophobicContact CG-CZ 4.16Å; K244-F248 WeakPolarHBondContact O-CB 3.25Å; K244-F248 WeakPolarHBondContact O-CD2 3.13Å; K244-F248 PolarHBondContact O-N 3.32Å; S245-F248 PolarHBondContact O-N 3.1Å; F248-F251 WeakPolarHBondContact O-CB 3.42Å; F248-F251 PolarHBondContact O-N 3.5Å; F248-W252 WeakPolarHBondContact O-CB 3.38Å; F248-W252 VanDerWaalsContact O-CD1 3.32Å; F248-W252 PolarHBondContact O-N 3.2Å
249L84.9Confident81.3Confident86 Ų8638.7 Ų38.745%0.4521%0.206SC..Hα-helixtrans-64-46178.2-75.9172.5000110.1S245 F251 W252 Q253S245-L249 VanDerWaalsContact O-CB 3.25Å; S245-L249 WeakPolarHBondContact O-CB 3.43Å; S245-L249 WeakPolarHBondContact O-CG 3.14Å; S245-L249 PolarHBondContact O-N 3.18Å; L249-F251 VanDerWaalsContact C-N 3.27Å; L249-F251 PolarHBondContact O-N 3.09Å; L249-W252 PolarHBondContact O-N 3.14Å; L249-Q253 WeakPolarHBondContact O-CB 3.43Å; L249-Q253 WeakPolarHBondContact O-CG 3.38Å; L249-Q253 PolarHBondContact O-N 2.86Å
250C80Confident81.3Confident8 Ų840.9 Ų40.95%0.05422%0.218CC..Hα-helixtrans-57.6-41.4174.7-61.70000112V246 G254 Q282V246-C250 PolarHBondContact O-SG 2.81Å; V246-C250 VanDerWaalsContact O-SG 3.33Å; C250-G254 PolarHBondContact O-N 3.32Å; C250-Q282 PolarHBondContact O-NE2 2.96Å
251F77.6Confident81.2Confident8 Ų841 Ų414%0.03522%0.219CC..Hα-helixtrans-65.3-50.7177172.2-99.6000113Y209 N210 A213 F214 V247 F248 L249 Q253 G254 I255Y209-F251 AromaticContact CE1-CD2 3.95Å; Y209-F251 HydrophobicContact CE1-CD2 3.95Å; Y209-F251 HydrophobicContact CE1-CE2 4.07Å; Y209-F251 AromaticContact CZ-CD2 3.98Å; N210-F251 HydrophobicContact CB-CE2 4.49Å; N210-F251 WeakPolarHBondContact OD1-CE2 3.33Å; N210-F251 WeakPolarHBondContact OD1-CZ 3.49Å; A213-F251 HydrophobicContact CB-CD2 4.46Å; A213-F251 HydrophobicContact CB-CE2 4.01Å; F214-F251 HydrophobicContact CD2-CZ 4.31Å; F214-F251 HydrophobicContact CE2-CE1 4.38Å; F214-F251 HydrophobicContact CE2-CZ 4.2Å; V247-F251 PolarHBondContact O-N 3.23Å; F248-F251 WeakPolarHBondContact O-CB 3.42Å; F248-F251 PolarHBondContact O-N 3.5Å; L249-F251 VanDerWaalsContact C-N 3.27Å; L249-F251 PolarHBondContact O-N 3.09Å; F251-Q253 VanDerWaalsContact C-N 3.33Å; F251-Q253 PolarHBondContact O-N 2.78Å; F251-G254 PolarHBondContact O-N 3.42Å; F251-G254 VanDerWaalsContact O-N 3.16Å; F251-I255 HydrophobicContact CD1-CD1 4.01Å; F251-I255 HydrophobicContact CE1-CD1 3.33Å; F251-I255 HydrophobicContact CE1-CG1 4.4Å; F251-I255 HydrophobicContact CE2-CD1 4.17Å; F251-I255 HydrophobicContact CZ-CD1 3.45Å; F251-I255 VanDerWaalsContact CZ-CD1 3.45Å; F251-I255 HydrophobicContact CZ-CG1 4.38Å; F251-I255 PolarHBondContact O-N 3.43Å; F251-I255 VanDerWaalsContact O-N 3.13Å
252W80.9Confident80.9Confident127 Ų12746.3 Ų46.348%0.48123%0.233SC..Hα-helixtrans-66.2-35-179.7-87107000112.2F248 L249 G254 I255 I256F248-W252 WeakPolarHBondContact O-CB 3.38Å; F248-W252 VanDerWaalsContact O-CD1 3.32Å; F248-W252 PolarHBondContact O-N 3.2Å; L249-W252 PolarHBondContact O-N 3.14Å; W252-G254 VanDerWaalsContact C-N 3.31Å; W252-G254 PolarHBondContact O-N 2.84Å; W252-I255 HydrophobicContact CE3-CB 4.46Å; W252-I255 HydrophobicContact CE3-CD1 4.45Å; W252-I255 HydrophobicContact CE3-CG2 4.44Å; W252-I255 HydrophobicContact CZ3-CG2 4.42Å; W252-I255 PolarHBondContact O-N 3.34Å; W252-I256 HydrophobicContact CB-CD1 4.46Å; W252-I256 VanDerWaalsContact O-CB 3.32Å; W252-I256 WeakPolarHBondContact O-CB 3.18Å; W252-I256 WeakPolarHBondContact O-CD1 3.32Å; W252-I256 WeakPolarHBondContact O-CG1 3.32Å; W252-I256 PolarHBondContact O-N 3.16Å
253Q83.1Confident80.6Confident16 Ų1649.1 Ų49.18%0.07525%0.251CS..Hα-helixtrans-56.2-47.9170.8-76.2173.2-2.500111.2L249 F251 I255 I256 L257 Q282 E289L249-Q253 WeakPolarHBondContact O-CB 3.43Å; L249-Q253 WeakPolarHBondContact O-CG 3.38Å; L249-Q253 PolarHBondContact O-N 2.86Å; F251-Q253 VanDerWaalsContact C-N 3.33Å; F251-Q253 PolarHBondContact O-N 2.78Å; Q253-I255 VanDerWaalsContact C-N 3.35Å; Q253-I255 PolarHBondContact O-N 2.83Å; Q253-I256 PolarHBondContact O-N 3.33Å; Q253-L257 VanDerWaalsContact O-CB 3.3Å; Q253-L257 WeakPolarHBondContact O-CB 3.16Å; Q253-L257 WeakPolarHBondContact O-CD1 3.28Å; Q253-L257 WeakPolarHBondContact O-CG 3.39Å; Q253-L257 PolarHBondContact O-N 3.17Å; Q253-Q282 HydrophobicContact CB-CG 4.19Å; Q253-E289 PolarHBondContact NE2-OE1 3.15Å; Q253-E289 PolarHBondContact NE2-OE2 3.38Å
254G79.6Confident80Confident21 Ų2156.2 Ų56.222%0.21628%0.283CS..Hα-helixtrans-58-45.8177.300000112.3C250 F251 W252 A258C250-G254 PolarHBondContact O-N 3.32Å; F251-G254 PolarHBondContact O-N 3.42Å; F251-G254 VanDerWaalsContact O-N 3.16Å; W252-G254 VanDerWaalsContact C-N 3.31Å; W252-G254 PolarHBondContact O-N 2.84Å; G254-A258 VanDerWaalsContact O-CB 3.24Å; G254-A258 WeakPolarHBondContact O-CB 3.37Å; G254-A258 PolarHBondContact O-N 3.07Å
255I81.2Confident79.5Confident37 Ų3756.5 Ų56.519%0.1929%0.291CS..Hα-helixtrans-63.4-49.2176.4-66178.8000111.6N210 F251 W252 Q253 L257 A258 I259N210-I255 WeakPolarHBondContact OD1-CD1 3.49Å; F251-I255 HydrophobicContact CD1-CD1 4.01Å; F251-I255 HydrophobicContact CE1-CD1 3.33Å; F251-I255 HydrophobicContact CE1-CG1 4.4Å; F251-I255 HydrophobicContact CE2-CD1 4.17Å; F251-I255 HydrophobicContact CZ-CD1 3.45Å; F251-I255 VanDerWaalsContact CZ-CD1 3.45Å; F251-I255 HydrophobicContact CZ-CG1 4.38Å; F251-I255 PolarHBondContact O-N 3.43Å; F251-I255 VanDerWaalsContact O-N 3.13Å; W252-I255 HydrophobicContact CE3-CB 4.46Å; W252-I255 HydrophobicContact CE3-CD1 4.45Å; W252-I255 HydrophobicContact CE3-CG2 4.44Å; W252-I255 HydrophobicContact CZ3-CG2 4.42Å; W252-I255 PolarHBondContact O-N 3.34Å; Q253-I255 VanDerWaalsContact C-N 3.35Å; Q253-I255 PolarHBondContact O-N 2.83Å; I255-L257 VanDerWaalsContact C-N 3.31Å; I255-L257 PolarHBondContact O-N 3.37Å; I255-A258 PolarHBondContact O-N 2.84Å; I255-I259 HydrophobicContact CG2-CD1 3.74Å; I255-I259 HydrophobicContact CG2-CG1 4.36Å; I255-I259 WeakPolarHBondContact O-CG1 3.4Å; I255-I259 PolarHBondContact O-N 3.3Å
256I85.2Confident78.8Confident86 Ų8654.1 Ų54.144%0.44127%0.274SS..Hα-helixtrans-60.5-45.2-177-71.9165.3000109.7W252 Q253 I259 L260W252-I256 HydrophobicContact CB-CD1 4.46Å; W252-I256 VanDerWaalsContact O-CB 3.32Å; W252-I256 WeakPolarHBondContact O-CB 3.18Å; W252-I256 WeakPolarHBondContact O-CD1 3.32Å; W252-I256 WeakPolarHBondContact O-CG1 3.32Å; W252-I256 PolarHBondContact O-N 3.16Å; Q253-I256 PolarHBondContact O-N 3.33Å; I256-I259 PolarHBondContact O-N 3.44Å; I256-L260 HydrophobicContact CG2-CD1 3.86Å; I256-L260 HydrophobicContact CG2-CG 4.33Å; I256-L260 WeakPolarHBondContact O-CB 3.45Å; I256-L260 VanDerWaalsContact O-CG 3.28Å; I256-L260 WeakPolarHBondContact O-CG 3.49Å; I256-L260 PolarHBondContact O-N 3.07Å
257L83.3Confident77.7Confident13 Ų1354.9 Ų54.97%0.06828%0.279CS..Hα-helixtrans-65.9-39.6178.6-69.5167.9000111.8Q253 I255 I259 L260 E261 A278 I281 Q282Q253-L257 VanDerWaalsContact O-CB 3.3Å; Q253-L257 WeakPolarHBondContact O-CB 3.16Å; Q253-L257 WeakPolarHBondContact O-CD1 3.28Å; Q253-L257 WeakPolarHBondContact O-CG 3.39Å; Q253-L257 PolarHBondContact O-N 3.17Å; I255-L257 VanDerWaalsContact C-N 3.31Å; I255-L257 PolarHBondContact O-N 3.37Å; L257-I259 VanDerWaalsContact C-N 3.31Å; L257-I259 PolarHBondContact O-N 3.42Å; L257-L260 HydrophobicContact CD2-CD1 4.46Å; L257-L260 PolarHBondContact O-N 3.48Å; L257-E261 WeakPolarHBondContact O-CB 3.34Å; L257-E261 PolarHBondContact O-N 2.86Å; L257-A278 HydrophobicContact CB-CB 4.26Å; L257-I281 HydrophobicContact CD2-CB 4.2Å; L257-I281 HydrophobicContact CD2-CG2 3.87Å; L257-Q282 HydrophobicContact CD1-CB 3.4Å; L257-Q282 VanDerWaalsContact CD1-CB 3.4Å; L257-Q282 HydrophobicContact CD1-CG 3.81Å
258A78.5Confident76.7Confident7 Ų757.5 Ų57.56%0.05830%0.301CS..Hα-helixtrans-64.7-34.5174.500000112.7F196 G254 I255 K262F196-A258 HydrophobicContact CE2-CB 3.8Å; F196-A258 HydrophobicContact CZ-CB 3.75Å; G254-A258 VanDerWaalsContact O-CB 3.24Å; G254-A258 WeakPolarHBondContact O-CB 3.37Å; G254-A258 PolarHBondContact O-N 3.07Å; I255-A258 PolarHBondContact O-N 2.84Å; A258-K262 PolarHBondContact O-N 3.31Å
259I82.3Confident75.6Confident96 Ų9656.8 Ų56.849%0.49230%0.299SS..Hα-helixtrans-69.8-46.1173.1-68.2168.9000110.6I255 I256 L257 E261 K262 T263I255-I259 HydrophobicContact CG2-CD1 3.74Å; I255-I259 HydrophobicContact CG2-CG1 4.36Å; I255-I259 WeakPolarHBondContact O-CG1 3.4Å; I255-I259 PolarHBondContact O-N 3.3Å; I256-I259 PolarHBondContact O-N 3.44Å; L257-I259 VanDerWaalsContact C-N 3.31Å; L257-I259 PolarHBondContact O-N 3.42Å; I259-E261 VanDerWaalsContact C-N 3.26Å; I259-E261 PolarHBondContact O-N 3.15Å; I259-K262 PolarHBondContact O-N 3.32Å; I259-K262 VanDerWaalsContact O-N 3.07Å; I259-T263 HydrophobicContact CG2-CG2 4.31Å; I259-T263 WeakPolarHBondContact O-CG2 3.39Å; I259-T263 PolarHBondContact O-N 2.65Å; I259-T263 PolarHBondContact O-OG1 2.83Å
260L80.7Confident73.9Confident61 Ų6157.6 Ų57.632%0.31931%0.309SS..Hα-helixtrans-61.4-35.8-179.9-72.8171.3000112.2I256 L257 T263 V265 L266I256-L260 HydrophobicContact CG2-CD1 3.86Å; I256-L260 HydrophobicContact CG2-CG 4.33Å; I256-L260 WeakPolarHBondContact O-CB 3.45Å; I256-L260 VanDerWaalsContact O-CG 3.28Å; I256-L260 WeakPolarHBondContact O-CG 3.49Å; I256-L260 PolarHBondContact O-N 3.07Å; L257-L260 HydrophobicContact CD2-CD1 4.46Å; L257-L260 PolarHBondContact O-N 3.48Å; L260-T263 WeakPolarHBondContact CA-OG1 3.29Å; L260-T263 PolarHBondContact O-OG1 3.28Å; L260-T263 VanDerWaalsContact O-OG1 3.1Å; L260-V265 HydrophobicContact CD2-CB 4.4Å; L260-V265 HydrophobicContact CD2-CG1 4.31Å; L260-V265 PolarHBondContact O-N 3.12Å; L260-L266 HydrophobicContact CB-CD1 3.63Å; L260-L266 PolarHBondContact O-N 3.02Å
261E74.6Confident72.7Confident18 Ų1864 Ų648%0.08434%0.343CS..Hα-helixtrans-62.4-48.7170.6-178.8175.8-17700111.5G194 L257 I259 T263 E264 A274 G275G194-E261 WeakPolarHBondContact CA-OE1 3.17Å; G194-E261 WeakPolarHBondContact CA-OE2 3.33Å; L257-E261 WeakPolarHBondContact O-CB 3.34Å; L257-E261 PolarHBondContact O-N 2.86Å; I259-E261 VanDerWaalsContact C-N 3.26Å; I259-E261 PolarHBondContact O-N 3.15Å; E261-T263 VanDerWaalsContact C-N 3.31Å; E261-T263 PolarHBondContact O-N 3.24Å; E261-E264 PolarHBondContact O-N 3.13Å; E261-A274 HydrophobicContact CG-CB 3.89Å; E261-A274 WeakPolarHBondContact OE1-CB 3.09Å; E261-G275 PolarHBondContact OE1-N 2.89Å; E261-G275 VanDerWaalsContact OE1-N 3.08Å
262K73.3Confident72Confident156 Ų15665 Ų6568%0.67835%0.35SS*.Hα-helixtrans-63.5-34.2179.5-174.7-177.4176.3-176.90113.1F196 A258 I259 E264F196-K262 HydrophobicContact CD2-CB 4.45Å; A258-K262 PolarHBondContact O-N 3.31Å; I259-K262 PolarHBondContact O-N 3.32Å; I259-K262 VanDerWaalsContact O-N 3.07Å; K262-E264 PolarHBondContact O-N 3.37Å
263T79Confident71.4Confident81 Ų8162.4 Ų62.450%0.49735%0.346SS..THydrogen-bonded Turntrans-777.2177.256.10000113.1I259 L260 E261 V265I259-T263 HydrophobicContact CG2-CG2 4.31Å; I259-T263 WeakPolarHBondContact O-CG2 3.39Å; I259-T263 PolarHBondContact O-N 2.65Å; I259-T263 PolarHBondContact O-OG1 2.83Å; L260-T263 WeakPolarHBondContact CA-OG1 3.29Å; L260-T263 PolarHBondContact O-OG1 3.28Å; L260-T263 VanDerWaalsContact O-OG1 3.1Å; E261-T263 VanDerWaalsContact C-N 3.31Å; E261-T263 PolarHBondContact O-N 3.24Å; T263-V265 PolarHBondContact O-N 3.21Å; T263-V265 WeakPolarHBondContact OG1-CG2 3.39Å
264E69.3Low70.8Confident158 Ų15862.4 Ų62.474%0.73835%0.348SS*.THydrogen-bonded Turntrans55.419.6-177.2-59.1-177.5173.200113.5E261 K262E261-E264 PolarHBondContact O-N 3.13Å; K262-E264 PolarHBondContact O-N 3.37Å
265V70.6Confident70.6Confident82 Ų8261.4 Ų61.450%0.49734%0.338SS..SBendtrans-70.6-28.9172.4174.20000109.3T21 L260 T263 P267T21-V265 WeakPolarHBondContact CG2-O 3.21Å; L260-V265 HydrophobicContact CD2-CB 4.4Å; L260-V265 HydrophobicContact CD2-CG1 4.31Å; L260-V265 PolarHBondContact O-N 3.12Å; T263-V265 PolarHBondContact O-N 3.21Å; T263-V265 WeakPolarHBondContact OG1-CG2 3.39Å; V265-P267 VanDerWaalsContact C-CD 3.43Å; V265-P267 WeakPolarHBondContact O-CD 3.22Å
266L65.5Low70.5Confident9 Ų959.7 Ų59.75%0.04733%0.329CS..SBendtrans-105.681.9170.2-75.8150.8000110.6V25 L260 V277 I281V25-L266 HydrophobicContact CG2-CD2 4.37Å; L260-L266 HydrophobicContact CB-CD1 3.63Å; L260-L266 PolarHBondContact O-N 3.02Å; L266-V277 HydrophobicContact CD2-CG1 3.97Å; L266-I281 HydrophobicContact CD2-CD1 3.69Å
267P59.1Low70.4Confident32 Ų3255.6 Ų55.621%0.20831%0.308CS..PPolyproline II helixtrans-59.4139.8171.220.6-35.1000112.3T21 V25 V265T21-P267 VanDerWaalsContact CG2-CD 3.4Å; T21-P267 HydrophobicContact CG2-CG 3.74Å; V25-P267 HydrophobicContact CB-CG 3.97Å; V25-P267 WeakPolarHBondContact CG1-O 3.44Å; V25-P267 VanDerWaalsContact CG2-CD 3.44Å; V25-P267 HydrophobicContact CG2-CG 3.7Å; V265-P267 VanDerWaalsContact C-CD 3.43Å; V265-P267 WeakPolarHBondContact O-CD 3.22Å
268A61.2Low70.4Confident59 Ų5955.1 Ų55.149%0.48831%0.306SS..PPolyproline II helixtrans-60137.8167.700000110.3A274A268-A274 HydrophobicContact CB-CB 3.93Å
269L57.7Low70.6Confident31 Ų3154.9 Ų54.916%0.16230%0.304CS..PPolyproline II helixtrans-74.4149.3170.3-85.3137.2000110.2V25 S26 F29 N271 T272 V277V25-L269 HydrophobicContact CG1-CD1 4.49Å; S26-L269 WeakPolarHBondContact OG-CD2 3.42Å; F29-L269 HydrophobicContact CB-CD1 3.39Å; F29-L269 HydrophobicContact CD1-CD1 3.49Å; F29-L269 VanDerWaalsContact CD1-CD1 3.49Å; F29-L269 HydrophobicContact CD2-CD1 4.1Å; F29-L269 HydrophobicContact CE1-CD1 4.24Å; F29-L269 HydrophobicContact CG-CD1 3.38Å; L269-N271 PolarHBondContact O-N 3.44Å; L269-N271 VanDerWaalsContact O-N 3.07Å; L269-T272 PolarHBondContact N-O 2.91Å; L269-T272 PolarHBondContact O-N 3.28Å; L269-V277 HydrophobicContact CD1-CG2 4.04Å
270P49.1Very low70.9Confident103 Ų10350.3 Ų50.367%0.66928%0.281SS*.THydrogen-bonded Turntrans-60.3117.3166.125.9-30.5000107.8
271N54.4Low71.2Confident142 Ų14248.9 Ų48.976%0.75927%0.273SS*.THydrogen-bonded Turntrans86.57.1-173.1-41.5-45.7000117L269L269-N271 PolarHBondContact O-N 3.44Å; L269-N271 VanDerWaalsContact O-N 3.07Å
272T62.4Low71.9Confident29 Ų2949.5 Ų49.518%0.17828%0.276CS..SBendtrans-142.7139.9175.1-51.50000111.5F29 L269 T276F29-T272 HydrophobicContact CE2-CG2 4.21Å; F29-T272 HydrophobicContact CZ-CG2 4.03Å; L269-T272 PolarHBondContact N-O 2.91Å; L269-T272 PolarHBondContact O-N 3.28Å; T272-T276 HydrophobicContact CG2-CG2 3.96Å
273N68.9Low72.8Confident73 Ų7342 Ų4239%0.3924%0.244SC..  trans-67.4139.8176.5-70.3-27.4000110.3G275 T276N273-G275 PolarHBondContact O-N 3.18Å; N273-T276 WeakPolarHBondContact O-CB 3.48Å; N273-T276 PolarHBondContact O-N 2.79Å
274A71.6Confident73.4Confident16 Ų1639.6 Ų39.613%0.13223%0.226CC..Hα-helixtrans-54.2-37.4174.400000111.8E261 A268 T276 V277 A278E261-A274 HydrophobicContact CG-CB 3.89Å; E261-A274 WeakPolarHBondContact OE1-CB 3.09Å; A268-A274 HydrophobicContact CB-CB 3.93Å; A274-T276 VanDerWaalsContact C-N 3.29Å; A274-T276 PolarHBondContact O-N 3.38Å; A274-V277 WeakPolarHBondContact O-CB 3.49Å; A274-V277 PolarHBondContact O-N 2.88Å; A274-V277 VanDerWaalsContact O-N 3.14Å; A274-A278 PolarHBondContact O-N 2.96Å; A274-A278 VanDerWaalsContact O-N 3.13Å
275G74.6Confident74.5Confident0 Ų035.2 Ų35.20%021%0.207CC..Hα-helixtrans-57.6-31.8173.600000115.6H193 E261 N273 A278 A279H193-G275 PolarHBondContact CD2-O 2.77Å; E261-G275 PolarHBondContact OE1-N 2.89Å; E261-G275 VanDerWaalsContact OE1-N 3.08Å; N273-G275 PolarHBondContact O-N 3.18Å; G275-A278 PolarHBondContact O-N 3.4Å; G275-A279 WeakPolarHBondContact O-CB 3.29Å; G275-A279 PolarHBondContact O-N 3.03Å
276T80.2Confident75.5Confident2 Ų231.4 Ų31.41%0.01218%0.184CC..Hα-helixtrans-69.9-37.3177-50.30000111.1L93 Y99 T272 N273 A274 A279 G280L93-T276 HydrophobicContact CD2-CG2 4.29Å; Y99-T276 HydrophobicContact CD1-CG2 4.43Å; Y99-T276 HydrophobicContact CE1-CG2 4.13Å; T272-T276 HydrophobicContact CG2-CG2 3.96Å; N273-T276 WeakPolarHBondContact O-CB 3.48Å; N273-T276 PolarHBondContact O-N 2.79Å; A274-T276 VanDerWaalsContact C-N 3.29Å; A274-T276 PolarHBondContact O-N 3.38Å; T276-A279 PolarHBondContact O-N 3.28Å; T276-G280 PolarHBondContact O-N 3.15Å
277V81.8Confident76.9Confident0 Ų031 Ų310%018%0.182CC..Hα-helixtrans-65.2-47.2175.6-174.20000109.9V25 F29 L266 L269 A274 A279 G280 I281V25-V277 HydrophobicContact CG1-CG1 4.2Å; F29-V277 HydrophobicContact CD2-CB 4.32Å; F29-V277 HydrophobicContact CD2-CG1 4.33Å; F29-V277 HydrophobicContact CD2-CG2 3.72Å; F29-V277 HydrophobicContact CE2-CG2 4.24Å; F29-V277 HydrophobicContact CG-CG2 4.36Å; L266-V277 HydrophobicContact CD2-CG1 3.97Å; L269-V277 HydrophobicContact CD1-CG2 4.04Å; A274-V277 WeakPolarHBondContact O-CB 3.49Å; A274-V277 PolarHBondContact O-N 2.88Å; A274-V277 VanDerWaalsContact O-N 3.14Å; V277-A279 PolarHBondContact O-N 3.46Å; V277-G280 PolarHBondContact O-N 3.4Å; V277-I281 HydrophobicContact CG1-CD1 4.21Å; V277-I281 WeakPolarHBondContact O-CG1 3.2Å; V277-I281 PolarHBondContact O-N 3.44Å
278A83.9Confident78.6Confident3 Ų332 Ų323%0.02519%0.185CC..Hα-helixtrans-57.2-47.9176.200000111.7L257 A274 G275 G280 I281 Q282L257-A278 HydrophobicContact CB-CB 4.26Å; A274-A278 PolarHBondContact O-N 2.96Å; A274-A278 VanDerWaalsContact O-N 3.13Å; G275-A278 PolarHBondContact O-N 3.4Å; A278-G280 VanDerWaalsContact C-N 3.33Å; A278-G280 PolarHBondContact O-N 2.86Å; A278-I281 PolarHBondContact O-N 3.33Å; A278-Q282 PolarHBondContact O-N 3.14Å
279A83.6Confident80.1Confident1 Ų131.1 Ų31.11%0.00817%0.171CC..Hα-helixtrans-61.1-39.617600000112.4Y99 G275 T276 V277 Q282 N283Y99-A279 HydrophobicContact CD2-CB 3.72Å; Y99-A279 HydrophobicContact CE2-CB 3.46Å; Y99-A279 VanDerWaalsContact CE2-CB 3.46Å; G275-A279 WeakPolarHBondContact O-CB 3.29Å; G275-A279 PolarHBondContact O-N 3.03Å; T276-A279 PolarHBondContact O-N 3.28Å; V277-A279 PolarHBondContact O-N 3.46Å; A279-Q282 PolarHBondContact O-N 3.1Å; A279-N283 WeakPolarHBondContact O-CB 3.37Å; A279-N283 PolarHBondContact O-N 3.46Å; A279-N283 PolarHBondContact O-ND2 2.89Å
280G87Confident81.9Confident0 Ų029.7 Ų29.70%016%0.164CC..Hα-helixtrans-61.5-46.2174.800000112.7L90 T276 V277 A278 Q282 N283 F284L90-G280 VanDerWaalsContact CD2-O 3.29Å; L90-G280 WeakPolarHBondContact CD2-O 3.38Å; T276-G280 PolarHBondContact O-N 3.15Å; V277-G280 PolarHBondContact O-N 3.4Å; A278-G280 VanDerWaalsContact C-N 3.33Å; A278-G280 PolarHBondContact O-N 2.86Å; G280-Q282 VanDerWaalsContact C-N 3.34Å; G280-Q282 PolarHBondContact O-N 3.21Å; G280-N283 PolarHBondContact O-N 3.4Å; G280-F284 WeakPolarHBondContact O-CB 3.4Å; G280-F284 PolarHBondContact O-N 2.91Å
281I88.3Confident84.1Confident32 Ų3227.2 Ų27.216%0.16415%0.145CC..Hα-helixtrans-61.4-44.8175.7-64.4170.8000110.2L32 L257 L266 V277 A278 N283 F284 L285L32-I281 HydrophobicContact CD1-CG1 3.7Å; L257-I281 HydrophobicContact CD2-CB 4.2Å; L257-I281 HydrophobicContact CD2-CG2 3.87Å; L266-I281 HydrophobicContact CD2-CD1 3.69Å; V277-I281 HydrophobicContact CG1-CD1 4.21Å; V277-I281 WeakPolarHBondContact O-CG1 3.2Å; V277-I281 PolarHBondContact O-N 3.44Å; A278-I281 PolarHBondContact O-N 3.33Å; I281-N283 PolarHBondContact O-N 2.98Å; I281-F284 WeakPolarHBondContact O-CB 3.45Å; I281-F284 PolarHBondContact O-N 3.41Å; I281-L285 HydrophobicContact CG2-CD1 4.07Å; I281-L285 HydrophobicContact CG2-CG 4.42Å; I281-L285 WeakPolarHBondContact O-CG 3.39Å; I281-L285 PolarHBondContact O-N 3.06Å
282Q89.7Confident86Confident30 Ų3026.3 Ų26.314%0.1414%0.138CC..Hα-helixtrans-58.2-49.7178.6-161.9171.9-5.900111.5C250 Q253 L257 A278 A279 G280 F284 L285 I286C250-Q282 PolarHBondContact O-NE2 2.96Å; Q253-Q282 HydrophobicContact CB-CG 4.19Å; L257-Q282 HydrophobicContact CD1-CB 3.4Å; L257-Q282 VanDerWaalsContact CD1-CB 3.4Å; L257-Q282 HydrophobicContact CD1-CG 3.81Å; A278-Q282 PolarHBondContact O-N 3.14Å; A279-Q282 PolarHBondContact O-N 3.1Å; G280-Q282 VanDerWaalsContact C-N 3.34Å; G280-Q282 PolarHBondContact O-N 3.21Å; Q282-F284 VanDerWaalsContact C-N 3.3Å; Q282-F284 PolarHBondContact O-N 2.91Å; Q282-L285 PolarHBondContact O-N 3.48Å; Q282-L285 VanDerWaalsContact O-N 3.17Å; Q282-I286 HydrophobicContact CG-CD1 3.94Å; Q282-I286 HydrophobicContact CG-CG1 4.45Å; Q282-I286 VanDerWaalsContact O-CG1 3.31Å; Q282-I286 WeakPolarHBondContact O-CG1 3.4Å; Q282-I286 PolarHBondContact O-N 3.22Å
283N90.7Very high87.5Confident0 Ų025.1 Ų25.10%013%0.132CC..Hα-helixtrans-63.4-36.7-179.1-80.2-60.3000112.6S86 S89 L90 D103 R106 A279 G280 I281 C287S86-N283 WeakPolarHBondContact CA-OD1 3.46Å; S86-N283 WeakPolarHBondContact CB-OD1 3.47Å; S86-N283 PolarHBondContact OG-OD1 2.99Å; S89-N283 PolarHBondContact OG-ND2 3.23Å; S89-N283 VanDerWaalsContact OG-ND2 3.07Å; L90-N283 HydrophobicContact CD2-CB 3.81Å; L90-N283 HydrophobicContact CG-CB 3.89Å; D103-N283 PolarHBondContact OD1-ND2 3.44Å; D103-N283 PolarHBondContact OD1-OD1 2.72Å; R106-N283 PolarHBondContact NH1-OD1 3.36Å; A279-N283 WeakPolarHBondContact O-CB 3.37Å; A279-N283 PolarHBondContact O-N 3.46Å; A279-N283 PolarHBondContact O-ND2 2.89Å; G280-N283 PolarHBondContact O-N 3.4Å; I281-N283 PolarHBondContact O-N 2.98Å; N283-C287 PolarHBondContact O-N 3.33Å; N283-C287 VanDerWaalsContact O-N 3.14Å; N283-C287 PolarHBondContact O-SG 3.49Å
284F91.9Very high88.7Confident30 Ų3021.7 Ų21.713%0.13211%0.113CC..Hα-helixtrans-61.5-47.3172.7-179.4-86.5000111.8F31 L32 A37 F40 T41 L90 G280 I281 Q282 C287 L288F31-F284 HydrophobicContact CE1-CE2 4.01Å; F31-F284 HydrophobicContact CE1-CZ 4.08Å; F31-F284 HydrophobicContact CZ-CZ 4.49Å; L32-F284 HydrophobicContact CD2-CB 3.65Å; L32-F284 HydrophobicContact CD2-CD2 3.89Å; L32-F284 HydrophobicContact CD2-CG 3.9Å; A37-F284 HydrophobicContact CB-CE2 4.36Å; F40-F284 HydrophobicContact CD1-CE2 4.36Å; F40-F284 HydrophobicContact CD1-CZ 4.35Å; F40-F284 HydrophobicContact CE1-CZ 4.31Å; T41-F284 HydrophobicContact CG2-CD2 3.23Å; T41-F284 HydrophobicContact CG2-CE2 3.42Å; T41-F284 VanDerWaalsContact CG2-CE2 3.42Å; T41-F284 HydrophobicContact CG2-CG 4.05Å; T41-F284 HydrophobicContact CG2-CZ 4.38Å; L90-F284 HydrophobicContact CD1-CB 4.37Å; L90-F284 HydrophobicContact CD2-CB 4.36Å; G280-F284 WeakPolarHBondContact O-CB 3.4Å; G280-F284 PolarHBondContact O-N 2.91Å; I281-F284 WeakPolarHBondContact O-CB 3.45Å; I281-F284 PolarHBondContact O-N 3.41Å; Q282-F284 VanDerWaalsContact C-N 3.3Å; Q282-F284 PolarHBondContact O-N 2.91Å; F284-C287 PolarHBondContact O-N 2.89Å; F284-L288 HydrophobicContact CD1-CD1 4.29Å; F284-L288 HydrophobicContact CE1-CD1 3.72Å; F284-L288 HydrophobicContact CE1-CG 4.49Å; F284-L288 HydrophobicContact CZ-CD1 4.36Å; F284-L288 PolarHBondContact O-N 3.37Å
285L92.1Very high89.8Confident66 Ų6624 Ų2435%0.34613%0.125SC..Hα-helixtrans-65.4-42.7178.5-67.4175.7000112I281 Q282 C287 L288 E289I281-L285 HydrophobicContact CG2-CD1 4.07Å; I281-L285 HydrophobicContact CG2-CG 4.42Å; I281-L285 WeakPolarHBondContact O-CG 3.39Å; I281-L285 PolarHBondContact O-N 3.06Å; Q282-L285 PolarHBondContact O-N 3.48Å; Q282-L285 VanDerWaalsContact O-N 3.17Å; L285-C287 VanDerWaalsContact C-N 3.29Å; L285-C287 PolarHBondContact O-N 2.88Å; L285-L288 WeakPolarHBondContact O-CB 3.01Å; L285-L288 PolarHBondContact O-N 3.14Å; L285-L288 VanDerWaalsContact O-N 3.1Å; L285-E289 WeakPolarHBondContact O-CG 3.46Å; L285-E289 PolarHBondContact O-N 3.19Å
286I93.1Very high90.6Very high1 Ų125.3 Ų25.31%0.00514%0.136CC..Hα-helixtrans-57.3-42.9176.5-70.8170000110.7Y82 S86 Q282 L288 E289 M290Y82-I286 HydrophobicContact CD1-CG2 4.18Å; S86-I286 VanDerWaalsContact OG-CG2 3.28Å; S86-I286 WeakPolarHBondContact OG-CG2 3.02Å; Q282-I286 HydrophobicContact CG-CD1 3.94Å; Q282-I286 HydrophobicContact CG-CG1 4.45Å; Q282-I286 VanDerWaalsContact O-CG1 3.31Å; Q282-I286 WeakPolarHBondContact O-CG1 3.4Å; Q282-I286 PolarHBondContact O-N 3.22Å; I286-L288 VanDerWaalsContact C-N 3.29Å; I286-L288 PolarHBondContact O-N 3.45Å; I286-E289 PolarHBondContact O-N 3.09Å; I286-M290 HydrophobicContact CG2-CE 4.3Å; I286-M290 HydrophobicContact CG2-CG 3.92Å; I286-M290 WeakPolarHBondContact O-CB 3.4Å; I286-M290 VanDerWaalsContact O-CG 3.25Å; I286-M290 WeakPolarHBondContact O-CG 3.49Å; I286-M290 PolarHBondContact O-N 3.15Å
287C94.7Very high91.2Very high0 Ų025.4 Ų25.40%014%0.137CC..Hα-helixtrans-56.9-43.5177.5-68.30000112.1T41 V44 N283 F284 L285T41-C287 HydrophobicContact CG2-CB 4.24Å; V44-C287 VanDerWaalsContact CG1-O 3.31Å; V44-C287 WeakPolarHBondContact CG1-O 3.29Å; N283-C287 PolarHBondContact O-N 3.33Å; N283-C287 VanDerWaalsContact O-N 3.14Å; N283-C287 PolarHBondContact O-SG 3.49Å; F284-C287 PolarHBondContact O-N 2.89Å; L285-C287 VanDerWaalsContact C-N 3.29Å; L285-C287 PolarHBondContact O-N 2.88Å
288L94Very high91.6Very high54 Ų5429.8 Ų29.828%0.28315%0.154SC..Hα-helixtrans-66.8-44.1176.6-63.3179.2000112F40 V44 F284 L285 I286 M290 L291 I292F40-L288 HydrophobicContact CE1-CD2 3.81Å; F40-L288 HydrophobicContact CZ-CD2 4.11Å; V44-L288 HydrophobicContact CG1-CD2 4.09Å; V44-L288 HydrophobicContact CG2-CD2 4.17Å; F284-L288 HydrophobicContact CD1-CD1 4.29Å; F284-L288 HydrophobicContact CE1-CD1 3.72Å; F284-L288 HydrophobicContact CE1-CG 4.49Å; F284-L288 HydrophobicContact CZ-CD1 4.36Å; F284-L288 PolarHBondContact O-N 3.37Å; L285-L288 WeakPolarHBondContact O-CB 3.01Å; L285-L288 PolarHBondContact O-N 3.14Å; L285-L288 VanDerWaalsContact O-N 3.1Å; I286-L288 VanDerWaalsContact C-N 3.29Å; I286-L288 PolarHBondContact O-N 3.45Å; L288-M290 VanDerWaalsContact C-N 3.33Å; L288-M290 PolarHBondContact O-N 3.47Å; L288-L291 PolarHBondContact O-N 3.48Å; L288-I292 PolarHBondContact O-N 3.3Å
289E93.5Very high91.9Very high40 Ų4036.8 Ų36.819%0.18718%0.183CC..Hα-helixtrans-65.6-36.1179.3-74-173169.700112.5Q253 L285 I286 L291 I292 A293Q253-E289 PolarHBondContact NE2-OE1 3.15Å; Q253-E289 PolarHBondContact NE2-OE2 3.38Å; L285-E289 WeakPolarHBondContact O-CG 3.46Å; L285-E289 PolarHBondContact O-N 3.19Å; I286-E289 PolarHBondContact O-N 3.09Å; E289-L291 PolarHBondContact O-N 3.03Å; E289-I292 CarbonylContact O-C 3.57Å; E289-I292 PolarHBondContact O-N 3.46Å; E289-I292 VanDerWaalsContact O-N 3.1Å; E289-A293 VanDerWaalsContact O-CB 3.3Å; E289-A293 WeakPolarHBondContact O-CB 3.27Å; E289-A293 PolarHBondContact O-N 2.71Å
290M94.7Very high92.1Very high1 Ų136.8 Ų36.81%0.00518%0.183CC..Hα-helixtrans-64.7-30.7178.5-72.9-47.999.500112A48 Y78 V79 Y82 A83 V246 I286 L288 A293 S294A48-M290 HydrophobicContact CB-CB 4.47Å; Y78-M290 HydrophobicContact CD1-SD 4.13Å; Y78-M290 HydrophobicContact CE1-CE 4.12Å; Y78-M290 HydrophobicContact CE1-SD 3.97Å; V79-M290 HydrophobicContact CG1-CB 4.28Å; V79-M290 HydrophobicContact CG2-SD 4.08Å; Y82-M290 VanDerWaalsContact CB-SD 3.59Å; Y82-M290 HydrophobicContact CG-SD 4.36Å; A83-M290 HydrophobicContact CB-CB 3.92Å; A83-M290 HydrophobicContact CB-CG 4.17Å; V246-M290 HydrophobicContact CG1-CE 4.23Å; I286-M290 HydrophobicContact CG2-CE 4.3Å; I286-M290 HydrophobicContact CG2-CG 3.92Å; I286-M290 WeakPolarHBondContact O-CB 3.4Å; I286-M290 VanDerWaalsContact O-CG 3.25Å; I286-M290 WeakPolarHBondContact O-CG 3.49Å; I286-M290 PolarHBondContact O-N 3.15Å; L288-M290 VanDerWaalsContact C-N 3.33Å; L288-M290 PolarHBondContact O-N 3.47Å; M290-A293 HydrophobicContact CE-CB 4.41Å; M290-A293 PolarHBondContact O-N 3.4Å; M290-S294 WeakPolarHBondContact O-CB 3.42Å; M290-S294 PolarHBondContact O-N 3.03Å
291L95.6Very high92.1Very high52 Ų5237 Ų3727%0.27219%0.185SC..Hα-helixtrans-65.3-46.8170.718064.3000111.3V44 T47 A48 I51 L288 E289 A293 S294 V295V44-L291 HydrophobicContact CG1-CB 3.7Å; V44-L291 HydrophobicContact CG1-CD2 3.89Å; V44-L291 HydrophobicContact CG1-CG 4.37Å; T47-L291 HydrophobicContact CG2-CD1 3.83Å; A48-L291 HydrophobicContact CB-CB 4.23Å; A48-L291 HydrophobicContact CB-CD1 4.25Å; I51-L291 HydrophobicContact CD1-CD1 4.01Å; L288-L291 PolarHBondContact O-N 3.48Å; E289-L291 PolarHBondContact O-N 3.03Å; L291-A293 VanDerWaalsContact C-N 3.32Å; L291-A293 PolarHBondContact O-N 3.17Å; L291-S294 WeakPolarHBondContact O-CB 3.19Å; L291-S294 PolarHBondContact O-N 3.01Å; L291-S294 PolarHBondContact O-OG 3.17Å; L291-V295 PolarHBondContact O-N 3.38Å
292I94.3Very high92Very high122 Ų12237.4 Ų37.463%0.62619%0.189SC*.Hα-helixtrans-62.3-43.3176.5-60.8171.6000110.2L288 E289 S294 V295 A296L288-I292 PolarHBondContact O-N 3.3Å; E289-I292 CarbonylContact O-C 3.57Å; E289-I292 PolarHBondContact O-N 3.46Å; E289-I292 VanDerWaalsContact O-N 3.1Å; I292-S294 VanDerWaalsContact C-N 3.34Å; I292-S294 PolarHBondContact O-N 2.66Å; I292-V295 PolarHBondContact O-N 2.94Å; I292-A296 WeakPolarHBondContact O-CB 3.25Å; I292-A296 PolarHBondContact O-N 2.93Å
293A93.7Very high91.6Very high5 Ų536.6 Ų36.64%0.04119%0.187CC..Hα-helixtrans-62.6-38.2177.300000111.9V79 V246 E289 M290 L291 V295 A296 L297V79-A293 HydrophobicContact CG2-CB 3.8Å; V246-A293 HydrophobicContact CG1-CB 4.36Å; V246-A293 HydrophobicContact CG2-CB 3.63Å; E289-A293 VanDerWaalsContact O-CB 3.3Å; E289-A293 WeakPolarHBondContact O-CB 3.27Å; E289-A293 PolarHBondContact O-N 2.71Å; M290-A293 HydrophobicContact CE-CB 4.41Å; M290-A293 PolarHBondContact O-N 3.4Å; L291-A293 VanDerWaalsContact C-N 3.32Å; L291-A293 PolarHBondContact O-N 3.17Å; A293-V295 VanDerWaalsContact C-N 3.26Å; A293-V295 PolarHBondContact O-N 3.41Å; A293-A296 PolarHBondContact O-N 3.25Å; A293-L297 VanDerWaalsContact O-CB 3.27Å; A293-L297 WeakPolarHBondContact O-CB 3.34Å; A293-L297 VanDerWaalsContact O-CG 3.3Å; A293-L297 WeakPolarHBondContact O-CG 3.14Å; A293-L297 PolarHBondContact O-N 3.28Å
294S94.7Very high91Very high0 Ų043.4 Ų43.40%022%0.219CC..Hα-helixtrans-58.6-40.7176.478.20000111.7T52 M290 L291 I292 R298T52-S294 WeakPolarHBondContact OG1-CB 3.45Å; M290-S294 WeakPolarHBondContact O-CB 3.42Å; M290-S294 PolarHBondContact O-N 3.03Å; L291-S294 WeakPolarHBondContact O-CB 3.19Å; L291-S294 PolarHBondContact O-N 3.01Å; L291-S294 PolarHBondContact O-OG 3.17Å; I292-S294 VanDerWaalsContact C-N 3.34Å; I292-S294 PolarHBondContact O-N 2.66Å; S294-R298 WeakPolarHBondContact O-CB 3.49Å; S294-R298 PolarHBondContact O-N 3.47Å
295V93.7Very high90.3Very high64 Ų6445.2 Ų45.239%0.38823%0.23SC..Hα-helixtrans-74-44.7177.2177.30000110.5L291 I292 A293 L297 R298 F299L291-V295 PolarHBondContact O-N 3.38Å; I292-V295 PolarHBondContact O-N 2.94Å; A293-V295 VanDerWaalsContact C-N 3.26Å; A293-V295 PolarHBondContact O-N 3.41Å; V295-L297 PolarHBondContact O-N 2.96Å; V295-R298 VanDerWaalsContact O-CB 3.31Å; V295-R298 WeakPolarHBondContact O-CB 3.25Å; V295-R298 PolarHBondContact O-N 3.16Å; V295-R298 VanDerWaalsContact O-N 3.15Å; V295-F299 HydrophobicContact CG1-CD2 4Å; V295-F299 HydrophobicContact CG1-CE2 3.58Å; V295-F299 WeakPolarHBondContact O-CD2 3.33Å; V295-F299 PolarHBondContact O-N 3.35Å
296A92.5Very high89.7Confident28 Ų2842.6 Ų42.623%0.23122%0.215CC..Hα-helixtrans-62.2-42.8178.900000112.5V242 I292 A293 R298 F299 A300V242-A296 HydrophobicContact CG1-CB 3.85Å; V242-A296 HydrophobicContact CG2-CB 4.12Å; I292-A296 WeakPolarHBondContact O-CB 3.25Å; I292-A296 PolarHBondContact O-N 2.93Å; A293-A296 PolarHBondContact O-N 3.25Å; A296-R298 VanDerWaalsContact C-N 3.28Å; A296-R298 PolarHBondContact O-N 2.88Å; A296-F299 PolarHBondContact O-N 3.46Å; A296-A300 WeakPolarHBondContact O-CB 3.44Å; A296-A300 PolarHBondContact O-N 3.31Å
297L91.9Very high88.6Confident4 Ų446.6 Ų46.62%0.02124%0.236CC..Hα-helixtrans-66.1-30.2175.4-74.3172.7000112.1Q55 I75 L76 V79 V242 V243 A293 V295 F299 A300 F301Q55-L297 PolarHBondContact NE2-O 3.09Å; I75-L297 HydrophobicContact CG2-CD2 4.17Å; L76-L297 HydrophobicContact CD2-CB 3.86Å; L76-L297 HydrophobicContact CD2-CD1 4.28Å; L76-L297 HydrophobicContact CD2-CG 4.48Å; V79-L297 HydrophobicContact CG2-CD1 3.54Å; V242-L297 HydrophobicContact CG1-CD2 3.79Å; V242-L297 HydrophobicContact CG1-CG 4.12Å; V243-L297 HydrophobicContact CG2-CD2 4.45Å; A293-L297 VanDerWaalsContact O-CB 3.27Å; A293-L297 WeakPolarHBondContact O-CB 3.34Å; A293-L297 VanDerWaalsContact O-CG 3.3Å; A293-L297 WeakPolarHBondContact O-CG 3.14Å; A293-L297 PolarHBondContact O-N 3.28Å; V295-L297 PolarHBondContact O-N 2.96Å; L297-F299 VanDerWaalsContact C-N 3.32Å; L297-A300 PolarHBondContact O-N 2.84Å; L297-F301 HydrophobicContact CD2-CD2 3.78Å; L297-F301 HydrophobicContact CD2-CE2 3.64Å; L297-F301 PolarHBondContact O-N 3.26Å
298R90.8Very high86.9Confident93 Ų9352.9 Ų52.935%0.35127%0.269SS..Hα-helixtrans-63.4-38.8172.7-168.4176.4-176.9836.8112.3H54 S294 V295 A296H54-R298 PolarHBondContact ND1-NH1 3.17Å; S294-R298 WeakPolarHBondContact O-CB 3.49Å; S294-R298 PolarHBondContact O-N 3.47Å; V295-R298 VanDerWaalsContact O-CB 3.31Å; V295-R298 WeakPolarHBondContact O-CB 3.25Å; V295-R298 PolarHBondContact O-N 3.16Å; V295-R298 VanDerWaalsContact O-N 3.15Å; A296-R298 VanDerWaalsContact C-N 3.28Å; A296-R298 PolarHBondContact O-N 2.88Å
299F89Confident84.9Confident149 Ų14951.9 Ų51.965%0.65427%0.272SS*.Hα-helixtrans-77.4-39.4175.2-70.8-66.5000112.9V295 A296 L297V295-F299 HydrophobicContact CG1-CD2 4Å; V295-F299 HydrophobicContact CG1-CE2 3.58Å; V295-F299 WeakPolarHBondContact O-CD2 3.33Å; V295-F299 PolarHBondContact O-N 3.35Å; A296-F299 PolarHBondContact O-N 3.46Å; L297-F299 VanDerWaalsContact C-N 3.32Å
300A87.8Confident82.4Confident1 Ų153.4 Ų53.41%0.00828%0.284CS..Hα-helixtrans-69.6-33.8179.900000113.2K239 V242 A296 L297K239-A300 VanDerWaalsContact CE-O 3.3Å; K239-A300 WeakPolarHBondContact CE-O 3.2Å; K239-A300 HydrophobicContact CG-CB 4.43Å; K239-A300 VanDerWaalsContact CG-O 3.27Å; K239-A300 WeakPolarHBondContact CG-O 3.4Å; V242-A300 HydrophobicContact CB-CB 3.99Å; V242-A300 HydrophobicContact CG1-CB 4.15Å; V242-A300 HydrophobicContact CG2-CB 4.02Å; A296-A300 WeakPolarHBondContact O-CB 3.44Å; A296-A300 PolarHBondContact O-N 3.31Å; L297-A300 PolarHBondContact O-N 2.84Å
301F88Confident79.5Confident5 Ų556.5 Ų56.52%0.02232%0.317CS..SBendtrans-126.868.9-178.1-56.9-77.3000111.8Q55 H59 V72 I75 L120 K239 V243 L297 S303Q55-F301 PolarHBondContact NE2-O 3.29Å; H59-F301 PolarHBondContact NE2-O 3.31Å; V72-F301 HydrophobicContact CG1-CB 3.83Å; V72-F301 HydrophobicContact CG1-CD1 4.13Å; V72-F301 HydrophobicContact CG1-CG 4.09Å; V72-F301 HydrophobicContact CG2-CD1 4.14Å; I75-F301 HydrophobicContact CD1-CZ 4.36Å; I75-F301 HydrophobicContact CG2-CE2 4.14Å; I75-F301 HydrophobicContact CG2-CZ 4.49Å; L120-F301 HydrophobicContact CD2-CD1 4.42Å; L120-F301 HydrophobicContact CD2-CE1 3.67Å; L120-F301 HydrophobicContact CD2-CZ 4.4Å; K239-F301 HydrophobicContact CB-CE1 4.24Å; K239-F301 HydrophobicContact CB-CZ 4.14Å; K239-F301 HydrophobicContact CD-CD1 4.48Å; K239-F301 HydrophobicContact CD-CE1 4.07Å; K239-F301 HydrophobicContact CG-CD1 4.4Å; K239-F301 HydrophobicContact CG-CE1 3.93Å; K239-F301 HydrophobicContact CG-CZ 4.22Å; V243-F301 HydrophobicContact CG2-CE2 3.75Å; V243-F301 HydrophobicContact CG2-CZ 3.78Å; L297-F301 HydrophobicContact CD2-CD2 3.78Å; L297-F301 HydrophobicContact CD2-CE2 3.64Å; L297-F301 PolarHBondContact O-N 3.26Å; F301-S303 PolarHBondContact O-N 3.3Å
302P85.8Confident76.4Confident40 Ų4059.1 Ų59.126%0.2635%0.346SS..  trans-65.5133.9179.4-5.318.7000110.2Q304 L305P302-Q304 PolarHBondContact O-N 3.3Å; P302-L305 HydrophobicContact CB-CD1 3.77Å; P302-L305 HydrophobicContact CG-CD1 3.6Å
303S80.3Confident73.1Confident14 Ų1455.8 Ų55.810%0.09834%0.341CS..G310 helixtrans-69.1-18.3173.561.40000112.7F301 L305 Y306F301-S303 PolarHBondContact O-N 3.3Å; S303-L305 VanDerWaalsContact C-N 3.28Å; S303-L305 PolarHBondContact O-N 3.42Å; S303-Y306 PolarHBondContact O-N 2.71Å
304Q78.6Confident70.3Confident143 Ų14360.3 Ų60.367%0.66837%0.37SS*.G310 helixtrans-63.9-30.3-177-68.2177.1-11.400113.3P302 Y306 I307P302-Q304 PolarHBondContact O-N 3.3Å; Q304-Y306 PolarHBondContact O-N 3.02Å; Q304-I307 HydrophobicContact CB-CD1 4.38Å; Q304-I307 HydrophobicContact CG-CD1 4.03Å; Q304-I307 PolarHBondContact O-N 2.95Å; Q304-I307 VanDerWaalsContact O-N 3.1Å
305L78.4Confident67.3Low68 Ų6865 Ų6536%0.35641%0.408SS..G310 helixtrans-58.1-20.3174.2-82.674.7000112.5P302 S303 P409P302-L305 HydrophobicContact CB-CD1 3.77Å; P302-L305 HydrophobicContact CG-CD1 3.6Å; S303-L305 VanDerWaalsContact C-N 3.28Å; S303-L305 PolarHBondContact O-N 3.42Å; L305-P409 HydrophobicContact CD2-CG 4.17Å
306Y78.1Confident64.2Low11 Ų1169.7 Ų69.74%0.04343%0.432CS..G310 helixtrans-107.3-6.3-177.1-59.7-69.5000113.5H59 N62 T64 C65 E68 Q69 S303 Q304H59-Y306 AromaticContact CE1-CD2 3.69Å; H59-Y306 AromaticContact CE1-CE2 3.73Å; H59-Y306 AromaticContact ND1-CD2 3.6Å; H59-Y306 AromaticContact ND1-CE2 3.89Å; N62-Y306 WeakPolarHBondContact O-CB 3.41Å; T64-Y306 WeakPolarHBondContact CG2-O 3.43Å; T64-Y306 WeakPolarHBondContact OG1-CA 3.48Å; T64-Y306 WeakPolarHBondContact OG1-CB 3.41Å; T64-Y306 PolarHBondContact OG1-O 3.13Å; C65-Y306 HydrophobicContact CB-CD1 3.93Å; C65-Y306 HydrophobicContact CB-CE1 3.76Å; E68-Y306 VanDerWaalsContact OE2-CE1 3.29Å; E68-Y306 WeakPolarHBondContact OE2-CE1 3.47Å; E68-Y306 PolarHBondContact OE2-OH 3.28Å; Q69-Y306 HydrophobicContact CG-CD1 3.73Å; Q69-Y306 HydrophobicContact CG-CD2 3.91Å; Q69-Y306 HydrophobicContact CG-CE1 3.65Å; Q69-Y306 HydrophobicContact CG-CE2 3.81Å; Q69-Y306 HydrophobicContact CG-CG 3.87Å; Q69-Y306 VanDerWaalsContact NE2-CG 3.32Å; S303-Y306 PolarHBondContact O-N 2.71Å; Q304-Y306 PolarHBondContact O-N 3.02Å
307I70.1Confident60.9Low85 Ų8572.6 Ų72.644%0.43645%0.45SS..THydrogen-bonded Turntrans-76.3-49.7178.1-63.8175.9000110N62 Q304 G309N62-I307 HydrophobicContact CB-CG1 4.1Å; Q304-I307 HydrophobicContact CB-CD1 4.38Å; Q304-I307 HydrophobicContact CG-CD1 4.03Å; Q304-I307 PolarHBondContact O-N 2.95Å; Q304-I307 VanDerWaalsContact O-N 3.1Å; I307-G309 PolarHBondContact O-N 2.69Å
308D59.9Low57.7Low131 Ų13175.6 Ų75.670%0.70148%0.482SS*.SBendtrans-78.582.6173.4-66.8-22.4000106.1V310D308-V310 VanDerWaalsContact C-N 3.34Å; D308-V310 PolarHBondContact O-N 2.89Å
309G50.8Low54.7Low34 Ų3481.8 Ų81.835%0.35151%0.507SS..  trans-46.6103.5174.600000108.8I307 G311 A312I307-G309 PolarHBondContact O-N 2.69Å; G309-G311 PolarHBondContact O-N 2.76Å; G309-A312 PolarHBondContact O-N 2.91Å
310V41.5Very low51.8Low71 Ų7182.4 Ų82.443%0.4352%0.517SS..THydrogen-bonded Turntrans-6582.8167.3178.60000104.9D308 P407D308-V310 VanDerWaalsContact C-N 3.34Å; D308-V310 PolarHBondContact O-N 2.89Å; V310-P407 HydrophobicContact CG1-CB 3.32Å; V310-P407 VanDerWaalsContact CG1-CD 3.44Å; V310-P407 HydrophobicContact CG1-CG 3.31Å
311G34.7Very low48.8Very low67 Ų6787.4 Ų87.469%0.69155%0.552SS**THydrogen-bonded Turntrans164.3-3.2-16100000116.4G309 G313G309-G311 PolarHBondContact O-N 2.76Å; G311-G313 VanDerWaalsContact C-N 3.26Å
312A30.2Very low45.8Very low107 Ų10795 Ų9588%0.88459%0.592SS**SBendtrans-95.230155.300000112G309G309-A312 PolarHBondContact O-N 2.91Å
313G25Very low42.8Very low51 Ų5197.3 Ų97.353%0.52662%0.623SS.*SBendtrans-106.5142.8161.500000109.4G311 A315G311-G313 VanDerWaalsContact C-N 3.26Å; G313-A315 PolarHBondContact O-N 3.13Å
314P33.9Very low40.2Very low101 Ų101100.5 Ų100.566%0.65666%0.658SS**  trans-84.1112.5-153.732.5-32.8000112.3
315A33.2Very low37.6Very low97 Ų97101 Ų10180%0.80267%0.67SS**SBendtrans-109.61156.300000112.7G313G313-A315 PolarHBondContact O-N 3.13Å
316N27.5Very low35Very low164 Ų164100.8 Ų100.888%0.87769%0.685SS**SBendtrans-137.563.8168-90.3-18.3000110.1
317S24.2Very low32.6Very low88 Ų88104.3 Ų104.362%0.61573%0.725SS**  trans-152.8107.7145.9-91.50000106.3Y319S317-Y319 PolarHBondContact O-N 3.17Å
318G24.7Very low30.5Very low67 Ų67109.2 Ų109.269%0.69175%0.746SS**  trans-44.913615100000107.7D320G318-D320 PolarHBondContact O-N 2.95Å
319Y27.3Very low29.3Very low224 Ų224109.4 Ų109.488%0.87875%0.752SS**  trans-62.279.9166.5-79.4-99.4000108S317S317-Y319 PolarHBondContact O-N 3.17Å
320D27.1Very low28.4Very low161 Ų161111 Ų11186%0.86176%0.758SS**  trans-82.4118.1153.6-86.2-20.4000107.3G318G318-D320 PolarHBondContact O-N 2.95Å
321S25.4Very low28Very low107 Ų107115.1 Ų115.175%0.74878%0.776SS**  trans-57.9155.3176.6-1580000112
322L26.2Very low27.9Very low164 Ų164118.9 Ų118.986%0.85978%0.776SS**SBendtrans87.5104.8173.2-77.980000119
323G22.5Very low28.4Very low88 Ų88117.5 Ų117.591%0.90776%0.759SS**  64.691.8126.100000118.8
324G24.7Very low29Very low81 Ų81123.7 Ų123.784%0.83577%0.772SS**  trans-145.7102.3166.100000111.8
325V25.2Very low29.2Very low153 Ų153128 Ų12893%0.92778%0.78SS**  trans-64.7132.7171.7169.50000110.2
326G23.6Very low29.9Very low65 Ų65133 Ų13367%0.6778%0.778SS**  trans52.683.2151.100000117.8E328G326-E328 PolarHBondContact O-N 3.27Å
327G27.3Very low31.2Very low85 Ų85127.3 Ų127.388%0.87676%0.758SS**  trans-73.3102.416100000110.5V329G327-V329 PolarHBondContact O-N 3.26Å
328E25.6Very low32.8Very low187 Ų187130.6 Ų130.687%0.87476%0.762SS**  trans-55.8129.1168.7-68.7177.2115.200110.4G326 S330G326-E328 PolarHBondContact O-N 3.27Å; E328-S330 PolarHBondContact O-N 3.2Å
329V35.5Very low34.9Very low136 Ų136133.7 Ų133.782%0.82476%0.762SS**  trans-57.9110.9168.8175.20000107.6G327 L331G327-V329 PolarHBondContact O-N 3.26Å; V329-L331 PolarHBondContact O-N 3.45Å
330S31.2Very low36.8Very low68 Ų68124.7 Ų124.748%0.47673%0.731SS.*  trans-57.4125.1-177.671.60000110.2E328 E332 S333E328-S330 PolarHBondContact O-N 3.2Å; S330-E332 PolarHBondContact O-N 2.92Å; S330-S333 PolarHBondContact O-N 3.42Å
331L34Very low39Very low156 Ų156119.7 Ų119.782%0.81771%0.708SS**Hα-helixtrans-52.9-18.1173.5-157.184.9000112.3V329V329-L331 PolarHBondContact O-N 3.45Å
332E32.5Very low41.4Very low146 Ų146118.2 Ų118.268%0.68270%0.698SS**Hα-helixtrans-73.7-30179.3-146.7173.117600113.4S330 K334 K335S330-E332 PolarHBondContact O-N 2.92Å; E332-K334 VanDerWaalsContact C-N 3.28Å; E332-K334 PolarHBondContact O-N 3.07Å; E332-K335 PolarHBondContact O-N 3.3Å
333S40.7Very low43.5Very low78 Ų78115 Ų11555%0.54568%0.682SS.*Hα-helixtrans-66.2-31.9174.6-159.30000111.8S330 K335 R336 G337S330-S333 PolarHBondContact O-N 3.42Å; S333-K335 PolarHBondContact O-N 3.39Å; S333-R336 PolarHBondContact O-N 3Å; S333-G337 PolarHBondContact O-N 3.26Å
334K36.5Very low46Very low182 Ų182110.8 Ų110.879%0.79164%0.639SS**Hα-helixtrans-73.4-26.7-177.8-154.1170.5-173.4174.30113.8E332E332-K334 VanDerWaalsContact C-N 3.28Å; E332-K334 PolarHBondContact O-N 3.07Å
335K38.8Very low48.5Very low191 Ų191111.6 Ų111.683%0.8362%0.623SS**Hα-helixtrans-80.8-27.7173.4-87.3-176.3177.3178.70113E332 S333E332-K335 PolarHBondContact O-N 3.3Å; S333-K335 PolarHBondContact O-N 3.39Å
336R48.4Very low50.9Low202 Ų202112.4 Ų112.476%0.76261%0.61SS**Hα-helixtrans-72.8-26.3171.2-87.4-176.1-176.4167.54113.3S333 F338 L339S333-R336 PolarHBondContact O-N 3Å; R336-F338 PolarHBondContact O-N 3.47Å; R336-L339 PolarHBondContact O-N 2.96Å
337G53.1Low53.3Low44 Ų44109.7 Ų109.745%0.45458%0.581SS.*THydrogen-bonded Turntrans-65.7-9.1-169.600000117.9S333S333-G337 PolarHBondContact O-N 3.26Å
338F59.4Low55.6Low158 Ų158108.1 Ų108.169%0.69355%0.552SS**THydrogen-bonded Turntrans-104.7-14.6-178.4-164.6-97.1000114.6Y57 R336Y57-F338 WeakPolarHBondContact OH-CD2 3.17Å; Y57-F338 PolarHBondContact OH-O 3.34Å; R336-F338 PolarHBondContact O-N 3.47Å
339L67.6Low58.2Low131 Ų131108.6 Ų108.669%0.68655%0.546SS*.SBendtrans-114131.8179.3-70.9174.1000109.7R336 S341R336-L339 PolarHBondContact O-N 2.96Å; L339-S341 PolarHBondContact O-N 3.13Å
340P67.1Low60.2Low35 Ų35105.2 Ų105.223%0.22752%0.523CS..  trans-53.3130.5170.2-20.830.7000109.7Y57 L60 S344 L345Y57-P340 HydrophobicContact CE2-CG 4.45Å; L60-P340 HydrophobicContact CB-CB 4.45Å; P340-S344 WeakPolarHBondContact CA-OG 3.46Å; P340-S344 WeakPolarHBondContact CB-OG 3.17Å; P340-L345 HydrophobicContact CB-CD2 4.16Å; P340-L345 HydrophobicContact CB-CG 4.37Å
341S73.8Confident62.3Low56 Ų56102 Ų10239%0.39250%0.5SS..  trans-62.816017762.20000111.2L339 D343 S344 L345L339-S341 PolarHBondContact O-N 3.13Å; S341-D343 PolarHBondContact O-N 3.03Å; S341-D343 VanDerWaalsContact O-N 3.13Å; S341-S344 PolarHBondContact N-OG 2.95Å; S341-S344 PolarHBondContact O-N 3.13Å; S341-S344 PolarHBondContact O-OG 3.33Å; S341-S344 PolarHBondContact OG-N 3.15Å; S341-L345 PolarHBondContact O-N 2.83Å
342S75.1Confident64.3Low77 Ų7799.6 Ų99.654%0.53848%0.484SS..Hα-helixtrans-54.1-33.9174.452.50000112.8L345 R346S342-L345 PolarHBondContact O-N 3.28Å; S342-R346 WeakPolarHBondContact O-CG 3.48Å; S342-R346 PolarHBondContact O-N 2.62Å
343D71.4Confident66.5Low96 Ų9695.5 Ų95.551%0.51347%0.466SS..Hα-helixtrans-70.1-38.8178.4-59.9-31.7000111.5S341 L345 R346 S347S341-D343 PolarHBondContact O-N 3.03Å; S341-D343 VanDerWaalsContact O-N 3.13Å; D343-L345 VanDerWaalsContact C-N 3.35Å; D343-L345 PolarHBondContact O-N 2.96Å; D343-R346 PolarHBondContact O-N 3.45Å; D343-S347 WeakPolarHBondContact O-CB 3.45Å; D343-S347 PolarHBondContact O-N 2.98Å
344S74.4Confident68.4Low0 Ų095.2 Ų95.20%046%0.462CS..Hα-helixtrans-65.6-35.6173.474.80000112.6L60 P340 S341 S347 L348L60-S344 VanDerWaalsContact O-CB 3.29Å; L60-S344 WeakPolarHBondContact O-CB 3.2Å; P340-S344 WeakPolarHBondContact CA-OG 3.46Å; P340-S344 WeakPolarHBondContact CB-OG 3.17Å; S341-S344 PolarHBondContact N-OG 2.95Å; S341-S344 PolarHBondContact O-N 3.13Å; S341-S344 PolarHBondContact O-OG 3.33Å; S341-S344 PolarHBondContact OG-N 3.15Å; S344-S347 WeakPolarHBondContact O-CB 3.3Å; S344-S347 PolarHBondContact O-N 2.9Å; S344-L348 WeakPolarHBondContact O-CB 3.21Å; S344-L348 PolarHBondContact O-N 3.15Å
345L77.7Confident70.6Confident98 Ų9893.3 Ų93.351%0.51345%0.454SS..Hα-helixtrans-71.6-39.7176.6-67.6178.1000112P340 S341 S342 D343 S347 L348 R349P340-L345 HydrophobicContact CB-CD2 4.16Å; P340-L345 HydrophobicContact CB-CG 4.37Å; S341-L345 PolarHBondContact O-N 2.83Å; S342-L345 PolarHBondContact O-N 3.28Å; D343-L345 VanDerWaalsContact C-N 3.35Å; D343-L345 PolarHBondContact O-N 2.96Å; L345-S347 VanDerWaalsContact C-N 3.32Å; L345-L348 PolarHBondContact O-N 3.27Å; L345-R349 PolarHBondContact O-N 3.49Å
346R75.9Confident72.7Confident170 Ų17086 Ų8664%0.64242%0.424SS*.Hα-helixtrans-60.4-45.5170.4-75.2174.5175.9-175.1-1.2110.4S342 D343 L348 R349 D350S342-R346 WeakPolarHBondContact O-CG 3.48Å; S342-R346 PolarHBondContact O-N 2.62Å; D343-R346 PolarHBondContact O-N 3.45Å; R346-L348 PolarHBondContact O-N 3.13Å; R346-R349 WeakPolarHBondContact O-CB 3.32Å; R346-R349 PolarHBondContact O-N 3.46Å; R346-D350 WeakPolarHBondContact O-CB 3.43Å; R346-D350 VanDerWaalsContact O-CG 3.28Å; R346-D350 PolarHBondContact O-N 3.49Å
347S73.1Confident74.2Confident8 Ų878.4 Ų78.46%0.05640%0.398CS..Hα-helixtrans-60.6-43.5175.1179.30000112.7Y63 D343 S344 L345 R349 D350 T351Y63-S347 VanDerWaalsContact CZ-CB 3.42Å; Y63-S347 VanDerWaalsContact OH-CB 3.27Å; Y63-S347 WeakPolarHBondContact OH-CB 3Å; Y63-S347 PolarHBondContact OH-OG 3.43Å; D343-S347 WeakPolarHBondContact O-CB 3.45Å; D343-S347 PolarHBondContact O-N 2.98Å; S344-S347 WeakPolarHBondContact O-CB 3.3Å; S344-S347 PolarHBondContact O-N 2.9Å; L345-S347 VanDerWaalsContact C-N 3.32Å; S347-R349 VanDerWaalsContact C-N 3.31Å; S347-R349 PolarHBondContact O-N 2.81Å; S347-D350 CarbonylContact O-C 3.41Å; S347-D350 WeakPolarHBondContact O-CA 3.24Å; S347-D350 WeakPolarHBondContact O-CB 3.31Å; S347-D350 PolarHBondContact O-N 3.3Å; S347-T351 WeakPolarHBondContact O-CB 3.33Å; S347-T351 PolarHBondContact O-N 2.95Å; S347-T351 PolarHBondContact O-OG1 2.89Å; S347-T351 VanDerWaalsContact O-OG1 3.06Å
348L76.6Confident75.7Confident51 Ų5182.8 Ų82.827%0.26741%0.405SS..Hα-helixtrans-59.1-44175.2-171.5165.9000110.9L60 S344 L345 R346 D350 T351 F352L60-L348 HydrophobicContact CD1-CD1 3.79Å; L60-L348 HydrophobicContact CD2-CB 4.44Å; S344-L348 WeakPolarHBondContact O-CB 3.21Å; S344-L348 PolarHBondContact O-N 3.15Å; L345-L348 PolarHBondContact O-N 3.27Å; R346-L348 PolarHBondContact O-N 3.13Å; L348-D350 VanDerWaalsContact C-N 3.3Å; L348-D350 PolarHBondContact O-N 3.14Å; L348-T351 VanDerWaalsContact O-CB 3.29Å; L348-T351 WeakPolarHBondContact O-CB 3.46Å; L348-T351 PolarHBondContact O-N 3.42Å; L348-F352 HydrophobicContact CD2-CD2 3.96Å; L348-F352 HydrophobicContact CD2-CE2 3.71Å; L348-F352 WeakPolarHBondContact O-CD2 3.4Å; L348-F352 PolarHBondContact O-N 3.31Å
349R79Confident76.8Confident198 Ų19878.5 Ų78.575%0.74739%0.394SS*.Hα-helixtrans-60.1-43.1173.1178.5-178177.3165.30.9111.4L345 R346 S347 T351 F352L345-R349 PolarHBondContact O-N 3.49Å; R346-R349 WeakPolarHBondContact O-CB 3.32Å; R346-R349 PolarHBondContact O-N 3.46Å; S347-R349 VanDerWaalsContact C-N 3.31Å; S347-R349 PolarHBondContact O-N 2.81Å; R349-T351 VanDerWaalsContact C-N 3.32Å; R349-T351 PolarHBondContact O-N 3.2Å; R349-F352 PolarHBondContact O-N 2.89Å
350D77.7Confident77.6Confident65 Ų6574.1 Ų74.135%0.34837%0.372SS..Hα-helixtrans-69.7-28.8178.8-70.3-24.5000112.2R70 R74 R346 S347 L348 F352 N353R70-D350 PolarHBondContact NE-O 3.01Å; R70-D350 PolarHBondContact NH2-O 3.28Å; R74-D350 PolarHBondContact NH2-O 2.96Å; R346-D350 WeakPolarHBondContact O-CB 3.43Å; R346-D350 VanDerWaalsContact O-CG 3.28Å; R346-D350 PolarHBondContact O-N 3.49Å; S347-D350 CarbonylContact O-C 3.41Å; S347-D350 WeakPolarHBondContact O-CA 3.24Å; S347-D350 WeakPolarHBondContact O-CB 3.31Å; S347-D350 PolarHBondContact O-N 3.3Å; L348-D350 VanDerWaalsContact C-N 3.3Å; L348-D350 PolarHBondContact O-N 3.14Å; D350-F352 VanDerWaalsContact C-N 3.27Å; D350-F352 PolarHBondContact O-N 3.27Å; D350-N353 WeakPolarHBondContact O-CB 3.46Å; D350-N353 PolarHBondContact O-N 3.46Å
351T76Confident78.3Confident1 Ų173.3 Ų73.31%0.00637%0.368CS..Hα-helixtrans-58-39.6172.9-71.40000110.3V73 R74 F77 S347 L348 R349 N353V73-T351 HydrophobicContact CB-CG2 4.4Å; V73-T351 HydrophobicContact CG1-CG2 3.82Å; R74-T351 HydrophobicContact CB-CG2 4.27Å; R74-T351 HydrophobicContact CG-CG2 3.37Å; R74-T351 WeakPolarHBondContact CG-O 3.31Å; R74-T351 PolarHBondContact NE-O 3.08Å; R74-T351 PolarHBondContact NH2-O 2.98Å; F77-T351 HydrophobicContact CD2-CG2 4Å; F77-T351 HydrophobicContact CE2-CG2 4.06Å; S347-T351 WeakPolarHBondContact O-CB 3.33Å; S347-T351 PolarHBondContact O-N 2.95Å; S347-T351 PolarHBondContact O-OG1 2.89Å; S347-T351 VanDerWaalsContact O-OG1 3.06Å; L348-T351 VanDerWaalsContact O-CB 3.29Å; L348-T351 WeakPolarHBondContact O-CB 3.46Å; L348-T351 PolarHBondContact O-N 3.42Å; R349-T351 VanDerWaalsContact C-N 3.32Å; R349-T351 PolarHBondContact O-N 3.2Å; T351-N353 VanDerWaalsContact C-N 3.33Å; T351-N353 PolarHBondContact O-N 3.25Å
352F74.7Confident78.8Confident105 Ų10575 Ų7546%0.46137%0.372SS..THydrogen-bonded Turntrans-82.9-4.6176.6-70.4-72.2000114.6F77 L348 R349 D350 P354F77-F352 AromaticContact CD1-CZ 3.96Å; F77-F352 HydrophobicContact CD1-CZ 3.96Å; F77-F352 HydrophobicContact CD2-CE1 4.36Å; F77-F352 HydrophobicContact CD2-CE2 4.42Å; F77-F352 AromaticContact CD2-CZ 3.85Å; F77-F352 HydrophobicContact CD2-CZ 3.85Å; F77-F352 HydrophobicContact CE1-CE2 4.39Å; F77-F352 AromaticContact CE1-CZ 3.71Å; F77-F352 HydrophobicContact CE1-CZ 3.71Å; F77-F352 HydrophobicContact CE2-CE1 4.49Å; F77-F352 AromaticContact CE2-CE2 3.79Å; F77-F352 HydrophobicContact CE2-CE2 3.79Å; F77-F352 AromaticContact CE2-CZ 3.58Å; F77-F352 HydrophobicContact CE2-CZ 3.58Å; F77-F352 HydrophobicContact CG-CE1 4.4Å; F77-F352 HydrophobicContact CG-CZ 4.04Å; F77-F352 AromaticContact CZ-CE2 3.78Å; F77-F352 HydrophobicContact CZ-CE2 3.78Å; F77-F352 AromaticContact CZ-CZ 3.51Å; F77-F352 HydrophobicContact CZ-CZ 3.51Å; L348-F352 HydrophobicContact CD2-CD2 3.96Å; L348-F352 HydrophobicContact CD2-CE2 3.71Å; L348-F352 WeakPolarHBondContact O-CD2 3.4Å; L348-F352 PolarHBondContact O-N 3.31Å; R349-F352 PolarHBondContact O-N 2.89Å; D350-F352 VanDerWaalsContact C-N 3.27Å; D350-F352 PolarHBondContact O-N 3.27Å; F352-P354 VanDerWaalsContact O-CD 3.31Å; F352-P354 WeakPolarHBondContact O-CD 3.08Å
353N79.6Confident79Confident60 Ų6074.5 Ų74.532%0.32136%0.36SS..  trans-84.5115.6-178.1-168.5-9.9000111.5R74 D350 T351 K355R74-N353 PolarHBondContact NH2-O 3.45Å; D350-N353 WeakPolarHBondContact O-CB 3.46Å; D350-N353 PolarHBondContact O-N 3.46Å; T351-N353 VanDerWaalsContact C-N 3.33Å; T351-N353 PolarHBondContact O-N 3.25Å; N353-K355 PolarHBondContact O-N 3.33Å; N353-K355 VanDerWaalsContact O-N 3.16Å; N353-K355 WeakPolarHBondContact OD1-CB 3.45Å; N353-K355 PolarHBondContact OD1-N 2.94Å; N353-K355 VanDerWaalsContact OD1-N 3.09Å
354P80.5Confident79.4Confident71 Ų7170 Ų7046%0.46134%0.337SS..THydrogen-bonded Turntrans-74.61.8178.932.7-37000113.5F352 D356 M357 F358F352-P354 VanDerWaalsContact O-CD 3.31Å; F352-P354 WeakPolarHBondContact O-CD 3.08Å; P354-D356 VanDerWaalsContact C-N 3.26Å; P354-D356 PolarHBondContact O-N 3.39Å; P354-M357 WeakPolarHBondContact O-CB 3.49Å; P354-M357 PolarHBondContact O-N 2.94Å; P354-M357 VanDerWaalsContact O-N 3.13Å; P354-F358 PolarHBondContact O-N 2.77Å; P354-F358 VanDerWaalsContact O-N 3.1Å
355K82.9Confident79.8Confident142 Ų14275.5 Ų75.562%0.61736%0.36SS*.Hα-helixtrans-55.8-36.3-177.4-174.9179.2179.3-173.80113.4N353 F358 S359N353-K355 PolarHBondContact O-N 3.33Å; N353-K355 VanDerWaalsContact O-N 3.16Å; N353-K355 WeakPolarHBondContact OD1-CB 3.45Å; N353-K355 PolarHBondContact OD1-N 2.94Å; N353-K355 VanDerWaalsContact OD1-N 3.09Å; K355-F358 PolarHBondContact O-N 2.75Å; K355-S359 VanDerWaalsContact O-CB 3.29Å; K355-S359 WeakPolarHBondContact O-CB 3.47Å; K355-S359 PolarHBondContact O-N 2.93Å
356D82.4Confident79.7Confident38 Ų3875 Ų7520%0.20336%0.356CS..Hα-helixtrans-64.4-45.6178.7-44.1-42000110.6R70 W71 R74 P354 F358 S359 D360R70-D356 IonicContact CZ-OD1 3.62Å; R70-D356 IonicContact CZ-OD2 2.95Å; R70-D356 IonicContact NE-OD2 3.82Å; R70-D356 IonicContact NH1-OD1 3.71Å; R70-D356 PolarHBondContact NH1-OD1 2.97Å; R70-D356 VanDerWaalsContact NH1-OD1 3.17Å; R70-D356 IonicContact NH1-OD2 3.17Å; R70-D356 PolarHBondContact NH1-OD2 3.41Å; R70-D356 VanDerWaalsContact NH2-CG 3.33Å; R70-D356 IonicContact NH2-OD1 3.17Å; R70-D356 PolarHBondContact NH2-OD1 3.12Å; R70-D356 IonicContact NH2-OD2 2.71Å; R70-D356 PolarHBondContact NH2-OD2 3.27Å; W71-D356 HydrophobicContact CH2-CB 4.12Å; R74-D356 IonicContact CZ-OD2 2.91Å; R74-D356 VanDerWaalsContact CZ-OD2 3.25Å; R74-D356 IonicContact NH1-OD2 2.77Å; R74-D356 PolarHBondContact NH1-OD2 3.25Å; R74-D356 IonicContact NH2-OD2 2.89Å; R74-D356 PolarHBondContact NH2-OD2 3.5Å; P354-D356 VanDerWaalsContact C-N 3.26Å; P354-D356 PolarHBondContact O-N 3.39Å; D356-F358 VanDerWaalsContact C-N 3.32Å; D356-F358 PolarHBondContact O-N 2.85Å; D356-S359 WeakPolarHBondContact O-CB 3.42Å; D356-S359 PolarHBondContact O-N 3.09Å; D356-D360 WeakPolarHBondContact O-CB 3.4Å; D356-D360 PolarHBondContact O-N 3.3Å
357M80.5Confident79.3Confident43 Ų4372.2 Ų72.221%0.21236%0.359CS..Hα-helixtrans-60.2-42.4177.6-175.5-172.775.600111.6F112 Y115 L169 C172 P354 D360 A361F112-M357 HydrophobicContact CD2-SD 4.43Å; Y115-M357 HydrophobicContact CD1-CB 4.01Å; Y115-M357 HydrophobicContact CD1-CG 3.99Å; Y115-M357 HydrophobicContact CE1-CB 3.6Å; Y115-M357 HydrophobicContact CE1-CG 3.99Å; Y115-M357 HydrophobicContact CG-CG 4.29Å; L169-M357 HydrophobicContact CD2-CG 3.98Å; C172-M357 HydrophobicContact CB-CG 4.42Å; C172-M357 HydrophobicContact CB-SD 3.58Å; C172-M357 VanDerWaalsContact CB-SD 3.58Å; P354-M357 WeakPolarHBondContact O-CB 3.49Å; P354-M357 PolarHBondContact O-N 2.94Å; P354-M357 VanDerWaalsContact O-N 3.13Å; M357-D360 PolarHBondContact O-N 3.2Å; M357-A361 WeakPolarHBondContact O-CB 3.28Å; M357-A361 PolarHBondContact O-N 2.96Å
358F84.4Confident78.8Confident135 Ų13575.3 Ų75.359%0.59238%0.375SS*.Hα-helixtrans-68.1-41.8176.9-176.3-104.5000112.4P354 K355 D356 D360 A361 I362P354-F358 PolarHBondContact O-N 2.77Å; P354-F358 VanDerWaalsContact O-N 3.1Å; K355-F358 PolarHBondContact O-N 2.75Å; D356-F358 VanDerWaalsContact C-N 3.32Å; D356-F358 PolarHBondContact O-N 2.85Å; F358-D360 VanDerWaalsContact C-N 3.31Å; F358-D360 PolarHBondContact O-N 2.93Å; F358-A361 PolarHBondContact O-N 3.36Å; F358-I362 HydrophobicContact CD1-CD1 3.78Å; F358-I362 HydrophobicContact CD1-CG1 4.49Å; F358-I362 HydrophobicContact CE1-CD1 3.19Å; F358-I362 HydrophobicContact CE1-CG1 4.15Å; F358-I362 HydrophobicContact CE2-CD1 4.32Å; F358-I362 HydrophobicContact CZ-CD1 3.51Å; F358-I362 HydrophobicContact CZ-CG1 4.18Å; F358-I362 WeakPolarHBondContact O-CG1 3.49Å; F358-I362 PolarHBondContact O-N 2.88Å
359S83.5Confident77.8Confident68 Ų6873 Ų7348%0.47636%0.363SS..Hα-helixtrans-60.1-43.9174.9-172.90000110.9K355 D356 I362 H363K355-S359 VanDerWaalsContact O-CB 3.29Å; K355-S359 WeakPolarHBondContact O-CB 3.47Å; K355-S359 PolarHBondContact O-N 2.93Å; D356-S359 WeakPolarHBondContact O-CB 3.42Å; D356-S359 PolarHBondContact O-N 3.09Å; S359-I362 PolarHBondContact O-N 3.23Å; S359-H363 VanDerWaalsContact O-CB 3.23Å; S359-H363 WeakPolarHBondContact O-CB 3.45Å; S359-H363 PolarHBondContact O-N 2.93Å
360D82.5Confident76.6Confident40 Ų4068.4 Ų68.421%0.21435%0.35CS..Hα-helixtrans-67.2-38.2176.2-84.92.1000112.4Y115 L169 D356 M357 F358 H363 N364Y115-D360 HydrophobicContact CE2-CB 4.33Å; Y115-D360 VanDerWaalsContact OH-CG 3.29Å; Y115-D360 PolarHBondContact OH-OD2 3.07Å; L169-D360 HydrophobicContact CD1-CB 4.35Å; L169-D360 HydrophobicContact CD2-CB 4.4Å; D356-D360 WeakPolarHBondContact O-CB 3.4Å; D356-D360 PolarHBondContact O-N 3.3Å; M357-D360 PolarHBondContact O-N 3.2Å; F358-D360 VanDerWaalsContact C-N 3.31Å; F358-D360 PolarHBondContact O-N 2.93Å; D360-H363 PolarHBondContact O-N 3.07Å; D360-N364 WeakPolarHBondContact O-CB 3.49Å; D360-N364 PolarHBondContact O-N 3.07Å; D360-N364 PolarHBondContact O-ND2 3.29Å
361A83.2Confident75.5Confident17 Ų1771.2 Ų71.214%0.1436%0.359CS..Hα-helixtrans-59.8-52.5173.200000110.7L169 M357 F358 H363 N364 F365L169-A361 HydrophobicContact CD2-CB 4.33Å; M357-A361 WeakPolarHBondContact O-CB 3.28Å; M357-A361 PolarHBondContact O-N 2.96Å; F358-A361 PolarHBondContact O-N 3.36Å; A361-H363 VanDerWaalsContact C-N 3.3Å; A361-H363 PolarHBondContact O-N 3.45Å; A361-N364 PolarHBondContact O-N 3.21Å; A361-F365 HydrophobicContact CB-CD2 4.38Å; A361-F365 WeakPolarHBondContact O-CB 3.35Å; A361-F365 WeakPolarHBondContact O-CD2 3.44Å; A361-F365 PolarHBondContact O-N 3.28Å
362I83.6Confident74.2Confident93 Ų9377.6 Ų77.648%0.47738%0.384SS..Hα-helixtrans-57-48.1175.9-69.3176.7000110F358 S359 N364 H366F358-I362 HydrophobicContact CD1-CD1 3.78Å; F358-I362 HydrophobicContact CD1-CG1 4.49Å; F358-I362 HydrophobicContact CE1-CD1 3.19Å; F358-I362 HydrophobicContact CE1-CG1 4.15Å; F358-I362 HydrophobicContact CE2-CD1 4.32Å; F358-I362 HydrophobicContact CZ-CD1 3.51Å; F358-I362 HydrophobicContact CZ-CG1 4.18Å; F358-I362 WeakPolarHBondContact O-CG1 3.49Å; F358-I362 PolarHBondContact O-N 2.88Å; S359-I362 PolarHBondContact O-N 3.23Å; I362-N364 PolarHBondContact O-N 3.36Å; I362-H366 WeakPolarHBondContact O-CB 3.49Å; I362-H366 PolarHBondContact O-N 2.92Å
363H79.9Confident73.2Confident65 Ų6573.4 Ų73.430%0.30137%0.367SS..Hα-helixtrans-59.8-50.5-178-179.2-112.1000112.4S359 D360 A361 H366 Y369S359-H363 VanDerWaalsContact O-CB 3.23Å; S359-H363 WeakPolarHBondContact O-CB 3.45Å; S359-H363 PolarHBondContact O-N 2.93Å; D360-H363 PolarHBondContact O-N 3.07Å; A361-H363 VanDerWaalsContact C-N 3.3Å; A361-H363 PolarHBondContact O-N 3.45Å; H363-H366 PolarHBondContact O-N 2.99Å; H363-Y369 AromaticContact CE1-CD2 3.69Å; H363-Y369 AromaticContact CE1-CE2 3.02Å; H363-Y369 WeakPolarHBondContact CE1-CE2 3.48Å; H363-Y369 AromaticContact CE1-CZ 3.56Å; H363-Y369 AromaticContact ND1-CD2 3.97Å; H363-Y369 AromaticContact ND1-CE2 3.26Å; H363-Y369 VanDerWaalsContact ND1-CE2 3.26Å; H363-Y369 WeakPolarHBondContact ND1-CE2 3.39Å; H363-Y369 AromaticContact NE2-CD2 3.94Å; H363-Y369 AromaticContact NE2-CE2 3.72Å; H363-Y369 WeakPolarHBondContact O-CD2 3.43Å
364N79.2Confident71.8Confident3 Ų375.5 Ų75.52%0.01638%0.375CS..Hα-helixtrans-76.9-25.6-174.6-75.4-90.1000113.8Q166 L169 D360 A361 I362Q166-N364 HydrophobicContact CG-CB 4.11Å; Q166-N364 PolarHBondContact NE2-O 2.94Å; L169-N364 HydrophobicContact CD1-CB 4.08Å; D360-N364 WeakPolarHBondContact O-CB 3.49Å; D360-N364 PolarHBondContact O-N 3.07Å; D360-N364 PolarHBondContact O-ND2 3.29Å; A361-N364 PolarHBondContact O-N 3.21Å; I362-N364 PolarHBondContact O-N 3.36Å
365F82.7Confident70.4Confident114 Ų11478 Ų7850%0.538%0.381SS..Hα-helixtrans-91.4-9.2175.3-70.5-68.8000113.2Q166 L169 A361Q166-F365 HydrophobicContact CB-CE1 4.42Å; Q166-F365 HydrophobicContact CB-CZ 4.39Å; Q166-F365 HydrophobicContact CG-CE1 4.19Å; Q166-F365 HydrophobicContact CG-CZ 4.4Å; L169-F365 HydrophobicContact CB-CE2 4.18Å; A361-F365 HydrophobicContact CB-CD2 4.38Å; A361-F365 WeakPolarHBondContact O-CB 3.35Å; A361-F365 WeakPolarHBondContact O-CD2 3.44Å; A361-F365 PolarHBondContact O-N 3.28Å
366H76.8Confident68.7Low89 Ų8978 Ų7841%0.41238%0.377SS..SBendtrans-79.6136.5179.6-168-86.3000112.5I362 H363 N368I362-H366 WeakPolarHBondContact O-CB 3.49Å; I362-H366 PolarHBondContact O-N 2.92Å; H363-H366 PolarHBondContact O-N 2.99Å; H366-N368 VanDerWaalsContact C-N 3.3Å; H366-N368 PolarHBondContact CE1-ND2 3.17Å; H366-N368 PolarHBondContact ND1-N 3.13Å; H366-N368 VanDerWaalsContact ND1-N 3.2Å; H366-N368 PolarHBondContact O-N 3.43Å
367P67.5Low66.8Low111 Ų11178.5 Ų78.572%0.72138%0.379SS*.THydrogen-bonded Turntrans-63.9-25.4-174.820.3-31.8000115.2Y369P367-Y369 VanDerWaalsContact C-N 3.27Å; P367-Y369 PolarHBondContact O-N 3.35Å
368N61.1Low65.1Low72 Ų7281 Ų8139%0.38539%0.393SS..THydrogen-bonded Turntrans-80.411.7-176-69.6-20.9000115.9H366 Q370 K371H366-N368 VanDerWaalsContact C-N 3.3Å; H366-N368 PolarHBondContact CE1-ND2 3.17Å; H366-N368 PolarHBondContact ND1-N 3.13Å; H366-N368 VanDerWaalsContact ND1-N 3.2Å; H366-N368 PolarHBondContact O-N 3.43Å; N368-Q370 VanDerWaalsContact C-N 3.32Å; N368-Q370 PolarHBondContact O-N 3.36Å; N368-K371 PolarHBondContact O-N 3.15Å
369Y55.3Low63.2Low4 Ų481.6 Ų81.62%0.01640%0.395CS..Hα-helixtrans-51.2-44.4-175-163.5-88.4000114.8E128 I158 H363 P367 K371 Y372 T373E128-Y369 WeakPolarHBondContact OE1-CE1 3.38Å; E128-Y369 PolarHBondContact OE1-OH 2.92Å; E128-Y369 PolarHBondContact OE2-OH 3.29Å; I158-Y369 HydrophobicContact CG2-CD1 4.16Å; I158-Y369 HydrophobicContact CG2-CE1 3.65Å; H363-Y369 AromaticContact CE1-CD2 3.69Å; H363-Y369 AromaticContact CE1-CE2 3.02Å; H363-Y369 WeakPolarHBondContact CE1-CE2 3.48Å; H363-Y369 AromaticContact CE1-CZ 3.56Å; H363-Y369 AromaticContact ND1-CD2 3.97Å; H363-Y369 AromaticContact ND1-CE2 3.26Å; H363-Y369 VanDerWaalsContact ND1-CE2 3.26Å; H363-Y369 WeakPolarHBondContact ND1-CE2 3.39Å; H363-Y369 AromaticContact NE2-CD2 3.94Å; H363-Y369 AromaticContact NE2-CE2 3.72Å; H363-Y369 WeakPolarHBondContact O-CD2 3.43Å; P367-Y369 VanDerWaalsContact C-N 3.27Å; P367-Y369 PolarHBondContact O-N 3.35Å; Y369-K371 PolarHBondContact O-N 3.01Å; Y369-K371 VanDerWaalsContact O-N 3.12Å; Y369-Y372 PolarHBondContact O-N 3.47Å; Y369-Y372 VanDerWaalsContact O-N 3.15Å; Y369-T373 HydrophobicContact CE1-CG2 3.98Å
370Q54.8Low61.6Low101 Ų10181.9 Ų81.947%0.47239%0.392SS..Hα-helixtrans-59.2-28.9-174.7-69.7177.1-17.900112.8N368 Y372 T373 Q374N368-Q370 VanDerWaalsContact C-N 3.32Å; N368-Q370 PolarHBondContact O-N 3.36Å; Q370-Y372 VanDerWaalsContact C-N 3.33Å; Q370-Y372 PolarHBondContact O-N 3.01Å; Q370-T373 PolarHBondContact O-OG1 2.74Å; Q370-Q374 VanDerWaalsContact O-CB 3.29Å; Q370-Q374 WeakPolarHBondContact O-CB 3.2Å; Q370-Q374 WeakPolarHBondContact O-CG 3.34Å; Q370-Q374 PolarHBondContact O-N 3Å
371K53.8Low59.8Low123 Ų12384.7 Ų84.754%0.53541%0.407SS..Hα-helixtrans-67.7-33-178.6-66.3-176.2177.21790112.3N368 Y369 Q375N368-K371 PolarHBondContact O-N 3.15Å; Y369-K371 PolarHBondContact O-N 3.01Å; Y369-K371 VanDerWaalsContact O-N 3.12Å; K371-Q375 VanDerWaalsContact O-CB 3.25Å; K371-Q375 WeakPolarHBondContact O-CB 3.35Å; K371-Q375 WeakPolarHBondContact O-CG 3.25Å; K371-Q375 PolarHBondContact O-N 3.4Å
372Y49.7Very low58.1Low135 Ų13589.7 Ų89.753%0.52943%0.425SS..Hα-helixtrans-79-40-174.7-64.6-72.6000113Y369 Q370 R376Y369-Y372 PolarHBondContact O-N 3.47Å; Y369-Y372 VanDerWaalsContact O-N 3.15Å; Q370-Y372 VanDerWaalsContact C-N 3.33Å; Q370-Y372 PolarHBondContact O-N 3.01Å; Y372-R376 PolarHBondContact O-N 3.23Å
373T53.4Low56.4Low17 Ų1788.7 Ų88.710%0.10442%0.421CS..Hα-helixtrans-72.1-37.7175.5510000111.6I158 Y369 Q370 R376 N377I158-T373 HydrophobicContact CD1-CG2 4.41Å; I158-T373 HydrophobicContact CG2-CG2 4.29Å; Y369-T373 HydrophobicContact CE1-CG2 3.98Å; Q370-T373 PolarHBondContact O-OG1 2.74Å; T373-R376 PolarHBondContact O-N 3.07Å; T373-N377 WeakPolarHBondContact O-CB 3.37Å; T373-N377 VanDerWaalsContact O-CG 3.31Å; T373-N377 PolarHBondContact O-N 3.1Å
374Q51.2Low54.5Low105 Ų10590.9 Ų90.949%0.49144%0.435SS..Hα-helixtrans-66.2-39.7173-71.3174.91.600112Q370 R376 N377 L378Q370-Q374 VanDerWaalsContact O-CB 3.29Å; Q370-Q374 WeakPolarHBondContact O-CB 3.2Å; Q370-Q374 WeakPolarHBondContact O-CG 3.34Å; Q370-Q374 PolarHBondContact O-N 3Å; Q374-R376 VanDerWaalsContact C-N 3.3Å; Q374-R376 PolarHBondContact O-N 3.24Å; Q374-N377 PolarHBondContact O-N 3.44Å; Q374-L378 HydrophobicContact CB-CD1 4.44Å; Q374-L378 WeakPolarHBondContact O-CB 3.31Å; Q374-L378 WeakPolarHBondContact O-CD1 3.47Å; Q374-L378 PolarHBondContact O-N 2.87Å
375Q49.4Very low52.5Low124 Ų12497 Ų9758%0.57946%0.464SS*.Hα-helixtrans-63.4-33.4176.4-82.8172.2-5.300113.4K371 K379K371-Q375 VanDerWaalsContact O-CB 3.25Å; K371-Q375 WeakPolarHBondContact O-CB 3.35Å; K371-Q375 WeakPolarHBondContact O-CG 3.25Å; K371-Q375 PolarHBondContact O-N 3.4Å; Q375-K379 PolarHBondContact O-N 3.07Å
376R47.7Very low50.4Low141 Ų14195.7 Ų95.753%0.53247%0.465SS..Hα-helixtrans-75.2-43.4174.2-166.7172.5176.9176.63.7111.7S129 Y372 T373 Q374 L378 K379 D380S129-R376 WeakPolarHBondContact OG-CD 3.43Å; S129-R376 PolarHBondContact OG-NH1 3.36Å; Y372-R376 PolarHBondContact O-N 3.23Å; T373-R376 PolarHBondContact O-N 3.07Å; Q374-R376 VanDerWaalsContact C-N 3.3Å; Q374-R376 PolarHBondContact O-N 3.24Å; R376-L378 VanDerWaalsContact C-N 3.33Å; R376-L378 PolarHBondContact O-N 3.25Å; R376-K379 WeakPolarHBondContact O-CB 3.36Å; R376-K379 PolarHBondContact O-N 2.87Å; R376-K379 VanDerWaalsContact O-N 3.11Å; R376-D380 PolarHBondContact O-N 2.87Å
377N42.9Very low48.6Very low48 Ų4897.9 Ų97.926%0.25748%0.478SS..Hα-helixtrans-61.7-38.3173.4-72-12.6000112.5T373 Q374 K379 D380 D381T373-N377 WeakPolarHBondContact O-CB 3.37Å; T373-N377 VanDerWaalsContact O-CG 3.31Å; T373-N377 PolarHBondContact O-N 3.1Å; Q374-N377 PolarHBondContact O-N 3.44Å; N377-K379 VanDerWaalsContact C-N 3.32Å; N377-K379 PolarHBondContact O-N 3.42Å; N377-D380 PolarHBondContact O-N 3.46Å; N377-D381 WeakPolarHBondContact O-CB 3.1Å; N377-D381 PolarHBondContact O-N 3.48Å
378L45.5Very low47.1Very low95 Ų9599.9 Ų99.950%0.49748%0.483SS..Hα-helixtrans-63-40.9173.9-97.888.3000110.4Q374 R376 D381 F382Q374-L378 HydrophobicContact CB-CD1 4.44Å; Q374-L378 WeakPolarHBondContact O-CB 3.31Å; Q374-L378 WeakPolarHBondContact O-CD1 3.47Å; Q374-L378 PolarHBondContact O-N 2.87Å; R376-L378 VanDerWaalsContact C-N 3.33Å; R376-L378 PolarHBondContact O-N 3.25Å; L378-D381 PolarHBondContact O-N 2.87Å; L378-F382 HydrophobicContact CB-CD2 4.34Å; L378-F382 HydrophobicContact CB-CE2 4.35Å; L378-F382 HydrophobicContact CD2-CE2 4.05Å; L378-F382 HydrophobicContact CG-CE2 4.49Å; L378-F382 WeakPolarHBondContact O-CB 3.21Å; L378-F382 WeakPolarHBondContact O-CD2 3.26Å; L378-F382 WeakPolarHBondContact O-CG 3.46Å; L378-F382 PolarHBondContact O-N 2.77Å
379K44.7Very low45.9Very low148 Ų14899.4 Ų99.464%0.64349%0.485SS*.Hα-helixtrans-62.1-43.2173.8-92.7-175.6171.8-175.80112.2Q375 R376 N377 F382 D383Q375-K379 PolarHBondContact O-N 3.07Å; R376-K379 WeakPolarHBondContact O-CB 3.36Å; R376-K379 PolarHBondContact O-N 2.87Å; R376-K379 VanDerWaalsContact O-N 3.11Å; N377-K379 VanDerWaalsContact C-N 3.32Å; N377-K379 PolarHBondContact O-N 3.42Å; K379-F382 PolarHBondContact O-N 2.84Å; K379-D383 WeakPolarHBondContact O-CB 3.36Å; K379-D383 VanDerWaalsContact O-CG 3.25Å; K379-D383 PolarHBondContact O-N 3.43Å
380D47.8Very low44.7Very low75 Ų75109.3 Ų109.340%0.40152%0.524SS..Hα-helixtrans-69.6-35.1178.9-64.2-30.7000112.1R376 N377 N384R376-D380 PolarHBondContact O-N 2.87Å; N377-D380 PolarHBondContact O-N 3.46Å; D380-N384 WeakPolarHBondContact O-CB 3.4Å; D380-N384 PolarHBondContact O-N 2.84Å
381D45.7Very low43.5Very low99 Ų99114.5 Ų114.553%0.52955%0.548SS..Hα-helixtrans-69-40.6171.8-84.1-23.7000111.1N377 L378 N384 E385N377-D381 WeakPolarHBondContact O-CB 3.1Å; N377-D381 PolarHBondContact O-N 3.48Å; L378-D381 PolarHBondContact O-N 2.87Å; D381-N384 PolarHBondContact O-N 3.44Å; D381-E385 WeakPolarHBondContact O-CB 3.23Å; D381-E385 WeakPolarHBondContact O-CG 3.26Å; D381-E385 PolarHBondContact O-N 2.92Å
382F47.4Very low42.2Very low122 Ų122111.5 Ų111.554%0.53555%0.552SS.*Hα-helixtrans-64.6-41.6173.4-82.1-63.1000111.4L378 K379 E385 T386L378-F382 HydrophobicContact CB-CD2 4.34Å; L378-F382 HydrophobicContact CB-CE2 4.35Å; L378-F382 HydrophobicContact CD2-CE2 4.05Å; L378-F382 HydrophobicContact CG-CE2 4.49Å; L378-F382 WeakPolarHBondContact O-CB 3.21Å; L378-F382 WeakPolarHBondContact O-CD2 3.26Å; L378-F382 WeakPolarHBondContact O-CG 3.46Å; L378-F382 PolarHBondContact O-N 2.77Å; K379-F382 PolarHBondContact O-N 2.84Å; F382-E385 PolarHBondContact O-N 3.44Å; F382-T386 VanDerWaalsContact O-CB 3.25Å; F382-T386 WeakPolarHBondContact O-CB 3.33Å; F382-T386 PolarHBondContact O-N 2.96Å; F382-T386 PolarHBondContact O-OG1 3.46Å
383D47.4Very low41.1Very low72 Ų72113 Ų11339%0.38557%0.569SS.*Hα-helixtrans-67.5-36.2178.6-72.7-13.4000111.1K379 I387K379-D383 WeakPolarHBondContact O-CB 3.36Å; K379-D383 VanDerWaalsContact O-CG 3.25Å; K379-D383 PolarHBondContact O-N 3.43Å; D383-I387 WeakPolarHBondContact O-CD1 3.4Å; D383-I387 WeakPolarHBondContact O-CG1 3.28Å; D383-I387 PolarHBondContact O-N 3.29Å
384N40.4Very low39.8Very low110 Ų110118.5 Ų118.559%0.58860%0.603SS**Hα-helixtrans-71.4-40.3172.6-90.1-18.5000113.2D380 D381 I387 D388D380-N384 WeakPolarHBondContact O-CB 3.4Å; D380-N384 PolarHBondContact O-N 2.84Å; D381-N384 PolarHBondContact O-N 3.44Å; N384-I387 PolarHBondContact O-N 2.87Å; N384-D388 PolarHBondContact O-N 2.95Å
385E37.9Very low38.7Very low133 Ų133120.9 Ų120.962%0.62162%0.619SS**Hα-helixtrans-70.8-30.1177.2-77.1-172.1165.900112.8D381 F382 S389D381-E385 WeakPolarHBondContact O-CB 3.23Å; D381-E385 WeakPolarHBondContact O-CG 3.26Å; D381-E385 PolarHBondContact O-N 2.92Å; F382-E385 PolarHBondContact O-N 3.44Å; E385-S389 PolarHBondContact O-N 2.82Å; E385-S389 PolarHBondContact O-OG 2.85Å
386T38Very low37.7Very low86 Ų86122 Ų12253%0.52863%0.628SS.*Hα-helixtrans-78.7-20.2178.4-440000112F382F382-T386 VanDerWaalsContact O-CB 3.25Å; F382-T386 WeakPolarHBondContact O-CB 3.33Å; F382-T386 PolarHBondContact O-N 2.96Å; F382-T386 PolarHBondContact O-OG1 3.46Å
387I38.8Very low36.8Very low134 Ų134120.7 Ų120.769%0.68764%0.64SS**Hα-helixtrans-77.7-32172.8-69.3167.3000111.2D383 N384D383-I387 WeakPolarHBondContact O-CD1 3.4Å; D383-I387 WeakPolarHBondContact O-CG1 3.28Å; D383-I387 PolarHBondContact O-N 3.29Å; N384-I387 PolarHBondContact O-N 2.87Å
388D36.2Very low36.1Very low153 Ų153125 Ų12582%0.81866%0.664SS**Hα-helixtrans-83.6-11.2179-83.4-14.8000114N384N384-D388 PolarHBondContact O-N 2.95Å
389S35.1Very low35.2Very low62 Ų62128.5 Ų128.543%0.43468%0.681SS.*SBendtrans-135.7122.817463.60000111.4E385E385-S389 PolarHBondContact O-N 2.82Å; E385-S389 PolarHBondContact O-OG 2.85Å
390Y30.3Very low34.4Very low213 Ų213128.1 Ų128.184%0.83568%0.682SS**  trans100.476.9179.2-63.9-85.2000117G392Y390-G392 PolarHBondContact O-N 3.46Å; Y390-G392 VanDerWaalsContact O-N 3.14Å
391Q29.9Very low33.5Very low210 Ų210129.3 Ų129.398%0.98170%0.696SS**  trans-59.5100136.7-75.9179.1-23.900108.9
392G26.4Very low32.8Very low59 Ų59129.2 Ų129.261%0.60870%0.699SS**  trans178.6110.1173.700000112.2Y390 T394Y390-G392 PolarHBondContact O-N 3.46Å; Y390-G392 VanDerWaalsContact O-N 3.14Å; G392-T394 PolarHBondContact O-N 3.04Å
393N26.7Very low31.9Very low166 Ų166128.7 Ų128.789%0.88871%0.706SS**  trans-28.4130.2169-78-17.9000113.7
394T27Very low31Very low134 Ų134130 Ų13082%0.82272%0.718SS**  -175.3139.3117.5-55.50000109.1G392 L396G392-T394 PolarHBondContact O-N 3.04Å; T394-L396 PolarHBondContact O-N 3.49Å
395D27.3Very low30.7Very low155 Ų155127.6 Ų127.683%0.82971%0.713SS**  trans-47124.5174.7-59.2-65.2000114.3
396L29.5Very low30.6Very low146 Ų146123.1 Ų123.176%0.76470%0.696SS**  trans-143.2103.7151.4-152.380.8000110.5T394 N398T394-L396 PolarHBondContact O-N 3.49Å; L396-N398 PolarHBondContact O-N 3.39Å
397S28.5Very low30.4Very low114 Ų114122.8 Ų122.880%0.79770%0.695SS**  trans-52.9101.5160.352.30000110.4
398N27.2Very low30.4Very low140 Ų140121.8 Ų121.875%0.74969%0.69SS**  trans-138.1120.2157.5-105.1-28.4000109L396 Q400L396-N398 PolarHBondContact O-N 3.39Å; N398-Q400 PolarHBondContact O-N 3.08Å
399I26.4Very low30.4Very low168 Ų168116 Ų11686%0.86266%0.661SS**  trans-6098.2-172.9-63.7161.2000108.7S401I399-S401 VanDerWaalsContact C-N 3.32Å; I399-S401 PolarHBondContact O-N 3.44Å
400Q28.1Very low30.2Very low140 Ų140118.2 Ų118.265%0.65467%0.673SS**  trans-68.995.7163.7-123.4174-3.800106.4N398 T402N398-Q400 PolarHBondContact O-N 3.08Å; Q400-T402 HydrophobicContact CB-CG2 4.26Å; Q400-T402 HydrophobicContact CG-CG2 4Å; Q400-T402 PolarHBondContact O-N 2.82Å
401S30.3Very low30.3Very low100 Ų100113.4 Ų113.470%0.69967%0.668SS**  trans-74.265.9163.1-179.40000108I399 V403I399-S401 VanDerWaalsContact C-N 3.32Å; I399-S401 PolarHBondContact O-N 3.44Å; S401-V403 PolarHBondContact O-N 2.98Å
402T30Very low30.4Very low96 Ų96108.7 Ų108.759%0.58966%0.656SS**  trans-73.199.3161.348.80000105.4Q400 P404Q400-T402 HydrophobicContact CB-CG2 4.26Å; Q400-T402 HydrophobicContact CG-CG2 4Å; Q400-T402 PolarHBondContact O-N 2.82Å; T402-P404 VanDerWaalsContact O-CD 3.24Å; T402-P404 WeakPolarHBondContact O-CD 3.42Å
403V27.8Very low30.7Very low112 Ų112117.2 Ų117.268%0.67967%0.67SS**  trans-88.4102.7156.1-178.80000104S401S401-V403 PolarHBondContact O-N 2.98Å
404P29.6Very low31.2Very low100 Ų100118.8 Ų118.865%0.64969%0.689SS**PPolyproline II helixtrans-62.1154.3173.6-14.831.2000108.8T402T402-P404 VanDerWaalsContact O-CD 3.24Å; T402-P404 WeakPolarHBondContact O-CD 3.42Å
405A33.3Very low31.4Very low59 Ų59118.1 Ų118.149%0.48868%0.683SS.*PPolyproline II helixtrans-50.4137169.600000109.5
406P35.9Very low31.6Very low39 Ų39116.1 Ų116.125%0.25368%0.675SS.*PPolyproline II helixtrans-56.8136.7-179.914.1-21.3000109.4E68 I408E68-P406 WeakPolarHBondContact OE1-CG 3.37Å; P406-I408 PolarHBondContact O-N 3.11Å
407P34.1Very low31.7Very low79 Ų79114.4 Ų114.451%0.51367%0.67SS.*PPolyproline II helixtrans-65.9140.1-172.6-16.929000111.2V310V310-P407 HydrophobicContact CG1-CB 3.32Å; V310-P407 VanDerWaalsContact CG1-CD 3.44Å; V310-P407 HydrophobicContact CG1-CG 3.31Å
408I38.9Very low31.9Very low112 Ų112114.5 Ų114.557%0.57466%0.662SS**PPolyproline II helixtrans-54.5123.8-177.4-62.6165.2000109P233 P406P233-I408 HydrophobicContact CB-CG1 4.42Å; P233-I408 HydrophobicContact CB-CG2 3.58Å; P406-I408 PolarHBondContact O-N 3.11Å
409P36.1Very low32.2Very low33 Ų33112.9 Ų112.921%0.21466%0.657CS.*PPolyproline II helixtrans-57136.8173.5-22.331.7000110F234 L305F234-P409 HydrophobicContact CD1-CG 4.23Å; F234-P409 HydrophobicContact CE1-CG 4.24Å; L305-P409 HydrophobicContact CD2-CG 4.17Å
410P31.9Very low32.6Very low107 Ų107109.2 Ų109.270%0.69564%0.643SS**PPolyproline II helixtrans-60.7145.5176.224.6-31.7000109.9
411P31.7Very low32.9Very low112 Ų112107 Ų10773%0.72764%0.643SS**PPolyproline II helixtrans-56.6145.6-179.923.3-32.8000110.2R413P411-R413 PolarHBondContact O-N 3.49Å; P411-R413 VanDerWaalsContact O-N 3.11Å
412P30.9Very low33.1Very low111 Ų111107.5 Ų107.572%0.72164%0.638SS**PPolyproline II helixtrans-55.1124175.420.7-29.2000108.6
413R34.4Very low33.4Very low239 Ų239108.5 Ų108.590%0.90264%0.642SS**PPolyproline II helixtrans-59.9140.1171.3-91.2-174.4-80.4-134.6-4.2108.4P411P411-R413 PolarHBondContact O-N 3.49Å; P411-R413 VanDerWaalsContact O-N 3.11Å
414P35.7Very low33.9Very low199 Ų199108.2 Ų108.2100%1.29264%0.639SS**  trans-58.70-174.824.4-34.3000113.6

Retrieved 414 of 414 residues in 81.3 ms (Link to these results)

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