A0A087YM82_POEFO Loading...

Potassium channel subfamily K member 4

AlphaFold DB , UniProt , Accession A0A087YM82, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 472 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M60.3Low85.6Confident168 Ų168105.5 Ų105.583%0.82855%0.551SS**  0158.20-67.8161.17700108.5T5 L6 I9M1-T5 HydrophobicContact CE-CG2 4.22Å; M1-L6 HydrophobicContact CB-CD1 4.37Å; M1-L6 HydrophobicContact CB-CG 4.2Å; M1-L6 HydrophobicContact CE-CD2 4.27Å; M1-L6 HydrophobicContact SD-CD2 4.14Å; M1-I9 HydrophobicContact CE-CD1 3.47Å; M1-I9 VanDerWaalsContact CE-CD1 3.47Å
2R81.9Confident86.2Confident171 Ų171106.3 Ų106.365%0.64555%0.553SS**  trans-72144.8172.1-70.4-179.5177.4159.5-1109.6S4 T5 L6R2-S4 VanDerWaalsContact C-N 3.29Å; R2-S4 PolarHBondContact O-N 2.99Å; R2-T5 WeakPolarHBondContact O-CB 3.17Å; R2-T5 PolarHBondContact O-N 2.63Å; R2-L6 PolarHBondContact O-N 3.21Å
3C85.6Confident86.9Confident90 Ų90104.2 Ų104.261%0.60855%0.547SS*.Hα-helixtrans-54.7-43.7-179.4-1790000112.1T5 L6 L7C3-T5 VanDerWaalsContact C-N 3.25Å; C3-T5 PolarHBondContact O-N 3Å; C3-L6 WeakPolarHBondContact O-CB 3.38Å; C3-L6 PolarHBondContact O-N 3.34Å; C3-L7 PolarHBondContact O-N 3.38Å
4S85Confident87.6Confident93 Ų93103.3 Ų103.365%0.6554%0.542SS*.Hα-helixtrans-58.1-33.1176.2-38.40000113.7R2 L8R2-S4 VanDerWaalsContact C-N 3.29Å; R2-S4 PolarHBondContact O-N 2.99Å; S4-L8 WeakPolarHBondContact O-CB 3.42Å; S4-L8 PolarHBondContact O-N 3.09Å
5T83.4Confident88.3Confident58 Ų58103.9 Ų103.936%0.35655%0.545SS..Hα-helixtrans-73.4-37.4176.5-46.30000111.5M1 R2 C3 I9M1-T5 HydrophobicContact CE-CG2 4.22Å; R2-T5 WeakPolarHBondContact O-CB 3.17Å; R2-T5 PolarHBondContact O-N 2.63Å; C3-T5 VanDerWaalsContact C-N 3.25Å; C3-T5 PolarHBondContact O-N 3Å; T5-I9 HydrophobicContact CG2-CD1 4.18Å; T5-I9 VanDerWaalsContact O-CG1 3.32Å; T5-I9 WeakPolarHBondContact O-CG1 3.45Å; T5-I9 PolarHBondContact O-N 2.93Å
6L87.1Confident88.8Confident96 Ų96107.8 Ų107.850%0.50355%0.552SS.*Hα-helixtrans-66.7-43.4174.1-77.5164000111.3M1 R2 C3 L8 I9 F10M1-L6 HydrophobicContact CB-CD1 4.37Å; M1-L6 HydrophobicContact CB-CG 4.2Å; M1-L6 HydrophobicContact CE-CD2 4.27Å; M1-L6 HydrophobicContact SD-CD2 4.14Å; R2-L6 PolarHBondContact O-N 3.21Å; C3-L6 WeakPolarHBondContact O-CB 3.38Å; C3-L6 PolarHBondContact O-N 3.34Å; L6-L8 PolarHBondContact O-N 3.4Å; L6-I9 PolarHBondContact O-N 2.81Å; L6-F10 WeakPolarHBondContact O-CB 3.48Å; L6-F10 PolarHBondContact O-N 3.2Å
7L91.4Very high89.4Confident103 Ų103107.9 Ų107.954%0.53955%0.553SS.*Hα-helixtrans-59.2-45.4174.3-72.8169.9000111.7C3 F10 T11C3-L7 PolarHBondContact O-N 3.38Å; L7-F10 PolarHBondContact O-N 3.2Å; L7-T11 WeakPolarHBondContact O-CG2 3.49Å; L7-T11 PolarHBondContact O-N 3.03Å; L7-T11 PolarHBondContact O-OG1 3.04Å
8L89.6Confident89.9Confident100 Ų100106.2 Ų106.252%0.52455%0.548SS..Hα-helixtrans-60.6-47.8177-175.8147.8000111.8S4 L6 F10 T11 M12S4-L8 WeakPolarHBondContact O-CB 3.42Å; S4-L8 PolarHBondContact O-N 3.09Å; L6-L8 PolarHBondContact O-N 3.4Å; L8-F10 VanDerWaalsContact C-N 3.34Å; L8-F10 PolarHBondContact O-N 3.14Å; L8-T11 WeakPolarHBondContact CA-OG1 3.44Å; L8-T11 PolarHBondContact O-N 2.65Å; L8-T11 PolarHBondContact O-OG1 3.5Å; L8-M12 HydrophobicContact CD2-CG 4.25Å; L8-M12 WeakPolarHBondContact O-CG 3.25Å; L8-M12 PolarHBondContact O-N 2.87Å
9I89.4Confident90.3Very high77 Ų77105.4 Ų105.440%0.39554%0.543SS..Hα-helixtrans-61.7-43.2177.6-68.6165.3000110.8M1 T5 L6 T11 M12 V13M1-I9 HydrophobicContact CE-CD1 3.47Å; M1-I9 VanDerWaalsContact CE-CD1 3.47Å; T5-I9 HydrophobicContact CG2-CD1 4.18Å; T5-I9 VanDerWaalsContact O-CG1 3.32Å; T5-I9 WeakPolarHBondContact O-CG1 3.45Å; T5-I9 PolarHBondContact O-N 2.93Å; L6-I9 PolarHBondContact O-N 2.81Å; I9-T11 PolarHBondContact O-N 3.48Å; I9-M12 PolarHBondContact O-N 2.93Å; I9-V13 WeakPolarHBondContact O-CG2 3.44Å; I9-V13 PolarHBondContact O-N 3.08Å
10F93.3Very high90.7Very high137 Ų137100.9 Ų100.960%0.60152%0.524SS*.Hα-helixtrans-59.7-45.2175.9178.5-99.1000112.1L6 L7 L8 M12 V13 L14L6-F10 WeakPolarHBondContact O-CB 3.48Å; L6-F10 PolarHBondContact O-N 3.2Å; L7-F10 PolarHBondContact O-N 3.2Å; L8-F10 VanDerWaalsContact C-N 3.34Å; L8-F10 PolarHBondContact O-N 3.14Å; F10-M12 VanDerWaalsContact C-N 3.32Å; F10-M12 PolarHBondContact O-N 2.96Å; F10-V13 PolarHBondContact O-N 3.29Å; F10-L14 WeakPolarHBondContact O-CB 3.45Å; F10-L14 PolarHBondContact O-N 3.17Å
11T94.6Very high91Very high68 Ų6899 Ų9942%0.41752%0.524SS..Hα-helixtrans-63.9-35.4175.953.30000112.9L7 L8 I9 L14 L15L7-T11 WeakPolarHBondContact O-CG2 3.49Å; L7-T11 PolarHBondContact O-N 3.03Å; L7-T11 PolarHBondContact O-OG1 3.04Å; L8-T11 WeakPolarHBondContact CA-OG1 3.44Å; L8-T11 PolarHBondContact O-N 2.65Å; L8-T11 PolarHBondContact O-OG1 3.5Å; I9-T11 PolarHBondContact O-N 3.48Å; T11-L14 PolarHBondContact O-N 2.98Å; T11-L15 VanDerWaalsContact O-CG 3.3Å; T11-L15 WeakPolarHBondContact O-CG 3.47Å; T11-L15 PolarHBondContact O-N 3.47Å
12M92.9Very high92.9Very high115 Ų11596.4 Ų96.457%0.56751%0.512SS*.Hα-helixtrans-68.1-40.3175.5-69-69.2173.600112L8 I9 F10 L15 Y16L8-M12 HydrophobicContact CD2-CG 4.25Å; L8-M12 WeakPolarHBondContact O-CG 3.25Å; L8-M12 PolarHBondContact O-N 2.87Å; I9-M12 PolarHBondContact O-N 2.93Å; F10-M12 VanDerWaalsContact C-N 3.32Å; F10-M12 PolarHBondContact O-N 2.96Å; M12-L15 PolarHBondContact O-N 3.22Å; M12-Y16 WeakPolarHBondContact O-CB 3.35Å; M12-Y16 PolarHBondContact O-N 3.06Å
13V94.8Very high93.6Very high79 Ų7991.5 Ų91.548%0.47950%0.501SS..Hα-helixtrans-64.2-42.5173.6172.50000111I9 F10 L15 Y16 L17I9-V13 WeakPolarHBondContact O-CG2 3.44Å; I9-V13 PolarHBondContact O-N 3.08Å; F10-V13 PolarHBondContact O-N 3.29Å; V13-L15 PolarHBondContact O-N 3.03Å; V13-Y16 WeakPolarHBondContact O-CB 3.45Å; V13-Y16 PolarHBondContact O-N 2.86Å; V13-L17 HydrophobicContact CG1-CD1 4.19Å; V13-L17 WeakPolarHBondContact O-CG 3.46Å; V13-L17 PolarHBondContact O-N 3.48Å
14L97.5Very high94.2Very high91 Ų9193.6 Ų93.648%0.47650%0.5SS..Hα-helixtrans-61.9-43.3176.8-17663.5000112F10 T11 Y16 L17 V18F10-L14 WeakPolarHBondContact O-CB 3.45Å; F10-L14 PolarHBondContact O-N 3.17Å; T11-L14 PolarHBondContact O-N 2.98Å; L14-Y16 VanDerWaalsContact C-N 3.35Å; L14-L17 PolarHBondContact O-N 3.32Å; L14-V18 WeakPolarHBondContact O-CG2 3.4Å; L14-V18 PolarHBondContact O-N 2.87Å
15L97.4Very high94.9Very high113 Ų11398.2 Ų98.259%0.59250%0.503SS*.Hα-helixtrans-64.2-38.2175-71.4169.2000112.3T11 M12 V13 V18 M19T11-L15 VanDerWaalsContact O-CG 3.3Å; T11-L15 WeakPolarHBondContact O-CG 3.47Å; T11-L15 PolarHBondContact O-N 3.47Å; M12-L15 PolarHBondContact O-N 3.22Å; V13-L15 PolarHBondContact O-N 3.03Å; L15-V18 PolarHBondContact O-N 3.09Å; L15-M19 WeakPolarHBondContact O-CB 3.41Å; L15-M19 PolarHBondContact O-N 2.99Å
16Y96.8Very high95.6Very high165 Ų16599.3 Ų99.365%0.64751%0.513SS*.Hα-helixtrans-64.1-41.8175.1-174.2-98.1000112M12 V13 L14 M19 G20M12-Y16 WeakPolarHBondContact O-CB 3.35Å; M12-Y16 PolarHBondContact O-N 3.06Å; V13-Y16 WeakPolarHBondContact O-CB 3.45Å; V13-Y16 PolarHBondContact O-N 2.86Å; L14-Y16 VanDerWaalsContact C-N 3.35Å; Y16-M19 HydrophobicContact CD2-CE 3.6Å; Y16-M19 HydrophobicContact CE2-CE 3.6Å; Y16-M19 HydrophobicContact CG-CE 4.38Å; Y16-M19 PolarHBondContact O-N 3.31Å; Y16-G20 PolarHBondContact O-N 3.09Å
17L98.1Very high96.1Very high110 Ų11099.8 Ų99.858%0.57652%0.516SS*.Hα-helixtrans-64.4-42.1174.8-70.4171.5000112.3V13 L14 G20 A21V13-L17 HydrophobicContact CG1-CD1 4.19Å; V13-L17 WeakPolarHBondContact O-CG 3.46Å; V13-L17 PolarHBondContact O-N 3.48Å; L14-L17 PolarHBondContact O-N 3.32Å; L17-G20 PolarHBondContact O-N 2.75Å; L17-A21 WeakPolarHBondContact O-CB 3.26Å; L17-A21 PolarHBondContact O-N 2.96Å
18V98.4Very high96.4Very high77 Ų7799.6 Ų99.647%0.46751%0.512SS..Hα-helixtrans-63.7-42.3175.5170.80000111.2L14 L15 A21 L22L14-V18 WeakPolarHBondContact O-CG2 3.4Å; L14-V18 PolarHBondContact O-N 2.87Å; L15-V18 PolarHBondContact O-N 3.09Å; V18-A21 PolarHBondContact O-N 3.16Å; V18-L22 HydrophobicContact CG1-CD1 4.15Å; V18-L22 WeakPolarHBondContact O-CG 3.47Å; V18-L22 PolarHBondContact O-N 2.77Å
19M98Very high96.8Very high91 Ų9196.5 Ų96.545%0.44850%0.501SS..Hα-helixtrans-61.2-48.3175.5179.6-82.2-63.300111.3L15 Y16 A21 L22 V23L15-M19 WeakPolarHBondContact O-CB 3.41Å; L15-M19 PolarHBondContact O-N 2.99Å; Y16-M19 HydrophobicContact CD2-CE 3.6Å; Y16-M19 HydrophobicContact CE2-CE 3.6Å; Y16-M19 HydrophobicContact CG-CE 4.38Å; Y16-M19 PolarHBondContact O-N 3.31Å; M19-A21 PolarHBondContact O-N 3.03Å; M19-L22 PolarHBondContact O-N 3.02Å; M19-V23 WeakPolarHBondContact O-CG2 3.46Å; M19-V23 PolarHBondContact O-N 3.24Å; M19-V23 HydrophobicContact SD-CG2 4.19Å
20G98Very high97.2Very high16 Ų1696.6 Ų96.617%0.16551%0.507CS..Hα-helixtrans-59.3-46.5175.700000112.8Y16 L17 L22 V23 F24Y16-G20 PolarHBondContact O-N 3.09Å; L17-G20 PolarHBondContact O-N 2.75Å; G20-L22 VanDerWaalsContact C-N 3.32Å; G20-L22 PolarHBondContact O-N 3.06Å; G20-V23 PolarHBondContact O-N 3.37Å; G20-F24 WeakPolarHBondContact O-CD2 3.33Å; G20-F24 PolarHBondContact O-N 2.95Å
21A98.3Very high97.3Very high62 Ų6294.2 Ų94.251%0.51250%0.499SS..Hα-helixtrans-62-36.6179.200000113.1L17 V18 M19 R25L17-A21 WeakPolarHBondContact O-CB 3.26Å; L17-A21 PolarHBondContact O-N 2.96Å; V18-A21 PolarHBondContact O-N 3.16Å; M19-A21 PolarHBondContact O-N 3.03Å; A21-R25 WeakPolarHBondContact O-CB 3.48Å; A21-R25 PolarHBondContact O-N 3.11Å; A21-R25 VanDerWaalsContact O-N 3.1Å
22L98.4Very high97.4Very high113 Ų11397.8 Ų97.859%0.59251%0.511SS*.Hα-helixtrans-68.2-42.3174-71.3170.9000111.7V18 M19 G20 S26V18-L22 HydrophobicContact CG1-CD1 4.15Å; V18-L22 WeakPolarHBondContact O-CG 3.47Å; V18-L22 PolarHBondContact O-N 2.77Å; M19-L22 PolarHBondContact O-N 3.02Å; G20-L22 VanDerWaalsContact C-N 3.32Å; G20-L22 PolarHBondContact O-N 3.06Å; L22-S26 WeakPolarHBondContact O-CB 3.4Å; L22-S26 PolarHBondContact O-N 2.98Å; L22-S26 VanDerWaalsContact O-N 3.08Å; L22-S26 PolarHBondContact O-OG 3.37Å
23V98.4Very high97.6Very high68 Ų6899.3 Ų99.341%0.41252%0.517SS..Hα-helixtrans-65.1-54.9178.2172.30000110.9M19 G20 R25 S26 L27M19-V23 WeakPolarHBondContact O-CG2 3.46Å; M19-V23 PolarHBondContact O-N 3.24Å; M19-V23 HydrophobicContact SD-CG2 4.19Å; G20-V23 PolarHBondContact O-N 3.37Å; V23-R25 VanDerWaalsContact C-N 3.34Å; V23-R25 PolarHBondContact O-N 3.37Å; V23-S26 PolarHBondContact O-N 3.28Å; V23-S26 PolarHBondContact O-OG 3.32Å; V23-L27 HydrophobicContact CG1-CD1 3.85Å; V23-L27 WeakPolarHBondContact O-CG 3.39Å; V23-L27 PolarHBondContact O-N 3.41Å; V23-L27 VanDerWaalsContact O-N 3.14Å
24F98.1Very high97.8Very high134 Ų134101.2 Ų101.259%0.58852%0.519SS*.Hα-helixtrans-57.7-44.6178.7-72.8-60.6000111.9G20 S26 L27 E28G20-F24 WeakPolarHBondContact O-CD2 3.33Å; G20-F24 PolarHBondContact O-N 2.95Å; F24-S26 PolarHBondContact O-N 2.97Å; F24-L27 PolarHBondContact O-N 2.99Å; F24-L27 VanDerWaalsContact O-N 3.12Å; F24-E28 WeakPolarHBondContact O-CG 3.24Å; F24-E28 PolarHBondContact O-N 2.97Å
25R98Very high97.7Very high190 Ų190101 Ų10172%0.71752%0.516SS*.Hα-helixtrans-58.9-35.6175.1-178.3178.6174.5-166.7-2.2112.8A21 V23 L27 A29A21-R25 WeakPolarHBondContact O-CB 3.48Å; A21-R25 PolarHBondContact O-N 3.11Å; A21-R25 VanDerWaalsContact O-N 3.1Å; V23-R25 VanDerWaalsContact C-N 3.34Å; V23-R25 PolarHBondContact O-N 3.37Å; R25-L27 VanDerWaalsContact C-N 3.33Å; R25-A29 HydrophobicContact CG-CB 4.41Å; R25-A29 VanDerWaalsContact O-CB 3.25Å; R25-A29 WeakPolarHBondContact O-CB 3.44Å; R25-A29 PolarHBondContact O-N 3.1Å
26S98Very high97.6Very high80 Ų80101.4 Ų101.456%0.55951%0.514SS*.Hα-helixtrans-75.4-20.4179.771.50000114.2L22 V23 F24L22-S26 WeakPolarHBondContact O-CB 3.4Å; L22-S26 PolarHBondContact O-N 2.98Å; L22-S26 VanDerWaalsContact O-N 3.08Å; L22-S26 PolarHBondContact O-OG 3.37Å; V23-S26 PolarHBondContact O-N 3.28Å; V23-S26 PolarHBondContact O-OG 3.32Å; F24-S26 PolarHBondContact O-N 2.97Å
27L97.7Very high97.6Very high107 Ų10795.8 Ų95.856%0.5650%0.502SS*.Hα-helixtrans-96-49.1179.7-63.8173.3000111.8V23 F24 R25V23-L27 HydrophobicContact CG1-CD1 3.85Å; V23-L27 WeakPolarHBondContact O-CG 3.39Å; V23-L27 PolarHBondContact O-N 3.41Å; V23-L27 VanDerWaalsContact O-N 3.14Å; F24-L27 PolarHBondContact O-N 2.99Å; F24-L27 VanDerWaalsContact O-N 3.12Å; R25-L27 VanDerWaalsContact C-N 3.33Å
28E97.8Very high97.6Very high99 Ų9993.3 Ų93.346%0.46349%0.491SS..Hα-helixtrans-86.7-39-169.3-52.5-47.3140.200113.6F24 L31 E32F24-E28 WeakPolarHBondContact O-CG 3.24Å; F24-E28 PolarHBondContact O-N 2.97Å; E28-L31 WeakPolarHBondContact O-CA 3.45Å; E28-L31 WeakPolarHBondContact O-CB 3.42Å; E28-L31 PolarHBondContact O-N 2.89Å; E28-E32 PolarHBondContact O-N 3.4Å
29A97.8Very high97.5Very high34 Ų3494.6 Ų94.628%0.28150%0.495SS..Hα-helixtrans-61.2-36.7-174.400000114.2R25 L31 E32 E33R25-A29 HydrophobicContact CG-CB 4.41Å; R25-A29 VanDerWaalsContact O-CB 3.25Å; R25-A29 WeakPolarHBondContact O-CB 3.44Å; R25-A29 PolarHBondContact O-N 3.1Å; A29-L31 VanDerWaalsContact C-N 3.27Å; A29-L31 PolarHBondContact O-N 2.91Å; A29-E32 PolarHBondContact O-N 3.25Å; A29-E33 WeakPolarHBondContact O-CB 3.46Å; A29-E33 PolarHBondContact O-N 3.06Å
30P98.1Very high97.3Very high80 Ų8093.9 Ų93.952%0.51949%0.491SS..Hα-helixtrans-67.6-24.6172.6-20.334000113.8K34P30-K34 WeakPolarHBondContact O-CB 3.47Å; P30-K34 PolarHBondContact O-N 2.99Å
31L96.8Very high97.3Very high86 Ų8698 Ų9845%0.4551%0.509SS..Hα-helixtrans-79.6-43.7175.1-177.860.2000110.6E28 A29 E33 K34 E35E28-L31 WeakPolarHBondContact O-CA 3.45Å; E28-L31 WeakPolarHBondContact O-CB 3.42Å; E28-L31 PolarHBondContact O-N 2.89Å; A29-L31 VanDerWaalsContact C-N 3.27Å; A29-L31 PolarHBondContact O-N 2.91Å; L31-E33 PolarHBondContact O-N 3Å; L31-K34 WeakPolarHBondContact O-CB 3.47Å; L31-K34 PolarHBondContact O-N 3.1Å; L31-E35 HydrophobicContact CD1-CG 4.42Å; L31-E35 PolarHBondContact O-N 2.96Å
32E96.8Very high97.1Very high143 Ų143100.8 Ų100.867%0.66851%0.512SS*.Hα-helixtrans-56.3-48.6172.6-176.3-177.3-161.600111.7E28 A29 K34 E35 H36E28-E32 PolarHBondContact O-N 3.4Å; A29-E32 PolarHBondContact O-N 3.25Å; E32-K34 VanDerWaalsContact C-N 3.29Å; E32-K34 PolarHBondContact O-N 2.75Å; E32-E35 PolarHBondContact O-N 2.76Å; E32-H36 VanDerWaalsContact O-CB 3.27Å; E32-H36 WeakPolarHBondContact O-CB 2.74Å; E32-H36 PolarHBondContact O-N 3.32Å
33E97.3Very high96.9Very high148 Ų14897.7 Ų97.769%0.69250%0.498SS*.Hα-helixtrans-60.5-38.6177.6-175.9172.7-162.700112A29 L31 A37A29-E33 WeakPolarHBondContact O-CB 3.46Å; A29-E33 PolarHBondContact O-N 3.06Å; L31-E33 PolarHBondContact O-N 3Å; E33-A37 WeakPolarHBondContact O-CB 3.47Å; E33-A37 PolarHBondContact O-N 3.39Å
34K97.4Very high96.7Very high118 Ų118101.4 Ų101.451%0.51350%0.504SS..Hα-helixtrans-66.4-50176.5172.2177.1165.5-76.40112.1P30 L31 E32 A37 V38P30-K34 WeakPolarHBondContact O-CB 3.47Å; P30-K34 PolarHBondContact O-N 2.99Å; L31-K34 WeakPolarHBondContact O-CB 3.47Å; L31-K34 PolarHBondContact O-N 3.1Å; E32-K34 VanDerWaalsContact C-N 3.29Å; E32-K34 PolarHBondContact O-N 2.75Å; K34-A37 WeakPolarHBondContact O-CB 3.3Å; K34-A37 PolarHBondContact O-N 3.14Å; K34-V38 WeakPolarHBondContact O-CG2 3.47Å; K34-V38 PolarHBondContact O-N 3.22Å
35E96.2Very high96.6Very high88 Ų8897.8 Ų97.841%0.41150%0.499SS..Hα-helixtrans-69.4-34.3-179.1-62.1-45.5127.900112L31 E32 A37 V38 L39L31-E35 HydrophobicContact CD1-CG 4.42Å; L31-E35 PolarHBondContact O-N 2.96Å; E32-E35 PolarHBondContact O-N 2.76Å; E35-A37 VanDerWaalsContact C-N 3.33Å; E35-A37 PolarHBondContact O-N 3.05Å; E35-V38 PolarHBondContact O-N 3Å; E35-L39 WeakPolarHBondContact O-CB 3.3Å; E35-L39 PolarHBondContact O-N 3.3Å
36H96Very high96.5Very high120 Ų12093.2 Ų93.256%0.55649%0.485SS*.Hα-helixtrans-60.1-41.8169.6174.4-95.1000112E32 L39 M40E32-H36 VanDerWaalsContact O-CB 3.27Å; E32-H36 WeakPolarHBondContact O-CB 2.74Å; E32-H36 PolarHBondContact O-N 3.32Å; H36-L39 PolarHBondContact O-N 2.99Å; H36-M40 WeakPolarHBondContact O-CB 3.48Å; H36-M40 PolarHBondContact O-N 2.78Å
37A97.1Very high96.3Very high47 Ų4791.2 Ų91.239%0.38847%0.468SS..Hα-helixtrans-65.1-39.8175.300000112.6E33 K34 E35 M40 D41E33-A37 WeakPolarHBondContact O-CB 3.47Å; E33-A37 PolarHBondContact O-N 3.39Å; K34-A37 WeakPolarHBondContact O-CB 3.3Å; K34-A37 PolarHBondContact O-N 3.14Å; E35-A37 VanDerWaalsContact C-N 3.33Å; E35-A37 PolarHBondContact O-N 3.05Å; A37-M40 PolarHBondContact O-N 3.22Å; A37-D41 PolarHBondContact O-N 3.27Å
38V97.4Very high96.2Very high58 Ų5895.1 Ų95.135%0.35248%0.481SS..Hα-helixtrans-63.1-48.2174.9171.50000111.1K34 E35 M40 D41 Q42K34-V38 WeakPolarHBondContact O-CG2 3.47Å; K34-V38 PolarHBondContact O-N 3.22Å; E35-V38 PolarHBondContact O-N 3Å; V38-M40 VanDerWaalsContact C-N 3.33Å; V38-M40 PolarHBondContact O-N 3.49Å; V38-D41 PolarHBondContact O-N 3.12Å; V38-Q42 HydrophobicContact CG1-CG 4.38Å; V38-Q42 WeakPolarHBondContact O-CG 3.5Å; V38-Q42 PolarHBondContact O-N 2.95Å
39L95.5Very high96.1Very high104 Ų10496.6 Ų96.655%0.54549%0.491SS..Hα-helixtrans-60.1-42.2178.1179.261.5000111.7E35 H36 D41 T43E35-L39 WeakPolarHBondContact O-CB 3.3Å; E35-L39 PolarHBondContact O-N 3.3Å; H36-L39 PolarHBondContact O-N 2.99Å; L39-D41 PolarHBondContact O-N 3.06Å; L39-T43 WeakPolarHBondContact O-CB 3.34Å; L39-T43 PolarHBondContact O-N 2.92Å; L39-T43 PolarHBondContact O-OG1 3.14Å
40M95.2Very high96Very high76 Ų7697.3 Ų97.337%0.37449%0.49SS..Hα-helixtrans-63.2-38.2176-177.5178.157.700112.5H36 A37 V38 R44H36-M40 WeakPolarHBondContact O-CB 3.48Å; H36-M40 PolarHBondContact O-N 2.78Å; A37-M40 PolarHBondContact O-N 3.22Å; V38-M40 VanDerWaalsContact C-N 3.33Å; V38-M40 PolarHBondContact O-N 3.49Å; M40-R44 WeakPolarHBondContact O-CD 3.39Å; M40-R44 VanDerWaalsContact O-CG 3.3Å; M40-R44 WeakPolarHBondContact O-CG 3.32Å; M40-R44 PolarHBondContact O-N 3.38Å; M40-R44 PolarHBondContact SD-NH2 3.48Å
41D96.6Very high95.7Very high102 Ų10299.1 Ų99.155%0.54551%0.505SS..Hα-helixtrans-72.1-45.1177.8-162.861.5000112A37 V38 L39 T43 R44 A45A37-D41 PolarHBondContact O-N 3.27Å; V38-D41 PolarHBondContact O-N 3.12Å; L39-D41 PolarHBondContact O-N 3.06Å; D41-T43 VanDerWaalsContact C-N 3.3Å; D41-T43 PolarHBondContact O-N 3.1Å; D41-R44 WeakPolarHBondContact O-CB 3.43Å; D41-R44 PolarHBondContact O-N 3.37Å; D41-R44 VanDerWaalsContact O-N 3.12Å; D41-A45 PolarHBondContact O-N 3.28Å
42Q95.4Very high95.6Very high122 Ų122100.7 Ų100.757%0.5752%0.522SS*.Hα-helixtrans-57.2-41.9172.9-71.2-179.8-1.600112.1V38 R44 A45 F46V38-Q42 HydrophobicContact CG1-CG 4.38Å; V38-Q42 WeakPolarHBondContact O-CG 3.5Å; V38-Q42 PolarHBondContact O-N 2.95Å; Q42-R44 VanDerWaalsContact C-N 3.35Å; Q42-R44 PolarHBondContact O-N 3.39Å; Q42-A45 PolarHBondContact O-N 2.9Å; Q42-F46 WeakPolarHBondContact O-CB 3.45Å; Q42-F46 PolarHBondContact O-N 2.93Å
43T93.9Very high95.6Very high47 Ų4796 Ų9629%0.28850%0.503SS..Hα-helixtrans-61.6-41.6176.3-59.10000111.7L39 D41 L47 L58L39-T43 WeakPolarHBondContact O-CB 3.34Å; L39-T43 PolarHBondContact O-N 2.92Å; L39-T43 PolarHBondContact O-OG1 3.14Å; D41-T43 VanDerWaalsContact C-N 3.3Å; D41-T43 PolarHBondContact O-N 3.1Å; T43-L47 HydrophobicContact CG2-CD1 4.14Å; T43-L47 WeakPolarHBondContact O-CG 3.43Å; T43-L47 PolarHBondContact O-N 3.15Å; T43-L47 VanDerWaalsContact O-N 3.08Å; T43-L58 HydrophobicContact CG2-CD2 4.07Å
44R93.4Very high95.4Very high146 Ų14692.7 Ų92.755%0.55149%0.49SS*.Hα-helixtrans-66.8-44.3175.9-71.3165.2179.2172.10.2112M40 D41 Q42 F46 L47 F48M40-R44 WeakPolarHBondContact O-CD 3.39Å; M40-R44 VanDerWaalsContact O-CG 3.3Å; M40-R44 WeakPolarHBondContact O-CG 3.32Å; M40-R44 PolarHBondContact O-N 3.38Å; M40-R44 PolarHBondContact SD-NH2 3.48Å; D41-R44 WeakPolarHBondContact O-CB 3.43Å; D41-R44 PolarHBondContact O-N 3.37Å; D41-R44 VanDerWaalsContact O-N 3.12Å; Q42-R44 VanDerWaalsContact C-N 3.35Å; Q42-R44 PolarHBondContact O-N 3.39Å; R44-F46 VanDerWaalsContact C-N 3.32Å; R44-F46 PolarHBondContact O-N 2.85Å; R44-L47 PolarHBondContact O-N 2.96Å; R44-F48 WeakPolarHBondContact O-CB 3.33Å; R44-F48 PolarHBondContact O-N 3.24Å
45A95.7Very high95.1Very high58 Ų5892.7 Ų92.748%0.47950%0.495SS..Hα-helixtrans-61.3-41.8177.500000111.6D41 Q42 F48 N49D41-A45 PolarHBondContact O-N 3.28Å; Q42-A45 PolarHBondContact O-N 2.9Å; A45-F48 PolarHBondContact O-N 3.32Å; A45-N49 WeakPolarHBondContact O-CB 3.39Å; A45-N49 PolarHBondContact O-N 2.96Å
46F95.8Very high95Very high95 Ų9597.1 Ų97.142%0.41751%0.509SS..Hα-helixtrans-61.9-48.9175.4-178.2-91.3000112.2Q42 R44 F48 N49 N50 L58Q42-F46 WeakPolarHBondContact O-CB 3.45Å; Q42-F46 PolarHBondContact O-N 2.93Å; R44-F46 VanDerWaalsContact C-N 3.32Å; R44-F46 PolarHBondContact O-N 2.85Å; F46-F48 PolarHBondContact O-N 2.87Å; F46-N49 PolarHBondContact O-N 3.22Å; F46-N50 HydrophobicContact CE1-CB 4.42Å; F46-N50 WeakPolarHBondContact O-CB 3.23Å; F46-N50 PolarHBondContact O-N 3.3Å; F46-N50 PolarHBondContact O-ND2 3.42Å; F46-L58 HydrophobicContact CD1-CD1 4.47Å; F46-L58 HydrophobicContact CD1-CD2 4.14Å; F46-L58 HydrophobicContact CE1-CD1 4.16Å
47L94.9Very high94.9Very high38 Ų3894.9 Ų94.920%0.19950%0.504CS..Hα-helixtrans-65.4-36.9178.8-72.1168.2000112.5T43 R44 N50 V53 L55 L58T43-L47 HydrophobicContact CG2-CD1 4.14Å; T43-L47 WeakPolarHBondContact O-CG 3.43Å; T43-L47 PolarHBondContact O-N 3.15Å; T43-L47 VanDerWaalsContact O-N 3.08Å; R44-L47 PolarHBondContact O-N 2.96Å; L47-N50 CarbonylContact O-C 3.41Å; L47-N50 PolarHBondContact O-N 3.45Å; L47-V53 HydrophobicContact CD2-CG1 4.42Å; L47-V53 WeakPolarHBondContact CD2-O 3.41Å; L47-L55 HydrophobicContact CD1-CD1 3.84Å; L47-L58 HydrophobicContact CD1-CD2 4.18Å; L47-L58 HydrophobicContact CD2-CB 4.39Å; L47-L58 HydrophobicContact CD2-CD2 3.76Å; L47-L58 HydrophobicContact CG-CD2 3.88Å
48F94.6Very high94.8Very high189 Ų18994 Ų9483%0.82949%0.493SS*.Hα-helixtrans-65.3-40.3175.7-177.2-95.4000112.1R44 A45 F46R44-F48 WeakPolarHBondContact O-CB 3.33Å; R44-F48 PolarHBondContact O-N 3.24Å; A45-F48 PolarHBondContact O-N 3.32Å; F46-F48 PolarHBondContact O-N 2.87Å
49N97.1Very high94.7Very high129 Ų12995.1 Ų95.169%0.6950%0.497SS*.Hα-helixtrans-76.3-24178.4-167.880.7000113.2A45 F46A45-N49 WeakPolarHBondContact O-CB 3.39Å; A45-N49 PolarHBondContact O-N 2.96Å; F46-N49 PolarHBondContact O-N 3.22Å
50N95.4Very high94.7Very high49 Ų4993 Ų9326%0.26249%0.486SS..  trans-120.465.6-176.6-59.8-82.5000111.2F46 L47 C52 V53F46-N50 HydrophobicContact CE1-CB 4.42Å; F46-N50 WeakPolarHBondContact O-CB 3.23Å; F46-N50 PolarHBondContact O-N 3.3Å; F46-N50 PolarHBondContact O-ND2 3.42Å; L47-N50 CarbonylContact O-C 3.41Å; L47-N50 PolarHBondContact O-N 3.45Å; N50-C52 PolarHBondContact O-N 3.35Å; N50-V53 HydrophobicContact CB-CG2 4.33Å; N50-V53 PolarHBondContact O-N 3.07Å
51S92.1Very high94.6Very high119 Ų11995.2 Ų95.283%0.83249%0.491SS*.THydrogen-bonded Turntrans-61.8-5.8-176.8590000116
52C95Very high94.5Very high119 Ų11993.4 Ų93.480%0.80448%0.484SS*.THydrogen-bonded Turntrans-85.4-7.9169.856.50000114.2N50N50-C52 PolarHBondContact O-N 3.35Å
53V95.1Very high94.5Very high44 Ų4492 Ų9227%0.26748%0.477SS..SBendtrans-109.8119.6176.6-177.40000108.8L47 N50 L58L47-V53 HydrophobicContact CD2-CG1 4.42Å; L47-V53 WeakPolarHBondContact CD2-O 3.41Å; N50-V53 HydrophobicContact CB-CG2 4.33Å; N50-V53 PolarHBondContact O-N 3.07Å; V53-L58 HydrophobicContact CG1-CB 4.04Å
54D93.1Very high94.5Very high79 Ų7994.6 Ų94.642%0.42248%0.484SS..  trans-88.9164.7173.975.6-82.6000112.1Y56 T57 L58D54-Y56 VanDerWaalsContact C-N 3.31Å; D54-Y56 PolarHBondContact O-N 3.07Å; D54-Y56 WeakPolarHBondContact OD2-CA 3.48Å; D54-Y56 VanDerWaalsContact OD2-CB 3.23Å; D54-Y56 WeakPolarHBondContact OD2-CB 3.46Å; D54-Y56 PolarHBondContact OD2-N 3.33Å; D54-T57 PolarHBondContact O-N 3.23Å; D54-T57 WeakPolarHBondContact OD1-CB 3.38Å; D54-T57 PolarHBondContact OD1-OG1 3.44Å; D54-T57 PolarHBondContact OD2-N 3.4Å; D54-L58 WeakPolarHBondContact O-CB 3.33Å; D54-L58 PolarHBondContact O-N 3Å
55L92.3Very high94.5Very high118 Ų11889.3 Ų89.362%0.61847%0.468SS*.Hα-helixtrans-63-32.4-177.1-177.265.4000113.5L47 N59L47-L55 HydrophobicContact CD1-CD1 3.84Å; L55-N59 VanDerWaalsContact O-CB 3.31Å; L55-N59 WeakPolarHBondContact O-CB 3.5Å; L55-N59 PolarHBondContact O-N 3.29Å
56Y93.3Very high94.4Very high180 Ų18091.3 Ų91.371%0.70647%0.47SS*.Hα-helixtrans-74.2-45.1179.7-178.7-86000110.7D54 L58 N59 D60D54-Y56 VanDerWaalsContact C-N 3.31Å; D54-Y56 PolarHBondContact O-N 3.07Å; D54-Y56 WeakPolarHBondContact OD2-CA 3.48Å; D54-Y56 VanDerWaalsContact OD2-CB 3.23Å; D54-Y56 WeakPolarHBondContact OD2-CB 3.46Å; D54-Y56 PolarHBondContact OD2-N 3.33Å; Y56-L58 VanDerWaalsContact C-N 3.34Å; Y56-L58 PolarHBondContact O-N 2.99Å; Y56-N59 PolarHBondContact O-N 3.35Å; Y56-D60 WeakPolarHBondContact O-CB 3.49Å; Y56-D60 PolarHBondContact O-N 2.98Å
57T94.8Very high94.2Very high73 Ų7393.2 Ų93.245%0.44848%0.48SS..Hα-helixtrans-61.6-41.3174.2-60.30000111.7D54 D60 Y61D54-T57 PolarHBondContact O-N 3.23Å; D54-T57 WeakPolarHBondContact OD1-CB 3.38Å; D54-T57 PolarHBondContact OD1-OG1 3.44Å; D54-T57 PolarHBondContact OD2-N 3.4Å; T57-D60 PolarHBondContact O-N 3.42Å; T57-Y61 WeakPolarHBondContact O-CB 3.18Å; T57-Y61 PolarHBondContact O-N 3.16Å
58L94.7Very high94Very high28 Ų2894 Ų9415%0.14749%0.489CS..Hα-helixtrans-62.6-44.6174.8-178.659.4000111.7T43 F46 L47 V53 D54 Y56 Y61 V62T43-L58 HydrophobicContact CG2-CD2 4.07Å; F46-L58 HydrophobicContact CD1-CD1 4.47Å; F46-L58 HydrophobicContact CD1-CD2 4.14Å; F46-L58 HydrophobicContact CE1-CD1 4.16Å; L47-L58 HydrophobicContact CD1-CD2 4.18Å; L47-L58 HydrophobicContact CD2-CB 4.39Å; L47-L58 HydrophobicContact CD2-CD2 3.76Å; L47-L58 HydrophobicContact CG-CD2 3.88Å; V53-L58 HydrophobicContact CG1-CB 4.04Å; D54-L58 WeakPolarHBondContact O-CB 3.33Å; D54-L58 PolarHBondContact O-N 3Å; Y56-L58 VanDerWaalsContact C-N 3.34Å; Y56-L58 PolarHBondContact O-N 2.99Å; L58-Y61 PolarHBondContact O-N 3.07Å; L58-V62 HydrophobicContact CD1-CG2 4.27Å; L58-V62 VanDerWaalsContact O-CG2 3.32Å; L58-V62 WeakPolarHBondContact O-CG2 3.3Å; L58-V62 PolarHBondContact O-N 2.99Å
59N94.9Very high93.8Very high82 Ų8288.5 Ų88.544%0.43947%0.471SS..Hα-helixtrans-64.5-44.4177.817779.9000112.3L55 Y56 Y61 V62 Q63L55-N59 VanDerWaalsContact O-CB 3.31Å; L55-N59 WeakPolarHBondContact O-CB 3.5Å; L55-N59 PolarHBondContact O-N 3.29Å; Y56-N59 PolarHBondContact O-N 3.35Å; N59-Y61 VanDerWaalsContact C-N 3.31Å; N59-Y61 PolarHBondContact O-N 3.48Å; N59-V62 PolarHBondContact O-N 3.42Å; N59-Q63 VanDerWaalsContact O-CG 3.29Å; N59-Q63 WeakPolarHBondContact O-CG 3.38Å; N59-Q63 PolarHBondContact O-N 2.84Å
60D95.8Very high93.4Very high60 Ų6084.5 Ų84.532%0.32146%0.461SS..Hα-helixtrans-59.3-40.2175.8169.683.3000112.2Y56 T57 K64Y56-D60 WeakPolarHBondContact O-CB 3.49Å; Y56-D60 PolarHBondContact O-N 2.98Å; T57-D60 PolarHBondContact O-N 3.42Å; D60-K64 WeakPolarHBondContact O-CD 3.48Å; D60-K64 WeakPolarHBondContact O-CG 3.5Å; D60-K64 PolarHBondContact O-N 3.47Å; D60-K64 WeakPolarHBondContact OD1-CE 3.22Å; D60-K64 IonicContact OD1-NZ 3.34Å; D60-K64 PolarHBondContact OD1-NZ 3.49Å; D60-K64 IonicContact OD2-NZ 2.68Å; D60-K64 PolarHBondContact OD2-NZ 2.84Å
61Y93.4Very high92.9Very high122 Ų12284.9 Ų84.948%0.47847%0.47SS..Hα-helixtrans-65.1-48172.8179.4-105.2000112.2T57 L58 N59 Q63 K64 V65T57-Y61 WeakPolarHBondContact O-CB 3.18Å; T57-Y61 PolarHBondContact O-N 3.16Å; L58-Y61 PolarHBondContact O-N 3.07Å; N59-Y61 VanDerWaalsContact C-N 3.31Å; N59-Y61 PolarHBondContact O-N 3.48Å; Y61-Q63 VanDerWaalsContact C-N 3.34Å; Y61-Q63 PolarHBondContact O-N 2.95Å; Y61-K64 PolarHBondContact O-N 3.07Å; Y61-V65 HydrophobicContact CD1-CG2 4.31Å; Y61-V65 HydrophobicContact CE1-CG2 3.85Å; Y61-V65 HydrophobicContact CE2-CG2 4.18Å; Y61-V65 WeakPolarHBondContact O-CG2 3.35Å; Y61-V65 PolarHBondContact O-N 3.07Å
62V94Very high92.6Very high64 Ų6480.9 Ų80.939%0.38845%0.448SS..Hα-helixtrans-61.3-40.8179168.80000111.6L58 N59 K64 V65 L66L58-V62 HydrophobicContact CD1-CG2 4.27Å; L58-V62 VanDerWaalsContact O-CG2 3.32Å; L58-V62 WeakPolarHBondContact O-CG2 3.3Å; L58-V62 PolarHBondContact O-N 2.99Å; N59-V62 PolarHBondContact O-N 3.42Å; V62-K64 PolarHBondContact O-N 3.11Å; V62-V65 PolarHBondContact O-N 3.27Å; V62-L66 HydrophobicContact CG1-CD1 3.91Å; V62-L66 HydrophobicContact CG1-CG 4.33Å; V62-L66 VanDerWaalsContact O-CG 3.31Å; V62-L66 WeakPolarHBondContact O-CG 3.33Å; V62-L66 PolarHBondContact O-N 3.08Å
63Q95.2Very high92.1Very high92 Ų9278.4 Ų78.443%0.4343%0.429SS..Hα-helixtrans-59.9-44.8174.6-69.1-63.2-33.800111.5N59 Y61 V65 L66 E67N59-Q63 VanDerWaalsContact O-CG 3.29Å; N59-Q63 WeakPolarHBondContact O-CG 3.38Å; N59-Q63 PolarHBondContact O-N 2.84Å; Y61-Q63 VanDerWaalsContact C-N 3.34Å; Y61-Q63 PolarHBondContact O-N 2.95Å; Q63-V65 VanDerWaalsContact C-N 3.32Å; Q63-V65 PolarHBondContact O-N 3.02Å; Q63-L66 PolarHBondContact O-N 3.39Å; Q63-E67 WeakPolarHBondContact O-CG 3.48Å; Q63-E67 PolarHBondContact O-N 2.84Å
64K94.1Very high91.6Very high103 Ų10380 Ų8045%0.44844%0.436SS..Hα-helixtrans-65.5-33.2177.5-71.3164.2-172.2165.20113.2D60 Y61 V62 S68D60-K64 WeakPolarHBondContact O-CD 3.48Å; D60-K64 WeakPolarHBondContact O-CG 3.5Å; D60-K64 PolarHBondContact O-N 3.47Å; D60-K64 WeakPolarHBondContact OD1-CE 3.22Å; D60-K64 IonicContact OD1-NZ 3.34Å; D60-K64 PolarHBondContact OD1-NZ 3.49Å; D60-K64 IonicContact OD2-NZ 2.68Å; D60-K64 PolarHBondContact OD2-NZ 2.84Å; Y61-K64 PolarHBondContact O-N 3.07Å; V62-K64 PolarHBondContact O-N 3.11Å; K64-S68 WeakPolarHBondContact O-CB 3.17Å; K64-S68 PolarHBondContact O-N 3.27Å; K64-S68 VanDerWaalsContact O-N 3.08Å; K64-S68 PolarHBondContact O-OG 3.44Å
65V93.6Very high91.3Very high35 Ų3577.2 Ų77.221%0.21242%0.424CS..Hα-helixtrans-67-46.5171.7172.80000110.1Y61 V62 Q63 E67 S68 V69 A75Y61-V65 HydrophobicContact CD1-CG2 4.31Å; Y61-V65 HydrophobicContact CE1-CG2 3.85Å; Y61-V65 HydrophobicContact CE2-CG2 4.18Å; Y61-V65 WeakPolarHBondContact O-CG2 3.35Å; Y61-V65 PolarHBondContact O-N 3.07Å; V62-V65 PolarHBondContact O-N 3.27Å; Q63-V65 VanDerWaalsContact C-N 3.32Å; Q63-V65 PolarHBondContact O-N 3.02Å; V65-E67 PolarHBondContact O-N 3.5Å; V65-S68 WeakPolarHBondContact O-CB 3.44Å; V65-S68 PolarHBondContact O-N 3.41Å; V65-S68 VanDerWaalsContact O-N 3.15Å; V65-V69 HydrophobicContact CG1-CG2 4.43Å; V65-V69 WeakPolarHBondContact O-CG2 3.4Å; V65-V69 PolarHBondContact O-N 3Å; V65-A75 HydrophobicContact CG1-CB 3.84Å
66L93Very high90.8Very high99 Ų9976.5 Ų76.552%0.51842%0.418SS..Hα-helixtrans-63.3-39.2177.6-69.7170.6000112.7V62 Q63 S68 G70V62-L66 HydrophobicContact CG1-CD1 3.91Å; V62-L66 HydrophobicContact CG1-CG 4.33Å; V62-L66 VanDerWaalsContact O-CG 3.31Å; V62-L66 WeakPolarHBondContact O-CG 3.33Å; V62-L66 PolarHBondContact O-N 3.08Å; Q63-L66 PolarHBondContact O-N 3.39Å; L66-S68 VanDerWaalsContact C-N 3.35Å; L66-G70 PolarHBondContact O-N 3.35Å
67E92.6Very high90.2Very high135 Ų13568.6 Ų68.663%0.63139%0.389SS*.Hα-helixtrans-61.7-41.4171.7-74.1178.9165.400111.7Q63 V65 G70 A71Q63-E67 WeakPolarHBondContact O-CG 3.48Å; Q63-E67 PolarHBondContact O-N 2.84Å; V65-E67 PolarHBondContact O-N 3.5Å; E67-G70 CarbonylContact O-C 3.56Å; E67-G70 PolarHBondContact O-N 3.43Å; E67-A71 PolarHBondContact O-N 3.05Å
68S90.9Very high89.6Confident55 Ų5568.2 Ų68.239%0.38539%0.394SS..Hα-helixtrans-68.4-43.2178.8-58.30000112.4K64 V65 L66 G70 A71 G72 V73K64-S68 WeakPolarHBondContact O-CB 3.17Å; K64-S68 PolarHBondContact O-N 3.27Å; K64-S68 VanDerWaalsContact O-N 3.08Å; K64-S68 PolarHBondContact O-OG 3.44Å; V65-S68 WeakPolarHBondContact O-CB 3.44Å; V65-S68 PolarHBondContact O-N 3.41Å; V65-S68 VanDerWaalsContact O-N 3.15Å; L66-S68 VanDerWaalsContact C-N 3.35Å; S68-G70 VanDerWaalsContact C-N 3.32Å; S68-A71 WeakPolarHBondContact O-CB 3.46Å; S68-A71 PolarHBondContact O-N 3.33Å; S68-A71 VanDerWaalsContact O-N 3.15Å; S68-G72 PolarHBondContact O-N 3.42Å; S68-V73 WeakPolarHBondContact O-CB 3.47Å; S68-V73 PolarHBondContact O-N 2.94Å
69V89.9Confident89.2Confident73 Ų7371.7 Ų71.744%0.44241%0.411SS..Hα-helixtrans-63-40.8171.3174.50000110.3V65 A71 G72 A75V65-V69 HydrophobicContact CG1-CG2 4.43Å; V65-V69 WeakPolarHBondContact O-CG2 3.4Å; V65-V69 PolarHBondContact O-N 3Å; V69-A71 PolarHBondContact O-N 3.1Å; V69-G72 WeakPolarHBondContact O-CA 3.49Å; V69-G72 PolarHBondContact O-N 3.42Å; V69-A75 HydrophobicContact CG2-CB 3.66Å
70G87.3Confident88.7Confident46 Ų4673 Ų7347%0.47442%0.418SS..Hα-helixtrans-60.4-28.3173.200000113.9L66 E67 S68 G72 K112L66-G70 PolarHBondContact O-N 3.35Å; E67-G70 CarbonylContact O-C 3.56Å; E67-G70 PolarHBondContact O-N 3.43Å; S68-G70 VanDerWaalsContact C-N 3.32Å; G70-G72 VanDerWaalsContact C-N 3.34Å; G70-K112 WeakPolarHBondContact O-CE 3.43Å; G70-K112 PolarHBondContact O-NZ 3.37Å
71A86.9Confident88Confident56 Ų5677.1 Ų77.146%0.46344%0.44SS..Hα-helixtrans-79.5-12170.500000113.8E67 S68 V69 K112E67-A71 PolarHBondContact O-N 3.05Å; S68-A71 WeakPolarHBondContact O-CB 3.46Å; S68-A71 PolarHBondContact O-N 3.33Å; S68-A71 VanDerWaalsContact O-N 3.15Å; V69-A71 PolarHBondContact O-N 3.1Å; A71-K112 WeakPolarHBondContact O-CG 3.27Å
72G83.8Confident87.5Confident36 Ų3674.2 Ų74.237%0.37143%0.43SS..THydrogen-bonded Turntrans95.823.6179.900000114.7S68 V69 G70 N87S68-G72 PolarHBondContact O-N 3.42Å; V69-G72 WeakPolarHBondContact O-CA 3.49Å; V69-G72 PolarHBondContact O-N 3.42Å; G70-G72 VanDerWaalsContact C-N 3.34Å; G72-N87 PolarHBondContact O-ND2 3.36Å
73V85.9Confident86.9Confident66 Ų6677.4 Ų77.440%0.445%0.449SS..  trans-90132.7174.1-176.30000110.1S68 A75S68-V73 WeakPolarHBondContact O-CB 3.47Å; S68-V73 PolarHBondContact O-N 2.94Å; V73-A75 PolarHBondContact O-N 3.44Å
74D84.4Confident86Confident77 Ų7781.1 Ų81.141%0.41246%0.464SS..  trans-69.2110.4167.6176.72.1000110.2E76 A77 A78D74-E76 WeakPolarHBondContact OD1-CA 3.43Å; D74-E76 WeakPolarHBondContact OD1-CB 3.42Å; D74-E76 PolarHBondContact OD1-N 3.49Å; D74-A77 HydrophobicContact CB-CB 3.91Å; D74-A77 VanDerWaalsContact CG-CB 3.47Å; D74-A77 PolarHBondContact OD1-N 2.87Å; D74-A77 WeakPolarHBondContact OD2-CB 3.34Å; D74-A77 PolarHBondContact OD2-N 3.18Å; D74-A78 WeakPolarHBondContact O-CB 3.48Å; D74-A78 PolarHBondContact O-N 2.92Å; D74-A78 VanDerWaalsContact O-N 3.15Å
75A85.9Confident85.1Confident22 Ų2279.9 Ų79.918%0.18247%0.473CS..Hα-helixtrans-72.6-29.9177.400000113.2V65 V69 V73 A78 I79V65-A75 HydrophobicContact CG1-CB 3.84Å; V69-A75 HydrophobicContact CG2-CB 3.66Å; V73-A75 PolarHBondContact O-N 3.44Å; A75-A78 PolarHBondContact O-N 3.06Å; A75-I79 VanDerWaalsContact O-CB 3.28Å; A75-I79 WeakPolarHBondContact O-CB 3.3Å; A75-I79 WeakPolarHBondContact O-CD1 3.48Å; A75-I79 WeakPolarHBondContact O-CG1 3.39Å; A75-I79 PolarHBondContact O-N 3.05Å
76E82.2Confident84.5Confident103 Ų10381.6 Ų81.648%0.48148%0.484SS..Hα-helixtrans-68.5-46.9175.4-166.1-159.9106.100109.8D74 A78 I79 L80 K82D74-E76 WeakPolarHBondContact OD1-CA 3.43Å; D74-E76 WeakPolarHBondContact OD1-CB 3.42Å; D74-E76 PolarHBondContact OD1-N 3.49Å; E76-A78 VanDerWaalsContact C-N 3.3Å; E76-A78 PolarHBondContact O-N 2.78Å; E76-I79 PolarHBondContact O-N 3.37Å; E76-L80 HydrophobicContact CG-CD1 3.71Å; E76-L80 HydrophobicContact CG-CG 4.11Å; E76-L80 VanDerWaalsContact O-CB 3.3Å; E76-L80 WeakPolarHBondContact O-CB 3.44Å; E76-L80 WeakPolarHBondContact O-CG 3.45Å; E76-L80 PolarHBondContact O-N 2.89Å; E76-K82 VanDerWaalsContact OE1-CE 3.29Å; E76-K82 WeakPolarHBondContact OE1-CE 3.5Å; E76-K82 IonicContact OE1-NZ 3.4Å; E76-K82 PolarHBondContact OE1-NZ 2.99Å
77A81.9Confident84Confident13 Ų1380 Ų8011%0.10748%0.476CS..Hα-helixtrans-56.2-44.1173.200000112.3D74 N81 K82D74-A77 HydrophobicContact CB-CB 3.91Å; D74-A77 VanDerWaalsContact CG-CB 3.47Å; D74-A77 PolarHBondContact OD1-N 2.87Å; D74-A77 WeakPolarHBondContact OD2-CB 3.34Å; D74-A77 PolarHBondContact OD2-N 3.18Å; A77-N81 WeakPolarHBondContact O-CA 3.31Å; A77-N81 PolarHBondContact O-N 3.05Å; A77-K82 HydrophobicContact CB-CB 3.91Å; A77-K82 HydrophobicContact CB-CD 4.01Å; A77-K82 HydrophobicContact CB-CG 4.31Å; A77-K82 PolarHBondContact O-N 3.41Å
78A82.2Confident83.8Confident65 Ų6579.4 Ų79.454%0.53747%0.468SS..Hα-helixtrans-65.6-44.2178.100000112.9D74 A75 E76 N81D74-A78 WeakPolarHBondContact O-CB 3.48Å; D74-A78 PolarHBondContact O-N 2.92Å; D74-A78 VanDerWaalsContact O-N 3.15Å; A75-A78 PolarHBondContact O-N 3.06Å; E76-A78 VanDerWaalsContact C-N 3.3Å; E76-A78 PolarHBondContact O-N 2.78Å; A78-N81 PolarHBondContact O-N 3.25Å
79I84.6Confident83.5Confident101 Ų10179.7 Ų79.752%0.51847%0.465SS..Hα-helixtrans-71.1-39.5-178.7-70.5166.1000111.6A75 E76 N81A75-I79 VanDerWaalsContact O-CB 3.28Å; A75-I79 WeakPolarHBondContact O-CB 3.3Å; A75-I79 WeakPolarHBondContact O-CD1 3.48Å; A75-I79 WeakPolarHBondContact O-CG1 3.39Å; A75-I79 PolarHBondContact O-N 3.05Å; E76-I79 PolarHBondContact O-N 3.37Å; I79-N81 VanDerWaalsContact C-N 3.25Å; I79-N81 PolarHBondContact O-N 2.9Å
80L86.1Confident83.3Confident109 Ų10982.8 Ų82.857%0.57148%0.478SS*.THydrogen-bonded Turntrans-82.60.9176.8-61.1-174.7000113.4E76 K82E76-L80 HydrophobicContact CG-CD1 3.71Å; E76-L80 HydrophobicContact CG-CG 4.11Å; E76-L80 VanDerWaalsContact O-CB 3.3Å; E76-L80 WeakPolarHBondContact O-CB 3.44Å; E76-L80 WeakPolarHBondContact O-CG 3.45Å; E76-L80 PolarHBondContact O-N 2.89Å; L80-K82 VanDerWaalsContact C-N 3.25Å; L80-K82 HydrophobicContact CB-CG 4.3Å; L80-K82 PolarHBondContact O-N 3.26Å
81N81Confident83.1Confident148 Ų14882.8 Ų82.879%0.79147%0.473SS*.THydrogen-bonded Turntrans54.938.2-177.8-163.528000113.1A77 A78 I79A77-N81 WeakPolarHBondContact O-CA 3.31Å; A77-N81 PolarHBondContact O-N 3.05Å; A78-N81 PolarHBondContact O-N 3.25Å; I79-N81 VanDerWaalsContact C-N 3.25Å; I79-N81 PolarHBondContact O-N 2.9Å
82K82.6Confident82.9Confident61 Ų6181 Ų8127%0.26546%0.458SS..PPolyproline II helixtrans-66.9159.2166.9-57.2-177.4-162.7166.50109.3E76 A77 L80 E224E76-K82 VanDerWaalsContact OE1-CE 3.29Å; E76-K82 WeakPolarHBondContact OE1-CE 3.5Å; E76-K82 IonicContact OE1-NZ 3.4Å; E76-K82 PolarHBondContact OE1-NZ 2.99Å; A77-K82 HydrophobicContact CB-CB 3.91Å; A77-K82 HydrophobicContact CB-CD 4.01Å; A77-K82 HydrophobicContact CB-CG 4.31Å; A77-K82 PolarHBondContact O-N 3.41Å; L80-K82 VanDerWaalsContact C-N 3.25Å; L80-K82 HydrophobicContact CB-CG 4.3Å; L80-K82 PolarHBondContact O-N 3.26Å; K82-E224 IonicContact NZ-OE1 2.75Å; K82-E224 PolarHBondContact NZ-OE1 3.08Å; K82-E224 IonicContact NZ-OE2 3.45Å; K82-E224 PolarHBondContact NZ-OE2 2.69Å
83T80.5Confident83.2Confident130 Ų13080.7 Ų80.780%0.79845%0.452SS*.PPolyproline II helixtrans-64.1136.9170.647.60000111.4A85T83-A85 PolarHBondContact O-N 3.4Å
84F77.1Confident83.4Confident170 Ų17082.7 Ų82.775%0.74646%0.459SS*.PPolyproline II helixtrans-55.8118.1175.3171.9-98.6000112
85A74.5Confident83.5Confident77 Ų7780.4 Ų80.464%0.63645%0.446SS*.PPolyproline II helixtrans-95.6150.5165.600000110.1T83T83-A85 PolarHBondContact O-N 3.4Å
86T81.8Confident83.8Confident72 Ų7280.6 Ų80.644%0.44244%0.443SS..  trans-110.1122.1178.4178.80000111.5W88 D89T86-W88 PolarHBondContact O-N 3.14Å; T86-W88 PolarHBondContact OG1-N 3.26Å; T86-W88 VanDerWaalsContact OG1-N 3.15Å; T86-D89 HydrophobicContact CG2-CB 4.38Å
87N81.8Confident84.4Confident65 Ų6577.2 Ų77.235%0.34843%0.43SS..THydrogen-bonded Turntrans-73.1-1.5172.1-59.1-19.6000112.4G72 S92 I109G72-N87 PolarHBondContact O-ND2 3.36Å; N87-S92 WeakPolarHBondContact O-CB 3.46Å; N87-I109 HydrophobicContact CB-CD1 4.04Å; N87-I109 HydrophobicContact CB-CG1 4.19Å
88W87.9Confident84.9Confident122 Ų12276.7 Ų76.746%0.46243%0.427SS..THydrogen-bonded Turntrans-116.540178.3-64.796.7000111.9T86 A93 F96 I109T86-W88 PolarHBondContact O-N 3.14Å; T86-W88 PolarHBondContact OG1-N 3.26Å; T86-W88 VanDerWaalsContact OG1-N 3.15Å; W88-A93 HydrophobicContact CE3-CB 4.31Å; W88-F96 AromaticContact CH2-CD1 3.79Å; W88-F96 HydrophobicContact CH2-CD1 3.79Å; W88-F96 HydrophobicContact CH2-CD2 4.26Å; W88-F96 AromaticContact CH2-CE1 3.82Å; W88-F96 HydrophobicContact CH2-CE1 3.82Å; W88-F96 HydrophobicContact CH2-CE2 4.29Å; W88-F96 HydrophobicContact CH2-CG 4.03Å; W88-F96 HydrophobicContact CH2-CZ 4.1Å; W88-F96 HydrophobicContact CZ3-CB 4.49Å; W88-F96 AromaticContact CZ3-CD1 3.57Å; W88-F96 HydrophobicContact CZ3-CD1 3.57Å; W88-F96 AromaticContact CZ3-CE1 3.96Å; W88-F96 HydrophobicContact CZ3-CE1 3.96Å; W88-F96 AromaticContact CZ3-CG 3.97Å; W88-F96 HydrophobicContact CZ3-CG 3.97Å; W88-I109 HydrophobicContact CD2-CG2 4.19Å; W88-I109 HydrophobicContact CE3-CG2 4.42Å; W88-I109 HydrophobicContact CH2-CG2 3.63Å; W88-I109 HydrophobicContact CZ2-CG2 3.33Å; W88-I109 HydrophobicContact CZ3-CG2 4.16Å
89D85.5Confident85.4Confident61 Ų6173.9 Ų73.933%0.32640%0.403SS..SBendtrans-67.2169.6162.690.2-80.1000111T86 A91 S92 A93T86-D89 HydrophobicContact CG2-CB 4.38Å; D89-A91 PolarHBondContact O-N 3.36Å; D89-A91 WeakPolarHBondContact OD2-CA 3.35Å; D89-A91 WeakPolarHBondContact OD2-CB 3.25Å; D89-A91 PolarHBondContact OD2-N 2.97Å; D89-S92 PolarHBondContact O-N 3.19Å; D89-S92 WeakPolarHBondContact OD1-CB 3.36Å; D89-S92 PolarHBondContact OD1-N 3.15Å; D89-S92 VanDerWaalsContact OD1-N 3.13Å; D89-S92 PolarHBondContact OD1-OG 3.48Å; D89-A93 WeakPolarHBondContact O-CB 3.43Å; D89-A93 PolarHBondContact O-N 2.95Å
90I85.8Confident86Confident139 Ų13970.1 Ų70.171%0.71338%0.383SS*.Hα-helixtrans-63.1-38.8-175.2-60.6174.4000112L94I90-L94 HydrophobicContact CG2-CD1 4.1Å; I90-L94 WeakPolarHBondContact O-CB 3.42Å; I90-L94 WeakPolarHBondContact O-CD1 3.47Å; I90-L94 WeakPolarHBondContact O-CG 3.11Å; I90-L94 PolarHBondContact O-N 3.39Å
91A82.7Confident86.5Confident45 Ų4566.7 Ų66.737%0.37237%0.365SS..Hα-helixtrans-71.5-44.4179.600000111.8D89 L94 F95D89-A91 PolarHBondContact O-N 3.36Å; D89-A91 WeakPolarHBondContact OD2-CA 3.35Å; D89-A91 WeakPolarHBondContact OD2-CB 3.25Å; D89-A91 PolarHBondContact OD2-N 2.97Å; A91-L94 PolarHBondContact O-N 3.33Å; A91-F95 WeakPolarHBondContact O-CB 3.37Å; A91-F95 PolarHBondContact O-N 2.87Å
92S83Confident87.2Confident20 Ų2059.9 Ų59.914%0.1433%0.329CS..Hα-helixtrans-71.1-34.2178.2-52.20000112.1N87 D89 F95 F96N87-S92 WeakPolarHBondContact O-CB 3.46Å; D89-S92 PolarHBondContact O-N 3.19Å; D89-S92 WeakPolarHBondContact OD1-CB 3.36Å; D89-S92 PolarHBondContact OD1-N 3.15Å; D89-S92 VanDerWaalsContact OD1-N 3.13Å; D89-S92 PolarHBondContact OD1-OG 3.48Å; S92-F95 PolarHBondContact O-N 3.24Å; S92-F96 WeakPolarHBondContact O-CB 3.46Å; S92-F96 PolarHBondContact O-N 3.3Å
93A90.3Very high87.8Confident29 Ų2960.4 Ų60.424%0.2434%0.337CS..Hα-helixtrans-66.7-35.9171.600000112.8W88 D89 S97W88-A93 HydrophobicContact CE3-CB 4.31Å; D89-A93 WeakPolarHBondContact O-CB 3.43Å; D89-A93 PolarHBondContact O-N 2.95Å; A93-S97 WeakPolarHBondContact O-CB 3.32Å; A93-S97 PolarHBondContact O-N 3.47Å; A93-S97 PolarHBondContact O-OG 3.22Å
94L89.1Confident88.5Confident107 Ų10754.5 Ų54.556%0.5630%0.301SS*.Hα-helixtrans-66.9-43.2170.9-78169.2000111.5I90 A91 S97 G98I90-L94 HydrophobicContact CG2-CD1 4.1Å; I90-L94 WeakPolarHBondContact O-CB 3.42Å; I90-L94 WeakPolarHBondContact O-CD1 3.47Å; I90-L94 WeakPolarHBondContact O-CG 3.11Å; I90-L94 PolarHBondContact O-N 3.39Å; A91-L94 PolarHBondContact O-N 3.33Å; L94-S97 WeakPolarHBondContact O-CB 3.27Å; L94-S97 PolarHBondContact O-N 3.24Å; L94-G98 PolarHBondContact O-N 2.97Å
95F87.6Confident89.4Confident29 Ų2948.5 Ų48.513%0.12729%0.287CS..Hα-helixtrans-60.2-48.5175.2-178.4-99.4000112A91 S92 S97 G98 T99 Y106 V219 W244A91-F95 WeakPolarHBondContact O-CB 3.37Å; A91-F95 PolarHBondContact O-N 2.87Å; S92-F95 PolarHBondContact O-N 3.24Å; F95-S97 VanDerWaalsContact C-N 3.35Å; F95-S97 PolarHBondContact O-N 3.02Å; F95-G98 CarbonylContact O-C 3.51Å; F95-G98 WeakPolarHBondContact O-CA 3.36Å; F95-G98 PolarHBondContact O-N 3.42Å; F95-T99 HydrophobicContact CD1-CG2 4.33Å; F95-T99 HydrophobicContact CE1-CG2 4.2Å; F95-T99 PolarHBondContact O-N 2.8Å; F95-Y106 AromaticContact CE1-CD2 3.88Å; F95-Y106 HydrophobicContact CE1-CD2 3.88Å; F95-Y106 AromaticContact CE1-CE2 3.83Å; F95-Y106 HydrophobicContact CE1-CE2 3.83Å; F95-Y106 HydrophobicContact CE2-CE2 4.45Å; F95-Y106 HydrophobicContact CZ-CD2 4.04Å; F95-Y106 AromaticContact CZ-CE2 3.49Å; F95-Y106 HydrophobicContact CZ-CE2 3.49Å; F95-Y106 VanDerWaalsContact CZ-CE2 3.49Å; F95-V219 HydrophobicContact CE1-CG1 3.63Å; F95-V219 HydrophobicContact CZ-CG1 3.84Å; F95-W244 AromaticContact CD2-NE1 3.86Å
96F91.2Very high90.2Very high27 Ų2745.2 Ų45.212%0.11826%0.258CS..Hα-helixtrans-57.7-42.8172.5170-95.8000112.6W88 S92 G98 T99 I100 I109 P111W88-F96 AromaticContact CH2-CD1 3.79Å; W88-F96 HydrophobicContact CH2-CD1 3.79Å; W88-F96 HydrophobicContact CH2-CD2 4.26Å; W88-F96 AromaticContact CH2-CE1 3.82Å; W88-F96 HydrophobicContact CH2-CE1 3.82Å; W88-F96 HydrophobicContact CH2-CE2 4.29Å; W88-F96 HydrophobicContact CH2-CG 4.03Å; W88-F96 HydrophobicContact CH2-CZ 4.1Å; W88-F96 HydrophobicContact CZ3-CB 4.49Å; W88-F96 AromaticContact CZ3-CD1 3.57Å; W88-F96 HydrophobicContact CZ3-CD1 3.57Å; W88-F96 AromaticContact CZ3-CE1 3.96Å; W88-F96 HydrophobicContact CZ3-CE1 3.96Å; W88-F96 AromaticContact CZ3-CG 3.97Å; W88-F96 HydrophobicContact CZ3-CG 3.97Å; S92-F96 WeakPolarHBondContact O-CB 3.46Å; S92-F96 PolarHBondContact O-N 3.3Å; F96-G98 PolarHBondContact O-N 3.06Å; F96-T99 PolarHBondContact O-N 3.41Å; F96-T99 PolarHBondContact O-OG1 3.5Å; F96-I100 HydrophobicContact CD1-CD1 4.18Å; F96-I100 HydrophobicContact CE1-CD1 3.49Å; F96-I100 VanDerWaalsContact CE1-CD1 3.49Å; F96-I100 HydrophobicContact CE1-CG1 4.45Å; F96-I100 HydrophobicContact CE2-CD1 4.4Å; F96-I100 HydrophobicContact CZ-CD1 3.6Å; F96-I100 HydrophobicContact CZ-CG1 4.22Å; F96-I100 PolarHBondContact O-N 3.39Å; F96-I109 HydrophobicContact CD2-CB 4.46Å; F96-I109 HydrophobicContact CD2-CG2 4.18Å; F96-I109 WeakPolarHBondContact CD2-O 3.34Å; F96-I109 VanDerWaalsContact CE2-O 3.26Å; F96-I109 WeakPolarHBondContact CE2-O 3.43Å; F96-I109 HydrophobicContact CG-CG2 4.48Å; F96-P111 HydrophobicContact CZ-CG 4.2Å
97S94.5Very high90.6Very high31 Ų3143.7 Ų43.722%0.21726%0.257CS..Hα-helixtrans-60-32.7172.8-57.40000111.5A93 L94 F95 M101 F123A93-S97 WeakPolarHBondContact O-CB 3.32Å; A93-S97 PolarHBondContact O-N 3.47Å; A93-S97 PolarHBondContact O-OG 3.22Å; L94-S97 WeakPolarHBondContact O-CB 3.27Å; L94-S97 PolarHBondContact O-N 3.24Å; F95-S97 VanDerWaalsContact C-N 3.35Å; F95-S97 PolarHBondContact O-N 3.02Å; S97-M101 WeakPolarHBondContact O-CG 3.48Å; S97-M101 PolarHBondContact O-N 2.98Å; S97-F123 WeakPolarHBondContact O-CE1 3.23Å
98G92.9Very high90.8Very high3 Ų343.1 Ų43.13%0.03125%0.254CS..Hα-helixtrans-65.1-48.9171.200000114.4L94 F95 F96 I100 M101 T102L94-G98 PolarHBondContact O-N 2.97Å; F95-G98 CarbonylContact O-C 3.51Å; F95-G98 WeakPolarHBondContact O-CA 3.36Å; F95-G98 PolarHBondContact O-N 3.42Å; F96-G98 PolarHBondContact O-N 3.06Å; G98-I100 PolarHBondContact O-N 3.17Å; G98-M101 PolarHBondContact O-N 3.47Å; G98-T102 WeakPolarHBondContact O-CB 3.27Å; G98-T102 WeakPolarHBondContact O-CG2 3.37Å; G98-T102 PolarHBondContact O-N 2.93Å; G98-T102 PolarHBondContact O-OG1 3.06Å
99T93.9Very high90.8Very high6 Ų638 Ų384%0.03724%0.235CC..Hα-helixtrans-60.2-29.9-178.266.90000112.2F95 F96 T102 T103 I104 G105 Y106F95-T99 HydrophobicContact CD1-CG2 4.33Å; F95-T99 HydrophobicContact CE1-CG2 4.2Å; F95-T99 PolarHBondContact O-N 2.8Å; F96-T99 PolarHBondContact O-N 3.41Å; F96-T99 PolarHBondContact O-OG1 3.5Å; T99-T102 WeakPolarHBondContact CA-OG1 3.45Å; T99-T102 PolarHBondContact O-OG1 2.82Å; T99-T103 PolarHBondContact O-N 3.42Å; T99-I104 PolarHBondContact O-N 2.87Å; T99-I104 VanDerWaalsContact O-N 3.11Å; T99-G105 PolarHBondContact O-N 3.06Å; T99-Y106 HydrophobicContact CG2-CD2 3.44Å; T99-Y106 VanDerWaalsContact CG2-CD2 3.44Å; T99-Y106 HydrophobicContact CG2-CE2 3.84Å; T99-Y106 HydrophobicContact CG2-CG 4.4Å
100I96.4Very high91.1Very high22 Ų2236.9 Ų36.911%0.11323%0.232CC..Hα-helixtrans-67.8-55.4169.4-60.5163.4000111.2F96 G98 T102 T103 C120 F123 A124 I128F96-I100 HydrophobicContact CD1-CD1 4.18Å; F96-I100 HydrophobicContact CE1-CD1 3.49Å; F96-I100 VanDerWaalsContact CE1-CD1 3.49Å; F96-I100 HydrophobicContact CE1-CG1 4.45Å; F96-I100 HydrophobicContact CE2-CD1 4.4Å; F96-I100 HydrophobicContact CZ-CD1 3.6Å; F96-I100 HydrophobicContact CZ-CG1 4.22Å; F96-I100 PolarHBondContact O-N 3.39Å; G98-I100 PolarHBondContact O-N 3.17Å; I100-T102 VanDerWaalsContact C-N 3.32Å; I100-T102 PolarHBondContact O-N 2.95Å; I100-T103 PolarHBondContact O-N 3.46Å; I100-T103 VanDerWaalsContact O-N 3.11Å; I100-C120 VanDerWaalsContact CD1-SG 3.56Å; I100-F123 HydrophobicContact CB-CD1 4.3Å; I100-F123 HydrophobicContact CB-CE1 4.25Å; I100-F123 HydrophobicContact CD1-CD1 4.02Å; I100-F123 HydrophobicContact CD1-CE1 4.34Å; I100-F123 HydrophobicContact CG2-CD1 3.95Å; I100-F123 HydrophobicContact CG2-CE1 4.29Å; I100-A124 HydrophobicContact CG2-CB 3.6Å; I100-I128 WeakPolarHBondContact O-CG1 3.45Å
101M95.9Very high91.4Very high37 Ų3731.6 Ų31.618%0.18221%0.207CC..Hα-helixtrans-62.6-37.4-175.6-72.8-171.8-67.100113S97 G98 T103 F123 M130 F131 W244S97-M101 WeakPolarHBondContact O-CG 3.48Å; S97-M101 PolarHBondContact O-N 2.98Å; G98-M101 PolarHBondContact O-N 3.47Å; M101-T103 VanDerWaalsContact C-N 3.29Å; M101-F123 HydrophobicContact CE-CZ 4.26Å; M101-F123 HydrophobicContact CG-CE1 3.79Å; M101-F123 HydrophobicContact CG-CZ 3.9Å; M101-F123 HydrophobicContact SD-CE1 4.4Å; M101-F123 HydrophobicContact SD-CZ 3.89Å; M101-M130 HydrophobicContact SD-CE 3.94Å; M101-F131 HydrophobicContact CB-CB 4.19Å; M101-F131 HydrophobicContact CB-CG 4.44Å; M101-F131 WeakPolarHBondContact O-CB 3.33Å; M101-F131 WeakPolarHBondContact O-CD1 3.49Å; M101-F131 WeakPolarHBondContact O-CG 3.41Å; M101-W244 HydrophobicContact CE-CH2 4.43Å
102T95.3Very high91.9Very high5 Ų534 Ų343%0.03121%0.209CC..THydrogen-bonded Turntrans-79.2-9.5177.659.40000113.5G98 T99 I100 I104 F131 T212 I247 L251G98-T102 WeakPolarHBondContact O-CB 3.27Å; G98-T102 WeakPolarHBondContact O-CG2 3.37Å; G98-T102 PolarHBondContact O-N 2.93Å; G98-T102 PolarHBondContact O-OG1 3.06Å; T99-T102 WeakPolarHBondContact CA-OG1 3.45Å; T99-T102 PolarHBondContact O-OG1 2.82Å; I100-T102 VanDerWaalsContact C-N 3.32Å; I100-T102 PolarHBondContact O-N 2.95Å; T102-I104 HydrophobicContact CG2-CD1 4.35Å; T102-I104 PolarHBondContact O-N 3.12Å; T102-I104 WeakPolarHBondContact OG1-CD1 3.46Å; T102-I104 WeakPolarHBondContact OG1-CG1 3.42Å; T102-I104 PolarHBondContact OG1-N 3.27Å; T102-F131 HydrophobicContact CG2-CE1 4.02Å; T102-F131 HydrophobicContact CG2-CE2 3.94Å; T102-F131 HydrophobicContact CG2-CZ 3.68Å; T102-T212 WeakPolarHBondContact O-CG2 3.34Å; T102-I247 HydrophobicContact CG2-CG2 4.32Å; T102-L251 HydrophobicContact CG2-CD1 3.89Å
103T96.2Very high92.4Very high72 Ų7236.7 Ų36.744%0.44223%0.228SC..THydrogen-bonded Turntrans57.417.9-168.758.30000115.4T99 I100 M101 I128T99-T103 PolarHBondContact O-N 3.42Å; I100-T103 PolarHBondContact O-N 3.46Å; I100-T103 VanDerWaalsContact O-N 3.11Å; M101-T103 VanDerWaalsContact C-N 3.29Å; T103-I128 HydrophobicContact CG2-CB 4.42Å; T103-I128 HydrophobicContact CG2-CD1 3.62Å; T103-I128 HydrophobicContact CG2-CG1 3.74Å; T103-I128 HydrophobicContact CG2-CG2 3.79Å
104I96.1Very high92.7Very high6 Ų641 Ų413%0.03125%0.247CC..  trans-70.3-44.8173.5-63.1166.3000110.7T99 T102 Y106 T209 T212 G214 I247 L251T99-I104 PolarHBondContact O-N 2.87Å; T99-I104 VanDerWaalsContact O-N 3.11Å; T102-I104 HydrophobicContact CG2-CD1 4.35Å; T102-I104 PolarHBondContact O-N 3.12Å; T102-I104 WeakPolarHBondContact OG1-CD1 3.46Å; T102-I104 WeakPolarHBondContact OG1-CG1 3.42Å; T102-I104 PolarHBondContact OG1-N 3.27Å; I104-Y106 HydrophobicContact CG2-CD1 3.8Å; I104-Y106 HydrophobicContact CG2-CD2 4.33Å; I104-Y106 HydrophobicContact CG2-CE1 3.51Å; I104-Y106 HydrophobicContact CG2-CE2 4.05Å; I104-Y106 HydrophobicContact CG2-CG 4.2Å; I104-Y106 PolarHBondContact O-N 3.14Å; I104-T209 HydrophobicContact CD1-CG2 4.06Å; I104-T212 HydrophobicContact CG1-CG2 3.98Å; I104-G214 WeakPolarHBondContact O-CA 3.21Å; I104-I247 HydrophobicContact CD1-CG2 3.66Å; I104-L251 HydrophobicContact CD1-CD1 4.19Å
105G94.3Very high93.1Very high44 Ų4438.4 Ų38.445%0.45425%0.246SC..  trans61.131.4166.700000118.9T99 G107T99-G105 PolarHBondContact O-N 3.06Å; G105-G107 PolarHBondContact O-N 3.38Å
106Y92.9Very high93.6Very high7 Ų738 Ų383%0.02725%0.25CS..  trans-36.2-36.5-174.6-62.2-58.7000117.1F95 T99 I104 N108 F205 T209 G214 G216 V219F95-Y106 AromaticContact CE1-CD2 3.88Å; F95-Y106 HydrophobicContact CE1-CD2 3.88Å; F95-Y106 AromaticContact CE1-CE2 3.83Å; F95-Y106 HydrophobicContact CE1-CE2 3.83Å; F95-Y106 HydrophobicContact CE2-CE2 4.45Å; F95-Y106 HydrophobicContact CZ-CD2 4.04Å; F95-Y106 AromaticContact CZ-CE2 3.49Å; F95-Y106 HydrophobicContact CZ-CE2 3.49Å; F95-Y106 VanDerWaalsContact CZ-CE2 3.49Å; T99-Y106 HydrophobicContact CG2-CD2 3.44Å; T99-Y106 VanDerWaalsContact CG2-CD2 3.44Å; T99-Y106 HydrophobicContact CG2-CE2 3.84Å; T99-Y106 HydrophobicContact CG2-CG 4.4Å; I104-Y106 HydrophobicContact CG2-CD1 3.8Å; I104-Y106 HydrophobicContact CG2-CD2 4.33Å; I104-Y106 HydrophobicContact CG2-CE1 3.51Å; I104-Y106 HydrophobicContact CG2-CE2 4.05Å; I104-Y106 HydrophobicContact CG2-CG 4.2Å; I104-Y106 PolarHBondContact O-N 3.14Å; Y106-N108 WeakPolarHBondContact CB-OD1 3.06Å; Y106-N108 PolarHBondContact O-N 2.9Å; Y106-N108 VanDerWaalsContact O-N 3.08Å; Y106-F205 HydrophobicContact CE1-CE2 4.07Å; Y106-T209 VanDerWaalsContact OH-CG2 3.24Å; Y106-T209 WeakPolarHBondContact OH-CG2 3.29Å; Y106-T209 PolarHBondContact OH-OG1 2.93Å; Y106-T209 VanDerWaalsContact OH-OG1 3.09Å; Y106-G214 VanDerWaalsContact CA-O 3.31Å; Y106-G214 WeakPolarHBondContact CA-O 3.45Å; Y106-G216 VanDerWaalsContact O-CA 3.3Å; Y106-G216 WeakPolarHBondContact O-CA 3.32Å; Y106-V219 HydrophobicContact CD1-CG2 4.4Å; Y106-V219 HydrophobicContact CD2-CG1 4.32Å; Y106-V219 HydrophobicContact CD2-CG2 4.39Å; Y106-V219 HydrophobicContact CE2-CG1 4.5Å; Y106-V219 HydrophobicContact CG-CG2 4.12Å
107G88.8Confident93.8Very high41 Ų4141 Ų4142%0.42326%0.263SS..  trans82.5-18.817000000116.1G105 I109 S110G105-G107 PolarHBondContact O-N 3.38Å; G107-I109 PolarHBondContact O-N 2.86Å; G107-I109 VanDerWaalsContact O-N 3.15Å; G107-S110 PolarHBondContact O-OG 2.87Å
108N86.7Confident94Very high53 Ų5344.9 Ų44.928%0.28328%0.281SS..SBendtrans-34.8-50.8163.964.8-43.3000112.3Y106 V219 E222Y106-N108 WeakPolarHBondContact CB-OD1 3.06Å; Y106-N108 PolarHBondContact O-N 2.9Å; Y106-N108 VanDerWaalsContact O-N 3.08Å; N108-V219 HydrophobicContact CB-CG2 4.19Å; N108-E222 PolarHBondContact ND2-OE1 3.37Å; N108-E222 PolarHBondContact ND2-OE2 2.92Å
109I87.8Confident94.3Very high13 Ų1351.1 Ų51.17%0.06731%0.307CS..SBendtrans-112.7128.2173.8-64.7165.8000108.1N87 W88 F96 G107 E222N87-I109 HydrophobicContact CB-CD1 4.04Å; N87-I109 HydrophobicContact CB-CG1 4.19Å; W88-I109 HydrophobicContact CD2-CG2 4.19Å; W88-I109 HydrophobicContact CE3-CG2 4.42Å; W88-I109 HydrophobicContact CH2-CG2 3.63Å; W88-I109 HydrophobicContact CZ2-CG2 3.33Å; W88-I109 HydrophobicContact CZ3-CG2 4.16Å; F96-I109 HydrophobicContact CD2-CB 4.46Å; F96-I109 HydrophobicContact CD2-CG2 4.18Å; F96-I109 WeakPolarHBondContact CD2-O 3.34Å; F96-I109 VanDerWaalsContact CE2-O 3.26Å; F96-I109 WeakPolarHBondContact CE2-O 3.43Å; F96-I109 HydrophobicContact CG-CG2 4.48Å; G107-I109 PolarHBondContact O-N 2.86Å; G107-I109 VanDerWaalsContact O-N 3.15Å; I109-E222 WeakPolarHBondContact CD1-OE1 3.43Å
110S91.3Very high94.4Very high38 Ų3852.3 Ų52.327%0.26632%0.316SS..  trans-148.8143.3-176.642.90000112.4G107 K112G107-S110 PolarHBondContact O-OG 2.87Å; S110-K112 WeakPolarHBondContact O-CD 3.36Å; S110-K112 VanDerWaalsContact O-CE 3.23Å; S110-K112 WeakPolarHBondContact O-CE 3.44Å; S110-K112 PolarHBondContact O-N 3.19Å; S110-K112 PolarHBondContact OG-NZ 2.78Å
111P93.5Very high94.5Very high29 Ų2956.1 Ų56.119%0.18834%0.335CS..  trans-75.7109.5-172.428.7-33.5000111.4F96 K117 C120F96-P111 HydrophobicContact CZ-CG 4.2Å; P111-K117 WeakPolarHBondContact O-CE 3.47Å; P111-K117 WeakPolarHBondContact O-CG 3.25Å; P111-C120 HydrophobicContact CG-CB 4.16Å
112K91.8Very high94.6Very high94 Ų9457.8 Ų57.841%0.40935%0.35SS..  trans-81-27.6-177.1-44.5-59.4176.9171.10113.4G70 A71 S110 K117G70-K112 WeakPolarHBondContact O-CE 3.43Å; G70-K112 PolarHBondContact O-NZ 3.37Å; A71-K112 WeakPolarHBondContact O-CG 3.27Å; S110-K112 WeakPolarHBondContact O-CD 3.36Å; S110-K112 VanDerWaalsContact O-CE 3.23Å; S110-K112 WeakPolarHBondContact O-CE 3.44Å; S110-K112 PolarHBondContact O-N 3.19Å; S110-K112 PolarHBondContact OG-NZ 2.78Å; K112-K117 WeakPolarHBondContact O-CE 3.47Å; K112-K117 PolarHBondContact O-NZ 3.18Å
113S94.5Very high94.7Very high77 Ų7760 Ų6054%0.53836%0.359SS..SBendtrans-80.8147178.867.10000112.4G115 G116 K117S113-G115 VanDerWaalsContact C-N 3.34Å; S113-G115 PolarHBondContact O-N 3.4Å; S113-G116 WeakPolarHBondContact O-CA 3.49Å; S113-G116 PolarHBondContact O-N 2.8Å; S113-G116 PolarHBondContact OG-N 2.95Å; S113-K117 WeakPolarHBondContact O-CG 3.42Å; S113-K117 PolarHBondContact O-N 2.95Å
114D96.7Very high94.8Very high120 Ų12057.7 Ų57.764%0.64235%0.347SS*.Hα-helixtrans-68.6-32.6-175-58.5-35.3000113.1G116 K117 L118D114-G116 VanDerWaalsContact C-N 3.33Å; D114-K117 PolarHBondContact O-N 3.2Å; D114-K117 IonicContact OD1-NZ 2.96Å; D114-K117 PolarHBondContact OD1-NZ 3.28Å; D114-L118 WeakPolarHBondContact O-CB 3.23Å; D114-L118 PolarHBondContact O-N 3.23Å
115G97.8Very high94.9Very high53 Ų5363.5 Ų63.555%0.54638%0.377SS..Hα-helixtrans-62.8-38.5168.800000112.6S113 F119S113-G115 VanDerWaalsContact C-N 3.34Å; S113-G115 PolarHBondContact O-N 3.4Å; G115-F119 WeakPolarHBondContact O-CB 3.45Å; G115-F119 PolarHBondContact O-N 3.46Å
116G96.4Very high95.1Very high20 Ų2066.3 Ų66.321%0.20639%0.386CS..Hα-helixtrans-67.1-41.4174.700000112.7S113 D114 C120S113-G116 WeakPolarHBondContact O-CA 3.49Å; S113-G116 PolarHBondContact O-N 2.8Å; S113-G116 PolarHBondContact OG-N 2.95Å; D114-G116 VanDerWaalsContact C-N 3.33Å; G116-C120 VanDerWaalsContact O-CB 3.24Å; G116-C120 WeakPolarHBondContact O-CB 3.38Å; G116-C120 PolarHBondContact O-N 2.81Å
117K97.3Very high95.3Very high89 Ų8966.1 Ų66.139%0.38739%0.386SS..Hα-helixtrans-61.9-48.4173.8-64.1167-159154.20111.3P111 K112 S113 D114 C120 I121P111-K117 WeakPolarHBondContact O-CE 3.47Å; P111-K117 WeakPolarHBondContact O-CG 3.25Å; K112-K117 WeakPolarHBondContact O-CE 3.47Å; K112-K117 PolarHBondContact O-NZ 3.18Å; S113-K117 WeakPolarHBondContact O-CG 3.42Å; S113-K117 PolarHBondContact O-N 2.95Å; D114-K117 PolarHBondContact O-N 3.2Å; D114-K117 IonicContact OD1-NZ 2.96Å; D114-K117 PolarHBondContact OD1-NZ 3.28Å; K117-C120 WeakPolarHBondContact O-CB 3.13Å; K117-C120 PolarHBondContact O-N 3.38Å; K117-I121 WeakPolarHBondContact O-CG1 3.35Å; K117-I121 PolarHBondContact O-N 3.08Å
118L98.1Very high95.7Very high114 Ų11467.4 Ų67.460%0.59738%0.382SS*.Hα-helixtrans-62.8-43.1179.1-178.761.1000111.9D114 I121 C122D114-L118 WeakPolarHBondContact O-CB 3.23Å; D114-L118 PolarHBondContact O-N 3.23Å; L118-I121 PolarHBondContact O-N 2.78Å; L118-C122 PolarHBondContact O-N 2.96Å
119F97.9Very high96.2Very high134 Ų13468.5 Ų68.559%0.58839%0.392SS*.Hα-helixtrans-61.3-45.7173.2178.5-98.9000111.6G115 I121 C122 F123G115-F119 WeakPolarHBondContact O-CB 3.45Å; G115-F119 PolarHBondContact O-N 3.46Å; F119-I121 VanDerWaalsContact C-N 3.33Å; F119-I121 PolarHBondContact O-N 3.13Å; F119-C122 PolarHBondContact O-N 3.36Å; F119-F123 HydrophobicContact CD1-CB 4.42Å; F119-F123 HydrophobicContact CE1-CB 4.09Å; F119-F123 HydrophobicContact CE1-CD2 4.22Å; F119-F123 HydrophobicContact CE1-CG 4.21Å; F119-F123 HydrophobicContact CZ-CB 4.29Å; F119-F123 HydrophobicContact CZ-CD2 4.01Å; F119-F123 HydrophobicContact CZ-CG 4.38Å; F119-F123 WeakPolarHBondContact O-CB 3.47Å; F119-F123 PolarHBondContact O-N 3.36Å
120C97.6Very high96.5Very high31 Ų3173.2 Ų73.221%0.20942%0.415CS..Hα-helixtrans-57.1-42.8178.1-175.20000112.4I100 P111 G116 K117 F123 A124I100-C120 VanDerWaalsContact CD1-SG 3.56Å; P111-C120 HydrophobicContact CG-CB 4.16Å; G116-C120 VanDerWaalsContact O-CB 3.24Å; G116-C120 WeakPolarHBondContact O-CB 3.38Å; G116-C120 PolarHBondContact O-N 2.81Å; K117-C120 WeakPolarHBondContact O-CB 3.13Å; K117-C120 PolarHBondContact O-N 3.38Å; C120-F123 PolarHBondContact O-N 3.14Å; C120-A124 VanDerWaalsContact O-CB 3.29Å; C120-A124 WeakPolarHBondContact O-CB 3.43Å; C120-A124 PolarHBondContact O-N 2.88Å
121I98.1Very high96.7Very high102 Ų10272.3 Ų72.352%0.52341%0.406SS..Hα-helixtrans-59.8-52.4175.7-67.4162.7000110.8K117 L118 F119 F123 A124 L125K117-I121 WeakPolarHBondContact O-CG1 3.35Å; K117-I121 PolarHBondContact O-N 3.08Å; L118-I121 PolarHBondContact O-N 2.78Å; F119-I121 VanDerWaalsContact C-N 3.33Å; F119-I121 PolarHBondContact O-N 3.13Å; I121-F123 VanDerWaalsContact C-N 3.33Å; I121-F123 PolarHBondContact O-N 3.5Å; I121-A124 PolarHBondContact O-N 2.95Å; I121-L125 HydrophobicContact CG2-CD1 4.17Å; I121-L125 WeakPolarHBondContact O-CG 3.41Å; I121-L125 PolarHBondContact O-N 3.04Å
122C98.1Very high96.8Very high72 Ų7272.7 Ų72.749%0.48642%0.416SS..Hα-helixtrans-63.7-38.3179.5-66.80000112.5L118 F119L118-C122 PolarHBondContact O-N 2.96Å; F119-C122 PolarHBondContact O-N 3.36Å
123F98Very high96.9Very high52 Ų5274.5 Ų74.523%0.22843%0.429CS..Hα-helixtrans-68.1-43.6178.9-178.4-98.2000111.8S97 I100 M101 F119 C120 I121 L125 V126 G127S97-F123 WeakPolarHBondContact O-CE1 3.23Å; I100-F123 HydrophobicContact CB-CD1 4.3Å; I100-F123 HydrophobicContact CB-CE1 4.25Å; I100-F123 HydrophobicContact CD1-CD1 4.02Å; I100-F123 HydrophobicContact CD1-CE1 4.34Å; I100-F123 HydrophobicContact CG2-CD1 3.95Å; I100-F123 HydrophobicContact CG2-CE1 4.29Å; M101-F123 HydrophobicContact CE-CZ 4.26Å; M101-F123 HydrophobicContact CG-CE1 3.79Å; M101-F123 HydrophobicContact CG-CZ 3.9Å; M101-F123 HydrophobicContact SD-CE1 4.4Å; M101-F123 HydrophobicContact SD-CZ 3.89Å; F119-F123 HydrophobicContact CD1-CB 4.42Å; F119-F123 HydrophobicContact CE1-CB 4.09Å; F119-F123 HydrophobicContact CE1-CD2 4.22Å; F119-F123 HydrophobicContact CE1-CG 4.21Å; F119-F123 HydrophobicContact CZ-CB 4.29Å; F119-F123 HydrophobicContact CZ-CD2 4.01Å; F119-F123 HydrophobicContact CZ-CG 4.38Å; F119-F123 WeakPolarHBondContact O-CB 3.47Å; F119-F123 PolarHBondContact O-N 3.36Å; C120-F123 PolarHBondContact O-N 3.14Å; I121-F123 VanDerWaalsContact C-N 3.33Å; I121-F123 PolarHBondContact O-N 3.5Å; F123-L125 PolarHBondContact O-N 3.21Å; F123-V126 PolarHBondContact O-N 3.39Å; F123-G127 WeakPolarHBondContact O-CA 3.13Å; F123-G127 PolarHBondContact O-N 2.91Å
124A97.7Very high96.9Very high22 Ų2275 Ų7518%0.18242%0.424CS..Hα-helixtrans-61.1-44.7176.700000112.4I100 C120 I121 V126 G127 I128I100-A124 HydrophobicContact CG2-CB 3.6Å; C120-A124 VanDerWaalsContact O-CB 3.29Å; C120-A124 WeakPolarHBondContact O-CB 3.43Å; C120-A124 PolarHBondContact O-N 2.88Å; I121-A124 PolarHBondContact O-N 2.95Å; A124-V126 PolarHBondContact O-N 2.94Å; A124-G127 PolarHBondContact O-N 2.96Å; A124-I128 HydrophobicContact CB-CD1 4.01Å; A124-I128 WeakPolarHBondContact O-CB 3.4Å; A124-I128 WeakPolarHBondContact O-CG1 3.31Å; A124-I128 PolarHBondContact O-N 2.68Å
125L97.4Very high96.6Very high129 Ų12970.7 Ų70.768%0.67540%0.402SS*.Hα-helixtrans-60.1-28.9-178.9-73.3169.8000113.9I121 F123 P129I121-L125 HydrophobicContact CG2-CD1 4.17Å; I121-L125 WeakPolarHBondContact O-CG 3.41Å; I121-L125 PolarHBondContact O-N 3.04Å; F123-L125 PolarHBondContact O-N 3.21Å; L125-P129 WeakPolarHBondContact O-CD 3.38Å; L125-P129 WeakPolarHBondContact O-CG 3.47Å
126V97.8Very high96.3Very high103 Ų10370.9 Ų70.962%0.62440%0.398SS*.Hα-helixtrans-97.7-40.4176.9-179.70000111.7F123 A124 P129 M130F123-V126 PolarHBondContact O-N 3.39Å; A124-V126 PolarHBondContact O-N 2.94Å; V126-P129 WeakPolarHBondContact O-CD 3.3Å; V126-M130 WeakPolarHBondContact O-CB 3.28Å; V126-M130 PolarHBondContact O-N 2.94Å
127G97.4Very high96Very high3 Ų371.5 Ų71.53%0.03140%0.404CS..Hα-helixtrans-68.3-41.1-174.800000113.7F123 A124 M130 F131F123-G127 WeakPolarHBondContact O-CA 3.13Å; F123-G127 PolarHBondContact O-N 2.91Å; A124-G127 PolarHBondContact O-N 2.96Å; G127-M130 PolarHBondContact O-N 3.37Å; G127-F131 VanDerWaalsContact O-CB 3.31Å; G127-F131 WeakPolarHBondContact O-CB 3.46Å; G127-F131 PolarHBondContact O-N 2.85Å
128I97Very high95.7Very high67 Ų6768.6 Ų68.634%0.34439%0.394SS..Hα-helixtrans-66.9-47.6-178.3-62.8164.6000111.4I100 T103 A124 M130 F131 G132I100-I128 WeakPolarHBondContact O-CG1 3.45Å; T103-I128 HydrophobicContact CG2-CB 4.42Å; T103-I128 HydrophobicContact CG2-CD1 3.62Å; T103-I128 HydrophobicContact CG2-CG1 3.74Å; T103-I128 HydrophobicContact CG2-CG2 3.79Å; A124-I128 HydrophobicContact CB-CD1 4.01Å; A124-I128 WeakPolarHBondContact O-CB 3.4Å; A124-I128 WeakPolarHBondContact O-CG1 3.31Å; A124-I128 PolarHBondContact O-N 2.68Å; I128-M130 PolarHBondContact O-N 3.48Å; I128-F131 PolarHBondContact O-N 3.09Å; I128-G132 PolarHBondContact O-N 3.33Å
129P97.3Very high95.2Very high76 Ų7663.8 Ų63.849%0.49437%0.371SS..Hα-helixtrans-61.2-40.4172.8-25.735.8000113.6L125 V126 G132 I133L125-P129 WeakPolarHBondContact O-CD 3.38Å; L125-P129 WeakPolarHBondContact O-CG 3.47Å; V126-P129 WeakPolarHBondContact O-CD 3.3Å; P129-G132 PolarHBondContact O-N 2.8Å; P129-I133 WeakPolarHBondContact O-CG1 3.27Å; P129-I133 PolarHBondContact O-N 3.47Å; P129-I133 VanDerWaalsContact O-N 3.13Å
130M96Very high94.6Very high112 Ų11263.1 Ų63.155%0.55237%0.374SS*.Hα-helixtrans-62.6-44.4177-177.1-175.371.300111.5M101 V126 G127 I128 I133 L134M101-M130 HydrophobicContact SD-CE 3.94Å; V126-M130 WeakPolarHBondContact O-CB 3.28Å; V126-M130 PolarHBondContact O-N 2.94Å; G127-M130 PolarHBondContact O-N 3.37Å; I128-M130 PolarHBondContact O-N 3.48Å; M130-I133 PolarHBondContact O-N 3.45Å; M130-L134 PolarHBondContact O-N 3.15Å; M130-L134 VanDerWaalsContact O-N 3.13Å
131F95.5Very high94.1Very high19 Ų1969 Ų698%0.08340%0.398CS..Hα-helixtrans-65.8-37.9175.7-175.1-98.6000111.9M101 T102 G127 I128 I133 L134 L135 L248 L251M101-F131 HydrophobicContact CB-CB 4.19Å; M101-F131 HydrophobicContact CB-CG 4.44Å; M101-F131 WeakPolarHBondContact O-CB 3.33Å; M101-F131 WeakPolarHBondContact O-CD1 3.49Å; M101-F131 WeakPolarHBondContact O-CG 3.41Å; T102-F131 HydrophobicContact CG2-CE1 4.02Å; T102-F131 HydrophobicContact CG2-CE2 3.94Å; T102-F131 HydrophobicContact CG2-CZ 3.68Å; G127-F131 VanDerWaalsContact O-CB 3.31Å; G127-F131 WeakPolarHBondContact O-CB 3.46Å; G127-F131 PolarHBondContact O-N 2.85Å; I128-F131 PolarHBondContact O-N 3.09Å; F131-I133 VanDerWaalsContact C-N 3.31Å; F131-I133 PolarHBondContact O-N 2.93Å; F131-L134 HydrophobicContact CD2-CD2 4.22Å; F131-L134 HydrophobicContact CE2-CD2 4.35Å; F131-L134 WeakPolarHBondContact O-CB 3.48Å; F131-L134 PolarHBondContact O-N 3.28Å; F131-L135 HydrophobicContact CE1-CB 4.34Å; F131-L135 HydrophobicContact CE1-CD1 3.96Å; F131-L135 HydrophobicContact CE1-CD2 4.11Å; F131-L135 HydrophobicContact CE1-CG 4.38Å; F131-L135 HydrophobicContact CZ-CD1 3.9Å; F131-L135 WeakPolarHBondContact O-CB 3.38Å; F131-L135 PolarHBondContact O-N 2.92Å; F131-L248 HydrophobicContact CE2-CD1 3.86Å; F131-L248 HydrophobicContact CZ-CD1 4.16Å; F131-L251 HydrophobicContact CE1-CD1 4.09Å; F131-L251 HydrophobicContact CZ-CD1 3.94Å
132G94.1Very high93.5Very high37 Ų3766.2 Ų66.238%0.38138%0.384SS..Hα-helixtrans-58.7-39.4173.800000113.5I128 P129 L135 A136I128-G132 PolarHBondContact O-N 3.33Å; P129-G132 PolarHBondContact O-N 2.8Å; G132-L135 PolarHBondContact O-N 3.1Å; G132-A136 PolarHBondContact O-N 3.37Å
133I94.4Very high92.5Very high133 Ų13363.7 Ų63.768%0.68237%0.371SS*.Hα-helixtrans-67.3-43.5174.7-65165.6000110.9P129 M130 F131 L135 A136 G137P129-I133 WeakPolarHBondContact O-CG1 3.27Å; P129-I133 PolarHBondContact O-N 3.47Å; P129-I133 VanDerWaalsContact O-N 3.13Å; M130-I133 PolarHBondContact O-N 3.45Å; F131-I133 VanDerWaalsContact C-N 3.31Å; F131-I133 PolarHBondContact O-N 2.93Å; I133-L135 VanDerWaalsContact C-N 3.34Å; I133-L135 PolarHBondContact O-N 3.19Å; I133-A136 PolarHBondContact O-N 3.3Å; I133-G137 PolarHBondContact O-N 2.88Å; I133-G137 VanDerWaalsContact O-N 3.13Å
134L93.7Very high91.7Very high86 Ų8664.7 Ų64.745%0.4538%0.381SS..Hα-helixtrans-59.2-45.9173.9176.164.6000111.1M130 F131 A136 G137 V138 L248M130-L134 PolarHBondContact O-N 3.15Å; M130-L134 VanDerWaalsContact O-N 3.13Å; F131-L134 HydrophobicContact CD2-CD2 4.22Å; F131-L134 HydrophobicContact CE2-CD2 4.35Å; F131-L134 WeakPolarHBondContact O-CB 3.48Å; F131-L134 PolarHBondContact O-N 3.28Å; L134-A136 VanDerWaalsContact C-N 3.35Å; L134-A136 PolarHBondContact O-N 3.14Å; L134-G137 PolarHBondContact O-N 3.49Å; L134-V138 HydrophobicContact CD1-CG2 3.98Å; L134-V138 HydrophobicContact CG-CG2 4.33Å; L134-V138 WeakPolarHBondContact O-CG2 3.21Å; L134-V138 PolarHBondContact O-N 3.43Å; L134-L248 HydrophobicContact CD2-CD1 3.98Å; L134-L248 HydrophobicContact CG-CD1 4.28Å
135L92.3Very high90.8Very high31 Ų3165.4 Ų65.416%0.16239%0.39CS..Hα-helixtrans-64.6-38.4-177.6-16068.5000112.1F131 G132 I133 G139 L251 A252 A255F131-L135 HydrophobicContact CE1-CB 4.34Å; F131-L135 HydrophobicContact CE1-CD1 3.96Å; F131-L135 HydrophobicContact CE1-CD2 4.11Å; F131-L135 HydrophobicContact CE1-CG 4.38Å; F131-L135 HydrophobicContact CZ-CD1 3.9Å; F131-L135 WeakPolarHBondContact O-CB 3.38Å; F131-L135 PolarHBondContact O-N 2.92Å; G132-L135 PolarHBondContact O-N 3.1Å; I133-L135 VanDerWaalsContact C-N 3.34Å; I133-L135 PolarHBondContact O-N 3.19Å; L135-G139 WeakPolarHBondContact O-CA 3.23Å; L135-G139 PolarHBondContact O-N 3Å; L135-L251 HydrophobicContact CD1-CB 3.77Å; L135-L251 HydrophobicContact CD2-CB 4.48Å; L135-A252 HydrophobicContact CD1-CB 3.97Å; L135-A255 HydrophobicContact CD2-CB 4.18Å
136A89.9Confident89.7Confident57 Ų5760.6 Ų60.647%0.47137%0.365SS..Hα-helixtrans-62.1-50172.600000111.5G132 I133 L134 V138 G139 D140G132-A136 PolarHBondContact O-N 3.37Å; I133-A136 PolarHBondContact O-N 3.3Å; L134-A136 VanDerWaalsContact C-N 3.35Å; L134-A136 PolarHBondContact O-N 3.14Å; A136-V138 PolarHBondContact O-N 3.36Å; A136-G139 PolarHBondContact O-N 3.2Å; A136-D140 PolarHBondContact O-N 3.48Å
137G90.6Very high88.6Confident33 Ų3364.6 Ų64.634%0.3437%0.369SS..Hα-helixtrans-62.8-42.5178.900000113.6I133 L134 D140 H141I133-G137 PolarHBondContact O-N 2.88Å; I133-G137 VanDerWaalsContact O-N 3.13Å; L134-G137 PolarHBondContact O-N 3.49Å; G137-D140 PolarHBondContact O-N 2.84Å; G137-H141 PolarHBondContact O-CD2 2.79Å; G137-H141 PolarHBondContact O-N 3.49Å; G137-H141 VanDerWaalsContact O-N 3.08Å
138V91.4Very high87.8Confident28 Ų2869 Ų6917%0.1739%0.392CS..Hα-helixtrans-65.7-39.9174176.30000110.7L134 A136 H141 L142 L249 A252L134-V138 HydrophobicContact CD1-CG2 3.98Å; L134-V138 HydrophobicContact CG-CG2 4.33Å; L134-V138 WeakPolarHBondContact O-CG2 3.21Å; L134-V138 PolarHBondContact O-N 3.43Å; A136-V138 PolarHBondContact O-N 3.36Å; V138-H141 PolarHBondContact O-N 3.02Å; V138-L142 VanDerWaalsContact O-CB 3.24Å; V138-L142 WeakPolarHBondContact O-CB 3.2Å; V138-L142 PolarHBondContact O-N 3.32Å; V138-L249 HydrophobicContact CG1-CD2 3.93Å; V138-A252 HydrophobicContact CB-CB 4.13Å; V138-A252 HydrophobicContact CG1-CB 3.6Å
139G87.9Confident86.9Confident12 Ų1268.6 Ų68.612%0.12439%0.392CS..Hα-helixtrans-61.8-42175.900000113.3L135 A136 G143L135-G139 WeakPolarHBondContact O-CA 3.23Å; L135-G139 PolarHBondContact O-N 3Å; A136-G139 PolarHBondContact O-N 3.2Å; G139-G143 WeakPolarHBondContact O-CA 3.31Å; G139-G143 PolarHBondContact O-N 3.09Å
140D85.6Confident85.8Confident120 Ų12066 Ų6664%0.64238%0.375SS*.Hα-helixtrans-68.4-40.6175.7-82.3-25.8000112.2A136 G137 T144A136-D140 PolarHBondContact O-N 3.48Å; G137-D140 PolarHBondContact O-N 2.84Å; D140-T144 WeakPolarHBondContact O-CB 3.38Å; D140-T144 PolarHBondContact O-N 3.44Å; D140-T144 PolarHBondContact O-OG1 3.3Å
141H86.4Confident84.8Confident154 Ų15462.1 Ų62.171%0.71336%0.361SS*.Hα-helixtrans-64.5-46.7173.8-81.5-60.1000112.2G137 V138 T144 G145G137-H141 PolarHBondContact O-CD2 2.79Å; G137-H141 PolarHBondContact O-N 3.49Å; G137-H141 VanDerWaalsContact O-N 3.08Å; V138-H141 PolarHBondContact O-N 3.02Å; H141-T144 PolarHBondContact O-N 3.48Å; H141-G145 PolarHBondContact O-N 3.49Å
142L84.5Confident84.2Confident44 Ų4468.5 Ų68.523%0.2339%0.389CS..Hα-helixtrans-63.9-47.3177.9-176.961.9000110.9V138 T144 G145 L146 F183 A252V138-L142 VanDerWaalsContact O-CB 3.24Å; V138-L142 WeakPolarHBondContact O-CB 3.2Å; V138-L142 PolarHBondContact O-N 3.32Å; L142-T144 VanDerWaalsContact C-N 3.28Å; L142-T144 PolarHBondContact O-N 3.23Å; L142-G145 PolarHBondContact O-N 2.59Å; L142-L146 VanDerWaalsContact O-CB 3.22Å; L142-L146 WeakPolarHBondContact O-CB 3.39Å; L142-L146 PolarHBondContact O-N 2.88Å; L142-F183 HydrophobicContact CD1-CZ 4.41Å; L142-F183 HydrophobicContact CD2-CE2 4.26Å; L142-F183 HydrophobicContact CD2-CZ 4.19Å; L142-A252 HydrophobicContact CD2-CB 4.41Å
143G77.3Confident83.3Confident20 Ų2069.6 Ų69.621%0.20639%0.385CS..Hα-helixtrans-60.1-35.4174.900000112.9G139 R147G139-G143 WeakPolarHBondContact O-CA 3.31Å; G139-G143 PolarHBondContact O-N 3.09Å; G143-R147 VanDerWaalsContact O-CB 3.25Å; G143-R147 WeakPolarHBondContact O-CB 3.47Å; G143-R147 WeakPolarHBondContact O-CD 3.34Å; G143-R147 WeakPolarHBondContact O-CG 3.22Å; G143-R147 PolarHBondContact O-N 2.72Å
144T81.3Confident82.4Confident73 Ų7366 Ų6645%0.44837%0.365SS..Hα-helixtrans-71.1-43.6174.4-62.20000111.9D140 H141 L142 L146 R147 N148D140-T144 WeakPolarHBondContact O-CB 3.38Å; D140-T144 PolarHBondContact O-N 3.44Å; D140-T144 PolarHBondContact O-OG1 3.3Å; H141-T144 PolarHBondContact O-N 3.48Å; L142-T144 VanDerWaalsContact C-N 3.28Å; L142-T144 PolarHBondContact O-N 3.23Å; T144-L146 VanDerWaalsContact C-N 3.32Å; T144-L146 PolarHBondContact O-N 3.48Å; T144-R147 PolarHBondContact O-N 3.41Å; T144-N148 WeakPolarHBondContact O-CB 3.5Å; T144-N148 VanDerWaalsContact O-CG 3.23Å; T144-N148 PolarHBondContact O-N 2.99Å; T144-N148 PolarHBondContact O-ND2 2.82Å
145G79.7Confident81.7Confident36 Ų3669.4 Ų69.437%0.37138%0.377SS..Hα-helixtrans-61.5-40.5173.800000112.7H141 L142 N148 T149H141-G145 PolarHBondContact O-N 3.49Å; L142-G145 PolarHBondContact O-N 2.59Å; G145-N148 PolarHBondContact O-N 3.33Å; G145-T149 PolarHBondContact O-N 2.91Å; G145-T149 PolarHBondContact O-OG1 2.9Å
146L74.5Confident81.2Confident28 Ų2873.3 Ų73.315%0.14740%0.397CS..Hα-helixtrans-67.9-45.6177.2-168.752.6000111.3L142 T144 N148 T149 V150 S175 L178L142-L146 VanDerWaalsContact O-CB 3.22Å; L142-L146 WeakPolarHBondContact O-CB 3.39Å; L142-L146 PolarHBondContact O-N 2.88Å; T144-L146 VanDerWaalsContact C-N 3.32Å; T144-L146 PolarHBondContact O-N 3.48Å; L146-N148 VanDerWaalsContact C-N 3.35Å; L146-N148 PolarHBondContact O-N 3.22Å; L146-T149 WeakPolarHBondContact O-CB 3.34Å; L146-T149 PolarHBondContact O-N 3.16Å; L146-T149 VanDerWaalsContact O-N 3.15Å; L146-V150 WeakPolarHBondContact O-CB 3.35Å; L146-V150 PolarHBondContact O-N 3.27Å; L146-S175 WeakPolarHBondContact CD2-OG 3.4Å; L146-S175 VanDerWaalsContact CG-OG 3.23Å; L146-S175 WeakPolarHBondContact CG-OG 3.31Å; L146-L178 HydrophobicContact CD1-CD2 4.16Å
147R73.9Confident80.5Confident188 Ų18874.1 Ų74.171%0.70939%0.39SS*.Hα-helixtrans-58.6-40.4170.5-77.5166.8-178.4-110.47.9113G143 T144 T149 V150 A151G143-R147 VanDerWaalsContact O-CB 3.25Å; G143-R147 WeakPolarHBondContact O-CB 3.47Å; G143-R147 WeakPolarHBondContact O-CD 3.34Å; G143-R147 WeakPolarHBondContact O-CG 3.22Å; G143-R147 PolarHBondContact O-N 2.72Å; T144-R147 PolarHBondContact O-N 3.41Å; R147-T149 VanDerWaalsContact C-N 3.3Å; R147-T149 PolarHBondContact O-N 2.88Å; R147-V150 WeakPolarHBondContact O-CB 3.44Å; R147-V150 PolarHBondContact O-N 3.45Å; R147-A151 VanDerWaalsContact O-CB 3.31Å; R147-A151 WeakPolarHBondContact O-CB 3.45Å; R147-A151 PolarHBondContact O-N 3.39Å
148N81.2Confident79.6Confident94 Ų9476.2 Ų76.250%0.50339%0.393SS..Hα-helixtrans-68.3-29.8176.8-77-30.4000112.7T144 G145 L146 K152T144-N148 WeakPolarHBondContact O-CB 3.5Å; T144-N148 VanDerWaalsContact O-CG 3.23Å; T144-N148 PolarHBondContact O-N 2.99Å; T144-N148 PolarHBondContact O-ND2 2.82Å; G145-N148 PolarHBondContact O-N 3.33Å; L146-N148 VanDerWaalsContact C-N 3.35Å; L146-N148 PolarHBondContact O-N 3.22Å; N148-K152 WeakPolarHBondContact O-CG 3.44Å; N148-K152 PolarHBondContact O-N 2.84Å
149T76.6Confident79Confident59 Ų5983.7 Ų83.736%0.36242%0.423SS..Hα-helixtrans-75.5-46.1174.4-570000110.4G145 L146 R147 A151 K152 I153G145-T149 PolarHBondContact O-N 2.91Å; G145-T149 PolarHBondContact O-OG1 2.9Å; L146-T149 WeakPolarHBondContact O-CB 3.34Å; L146-T149 PolarHBondContact O-N 3.16Å; L146-T149 VanDerWaalsContact O-N 3.15Å; R147-T149 VanDerWaalsContact C-N 3.3Å; R147-T149 PolarHBondContact O-N 2.88Å; T149-A151 VanDerWaalsContact C-N 3.31Å; T149-A151 PolarHBondContact O-N 2.89Å; T149-K152 WeakPolarHBondContact O-CB 3.5Å; T149-K152 PolarHBondContact O-N 3.23Å; T149-K152 VanDerWaalsContact O-N 3.14Å; T149-I153 HydrophobicContact CG2-CD1 4.5Å; T149-I153 PolarHBondContact O-N 3.3Å
150V75.3Confident78.6Confident22 Ų2293.2 Ų93.213%0.13346%0.456CS..Hα-helixtrans-50.3-47.2167.2149.10000111.9L146 R147 K152 I153 E154 S171L146-V150 WeakPolarHBondContact O-CB 3.35Å; L146-V150 PolarHBondContact O-N 3.27Å; R147-V150 WeakPolarHBondContact O-CB 3.44Å; R147-V150 PolarHBondContact O-N 3.45Å; V150-K152 VanDerWaalsContact C-N 3.28Å; V150-K152 PolarHBondContact O-N 2.92Å; V150-I153 CarbonylContact O-C 3.58Å; V150-I153 WeakPolarHBondContact O-CB 3.36Å; V150-I153 PolarHBondContact O-N 2.87Å; V150-I153 VanDerWaalsContact O-N 3.1Å; V150-E154 WeakPolarHBondContact O-CB 3.34Å; V150-E154 PolarHBondContact O-N 2.87Å; V150-S171 WeakPolarHBondContact CG1-OG 3.32Å; V150-S171 WeakPolarHBondContact CG2-O 3.47Å
151A74.8Confident78.4Confident31 Ų3199 Ų9926%0.25647%0.469SS..Hα-helixtrans-66.6-26.1-178.500000113.5R147 T149 K155R147-A151 VanDerWaalsContact O-CB 3.31Å; R147-A151 WeakPolarHBondContact O-CB 3.45Å; R147-A151 PolarHBondContact O-N 3.39Å; T149-A151 VanDerWaalsContact C-N 3.31Å; T149-A151 PolarHBondContact O-N 2.89Å; A151-K155 VanDerWaalsContact O-CG 3.27Å; A151-K155 WeakPolarHBondContact O-CG 3.37Å; A151-K155 PolarHBondContact O-N 3.18Å
152K82.6Confident78.1Confident153 Ų15393.8 Ų93.867%0.66545%0.447SS*.Hα-helixtrans-72-42.2171.1-68166.6-175.3174.60110.9N148 T149 V150 L156N148-K152 WeakPolarHBondContact O-CG 3.44Å; N148-K152 PolarHBondContact O-N 2.84Å; T149-K152 WeakPolarHBondContact O-CB 3.5Å; T149-K152 PolarHBondContact O-N 3.23Å; T149-K152 VanDerWaalsContact O-N 3.14Å; V150-K152 VanDerWaalsContact C-N 3.28Å; V150-K152 PolarHBondContact O-N 2.92Å; K152-L156 PolarHBondContact O-N 3.36Å
153I75.9Confident78.1Confident60 Ų6094.6 Ų94.631%0.30846%0.457SS..Hα-helixtrans-65.7-46.2176.5-64.1167.2000110.1T149 V150 K155 L156 F157 L174T149-I153 HydrophobicContact CG2-CD1 4.5Å; T149-I153 PolarHBondContact O-N 3.3Å; V150-I153 CarbonylContact O-C 3.58Å; V150-I153 WeakPolarHBondContact O-CB 3.36Å; V150-I153 PolarHBondContact O-N 2.87Å; V150-I153 VanDerWaalsContact O-N 3.1Å; I153-K155 PolarHBondContact O-N 2.89Å; I153-L156 WeakPolarHBondContact O-CA 3.24Å; I153-L156 WeakPolarHBondContact O-CB 3.39Å; I153-L156 PolarHBondContact O-N 2.85Å; I153-F157 HydrophobicContact CG2-CD2 3.64Å; I153-F157 HydrophobicContact CG2-CE2 3.7Å; I153-F157 WeakPolarHBondContact O-CD2 3.47Å; I153-F157 PolarHBondContact O-N 3.19Å; I153-L174 HydrophobicContact CG2-CD1 4.19Å
154E74.9Confident78.1Confident56 Ų5697.8 Ų97.826%0.26247%0.474SS..Hα-helixtrans-56.6-44.9176166.8158.7-136.900112.3V150 L156 F157 L158 V167V150-E154 WeakPolarHBondContact O-CB 3.34Å; V150-E154 PolarHBondContact O-N 2.87Å; E154-L156 PolarHBondContact O-N 3.43Å; E154-F157 PolarHBondContact O-N 3.47Å; E154-L158 HydrophobicContact CG-CD1 3.61Å; E154-L158 HydrophobicContact CG-CG 4.16Å; E154-L158 WeakPolarHBondContact O-CB 3.25Å; E154-L158 VanDerWaalsContact O-CG 3.27Å; E154-L158 WeakPolarHBondContact O-CG 3.48Å; E154-L158 PolarHBondContact O-N 3.07Å; E154-V167 HydrophobicContact CB-CG1 3.74Å; E154-V167 HydrophobicContact CG-CG1 3.63Å
155K80.1Confident78.1Confident158 Ų15899.3 Ų99.369%0.68748%0.484SS*.Hα-helixtrans-59.7-29.8173.3-75.6171.1-177.8-179.80113.3A151 I153A151-K155 VanDerWaalsContact O-CG 3.27Å; A151-K155 WeakPolarHBondContact O-CG 3.37Å; A151-K155 PolarHBondContact O-N 3.18Å; I153-K155 PolarHBondContact O-N 2.89Å
156L80Confident78.2Confident114 Ų114100.8 Ų100.860%0.59749%0.485SS*.Hα-helixtrans-79.1-37177.1-165.8138000112.1K152 I153 E154 K159K152-L156 PolarHBondContact O-N 3.36Å; I153-L156 WeakPolarHBondContact O-CA 3.24Å; I153-L156 WeakPolarHBondContact O-CB 3.39Å; I153-L156 PolarHBondContact O-N 2.85Å; E154-L156 PolarHBondContact O-N 3.43Å; L156-K159 WeakPolarHBondContact O-CB 3.3Å
157F75.2Confident78.5Confident73 Ų7399.6 Ų99.632%0.3248%0.479SS..Hα-helixtrans-77.3-31.9175-84.5-85.5000114.2I153 E154 K159 W160 V162 V167I153-F157 HydrophobicContact CG2-CD2 3.64Å; I153-F157 HydrophobicContact CG2-CE2 3.7Å; I153-F157 WeakPolarHBondContact O-CD2 3.47Å; I153-F157 PolarHBondContact O-N 3.19Å; E154-F157 PolarHBondContact O-N 3.47Å; F157-K159 VanDerWaalsContact C-N 3.27Å; F157-K159 PolarHBondContact O-N 3.27Å; F157-W160 WeakPolarHBondContact O-CA 3.5Å; F157-W160 VanDerWaalsContact O-CB 3.3Å; F157-W160 WeakPolarHBondContact O-CB 3.41Å; F157-W160 PolarHBondContact O-N 3Å; F157-V162 HydrophobicContact CD1-CG2 4.4Å; F157-V167 HydrophobicContact CB-CG1 4.28Å; F157-V167 HydrophobicContact CB-CG2 4.2Å
158L72.1Confident78.7Confident78 Ų7899.8 Ų99.841%0.40848%0.479SS..Hα-helixtrans-66-31.2173.4-72.5169.5000111.6E154 W160 R161 V167E154-L158 HydrophobicContact CG-CD1 3.61Å; E154-L158 HydrophobicContact CG-CG 4.16Å; E154-L158 WeakPolarHBondContact O-CB 3.25Å; E154-L158 VanDerWaalsContact O-CG 3.27Å; E154-L158 WeakPolarHBondContact O-CG 3.48Å; E154-L158 PolarHBondContact O-N 3.07Å; L158-W160 PolarHBondContact O-N 3.46Å; L158-R161 PolarHBondContact O-N 3.2Å; L158-V167 HydrophobicContact CD2-CG2 4.27Å
159K79.9Confident78.8Confident184 Ų18499.6 Ų99.680%0.848%0.482SS*.THydrogen-bonded Turntrans-60.8-23.2169.3-169.8179.2177.4-176.10112.6L156 F157L156-K159 WeakPolarHBondContact O-CB 3.3Å; F157-K159 VanDerWaalsContact C-N 3.27Å; F157-K159 PolarHBondContact O-N 3.27Å
160W78.9Confident79.1Confident212 Ų21299.7 Ų99.780%0.80348%0.479SS*.THydrogen-bonded Turntrans-89.411.7174.3-90.464.7000114.1F157 L158 V162F157-W160 WeakPolarHBondContact O-CA 3.5Å; F157-W160 VanDerWaalsContact O-CB 3.3Å; F157-W160 WeakPolarHBondContact O-CB 3.41Å; F157-W160 PolarHBondContact O-N 3Å; L158-W160 PolarHBondContact O-N 3.46Å; W160-V162 HydrophobicContact CB-CG2 4.31Å; W160-V162 PolarHBondContact O-N 2.85Å
161R81.1Confident79.3Confident242 Ų24299.1 Ų99.191%0.91348%0.476SS*.THydrogen-bonded Turntrans58.425.2-180-65.8-174.4171-173.8-2.1115.3L158L158-R161 PolarHBondContact O-N 3.2Å
162V81.4Confident79.6Confident44 Ų4499.4 Ų99.427%0.26748%0.479SS..  trans-71.6142.4173.1-173.50000110.2F157 W160 V166 V167F157-V162 HydrophobicContact CD1-CG2 4.4Å; W160-V162 HydrophobicContact CB-CG2 4.31Å; W160-V162 PolarHBondContact O-N 2.85Å; V162-V166 HydrophobicContact CG1-CB 4.07Å; V162-V166 HydrophobicContact CG1-CG1 3.78Å; V162-V167 HydrophobicContact CB-CG2 3.71Å; V162-V167 HydrophobicContact CG1-CG2 3.68Å
163S82.8Confident79.8Confident62 Ų6295.6 Ų95.643%0.43447%0.468SS..  trans-65.4142.818073.60000112.5T165 V166 V167S163-T165 VanDerWaalsContact C-N 3.33Å; S163-T165 PolarHBondContact O-N 3.28Å; S163-V166 PolarHBondContact O-N 2.86Å; S163-V166 VanDerWaalsContact OG-CG2 3.3Å; S163-V166 WeakPolarHBondContact OG-CG2 3.45Å; S163-V167 WeakPolarHBondContact O-CG2 3.3Å; S163-V167 PolarHBondContact O-N 3.13Å
164P78.8Confident80.1Confident87 Ų8796 Ų9657%0.56547%0.47SS*.Hα-helixtrans-63-35.6-170.523.7-34.2000113.3V166 V167 R168P164-V166 VanDerWaalsContact C-N 3.33Å; P164-V166 PolarHBondContact O-N 3.44Å; P164-V167 PolarHBondContact O-N 3.32Å; P164-R168 WeakPolarHBondContact O-CB 3.45Å; P164-R168 PolarHBondContact O-N 3.03Å
165T81.3Confident80.5Confident105 Ų10594.4 Ų94.464%0.64447%0.465SS*.Hα-helixtrans-61.4-41.7175.7-43.80000111.6S163 R168 V169S163-T165 VanDerWaalsContact C-N 3.33Å; S163-T165 PolarHBondContact O-N 3.28Å; T165-R168 PolarHBondContact O-N 3.11Å; T165-V169 WeakPolarHBondContact O-CG2 3.42Å; T165-V169 PolarHBondContact O-N 3.35Å; T165-V169 VanDerWaalsContact O-N 3.15Å
166V81.3Confident80.9Confident66 Ų6689.7 Ų89.740%0.445%0.447SS..Hα-helixtrans-69.9-41.7177.4171.60000110.9V162 S163 P164 R168 V169 I170V162-V166 HydrophobicContact CG1-CB 4.07Å; V162-V166 HydrophobicContact CG1-CG1 3.78Å; S163-V166 PolarHBondContact O-N 2.86Å; S163-V166 VanDerWaalsContact OG-CG2 3.3Å; S163-V166 WeakPolarHBondContact OG-CG2 3.45Å; P164-V166 VanDerWaalsContact C-N 3.33Å; P164-V166 PolarHBondContact O-N 3.44Å; V166-R168 VanDerWaalsContact C-N 3.3Å; V166-R168 PolarHBondContact O-N 3.03Å; V166-V169 PolarHBondContact O-N 3.48Å; V166-I170 HydrophobicContact CG1-CD1 3.64Å; V166-I170 HydrophobicContact CG1-CG1 4.21Å; V166-I170 WeakPolarHBondContact O-CB 3.41Å; V166-I170 WeakPolarHBondContact O-CG1 3.44Å; V166-I170 PolarHBondContact O-N 2.89Å
167V79.8Confident81.3Confident3 Ų389.3 Ų89.32%0.01845%0.445CS..Hα-helixtrans-61.1-39.8176.1-177.90000111.4E154 F157 L158 V162 S163 P164 I170 S171E154-V167 HydrophobicContact CB-CG1 3.74Å; E154-V167 HydrophobicContact CG-CG1 3.63Å; F157-V167 HydrophobicContact CB-CG1 4.28Å; F157-V167 HydrophobicContact CB-CG2 4.2Å; L158-V167 HydrophobicContact CD2-CG2 4.27Å; V162-V167 HydrophobicContact CB-CG2 3.71Å; V162-V167 HydrophobicContact CG1-CG2 3.68Å; S163-V167 WeakPolarHBondContact O-CG2 3.3Å; S163-V167 PolarHBondContact O-N 3.13Å; P164-V167 PolarHBondContact O-N 3.32Å; V167-I170 PolarHBondContact O-N 3.01Å; V167-S171 VanDerWaalsContact O-CB 3.27Å; V167-S171 WeakPolarHBondContact O-CB 3.33Å; V167-S171 PolarHBondContact O-N 3.38Å; V167-S171 PolarHBondContact O-OG 3.32Å; V167-S171 VanDerWaalsContact O-OG 3.14Å
168R79.6Confident81.9Confident192 Ų19289 Ų8973%0.72545%0.446SS*.Hα-helixtrans-66.4-32.9175.8-173.7173.5177.4174.9-1.2113.7P164 T165 V166 S171 A172P164-R168 WeakPolarHBondContact O-CB 3.45Å; P164-R168 PolarHBondContact O-N 3.03Å; T165-R168 PolarHBondContact O-N 3.11Å; V166-R168 VanDerWaalsContact C-N 3.3Å; V166-R168 PolarHBondContact O-N 3.03Å; R168-S171 PolarHBondContact O-OG 3.09Å; R168-A172 WeakPolarHBondContact O-CB 3.5Å; R168-A172 PolarHBondContact O-N 2.84Å
169V82.9Confident82.8Confident90 Ų9085.4 Ų85.455%0.54543%0.429SS..Hα-helixtrans-73.9-47.9173.71720000110.7T165 V166 S171 A172 V173T165-V169 WeakPolarHBondContact O-CG2 3.42Å; T165-V169 PolarHBondContact O-N 3.35Å; T165-V169 VanDerWaalsContact O-N 3.15Å; V166-V169 PolarHBondContact O-N 3.48Å; V169-S171 VanDerWaalsContact C-N 3.29Å; V169-S171 PolarHBondContact O-N 2.84Å; V169-A172 PolarHBondContact O-N 3.15Å; V169-V173 WeakPolarHBondContact O-CG2 3.35Å; V169-V173 PolarHBondContact O-N 3.43Å
170I82.1Confident83.3Confident61 Ų6178.7 Ų78.731%0.31340%0.404SS..Hα-helixtrans-56.9-44.6176.5-70.9172000110.5V166 V167 V173 L174V166-I170 HydrophobicContact CG1-CD1 3.64Å; V166-I170 HydrophobicContact CG1-CG1 4.21Å; V166-I170 WeakPolarHBondContact O-CB 3.41Å; V166-I170 WeakPolarHBondContact O-CG1 3.44Å; V166-I170 PolarHBondContact O-N 2.89Å; V167-I170 PolarHBondContact O-N 3.01Å; I170-V173 PolarHBondContact O-N 3.44Å; I170-L174 HydrophobicContact CG2-CD1 3.78Å; I170-L174 HydrophobicContact CG2-CG 4.27Å; I170-L174 WeakPolarHBondContact O-CB 3.45Å; I170-L174 WeakPolarHBondContact O-CG 3.3Å; I170-L174 PolarHBondContact O-N 3.11Å
171S79.9Confident84Confident10 Ų1073.1 Ų73.17%0.0739%0.389CS..Hα-helixtrans-70.8-33.1-17873.20000113.1V150 V167 R168 V169 S175V150-S171 WeakPolarHBondContact CG1-OG 3.32Å; V150-S171 WeakPolarHBondContact CG2-O 3.47Å; V167-S171 VanDerWaalsContact O-CB 3.27Å; V167-S171 WeakPolarHBondContact O-CB 3.33Å; V167-S171 PolarHBondContact O-N 3.38Å; V167-S171 PolarHBondContact O-OG 3.32Å; V167-S171 VanDerWaalsContact O-OG 3.14Å; R168-S171 PolarHBondContact O-OG 3.09Å; V169-S171 VanDerWaalsContact C-N 3.29Å; V169-S171 PolarHBondContact O-N 2.84Å; S171-S175 WeakPolarHBondContact O-CB 3.41Å; S171-S175 PolarHBondContact O-N 3.39Å
172A80.7Confident84.5Confident37 Ų3765.9 Ų65.931%0.30637%0.368SS..Hα-helixtrans-65.7-40.9169.400000112.3R168 V169 S175 I176R168-A172 WeakPolarHBondContact O-CB 3.5Å; R168-A172 PolarHBondContact O-N 2.84Å; V169-A172 PolarHBondContact O-N 3.15Å; A172-S175 WeakPolarHBondContact O-CB 3.33Å; A172-S175 PolarHBondContact O-N 3.38Å; A172-I176 WeakPolarHBondContact O-CG1 3.4Å; A172-I176 PolarHBondContact O-N 2.56Å
173V86.2Confident85.1Confident73 Ų7364.8 Ų64.844%0.44236%0.36SS..Hα-helixtrans-66.5-46.5176.1172.50000111.3V169 I170 S175 I176 L177V169-V173 WeakPolarHBondContact O-CG2 3.35Å; V169-V173 PolarHBondContact O-N 3.43Å; I170-V173 PolarHBondContact O-N 3.44Å; V173-S175 VanDerWaalsContact C-N 3.27Å; V173-S175 PolarHBondContact O-N 2.75Å; V173-I176 PolarHBondContact O-N 3.41Å; V173-I176 VanDerWaalsContact O-N 3.15Å; V173-L177 HydrophobicContact CG1-CD1 3.91Å; V173-L177 HydrophobicContact CG1-CG 4.36Å; V173-L177 WeakPolarHBondContact O-CG 3.22Å; V173-L177 PolarHBondContact O-N 3.26Å
174L84Confident85.7Confident69 Ų6964.4 Ų64.436%0.36135%0.353SS..Hα-helixtrans-61.4-36.2174.8-70.5173.2000112.2I153 I170 L177 L178I153-L174 HydrophobicContact CG2-CD1 4.19Å; I170-L174 HydrophobicContact CG2-CD1 3.78Å; I170-L174 HydrophobicContact CG2-CG 4.27Å; I170-L174 WeakPolarHBondContact O-CB 3.45Å; I170-L174 WeakPolarHBondContact O-CG 3.3Å; I170-L174 PolarHBondContact O-N 3.11Å; L174-L177 PolarHBondContact O-N 3.37Å; L174-L178 VanDerWaalsContact O-CB 3.28Å; L174-L178 WeakPolarHBondContact O-CB 3.32Å; L174-L178 PolarHBondContact O-N 2.97Å
175S82.6Confident86.6Confident22 Ų2262.3 Ų62.315%0.15434%0.343CS..Hα-helixtrans-61.3-40.7173.8173.70000112.3L146 S171 A172 V173 G179L146-S175 WeakPolarHBondContact CD2-OG 3.4Å; L146-S175 VanDerWaalsContact CG-OG 3.23Å; L146-S175 WeakPolarHBondContact CG-OG 3.31Å; S171-S175 WeakPolarHBondContact O-CB 3.41Å; S171-S175 PolarHBondContact O-N 3.39Å; A172-S175 WeakPolarHBondContact O-CB 3.33Å; A172-S175 PolarHBondContact O-N 3.38Å; V173-S175 VanDerWaalsContact C-N 3.27Å; V173-S175 PolarHBondContact O-N 2.75Å; S175-G179 PolarHBondContact O-N 3.05Å
176I87.6Confident87.2Confident60 Ų6060.8 Ų60.831%0.30833%0.333SS..Hα-helixtrans-69.1-50174.5-64.1160.9000110.2A172 V173 L178 G179 C180 Y253 M260A172-I176 WeakPolarHBondContact O-CG1 3.4Å; A172-I176 PolarHBondContact O-N 2.56Å; V173-I176 PolarHBondContact O-N 3.41Å; V173-I176 VanDerWaalsContact O-N 3.15Å; I176-L178 VanDerWaalsContact C-N 3.31Å; I176-L178 PolarHBondContact O-N 3.23Å; I176-G179 PolarHBondContact O-N 2.67Å; I176-G179 VanDerWaalsContact O-N 3.09Å; I176-C180 PolarHBondContact O-N 2.95Å; I176-C180 PolarHBondContact O-SG 3.36Å; I176-C180 VanDerWaalsContact O-SG 3.37Å; I176-Y253 WeakPolarHBondContact CA-OH 3.33Å; I176-Y253 PolarHBondContact O-OH 2.93Å; I176-M260 HydrophobicContact CD1-CE 3.66Å; I176-M260 HydrophobicContact CG1-CE 3.56Å
177L89.8Confident87.9Confident106 Ų10658.1 Ų58.156%0.55532%0.318SS*.Hα-helixtrans-60.1-40-177.4-69.1172.2000112.3V173 L174 C180 L181V173-L177 HydrophobicContact CG1-CD1 3.91Å; V173-L177 HydrophobicContact CG1-CG 4.36Å; V173-L177 WeakPolarHBondContact O-CG 3.22Å; V173-L177 PolarHBondContact O-N 3.26Å; L174-L177 PolarHBondContact O-N 3.37Å; L177-C180 PolarHBondContact O-N 3.37Å; L177-L181 WeakPolarHBondContact O-CB 3.32Å; L177-L181 PolarHBondContact O-N 3.19Å
178L87.8Confident88.7Confident66 Ų6658.6 Ų58.635%0.34632%0.32SS..Hα-helixtrans-65-41.2174.7-179.860.9000112.1L146 L174 I176 L181 L182L146-L178 HydrophobicContact CD1-CD2 4.16Å; L174-L178 VanDerWaalsContact O-CB 3.28Å; L174-L178 WeakPolarHBondContact O-CB 3.32Å; L174-L178 PolarHBondContact O-N 2.97Å; I176-L178 VanDerWaalsContact C-N 3.31Å; I176-L178 PolarHBondContact O-N 3.23Å; L178-L181 PolarHBondContact O-N 3.45Å; L178-L182 HydrophobicContact CD1-CD1 3.87Å; L178-L182 HydrophobicContact CD1-CG 4.13Å; L178-L182 HydrophobicContact CG-CD1 3.95Å; L178-L182 WeakPolarHBondContact O-CB 3.44Å; L178-L182 VanDerWaalsContact O-CG 3.3Å; L178-L182 WeakPolarHBondContact O-CG 3.24Å; L178-L182 PolarHBondContact O-N 3.13Å
179G89.5Confident89.5Confident3 Ų354.2 Ų54.23%0.03131%0.311CS..Hα-helixtrans-67.9-40.1176.200000112.8S175 I176 L181 L182 F183S175-G179 PolarHBondContact O-N 3.05Å; I176-G179 PolarHBondContact O-N 2.67Å; I176-G179 VanDerWaalsContact O-N 3.09Å; G179-L181 VanDerWaalsContact C-N 3.33Å; G179-L181 PolarHBondContact O-N 2.96Å; G179-L182 PolarHBondContact O-N 2.97Å; G179-F183 WeakPolarHBondContact O-CB 3.3Å; G179-F183 WeakPolarHBondContact O-CD2 3.35Å; G179-F183 PolarHBondContact O-N 3.34Å
180C92.1Very high89.9Confident42 Ų4252.8 Ų52.828%0.28430%0.302SS..Hα-helixtrans-62.9-38.3172.1-67.20000112I176 L177 L184 A185I176-C180 PolarHBondContact O-N 2.95Å; I176-C180 PolarHBondContact O-SG 3.36Å; I176-C180 VanDerWaalsContact O-SG 3.37Å; L177-C180 PolarHBondContact O-N 3.37Å; C180-L184 HydrophobicContact CB-CD1 4.15Å; C180-L184 WeakPolarHBondContact O-CA 3.5Å; C180-L184 VanDerWaalsContact O-CB 3.24Å; C180-L184 WeakPolarHBondContact O-CB 3.43Å; C180-L184 PolarHBondContact O-N 3.3Å; C180-A185 PolarHBondContact O-N 2.97Å
181L93.1Very high90.4Very high95 Ų9550.1 Ų50.150%0.49729%0.288SS..Iπ-helixtrans-62.6-48.9173.6179.965000111.7L177 L178 G179 A185 V186L177-L181 WeakPolarHBondContact O-CB 3.32Å; L177-L181 PolarHBondContact O-N 3.19Å; L178-L181 PolarHBondContact O-N 3.45Å; G179-L181 VanDerWaalsContact C-N 3.33Å; G179-L181 PolarHBondContact O-N 2.96Å; L181-A185 HydrophobicContact CD1-CB 4.28Å; L181-V186 WeakPolarHBondContact O-CG2 3.31Å; L181-V186 PolarHBondContact O-N 2.89Å
182L92.1Very high91Very high90 Ų9052.5 Ų52.547%0.47130%0.298SS..Iπ-helixtrans-77.6-34.3-173.6-68.8173.8000114.4L178 G179 P187L178-L182 HydrophobicContact CD1-CD1 3.87Å; L178-L182 HydrophobicContact CD1-CG 4.13Å; L178-L182 HydrophobicContact CG-CD1 3.95Å; L178-L182 WeakPolarHBondContact O-CB 3.44Å; L178-L182 VanDerWaalsContact O-CG 3.3Å; L178-L182 WeakPolarHBondContact O-CG 3.24Å; L178-L182 PolarHBondContact O-N 3.13Å; G179-L182 PolarHBondContact O-N 2.97Å; L182-P187 VanDerWaalsContact O-CD 3.32Å; L182-P187 WeakPolarHBondContact O-CD 3.19Å
183F94.1Very high91.4Very high22 Ų2257.9 Ų57.910%0.09632%0.317CS..Iπ-helixtrans-108.7-16-173.4-59.6-62.1000114.4L142 G179 L210 W246 L249 Y253L142-F183 HydrophobicContact CD1-CZ 4.41Å; L142-F183 HydrophobicContact CD2-CE2 4.26Å; L142-F183 HydrophobicContact CD2-CZ 4.19Å; G179-F183 WeakPolarHBondContact O-CB 3.3Å; G179-F183 WeakPolarHBondContact O-CD2 3.35Å; G179-F183 PolarHBondContact O-N 3.34Å; F183-L210 HydrophobicContact CB-CD1 4.32Å; F183-L210 WeakPolarHBondContact O-CD1 3.32Å; F183-W246 PolarHBondContact O-NE1 3.38Å; F183-W246 VanDerWaalsContact O-NE1 3.09Å; F183-L249 HydrophobicContact CD1-CB 4.42Å; F183-L249 HydrophobicContact CE1-CB 3.56Å; F183-L249 HydrophobicContact CE1-CD1 4.44Å; F183-L249 HydrophobicContact CZ-CB 4.1Å; F183-Y253 HydrophobicContact CB-CD1 4.21Å; F183-Y253 AromaticContact CD2-CD1 3.59Å; F183-Y253 HydrophobicContact CD2-CD1 3.59Å; F183-Y253 HydrophobicContact CD2-CD2 4.11Å; F183-Y253 HydrophobicContact CD2-CE1 4.32Å; F183-Y253 AromaticContact CD2-CG 3.47Å; F183-Y253 HydrophobicContact CD2-CG 3.47Å; F183-Y253 VanDerWaalsContact CD2-CG 3.47Å; F183-Y253 HydrophobicContact CE2-CD1 4.39Å; F183-Y253 HydrophobicContact CE2-CD2 4.18Å; F183-Y253 AromaticContact CE2-CG 3.82Å; F183-Y253 HydrophobicContact CE2-CG 3.82Å; F183-Y253 HydrophobicContact CG-CD1 4.24Å; F183-Y253 HydrophobicContact CG-CG 4.4Å
184L95.4Very high91.4Very high53 Ų5356.6 Ų56.628%0.27731%0.31SS..Iπ-helixtrans-110.7-62.3173.8-49.3174.1000111.7C180 T188 V206 L210C180-L184 HydrophobicContact CB-CD1 4.15Å; C180-L184 WeakPolarHBondContact O-CA 3.5Å; C180-L184 VanDerWaalsContact O-CB 3.24Å; C180-L184 WeakPolarHBondContact O-CB 3.43Å; C180-L184 PolarHBondContact O-N 3.3Å; L184-T188 VanDerWaalsContact O-CB 3.3Å; L184-T188 WeakPolarHBondContact O-CB 3.29Å; L184-T188 PolarHBondContact O-N 2.82Å; L184-T188 PolarHBondContact O-OG1 3.02Å; L184-V206 HydrophobicContact CB-CG1 4.14Å; L184-V206 HydrophobicContact CD2-CG1 3.67Å; L184-L210 HydrophobicContact CD2-CD1 4.04Å
185A95.8Very high91.5Very high44 Ų4454.7 Ų54.736%0.36430%0.299SS..Iπ-helixtrans-70-47.5-168.900000113.9C180 L181 T188 L189C180-A185 PolarHBondContact O-N 2.97Å; L181-A185 HydrophobicContact CD1-CB 4.28Å; A185-T188 WeakPolarHBondContact O-CB 3.13Å; A185-T188 PolarHBondContact O-N 3.11Å; A185-L189 PolarHBondContact O-N 3.35Å
186V95.4Very high91.7Very high72 Ų7258.4 Ų58.444%0.43632%0.317SS..Hα-helixtrans-62.5-48.1177.3167.60000111.7L181 T188 L189 V190L181-V186 WeakPolarHBondContact O-CG2 3.31Å; L181-V186 PolarHBondContact O-N 2.89Å; V186-T188 PolarHBondContact O-N 3.49Å; V186-L189 PolarHBondContact O-N 3.23Å; V186-V190 WeakPolarHBondContact O-CG2 3.35Å; V186-V190 PolarHBondContact O-N 3.11Å; V186-V190 VanDerWaalsContact O-N 3.1Å
187P95.6Very high92Very high11 Ų1157.4 Ų57.47%0.07131%0.309CS..Hα-helixtrans-59.9-40.5174.1-28.338.2000113.5L182 L189 V190 F191 V206 W246L182-P187 VanDerWaalsContact O-CD 3.32Å; L182-P187 WeakPolarHBondContact O-CD 3.19Å; P187-L189 VanDerWaalsContact C-N 3.28Å; P187-L189 PolarHBondContact O-N 3.33Å; P187-V190 PolarHBondContact O-N 3.43Å; P187-F191 HydrophobicContact CB-CD2 4.22Å; P187-F191 HydrophobicContact CB-CE2 3.81Å; P187-F191 WeakPolarHBondContact O-CD2 3.41Å; P187-F191 PolarHBondContact O-N 2.79Å; P187-V206 HydrophobicContact CB-CG2 4.11Å; P187-W246 HydrophobicContact CB-CD2 4.45Å; P187-W246 HydrophobicContact CB-CZ2 4.35Å; P187-W246 HydrophobicContact CG-CG 4.33Å; P187-W246 VanDerWaalsContact CG-NE1 3.33Å
188T96.5Very high92.3Very high12 Ų1254.9 Ų54.97%0.07430%0.301CS..Hα-helixtrans-54.3-44.4175.4-62.80000111.7L184 A185 V186 Q192 L199 S202L184-T188 VanDerWaalsContact O-CB 3.3Å; L184-T188 WeakPolarHBondContact O-CB 3.29Å; L184-T188 PolarHBondContact O-N 2.82Å; L184-T188 PolarHBondContact O-OG1 3.02Å; A185-T188 WeakPolarHBondContact O-CB 3.13Å; A185-T188 PolarHBondContact O-N 3.11Å; V186-T188 PolarHBondContact O-N 3.49Å; T188-Q192 WeakPolarHBondContact O-CB 3.24Å; T188-Q192 PolarHBondContact O-N 2.88Å; T188-Q192 VanDerWaalsContact O-N 3.1Å; T188-L199 HydrophobicContact CG2-CD1 3.79Å; T188-L199 HydrophobicContact CG2-CG 4.49Å; T188-S202 VanDerWaalsContact O-CB 3.31Å; T188-S202 WeakPolarHBondContact O-CB 3.47Å
189L95.6Very high92.7Very high100 Ų10056.4 Ų56.452%0.52431%0.308SS..Hα-helixtrans-70.5-32.4177.4-64.8173.2000112.8A185 V186 P187 E193 L199A185-L189 PolarHBondContact O-N 3.35Å; V186-L189 PolarHBondContact O-N 3.23Å; P187-L189 VanDerWaalsContact C-N 3.28Å; P187-L189 PolarHBondContact O-N 3.33Å; L189-E193 WeakPolarHBondContact O-CG 3.46Å; L189-E193 PolarHBondContact O-N 3.19Å; L189-L199 HydrophobicContact CD2-CD1 4.01Å
190V92.4Very high93Very high60 Ų6062.4 Ų62.436%0.36434%0.339SS..Hα-helixtrans-68.8-44.3175.1172.90000111.2V186 P187 E193 V194V186-V190 WeakPolarHBondContact O-CG2 3.35Å; V186-V190 PolarHBondContact O-N 3.11Å; V186-V190 VanDerWaalsContact O-N 3.1Å; P187-V190 PolarHBondContact O-N 3.43Å; V190-E193 PolarHBondContact O-N 3.25Å; V190-V194 HydrophobicContact CG1-CG2 4.15Å; V190-V194 WeakPolarHBondContact O-CB 3.35Å; V190-V194 VanDerWaalsContact O-CG2 3.29Å; V190-V194 WeakPolarHBondContact O-CG2 3.47Å; V190-V194 PolarHBondContact O-N 3.13Å
191F92.5Very high93.2Very high6 Ų663.5 Ų63.53%0.02634%0.34CS..Hα-helixtrans-66.2-37.2178.2-66.5-58000112.2P187 E193 V194 E195 W197 F205 V206 A220 Y239 V243 W246P187-F191 HydrophobicContact CB-CD2 4.22Å; P187-F191 HydrophobicContact CB-CE2 3.81Å; P187-F191 WeakPolarHBondContact O-CD2 3.41Å; P187-F191 PolarHBondContact O-N 2.79Å; F191-E193 PolarHBondContact O-N 3.45Å; F191-V194 PolarHBondContact O-N 3.45Å; F191-E195 HydrophobicContact CD1-CG 4.31Å; F191-E195 WeakPolarHBondContact O-CB 3.23Å; F191-E195 PolarHBondContact O-N 3.4Å; F191-W197 HydrophobicContact CB-CE3 3.98Å; F191-W197 HydrophobicContact CB-CZ3 4.09Å; F191-W197 HydrophobicContact CD1-CZ3 4.37Å; F191-W197 HydrophobicContact CG-CZ3 4.31Å; F191-F205 HydrophobicContact CD1-CE1 4.22Å; F191-F205 AromaticContact CD2-CD1 3.96Å; F191-F205 HydrophobicContact CD2-CD1 3.96Å; F191-F205 HydrophobicContact CD2-CE1 4.07Å; F191-F205 AromaticContact CE1-CE1 3.93Å; F191-F205 HydrophobicContact CE1-CE1 3.93Å; F191-F205 HydrophobicContact CE2-CD1 4.06Å; F191-F205 AromaticContact CE2-CE1 3.76Å; F191-F205 HydrophobicContact CE2-CE1 3.76Å; F191-F205 HydrophobicContact CG-CD1 4.23Å; F191-F205 HydrophobicContact CG-CE1 4.32Å; F191-F205 HydrophobicContact CZ-CD1 4.42Å; F191-F205 AromaticContact CZ-CE1 3.7Å; F191-F205 HydrophobicContact CZ-CE1 3.7Å; F191-V206 HydrophobicContact CD2-CG2 3.54Å; F191-V206 HydrophobicContact CE2-CG2 3.69Å; F191-A220 HydrophobicContact CD1-CB 4.05Å; F191-A220 HydrophobicContact CE1-CB 3.6Å; F191-A220 HydrophobicContact CZ-CB 4.46Å; F191-Y239 VanDerWaalsContact CD1-OH 3.23Å; F191-Y239 WeakPolarHBondContact CD1-OH 3.43Å; F191-Y239 HydrophobicContact CE1-CE2 4.39Å; F191-Y239 VanDerWaalsContact CE1-OH 3.29Å; F191-Y239 WeakPolarHBondContact CE1-OH 3.21Å; F191-V243 HydrophobicContact CE1-CG1 4.48Å; F191-V243 HydrophobicContact CE1-CG2 3.83Å; F191-V243 HydrophobicContact CZ-CG1 4.38Å; F191-V243 HydrophobicContact CZ-CG2 4.18Å; F191-W246 HydrophobicContact CE2-CD2 4.4Å; F191-W246 HydrophobicContact CE2-CE3 4.05Å; F191-W246 AromaticContact CE2-CH2 3.82Å; F191-W246 HydrophobicContact CE2-CH2 3.82Å; F191-W246 HydrophobicContact CE2-CZ2 4.16Å; F191-W246 AromaticContact CE2-CZ3 3.75Å; F191-W246 HydrophobicContact CE2-CZ3 3.75Å; F191-W246 HydrophobicContact CZ-CD2 4.37Å; F191-W246 AromaticContact CZ-CE3 3.7Å; F191-W246 HydrophobicContact CZ-CE3 3.7Å; F191-W246 HydrophobicContact CZ-CH2 4.12Å; F191-W246 AromaticContact CZ-CZ3 3.56Å; F191-W246 HydrophobicContact CZ-CZ3 3.56Å
192Q92.9Very high93.4Very high59 Ų5959 Ų5928%0.27632%0.316SS..Hα-helixtrans-56.5-47.6173.5169.5173.3-13.200112.2T188 N196 W197 L199 S202T188-Q192 WeakPolarHBondContact O-CB 3.24Å; T188-Q192 PolarHBondContact O-N 2.88Å; T188-Q192 VanDerWaalsContact O-N 3.1Å; Q192-N196 VanDerWaalsContact O-CA 3.31Å; Q192-N196 WeakPolarHBondContact O-CA 3.41Å; Q192-N196 PolarHBondContact O-N 3.3Å; Q192-W197 WeakPolarHBondContact CA-O 3.43Å; Q192-W197 WeakPolarHBondContact CG-O 3.41Å; Q192-L199 VanDerWaalsContact OE1-CD1 3.3Å; Q192-S202 WeakPolarHBondContact CA-OG 3.42Å; Q192-S202 PolarHBondContact N-OG 2.93Å
193E88.3Confident93.6Very high150 Ų15056.7 Ų56.770%0.70131%0.308SS*.Hα-helixtrans-79.9-28-177-61.6-69.6139.700113.4L189 V190 F191L189-E193 WeakPolarHBondContact O-CG 3.46Å; L189-E193 PolarHBondContact O-N 3.19Å; V190-E193 PolarHBondContact O-N 3.25Å; F191-E193 PolarHBondContact O-N 3.45Å
194V86.5Confident93.8Very high47 Ų4759.5 Ų59.529%0.28532%0.318SS..Hα-helixtrans-89.8-43.2-177.1175.90000112.7V190 F191 Y239V190-V194 HydrophobicContact CG1-CG2 4.15Å; V190-V194 WeakPolarHBondContact O-CB 3.35Å; V190-V194 VanDerWaalsContact O-CG2 3.29Å; V190-V194 WeakPolarHBondContact O-CG2 3.47Å; V190-V194 PolarHBondContact O-N 3.13Å; F191-V194 PolarHBondContact O-N 3.45Å; V194-Y239 HydrophobicContact CB-CE2 4.33Å; V194-Y239 HydrophobicContact CG1-CD1 4.37Å; V194-Y239 HydrophobicContact CG1-CD2 4.21Å; V194-Y239 HydrophobicContact CG1-CE1 3.92Å; V194-Y239 HydrophobicContact CG1-CE2 3.77Å; V194-Y239 HydrophobicContact CG1-CG 4.49Å; V194-Y239 HydrophobicContact CG2-CE2 4.47Å
195E85.5Confident93.9Very high28 Ų2857.2 Ų57.213%0.13131%0.306CS..Hα-helixtrans-95.8-5.6-176.3-52.6-72-178.300112.5F191 W197 A220 G221 Y239F191-E195 HydrophobicContact CD1-CG 4.31Å; F191-E195 WeakPolarHBondContact O-CB 3.23Å; F191-E195 PolarHBondContact O-N 3.4Å; E195-W197 HydrophobicContact CB-CD2 3.51Å; E195-W197 VanDerWaalsContact CB-CE2 3.45Å; E195-W197 HydrophobicContact CB-CE3 3.99Å; E195-W197 HydrophobicContact CB-CG 3.81Å; E195-W197 HydrophobicContact CB-CH2 4.34Å; E195-W197 HydrophobicContact CB-CZ2 3.9Å; E195-W197 HydrophobicContact CB-CZ3 4.37Å; E195-W197 HydrophobicContact CG-CD2 4.1Å; E195-W197 HydrophobicContact CG-CE3 4.12Å; E195-W197 HydrophobicContact CG-CH2 3.92Å; E195-W197 HydrophobicContact CG-CZ2 3.88Å; E195-W197 HydrophobicContact CG-CZ3 4.03Å; E195-W197 PolarHBondContact O-N 3.4Å; E195-A220 WeakPolarHBondContact OE1-CA 3.37Å; E195-G221 PolarHBondContact OE1-N 3.35Å; E195-Y239 WeakPolarHBondContact OE1-CE1 3Å; E195-Y239 VanDerWaalsContact OE1-CZ 3.27Å; E195-Y239 PolarHBondContact OE1-OH 3.08Å
196N87.7Confident93.9Very high100 Ų10055.1 Ų55.154%0.53529%0.289SS..  trans61.518.4-173.5-57-101.3000114.4Q192 F225Q192-N196 VanDerWaalsContact O-CA 3.31Å; Q192-N196 WeakPolarHBondContact O-CA 3.41Å; Q192-N196 PolarHBondContact O-N 3.3Å; N196-F225 VanDerWaalsContact ND2-CE1 3.31Å; N196-F225 WeakPolarHBondContact ND2-CE1 3.38Å
197W92.8Very high93.9Very high40 Ų4055 Ų5515%0.15229%0.288CS..  trans-71152.2173.7-60.8-19.9000111.3F191 Q192 E195 E201 S202 F205 Y218 A220F191-W197 HydrophobicContact CB-CE3 3.98Å; F191-W197 HydrophobicContact CB-CZ3 4.09Å; F191-W197 HydrophobicContact CD1-CZ3 4.37Å; F191-W197 HydrophobicContact CG-CZ3 4.31Å; Q192-W197 WeakPolarHBondContact CA-O 3.43Å; Q192-W197 WeakPolarHBondContact CG-O 3.41Å; E195-W197 HydrophobicContact CB-CD2 3.51Å; E195-W197 VanDerWaalsContact CB-CE2 3.45Å; E195-W197 HydrophobicContact CB-CE3 3.99Å; E195-W197 HydrophobicContact CB-CG 3.81Å; E195-W197 HydrophobicContact CB-CH2 4.34Å; E195-W197 HydrophobicContact CB-CZ2 3.9Å; E195-W197 HydrophobicContact CB-CZ3 4.37Å; E195-W197 HydrophobicContact CG-CD2 4.1Å; E195-W197 HydrophobicContact CG-CE3 4.12Å; E195-W197 HydrophobicContact CG-CH2 3.92Å; E195-W197 HydrophobicContact CG-CZ2 3.88Å; E195-W197 HydrophobicContact CG-CZ3 4.03Å; E195-W197 PolarHBondContact O-N 3.4Å; W197-E201 HydrophobicContact CB-CB 4.08Å; W197-S202 WeakPolarHBondContact CB-OG 3.06Å; W197-F205 HydrophobicContact CE3-CB 4.44Å; W197-F205 HydrophobicContact CH2-CD1 4.22Å; W197-F205 HydrophobicContact CH2-CD2 4.21Å; W197-F205 HydrophobicContact CH2-CE2 4.49Å; W197-F205 HydrophobicContact CH2-CG 4.06Å; W197-F205 HydrophobicContact CZ3-CB 3.9Å; W197-F205 AromaticContact CZ3-CD1 3.59Å; W197-F205 HydrophobicContact CZ3-CD1 3.59Å; W197-F205 HydrophobicContact CZ3-CD2 4.22Å; W197-F205 HydrophobicContact CZ3-CE1 4.19Å; W197-F205 AromaticContact CZ3-CG 3.61Å; W197-F205 HydrophobicContact CZ3-CG 3.61Å; W197-Y218 AromaticContact CD2-CD1 3.95Å; W197-Y218 HydrophobicContact CD2-CD1 3.95Å; W197-Y218 AromaticContact CE2-CD1 3.75Å; W197-Y218 HydrophobicContact CE3-CD1 4.48Å; W197-Y218 HydrophobicContact CG-CD1 4.27Å; W197-Y218 HydrophobicContact CZ2-CD1 4.12Å; W197-Y218 AromaticContact NE1-CD1 3.91Å; W197-A220 HydrophobicContact CH2-CB 4.29Å
198S96.1Very high94Very high53 Ų5355.6 Ų55.637%0.37129%0.29SS..  trans-65.3164.8169.473.10000111.7L200 E201 S202S198-L200 PolarHBondContact O-N 2.84Å; S198-L200 PolarHBondContact OG-N 3.22Å; S198-E201 WeakPolarHBondContact CA-OE2 3.47Å; S198-E201 WeakPolarHBondContact CB-OE2 3.32Å; S198-E201 PolarHBondContact N-OE2 2.73Å; S198-E201 PolarHBondContact O-N 3.39Å; S198-E201 WeakPolarHBondContact OG-CG 3.31Å; S198-E201 PolarHBondContact OG-N 3.19Å; S198-E201 PolarHBondContact OG-OE2 3.36Å; S198-S202 VanDerWaalsContact O-CB 3.29Å; S198-S202 WeakPolarHBondContact O-CB 3.45Å; S198-S202 PolarHBondContact O-N 3.18Å; S198-S202 PolarHBondContact O-OG 3.49Å
199L96.3Very high94Very high97 Ų9755 Ų5551%0.50829%0.287SS..Hα-helixtrans-55.9-34.8173.7-172.174.3000112.2T188 L189 Q192 S203T188-L199 HydrophobicContact CG2-CD1 3.79Å; T188-L199 HydrophobicContact CG2-CG 4.49Å; L189-L199 HydrophobicContact CD2-CD1 4.01Å; Q192-L199 VanDerWaalsContact OE1-CD1 3.3Å; L199-S203 VanDerWaalsContact O-CB 3.25Å; L199-S203 WeakPolarHBondContact O-CB 3.32Å; L199-S203 PolarHBondContact O-N 3.41Å; L199-S203 PolarHBondContact O-OG 3.09Å
200L96.8Very high94Very high129 Ų12950.4 Ų50.468%0.67526%0.263SS*.Hα-helixtrans-69.6-55.1179.6179.560.9000110.9S198 S202 S203 Y204S198-L200 PolarHBondContact O-N 2.84Å; S198-L200 PolarHBondContact OG-N 3.22Å; L200-S202 VanDerWaalsContact C-N 3.32Å; L200-S202 PolarHBondContact O-N 2.85Å; L200-S203 PolarHBondContact O-N 2.7Å; L200-S203 VanDerWaalsContact O-N 3.11Å; L200-S203 PolarHBondContact O-OG 2.88Å; L200-Y204 WeakPolarHBondContact O-CB 3.37Å; L200-Y204 PolarHBondContact O-N 3.39Å
201E96.6Very high94.1Very high66 Ų6649.3 Ų49.331%0.30826%0.257SS..Hα-helixtrans-58.1-44179.1-66.8156.1135.400111.3W197 S198 S203 Y204 F205 Y218W197-E201 HydrophobicContact CB-CB 4.08Å; S198-E201 WeakPolarHBondContact CA-OE2 3.47Å; S198-E201 WeakPolarHBondContact CB-OE2 3.32Å; S198-E201 PolarHBondContact N-OE2 2.73Å; S198-E201 PolarHBondContact O-N 3.39Å; S198-E201 WeakPolarHBondContact OG-CG 3.31Å; S198-E201 PolarHBondContact OG-N 3.19Å; S198-E201 PolarHBondContact OG-OE2 3.36Å; E201-S203 PolarHBondContact O-N 3.08Å; E201-Y204 WeakPolarHBondContact O-CB 3.29Å; E201-Y204 PolarHBondContact O-N 3.42Å; E201-F205 WeakPolarHBondContact O-CB 3.29Å; E201-F205 PolarHBondContact O-N 3.34Å; E201-Y218 HydrophobicContact CB-CD1 4.32Å; E201-Y218 HydrophobicContact CB-CE1 3.8Å; E201-Y218 HydrophobicContact CG-CE1 3.89Å; E201-Y218 PolarHBondContact OE1-OH 3.01Å
202S96.7Very high94.2Very high0 Ų051.7 Ų51.70%027%0.272CS..Hα-helixtrans-60.6-42.7175-58.70000112.4T188 Q192 W197 S198 L200 V206T188-S202 VanDerWaalsContact O-CB 3.31Å; T188-S202 WeakPolarHBondContact O-CB 3.47Å; Q192-S202 WeakPolarHBondContact CA-OG 3.42Å; Q192-S202 PolarHBondContact N-OG 2.93Å; W197-S202 WeakPolarHBondContact CB-OG 3.06Å; S198-S202 VanDerWaalsContact O-CB 3.29Å; S198-S202 WeakPolarHBondContact O-CB 3.45Å; S198-S202 PolarHBondContact O-N 3.18Å; S198-S202 PolarHBondContact O-OG 3.49Å; L200-S202 VanDerWaalsContact C-N 3.32Å; L200-S202 PolarHBondContact O-N 2.85Å; S202-V206 WeakPolarHBondContact O-CB 3.43Å; S202-V206 VanDerWaalsContact O-CG2 3.23Å; S202-V206 WeakPolarHBondContact O-CG2 3.36Å; S202-V206 PolarHBondContact O-N 2.89Å; S202-V206 VanDerWaalsContact O-N 3.11Å
203S97.1Very high94.4Very high42 Ų4252.2 Ų52.229%0.29428%0.279SS..Hα-helixtrans-70.4-35.3178.775.30000112.4L199 L200 E201 V207L199-S203 VanDerWaalsContact O-CB 3.25Å; L199-S203 WeakPolarHBondContact O-CB 3.32Å; L199-S203 PolarHBondContact O-N 3.41Å; L199-S203 PolarHBondContact O-OG 3.09Å; L200-S203 PolarHBondContact O-N 2.7Å; L200-S203 VanDerWaalsContact O-N 3.11Å; L200-S203 PolarHBondContact O-OG 2.88Å; E201-S203 PolarHBondContact O-N 3.08Å; S203-V207 WeakPolarHBondContact O-CG2 3.23Å; S203-V207 PolarHBondContact O-N 3.36Å
204Y97.4Very high94.7Very high81 Ų8145.4 Ų45.432%0.31825%0.248SC..Hα-helixtrans-66.1-52.5176167.4-96000110.6L200 E201 V206 V207 I208 F215 D217 Y218L200-Y204 WeakPolarHBondContact O-CB 3.37Å; L200-Y204 PolarHBondContact O-N 3.39Å; E201-Y204 WeakPolarHBondContact O-CB 3.29Å; E201-Y204 PolarHBondContact O-N 3.42Å; Y204-V206 VanDerWaalsContact C-N 3.31Å; Y204-V206 PolarHBondContact O-N 3.43Å; Y204-V207 PolarHBondContact O-N 2.76Å; Y204-V207 VanDerWaalsContact O-N 3.13Å; Y204-I208 HydrophobicContact CD1-CG1 4.43Å; Y204-I208 HydrophobicContact CD2-CG1 3.87Å; Y204-I208 HydrophobicContact CE1-CG1 4.24Å; Y204-I208 HydrophobicContact CE2-CD1 4.13Å; Y204-I208 HydrophobicContact CE2-CG1 3.67Å; Y204-I208 HydrophobicContact CG-CG1 4.26Å; Y204-I208 WeakPolarHBondContact O-CB 3.34Å; Y204-I208 VanDerWaalsContact O-CG1 3.31Å; Y204-I208 WeakPolarHBondContact O-CG1 3.41Å; Y204-I208 PolarHBondContact O-N 3.47Å; Y204-F215 VanDerWaalsContact OH-CD2 3.23Å; Y204-F215 WeakPolarHBondContact OH-CD2 3.49Å; Y204-D217 WeakPolarHBondContact CE1-OD2 3.31Å; Y204-D217 VanDerWaalsContact CZ-OD2 3.3Å; Y204-D217 PolarHBondContact OH-OD2 3.33Å; Y204-Y218 AromaticContact CD1-CD2 3.94Å; Y204-Y218 HydrophobicContact CD1-CD2 3.94Å; Y204-Y218 HydrophobicContact CD1-CE2 4.29Å; Y204-Y218 AromaticContact CE1-CD2 3.84Å; Y204-Y218 HydrophobicContact CE1-CD2 3.84Å; Y204-Y218 HydrophobicContact CE1-CE2 4.19Å
205F96.8Very high95.1Very high4 Ų449.2 Ų49.22%0.01826%0.261CS..Hα-helixtrans-51.3-50.1173.7169.3-105.3000111.6Y106 F191 W197 E201 V207 I208 T209 Y218 A220 W246Y106-F205 HydrophobicContact CE1-CE2 4.07Å; F191-F205 HydrophobicContact CD1-CE1 4.22Å; F191-F205 AromaticContact CD2-CD1 3.96Å; F191-F205 HydrophobicContact CD2-CD1 3.96Å; F191-F205 HydrophobicContact CD2-CE1 4.07Å; F191-F205 AromaticContact CE1-CE1 3.93Å; F191-F205 HydrophobicContact CE1-CE1 3.93Å; F191-F205 HydrophobicContact CE2-CD1 4.06Å; F191-F205 AromaticContact CE2-CE1 3.76Å; F191-F205 HydrophobicContact CE2-CE1 3.76Å; F191-F205 HydrophobicContact CG-CD1 4.23Å; F191-F205 HydrophobicContact CG-CE1 4.32Å; F191-F205 HydrophobicContact CZ-CD1 4.42Å; F191-F205 AromaticContact CZ-CE1 3.7Å; F191-F205 HydrophobicContact CZ-CE1 3.7Å; W197-F205 HydrophobicContact CE3-CB 4.44Å; W197-F205 HydrophobicContact CH2-CD1 4.22Å; W197-F205 HydrophobicContact CH2-CD2 4.21Å; W197-F205 HydrophobicContact CH2-CE2 4.49Å; W197-F205 HydrophobicContact CH2-CG 4.06Å; W197-F205 HydrophobicContact CZ3-CB 3.9Å; W197-F205 AromaticContact CZ3-CD1 3.59Å; W197-F205 HydrophobicContact CZ3-CD1 3.59Å; W197-F205 HydrophobicContact CZ3-CD2 4.22Å; W197-F205 HydrophobicContact CZ3-CE1 4.19Å; W197-F205 AromaticContact CZ3-CG 3.61Å; W197-F205 HydrophobicContact CZ3-CG 3.61Å; E201-F205 WeakPolarHBondContact O-CB 3.29Å; E201-F205 PolarHBondContact O-N 3.34Å; F205-V207 PolarHBondContact O-N 3.14Å; F205-I208 PolarHBondContact O-N 2.9Å; F205-T209 VanDerWaalsContact CE2-OG1 3.29Å; F205-T209 WeakPolarHBondContact CE2-OG1 3.35Å; F205-T209 WeakPolarHBondContact O-CB 3.36Å; F205-T209 PolarHBondContact O-N 3.46Å; F205-T209 PolarHBondContact O-OG1 3.33Å; F205-Y218 WeakPolarHBondContact CD2-O 3.36Å; F205-Y218 WeakPolarHBondContact CE2-O 3.34Å; F205-A220 HydrophobicContact CE1-CB 3.9Å; F205-A220 HydrophobicContact CZ-CB 3.67Å; F205-W246 AromaticContact CE1-CH2 3.96Å; F205-W246 HydrophobicContact CE1-CH2 3.96Å; F205-W246 AromaticContact CE1-CZ3 3.93Å; F205-W246 HydrophobicContact CE1-CZ3 3.93Å; F205-W246 HydrophobicContact CZ-CZ3 4.35Å
206V97Very high95.4Very high1 Ų148.8 Ų48.81%0.00626%0.264CS..Hα-helixtrans-58.4-43.6179.2159.30000112.3L184 P187 F191 S202 Y204 L210 W246L184-V206 HydrophobicContact CB-CG1 4.14Å; L184-V206 HydrophobicContact CD2-CG1 3.67Å; P187-V206 HydrophobicContact CB-CG2 4.11Å; F191-V206 HydrophobicContact CD2-CG2 3.54Å; F191-V206 HydrophobicContact CE2-CG2 3.69Å; S202-V206 WeakPolarHBondContact O-CB 3.43Å; S202-V206 VanDerWaalsContact O-CG2 3.23Å; S202-V206 WeakPolarHBondContact O-CG2 3.36Å; S202-V206 PolarHBondContact O-N 2.89Å; S202-V206 VanDerWaalsContact O-N 3.11Å; Y204-V206 VanDerWaalsContact C-N 3.31Å; Y204-V206 PolarHBondContact O-N 3.43Å; V206-L210 WeakPolarHBondContact O-CB 3.42Å; V206-L210 WeakPolarHBondContact O-CG 3.31Å; V206-L210 PolarHBondContact O-N 3.17Å; V206-L210 VanDerWaalsContact O-N 3.16Å; V206-W246 HydrophobicContact CB-CZ2 4.31Å; V206-W246 HydrophobicContact CG1-CZ2 4.2Å; V206-W246 HydrophobicContact CG2-CH2 4.16Å; V206-W246 HydrophobicContact CG2-CZ2 3.93Å
207V95.9Very high95.6Very high69 Ų6948 Ų4842%0.41826%0.26SS..Hα-helixtrans-70.6-52178170.90000111.1S203 Y204 F205 T209 L210 T211S203-V207 WeakPolarHBondContact O-CG2 3.23Å; S203-V207 PolarHBondContact O-N 3.36Å; Y204-V207 PolarHBondContact O-N 2.76Å; Y204-V207 VanDerWaalsContact O-N 3.13Å; F205-V207 PolarHBondContact O-N 3.14Å; V207-T209 PolarHBondContact O-N 3.12Å; V207-L210 PolarHBondContact O-N 2.76Å; V207-T211 HydrophobicContact CG1-CG2 4.02Å; V207-T211 WeakPolarHBondContact O-CB 3.49Å; V207-T211 VanDerWaalsContact O-CG2 3.23Å; V207-T211 WeakPolarHBondContact O-CG2 3.37Å; V207-T211 PolarHBondContact O-N 2.84Å; V207-T211 PolarHBondContact O-OG1 3.21Å
208I96.6Very high95.6Very high23 Ų2349.1 Ų49.112%0.11827%0.265CS..Hα-helixtrans-59.9-33.1-178.8-67.5-56.8000112.3Y204 F205 T211 V213 G214 F215Y204-I208 HydrophobicContact CD1-CG1 4.43Å; Y204-I208 HydrophobicContact CD2-CG1 3.87Å; Y204-I208 HydrophobicContact CE1-CG1 4.24Å; Y204-I208 HydrophobicContact CE2-CD1 4.13Å; Y204-I208 HydrophobicContact CE2-CG1 3.67Å; Y204-I208 HydrophobicContact CG-CG1 4.26Å; Y204-I208 WeakPolarHBondContact O-CB 3.34Å; Y204-I208 VanDerWaalsContact O-CG1 3.31Å; Y204-I208 WeakPolarHBondContact O-CG1 3.41Å; Y204-I208 PolarHBondContact O-N 3.47Å; F205-I208 PolarHBondContact O-N 2.9Å; I208-T211 PolarHBondContact O-OG1 2.92Å; I208-V213 HydrophobicContact CD1-CB 4.31Å; I208-V213 HydrophobicContact CD1-CG1 4.13Å; I208-V213 HydrophobicContact CG2-CB 4.18Å; I208-V213 HydrophobicContact CG2-CG1 4.27Å; I208-V213 PolarHBondContact O-N 3.43Å; I208-G214 PolarHBondContact O-N 3.04Å; I208-F215 HydrophobicContact CD1-CD2 3.91Å; I208-F215 HydrophobicContact CD1-CE2 3.63Å; I208-F215 HydrophobicContact CG1-CD2 4.13Å; I208-F215 HydrophobicContact CG1-CE2 4.34Å; I208-F215 HydrophobicContact CG2-CB 4.42Å; I208-F215 HydrophobicContact CG2-CD2 3.77Å; I208-F215 HydrophobicContact CG2-CE2 4.49Å; I208-F215 HydrophobicContact CG2-CG 4.33Å
209T96.4Very high95.4Very high0 Ų047.2 Ų47.20%025%0.251CS..Hα-helixtrans-68.6-55.2173.3-630000111.7I104 Y106 F205 V207 T211 T212 W246 I247I104-T209 HydrophobicContact CD1-CG2 4.06Å; Y106-T209 VanDerWaalsContact OH-CG2 3.24Å; Y106-T209 WeakPolarHBondContact OH-CG2 3.29Å; Y106-T209 PolarHBondContact OH-OG1 2.93Å; Y106-T209 VanDerWaalsContact OH-OG1 3.09Å; F205-T209 VanDerWaalsContact CE2-OG1 3.29Å; F205-T209 WeakPolarHBondContact CE2-OG1 3.35Å; F205-T209 WeakPolarHBondContact O-CB 3.36Å; F205-T209 PolarHBondContact O-N 3.46Å; F205-T209 PolarHBondContact O-OG1 3.33Å; V207-T209 PolarHBondContact O-N 3.12Å; T209-T211 VanDerWaalsContact C-N 3.31Å; T209-T211 PolarHBondContact O-N 3.35Å; T209-T212 PolarHBondContact O-N 3.1Å; T209-T212 VanDerWaalsContact O-N 3.09Å; T209-W246 HydrophobicContact CG2-CH2 3.73Å; T209-W246 HydrophobicContact CG2-CZ3 4Å; T209-I247 HydrophobicContact CG2-CD1 4.16Å; T209-I247 HydrophobicContact CG2-CG1 3.96Å
210L95.3Very high95Very high3 Ų342.8 Ų42.82%0.01623%0.229CC..Hα-helixtrans-76.1-16.6-173.9-63.3-172.8000113.7F183 L184 V206 V207 T212 W246 L251 F254F183-L210 HydrophobicContact CB-CD1 4.32Å; F183-L210 WeakPolarHBondContact O-CD1 3.32Å; L184-L210 HydrophobicContact CD2-CD1 4.04Å; V206-L210 WeakPolarHBondContact O-CB 3.42Å; V206-L210 WeakPolarHBondContact O-CG 3.31Å; V206-L210 PolarHBondContact O-N 3.17Å; V206-L210 VanDerWaalsContact O-N 3.16Å; V207-L210 PolarHBondContact O-N 2.76Å; L210-T212 VanDerWaalsContact C-N 3.27Å; L210-W246 HydrophobicContact CD1-CZ2 3.88Å; L210-W246 HydrophobicContact CD2-CH2 4.41Å; L210-W246 HydrophobicContact CD2-CZ2 3.93Å; L210-W246 HydrophobicContact CG-CH2 4.41Å; L210-W246 HydrophobicContact CG-CZ2 3.76Å; L210-L251 HydrophobicContact CD2-CD2 4.47Å; L210-L251 HydrophobicContact CD2-CG 4.36Å; L210-L251 WeakPolarHBondContact O-CD2 3.31Å; L210-F254 WeakPolarHBondContact O-CD1 3.24Å; L210-F254 WeakPolarHBondContact O-CG 3.26Å
211T94.2Very high94.2Very high38 Ų3837.3 Ų37.323%0.23320%0.203CC..THydrogen-bonded Turntrans-83.71.3168.659.90000113.7V207 I208 T209 V213 F254V207-T211 HydrophobicContact CG1-CG2 4.02Å; V207-T211 WeakPolarHBondContact O-CB 3.49Å; V207-T211 VanDerWaalsContact O-CG2 3.23Å; V207-T211 WeakPolarHBondContact O-CG2 3.37Å; V207-T211 PolarHBondContact O-N 2.84Å; V207-T211 PolarHBondContact O-OG1 3.21Å; I208-T211 PolarHBondContact O-OG1 2.92Å; T209-T211 VanDerWaalsContact C-N 3.31Å; T209-T211 PolarHBondContact O-N 3.35Å; T211-V213 PolarHBondContact O-N 2.87Å; T211-V213 WeakPolarHBondContact OG1-CG2 3.49Å; T211-F254 HydrophobicContact CG2-CE1 4.12Å; T211-F254 HydrophobicContact CG2-CE2 4.07Å; T211-F254 HydrophobicContact CG2-CZ 3.62Å
212T95.4Very high92.9Very high56 Ų5638 Ų3834%0.34421%0.206SC..THydrogen-bonded Turntrans5042.2-172.766.60000112.9T102 I104 T209 L210 L251T102-T212 WeakPolarHBondContact O-CG2 3.34Å; I104-T212 HydrophobicContact CG1-CG2 3.98Å; T209-T212 PolarHBondContact O-N 3.1Å; T209-T212 VanDerWaalsContact O-N 3.09Å; L210-T212 VanDerWaalsContact C-N 3.27Å; T212-L251 HydrophobicContact CG2-CD2 3.46Å; T212-L251 VanDerWaalsContact CG2-CD2 3.46Å
213V96.4Very high91.2Very high70 Ų7040.2 Ų40.242%0.42423%0.229SC..  trans-94.1-40.9172.8172.20000110.8I208 T211 F215I208-V213 HydrophobicContact CD1-CB 4.31Å; I208-V213 HydrophobicContact CD1-CG1 4.13Å; I208-V213 HydrophobicContact CG2-CB 4.18Å; I208-V213 HydrophobicContact CG2-CG1 4.27Å; I208-V213 PolarHBondContact O-N 3.43Å; T211-V213 PolarHBondContact O-N 2.87Å; T211-V213 WeakPolarHBondContact OG1-CG2 3.49Å; V213-F215 HydrophobicContact CG1-CD1 4.2Å; V213-F215 HydrophobicContact CG1-CD2 4.03Å; V213-F215 HydrophobicContact CG1-CE1 3.8Å; V213-F215 HydrophobicContact CG1-CE2 3.62Å; V213-F215 HydrophobicContact CG1-CG 4.31Å; V213-F215 HydrophobicContact CG1-CZ 3.5Å; V213-F215 VanDerWaalsContact CG1-CZ 3.5Å; V213-F215 PolarHBondContact O-N 3.3Å
214G95.5Very high89Confident6 Ų642.3 Ų42.36%0.06223%0.234CC..  trans45.267.4168.100000115.9I104 Y106 I208 G216I104-G214 WeakPolarHBondContact O-CA 3.21Å; Y106-G214 VanDerWaalsContact CA-O 3.31Å; Y106-G214 WeakPolarHBondContact CA-O 3.45Å; I208-G214 PolarHBondContact O-N 3.04Å; G214-G216 VanDerWaalsContact C-N 3.29Å; G214-G216 PolarHBondContact O-N 3.24Å
215F94.5Very high86.5Confident127 Ų12743 Ų4356%0.55724%0.239SC*.  trans-67.5-25.5177.6-67.7-57.7000114.4Y204 I208 V213 D217Y204-F215 VanDerWaalsContact OH-CD2 3.23Å; Y204-F215 WeakPolarHBondContact OH-CD2 3.49Å; I208-F215 HydrophobicContact CD1-CD2 3.91Å; I208-F215 HydrophobicContact CD1-CE2 3.63Å; I208-F215 HydrophobicContact CG1-CD2 4.13Å; I208-F215 HydrophobicContact CG1-CE2 4.34Å; I208-F215 HydrophobicContact CG2-CB 4.42Å; I208-F215 HydrophobicContact CG2-CD2 3.77Å; I208-F215 HydrophobicContact CG2-CE2 4.49Å; I208-F215 HydrophobicContact CG2-CG 4.33Å; V213-F215 HydrophobicContact CG1-CD1 4.2Å; V213-F215 HydrophobicContact CG1-CD2 4.03Å; V213-F215 HydrophobicContact CG1-CE1 3.8Å; V213-F215 HydrophobicContact CG1-CE2 3.62Å; V213-F215 HydrophobicContact CG1-CG 4.31Å; V213-F215 HydrophobicContact CG1-CZ 3.5Å; V213-F215 VanDerWaalsContact CG1-CZ 3.5Å; V213-F215 PolarHBondContact O-N 3.3Å; F215-D217 PolarHBondContact O-N 3.1Å
216G92Very high84.1Confident19 Ų1946 Ų4620%0.19625%0.254CS..SBendtrans74.59.3177.500000115.5Y106 G214 Y218Y106-G216 VanDerWaalsContact O-CA 3.3Å; Y106-G216 WeakPolarHBondContact O-CA 3.32Å; G214-G216 VanDerWaalsContact C-N 3.29Å; G214-G216 PolarHBondContact O-N 3.24Å; G216-Y218 VanDerWaalsContact C-N 3.33Å
217D91.7Very high81.5Confident84 Ų8451.8 Ų51.845%0.44929%0.289SS..SBendtrans-65.6-34.716547.44.4000112.3Y204 F215Y204-D217 WeakPolarHBondContact CE1-OD2 3.31Å; Y204-D217 VanDerWaalsContact CZ-OD2 3.3Å; Y204-D217 PolarHBondContact OH-OD2 3.33Å; F215-D217 PolarHBondContact O-N 3.1Å
218Y93Very high79.1Confident63 Ų6357.1 Ų57.125%0.24730%0.302CS..SBendtrans-122.7128.4169.2-63.3-93.3000110W197 E201 Y204 F205 G216W197-Y218 AromaticContact CD2-CD1 3.95Å; W197-Y218 HydrophobicContact CD2-CD1 3.95Å; W197-Y218 AromaticContact CE2-CD1 3.75Å; W197-Y218 HydrophobicContact CE3-CD1 4.48Å; W197-Y218 HydrophobicContact CG-CD1 4.27Å; W197-Y218 HydrophobicContact CZ2-CD1 4.12Å; W197-Y218 AromaticContact NE1-CD1 3.91Å; E201-Y218 HydrophobicContact CB-CD1 4.32Å; E201-Y218 HydrophobicContact CB-CE1 3.8Å; E201-Y218 HydrophobicContact CG-CE1 3.89Å; E201-Y218 PolarHBondContact OE1-OH 3.01Å; Y204-Y218 AromaticContact CD1-CD2 3.94Å; Y204-Y218 HydrophobicContact CD1-CD2 3.94Å; Y204-Y218 HydrophobicContact CD1-CE2 4.29Å; Y204-Y218 AromaticContact CE1-CD2 3.84Å; Y204-Y218 HydrophobicContact CE1-CD2 3.84Å; Y204-Y218 HydrophobicContact CE1-CE2 4.19Å; F205-Y218 WeakPolarHBondContact CD2-O 3.36Å; F205-Y218 WeakPolarHBondContact CE2-O 3.34Å; G216-Y218 VanDerWaalsContact C-N 3.33Å
219V91.2Very high76.6Confident13 Ų1361 Ų618%0.07932%0.322CS..  trans-139.3118.2178.9-1770000109.5F95 Y106 N108 G221 E222F95-V219 HydrophobicContact CE1-CG1 3.63Å; F95-V219 HydrophobicContact CZ-CG1 3.84Å; Y106-V219 HydrophobicContact CD1-CG2 4.4Å; Y106-V219 HydrophobicContact CD2-CG1 4.32Å; Y106-V219 HydrophobicContact CD2-CG2 4.39Å; Y106-V219 HydrophobicContact CE2-CG1 4.5Å; Y106-V219 HydrophobicContact CG-CG2 4.12Å; N108-V219 HydrophobicContact CB-CG2 4.19Å; V219-G221 PolarHBondContact O-N 3.37Å; V219-E222 HydrophobicContact CB-CB 4.29Å; V219-E222 WeakPolarHBondContact CB-OE2 3.37Å; V219-E222 HydrophobicContact CG1-CB 4.24Å
220A88.4Confident74Confident5 Ų563.5 Ų63.54%0.04135%0.348CS..THydrogen-bonded Turntrans-68.8129.7-178.500000112.1F191 E195 W197 F205 V243F191-A220 HydrophobicContact CD1-CB 4.05Å; F191-A220 HydrophobicContact CE1-CB 3.6Å; F191-A220 HydrophobicContact CZ-CB 4.46Å; E195-A220 WeakPolarHBondContact OE1-CA 3.37Å; W197-A220 HydrophobicContact CH2-CB 4.29Å; F205-A220 HydrophobicContact CE1-CB 3.9Å; F205-A220 HydrophobicContact CZ-CB 3.67Å; A220-V243 HydrophobicContact CB-CG1 4.13Å; A220-V243 HydrophobicContact CB-CG2 4.41Å
221G79.3Confident71.4Confident13 Ų1373 Ų7313%0.13439%0.392CS..THydrogen-bonded Turntrans83.211.8178.700000115.9E195 V219 K240E195-G221 PolarHBondContact OE1-N 3.35Å; V219-G221 PolarHBondContact O-N 3.37Å; G221-K240 WeakPolarHBondContact O-CE 3.2Å; G221-K240 PolarHBondContact O-NZ 3.13Å
222E69.9Low69Low82 Ų8276.9 Ų76.938%0.38341%0.411SS..  trans-97.9-15.1176.3-166.9161.8-142.800113.5N108 I109 V219N108-E222 PolarHBondContact ND2-OE1 3.37Å; N108-E222 PolarHBondContact ND2-OE2 2.92Å; I109-E222 WeakPolarHBondContact CD1-OE1 3.43Å; V219-E222 HydrophobicContact CB-CB 4.29Å; V219-E222 WeakPolarHBondContact CB-OE2 3.37Å; V219-E222 HydrophobicContact CG1-CB 4.24Å
223G60.5Low66.8Low46 Ų4681 Ų8147%0.47443%0.43SS..  trans-71.6133.4-174.300000115.7F225G223-F225 PolarHBondContact O-N 3.2Å
224E51.2Low64.6Low85 Ų8584 Ų8440%0.39744%0.443SS..G310 helixtrans-59.5-9.6175.1-156.7-162.8-136.600113.9K82 M226 T227 R228K82-E224 IonicContact NZ-OE1 2.75Å; K82-E224 PolarHBondContact NZ-OE1 3.08Å; K82-E224 IonicContact NZ-OE2 3.45Å; K82-E224 PolarHBondContact NZ-OE2 2.69Å; E224-M226 VanDerWaalsContact C-N 3.26Å; E224-M226 PolarHBondContact O-N 3.49Å; E224-T227 PolarHBondContact O-N 3.45Å; E224-T227 VanDerWaalsContact O-N 3.12Å; E224-T227 PolarHBondContact O-OG1 3.23Å; E224-R228 IonicContact OE2-NH2 3.66Å
225F45.4Very low62.5Low97 Ų9786.1 Ų86.143%0.42546%0.456SS..G310 helixtrans-58.9-33.4-175.5-173.2-103.2000113.6N196 G223 T227 R228 I229N196-F225 VanDerWaalsContact ND2-CE1 3.31Å; N196-F225 WeakPolarHBondContact ND2-CE1 3.38Å; G223-F225 PolarHBondContact O-N 3.2Å; F225-T227 PolarHBondContact O-N 2.86Å; F225-T227 VanDerWaalsContact O-N 3.15Å; F225-R228 PolarHBondContact O-N 3.44Å; F225-I229 HydrophobicContact CE1-CD1 3.59Å; F225-I229 HydrophobicContact CE1-CG1 4.24Å; F225-I229 HydrophobicContact CZ-CD1 3.87Å; F225-I229 HydrophobicContact CZ-CG1 4.33Å
226M46.2Very low60.7Low65 Ų6584.7 Ų84.732%0.3245%0.451SS..G310 helixtrans-66.8-17.4-178.7-153163.9-63.100112.9E224 R228 P235 E236E224-M226 VanDerWaalsContact C-N 3.26Å; E224-M226 PolarHBondContact O-N 3.49Å; M226-R228 VanDerWaalsContact C-N 3.33Å; M226-P235 HydrophobicContact SD-CB 4.37Å; M226-E236 HydrophobicContact SD-CB 3.57Å; M226-E236 VanDerWaalsContact SD-CB 3.57Å; M226-E236 HydrophobicContact SD-CG 3.78Å
227T42.6Very low59.5Low123 Ų12392.9 Ų92.976%0.75548%0.477SS*.G310 helixtrans-80.2-11172.7-34.40000113.2E224 F225E224-T227 PolarHBondContact O-N 3.45Å; E224-T227 VanDerWaalsContact O-N 3.12Å; E224-T227 PolarHBondContact O-OG1 3.23Å; F225-T227 PolarHBondContact O-N 2.86Å; F225-T227 VanDerWaalsContact O-N 3.15Å
228R44.5Very low58.7Low181 Ų18195.6 Ų95.668%0.68348%0.481SS*.THydrogen-bonded Turntrans-95.7-13.2-178.1-63.4-164.4-175.3-158.34.4115.2E224 F225 M226E224-R228 IonicContact OE2-NH2 3.66Å; F225-R228 PolarHBondContact O-N 3.44Å; M226-R228 VanDerWaalsContact C-N 3.33Å
229I45.3Very low58.3Low106 Ų10692.9 Ų92.954%0.54447%0.471SS..SBendtrans-102.4113.3176.1-60.4-175.5000109.7F225F225-I229 HydrophobicContact CE1-CD1 3.59Å; F225-I229 HydrophobicContact CE1-CG1 4.24Å; F225-I229 HydrophobicContact CZ-CD1 3.87Å; F225-I229 HydrophobicContact CZ-CG1 4.33Å
230G42Very low57.8Low52 Ų5294.6 Ų94.654%0.53648%0.477SS..  trans-68.5156.7-17600000115.5N232G230-N232 PolarHBondContact O-N 3.23Å; G230-N232 PolarHBondContact O-ND2 3.4Å
231E41.1Very low57.6Low202 Ų20297.9 Ų97.994%0.94450%0.498SS*.SBendtrans59.7-10.1162.4-55.9-159.9135.800119.3L233E231-L233 PolarHBondContact O-N 3.22Å
232N43.3Very low58Low119 Ų119101.4 Ų101.464%0.63651%0.513SS*.  trans-95.670.4175.7-73.6-80.9000112G230 L234 P235G230-N232 PolarHBondContact O-N 3.23Å; G230-N232 PolarHBondContact O-ND2 3.4Å; N232-L234 PolarHBondContact O-N 3.39Å; N232-P235 WeakPolarHBondContact O-CD 3.38Å
233L48.9Very low59Low143 Ų14397.7 Ų97.775%0.74950%0.496SS*.  trans-71.319.5-174.2-147.878.1000115.6E231E231-L233 PolarHBondContact O-N 3.22Å
234L49.3Very low60.4Low134 Ų13499 Ų9970%0.70249%0.487SS*.SBendtrans-108.3-28-167.3-67175.9000116.8N232 W238N232-L234 PolarHBondContact O-N 3.39Å; L234-W238 PolarHBondContact O-NE1 2.84Å
235P53.3Low62.3Low49 Ų49101 Ų10132%0.31849%0.494SS..SBendtrans-63.9-45.2179.9-25.536.3000114.5M226 N232 Y237 W238 Y239M226-P235 HydrophobicContact SD-CB 4.37Å; N232-P235 WeakPolarHBondContact O-CD 3.38Å; P235-Y237 PolarHBondContact O-N 3.41Å; P235-W238 HydrophobicContact CB-CZ2 4.44Å; P235-W238 PolarHBondContact O-N 2.78Å; P235-Y239 VanDerWaalsContact O-CB 3.3Å; P235-Y239 WeakPolarHBondContact O-CB 3.39Å; P235-Y239 PolarHBondContact O-N 3.39Å
236E56.7Low64.6Low98 Ų9897.3 Ų97.346%0.45848%0.478SS..Hα-helixtrans-59.5-44.3-163.2-160.2176.1177.100113.6M226 W238M226-E236 HydrophobicContact SD-CB 3.57Å; M226-E236 VanDerWaalsContact SD-CB 3.57Å; M226-E236 HydrophobicContact SD-CG 3.78Å; E236-W238 PolarHBondContact O-N 3.02Å
237Y65.2Low66.9Low190 Ų19094.5 Ų94.575%0.74546%0.464SS*.Hα-helixtrans-66.7-29.9-174.5-77.8-80.5000114.6P235 P241P235-Y237 PolarHBondContact O-N 3.41Å; Y237-P241 VanDerWaalsContact O-CD 3.3Å; Y237-P241 WeakPolarHBondContact O-CD 3.29Å; Y237-P241 WeakPolarHBondContact O-CG 3.45Å
238W76.4Confident69.3Low142 Ų14290.5 Ų90.554%0.53844%0.438SS..Hα-helixtrans-99.9-24177.863.1-100.4000113L234 P235 E236 P241 L242L234-W238 PolarHBondContact O-NE1 2.84Å; P235-W238 HydrophobicContact CB-CZ2 4.44Å; P235-W238 PolarHBondContact O-N 2.78Å; E236-W238 PolarHBondContact O-N 3.02Å; W238-P241 WeakPolarHBondContact O-CD 3.23Å; W238-L242 HydrophobicContact CE3-CB 4.37Å; W238-L242 HydrophobicContact CE3-CD1 4.01Å; W238-L242 HydrophobicContact CZ3-CD1 4.06Å; W238-L242 VanDerWaalsContact O-CB 3.25Å; W238-L242 WeakPolarHBondContact O-CB 3.37Å; W238-L242 PolarHBondContact O-N 3.03Å
239Y83.4Confident71.7Confident5 Ų584 Ų842%0.0242%0.416CS..Hα-helixtrans-63.2-53.9-178.4177.2-118.7000112.3F191 V194 E195 P235 L242 V243F191-Y239 VanDerWaalsContact CD1-OH 3.23Å; F191-Y239 WeakPolarHBondContact CD1-OH 3.43Å; F191-Y239 HydrophobicContact CE1-CE2 4.39Å; F191-Y239 VanDerWaalsContact CE1-OH 3.29Å; F191-Y239 WeakPolarHBondContact CE1-OH 3.21Å; V194-Y239 HydrophobicContact CB-CE2 4.33Å; V194-Y239 HydrophobicContact CG1-CD1 4.37Å; V194-Y239 HydrophobicContact CG1-CD2 4.21Å; V194-Y239 HydrophobicContact CG1-CE1 3.92Å; V194-Y239 HydrophobicContact CG1-CE2 3.77Å; V194-Y239 HydrophobicContact CG1-CG 4.49Å; V194-Y239 HydrophobicContact CG2-CE2 4.47Å; E195-Y239 WeakPolarHBondContact OE1-CE1 3Å; E195-Y239 VanDerWaalsContact OE1-CZ 3.27Å; E195-Y239 PolarHBondContact OE1-OH 3.08Å; P235-Y239 VanDerWaalsContact O-CB 3.3Å; P235-Y239 WeakPolarHBondContact O-CB 3.39Å; P235-Y239 PolarHBondContact O-N 3.39Å; Y239-L242 PolarHBondContact O-N 2.81Å; Y239-V243 HydrophobicContact CD2-CG2 3.96Å; Y239-V243 HydrophobicContact CE1-CG2 4.2Å; Y239-V243 HydrophobicContact CE2-CG2 3.51Å; Y239-V243 HydrophobicContact CG-CG2 4.46Å; Y239-V243 WeakPolarHBondContact O-CG2 3.29Å; Y239-V243 PolarHBondContact O-N 3.48Å
240K81.3Confident74Confident49 Ų4978.9 Ų78.921%0.21339%0.39CS..Hα-helixtrans-57.6-44.9179.7-70.1179.4176.6179.50112.6G221 W244G221-K240 WeakPolarHBondContact O-CE 3.2Å; G221-K240 PolarHBondContact O-NZ 3.13Å; K240-W244 WeakPolarHBondContact O-CB 3.37Å; K240-W244 PolarHBondContact O-N 3.26Å; K240-W244 VanDerWaalsContact O-N 3.13Å
241P84.6Confident76.5Confident75 Ų7576.8 Ų76.849%0.48737%0.366SS..Hα-helixtrans-62.6-34.5170.5-27.536.7000115.5Y237 W238 W244 F245Y237-P241 VanDerWaalsContact O-CD 3.3Å; Y237-P241 WeakPolarHBondContact O-CD 3.29Å; Y237-P241 WeakPolarHBondContact O-CG 3.45Å; W238-P241 WeakPolarHBondContact O-CD 3.23Å; P241-W244 VanDerWaalsContact O-CB 3.29Å; P241-W244 WeakPolarHBondContact O-CB 3.31Å; P241-W244 PolarHBondContact O-N 2.87Å; P241-F245 PolarHBondContact O-N 3.5Å
242L88Confident78.9Confident86 Ų8667.2 Ų67.245%0.4532%0.322SS..Hα-helixtrans-71.2-42.6178.9-173.5152.6000111.6W238 Y239 W244 F245 W246W238-L242 HydrophobicContact CE3-CB 4.37Å; W238-L242 HydrophobicContact CE3-CD1 4.01Å; W238-L242 HydrophobicContact CZ3-CD1 4.06Å; W238-L242 VanDerWaalsContact O-CB 3.25Å; W238-L242 WeakPolarHBondContact O-CB 3.37Å; W238-L242 PolarHBondContact O-N 3.03Å; Y239-L242 PolarHBondContact O-N 2.81Å; L242-W244 VanDerWaalsContact C-N 3.29Å; L242-W244 PolarHBondContact O-N 3.34Å; L242-F245 PolarHBondContact O-N 3.42Å; L242-F245 VanDerWaalsContact O-N 3.17Å; L242-W246 PolarHBondContact O-N 2.87Å
243V90.6Very high81.2Confident4 Ų462.1 Ų62.12%0.02429%0.294CS..Hα-helixtrans-57-45.5171.2173.10000110.1F191 A220 Y239 F245 W246 I247F191-V243 HydrophobicContact CE1-CG1 4.48Å; F191-V243 HydrophobicContact CE1-CG2 3.83Å; F191-V243 HydrophobicContact CZ-CG1 4.38Å; F191-V243 HydrophobicContact CZ-CG2 4.18Å; A220-V243 HydrophobicContact CB-CG1 4.13Å; A220-V243 HydrophobicContact CB-CG2 4.41Å; Y239-V243 HydrophobicContact CD2-CG2 3.96Å; Y239-V243 HydrophobicContact CE1-CG2 4.2Å; Y239-V243 HydrophobicContact CE2-CG2 3.51Å; Y239-V243 HydrophobicContact CG-CG2 4.46Å; Y239-V243 WeakPolarHBondContact O-CG2 3.29Å; Y239-V243 PolarHBondContact O-N 3.48Å; V243-F245 PolarHBondContact O-N 3.24Å; V243-W246 HydrophobicContact CG1-CE3 4.06Å; V243-W246 HydrophobicContact CG1-CZ3 4.25Å; V243-W246 PolarHBondContact O-N 3.42Å; V243-I247 HydrophobicContact CG1-CD1 4.11Å; V243-I247 WeakPolarHBondContact O-CG1 3.03Å; V243-I247 PolarHBondContact O-N 3.15Å
244W88.7Confident83.1Confident73 Ų7358.2 Ų58.228%0.27727%0.271SS..Hα-helixtrans-55.6-45173.5-111.2112.6000113.8F95 M101 K240 P241 L242 I247 L248F95-W244 AromaticContact CD2-NE1 3.86Å; M101-W244 HydrophobicContact CE-CH2 4.43Å; K240-W244 WeakPolarHBondContact O-CB 3.37Å; K240-W244 PolarHBondContact O-N 3.26Å; K240-W244 VanDerWaalsContact O-N 3.13Å; P241-W244 VanDerWaalsContact O-CB 3.29Å; P241-W244 WeakPolarHBondContact O-CB 3.31Å; P241-W244 PolarHBondContact O-N 2.87Å; L242-W244 VanDerWaalsContact C-N 3.29Å; L242-W244 PolarHBondContact O-N 3.34Å; W244-I247 PolarHBondContact O-N 2.93Å; W244-L248 PolarHBondContact O-N 3.38Å; W244-L248 VanDerWaalsContact O-N 3.07Å
245F90.9Very high84.9Confident127 Ų12753.4 Ų53.456%0.55725%0.251SS*.Hα-helixtrans-68.4-37.7177.9-176.3-107000112.2P241 L242 V243 L248 L249P241-F245 PolarHBondContact O-N 3.5Å; L242-F245 PolarHBondContact O-N 3.42Å; L242-F245 VanDerWaalsContact O-N 3.17Å; V243-F245 PolarHBondContact O-N 3.24Å; F245-L248 PolarHBondContact O-N 3.19Å; F245-L249 HydrophobicContact CD1-CD1 4.09Å; F245-L249 HydrophobicContact CE1-CD1 3.49Å; F245-L249 VanDerWaalsContact CE1-CD1 3.49Å; F245-L249 HydrophobicContact CE1-CG 4.36Å; F245-L249 HydrophobicContact CE2-CD1 4.34Å; F245-L249 HydrophobicContact CZ-CD1 3.64Å; F245-L249 HydrophobicContact CZ-CG 4.27Å; F245-L249 PolarHBondContact O-N 3.3Å; F245-L249 VanDerWaalsContact O-N 3.14Å
246W94.8Very high86.4Confident20 Ų2053 Ų538%0.07625%0.249CC..Hα-helixtrans-61.6-45.8170.7159.170.4000111.7F183 P187 F191 F205 V206 T209 L210 L242 V243 L248 L249 G250F183-W246 PolarHBondContact O-NE1 3.38Å; F183-W246 VanDerWaalsContact O-NE1 3.09Å; P187-W246 HydrophobicContact CB-CD2 4.45Å; P187-W246 HydrophobicContact CB-CZ2 4.35Å; P187-W246 HydrophobicContact CG-CG 4.33Å; P187-W246 VanDerWaalsContact CG-NE1 3.33Å; F191-W246 HydrophobicContact CE2-CD2 4.4Å; F191-W246 HydrophobicContact CE2-CE3 4.05Å; F191-W246 AromaticContact CE2-CH2 3.82Å; F191-W246 HydrophobicContact CE2-CH2 3.82Å; F191-W246 HydrophobicContact CE2-CZ2 4.16Å; F191-W246 AromaticContact CE2-CZ3 3.75Å; F191-W246 HydrophobicContact CE2-CZ3 3.75Å; F191-W246 HydrophobicContact CZ-CD2 4.37Å; F191-W246 AromaticContact CZ-CE3 3.7Å; F191-W246 HydrophobicContact CZ-CE3 3.7Å; F191-W246 HydrophobicContact CZ-CH2 4.12Å; F191-W246 AromaticContact CZ-CZ3 3.56Å; F191-W246 HydrophobicContact CZ-CZ3 3.56Å; F205-W246 AromaticContact CE1-CH2 3.96Å; F205-W246 HydrophobicContact CE1-CH2 3.96Å; F205-W246 AromaticContact CE1-CZ3 3.93Å; F205-W246 HydrophobicContact CE1-CZ3 3.93Å; F205-W246 HydrophobicContact CZ-CZ3 4.35Å; V206-W246 HydrophobicContact CB-CZ2 4.31Å; V206-W246 HydrophobicContact CG1-CZ2 4.2Å; V206-W246 HydrophobicContact CG2-CH2 4.16Å; V206-W246 HydrophobicContact CG2-CZ2 3.93Å; T209-W246 HydrophobicContact CG2-CH2 3.73Å; T209-W246 HydrophobicContact CG2-CZ3 4Å; L210-W246 HydrophobicContact CD1-CZ2 3.88Å; L210-W246 HydrophobicContact CD2-CH2 4.41Å; L210-W246 HydrophobicContact CD2-CZ2 3.93Å; L210-W246 HydrophobicContact CG-CH2 4.41Å; L210-W246 HydrophobicContact CG-CZ2 3.76Å; L242-W246 PolarHBondContact O-N 2.87Å; V243-W246 HydrophobicContact CG1-CE3 4.06Å; V243-W246 HydrophobicContact CG1-CZ3 4.25Å; V243-W246 PolarHBondContact O-N 3.42Å; W246-L248 PolarHBondContact O-N 2.82Å; W246-L249 PolarHBondContact O-N 3.48Å; W246-G250 WeakPolarHBondContact O-CA 3.35Å; W246-G250 PolarHBondContact O-N 2.95Å
247I95.1Very high87.6Confident6 Ų649.2 Ų49.23%0.03123%0.233CC..Hα-helixtrans-57.1-48.6176.5-70.8171.7000110.3T102 I104 T209 V243 W244 L249 G250 L251T102-I247 HydrophobicContact CG2-CG2 4.32Å; I104-I247 HydrophobicContact CD1-CG2 3.66Å; T209-I247 HydrophobicContact CG2-CD1 4.16Å; T209-I247 HydrophobicContact CG2-CG1 3.96Å; V243-I247 HydrophobicContact CG1-CD1 4.11Å; V243-I247 WeakPolarHBondContact O-CG1 3.03Å; V243-I247 PolarHBondContact O-N 3.15Å; W244-I247 PolarHBondContact O-N 2.93Å; I247-L249 PolarHBondContact O-N 3.03Å; I247-G250 PolarHBondContact O-N 3.28Å; I247-L251 HydrophobicContact CG2-CD1 3.65Å; I247-L251 HydrophobicContact CG2-CG 4.13Å; I247-L251 VanDerWaalsContact O-CB 3.31Å; I247-L251 WeakPolarHBondContact O-CB 3.49Å; I247-L251 VanDerWaalsContact O-CG 3.22Å; I247-L251 WeakPolarHBondContact O-CG 3.43Å; I247-L251 PolarHBondContact O-N 3.4Å
248L92.9Very high88.4Confident39 Ų3944.5 Ų44.520%0.20422%0.22CC..Hα-helixtrans-58.2-47.2179.817863.1000112.6F131 L134 W244 F245 W246 A252F131-L248 HydrophobicContact CE2-CD1 3.86Å; F131-L248 HydrophobicContact CZ-CD1 4.16Å; L134-L248 HydrophobicContact CD2-CD1 3.98Å; L134-L248 HydrophobicContact CG-CD1 4.28Å; W244-L248 PolarHBondContact O-N 3.38Å; W244-L248 VanDerWaalsContact O-N 3.07Å; F245-L248 PolarHBondContact O-N 3.19Å; W246-L248 PolarHBondContact O-N 2.82Å; L248-A252 WeakPolarHBondContact O-CB 3.33Å; L248-A252 PolarHBondContact O-N 2.91Å
249L93.5Very high88.6Confident44 Ų4441.9 Ų41.923%0.2322%0.22CC..Hα-helixtrans-74-37.2179.7-66.1-177.2000112.9V138 F183 F245 W246 I247 A252 Y253V138-L249 HydrophobicContact CG1-CD2 3.93Å; F183-L249 HydrophobicContact CD1-CB 4.42Å; F183-L249 HydrophobicContact CE1-CB 3.56Å; F183-L249 HydrophobicContact CE1-CD1 4.44Å; F183-L249 HydrophobicContact CZ-CB 4.1Å; F245-L249 HydrophobicContact CD1-CD1 4.09Å; F245-L249 HydrophobicContact CE1-CD1 3.49Å; F245-L249 VanDerWaalsContact CE1-CD1 3.49Å; F245-L249 HydrophobicContact CE1-CG 4.36Å; F245-L249 HydrophobicContact CE2-CD1 4.34Å; F245-L249 HydrophobicContact CZ-CD1 3.64Å; F245-L249 HydrophobicContact CZ-CG 4.27Å; F245-L249 PolarHBondContact O-N 3.3Å; F245-L249 VanDerWaalsContact O-N 3.14Å; W246-L249 PolarHBondContact O-N 3.48Å; I247-L249 PolarHBondContact O-N 3.03Å; L249-A252 PolarHBondContact O-N 2.86Å; L249-Y253 WeakPolarHBondContact O-CB 3.45Å; L249-Y253 PolarHBondContact O-N 3.02Å
250G94.6Very high88.5Confident0 Ų045 Ų450%024%0.235CC..Hα-helixtrans-66.9-41.7178.900000112.1W246 I247 Y253 F254W246-G250 WeakPolarHBondContact O-CA 3.35Å; W246-G250 PolarHBondContact O-N 2.95Å; I247-G250 PolarHBondContact O-N 3.28Å; G250-Y253 PolarHBondContact O-N 2.98Å; G250-F254 WeakPolarHBondContact O-CB 3.42Å; G250-F254 PolarHBondContact O-N 2.9Å
251L94.1Very high88.6Confident7 Ų746.6 Ų46.64%0.03725%0.245CC..Hα-helixtrans-65.2-40.7172.5-70.2175.9000111.4T102 I104 F131 L135 L210 T212 I247 Y253 F254 A255T102-L251 HydrophobicContact CG2-CD1 3.89Å; I104-L251 HydrophobicContact CD1-CD1 4.19Å; F131-L251 HydrophobicContact CE1-CD1 4.09Å; F131-L251 HydrophobicContact CZ-CD1 3.94Å; L135-L251 HydrophobicContact CD1-CB 3.77Å; L135-L251 HydrophobicContact CD2-CB 4.48Å; L210-L251 HydrophobicContact CD2-CD2 4.47Å; L210-L251 HydrophobicContact CD2-CG 4.36Å; L210-L251 WeakPolarHBondContact O-CD2 3.31Å; T212-L251 HydrophobicContact CG2-CD2 3.46Å; T212-L251 VanDerWaalsContact CG2-CD2 3.46Å; I247-L251 HydrophobicContact CG2-CD1 3.65Å; I247-L251 HydrophobicContact CG2-CG 4.13Å; I247-L251 VanDerWaalsContact O-CB 3.31Å; I247-L251 WeakPolarHBondContact O-CB 3.49Å; I247-L251 VanDerWaalsContact O-CG 3.22Å; I247-L251 WeakPolarHBondContact O-CG 3.43Å; I247-L251 PolarHBondContact O-N 3.4Å; L251-Y253 VanDerWaalsContact C-N 3.34Å; L251-Y253 PolarHBondContact O-N 3.18Å; L251-F254 PolarHBondContact O-N 2.94Å; L251-A255 VanDerWaalsContact O-CB 3.3Å; L251-A255 WeakPolarHBondContact O-CB 3.2Å; L251-A255 PolarHBondContact O-N 2.94Å
252A92.3Very high88.5Confident1 Ų144.3 Ų44.31%0.00824%0.235CC..Hα-helixtrans-63.9-40.8176.400000111.5L135 V138 L142 L248 L249 S256L135-A252 HydrophobicContact CD1-CB 3.97Å; V138-A252 HydrophobicContact CB-CB 4.13Å; V138-A252 HydrophobicContact CG1-CB 3.6Å; L142-A252 HydrophobicContact CD2-CB 4.41Å; L248-A252 WeakPolarHBondContact O-CB 3.33Å; L248-A252 PolarHBondContact O-N 2.91Å; L249-A252 PolarHBondContact O-N 2.86Å; A252-S256 PolarHBondContact O-N 3.07Å; A252-S256 VanDerWaalsContact O-N 3.14Å
253Y90.8Very high88.2Confident12 Ų1243.8 Ų43.85%0.04723%0.233CC..Hα-helixtrans-61.9-50.5171.4173.1-111.2000111.6I176 F183 L249 G250 L251 A255 S256 V257I176-Y253 WeakPolarHBondContact CA-OH 3.33Å; I176-Y253 PolarHBondContact O-OH 2.93Å; F183-Y253 HydrophobicContact CB-CD1 4.21Å; F183-Y253 AromaticContact CD2-CD1 3.59Å; F183-Y253 HydrophobicContact CD2-CD1 3.59Å; F183-Y253 HydrophobicContact CD2-CD2 4.11Å; F183-Y253 HydrophobicContact CD2-CE1 4.32Å; F183-Y253 AromaticContact CD2-CG 3.47Å; F183-Y253 HydrophobicContact CD2-CG 3.47Å; F183-Y253 VanDerWaalsContact CD2-CG 3.47Å; F183-Y253 HydrophobicContact CE2-CD1 4.39Å; F183-Y253 HydrophobicContact CE2-CD2 4.18Å; F183-Y253 AromaticContact CE2-CG 3.82Å; F183-Y253 HydrophobicContact CE2-CG 3.82Å; F183-Y253 HydrophobicContact CG-CD1 4.24Å; F183-Y253 HydrophobicContact CG-CG 4.4Å; L249-Y253 WeakPolarHBondContact O-CB 3.45Å; L249-Y253 PolarHBondContact O-N 3.02Å; G250-Y253 PolarHBondContact O-N 2.98Å; L251-Y253 VanDerWaalsContact C-N 3.34Å; L251-Y253 PolarHBondContact O-N 3.18Å; Y253-A255 PolarHBondContact O-N 3.08Å; Y253-S256 WeakPolarHBondContact O-CB 3.4Å; Y253-S256 PolarHBondContact O-N 3.46Å; Y253-S256 VanDerWaalsContact O-N 3.08Å; Y253-S256 PolarHBondContact O-OG 2.87Å; Y253-V257 HydrophobicContact CD1-CG2 4.47Å; Y253-V257 HydrophobicContact CD2-CG2 4.16Å; Y253-V257 HydrophobicContact CE1-CG2 3.95Å; Y253-V257 HydrophobicContact CE2-CG2 3.58Å; Y253-V257 VanDerWaalsContact CZ-CG2 3.45Å; Y253-V257 WeakPolarHBondContact O-CG2 3.45Å; Y253-V257 PolarHBondContact O-N 3.23Å
254F89.8Confident87.7Confident62 Ų6251.9 Ų51.927%0.27226%0.263SS..Hα-helixtrans-62.1-42.5-178.2-169.2-107.9000112L210 T211 G250 L251 S256 V257 L258L210-F254 WeakPolarHBondContact O-CD1 3.24Å; L210-F254 WeakPolarHBondContact O-CG 3.26Å; T211-F254 HydrophobicContact CG2-CE1 4.12Å; T211-F254 HydrophobicContact CG2-CE2 4.07Å; T211-F254 HydrophobicContact CG2-CZ 3.62Å; G250-F254 WeakPolarHBondContact O-CB 3.42Å; G250-F254 PolarHBondContact O-N 2.9Å; L251-F254 PolarHBondContact O-N 2.94Å; F254-S256 VanDerWaalsContact C-N 3.31Å; F254-S256 PolarHBondContact O-N 3.38Å; F254-V257 PolarHBondContact O-N 2.75Å; F254-V257 VanDerWaalsContact O-N 3.13Å; F254-L258 HydrophobicContact CD1-CD1 3.84Å; F254-L258 HydrophobicContact CD1-CG 4.05Å; F254-L258 HydrophobicContact CE1-CD1 3.53Å; F254-L258 HydrophobicContact CE1-CD2 4.03Å; F254-L258 HydrophobicContact CE1-CG 3.75Å; F254-L258 HydrophobicContact CZ-CD1 4.3Å; F254-L258 HydrophobicContact CZ-CD2 3.95Å; F254-L258 HydrophobicContact CZ-CG 4.08Å; F254-L258 WeakPolarHBondContact O-CG 3.39Å; F254-L258 PolarHBondContact O-N 2.99Å
255A86.3Confident87.2Confident33 Ų3353.5 Ų53.527%0.27328%0.276SS..Hα-helixtrans-59.8-38.3172.700000112.6L135 L251 Y253 T259L135-A255 HydrophobicContact CD2-CB 4.18Å; L251-A255 VanDerWaalsContact O-CB 3.3Å; L251-A255 WeakPolarHBondContact O-CB 3.2Å; L251-A255 PolarHBondContact O-N 2.94Å; Y253-A255 PolarHBondContact O-N 3.08Å; A255-T259 WeakPolarHBondContact O-CB 3.21Å; A255-T259 PolarHBondContact O-N 3.34Å; A255-T259 PolarHBondContact O-OG1 3.5Å
256S84Confident86.8Confident41 Ų4155.5 Ų55.529%0.28728%0.28SS..Hα-helixtrans-66.9-37.5174.484.20000112.4A252 Y253 F254 T259 M260A252-S256 PolarHBondContact O-N 3.07Å; A252-S256 VanDerWaalsContact O-N 3.14Å; Y253-S256 WeakPolarHBondContact O-CB 3.4Å; Y253-S256 PolarHBondContact O-N 3.46Å; Y253-S256 VanDerWaalsContact O-N 3.08Å; Y253-S256 PolarHBondContact O-OG 2.87Å; F254-S256 VanDerWaalsContact C-N 3.31Å; F254-S256 PolarHBondContact O-N 3.38Å; S256-T259 PolarHBondContact O-N 3.04Å; S256-M260 WeakPolarHBondContact O-CB 3.39Å; S256-M260 PolarHBondContact O-N 3.47Å
257V82.9Confident86.3Confident18 Ų1859 Ų5911%0.10930%0.304CS..Hα-helixtrans-69.6-45.8176.1171.60000111.1Y253 F254 T259 M260 I261Y253-V257 HydrophobicContact CD1-CG2 4.47Å; Y253-V257 HydrophobicContact CD2-CG2 4.16Å; Y253-V257 HydrophobicContact CE1-CG2 3.95Å; Y253-V257 HydrophobicContact CE2-CG2 3.58Å; Y253-V257 VanDerWaalsContact CZ-CG2 3.45Å; Y253-V257 WeakPolarHBondContact O-CG2 3.45Å; Y253-V257 PolarHBondContact O-N 3.23Å; F254-V257 PolarHBondContact O-N 2.75Å; F254-V257 VanDerWaalsContact O-N 3.13Å; V257-T259 VanDerWaalsContact C-N 3.3Å; V257-T259 PolarHBondContact O-N 2.88Å; V257-M260 WeakPolarHBondContact O-CB 3.42Å; V257-M260 PolarHBondContact O-N 3.41Å; V257-I261 HydrophobicContact CG1-CD1 3.68Å; V257-I261 HydrophobicContact CG1-CG1 4.31Å; V257-I261 WeakPolarHBondContact O-CB 3.4Å; V257-I261 VanDerWaalsContact O-CG1 3.31Å; V257-I261 WeakPolarHBondContact O-CG1 3.42Å; V257-I261 PolarHBondContact O-N 3.42Å
258L81.6Confident85.5Confident91 Ų9162.1 Ų62.148%0.47632%0.32SS..Hα-helixtrans-57.6-42.4172.5-73.2-177.7000111.8F254 M260 I261 G262F254-L258 HydrophobicContact CD1-CD1 3.84Å; F254-L258 HydrophobicContact CD1-CG 4.05Å; F254-L258 HydrophobicContact CE1-CD1 3.53Å; F254-L258 HydrophobicContact CE1-CD2 4.03Å; F254-L258 HydrophobicContact CE1-CG 3.75Å; F254-L258 HydrophobicContact CZ-CD1 4.3Å; F254-L258 HydrophobicContact CZ-CD2 3.95Å; F254-L258 HydrophobicContact CZ-CG 4.08Å; F254-L258 WeakPolarHBondContact O-CG 3.39Å; F254-L258 PolarHBondContact O-N 2.99Å; L258-M260 PolarHBondContact O-N 3.17Å; L258-I261 PolarHBondContact O-N 2.85Å; L258-G262 PolarHBondContact O-N 3.48Å
259T81.6Confident84.7Confident87 Ų8763.7 Ų63.753%0.53433%0.334SS..Hα-helixtrans-64.2-40.4176.8-60.50000111.6A255 S256 V257 N263A255-T259 WeakPolarHBondContact O-CB 3.21Å; A255-T259 PolarHBondContact O-N 3.34Å; A255-T259 PolarHBondContact O-OG1 3.5Å; S256-T259 PolarHBondContact O-N 3.04Å; V257-T259 VanDerWaalsContact C-N 3.3Å; V257-T259 PolarHBondContact O-N 2.88Å; T259-N263 WeakPolarHBondContact O-CB 3.23Å; T259-N263 PolarHBondContact O-N 2.76Å; T259-N263 PolarHBondContact O-ND2 3.29Å
260M79.6Confident84.2Confident69 Ų6969.5 Ų69.534%0.3436%0.357SS..Hα-helixtrans-65.9-47.3174.9178.6168.154.500112I176 S256 V257 L258 N263 W264I176-M260 HydrophobicContact CD1-CE 3.66Å; I176-M260 HydrophobicContact CG1-CE 3.56Å; S256-M260 WeakPolarHBondContact O-CB 3.39Å; S256-M260 PolarHBondContact O-N 3.47Å; V257-M260 WeakPolarHBondContact O-CB 3.42Å; V257-M260 PolarHBondContact O-N 3.41Å; L258-M260 PolarHBondContact O-N 3.17Å; M260-N263 PolarHBondContact O-N 2.55Å; M260-W264 PolarHBondContact O-N 3.29Å
261I83.1Confident83.7Confident84 Ų8475.2 Ų75.243%0.43138%0.382SS..Hα-helixtrans-60.8-45.6176.3-68.9168.8000110.3V257 L258 N263 W264 L265V257-I261 HydrophobicContact CG1-CD1 3.68Å; V257-I261 HydrophobicContact CG1-CG1 4.31Å; V257-I261 WeakPolarHBondContact O-CB 3.4Å; V257-I261 VanDerWaalsContact O-CG1 3.31Å; V257-I261 WeakPolarHBondContact O-CG1 3.42Å; V257-I261 PolarHBondContact O-N 3.42Å; L258-I261 PolarHBondContact O-N 2.85Å; I261-N263 VanDerWaalsContact C-N 3.31Å; I261-N263 PolarHBondContact O-N 2.96Å; I261-W264 CarbonylContact O-C 3.56Å; I261-W264 WeakPolarHBondContact O-CA 3.42Å; I261-W264 WeakPolarHBondContact O-CB 3.12Å; I261-W264 PolarHBondContact O-N 2.91Å; I261-L265 HydrophobicContact CG2-CD1 3.86Å; I261-L265 HydrophobicContact CG2-CG 4.19Å; I261-L265 WeakPolarHBondContact O-CB 3.35Å; I261-L265 WeakPolarHBondContact O-CG 3.41Å; I261-L265 PolarHBondContact O-N 2.9Å
262G82.8Confident83Confident27 Ų2778.5 Ų78.528%0.27840%0.403SS..Hα-helixtrans-59.6-39.4176.600000112.8L258 R266L258-G262 PolarHBondContact O-N 3.48Å; G262-R266 WeakPolarHBondContact O-CD 3.38Å; G262-R266 WeakPolarHBondContact O-CG 3.4Å; G262-R266 PolarHBondContact O-N 2.97Å
263N82.2Confident82.4Confident74 Ų7484.7 Ų84.740%0.39643%0.426SS..Hα-helixtrans-69.2-35.5172.5-74.1-38.8000112.8T259 M260 I261 R266 V267T259-N263 WeakPolarHBondContact O-CB 3.23Å; T259-N263 PolarHBondContact O-N 2.76Å; T259-N263 PolarHBondContact O-ND2 3.29Å; M260-N263 PolarHBondContact O-N 2.55Å; I261-N263 VanDerWaalsContact C-N 3.31Å; I261-N263 PolarHBondContact O-N 2.96Å; N263-R266 PolarHBondContact O-N 3.36Å; N263-R266 PolarHBondContact OD1-NH1 2.91Å; N263-V267 WeakPolarHBondContact O-CG2 3.17Å; N263-V267 PolarHBondContact O-N 3.44Å; N263-V267 VanDerWaalsContact O-N 3.11Å
264W80.6Confident81.9Confident175 Ų17586.8 Ų86.866%0.66345%0.446SS*.Hα-helixtrans-66.8-43.8173.9-132.873000112M260 I261 R266 V267 L268M260-W264 PolarHBondContact O-N 3.29Å; I261-W264 CarbonylContact O-C 3.56Å; I261-W264 WeakPolarHBondContact O-CA 3.42Å; I261-W264 WeakPolarHBondContact O-CB 3.12Å; I261-W264 PolarHBondContact O-N 2.91Å; W264-R266 VanDerWaalsContact C-N 3.33Å; W264-R266 PolarHBondContact O-N 3.39Å; W264-V267 WeakPolarHBondContact O-CB 3.43Å; W264-V267 PolarHBondContact O-N 3.23Å; W264-L268 HydrophobicContact CE3-CD1 3.65Å; W264-L268 HydrophobicContact CE3-CD2 4.44Å; W264-L268 HydrophobicContact CE3-CG 4.02Å; W264-L268 HydrophobicContact CZ3-CD1 3.84Å; W264-L268 HydrophobicContact CZ3-CD2 4.19Å; W264-L268 HydrophobicContact CZ3-CG 4.24Å; W264-L268 WeakPolarHBondContact O-CG 3.49Å; W264-L268 PolarHBondContact O-N 2.71Å
265L78.1Confident81.7Confident106 Ų10687.7 Ų87.756%0.55545%0.451SS*.Hα-helixtrans-61.2-38.1173.6-71.1171.5000112I261 V267 L268 S269I261-L265 HydrophobicContact CG2-CD1 3.86Å; I261-L265 HydrophobicContact CG2-CG 4.19Å; I261-L265 WeakPolarHBondContact O-CB 3.35Å; I261-L265 WeakPolarHBondContact O-CG 3.41Å; I261-L265 PolarHBondContact O-N 2.9Å; L265-V267 VanDerWaalsContact C-N 3.34Å; L265-V267 PolarHBondContact O-N 3.47Å; L265-L268 HydrophobicContact CD2-CD1 4.49Å; L265-L268 PolarHBondContact O-N 3.44Å; L265-S269 VanDerWaalsContact O-CB 3.23Å; L265-S269 WeakPolarHBondContact O-CB 3.46Å; L265-S269 PolarHBondContact O-N 2.87Å
266R81.9Confident81.3Confident170 Ų17092.9 Ų92.964%0.64247%0.471SS*.Hα-helixtrans-62.1-38.3171.4-73.2164.2-180177.7-4.8112.2G262 N263 W264 K270G262-R266 WeakPolarHBondContact O-CD 3.38Å; G262-R266 WeakPolarHBondContact O-CG 3.4Å; G262-R266 PolarHBondContact O-N 2.97Å; N263-R266 PolarHBondContact O-N 3.36Å; N263-R266 PolarHBondContact OD1-NH1 2.91Å; W264-R266 VanDerWaalsContact C-N 3.33Å; W264-R266 PolarHBondContact O-N 3.39Å; R266-K270 WeakPolarHBondContact O-CG 3.39Å; R266-K270 PolarHBondContact O-N 3.04Å; R266-K270 VanDerWaalsContact O-N 3.15Å
267V83.9Confident81.3Confident93 Ų9395.1 Ų95.156%0.56448%0.477SS*.Hα-helixtrans-71-46.1175.9171.80000111.3N263 W264 L265 S269 K270 K271N263-V267 WeakPolarHBondContact O-CG2 3.17Å; N263-V267 PolarHBondContact O-N 3.44Å; N263-V267 VanDerWaalsContact O-N 3.11Å; W264-V267 WeakPolarHBondContact O-CB 3.43Å; W264-V267 PolarHBondContact O-N 3.23Å; L265-V267 VanDerWaalsContact C-N 3.34Å; L265-V267 PolarHBondContact O-N 3.47Å; V267-S269 VanDerWaalsContact C-N 3.33Å; V267-S269 PolarHBondContact O-N 2.93Å; V267-K270 WeakPolarHBondContact O-CB 3.4Å; V267-K270 PolarHBondContact O-N 3.4Å; V267-K270 VanDerWaalsContact O-N 3.14Å; V267-K271 PolarHBondContact O-N 2.89Å
268L78.6Confident81.3Confident72 Ų72101 Ų10138%0.37750%0.503SS..Hα-helixtrans-57.9-44.8174.3-70.9176.2000111.4W264 L265 K270 K271 T272W264-L268 HydrophobicContact CE3-CD1 3.65Å; W264-L268 HydrophobicContact CE3-CD2 4.44Å; W264-L268 HydrophobicContact CE3-CG 4.02Å; W264-L268 HydrophobicContact CZ3-CD1 3.84Å; W264-L268 HydrophobicContact CZ3-CD2 4.19Å; W264-L268 HydrophobicContact CZ3-CG 4.24Å; W264-L268 WeakPolarHBondContact O-CG 3.49Å; W264-L268 PolarHBondContact O-N 2.71Å; L265-L268 HydrophobicContact CD2-CD1 4.49Å; L265-L268 PolarHBondContact O-N 3.44Å; L268-K270 VanDerWaalsContact C-N 3.3Å; L268-K270 PolarHBondContact O-N 3.24Å; L268-K271 PolarHBondContact O-N 2.93Å; L268-K271 VanDerWaalsContact O-N 3.1Å; L268-T272 PolarHBondContact O-N 2.81Å; L268-T272 PolarHBondContact O-OG1 2.75Å; L268-T272 VanDerWaalsContact O-OG1 3.12Å
269S76.5Confident81.5Confident71 Ų71102.6 Ų102.650%0.49751%0.512SS..Hα-helixtrans-64-30.6176.9176.70000113.5L265 V267 R273L265-S269 VanDerWaalsContact O-CB 3.23Å; L265-S269 WeakPolarHBondContact O-CB 3.46Å; L265-S269 PolarHBondContact O-N 2.87Å; V267-S269 VanDerWaalsContact C-N 3.33Å; V267-S269 PolarHBondContact O-N 2.93Å; S269-R273 VanDerWaalsContact O-CB 3.3Å; S269-R273 WeakPolarHBondContact O-CB 3.46Å; S269-R273 PolarHBondContact O-N 3.2Å
270K82.9Confident81.5Confident166 Ų166107.1 Ų107.172%0.72252%0.519SS*.Hα-helixtrans-70.2-43.4169.8-76-179.6178-171.60111.2R266 V267 L268 A274R266-K270 WeakPolarHBondContact O-CG 3.39Å; R266-K270 PolarHBondContact O-N 3.04Å; R266-K270 VanDerWaalsContact O-N 3.15Å; V267-K270 WeakPolarHBondContact O-CB 3.4Å; V267-K270 PolarHBondContact O-N 3.4Å; V267-K270 VanDerWaalsContact O-N 3.14Å; L268-K270 VanDerWaalsContact C-N 3.3Å; L268-K270 PolarHBondContact O-N 3.24Å; K270-A274 PolarHBondContact O-N 3.41Å; K270-A274 VanDerWaalsContact O-N 3.1Å
271K83.8Confident81.8Confident120 Ų120106.5 Ų106.552%0.52253%0.525SS..Hα-helixtrans-65.1-52.8-179.5-179.1176.9167.7-178.80112.1V267 L268 R273 A274 E275V267-K271 PolarHBondContact O-N 2.89Å; L268-K271 PolarHBondContact O-N 2.93Å; L268-K271 VanDerWaalsContact O-N 3.1Å; K271-R273 PolarHBondContact O-N 2.59Å; K271-A274 WeakPolarHBondContact O-CB 3.29Å; K271-A274 PolarHBondContact O-N 3.03Å; K271-E275 WeakPolarHBondContact CE-OE1 3.3Å; K271-E275 WeakPolarHBondContact CE-OE2 3.25Å; K271-E275 IonicContact NZ-OE1 2.7Å; K271-E275 PolarHBondContact NZ-OE1 2.63Å; K271-E275 VanDerWaalsContact NZ-OE1 3.14Å; K271-E275 PolarHBondContact O-N 3.4Å
272T79.8Confident81.9Confident76 Ų76108.8 Ų108.847%0.46653%0.533SS..Hα-helixtrans-63.5-30-179.755.60000112.4L268 M276L268-T272 PolarHBondContact O-N 2.81Å; L268-T272 PolarHBondContact O-OG1 2.75Å; L268-T272 VanDerWaalsContact O-OG1 3.12Å; T272-M276 WeakPolarHBondContact O-CB 3.31Å; T272-M276 WeakPolarHBondContact O-CG 3.49Å; T272-M276 PolarHBondContact O-N 3.22Å
273R79.5Confident81.9Confident131 Ų131110 Ų11049%0.49454%0.541SS..Hα-helixtrans-65.1-44.8169.6178.5177.5169.8-129.4-23.5112S269 K271 M276 E277S269-R273 VanDerWaalsContact O-CB 3.3Å; S269-R273 WeakPolarHBondContact O-CB 3.46Å; S269-R273 PolarHBondContact O-N 3.2Å; K271-R273 PolarHBondContact O-N 2.59Å; R273-M276 PolarHBondContact O-N 3.4Å; R273-E277 HydrophobicContact CG-CG 4.38Å; R273-E277 IonicContact CZ-OE1 2.63Å; R273-E277 IonicContact CZ-OE2 3.14Å; R273-E277 IonicContact NE-OE1 2.75Å; R273-E277 PolarHBondContact NE-OE1 3.47Å; R273-E277 IonicContact NE-OE2 3.18Å; R273-E277 PolarHBondContact NE-OE2 2.83Å; R273-E277 VanDerWaalsContact NH2-CD 3.29Å; R273-E277 IonicContact NH2-OE1 2.71Å; R273-E277 PolarHBondContact NH2-OE1 3.18Å; R273-E277 IonicContact NH2-OE2 2.76Å; R273-E277 PolarHBondContact NH2-OE2 3.08Å; R273-E277 WeakPolarHBondContact O-CB 3.15Å; R273-E277 WeakPolarHBondContact O-CG 3.49Å; R273-E277 PolarHBondContact O-N 3.27Å
274A81.1Confident82.1Confident56 Ų56109.7 Ų109.746%0.46354%0.541SS..Hα-helixtrans-62.5-46.2178.400000111.3K270 K271 M276 E277 E278K270-A274 PolarHBondContact O-N 3.41Å; K270-A274 VanDerWaalsContact O-N 3.1Å; K271-A274 WeakPolarHBondContact O-CB 3.29Å; K271-A274 PolarHBondContact O-N 3.03Å; A274-M276 VanDerWaalsContact C-N 3.32Å; A274-M276 PolarHBondContact O-N 2.99Å; A274-E277 PolarHBondContact O-N 3.18Å; A274-E277 VanDerWaalsContact O-N 3.1Å; A274-E278 PolarHBondContact O-N 3.15Å
275E85.7Confident82.3Confident82 Ų82106.2 Ų106.238%0.38354%0.536SS..Hα-helixtrans-61.1-38175.8-68170.7146.300111.7K271 L279K271-E275 WeakPolarHBondContact CE-OE1 3.3Å; K271-E275 WeakPolarHBondContact CE-OE2 3.25Å; K271-E275 IonicContact NZ-OE1 2.7Å; K271-E275 PolarHBondContact NZ-OE1 2.63Å; K271-E275 VanDerWaalsContact NZ-OE1 3.14Å; K271-E275 PolarHBondContact O-N 3.4Å; E275-L279 WeakPolarHBondContact O-CB 3.44Å; E275-L279 VanDerWaalsContact O-CG 3.24Å; E275-L279 WeakPolarHBondContact O-CG 3.49Å; E275-L279 PolarHBondContact O-N 3.48Å
276M77.5Confident82.3Confident141 Ų141108.6 Ų108.670%0.69554%0.537SS*.Hα-helixtrans-69.8-33.2172.3-81.8-166.9168.600114.1T272 R273 A274 R280T272-M276 WeakPolarHBondContact O-CB 3.31Å; T272-M276 WeakPolarHBondContact O-CG 3.49Å; T272-M276 PolarHBondContact O-N 3.22Å; R273-M276 PolarHBondContact O-N 3.4Å; A274-M276 VanDerWaalsContact C-N 3.32Å; A274-M276 PolarHBondContact O-N 2.99Å; M276-R280 VanDerWaalsContact O-CB 3.26Å; M276-R280 WeakPolarHBondContact O-CB 3.06Å; M276-R280 PolarHBondContact O-N 2.75Å
277E82.9Confident82.3Confident88 Ų88103.8 Ų103.841%0.41153%0.527SS..Hα-helixtrans-73.9-34.3177.5-74.8176.5169.600111.1R273 A274 A281R273-E277 HydrophobicContact CG-CG 4.38Å; R273-E277 IonicContact CZ-OE1 2.63Å; R273-E277 IonicContact CZ-OE2 3.14Å; R273-E277 IonicContact NE-OE1 2.75Å; R273-E277 PolarHBondContact NE-OE1 3.47Å; R273-E277 IonicContact NE-OE2 3.18Å; R273-E277 PolarHBondContact NE-OE2 2.83Å; R273-E277 VanDerWaalsContact NH2-CD 3.29Å; R273-E277 IonicContact NH2-OE1 2.71Å; R273-E277 PolarHBondContact NH2-OE1 3.18Å; R273-E277 IonicContact NH2-OE2 2.76Å; R273-E277 PolarHBondContact NH2-OE2 3.08Å; R273-E277 WeakPolarHBondContact O-CB 3.15Å; R273-E277 WeakPolarHBondContact O-CG 3.49Å; R273-E277 PolarHBondContact O-N 3.27Å; A274-E277 PolarHBondContact O-N 3.18Å; A274-E277 VanDerWaalsContact O-N 3.1Å; E277-A281 PolarHBondContact O-N 2.93Å
278E84.6Confident82Confident142 Ų142104.9 Ų104.966%0.66453%0.526SS*.Hα-helixtrans-65.1-51.3169.2-176.7178.6-178.900112.2A274 R280 A281 H282A274-E278 PolarHBondContact O-N 3.15Å; E278-R280 PolarHBondContact O-N 3.26Å; E278-A281 WeakPolarHBondContact O-CB 3.21Å; E278-A281 PolarHBondContact O-N 2.78Å; E278-H282 PolarHBondContact O-N 2.85Å
279L85Confident82.2Confident124 Ų124105.1 Ų105.165%0.64953%0.528SS*.Hα-helixtrans-58.5-36.6175.7-74.5169.4000112.1E275 A283E275-L279 WeakPolarHBondContact O-CB 3.44Å; E275-L279 VanDerWaalsContact O-CG 3.24Å; E275-L279 WeakPolarHBondContact O-CG 3.49Å; E275-L279 PolarHBondContact O-N 3.48Å; L279-A283 WeakPolarHBondContact O-CB 3.36Å; L279-A283 PolarHBondContact O-N 2.88Å
280R82.6Confident82Confident183 Ų183105.5 Ų105.569%0.69152%0.523SS*.Hα-helixtrans-66.2-42.3174.3-175.9179.6179.187.23.6111.8M276 E278 A283 T284M276-R280 VanDerWaalsContact O-CB 3.26Å; M276-R280 WeakPolarHBondContact O-CB 3.06Å; M276-R280 PolarHBondContact O-N 2.75Å; E278-R280 PolarHBondContact O-N 3.26Å; R280-A283 PolarHBondContact O-N 3.15Å; R280-T284 PolarHBondContact O-N 3.04Å; R280-T284 PolarHBondContact O-OG1 3.25Å; R280-T284 VanDerWaalsContact O-OG1 3.11Å
281A84.6Confident81.6Confident55 Ų55103.4 Ų103.446%0.45552%0.516SS..Hα-helixtrans-62.3-48.1177.700000111.4E277 E278 A283 T284 D285E277-A281 PolarHBondContact O-N 2.93Å; E278-A281 WeakPolarHBondContact O-CB 3.21Å; E278-A281 PolarHBondContact O-N 2.78Å; A281-A283 VanDerWaalsContact C-N 3.32Å; A281-A283 PolarHBondContact O-N 3.32Å; A281-T284 WeakPolarHBondContact CA-OG1 3.48Å; A281-T284 PolarHBondContact O-N 3.25Å; A281-T284 VanDerWaalsContact O-N 3.16Å; A281-T284 PolarHBondContact O-OG1 2.92Å; A281-D285 PolarHBondContact O-N 2.95Å
282H85.4Confident81Confident133 Ų133102.6 Ų102.662%0.61652%0.518SS*.Hα-helixtrans-61.8-38176.3-171.4-76.3000112.2E278 W286E278-H282 PolarHBondContact O-N 2.85Å; H282-W286 WeakPolarHBondContact O-CB 3.39Å; H282-W286 PolarHBondContact O-N 2.74Å
283A81.8Confident79.9Confident52 Ų52105 Ų10543%0.4353%0.525SS..Hα-helixtrans-65.2-41173.700000112.4L279 R280 A281 T287L279-A283 WeakPolarHBondContact O-CB 3.36Å; L279-A283 PolarHBondContact O-N 2.88Å; R280-A283 PolarHBondContact O-N 3.15Å; A281-A283 VanDerWaalsContact C-N 3.32Å; A281-A283 PolarHBondContact O-N 3.32Å; A283-T287 WeakPolarHBondContact O-CG2 3.16Å; A283-T287 PolarHBondContact O-N 2.96Å; A283-T287 VanDerWaalsContact O-N 3.09Å; A283-T287 PolarHBondContact O-OG1 3.21Å
284T86.4Confident78.9Confident67 Ų67102.6 Ų102.641%0.41153%0.528SS..Hα-helixtrans-66.7-41.7176.543.40000112.7R280 A281 T287 Q288R280-T284 PolarHBondContact O-N 3.04Å; R280-T284 PolarHBondContact O-OG1 3.25Å; R280-T284 VanDerWaalsContact O-OG1 3.11Å; A281-T284 WeakPolarHBondContact CA-OG1 3.48Å; A281-T284 PolarHBondContact O-N 3.25Å; A281-T284 VanDerWaalsContact O-N 3.16Å; A281-T284 PolarHBondContact O-OG1 2.92Å; T284-T287 WeakPolarHBondContact CA-OG1 3.28Å; T284-T287 PolarHBondContact O-N 3.43Å; T284-T287 PolarHBondContact O-OG1 2.84Å; T284-Q288 PolarHBondContact O-N 3.31Å
285D85.6Confident77.9Confident102 Ų102103.5 Ų103.555%0.54553%0.528SS..Hα-helixtrans-61.1-46.6176-176.259000111.3A281 T287 Q288 N289A281-D285 PolarHBondContact O-N 2.95Å; D285-T287 VanDerWaalsContact C-N 3.31Å; D285-T287 PolarHBondContact O-N 3.27Å; D285-Q288 PolarHBondContact O-N 2.9Å; D285-Q288 VanDerWaalsContact O-N 3.09Å; D285-N289 WeakPolarHBondContact O-CB 3.48Å; D285-N289 PolarHBondContact O-N 2.88Å
286W78.3Confident76.3Confident156 Ų156106.5 Ų106.559%0.59155%0.547SS*.Hα-helixtrans-58.2-40.4174.8-169.575.2000112.8H282 N289 I290H282-W286 WeakPolarHBondContact O-CB 3.39Å; H282-W286 PolarHBondContact O-N 2.74Å; W286-N289 PolarHBondContact O-N 2.93Å; W286-I290 HydrophobicContact CD2-CD1 3.74Å; W286-I290 HydrophobicContact CE3-CD1 3.77Å; W286-I290 HydrophobicContact CH2-CD1 3.58Å; W286-I290 HydrophobicContact CZ2-CD1 3.54Å; W286-I290 HydrophobicContact CZ3-CD1 3.69Å; W286-I290 WeakPolarHBondContact O-CG1 3.3Å; W286-I290 PolarHBondContact O-N 3.45Å
287T81.3Confident74.9Confident69 Ų69107.7 Ų107.742%0.42355%0.548SS..Hα-helixtrans-68.3-35.1175.155.80000113.6A283 T284 D285 Q291A283-T287 WeakPolarHBondContact O-CG2 3.16Å; A283-T287 PolarHBondContact O-N 2.96Å; A283-T287 VanDerWaalsContact O-N 3.09Å; A283-T287 PolarHBondContact O-OG1 3.21Å; T284-T287 WeakPolarHBondContact CA-OG1 3.28Å; T284-T287 PolarHBondContact O-N 3.43Å; T284-T287 PolarHBondContact O-OG1 2.84Å; D285-T287 VanDerWaalsContact C-N 3.31Å; D285-T287 PolarHBondContact O-N 3.27Å; T287-Q291 WeakPolarHBondContact O-CB 3.43Å; T287-Q291 WeakPolarHBondContact O-CG 2.85Å; T287-Q291 PolarHBondContact O-N 3.13Å
288Q78.6Confident73.3Confident117 Ų117113.1 Ų113.155%0.54757%0.565SS.*Hα-helixtrans-70.3-39.9174.8-73.4-172.2-10.200111.7T284 D285 Q291 N292T284-Q288 PolarHBondContact O-N 3.31Å; D285-Q288 PolarHBondContact O-N 2.9Å; D285-Q288 VanDerWaalsContact O-N 3.09Å; Q288-Q291 PolarHBondContact O-N 3.44Å; Q288-N292 VanDerWaalsContact O-CG 3.32Å; Q288-N292 PolarHBondContact O-N 2.98Å
289N82.1Confident71.8Confident76 Ų76112.5 Ų112.541%0.40657%0.565SS.*Hα-helixtrans-60.2-46.5175.3-17221.7000111.7D285 W286 Q291 N292 M293D285-N289 WeakPolarHBondContact O-CB 3.48Å; D285-N289 PolarHBondContact O-N 2.88Å; W286-N289 PolarHBondContact O-N 2.93Å; N289-Q291 PolarHBondContact O-N 2.95Å; N289-N292 PolarHBondContact O-N 3.34Å; N289-M293 WeakPolarHBondContact O-CG 3.39Å; N289-M293 PolarHBondContact O-N 3.36Å
290I72.6Confident69.8Low80 Ų80112.7 Ų112.741%0.4157%0.573SS.*Hα-helixtrans-61.4-42.4173.9-72.8174.1000111.7W286 M293 S294W286-I290 HydrophobicContact CD2-CD1 3.74Å; W286-I290 HydrophobicContact CE3-CD1 3.77Å; W286-I290 HydrophobicContact CH2-CD1 3.58Å; W286-I290 HydrophobicContact CZ2-CD1 3.54Å; W286-I290 HydrophobicContact CZ3-CD1 3.69Å; W286-I290 WeakPolarHBondContact O-CG1 3.3Å; W286-I290 PolarHBondContact O-N 3.45Å; I290-M293 PolarHBondContact O-N 3.21Å; I290-S294 PolarHBondContact O-N 3.15Å
291Q74Confident67.9Low122 Ų122107 Ų10757%0.5757%0.572SS**Hα-helixtrans-60.3-48.6176-79.1179.9-13.100111.2T287 Q288 N289 M293 S294 V295T287-Q291 WeakPolarHBondContact O-CB 3.43Å; T287-Q291 WeakPolarHBondContact O-CG 2.85Å; T287-Q291 PolarHBondContact O-N 3.13Å; Q288-Q291 PolarHBondContact O-N 3.44Å; N289-Q291 PolarHBondContact O-N 2.95Å; Q291-M293 PolarHBondContact O-N 2.91Å; Q291-S294 WeakPolarHBondContact O-CA 3.13Å; Q291-S294 WeakPolarHBondContact O-CB 3.43Å; Q291-S294 PolarHBondContact O-N 3.01Å; Q291-S294 PolarHBondContact O-OG 2.56Å; Q291-V295 WeakPolarHBondContact O-CG2 3.47Å; Q291-V295 PolarHBondContact O-N 3.13Å; Q291-V295 VanDerWaalsContact O-N 3.14Å
292N70.8Confident65.9Low103 Ų103110.6 Ų110.655%0.55158%0.583SS**Hα-helixtrans-59.2-48.6178.4-69.7-18.2000111.9Q288 N289 S294 V295 D296Q288-N292 VanDerWaalsContact O-CG 3.32Å; Q288-N292 PolarHBondContact O-N 2.98Å; N289-N292 PolarHBondContact O-N 3.34Å; N292-S294 PolarHBondContact O-N 2.86Å; N292-V295 PolarHBondContact O-N 3.44Å; N292-D296 PolarHBondContact O-N 3.33Å
293M56.9Low64Low126 Ų126112 Ų11262%0.62160%0.595SS**Hα-helixtrans-57.7-30.5174.3-71.1-174.8178.100113.1N289 I290 Q291N289-M293 WeakPolarHBondContact O-CG 3.39Å; N289-M293 PolarHBondContact O-N 3.36Å; I290-M293 PolarHBondContact O-N 3.21Å; Q291-M293 PolarHBondContact O-N 2.91Å
294S59.8Low62.2Low81 Ų81116.9 Ų116.957%0.56661%0.609SS**Hα-helixtrans-76.7-22.6175.579.90000114.1I290 Q291 N292I290-S294 PolarHBondContact O-N 3.15Å; Q291-S294 WeakPolarHBondContact O-CA 3.13Å; Q291-S294 WeakPolarHBondContact O-CB 3.43Å; Q291-S294 PolarHBondContact O-N 3.01Å; Q291-S294 PolarHBondContact O-OG 2.56Å; N292-S294 PolarHBondContact O-N 2.86Å
295V58.7Low60.5Low75 Ų75117.4 Ų117.446%0.45561%0.609SS.*Hα-helixtrans-74.9-38.2173.9-172.40000110.9Q291 N292 F297 R298Q291-V295 WeakPolarHBondContact O-CG2 3.47Å; Q291-V295 PolarHBondContact O-N 3.13Å; Q291-V295 VanDerWaalsContact O-N 3.14Å; N292-V295 PolarHBondContact O-N 3.44Å; V295-F297 PolarHBondContact O-N 3.38Å; V295-R298 VanDerWaalsContact O-CB 3.25Å; V295-R298 WeakPolarHBondContact O-CB 3.3Å; V295-R298 PolarHBondContact O-N 3.03Å; V295-R298 VanDerWaalsContact O-N 3.08Å
296D53.7Low58.4Low145 Ų145117.7 Ų117.778%0.77562%0.616SS**Hα-helixtrans-65.7-17.3180-74.4-26.7000113.6N292 R298N292-D296 PolarHBondContact O-N 3.33Å; D296-R298 PolarHBondContact O-N 2.76Å
297F47.2Very low57Low165 Ų165119.1 Ų119.172%0.72463%0.627SS**THydrogen-bonded Turntrans-77.510171.8-148.8-97.2000113.9V295 I299V295-F297 PolarHBondContact O-N 3.38Å; F297-I299 VanDerWaalsContact C-N 3.31Å; F297-I299 PolarHBondContact O-N 3.31Å
298R48.8Very low55.1Low203 Ų203123.8 Ų123.877%0.76664%0.642SS**  trans-76.481.2174.3-165.9-179.6-56.7-149.11.5111.1V295 D296V295-R298 VanDerWaalsContact O-CB 3.25Å; V295-R298 WeakPolarHBondContact O-CB 3.3Å; V295-R298 PolarHBondContact O-N 3.03Å; V295-R298 VanDerWaalsContact O-N 3.08Å; D296-R298 PolarHBondContact O-N 2.76Å
299I52.9Low53.5Low128 Ų128129.7 Ų129.766%0.65666%0.659SS**  trans-41125.5178.5-60.4166.2000111.3F297 G301F297-I299 VanDerWaalsContact C-N 3.31Å; F297-I299 PolarHBondContact O-N 3.31Å; I299-G301 PolarHBondContact O-N 2.89Å
300P43.2Very low51.7Low128 Ų128137.5 Ų137.583%0.83168%0.682SS**  trans-75.371.2176.331.7-35.5000110.9N302P300-N302 PolarHBondContact O-N 3.37Å
301G43.4Very low50.1Low64 Ų64145.4 Ų145.466%0.6671%0.707SS**  trans-71.983.3-18000000112.7I299 L303I299-G301 PolarHBondContact O-N 2.89Å; G301-L303 PolarHBondContact O-N 3.46Å
302N42Very low48.4Very low130 Ų130151.3 Ų151.370%0.69572%0.724SS**  trans-70.276.8163.1-176.136.5000109.9P300 E304P300-N302 PolarHBondContact O-N 3.37Å; N302-E304 PolarHBondContact ND2-OE1 2.85Å; N302-E304 PolarHBondContact O-N 3.15Å
303L46.5Very low46.9Very low164 Ų164156 Ų15686%0.85974%0.74SS**  trans-81.791.6172.5-167.375.2000108.9G301 D305G301-L303 PolarHBondContact O-N 3.46Å; L303-D305 PolarHBondContact O-N 3.39Å
304E44.2Very low45.8Very low154 Ų154158.3 Ų158.372%0.7275%0.749SS**  trans-65102.2176-65.2-166.6166.300110.8N302 P306N302-E304 PolarHBondContact ND2-OE1 2.85Å; N302-E304 PolarHBondContact O-N 3.15Å; E304-P306 WeakPolarHBondContact O-CD 3.37Å
305D48.9Very low44.8Very low78 Ų78165.7 Ų165.742%0.41776%0.764SS.*  trans-63.3111.6173.3175.9-7.5000110.6L303 F307 K308L303-D305 PolarHBondContact O-N 3.39Å; D305-F307 PolarHBondContact O-N 3.06Å; D305-F307 VanDerWaalsContact O-N 3.09Å; D305-F307 PolarHBondContact OD1-N 2.78Å; D305-K308 WeakPolarHBondContact OD2-CD 3.29Å; D305-K308 WeakPolarHBondContact OD2-CE 3Å; D305-K308 IonicContact OD2-NZ 2.63Å; D305-K308 PolarHBondContact OD2-NZ 2.88Å
306P43.1Very low43.7Very low108 Ų108170.4 Ų170.470%0.70178%0.781SS**THydrogen-bonded Turntrans-68.1-12.5-173-21.134.4000114.6E304E304-P306 WeakPolarHBondContact O-CD 3.37Å
307F47.4Very low42.8Very low185 Ų185174.2 Ų174.281%0.81178%0.784SS**THydrogen-bonded Turntrans-106.85.5-161.4-80.1-80.7000116.4D305 R309D305-F307 PolarHBondContact O-N 3.06Å; D305-F307 VanDerWaalsContact O-N 3.09Å; D305-F307 PolarHBondContact OD1-N 2.78Å; F307-R309 PolarHBondContact O-N 2.7Å
308K42.3Very low42.1Very low168 Ų168171.5 Ų171.573%0.7379%0.785SS**  trans-97.646.2-177.2-70-173.6173.5110.70116D305 R310D305-K308 WeakPolarHBondContact OD2-CD 3.29Å; D305-K308 WeakPolarHBondContact OD2-CE 3Å; D305-K308 IonicContact OD2-NZ 2.63Å; D305-K308 PolarHBondContact OD2-NZ 2.88Å; K308-R310 PolarHBondContact O-N 3.34Å
309R45.6Very low41.4Very low240 Ų240170.3 Ų170.391%0.90679%0.788SS**  trans-89.866.8169.5-82.2-168.7172-166.50.6114.3F307F307-R309 PolarHBondContact O-N 2.7Å
310R43.6Very low40.3Very low240 Ų240168 Ų16891%0.90680%0.795SS**  trans-179.5148.3157.8-102.1160178.8-160.20.2107.1K308K308-R310 PolarHBondContact O-N 3.34Å
311R38.9Very low39.8Very low246 Ų246170.6 Ų170.693%0.92880%0.796SS**  cis-140.5164.821.9-159.9171.8-176.8167.8-1.6110.4
312R38.7Very low39.2Very low246 Ų246172.7 Ų172.793%0.92880%0.801SS**  trans-70.1156.2-171.8-74.5177.6172.1162.5-4.4114.4
313K40Very low38.8Very low203 Ų203174.4 Ų174.488%0.88381%0.805SS**  trans-42.1139.5163.9-62174.3178176.70112.7
314H31.9Very low38.1Very low173 Ų173170.9 Ų170.980%0.80179%0.793SS**  trans-141.4145.8138.4-139.759.1000110.4H316H314-H316 AromaticContact CD2-CD2 3.77Å; H314-H316 AromaticContact NE2-CD2 3.6Å; H314-H316 AromaticContact NE2-NE2 3.93Å
315R38.8Very low37.5Very low237 Ų237172.4 Ų172.489%0.89480%0.8SS**  trans-137.1111.3-172176.5-164.3-170-166.97.1107.6
316H37.5Very low36.6Very low173 Ų173171.4 Ų171.480%0.80181%0.808SS**  trans-134.9162171.4-98.9-85.2000112.2H314H314-H316 AromaticContact CD2-CD2 3.77Å; H314-H316 AromaticContact NE2-CD2 3.6Å; H314-H316 AromaticContact NE2-NE2 3.93Å
317R34.2Very low36Very low226 Ų226175.4 Ų175.485%0.85382%0.817SS**  trans-151.2117.7-159.5174.2-165.5-173.7-163.34.3109
318S31.5Very low35.2Very low107 Ų107170.6 Ų170.675%0.74881%0.806SS**  trans-151.8134.8161.953.30000107
319H34.1Very low34.7Very low179 Ų179171 Ų17183%0.82981%0.811SS**  65.6128.655.3-75.6-14.6000113.6
320G29.6Very low33.9Very low78 Ų78164.7 Ų164.780%0.80480%0.803SS**  trans159.394.6172.700000112.8
321H33.5Very low33.2Very low183 Ų183156.9 Ų156.985%0.84779%0.79SS**  trans-78.3148.1174.4-72.5-112.1000112.8
322S31.4Very low32.6Very low108 Ų108153.2 Ų153.276%0.75579%0.789SS**  -179.8135.3123.253.20000108.9
323H32.7Very low32.1Very low167 Ų167145.3 Ų145.377%0.77378%0.784SS**  49.313473.6-73-84.6000113.9
324S32Very low31.7Very low89 Ų89140.5 Ų140.562%0.62278%0.782SS**  cis-167.6174.9-6.252.30000110.4
325H32.4Very low32.2Very low186 Ų186138.6 Ų138.686%0.86179%0.785SS**  trans23.3139.1162.8-53.6-71.7000121
326G29.3Very low31.8Very low57 Ų57130.6 Ų130.659%0.58878%0.777SS**  cis135144.97.400000111.1
327H31.4Very low31.3Very low193 Ų193129.5 Ų129.589%0.89477%0.772SS**  trans63.9158.9-176.5-58.5-81.2000115.5
328S29.8Very low31Very low83 Ų83125.8 Ų125.858%0.5876%0.762SS**  cis-165.7165-30.453.70000108.9
329H31.4Very low30.9Very low178 Ų178127.8 Ų127.882%0.82476%0.759SS**  trans63.7165.6172-62.3-66.2000116.3
330S28.5Very low30.6Very low106 Ų106125.5 Ų125.574%0.74175%0.749SS**  cis-167.2172.3-36.1-171.20000108.4
331A29Very low30.5Very low76 Ų76129.4 Ų129.463%0.62875%0.746SS**  trans67.4108.7159.800000119.4
332N27.1Very low30.2Very low169 Ų169128.6 Ų128.690%0.90475%0.748SS**  50.3100.8123.3-54.91.3000118.9
333G27.7Very low30.1Very low80 Ų80132.6 Ų132.683%0.82576%0.755SS**  trans-103.2135.8150.900000111.1
334A32.4Very low29.9Very low103 Ų103129.7 Ų129.785%0.85175%0.753SS**  trans-137.7111.9164.200000109.5
335P41.8Very low29.8Very low132 Ų132133 Ų13386%0.85776%0.759SS**  trans-121.3173.8136.51.820.5000109.6
336G31Very low29.5Very low70 Ų70132.2 Ų132.272%0.72276%0.761SS**  cis137.382.47.500000110
337E27Very low29.6Very low150 Ų150137.5 Ų137.570%0.70177%0.77SS**  trans23131.6163-60.4-153.5124.200122.5
338K27.9Very low29.4Very low147 Ų147134.1 Ų134.164%0.63977%0.769SS**  trans69141.2142.6-64.7161.3-166.6155.80116.6
339Q28.4Very low29.3Very low150 Ų150133.7 Ų133.770%0.70178%0.777SS**  cis-162156.73.8-113.1165.3-88.200106.7
340E29.4Very low29Very low131 Ų131130.9 Ų130.961%0.61278%0.777SS**  cis-162.8-173.6-1.4-147.9179.2-67.800110.2
341Q27.6Very low28.9Very low160 Ų160136.6 Ų136.675%0.74878%0.784SS**  trans52.867.3154.4-65.9179.830.600119.8
342N27.1Very low28.8Very low165 Ų165138.2 Ų138.288%0.88279%0.791SS**  -159.495.6114.9-116.2-21.8000111.5
343Q28.3Very low28.8Very low193 Ų193134 Ų13490%0.90278%0.775SS**  trans-144.9156174.7-73.9-175.6-1500107.6
344S27.9Very low28.9Very low105 Ų105135.9 Ų135.973%0.73478%0.775SS**  cis-137.8146.218.951.10000114.1
345Q31.3Very low28.5Very low160 Ų160141.1 Ų141.175%0.74877%0.774SS**  trans-79.3155.5145.3-70.9174.4-77.500108.5
346N25.5Very low27.8Very low168 Ų168140.1 Ų140.190%0.89877%0.77SS**  trans-125.287.4154.9-11910.4000107.7
347E31.8Very low27.6Very low168 Ų168141.8 Ų141.879%0.78577%0.771SS**  trans-93134.2155.5-75.5-164.5138.100108.4
348S26Very low27.5Very low123 Ų123139.5 Ų139.586%0.8677%0.772SS**  trans-131.368161.266.80000109
349G29.1Very low27.5Very low73 Ų73141.3 Ų141.375%0.75378%0.782SS**  trans-77.8132.1168.400000110.6
350S23.8Very low27.4Very low119 Ų119139 Ų13983%0.83278%0.783SS**  trans-125.196.8164.161.30000109.2
351Y27.9Very low27.3Very low227 Ų227141.9 Ų141.989%0.8980%0.796SS**  trans-76.6135.5174.4-99.3-95.9000111.3
352S25.8Very low27.2Very low109 Ų109139.6 Ų139.676%0.76280%0.798SS**  trans-152.688.6140.548.60000109
353S28.5Very low27.2Very low82 Ų82134.9 Ų134.957%0.57379%0.788SS**  64.293.382.375.90000112.8Y355S353-Y355 PolarHBondContact O-N 2.68Å
354S27.8Very low27.2Very low118 Ų118130.9 Ų130.983%0.82578%0.782SS**  trans-58.9122.1167.749.40000111.5
355Y25.2Very low27.3Very low213 Ų213134 Ų13484%0.83579%0.785SS**  trans-91.1110.7164-100.4-95.7000109.8S353S353-Y355 PolarHBondContact O-N 2.68Å
356S26.9Very low27.2Very low111 Ų111131 Ų13178%0.77678%0.782SS**  trans-112.277.1162.959.50000108.6S358S356-S358 PolarHBondContact O-N 3.28Å
357S26.2Very low27.5Very low106 Ų106132.3 Ų132.374%0.74178%0.782SS**  trans-80.6100.4174.350.30000110.1
358S26.3Very low27.4Very low101 Ų101130.6 Ų130.671%0.70678%0.784SS**  trans-80.6172.716051.50000110.9S356S356-S358 PolarHBondContact O-N 3.28Å
359E27.2Very low27.4Very low185 Ų185132.1 Ų132.186%0.86478%0.782SS**  trans73.7140179.3-58.9-174.2161.200114.7
360S27.1Very low27.5Very low103 Ų103133.7 Ų133.772%0.7278%0.781SS**  cis-168.9150.2-949.90000111.1
361E25.9Very low27.8Very low190 Ų190136.6 Ų136.689%0.88878%0.782SS**  trans179.3152.1148.4-105.3175.8-152.700109.2
362S26Very low27.8Very low113 Ų113130.2 Ų130.279%0.7978%0.776SS**  cis-165.3169.2-34.354.60000109.8
363G27.6Very low27.9Very low65 Ų65131.4 Ų131.467%0.6778%0.779SS**  trans104.3106.5179.300000112.2
364S27.4Very low27.8Very low109 Ų109135.5 Ų135.576%0.76279%0.789SS**  75.113269-67.30000112.5
365E29.4Very low27.9Very low171 Ų171136.7 Ų136.780%0.79979%0.791SS**  cis-155.3146.917.5-137.6146.4-121.600113.9
366S29.1Very low28.1Very low98 Ų98133.9 Ų133.969%0.68579%0.791SS**  trans31.8122.615660.90000122.6
367E31.6Very low28.1Very low195 Ų195140 Ų14091%0.91180%0.797SS**  trans-90.2154.4136.5-67.9-172.2130.700110.2
368T29.8Very low28.4Very low132 Ų132141.8 Ų141.881%0.8180%0.803SS**  trans-148.2131166.150.30000111.9
369D27.8Very low28.9Very low155 Ų155142.3 Ų142.383%0.82980%0.804SS**  trans-61.1154174.7-66.4-76.4000114.5
370S30.4Very low28.9Very low105 Ų105137 Ų13773%0.73480%0.798SS**  169.1139110.5-79.30000117.1
371Q29.1Very low29.1Very low181 Ų181139.3 Ų139.385%0.84681%0.809SS**  trans65.6100.3143.5-65.7-179.36.200122.5
372A28.4Very low29.4Very low92 Ų92139.2 Ų139.276%0.7681%0.808SS**  42.1132.3116.700000122.6
373T27.4Very low29.8Very low134 Ų134138.1 Ų138.182%0.82281%0.806SS**  -176160.1105.2-70.80000111.4
374Q28.2Very low30.3Very low169 Ų169140.6 Ų140.679%0.7981%0.81SS**  trans-62.2155.8-175-59.6166-6700115.8
375T29.3Very low30.7Very low143 Ų143141.2 Ų141.288%0.87781%0.812SS**  -169.6152.6117.713.10000112.5
376D29Very low31Very low153 Ų153140.2 Ų140.282%0.81881%0.812SS**  trans-75.2142.3-175.1-58.9-87.6000115
377R27.4Very low31.4Very low239 Ų239141.3 Ų141.390%0.90282%0.816SS**  trans-166127.1136.7-114.6166.6-177.8152.81.9113.7
378V33Very low31.8Very low144 Ų144138.7 Ų138.787%0.87381%0.814SS**  trans-96.1130.2159.8173.80000107.9
379P35.8Very low32.2Very low113 Ų113140.9 Ų140.973%0.73482%0.815SS**  -145.6158.1126.638-24.5000114.3
380G27.8Very low32.6Very low72 Ų72138.8 Ų138.874%0.74281%0.81SS**  trans88.6105.3151.500000117.2
381T30.3Very low33.2Very low153 Ų153140.7 Ų140.794%0.93981%0.807SS**  trans-84.6106158.6-52.70000108.6
382E32Very low34Very low187 Ų187137.8 Ų137.887%0.87480%0.804SS**PPolyproline II helixtrans-102.1152.7163.7-71.2-167.6131.700110.8
383A35.1Very low34.7Very low90 Ų90139.5 Ų139.574%0.74480%0.8SS**PPolyproline II helixtrans-75.9153.7-173.400000112.2
384P37.1Very low35.3Very low118 Ų118138.6 Ų138.677%0.76679%0.789SS**PPolyproline II helixtrans-64.7145.7175.428.4-35.5000111.4
385P37.4Very low36.1Very low122 Ų122139.3 Ų139.379%0.79279%0.786SS**PPolyproline II helixtrans-70.6150.8172.431-35000111.3
386D34.8Very low36.7Very low150 Ų150137.8 Ų137.880%0.80277%0.772SS**PPolyproline II helixtrans-59.2145.5175.8-72.8-59.3000112.3V388D386-V388 PolarHBondContact O-N 3.05Å
387P37.1Very low37.5Very low120 Ų120133.7 Ų133.778%0.77976%0.76SS**PPolyproline II helixtrans-67.3120-179.827.2-34.1000111.3Q389P387-Q389 PolarHBondContact O-N 3.38Å
388V39.7Very low38.3Very low141 Ų141129.3 Ų129.386%0.85575%0.75SS**  trans-62.6110.1176.1178.40000109.9D386 P390D386-V388 PolarHBondContact O-N 3.05Å; V388-P390 WeakPolarHBondContact O-CD 3.32Å
389Q38.5Very low38.7Very low177 Ų177127.4 Ų127.483%0.82773%0.734SS**PPolyproline II helixtrans-80.5117.2177.8-16617141.400109.6P387P387-Q389 PolarHBondContact O-N 3.38Å
390P36.7Very low39Very low112 Ų112127.3 Ų127.373%0.72773%0.727SS**PPolyproline II helixtrans-66.7141-176.826.5-34.1000111.4V388V388-P390 WeakPolarHBondContact O-CD 3.32Å
391Q43.6Very low39.7Very low145 Ų145127.4 Ų127.468%0.67872%0.721SS**PPolyproline II helixtrans-78.1150.2-178.6-68.7-169.20.300111.6L393Q391-L393 PolarHBondContact O-N 3.34Å
392P45.7Very low40.1Very low120 Ų120128.9 Ų128.978%0.77972%0.715SS**THydrogen-bonded Turntrans-681.7-178.2-21.634.1000116.1
393L43.1Very low40.4Very low128 Ų128125.8 Ų125.867%0.6770%0.703SS**THydrogen-bonded Turntrans-83.9-37.9-170.7-134.377.6000113.1Q391 Y395 L396Q391-L393 PolarHBondContact O-N 3.34Å; L393-Y395 VanDerWaalsContact C-N 3.33Å; L393-Y395 PolarHBondContact O-N 2.95Å; L393-L396 WeakPolarHBondContact O-CB 3.48Å; L393-L396 PolarHBondContact O-N 3.15Å; L393-L396 VanDerWaalsContact O-N 3.08Å
394D40Very low40.6Very low114 Ų114128.8 Ų128.861%0.6171%0.706SS**Hα-helixtrans-67.3-36.6-170.8-55.5-43000111.8L396 A397 E398D394-L396 PolarHBondContact O-N 3.12Å; D394-A397 PolarHBondContact O-N 3.21Å; D394-A397 VanDerWaalsContact O-N 3.16Å; D394-E398 PolarHBondContact O-N 3.38Å
395Y44.1Very low40.9Very low185 Ų185132.2 Ų132.273%0.72571%0.712SS**Hα-helixtrans-57.5-21.4173.6-110.9-84.6000114.2L393 N399L393-Y395 VanDerWaalsContact C-N 3.33Å; L393-Y395 PolarHBondContact O-N 2.95Å; Y395-N399 PolarHBondContact O-ND2 2.85Å
396L42.5Very low41Very low110 Ų110131.3 Ų131.358%0.57671%0.709SS**Hα-helixtrans-88.4-32.2-179.4-118.3168.6000112.4L393 D394 L400L393-L396 WeakPolarHBondContact O-CB 3.48Å; L393-L396 PolarHBondContact O-N 3.15Å; L393-L396 VanDerWaalsContact O-N 3.08Å; D394-L396 PolarHBondContact O-N 3.12Å; L396-L400 HydrophobicContact CD2-CD1 4.32Å; L396-L400 PolarHBondContact O-N 3.18Å
397A45.6Very low41.3Very low68 Ų68129.3 Ų129.356%0.56271%0.707SS**Hα-helixtrans-68.6-4617700000111.4D394 N399 L400 A401D394-A397 PolarHBondContact O-N 3.21Å; D394-A397 VanDerWaalsContact O-N 3.16Å; A397-N399 VanDerWaalsContact C-N 3.29Å; A397-N399 PolarHBondContact O-N 3.05Å; A397-L400 PolarHBondContact O-N 3.04Å; A397-A401 PolarHBondContact O-N 3.45Å
398E43.9Very low41.3Very low147 Ų147131.2 Ų131.269%0.68771%0.71SS**Hα-helixtrans-66.8-28.7-176.7-162.2165.4-140.600112.9D394D394-E398 PolarHBondContact O-N 3.38Å
399N41.4Very low41Very low103 Ų103128.6 Ų128.655%0.55170%0.703SS**Hα-helixtrans-82.6-12.8173.8-78.8-85.5000114.3Y395 A397Y395-N399 PolarHBondContact O-ND2 2.85Å; A397-N399 VanDerWaalsContact C-N 3.29Å; A397-N399 PolarHBondContact O-N 3.05Å
400L42.3Very low40.7Very low112 Ų112129 Ų12959%0.58671%0.705SS**Hα-helixtrans-89.5-28.8175.9-86.9164.2000112.7L396 A397 F402 I403L396-L400 HydrophobicContact CD2-CD1 4.32Å; L396-L400 PolarHBondContact O-N 3.18Å; A397-L400 PolarHBondContact O-N 3.04Å; L400-F402 PolarHBondContact O-N 3.32Å; L400-I403 PolarHBondContact O-N 3.34Å
401A41.8Very low40.5Very low74 Ų74129.4 Ų129.461%0.61271%0.711SS**G310 helixtrans-60.2-29.8175.600000113.2A397 I403A397-A401 PolarHBondContact O-N 3.45Å; A401-I403 VanDerWaalsContact C-N 3.33Å; A401-I403 PolarHBondContact O-N 2.9Å
402F39.1Very low39.9Very low184 Ų184125.6 Ų125.681%0.80771%0.71SS**G310 helixtrans-84.69.5-174-106.5-76.1000116L400L400-F402 PolarHBondContact O-N 3.32Å
403I38.7Very low39.2Very low122 Ų122129.7 Ų129.763%0.62672%0.716SS**G310 helixtrans-109.4-22-174.5-61.8-179.2000113L400 A401L400-I403 PolarHBondContact O-N 3.34Å; A401-I403 VanDerWaalsContact C-N 3.33Å; A401-I403 PolarHBondContact O-N 2.9Å
404D39.7Very low38.5Very low152 Ų152129.7 Ų129.781%0.81372%0.721SS**SBendtrans-85.2-26.9-175.8-144.530.2000112.8S406D404-S406 VanDerWaalsContact C-N 3.29Å; D404-S406 PolarHBondContact O-N 2.85Å
405E43.9Very low37.8Very low191 Ų191133.2 Ų133.289%0.89373%0.734SS**THydrogen-bonded Turntrans-87.847.6-174.1-156.9174.6-162.300113.7
406S38Very low37.1Very low103 Ų103131.7 Ų131.772%0.7274%0.737SS**THydrogen-bonded Turntrans-136.618.2173.976.90000114.8D404D404-S406 VanDerWaalsContact C-N 3.29Å; D404-S406 PolarHBondContact O-N 2.85Å
407S41.6Very low36.3Very low108 Ų108135.2 Ų135.276%0.75575%0.751SS**SBendtrans-12642.9-177.4-60.80000113.6
408D36.7Very low35.6Very low159 Ų159137.8 Ų137.885%0.8576%0.762SS**  trans-150.6143.7163.9-136.4-25000114.4
409A33.8Very low34.9Very low87 Ų87137.9 Ų137.972%0.71977%0.772SS**  trans58.9148.417500000118.4
410Q33.4Very low34.1Very low186 Ų186141.5 Ų141.587%0.86979%0.786SS**  cis-127.2137.94.1-70.8179.8-3.700112.1
411S31.6Very low33.3Very low120 Ų120144.9 Ų144.984%0.83980%0.799SS**  trans-85.7123.3154.9179.60000109K413S411-K413 PolarHBondContact O-N 3.48Å
412G30.4Very low32.5Very low65 Ų65146.5 Ų146.567%0.6781%0.805SS**  trans-71.5112.1-178.700000111.9V414G412-V414 PolarHBondContact O-N 3.29Å
413K31.6Very low31.9Very low206 Ų206146.9 Ų146.990%0.89681%0.807SS**  trans-67.1112.1172.7-74-178.6177.9175.70110.5S411S411-K413 PolarHBondContact O-N 3.48Å
414V29.3Very low31.6Very low128 Ų128149.5 Ų149.578%0.77682%0.816SS**  trans-71.7125.1155.9176.40000107.8G412G412-V414 PolarHBondContact O-N 3.29Å
415Q25.1Very low31.5Very low188 Ų188146.6 Ų146.688%0.87981%0.806SS**  trans-93.5115.5-179.8-174.8167.3-16.200109.5
416L29.4Very low30.8Very low153 Ų153144.7 Ų144.780%0.80180%0.802SS**  trans-113.1129.3174.3-84.3160.8000109.4
417E25.8Very low30.4Very low183 Ų183145.7 Ų145.786%0.85581%0.809SS**PPolyproline II helixtrans-75.3137.6170-65.6-17411800110.9
418P30.7Very low29.9Very low122 Ų122151 Ų15179%0.79281%0.812SS**PPolyproline II helixtrans-94.3128.116133.3-27.7000110.9
419V28.5Very low29.7Very low150 Ų150152.2 Ų152.291%0.90981%0.813SS**PPolyproline II helixtrans-70154.3174.3174.60000111.4
420Q25.4Very low29.5Very low178 Ų178152.6 Ų152.683%0.83282%0.816SS**  trans-89.5113.9-168.1174.9-168.4-68.900114.2
421E25.3Very low29.4Very low184 Ų184153.2 Ų153.286%0.8682%0.816SS**  trans177.5156.5145.9-106.1178.6171.100110.2
422S25.4Very low29.4Very low108 Ų108157.5 Ų157.576%0.75581%0.814SS**  cis-147.5-171-1.160.70000111.3
423K26.5Very low29.4Very low192 Ų192165 Ų16584%0.83582%0.822SS**  trans-85.9170.8-173.4-54.9168.3-175.6165.10111
424Q31.4Very low29.6Very low176 Ų176166.3 Ų166.382%0.82282%0.821SS**  cis-157-152.620-145.4179.9-13.600110.9
425P38.3Very low29.7Very low91 Ų91168.2 Ų168.259%0.59182%0.821SS**  -131.4-177.8-123.947.4-29.7000119.8
426N28.8Very low30Very low151 Ų151170.2 Ų170.281%0.80782%0.821SS**  trans77.9116.2149.3-69.2-28.7000122.3
427S30Very low30.3Very low125 Ų125173.8 Ų173.887%0.87482%0.824SS**  -152.6168.2118.169.40000111.7
428R31.2Very low31Very low219 Ų219171.2 Ų171.283%0.82682%0.823SS**  trans-113.7145.3-152.6-63.8169.3170.6160.2-5.7115.1
429Q32.4Very low31.2Very low184 Ų184170.8 Ų170.886%0.8682%0.818SS**  trans63.4162.2140.1-72.2174.4-10.400119.2
430A29.2Very low31.4Very low96 Ų96170.9 Ų170.979%0.79381%0.814SS**  cis-162.4173.4-23.800000111.9
431K31.3Very low31.7Very low198 Ų198171.7 Ų171.786%0.86181%0.809SS**  trans-72.3148.7-174.3-54.8162.9178.7171.90114.9
432R30.3Very low31.9Very low211 Ų211173.5 Ų173.580%0.79681%0.808SS**  175.2131.7113.2-101.8-179.1167.3-174.5-0.9119.1
433R30.4Very low32.1Very low221 Ų221172.9 Ų172.983%0.83480%0.804SS**  trans63.2149.5135.8-76.6-178169.9-176.9-4.5123.8
434R37Very low32.3Very low234 Ų234168.3 Ų168.388%0.88380%0.796SS**  trans-88164.1175.9-59.9168.8164.9173.6-6.7112.8
435H31Very low32.2Very low169 Ų169169 Ų16978%0.78280%0.796SS**  -167.8140.6120-110.3-73.1000117.3
436R32.3Very low31.8Very low230 Ų230170.3 Ų170.387%0.86880%0.803SS**  trans25.4146.7154.7-77.8179.1172.5167-4.1125.2
437R35.9Very low31.9Very low227 Ų227169 Ų16986%0.85780%0.796SS**  trans-75.2168.9164.4-67.5178.4172.2169.3-4.3113.8
438P39.7Very low32.1Very low129 Ų129173 Ų17384%0.83879%0.793SS**  -132.4-17212039-29.9000114.7
439T35Very low32Very low113 Ų113166.6 Ų166.669%0.69378%0.782SS**  trans-145.2144.8-168.350.10000114.3
440N31.8Very low32Very low153 Ų153166.5 Ų166.582%0.81878%0.781SS**  trans-170.7168.4164.7-91.6-41.5000111.3
441R32Very low32.2Very low194 Ų194168.1 Ų168.173%0.73278%0.777SS**  cis-179.1113.6-34.1-174.7-174.8-141-165.67.2112.8
442R30.7Very low32.3Very low222 Ų222165 Ų16584%0.83877%0.769SS**  trans64.8168.7162.7-70.3177.3177.5177.6-3.4117.5
443S29.3Very low32.6Very low95 Ų95164.3 Ų164.366%0.66477%0.772SS**  cis-169.6162.2-34590000113.2
444S29.1Very low32.7Very low97 Ų97165.1 Ų165.168%0.67878%0.775SS**  trans71.2124.3144.459.40000125.3
445K30.1Very low32.7Very low190 Ų190162.6 Ų162.683%0.82677%0.773SS**  trans82.4114.7131-78.1-175.7176.7-1740123.7
446T30Very low33.7Very low119 Ų119159.3 Ų159.373%0.7377%0.767SS**  44145.8126.561.40000121
447N30.5Very low33.8Very low123 Ų123156.3 Ų156.366%0.65877%0.768SS**  cis-178.5174.337.5-136.79.4000113.3
448Y34.1Very low33.6Very low209 Ų209149.2 Ų149.282%0.8277%0.766SS**  trans65.2156.1165.1-66.4-72.6000119.8
449S30.3Very low33.5Very low84 Ų84151 Ų15159%0.58777%0.768SS**  cis176.6141.3-33.3157.80000112.8
450H32.5Very low33.4Very low182 Ų182151.8 Ų151.884%0.84377%0.773SS**  trans-157.4144.1138.2-136.1-85.8000115
451N33.2Very low33.8Very low131 Ų131150.6 Ų150.670%0.70177%0.771SS**  trans-86170.6171.2-67.9-55.1000110.5
452N33.6Very low34.7Very low133 Ų133146.5 Ų146.571%0.71177%0.77SS**  cis-161.7174.631.4-140.4-9.1000108.2
453K35.9Very low35.1Very low196 Ų196142.2 Ų142.285%0.85277%0.768SS**  cis-139.4-159.629.3-67.5-173.3-179.2176.50113.3
454R32.8Very low36.5Very low238 Ų238142.7 Ų142.790%0.89877%0.769SS**  trans-100170.8-164.5-66174172.1-171.8-3.9116.3
455Q36.6Very low37Very low181 Ų181145.5 Ų145.585%0.84678%0.777SS**  trans-94.8-153.8175-47.1162.4-2300110.5
456P53.3Low37.6Very low99 Ų99144 Ų14464%0.64378%0.777SS**  cis-142.1-179.7-11.740.8-21.1000117.9
457N33.8Very low39.2Very low167 Ų167143 Ų14389%0.89377%0.772SS**  trans59.5140.3147.6-71.24000123.7
458G31.4Very low39.7Very low79 Ų79146.7 Ų146.781%0.81478%0.782SS**  trans168.2133.7159.100000113.6
459N38Very low40.1Very low166 Ų166145.8 Ų145.889%0.88878%0.783SS**  trans-124166-179.5-135.510.8000110.6
460T33.3Very low41.8Very low129 Ų129146.5 Ų146.579%0.79179%0.785SS**  trans129.7145.8150.1-45.40000115.7
461T38.7Very low42.6Very low128 Ų128144.3 Ų144.379%0.78578%0.779SS**  trans-91.9-170.1179.4490000111.5
462P51.1Low43.5Very low108 Ų108148.4 Ų148.470%0.70180%0.801SS**  cis-147.9-178.911.146.9-26.2000120
463V39.2Very low44Very low133 Ų133149.2 Ų149.281%0.80681%0.805SS**  trans21.6128.8137178.10000118.5
464P58.5Low44.5Very low105 Ų105146.7 Ų146.768%0.68280%0.803SS**  -151.2173.76643.9-25.7000118.7
465D40.3Very low45.1Very low156 Ų156141.6 Ų141.683%0.83480%0.798SS**  177.6166.2109.1-109-17.7000115.6
466L42.8Very low45.6Very low159 Ų159139.3 Ų139.383%0.83280%0.795SS**  trans-161.4-168.3-169.5-102.6171.5000109.3
467P62.5Low45.1Very low97 Ų97141.8 Ų141.863%0.6380%0.804SS**  cis-136.7175.7-20.325.2-0.9000115.7
468K41Very low45.9Very low201 Ų201140.1 Ų140.187%0.87480%0.798SS**  148.3139.2122-79.9-171.5179.41770118.5
469K43Very low46.9Very low190 Ų190144.5 Ų144.583%0.82680%0.797SS**  trans-57.8-177.6162.5-110.3-164.2176.7-168.30114
470P65.4Low47.6Very low98 Ų98142.8 Ų142.864%0.63679%0.79SS**  cis-144.5172.622.244.3-25.9000119.7
471L49.6Very low48.8Very low136 Ų136144 Ų14471%0.71279%0.79SS**  trans60.7159.7146-73.4161.1000119
472D53.6Low49.7Very low217 Ų217145.5 Ų145.5100%1.1679%0.79SS**  cis-96.800.2-70.6-55.8000113.9

Retrieved 472 of 472 residues in 407.7 ms (Link to these results)

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