G4VFD9_SCHMA Loading...

Putative transmembrane 4 superfamily member

AlphaFold DB , UniProt , Accession G4VFD9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 233 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
1M51.6Low84.2Confident237 Ų23790.1 Ų90.1100%1.16746%0.464SS*.  097.20-170.1175.5-76.800107.9
2A65.8Low85.2Confident98 Ų9882.8 Ų82.881%0.8143%0.426SS*.PPolyproline II helixtrans-81.5124.4-178.700000109.5S4A2-S4 PolarHBondContact O-N 2.97Å
3L77.9Confident86Confident57 Ų5778.8 Ų78.830%0.29841%0.406SS..PPolyproline II helixtrans-69.7127.6176.3-164.964.7000109S7 S8 T215 Q222L3-S7 VanDerWaalsContact CD1-CB 3.47Å; L3-S8 WeakPolarHBondContact CD2-OG 3.25Å; L3-T215 HydrophobicContact CD2-CG2 3.87Å; L3-Q222 PolarHBondContact O-NE2 2.95Å
4S87.4Confident86.7Confident61 Ų6179.8 Ų79.843%0.42742%0.417SS..PPolyproline II helixtrans-63.5154179.681.70000111.2A2 R6 S7 S8A2-S4 PolarHBondContact O-N 2.97Å; S4-R6 PolarHBondContact O-N 3.08Å; S4-S7 PolarHBondContact O-N 3.36Å; S4-S7 WeakPolarHBondContact OG-CB 3.42Å; S4-S7 PolarHBondContact OG-N 2.94Å; S4-S7 PolarHBondContact OG-OG 2.6Å; S4-S8 PolarHBondContact O-N 3.08Å; S4-S8 PolarHBondContact O-OG 3.3Å
5F88.4Confident87.3Confident27 Ų2775.9 Ų75.912%0.11840%0.397CS..Hα-helixtrans-50.2-46.1177176.7-91.5000112.2S8 K9 H69 Y219 Q222 D224 P225F5-S8 PolarHBondContact O-N 3.31Å; F5-K9 HydrophobicContact CE1-CD 4.43Å; F5-K9 WeakPolarHBondContact O-CB 3.24Å; F5-K9 PolarHBondContact O-N 2.63Å; F5-H69 AromaticContact CE2-CD2 3.42Å; F5-H69 VanDerWaalsContact CE2-CD2 3.42Å; F5-H69 WeakPolarHBondContact CE2-CD2 3.32Å; F5-H69 AromaticContact CE2-NE2 3.47Å; F5-H69 WeakPolarHBondContact CE2-NE2 3.3Å; F5-H69 AromaticContact CZ-CD2 3.66Å; F5-Y219 HydrophobicContact CD2-CD2 4.19Å; F5-Y219 AromaticContact CD2-CE2 3.87Å; F5-Y219 HydrophobicContact CD2-CE2 3.87Å; F5-Y219 HydrophobicContact CE1-CE2 4.29Å; F5-Y219 HydrophobicContact CE2-CD2 4.22Å; F5-Y219 AromaticContact CE2-CE2 3.57Å; F5-Y219 HydrophobicContact CE2-CE2 3.57Å; F5-Y219 HydrophobicContact CG-CE2 4.38Å; F5-Y219 AromaticContact CZ-CE2 3.8Å; F5-Y219 HydrophobicContact CZ-CE2 3.8Å; F5-Q222 HydrophobicContact CD2-CB 3.83Å; F5-D224 HydrophobicContact CE2-CB 4.15Å; F5-D224 HydrophobicContact CZ-CB 3.85Å; F5-P225 HydrophobicContact CB-CG 4.46Å; F5-P225 VanDerWaalsContact CD1-CD 3.47Å; F5-P225 HydrophobicContact CD1-CG 3.96Å; F5-P225 HydrophobicContact CE1-CG 4.46Å; F5-P225 HydrophobicContact CG-CG 4.26Å
6R89.4Confident87.9Confident178 Ų17871.3 Ų71.367%0.67237%0.373SS*.Hα-helixtrans-65.2-42.9179.3-176.9178.1-83.1-171.3-0.7111.5S4 K9 Y10S4-R6 PolarHBondContact O-N 3.08Å; R6-K9 PolarHBondContact O-N 2.03Å; R6-Y10 HydrophobicContact CG-CD2 3.64Å; R6-Y10 HydrophobicContact CG-CE2 3.27Å; R6-Y10 WeakPolarHBondContact O-CD2 3.06Å; R6-Y10 PolarHBondContact O-N 3.4Å
7S91.1Very high88.5Confident55 Ų5571.8 Ų71.839%0.38538%0.376SS..Hα-helixtrans-64.3-44.2177.1-58.20000112L3 S4 K9 Y10 L11L3-S7 VanDerWaalsContact CD1-CB 3.47Å; S4-S7 PolarHBondContact O-N 3.36Å; S4-S7 WeakPolarHBondContact OG-CB 3.42Å; S4-S7 PolarHBondContact OG-N 2.94Å; S4-S7 PolarHBondContact OG-OG 2.6Å; S7-K9 PolarHBondContact O-N 3.33Å; S7-Y10 PolarHBondContact O-N 3.4Å; S7-L11 WeakPolarHBondContact O-CB 3.08Å; S7-L11 PolarHBondContact O-N 2.84Å
8S92.3Very high88.9Confident0 Ų073.3 Ų73.30%038%0.384CS..Hα-helixtrans-60.2-45175.1-55.50000111.4L3 S4 F5 L11 L12 Q222L3-S8 WeakPolarHBondContact CD2-OG 3.25Å; S4-S8 PolarHBondContact O-N 3.08Å; S4-S8 PolarHBondContact O-OG 3.3Å; F5-S8 PolarHBondContact O-N 3.31Å; S8-L11 PolarHBondContact O-N 3.27Å; S8-L12 VanDerWaalsContact O-CG 3.32Å; S8-L12 WeakPolarHBondContact O-CG 3.45Å; S8-L12 PolarHBondContact O-N 3.26Å; S8-Q222 PolarHBondContact OG-OE1 3.29Å
9K93.4Very high89.4Confident55 Ų5571.3 Ų71.324%0.23937%0.37CS..Hα-helixtrans-58.5-50.5176.7-176.6170.4-175.9163.40111.8F5 R6 S7 L12 I13 A66 I67 Y219F5-K9 HydrophobicContact CE1-CD 4.43Å; F5-K9 WeakPolarHBondContact O-CB 3.24Å; F5-K9 PolarHBondContact O-N 2.63Å; R6-K9 PolarHBondContact O-N 2.03Å; S7-K9 PolarHBondContact O-N 3.33Å; K9-L12 PolarHBondContact O-N 2.03Å; K9-I13 HydrophobicContact CG-CD1 3.85Å; K9-I13 VanDerWaalsContact O-CG1 3.27Å; K9-I13 WeakPolarHBondContact O-CG1 3.41Å; K9-I13 PolarHBondContact O-N 3.09Å; K9-A66 WeakPolarHBondContact CE-O 2.96Å; K9-I67 PolarHBondContact NZ-O 3.16Å; K9-Y219 HydrophobicContact CB-CE2 3.74Å; K9-Y219 HydrophobicContact CG-CE2 4.4Å
10Y94Very high89.8Confident138 Ų13869.7 Ų69.754%0.54136%0.362SS..Hα-helixtrans-66.1-37.7179.5-74.4-58.2000112.9R6 S7 I13 T14R6-Y10 HydrophobicContact CG-CD2 3.64Å; R6-Y10 HydrophobicContact CG-CE2 3.27Å; R6-Y10 WeakPolarHBondContact O-CD2 3.06Å; R6-Y10 PolarHBondContact O-N 3.4Å; S7-Y10 PolarHBondContact O-N 3.4Å; Y10-I13 PolarHBondContact O-N 2.05Å; Y10-T14 WeakPolarHBondContact O-CB 3.34Å; Y10-T14 PolarHBondContact O-N 2.97Å; Y10-T14 PolarHBondContact O-OG1 2.95Å
11L94.9Very high90.1Very high85 Ų8570.2 Ų70.245%0.44537%0.369SS..Hα-helixtrans-61.3-47.4175.9-166.788.4000110.8S7 S8 T14 L15 T215S7-L11 WeakPolarHBondContact O-CB 3.08Å; S7-L11 PolarHBondContact O-N 2.84Å; S8-L11 PolarHBondContact O-N 3.27Å; L11-T14 PolarHBondContact O-N 2.99Å; L11-L15 WeakPolarHBondContact O-CB 2.91Å; L11-L15 PolarHBondContact O-N 3.06Å; L11-T215 HydrophobicContact CB-CG2 4.44Å; L11-T215 HydrophobicContact CD2-CG2 3.68Å; L11-T215 WeakPolarHBondContact CD2-OG1 2.97Å
12L95.6Very high92.3Very high2 Ų261.9 Ų61.91%0.0133%0.328CS..Hα-helixtrans-64.7-42.3178.8-70.5167.8000112S8 K9 L15 N16 A66 Y77 T215 A216 Y219S8-L12 VanDerWaalsContact O-CG 3.32Å; S8-L12 WeakPolarHBondContact O-CG 3.45Å; S8-L12 PolarHBondContact O-N 3.26Å; K9-L12 PolarHBondContact O-N 2.03Å; L12-L15 PolarHBondContact O-N 3.25Å; L12-N16 WeakPolarHBondContact O-CB 2.98Å; L12-N16 PolarHBondContact O-N 3.08Å; L12-N16 PolarHBondContact O-ND2 3.06Å; L12-A66 HydrophobicContact CB-CB 3.95Å; L12-Y77 HydrophobicContact CD2-CE1 4.25Å; L12-T215 HydrophobicContact CD1-CG2 4.43Å; L12-T215 HydrophobicContact CD2-CG2 4.36Å; L12-T215 HydrophobicContact CG-CG2 4.08Å; L12-A216 HydrophobicContact CD2-CB 3.87Å; L12-Y219 HydrophobicContact CD1-CD1 3.54Å; L12-Y219 HydrophobicContact CD1-CE1 4.29Å; L12-Y219 HydrophobicContact CD1-CG 3.69Å
13I96.3Very high93.8Very high31 Ų3157.3 Ų57.316%0.15929%0.29CS..Hα-helixtrans-60.6-47.7175.2-69.7168.8000110K9 Y10 L15 N16 L17 L63 A66 I67K9-I13 HydrophobicContact CG-CD1 3.85Å; K9-I13 VanDerWaalsContact O-CG1 3.27Å; K9-I13 WeakPolarHBondContact O-CG1 3.41Å; K9-I13 PolarHBondContact O-N 3.09Å; Y10-I13 PolarHBondContact O-N 2.05Å; I13-L15 PolarHBondContact O-N 2.99Å; I13-N16 PolarHBondContact O-N 3.19Å; I13-L17 HydrophobicContact CG2-CD1 3.98Å; I13-L17 HydrophobicContact CG2-CG 4.39Å; I13-L17 VanDerWaalsContact O-CG 3.31Å; I13-L17 WeakPolarHBondContact O-CG 3.37Å; I13-L17 PolarHBondContact O-N 2.75Å; I13-L63 HydrophobicContact CB-CD1 4.41Å; I13-L63 HydrophobicContact CG1-CD1 4.24Å; I13-L63 HydrophobicContact CG2-CD1 3.95Å; I13-A66 HydrophobicContact CG1-CB 3.9Å; I13-I67 HydrophobicContact CD1-CG1 4.16Å; I13-I67 HydrophobicContact CG1-CG1 4.37Å
14T96Very high94.7Very high93 Ų9360.5 Ų60.557%0.57130%0.302SS*.Hα-helixtrans-62.1-45.1-179.7-55.20000111.6Y10 L11 N16 L17 L18Y10-T14 WeakPolarHBondContact O-CB 3.34Å; Y10-T14 PolarHBondContact O-N 2.97Å; Y10-T14 PolarHBondContact O-OG1 2.95Å; L11-T14 PolarHBondContact O-N 2.99Å; T14-N16 PolarHBondContact O-N 2.96Å; T14-L17 PolarHBondContact O-N 2.01Å; T14-L18 PolarHBondContact O-N 3.38Å
15L95.5Very high95.2Very high22 Ų2262.2 Ų62.212%0.11531%0.305CS..Hα-helixtrans-60.2-45.7177.8-176.767.2000111.6L11 L12 I13 L18 Y19 I208L11-L15 WeakPolarHBondContact O-CB 2.91Å; L11-L15 PolarHBondContact O-N 3.06Å; L12-L15 PolarHBondContact O-N 3.25Å; I13-L15 PolarHBondContact O-N 2.99Å; L15-L18 WeakPolarHBondContact O-CB 3.42Å; L15-L18 PolarHBondContact O-N 3.01Å; L15-Y19 HydrophobicContact CD1-CE1 4.08Å; L15-Y19 HydrophobicContact CD1-CE2 4.07Å; L15-Y19 HydrophobicContact CD2-CE2 4.04Å; L15-Y19 HydrophobicContact CG-CD2 4.28Å; L15-Y19 HydrophobicContact CG-CE2 3.71Å; L15-Y19 PolarHBondContact O-N 3.08Å; L15-I208 HydrophobicContact CD1-CG2 4.49Å
16N97.3Very high95.5Very high1 Ų163.4 Ų63.41%0.00531%0.313CS..Hα-helixtrans-72.8-30.6-179.7-73.6-68.6000112.9L12 I13 T14 L18 Y19 L20 L63 Y77L12-N16 WeakPolarHBondContact O-CB 2.98Å; L12-N16 PolarHBondContact O-N 3.08Å; L12-N16 PolarHBondContact O-ND2 3.06Å; I13-N16 PolarHBondContact O-N 3.19Å; T14-N16 PolarHBondContact O-N 2.96Å; N16-L18 VanDerWaalsContact C-N 3.35Å; N16-Y19 PolarHBondContact O-N 3.26Å; N16-L20 WeakPolarHBondContact O-CB 3.07Å; N16-L20 PolarHBondContact O-N 3.32Å; N16-L63 HydrophobicContact CB-CB 4.36Å; N16-Y77 PolarHBondContact ND2-OH 3.02Å; N16-Y77 WeakPolarHBondContact OD1-CE2 3.35Å; N16-Y77 PolarHBondContact OD1-OH 3.24Å
17L97.5Very high95.8Very high81 Ų8157.3 Ų57.342%0.42430%0.295SS..Hα-helixtrans-64.7-39.9169.8-72.5175.8000111.4I13 T14 L20 V21 L63I13-L17 HydrophobicContact CG2-CD1 3.98Å; I13-L17 HydrophobicContact CG2-CG 4.39Å; I13-L17 VanDerWaalsContact O-CG 3.31Å; I13-L17 WeakPolarHBondContact O-CG 3.37Å; I13-L17 PolarHBondContact O-N 2.75Å; T14-L17 PolarHBondContact O-N 2.01Å; L17-L20 WeakPolarHBondContact O-CB 3.32Å; L17-L20 PolarHBondContact O-N 3.25Å; L17-V21 WeakPolarHBondContact O-CG2 3.49Å; L17-V21 PolarHBondContact O-N 3.07Å; L17-L63 HydrophobicContact CD2-CD2 4.48Å
18L96.6Very high95.9Very high99 Ų9956.6 Ų56.652%0.51830%0.296SS..Hα-helixtrans-61.9-46.2173.5-177.271.1000111.3T14 L15 N16 L20 V21 I22T14-L18 PolarHBondContact O-N 3.38Å; L15-L18 WeakPolarHBondContact O-CB 3.42Å; L15-L18 PolarHBondContact O-N 3.01Å; N16-L18 VanDerWaalsContact C-N 3.35Å; L18-L20 VanDerWaalsContact C-N 3.3Å; L18-L20 PolarHBondContact O-N 3.2Å; L18-V21 PolarHBondContact O-N 3.37Å; L18-I22 HydrophobicContact CG-CD1 4.1Å; L18-I22 WeakPolarHBondContact O-CG1 3.45Å; L18-I22 PolarHBondContact O-N 2.7Å
19Y96.7Very high95.9Very high34 Ų3461 Ų6113%0.13332%0.323CS..Hα-helixtrans-61.7-37.1175.9-67.7-22.5000112.8L15 N16 I22 A23 L58 L81L15-Y19 HydrophobicContact CD1-CE1 4.08Å; L15-Y19 HydrophobicContact CD1-CE2 4.07Å; L15-Y19 HydrophobicContact CD2-CE2 4.04Å; L15-Y19 HydrophobicContact CG-CD2 4.28Å; L15-Y19 HydrophobicContact CG-CE2 3.71Å; L15-Y19 PolarHBondContact O-N 3.08Å; N16-Y19 PolarHBondContact O-N 3.26Å; Y19-I22 PolarHBondContact O-N 3.07Å; Y19-A23 WeakPolarHBondContact O-CB 3.45Å; Y19-A23 PolarHBondContact O-N 3.24Å; Y19-L58 HydrophobicContact CD2-CD2 3.94Å; Y19-L58 HydrophobicContact CE2-CD2 4.31Å; Y19-L81 HydrophobicContact CE2-CD2 4Å
20L97.5Very high95.7Very high39 Ų3958.5 Ų58.520%0.20431%0.312CS..Hα-helixtrans-62.7-44.3175.5-17268.6000111.5N16 L17 L18 A23 F24 F56 A59 V60N16-L20 WeakPolarHBondContact O-CB 3.07Å; N16-L20 PolarHBondContact O-N 3.32Å; L17-L20 WeakPolarHBondContact O-CB 3.32Å; L17-L20 PolarHBondContact O-N 3.25Å; L18-L20 VanDerWaalsContact C-N 3.3Å; L18-L20 PolarHBondContact O-N 3.2Å; L20-A23 WeakPolarHBondContact O-CB 3.21Å; L20-A23 PolarHBondContact O-N 3.44Å; L20-F24 HydrophobicContact CD1-CE2 3.88Å; L20-F24 HydrophobicContact CD1-CZ 4.46Å; L20-F24 HydrophobicContact CD2-CE2 4.23Å; L20-F24 HydrophobicContact CG-CD2 4.14Å; L20-F24 HydrophobicContact CG-CE2 3.7Å; L20-F24 WeakPolarHBondContact O-CD2 3.43Å; L20-F24 PolarHBondContact O-N 2.03Å; L20-F24 VanDerWaalsContact O-N 3.12Å; L20-F56 HydrophobicContact CD1-CD2 3.49Å; L20-F56 VanDerWaalsContact CD1-CD2 3.49Å; L20-F56 HydrophobicContact CD1-CE2 3.59Å; L20-F56 HydrophobicContact CD1-CG 4.47Å; L20-A59 HydrophobicContact CB-CB 4.1Å; L20-A59 HydrophobicContact CD1-CB 4.38Å; L20-V60 HydrophobicContact CD1-CG2 4.48Å
21V97.7Very high95.5Very high82 Ų8254 Ų5450%0.49730%0.304SS..Hα-helixtrans-61.6-45.9175.5172.20000111L17 L18 A23 F24 I25L17-V21 WeakPolarHBondContact O-CG2 3.49Å; L17-V21 PolarHBondContact O-N 3.07Å; L18-V21 PolarHBondContact O-N 3.37Å; V21-A23 VanDerWaalsContact C-N 3.32Å; V21-A23 PolarHBondContact O-N 3.27Å; V21-F24 PolarHBondContact O-N 3.32Å; V21-I25 HydrophobicContact CG1-CD1 3.92Å; V21-I25 WeakPolarHBondContact O-CG1 3.05Å; V21-I25 PolarHBondContact O-N 3.14Å
22I96.5Very high95.3Very high62 Ų6258 Ų5832%0.31832%0.315SS..Hα-helixtrans-61-42.3177.6-67.2167.8000110.8L18 Y19 F24 I25 L26 L55L18-I22 HydrophobicContact CG-CD1 4.1Å; L18-I22 WeakPolarHBondContact O-CG1 3.45Å; L18-I22 PolarHBondContact O-N 2.7Å; Y19-I22 PolarHBondContact O-N 3.07Å; I22-F24 PolarHBondContact O-N 3.31Å; I22-I25 PolarHBondContact O-N 3.42Å; I22-L26 HydrophobicContact CG2-CD1 3.95Å; I22-L26 HydrophobicContact CG2-CG 4.2Å; I22-L26 WeakPolarHBondContact O-CG 3.25Å; I22-L26 PolarHBondContact O-N 2.87Å; I22-L55 HydrophobicContact CG2-CD1 4.42Å
23A97.7Very high94.9Very high1 Ų159.3 Ų59.31%0.00833%0.325CS..Hα-helixtrans-59-45.5177.600000111.9Y19 L20 V21 I25 L26 V27 G52 L55 F56Y19-A23 WeakPolarHBondContact O-CB 3.45Å; Y19-A23 PolarHBondContact O-N 3.24Å; L20-A23 WeakPolarHBondContact O-CB 3.21Å; L20-A23 PolarHBondContact O-N 3.44Å; V21-A23 VanDerWaalsContact C-N 3.32Å; V21-A23 PolarHBondContact O-N 3.27Å; A23-I25 PolarHBondContact O-N 2.93Å; A23-L26 PolarHBondContact O-N 2.85Å; A23-V27 WeakPolarHBondContact O-CG2 3.45Å; A23-V27 PolarHBondContact O-N 3.45Å; A23-G52 WeakPolarHBondContact CB-O 3.48Å; A23-L55 HydrophobicContact CB-CB 4.07Å; A23-F56 HydrophobicContact CB-CB 3.96Å
24F97.3Very high94.2Very high125 Ų12563.6 Ų63.655%0.54834%0.339SS..Hα-helixtrans-63-40175.7-75.5-60.4000112.7L20 V21 I22 G28 F56L20-F24 HydrophobicContact CD1-CE2 3.88Å; L20-F24 HydrophobicContact CD1-CZ 4.46Å; L20-F24 HydrophobicContact CD2-CE2 4.23Å; L20-F24 HydrophobicContact CG-CD2 4.14Å; L20-F24 HydrophobicContact CG-CE2 3.7Å; L20-F24 WeakPolarHBondContact O-CD2 3.43Å; L20-F24 PolarHBondContact O-N 2.03Å; L20-F24 VanDerWaalsContact O-N 3.12Å; V21-F24 PolarHBondContact O-N 3.32Å; I22-F24 PolarHBondContact O-N 3.31Å; F24-G28 PolarHBondContact O-N 3.38Å; F24-F56 HydrophobicContact CE1-CE2 4.28Å; F24-F56 HydrophobicContact CE2-CE2 4.43Å; F24-F56 HydrophobicContact CZ-CD2 4.25Å; F24-F56 AromaticContact CZ-CE2 3.8Å; F24-F56 HydrophobicContact CZ-CE2 3.8Å
25I97.1Very high93.6Very high97 Ų9766.3 Ų66.350%0.49735%0.349SS..Hα-helixtrans-63.3-47.3176.1-67.2168.3000110.5V21 I22 A23 V27 G28 V29V21-I25 HydrophobicContact CG1-CD1 3.92Å; V21-I25 WeakPolarHBondContact O-CG1 3.05Å; V21-I25 PolarHBondContact O-N 3.14Å; I22-I25 PolarHBondContact O-N 3.42Å; A23-I25 PolarHBondContact O-N 2.93Å; I25-V27 PolarHBondContact O-N 2.9Å; I25-G28 PolarHBondContact O-N 2.89Å; I25-V29 HydrophobicContact CG2-CG2 4.11Å; I25-V29 WeakPolarHBondContact O-CB 3.08Å; I25-V29 VanDerWaalsContact O-CG2 3.28Å; I25-V29 WeakPolarHBondContact O-CG2 3.25Å; I25-V29 PolarHBondContact O-N 3.36Å
26L95.4Very high92.7Very high52 Ų5266.8 Ų66.827%0.27236%0.355SS..Hα-helixtrans-60.7-47.3-179.8-71.6174.5000111.8I22 A23 A30 I48 L55I22-L26 HydrophobicContact CG2-CD1 3.95Å; I22-L26 HydrophobicContact CG2-CG 4.2Å; I22-L26 WeakPolarHBondContact O-CG 3.25Å; I22-L26 PolarHBondContact O-N 2.87Å; A23-L26 PolarHBondContact O-N 2.85Å; L26-A30 WeakPolarHBondContact O-CB 3.33Å; L26-A30 PolarHBondContact O-N 2.94Å; L26-A30 VanDerWaalsContact O-N 3.1Å; L26-I48 HydrophobicContact CB-CG2 4.37Å; L26-I48 HydrophobicContact CD2-CG2 4.17Å; L26-L55 HydrophobicContact CD1-CD1 3.66Å
27V95.3Very high91.1Very high50 Ų5074.8 Ų74.830%0.30340%0.396SS..Hα-helixtrans-66.5-44.3178.41770000110.9A23 I25 A30 A31 V53A23-V27 WeakPolarHBondContact O-CG2 3.45Å; A23-V27 PolarHBondContact O-N 3.45Å; I25-V27 PolarHBondContact O-N 2.9Å; V27-A30 PolarHBondContact O-N 2.67Å; V27-A31 VanDerWaalsContact O-CB 3.27Å; V27-A31 WeakPolarHBondContact O-CB 3.05Å; V27-A31 PolarHBondContact O-N 2.74Å; V27-V53 HydrophobicContact CG2-CG2 4.4Å
28G93.2Very high89.3Confident40 Ų4080.1 Ų80.141%0.41241%0.412SS..Hα-helixtrans-63.9-48.5-17900000113.2F24 I25 A31 Y32F24-G28 PolarHBondContact O-N 3.38Å; I25-G28 PolarHBondContact O-N 2.89Å; G28-A31 PolarHBondContact O-N 2.91Å; G28-Y32 WeakPolarHBondContact O-CB 3.46Å; G28-Y32 PolarHBondContact O-N 2.9Å
29V92.5Very high87.3Confident92 Ų9281.3 Ų81.356%0.55842%0.423SS*.Hα-helixtrans-64.7-41.6178.3172.70000110.9I25 Y32 A33I25-V29 HydrophobicContact CG2-CG2 4.11Å; I25-V29 WeakPolarHBondContact O-CB 3.08Å; I25-V29 VanDerWaalsContact O-CG2 3.28Å; I25-V29 WeakPolarHBondContact O-CG2 3.25Å; I25-V29 PolarHBondContact O-N 3.36Å; V29-Y32 PolarHBondContact O-N 3.35Å; V29-A33 WeakPolarHBondContact O-CB 3.07Å; V29-A33 PolarHBondContact O-N 2.91Å
30A90Very high85.8Confident2 Ų282.6 Ų82.62%0.01743%0.434CS..Hα-helixtrans-66.8-40.8178.200000112.5L26 V27 A33 R34 V45 I48 I49L26-A30 WeakPolarHBondContact O-CB 3.33Å; L26-A30 PolarHBondContact O-N 2.94Å; L26-A30 VanDerWaalsContact O-N 3.1Å; V27-A30 PolarHBondContact O-N 2.67Å; A30-A33 PolarHBondContact O-N 2.77Å; A30-R34 PolarHBondContact O-N 3.1Å; A30-V45 HydrophobicContact CB-CG1 3.94Å; A30-V45 VanDerWaalsContact O-CG1 3.28Å; A30-V45 WeakPolarHBondContact O-CG1 3.31Å; A30-I48 HydrophobicContact CB-CB 4.06Å; A30-I48 HydrophobicContact CB-CG2 3.75Å; A30-I49 HydrophobicContact CB-CD1 4.3Å; A30-I49 HydrophobicContact CB-CG1 3.53Å
31A89.6Confident84.6Confident45 Ų4583.2 Ų83.237%0.37244%0.442SS..Hα-helixtrans-62.6-42.6173.900000111.5V27 G28 R34 L35V27-A31 VanDerWaalsContact O-CB 3.27Å; V27-A31 WeakPolarHBondContact O-CB 3.05Å; V27-A31 PolarHBondContact O-N 2.74Å; G28-A31 PolarHBondContact O-N 2.91Å; A31-R34 WeakPolarHBondContact O-CB 3Å; A31-R34 PolarHBondContact O-N 3.35Å; A31-L35 WeakPolarHBondContact O-CG 2.97Å; A31-L35 PolarHBondContact O-N 2.74Å
32Y89.7Confident83.8Confident169 Ų16983.1 Ų83.166%0.66344%0.441SS*.Hα-helixtrans-63.8-42.3175.2-178-96.8000112.6G28 V29 R34 L35 S36G28-Y32 WeakPolarHBondContact O-CB 3.46Å; G28-Y32 PolarHBondContact O-N 2.9Å; V29-Y32 PolarHBondContact O-N 3.35Å; Y32-R34 VanDerWaalsContact C-N 3.26Å; Y32-R34 PolarHBondContact O-N 3.2Å; Y32-L35 PolarHBondContact O-N 2.84Å; Y32-L35 VanDerWaalsContact O-N 3.14Å; Y32-S36 PolarHBondContact O-N 3.33Å; Y32-S36 PolarHBondContact O-OG 3.36Å
33A86.4Confident83.3Confident28 Ų2887.5 Ų87.523%0.23146%0.46CS..Hα-helixtrans-62.6-32.9176.600000112.4V29 A30 S36V29-A33 WeakPolarHBondContact O-CB 3.07Å; V29-A33 PolarHBondContact O-N 2.91Å; A30-A33 PolarHBondContact O-N 2.77Å; A33-S36 PolarHBondContact O-N 3.2Å
34R83.2Confident82.7Confident122 Ų12292.9 Ų92.946%0.4649%0.488SS..Hα-helixtrans-65.9-34.7173.6-98.9-81-172.4-171.97.3113.8A30 A31 Y32 V45A30-R34 PolarHBondContact O-N 3.1Å; A31-R34 WeakPolarHBondContact O-CB 3Å; A31-R34 PolarHBondContact O-N 3.35Å; Y32-R34 VanDerWaalsContact C-N 3.26Å; Y32-R34 PolarHBondContact O-N 3.2Å; R34-V45 HydrophobicContact CG-CB 4.2Å; R34-V45 HydrophobicContact CG-CG1 3.55Å
35L82.7Confident82.3Confident149 Ų14987.1 Ų87.178%0.7846%0.463SS*.Hα-helixtrans-81.3-20.4178.4-64174.6000112.3A31 Y32A31-L35 WeakPolarHBondContact O-CG 2.97Å; A31-L35 PolarHBondContact O-N 2.74Å; Y32-L35 PolarHBondContact O-N 2.84Å; Y32-L35 VanDerWaalsContact O-N 3.14Å
36S77.6Confident81.9Confident32 Ų3284.1 Ų84.122%0.22446%0.455CS..SBendtrans-70.9138.9177.8-62.40000110.8Y32 A33 Y38Y32-S36 PolarHBondContact O-N 3.33Å; Y32-S36 PolarHBondContact O-OG 3.36Å; A33-S36 PolarHBondContact O-N 3.2Å; S36-Y38 PolarHBondContact O-N 2.82Å
37I62Low81.8Confident170 Ų17083.2 Ų83.287%0.87246%0.459SS*.SBendtrans-64.5-10.2177.6-60.1170.5000111.9V39I37-V39 PolarHBondContact O-N 3.33Å; I37-V39 VanDerWaalsContact O-N 3.16Å
38Y61.1Low81.7Confident192 Ų19284.1 Ų84.175%0.75346%0.461SS*.SBendtrans-65.6113.8172.4-69.9-77.8000110.4S36 T40S36-Y38 PolarHBondContact O-N 2.82Å; Y38-T40 VanDerWaalsContact C-N 3.28Å; Y38-T40 PolarHBondContact O-N 2.86Å
39V55.1Low81.7Confident124 Ų12484.9 Ų84.975%0.75246%0.455SS*.  trans-60.688.2178.8-177.50000109.7I37I37-V39 PolarHBondContact O-N 3.33Å; I37-V39 VanDerWaalsContact O-N 3.16Å
40T64Low81.8Confident61 Ų6183.3 Ų83.337%0.37445%0.452SS..  trans-91.9137.1167.352.50000108.2Y38 V42 V45Y38-T40 VanDerWaalsContact C-N 3.28Å; Y38-T40 PolarHBondContact O-N 2.86Å; T40-V42 PolarHBondContact O-N 2.79Å; T40-V45 VanDerWaalsContact OG1-CG2 3.3Å; T40-V45 WeakPolarHBondContact OG1-CG2 3.17Å
41S73.5Confident82.1Confident52 Ų5286.8 Ų86.836%0.36448%0.475SS..  trans-61.1126.3178.2177.40000109.3H43 I44 V45S41-H43 PolarHBondContact O-N 2.87Å; S41-H43 PolarHBondContact OG-ND1 3.27Å; S41-I44 PolarHBondContact O-N 3.45Å; S41-V45 PolarHBondContact O-N 3.01Å
42V80.1Confident82.4Confident81 Ų8184.6 Ų84.649%0.49146%0.458SS..Hα-helixtrans-42.1-39.3173.5160.50000111.8T40 G46T40-V42 PolarHBondContact O-N 2.79Å; V42-G46 PolarHBondContact O-N 3.01Å
43H85.6Confident82.8Confident154 Ų15480.3 Ų80.371%0.71345%0.448SS*.Hα-helixtrans-69.2-44.5-177.9-56.188.5000112.6S41 G46 G47S41-H43 PolarHBondContact O-N 2.87Å; S41-H43 PolarHBondContact OG-ND1 3.27Å; H43-G46 PolarHBondContact O-N 2.81Å; H43-G47 PolarHBondContact O-N 3.28Å
44I85.1Confident83.3Confident114 Ų11483 Ų8359%0.58546%0.455SS*.Hα-helixtrans-65.5-47.7-179.3-62.2173.2000109.4S41 G46 G47 I48S41-I44 PolarHBondContact O-N 3.45Å; I44-G46 VanDerWaalsContact C-N 3.34Å; I44-G46 PolarHBondContact O-N 2.93Å; I44-G47 PolarHBondContact O-N 3.25Å; I44-I48 HydrophobicContact CG2-CD1 4.29Å; I44-I48 WeakPolarHBondContact O-CG1 3.37Å; I44-I48 PolarHBondContact O-N 3.1Å; I44-I48 VanDerWaalsContact O-N 3.13Å
45V88.6Confident83.9Confident4 Ų478.9 Ų78.92%0.02444%0.442CS..Hα-helixtrans-66.9-39.1-178.9-170.30000111.4A30 R34 T40 S41 G47 I48 I49A30-V45 HydrophobicContact CB-CG1 3.94Å; A30-V45 VanDerWaalsContact O-CG1 3.28Å; A30-V45 WeakPolarHBondContact O-CG1 3.31Å; R34-V45 HydrophobicContact CG-CB 4.2Å; R34-V45 HydrophobicContact CG-CG1 3.55Å; T40-V45 VanDerWaalsContact OG1-CG2 3.3Å; T40-V45 WeakPolarHBondContact OG1-CG2 3.17Å; S41-V45 PolarHBondContact O-N 3.01Å; V45-G47 VanDerWaalsContact C-N 3.29Å; V45-G47 PolarHBondContact O-N 3.4Å; V45-I48 PolarHBondContact O-N 2.95Å; V45-I49 HydrophobicContact CG1-CD1 4.08Å; V45-I49 HydrophobicContact CG1-CG1 4.46Å; V45-I49 WeakPolarHBondContact O-CG1 3.24Å; V45-I49 PolarHBondContact O-N 3.46Å
46G90.2Very high84.6Confident33 Ų3375.9 Ų75.934%0.3442%0.423SS..Hα-helixtrans-57.5-42173.200000112.5V42 H43 I44 I49 A50V42-G46 PolarHBondContact O-N 3.01Å; H43-G46 PolarHBondContact O-N 2.81Å; I44-G46 VanDerWaalsContact C-N 3.34Å; I44-G46 PolarHBondContact O-N 2.93Å; G46-I49 PolarHBondContact O-N 2.96Å; G46-A50 WeakPolarHBondContact O-CB 3.45Å; G46-A50 PolarHBondContact O-N 3.48Å
47G92.3Very high85.6Confident34 Ų3478.4 Ų78.435%0.35144%0.437SS..Hα-helixtrans-60.7-45.8175.200000113.2H43 I44 V45 I49 A50 C51H43-G47 PolarHBondContact O-N 3.28Å; I44-G47 PolarHBondContact O-N 3.25Å; V45-G47 VanDerWaalsContact C-N 3.29Å; V45-G47 PolarHBondContact O-N 3.4Å; G47-I49 PolarHBondContact O-N 3.25Å; G47-A50 PolarHBondContact O-N 2.88Å; G47-C51 PolarHBondContact O-N 2.99Å; G47-C51 PolarHBondContact O-SG 3.48Å
48I93.7Very high87.2Confident68 Ų6870.4 Ų70.435%0.34940%0.396SS..Hα-helixtrans-63.6-42.8179.2-60.2168.9000111.1L26 A30 I44 V45 C51 G52L26-I48 HydrophobicContact CB-CG2 4.37Å; L26-I48 HydrophobicContact CD2-CG2 4.17Å; A30-I48 HydrophobicContact CB-CB 4.06Å; A30-I48 HydrophobicContact CB-CG2 3.75Å; I44-I48 HydrophobicContact CG2-CD1 4.29Å; I44-I48 WeakPolarHBondContact O-CG1 3.37Å; I44-I48 PolarHBondContact O-N 3.1Å; I44-I48 VanDerWaalsContact O-N 3.13Å; V45-I48 PolarHBondContact O-N 2.95Å; I48-C51 PolarHBondContact O-N 3.05Å; I48-G52 PolarHBondContact O-N 3.34Å
49I93.1Very high89Confident56 Ų5661.3 Ų61.329%0.28736%0.36SS..Hα-helixtrans-62.2-46.6176.8-65.2170.3000110.4A30 V45 G46 G47 C51 G52 V53A30-I49 HydrophobicContact CB-CD1 4.3Å; A30-I49 HydrophobicContact CB-CG1 3.53Å; V45-I49 HydrophobicContact CG1-CD1 4.08Å; V45-I49 HydrophobicContact CG1-CG1 4.46Å; V45-I49 WeakPolarHBondContact O-CG1 3.24Å; V45-I49 PolarHBondContact O-N 3.46Å; G46-I49 PolarHBondContact O-N 2.96Å; G47-I49 PolarHBondContact O-N 3.25Å; I49-C51 PolarHBondContact O-N 3.16Å; I49-G52 PolarHBondContact O-N 3.34Å; I49-G52 VanDerWaalsContact O-N 3.16Å; I49-V53 HydrophobicContact CG2-CG2 4.37Å; I49-V53 WeakPolarHBondContact O-CG2 3.44Å; I49-V53 PolarHBondContact O-N 3.01Å
50A95.1Very high91Very high60 Ų6057.9 Ų57.950%0.49634%0.34SS..Hα-helixtrans-59.8-44.517900000111.9G46 G47 G52 V53 F54G46-A50 WeakPolarHBondContact O-CB 3.45Å; G46-A50 PolarHBondContact O-N 3.48Å; G47-A50 PolarHBondContact O-N 2.88Å; A50-G52 VanDerWaalsContact C-N 3.34Å; A50-G52 PolarHBondContact O-N 2.81Å; A50-V53 PolarHBondContact O-N 3.3Å; A50-F54 WeakPolarHBondContact O-CB 3.47Å; A50-F54 PolarHBondContact O-N 3.44Å
51C95.5Very high92.5Very high74 Ų7456.1 Ų56.150%0.533%0.331SS..Hα-helixtrans-59.5-43.7173.9-700000112G47 I48 I49 F54 L55G47-C51 PolarHBondContact O-N 2.99Å; G47-C51 PolarHBondContact O-SG 3.48Å; I48-C51 PolarHBondContact O-N 3.05Å; I49-C51 PolarHBondContact O-N 3.16Å; C51-F54 PolarHBondContact O-N 3.34Å; C51-L55 WeakPolarHBondContact O-CB 3.35Å; C51-L55 WeakPolarHBondContact O-CG 3.2Å; C51-L55 PolarHBondContact O-N 2.67Å
52G97Very high93.6Very high0 Ų053.7 Ų53.70%031%0.314CS..Hα-helixtrans-62.3-45.2177.800000113A23 I48 I49 A50 L55 F56A23-G52 WeakPolarHBondContact CB-O 3.48Å; I48-G52 PolarHBondContact O-N 3.34Å; I49-G52 PolarHBondContact O-N 3.34Å; I49-G52 VanDerWaalsContact O-N 3.16Å; A50-G52 VanDerWaalsContact C-N 3.34Å; A50-G52 PolarHBondContact O-N 2.81Å; G52-L55 PolarHBondContact O-N 2.87Å; G52-F56 PolarHBondContact O-N 3.35Å
53V96.9Very high94.4Very high78 Ų7851.8 Ų51.847%0.47330%0.301SS..Hα-helixtrans-65.3-41.9176.9174.80000111.4V27 I49 A50 F56 V57V27-V53 HydrophobicContact CG2-CG2 4.4Å; I49-V53 HydrophobicContact CG2-CG2 4.37Å; I49-V53 WeakPolarHBondContact O-CG2 3.44Å; I49-V53 PolarHBondContact O-N 3.01Å; A50-V53 PolarHBondContact O-N 3.3Å; V53-F56 WeakPolarHBondContact O-CB 3.31Å; V53-F56 PolarHBondContact O-N 2.72Å; V53-V57 WeakPolarHBondContact O-CG2 3.49Å; V53-V57 PolarHBondContact O-N 2.8Å; V53-V57 VanDerWaalsContact O-N 3.07Å
54F96.7Very high94.9Very high86 Ų8647.9 Ų47.938%0.37729%0.285SS..Hα-helixtrans-61.3-46.3175.9179-96.2000111.8A50 C51 F56 V57 L58 L80 L84A50-F54 WeakPolarHBondContact O-CB 3.47Å; A50-F54 PolarHBondContact O-N 3.44Å; C51-F54 PolarHBondContact O-N 3.34Å; F54-F56 VanDerWaalsContact C-N 3.3Å; F54-F56 PolarHBondContact O-N 3.26Å; F54-V57 PolarHBondContact O-N 3.31Å; F54-L58 HydrophobicContact CE1-CD1 4.12Å; F54-L58 WeakPolarHBondContact O-CB 3.42Å; F54-L58 PolarHBondContact O-N 3.41Å; F54-L80 HydrophobicContact CE2-CD2 4.37Å; F54-L80 HydrophobicContact CZ-CD2 4.2Å; F54-L84 HydrophobicContact CD1-CD2 4.4Å; F54-L84 HydrophobicContact CE1-CD1 3.9Å; F54-L84 HydrophobicContact CE1-CD2 3.69Å; F54-L84 HydrophobicContact CE1-CG 3.85Å
55L97Very high95.4Very high34 Ų3442.4 Ų42.418%0.17826%0.257CS..Hα-helixtrans-62.7-35.9175.9-75.1173.8000112.4I22 A23 L26 C51 G52 L58 A59 L84I22-L55 HydrophobicContact CG2-CD1 4.42Å; A23-L55 HydrophobicContact CB-CB 4.07Å; L26-L55 HydrophobicContact CD1-CD1 3.66Å; C51-L55 WeakPolarHBondContact O-CB 3.35Å; C51-L55 WeakPolarHBondContact O-CG 3.2Å; C51-L55 PolarHBondContact O-N 2.67Å; G52-L55 PolarHBondContact O-N 2.87Å; L55-L58 PolarHBondContact O-N 3.49Å; L55-A59 VanDerWaalsContact O-CB 3.23Å; L55-A59 WeakPolarHBondContact O-CB 3.46Å; L55-A59 PolarHBondContact O-N 2.97Å; L55-L84 HydrophobicContact CD2-CD1 4.25Å
56F97.7Very high95.6Very high86 Ų8642.2 Ų42.238%0.37726%0.256SS..Hα-helixtrans-60.9-49.5174.1177.4-90.8000111.6L20 A23 F24 G52 V53 F54 L58 A59 V60L20-F56 HydrophobicContact CD1-CD2 3.49Å; L20-F56 VanDerWaalsContact CD1-CD2 3.49Å; L20-F56 HydrophobicContact CD1-CE2 3.59Å; L20-F56 HydrophobicContact CD1-CG 4.47Å; A23-F56 HydrophobicContact CB-CB 3.96Å; F24-F56 HydrophobicContact CE1-CE2 4.28Å; F24-F56 HydrophobicContact CE2-CE2 4.43Å; F24-F56 HydrophobicContact CZ-CD2 4.25Å; F24-F56 AromaticContact CZ-CE2 3.8Å; F24-F56 HydrophobicContact CZ-CE2 3.8Å; G52-F56 PolarHBondContact O-N 3.35Å; V53-F56 WeakPolarHBondContact O-CB 3.31Å; V53-F56 PolarHBondContact O-N 2.72Å; F54-F56 VanDerWaalsContact C-N 3.3Å; F54-F56 PolarHBondContact O-N 3.26Å; F56-L58 VanDerWaalsContact C-N 3.34Å; F56-L58 PolarHBondContact O-N 2.95Å; F56-A59 PolarHBondContact O-N 3.49Å; F56-V60 HydrophobicContact CD1-CG2 4.33Å; F56-V60 HydrophobicContact CE1-CG2 3.94Å; F56-V60 HydrophobicContact CE2-CG2 4.35Å; F56-V60 HydrophobicContact CZ-CG2 3.94Å; F56-V60 WeakPolarHBondContact O-CG2 3.29Å; F56-V60 PolarHBondContact O-N 3.29Å
57V96.7Very high95.8Very high86 Ų8644.9 Ų44.952%0.52126%0.261SS..Hα-helixtrans-61.7-44178.51740000110.8V53 F54 V60 A61V53-V57 WeakPolarHBondContact O-CG2 3.49Å; V53-V57 PolarHBondContact O-N 2.8Å; V53-V57 VanDerWaalsContact O-N 3.07Å; F54-V57 PolarHBondContact O-N 3.31Å; V57-V60 PolarHBondContact O-N 3.13Å; V57-A61 WeakPolarHBondContact O-CB 3.48Å; V57-A61 PolarHBondContact O-N 3Å
58L97.4Very high95.8Very high1 Ų150.5 Ų50.51%0.00528%0.276CS..Hα-helixtrans-59.9-46.5176.3-175.6154.3000111.5Y19 F54 L55 F56 A61 G62 Y77 L80 L81 L84Y19-L58 HydrophobicContact CD2-CD2 3.94Å; Y19-L58 HydrophobicContact CE2-CD2 4.31Å; F54-L58 HydrophobicContact CE1-CD1 4.12Å; F54-L58 WeakPolarHBondContact O-CB 3.42Å; F54-L58 PolarHBondContact O-N 3.41Å; L55-L58 PolarHBondContact O-N 3.49Å; F56-L58 VanDerWaalsContact C-N 3.34Å; F56-L58 PolarHBondContact O-N 2.95Å; L58-A61 PolarHBondContact O-N 3.3Å; L58-G62 PolarHBondContact O-N 3.34Å; L58-Y77 HydrophobicContact CD2-CD2 4.17Å; L58-Y77 HydrophobicContact CD2-CE2 3.6Å; L58-Y77 HydrophobicContact CG-CD2 4.27Å; L58-Y77 HydrophobicContact CG-CE2 4.2Å; L58-L80 HydrophobicContact CD1-CB 4.15Å; L58-L81 HydrophobicContact CD1-CD2 4.02Å; L58-L81 HydrophobicContact CD1-CG 4.48Å; L58-L81 HydrophobicContact CD2-CD2 3.85Å; L58-L81 HydrophobicContact CD2-CG 4.42Å; L58-L81 HydrophobicContact CG-CD2 4.48Å; L58-L84 HydrophobicContact CD1-CD1 3.48Å; L58-L84 VanDerWaalsContact CD1-CD1 3.48Å; L58-L84 HydrophobicContact CD1-CG 4.37Å
59A97.5Very high95.6Very high1 Ų148.7 Ų48.71%0.00827%0.266CS..Hα-helixtrans-63.5-42.3-179.800000111.9L20 L55 F56 G62 L63L20-A59 HydrophobicContact CB-CB 4.1Å; L20-A59 HydrophobicContact CD1-CB 4.38Å; L55-A59 VanDerWaalsContact O-CB 3.23Å; L55-A59 WeakPolarHBondContact O-CB 3.46Å; L55-A59 PolarHBondContact O-N 2.97Å; F56-A59 PolarHBondContact O-N 3.49Å; A59-G62 PolarHBondContact O-N 3.17Å; A59-L63 VanDerWaalsContact O-CB 3.29Å; A59-L63 WeakPolarHBondContact O-CB 3.41Å; A59-L63 PolarHBondContact O-N 3.08Å
60V97.1Very high95.6Very high53 Ų5348.8 Ų48.832%0.32127%0.267SS..Hα-helixtrans-65-45.2175.9172.10000110.9L20 F56 V57 G62 L63 L64L20-V60 HydrophobicContact CD1-CG2 4.48Å; F56-V60 HydrophobicContact CD1-CG2 4.33Å; F56-V60 HydrophobicContact CE1-CG2 3.94Å; F56-V60 HydrophobicContact CE2-CG2 4.35Å; F56-V60 HydrophobicContact CZ-CG2 3.94Å; F56-V60 WeakPolarHBondContact O-CG2 3.29Å; F56-V60 PolarHBondContact O-N 3.29Å; V57-V60 PolarHBondContact O-N 3.13Å; V60-G62 PolarHBondContact O-N 3.32Å; V60-L63 PolarHBondContact O-N 3.22Å; V60-L64 HydrophobicContact CG1-CD1 3.86Å; V60-L64 HydrophobicContact CG1-CG 4.29Å; V60-L64 WeakPolarHBondContact O-CB 3.19Å; V60-L64 VanDerWaalsContact O-CG 3.31Å; V60-L64 WeakPolarHBondContact O-CG 3.33Å; V60-L64 PolarHBondContact O-N 2.78Å
61A96.5Very high95.4Very high23 Ų2349.3 Ų49.319%0.1926%0.259CS..Hα-helixtrans-60.1-45.6175.900000111.5V57 L58 L64 G65 I73V57-A61 WeakPolarHBondContact O-CB 3.48Å; V57-A61 PolarHBondContact O-N 3Å; L58-A61 PolarHBondContact O-N 3.3Å; A61-L64 PolarHBondContact O-N 3.15Å; A61-G65 PolarHBondContact O-N 2.74Å; A61-I73 HydrophobicContact CB-CG2 4.27Å; A61-I73 WeakPolarHBondContact O-CG2 3.16Å
62G96.8Very high95.3Very high1 Ų149.5 Ų49.51%0.0126%0.26CS..Hα-helixtrans-63-42176.800000113.1L58 A59 V60 G65 A66 Y77L58-G62 PolarHBondContact O-N 3.34Å; A59-G62 PolarHBondContact O-N 3.17Å; V60-G62 PolarHBondContact O-N 3.32Å; G62-G65 PolarHBondContact O-N 3.37Å; G62-A66 VanDerWaalsContact O-CB 3.25Å; G62-A66 WeakPolarHBondContact O-CB 3.48Å; G62-A66 PolarHBondContact O-N 3.46Å; G62-Y77 VanDerWaalsContact CA-CE2 3.45Å
63L96.4Very high95.2Very high41 Ų4151.9 Ų51.922%0.21527%0.272CS..Hα-helixtrans-65-47.4176.8-174.363000111.8I13 N16 L17 A59 V60 A66 I67I13-L63 HydrophobicContact CB-CD1 4.41Å; I13-L63 HydrophobicContact CG1-CD1 4.24Å; I13-L63 HydrophobicContact CG2-CD1 3.95Å; N16-L63 HydrophobicContact CB-CB 4.36Å; L17-L63 HydrophobicContact CD2-CD2 4.48Å; A59-L63 VanDerWaalsContact O-CB 3.29Å; A59-L63 WeakPolarHBondContact O-CB 3.41Å; A59-L63 PolarHBondContact O-N 3.08Å; V60-L63 PolarHBondContact O-N 3.22Å; L63-A66 PolarHBondContact O-N 3.29Å; L63-I67 HydrophobicContact CD1-CD1 3.7Å; L63-I67 HydrophobicContact CD1-CG1 4.15Å; L63-I67 HydrophobicContact CD2-CD1 4.48Å; L63-I67 HydrophobicContact CG-CD1 3.76Å; L63-I67 HydrophobicContact CG-CG1 4.46Å; L63-I67 WeakPolarHBondContact O-CB 3.33Å; L63-I67 VanDerWaalsContact O-CG1 3.3Å; L63-I67 WeakPolarHBondContact O-CG1 3.4Å; L63-I67 PolarHBondContact O-N 3.3Å
64L96.1Very high95.1Very high72 Ų7248.2 Ų48.238%0.37725%0.25SC..Hα-helixtrans-63.9-42.4177-70.1176.2000111.7V60 A61 K68V60-L64 HydrophobicContact CG1-CD1 3.86Å; V60-L64 HydrophobicContact CG1-CG 4.29Å; V60-L64 WeakPolarHBondContact O-CB 3.19Å; V60-L64 VanDerWaalsContact O-CG 3.31Å; V60-L64 WeakPolarHBondContact O-CG 3.33Å; V60-L64 PolarHBondContact O-N 2.78Å; A61-L64 PolarHBondContact O-N 3.15Å; L64-K68 WeakPolarHBondContact O-CB 3.47Å; L64-K68 PolarHBondContact O-N 3.41Å
65G94.7Very high95Very high0 Ų048.2 Ų48.20%025%0.25CC..Hα-helixtrans-60.9-41.8174.900000112.3A61 G62 H69 N70A61-G65 PolarHBondContact O-N 2.74Å; G62-G65 PolarHBondContact O-N 3.37Å; G65-H69 VanDerWaalsContact O-CA 3.24Å; G65-H69 WeakPolarHBondContact O-CA 3.05Å; G65-H69 PolarHBondContact O-N 3.16Å; G65-H69 VanDerWaalsContact O-N 3.1Å; G65-N70 PolarHBondContact O-N 2.98Å
66A94.3Very high94.9Very high0 Ų053 Ų530%027%0.269CS..Hα-helixtrans-71.7-45.8178.100000113K9 L12 I13 G62 L63 Y219K9-A66 WeakPolarHBondContact CE-O 2.96Å; L12-A66 HydrophobicContact CB-CB 3.95Å; I13-A66 HydrophobicContact CG1-CB 3.9Å; G62-A66 VanDerWaalsContact O-CB 3.25Å; G62-A66 WeakPolarHBondContact O-CB 3.48Å; G62-A66 PolarHBondContact O-N 3.46Å; L63-A66 PolarHBondContact O-N 3.29Å; A66-Y219 PolarHBondContact O-OH 3.17Å
67I93.6Very high94.8Very high88 Ų8848.9 Ų48.945%0.45125%0.251SS..Hα-helixtrans-67.5-50.2-177.4-69.4173.5000111K9 I13 L63K9-I67 PolarHBondContact NZ-O 3.16Å; I13-I67 HydrophobicContact CD1-CG1 4.16Å; I13-I67 HydrophobicContact CG1-CG1 4.37Å; L63-I67 HydrophobicContact CD1-CD1 3.7Å; L63-I67 HydrophobicContact CD1-CG1 4.15Å; L63-I67 HydrophobicContact CD2-CD1 4.48Å; L63-I67 HydrophobicContact CG-CD1 3.76Å; L63-I67 HydrophobicContact CG-CG1 4.46Å; L63-I67 WeakPolarHBondContact O-CB 3.33Å; L63-I67 VanDerWaalsContact O-CG1 3.3Å; L63-I67 WeakPolarHBondContact O-CG1 3.4Å; L63-I67 PolarHBondContact O-N 3.3Å
68K91.7Very high94.8Very high153 Ų15345.4 Ų45.467%0.66523%0.229SC*.Hα-helixtrans-88.2-4.6-174-63.9-171.1173.8-174.30114.2L64 N70L64-K68 WeakPolarHBondContact O-CB 3.47Å; L64-K68 PolarHBondContact O-N 3.41Å; K68-N70 HydrophobicContact CB-CB 4.3Å; K68-N70 PolarHBondContact O-N 3.35Å; K68-N70 VanDerWaalsContact O-N 3.15Å
69H91.1Very high94.8Very high30 Ų3049.5 Ų49.514%0.13925%0.25CS..THydrogen-bonded Turntrans49.136.8-169.4-155.1-84000112.3F5 G65 Q71 Y219 Q222F5-H69 AromaticContact CE2-CD2 3.42Å; F5-H69 VanDerWaalsContact CE2-CD2 3.42Å; F5-H69 WeakPolarHBondContact CE2-CD2 3.32Å; F5-H69 AromaticContact CE2-NE2 3.47Å; F5-H69 WeakPolarHBondContact CE2-NE2 3.3Å; F5-H69 AromaticContact CZ-CD2 3.66Å; G65-H69 VanDerWaalsContact O-CA 3.24Å; G65-H69 WeakPolarHBondContact O-CA 3.05Å; G65-H69 PolarHBondContact O-N 3.16Å; G65-H69 VanDerWaalsContact O-N 3.1Å; H69-Q71 PolarHBondContact CE1-NE2 3.14Å; H69-Q71 PolarHBondContact ND1-NE2 3.29Å; H69-Q71 PolarHBondContact O-N 3.09Å; H69-Q71 VanDerWaalsContact O-N 3.15Å; H69-Y219 AromaticContact CD2-CE1 3.58Å; H69-Y219 AromaticContact CD2-CE2 3.76Å; H69-Y219 AromaticContact CD2-CZ 3.31Å; H69-Y219 PolarHBondContact CD2-OH 3.06Å; H69-Y219 PolarHBondContact NE2-O 3.28Å; H69-Q222 PolarHBondContact CE1-O 3.15Å; H69-Q222 PolarHBondContact NE2-O 3.15Å
70N91.6Very high94.7Very high58 Ų5852.4 Ų52.431%0.3127%0.266SS..  trans-77107.7-176.3-176.1-43000109.9G65 K68 P72 I73 L74G65-N70 PolarHBondContact O-N 2.98Å; K68-N70 HydrophobicContact CB-CB 4.3Å; K68-N70 PolarHBondContact O-N 3.35Å; K68-N70 VanDerWaalsContact O-N 3.15Å; N70-P72 WeakPolarHBondContact OD1-CD 3.34Å; N70-I73 HydrophobicContact CB-CB 4.2Å; N70-I73 HydrophobicContact CB-CD1 4.02Å; N70-I73 HydrophobicContact CB-CG1 4.23Å; N70-I73 PolarHBondContact O-N 3.35Å; N70-I73 PolarHBondContact OD1-N 2.98Å; N70-L74 WeakPolarHBondContact O-CB 3.45Å; N70-L74 PolarHBondContact O-N 3.47Å
71Q91.2Very high94.6Very high70 Ų7049.9 Ų49.933%0.32725%0.25SS..Hα-helixtrans-56.1-50.5-173.5-70.9-69.3-36.600113.9H69 L74 F75 R220H69-Q71 PolarHBondContact CE1-NE2 3.14Å; H69-Q71 PolarHBondContact ND1-NE2 3.29Å; H69-Q71 PolarHBondContact O-N 3.09Å; H69-Q71 VanDerWaalsContact O-N 3.15Å; Q71-L74 PolarHBondContact O-N 3.49Å; Q71-F75 WeakPolarHBondContact O-CB 3.25Å; Q71-F75 PolarHBondContact O-N 3.04Å; Q71-R220 PolarHBondContact NE2-O 3.43Å; Q71-R220 VanDerWaalsContact NE2-O 3.1Å
72P94.1Very high94.6Very high78 Ų7853.2 Ų53.251%0.50626%0.261SS..Hα-helixtrans-55.5-49.6172.9-27.829.7000114.2N70 L74 F75 F76N70-P72 WeakPolarHBondContact OD1-CD 3.34Å; P72-L74 VanDerWaalsContact C-N 3.33Å; P72-L74 PolarHBondContact O-N 3.14Å; P72-F75 WeakPolarHBondContact O-CB 3.18Å; P72-F75 PolarHBondContact O-N 3.5Å; P72-F75 VanDerWaalsContact O-N 3.17Å; P72-F76 WeakPolarHBondContact O-CD2 3.17Å; P72-F76 PolarHBondContact O-N 3.15Å
73I94.9Very high94.6Very high50 Ų5054.7 Ų54.726%0.25628%0.276SS..Hα-helixtrans-62.8-43.7-177.3-63.9177.6000110.3A61 N70 F75 F76 Y77A61-I73 HydrophobicContact CB-CG2 4.27Å; A61-I73 WeakPolarHBondContact O-CG2 3.16Å; N70-I73 HydrophobicContact CB-CB 4.2Å; N70-I73 HydrophobicContact CB-CD1 4.02Å; N70-I73 HydrophobicContact CB-CG1 4.23Å; N70-I73 PolarHBondContact O-N 3.35Å; N70-I73 PolarHBondContact OD1-N 2.98Å; I73-F75 VanDerWaalsContact C-N 3.3Å; I73-F75 PolarHBondContact O-N 3.44Å; I73-F76 PolarHBondContact O-N 3.05Å; I73-Y77 WeakPolarHBondContact O-CB 3.34Å; I73-Y77 PolarHBondContact O-N 2.83Å
74L94.3Very high94.5Very high1 Ų154.5 Ų54.51%0.00528%0.275CS..Hα-helixtrans-63.7-36.3177.8-172.763.9000111.8N70 Q71 P72 Y77 I78 A216 Y219 R220N70-L74 WeakPolarHBondContact O-CB 3.45Å; N70-L74 PolarHBondContact O-N 3.47Å; Q71-L74 PolarHBondContact O-N 3.49Å; P72-L74 VanDerWaalsContact C-N 3.33Å; P72-L74 PolarHBondContact O-N 3.14Å; L74-Y77 HydrophobicContact CD1-CD1 4.11Å; L74-Y77 PolarHBondContact O-N 3.39Å; L74-I78 HydrophobicContact CG-CD1 4.15Å; L74-I78 WeakPolarHBondContact O-CD1 3.24Å; L74-I78 WeakPolarHBondContact O-CG1 3.4Å; L74-I78 PolarHBondContact O-N 2.93Å; L74-A216 HydrophobicContact CD1-CB 4.25Å; L74-Y219 HydrophobicContact CD1-CD1 4.38Å; L74-Y219 HydrophobicContact CD2-CD1 3.71Å; L74-Y219 HydrophobicContact CD2-CE1 4.33Å; L74-R220 HydrophobicContact CD2-CB 3.55Å; L74-R220 HydrophobicContact CD2-CG 4.01Å; L74-R220 HydrophobicContact CG-CB 4.34Å
75F94.6Very high94.6Very high87 Ų8752.4 Ų52.438%0.38226%0.263SS..Hα-helixtrans-64.2-47.9174.9179.2-118.9000112.3Q71 P72 I73 Y77 I78 I79Q71-F75 WeakPolarHBondContact O-CB 3.25Å; Q71-F75 PolarHBondContact O-N 3.04Å; P72-F75 WeakPolarHBondContact O-CB 3.18Å; P72-F75 PolarHBondContact O-N 3.5Å; P72-F75 VanDerWaalsContact O-N 3.17Å; I73-F75 VanDerWaalsContact C-N 3.3Å; I73-F75 PolarHBondContact O-N 3.44Å; F75-Y77 VanDerWaalsContact C-N 3.33Å; F75-Y77 PolarHBondContact O-N 2.72Å; F75-I78 PolarHBondContact O-N 2.9Å; F75-I79 HydrophobicContact CD1-CD1 3.97Å; F75-I79 HydrophobicContact CD2-CD1 4.33Å; F75-I79 HydrophobicContact CE1-CD1 3.55Å; F75-I79 HydrophobicContact CE2-CD1 3.98Å; F75-I79 HydrophobicContact CE2-CG1 4.4Å; F75-I79 HydrophobicContact CG-CD1 4.37Å; F75-I79 HydrophobicContact CZ-CD1 3.59Å; F75-I79 HydrophobicContact CZ-CG1 4.45Å; F75-I79 WeakPolarHBondContact O-CG1 3.38Å; F75-I79 PolarHBondContact O-N 3.39Å; F75-I79 VanDerWaalsContact O-N 3.1Å
76F95Very high94.7Very high133 Ų13356.5 Ų56.558%0.58328%0.284SS*.Hα-helixtrans-61.2-42.7175.1-74.9-66.9000111.9P72 I73 I78 I79 L80P72-F76 WeakPolarHBondContact O-CD2 3.17Å; P72-F76 PolarHBondContact O-N 3.15Å; I73-F76 PolarHBondContact O-N 3.05Å; F76-I78 VanDerWaalsContact C-N 3.34Å; F76-I78 PolarHBondContact O-N 3.31Å; F76-I79 PolarHBondContact O-N 3.01Å; F76-L80 WeakPolarHBondContact O-CG 3.37Å; F76-L80 PolarHBondContact O-N 3.5Å
77Y96.4Very high94.8Very high1 Ų160.9 Ų60.90%0.00431%0.311CS..Hα-helixtrans-57.3-45.1175.7171.9-105.8000112.5L12 N16 L58 G62 I73 L74 F75 I79 L80 L81 A216L12-Y77 HydrophobicContact CD2-CE1 4.25Å; N16-Y77 PolarHBondContact ND2-OH 3.02Å; N16-Y77 WeakPolarHBondContact OD1-CE2 3.35Å; N16-Y77 PolarHBondContact OD1-OH 3.24Å; L58-Y77 HydrophobicContact CD2-CD2 4.17Å; L58-Y77 HydrophobicContact CD2-CE2 3.6Å; L58-Y77 HydrophobicContact CG-CD2 4.27Å; L58-Y77 HydrophobicContact CG-CE2 4.2Å; G62-Y77 VanDerWaalsContact CA-CE2 3.45Å; I73-Y77 WeakPolarHBondContact O-CB 3.34Å; I73-Y77 PolarHBondContact O-N 2.83Å; L74-Y77 HydrophobicContact CD1-CD1 4.11Å; L74-Y77 PolarHBondContact O-N 3.39Å; F75-Y77 VanDerWaalsContact C-N 3.33Å; F75-Y77 PolarHBondContact O-N 2.72Å; Y77-I79 PolarHBondContact O-N 3.45Å; Y77-L80 PolarHBondContact O-N 3.44Å; Y77-L81 HydrophobicContact CD1-CD1 4.13Å; Y77-L81 HydrophobicContact CD2-CG 4.39Å; Y77-L81 HydrophobicContact CE1-CD1 3.4Å; Y77-L81 HydrophobicContact CE1-CG 4.25Å; Y77-L81 HydrophobicContact CE2-CD1 3.84Å; Y77-L81 HydrophobicContact CE2-CD2 4.45Å; Y77-L81 HydrophobicContact CE2-CG 3.93Å; Y77-L81 PolarHBondContact O-N 3.5Å; Y77-L81 WeakPolarHBondContact OH-CD1 3.49Å; Y77-A216 HydrophobicContact CD1-CB 4.27Å; Y77-A216 HydrophobicContact CE1-CB 4.09Å
78I96Very high94.9Very high12 Ų1259.6 Ų59.66%0.06230%0.303CS..Hα-helixtrans-61.7-43.4177-71.5161.4000111.3L74 F75 F76 F82 V213 A216 L217 R220L74-I78 HydrophobicContact CG-CD1 4.15Å; L74-I78 WeakPolarHBondContact O-CD1 3.24Å; L74-I78 WeakPolarHBondContact O-CG1 3.4Å; L74-I78 PolarHBondContact O-N 2.93Å; F75-I78 PolarHBondContact O-N 2.9Å; F76-I78 VanDerWaalsContact C-N 3.34Å; F76-I78 PolarHBondContact O-N 3.31Å; I78-F82 VanDerWaalsContact O-CB 3.28Å; I78-F82 WeakPolarHBondContact O-CB 3.39Å; I78-F82 PolarHBondContact O-N 2.8Å; I78-V213 HydrophobicContact CG2-CG1 4.37Å; I78-A216 HydrophobicContact CD1-CB 3.97Å; I78-A216 HydrophobicContact CG1-CB 3.52Å; I78-L217 HydrophobicContact CD1-CD2 4.07Å; I78-L217 HydrophobicContact CD1-CG 4.24Å; I78-L217 HydrophobicContact CG2-CD2 3.87Å; I78-L217 HydrophobicContact CG2-CG 3.98Å; I78-R220 HydrophobicContact CD1-CB 4.44Å
79I96.2Very high95.1Very high87 Ų8756.5 Ų56.545%0.44629%0.29SS..Hα-helixtrans-61.8-45.5177.7-68.4167.2000110.6F75 F76 Y77 F82 G83F75-I79 HydrophobicContact CD1-CD1 3.97Å; F75-I79 HydrophobicContact CD2-CD1 4.33Å; F75-I79 HydrophobicContact CE1-CD1 3.55Å; F75-I79 HydrophobicContact CE2-CD1 3.98Å; F75-I79 HydrophobicContact CE2-CG1 4.4Å; F75-I79 HydrophobicContact CG-CD1 4.37Å; F75-I79 HydrophobicContact CZ-CD1 3.59Å; F75-I79 HydrophobicContact CZ-CG1 4.45Å; F75-I79 WeakPolarHBondContact O-CG1 3.38Å; F75-I79 PolarHBondContact O-N 3.39Å; F75-I79 VanDerWaalsContact O-N 3.1Å; F76-I79 PolarHBondContact O-N 3.01Å; Y77-I79 PolarHBondContact O-N 3.45Å; I79-F82 PolarHBondContact O-N 3.07Å; I79-G83 PolarHBondContact O-N 3.31Å
80L96.1Very high95.4Very high63 Ų6358.7 Ų58.733%0.3331%0.308SS..Hα-helixtrans-64.8-46.1-179.4-69.2174.8000112.1F54 L58 F76 Y77 F82 G83 L84F54-L80 HydrophobicContact CE2-CD2 4.37Å; F54-L80 HydrophobicContact CZ-CD2 4.2Å; L58-L80 HydrophobicContact CD1-CB 4.15Å; F76-L80 WeakPolarHBondContact O-CG 3.37Å; F76-L80 PolarHBondContact O-N 3.5Å; Y77-L80 PolarHBondContact O-N 3.44Å; L80-F82 VanDerWaalsContact C-N 3.35Å; L80-G83 PolarHBondContact O-N 2.95Å; L80-L84 PolarHBondContact O-N 3.37Å
81L95.3Very high95.6Very high0 Ų059.1 Ų59.10%031%0.313CS..Hα-helixtrans-62.3-41174.3-81.4-174.7000112.2Y19 L58 Y77 G83 L84 F85 E209 V213Y19-L81 HydrophobicContact CE2-CD2 4Å; L58-L81 HydrophobicContact CD1-CD2 4.02Å; L58-L81 HydrophobicContact CD1-CG 4.48Å; L58-L81 HydrophobicContact CD2-CD2 3.85Å; L58-L81 HydrophobicContact CD2-CG 4.42Å; L58-L81 HydrophobicContact CG-CD2 4.48Å; Y77-L81 HydrophobicContact CD1-CD1 4.13Å; Y77-L81 HydrophobicContact CD2-CG 4.39Å; Y77-L81 HydrophobicContact CE1-CD1 3.4Å; Y77-L81 HydrophobicContact CE1-CG 4.25Å; Y77-L81 HydrophobicContact CE2-CD1 3.84Å; Y77-L81 HydrophobicContact CE2-CD2 4.45Å; Y77-L81 HydrophobicContact CE2-CG 3.93Å; Y77-L81 PolarHBondContact O-N 3.5Å; Y77-L81 WeakPolarHBondContact OH-CD1 3.49Å; L81-G83 VanDerWaalsContact C-N 3.31Å; L81-G83 PolarHBondContact O-N 2.93Å; L81-L84 PolarHBondContact O-N 2.73Å; L81-F85 WeakPolarHBondContact O-CB 3.36Å; L81-F85 PolarHBondContact O-N 2.98Å; L81-E209 HydrophobicContact CD2-CG 4.28Å; L81-E209 WeakPolarHBondContact CD2-OE1 3.37Å; L81-V213 HydrophobicContact CB-CG2 3.62Å; L81-V213 HydrophobicContact CD1-CG2 4.34Å
82F96.5Very high95.9Very high93 Ų9355.8 Ų55.841%0.40830%0.297SS..Hα-helixtrans-66-37.9177.9-174.4-109.2000111.7I78 I79 L80 F85 L86 V213I78-F82 VanDerWaalsContact O-CB 3.28Å; I78-F82 WeakPolarHBondContact O-CB 3.39Å; I78-F82 PolarHBondContact O-N 2.8Å; I79-F82 PolarHBondContact O-N 3.07Å; L80-F82 VanDerWaalsContact C-N 3.35Å; F82-F85 AromaticContact CD2-CD1 3.98Å; F82-F85 HydrophobicContact CD2-CD1 3.98Å; F82-F85 AromaticContact CE2-CD1 3.86Å; F82-F85 HydrophobicContact CE2-CD1 3.86Å; F82-F85 HydrophobicContact CE2-CE1 4.11Å; F82-F85 WeakPolarHBondContact O-CB 3.42Å; F82-F85 PolarHBondContact O-N 3.02Å; F82-L86 HydrophobicContact CD1-CD1 4.17Å; F82-L86 HydrophobicContact CE1-CD1 3.74Å; F82-L86 HydrophobicContact CE1-CD2 4.44Å; F82-L86 HydrophobicContact CE1-CG 4.15Å; F82-L86 HydrophobicContact CZ-CD1 4.24Å; F82-L86 HydrophobicContact CZ-CD2 4.11Å; F82-L86 HydrophobicContact CZ-CG 4.24Å; F82-L86 WeakPolarHBondContact O-CG 3.14Å; F82-L86 PolarHBondContact O-N 3.18Å; F82-V213 HydrophobicContact CB-CG2 4.43Å; F82-V213 HydrophobicContact CD2-CG1 4.42Å
83G96.3Very high96Very high32 Ų3254.7 Ų54.733%0.3329%0.291SS..Hα-helixtrans-62.2-44.6172.700000112.7I79 L80 L81 L86 V87I79-G83 PolarHBondContact O-N 3.31Å; L80-G83 PolarHBondContact O-N 2.95Å; L81-G83 VanDerWaalsContact C-N 3.31Å; L81-G83 PolarHBondContact O-N 2.93Å; G83-L86 PolarHBondContact O-N 3.19Å; G83-V87 WeakPolarHBondContact O-CG2 3.45Å; G83-V87 PolarHBondContact O-N 2.99Å; G83-V87 VanDerWaalsContact O-N 3.13Å
84L95.6Very high96Very high36 Ų3655.1 Ų55.119%0.18830%0.302CS..Hα-helixtrans-60.3-44.6173.9-82.5-171.4000111.9F54 L55 L58 L80 L81 L86 V87 Q88 E209F54-L84 HydrophobicContact CD1-CD2 4.4Å; F54-L84 HydrophobicContact CE1-CD1 3.9Å; F54-L84 HydrophobicContact CE1-CD2 3.69Å; F54-L84 HydrophobicContact CE1-CG 3.85Å; L55-L84 HydrophobicContact CD2-CD1 4.25Å; L58-L84 HydrophobicContact CD1-CD1 3.48Å; L58-L84 VanDerWaalsContact CD1-CD1 3.48Å; L58-L84 HydrophobicContact CD1-CG 4.37Å; L80-L84 PolarHBondContact O-N 3.37Å; L81-L84 PolarHBondContact O-N 2.73Å; L84-L86 VanDerWaalsContact C-N 3.34Å; L84-L86 PolarHBondContact O-N 2.95Å; L84-V87 PolarHBondContact O-N 3.38Å; L84-Q88 WeakPolarHBondContact O-CB 3.32Å; L84-Q88 WeakPolarHBondContact O-CG 3.33Å; L84-Q88 PolarHBondContact O-N 3.37Å; L84-E209 WeakPolarHBondContact CB-OE1 3.21Å
85F96.6Very high96.1Very high28 Ų2856.3 Ų56.312%0.12331%0.31CS..Hα-helixtrans-54.7-48.1174.8160-102.5000111.7L81 F82 V87 Q88 F89 S206 E209 L210L81-F85 WeakPolarHBondContact O-CB 3.36Å; L81-F85 PolarHBondContact O-N 2.98Å; F82-F85 AromaticContact CD2-CD1 3.98Å; F82-F85 HydrophobicContact CD2-CD1 3.98Å; F82-F85 AromaticContact CE2-CD1 3.86Å; F82-F85 HydrophobicContact CE2-CD1 3.86Å; F82-F85 HydrophobicContact CE2-CE1 4.11Å; F82-F85 WeakPolarHBondContact O-CB 3.42Å; F82-F85 PolarHBondContact O-N 3.02Å; F85-V87 VanDerWaalsContact C-N 3.34Å; F85-V87 PolarHBondContact O-N 2.67Å; F85-Q88 PolarHBondContact O-N 3.39Å; F85-F89 HydrophobicContact CE2-CB 4.19Å; F85-F89 HydrophobicContact CE2-CG 4.48Å; F85-F89 HydrophobicContact CZ-CB 4.42Å; F85-F89 HydrophobicContact CZ-CG 4.48Å; F85-F89 WeakPolarHBondContact O-CB 3.22Å; F85-F89 PolarHBondContact O-N 2.87Å; F85-S206 WeakPolarHBondContact CD2-O 3.37Å; F85-E209 WeakPolarHBondContact CA-OE2 3.32Å; F85-E209 HydrophobicContact CB-CG 4.04Å; F85-E209 PolarHBondContact N-OE2 2.98Å; F85-L210 HydrophobicContact CD2-CB 4.24Å; F85-L210 HydrophobicContact CE2-CB 4.18Å; F85-L210 HydrophobicContact CE2-CD2 4.49Å; F85-L210 HydrophobicContact CZ-CD1 4.42Å
86L97.1Very high96.1Very high87 Ų8756.2 Ų56.246%0.45531%0.313SS..Hα-helixtrans-61.8-42.6180-69.3178.3000112F82 G83 L84 S90F82-L86 HydrophobicContact CD1-CD1 4.17Å; F82-L86 HydrophobicContact CE1-CD1 3.74Å; F82-L86 HydrophobicContact CE1-CD2 4.44Å; F82-L86 HydrophobicContact CE1-CG 4.15Å; F82-L86 HydrophobicContact CZ-CD1 4.24Å; F82-L86 HydrophobicContact CZ-CD2 4.11Å; F82-L86 HydrophobicContact CZ-CG 4.24Å; F82-L86 WeakPolarHBondContact O-CG 3.14Å; F82-L86 PolarHBondContact O-N 3.18Å; G83-L86 PolarHBondContact O-N 3.19Å; L84-L86 VanDerWaalsContact C-N 3.34Å; L84-L86 PolarHBondContact O-N 2.95Å; L86-S90 WeakPolarHBondContact O-CB 3.41Å; L86-S90 PolarHBondContact O-N 3.49Å
87V96.2Very high96.1Very high92 Ų9254.7 Ų54.756%0.55832%0.319SS*.Hα-helixtrans-66.2-48177.7174.50000110.7G83 L84 F85 S90 V91G83-V87 WeakPolarHBondContact O-CG2 3.45Å; G83-V87 PolarHBondContact O-N 2.99Å; G83-V87 VanDerWaalsContact O-N 3.13Å; L84-V87 PolarHBondContact O-N 3.38Å; F85-V87 VanDerWaalsContact C-N 3.34Å; F85-V87 PolarHBondContact O-N 2.67Å; V87-S90 PolarHBondContact O-N 2.88Å; V87-V91 HydrophobicContact CG1-CG2 4.46Å; V87-V91 VanDerWaalsContact O-CG2 3.3Å; V87-V91 WeakPolarHBondContact O-CG2 3.31Å; V87-V91 PolarHBondContact O-N 3.04Å
88Q95.7Very high96Very high61 Ų6157.4 Ų57.429%0.28533%0.333SS..Hα-helixtrans-63.8-44.5-179.6-72.6-174.55.300112.3L84 F85 V91 A92 E209L84-Q88 WeakPolarHBondContact O-CB 3.32Å; L84-Q88 WeakPolarHBondContact O-CG 3.33Å; L84-Q88 PolarHBondContact O-N 3.37Å; F85-Q88 PolarHBondContact O-N 3.39Å; Q88-V91 PolarHBondContact O-N 3.1Å; Q88-A92 VanDerWaalsContact O-CB 3.25Å; Q88-A92 WeakPolarHBondContact O-CB 3.34Å; Q88-A92 PolarHBondContact O-N 3.49Å; Q88-E209 PolarHBondContact OE1-OE2 3.46Å; Q88-E209 VanDerWaalsContact OE1-OE2 3.09Å
89F97.1Very high95.8Very high88 Ų8859 Ų5939%0.38635%0.345SS..Hα-helixtrans-64.3-41.1177.9-178.5-105.2000111.6F85 A92 C93 L203F85-F89 HydrophobicContact CE2-CB 4.19Å; F85-F89 HydrophobicContact CE2-CG 4.48Å; F85-F89 HydrophobicContact CZ-CB 4.42Å; F85-F89 HydrophobicContact CZ-CG 4.48Å; F85-F89 WeakPolarHBondContact O-CB 3.22Å; F85-F89 PolarHBondContact O-N 2.87Å; F89-A92 PolarHBondContact O-N 3.36Å; F89-C93 WeakPolarHBondContact O-CB 3.37Å; F89-C93 PolarHBondContact O-N 3.04Å; F89-C93 PolarHBondContact O-SG 3.21Å; F89-L203 HydrophobicContact CD2-CD1 3.87Å; F89-L203 HydrophobicContact CE2-CD1 3.78Å
90S97.1Very high95.5Very high75 Ų7558.5 Ų58.552%0.52435%0.349SS..Hα-helixtrans-61.5-49.4174.5-179.80000111.8L86 V87 A92 C93 A94L86-S90 WeakPolarHBondContact O-CB 3.41Å; L86-S90 PolarHBondContact O-N 3.49Å; V87-S90 PolarHBondContact O-N 2.88Å; S90-A92 VanDerWaalsContact C-N 3.34Å; S90-A92 PolarHBondContact O-N 3.48Å; S90-C93 PolarHBondContact O-N 3.36Å; S90-A94 WeakPolarHBondContact O-CB 3.42Å; S90-A94 PolarHBondContact O-N 2.95Å
91V95.7Very high95.2Very high68 Ų6861.2 Ų61.241%0.41236%0.364SS..Hα-helixtrans-62.7-40.7177.4172.50000111.2V87 Q88 A94 C95V87-V91 HydrophobicContact CG1-CG2 4.46Å; V87-V91 VanDerWaalsContact O-CG2 3.3Å; V87-V91 WeakPolarHBondContact O-CG2 3.31Å; V87-V91 PolarHBondContact O-N 3.04Å; Q88-V91 PolarHBondContact O-N 3.1Å; V91-A94 PolarHBondContact O-N 3.41Å; V91-C95 WeakPolarHBondContact O-CB 2.85Å; V91-C95 PolarHBondContact O-N 2.91Å; V91-C95 PolarHBondContact O-SG 3.3Å
92A97.3Very high95.1Very high0 Ų068.7 Ų68.70%039%0.394CS..Hα-helixtrans-59.6-48.8176.200000111.6Q88 F89 S90 A94 C95 L96 L203Q88-A92 VanDerWaalsContact O-CB 3.25Å; Q88-A92 WeakPolarHBondContact O-CB 3.34Å; Q88-A92 PolarHBondContact O-N 3.49Å; F89-A92 PolarHBondContact O-N 3.36Å; S90-A92 VanDerWaalsContact C-N 3.34Å; S90-A92 PolarHBondContact O-N 3.48Å; A92-A94 VanDerWaalsContact C-N 3.35Å; A92-A94 PolarHBondContact O-N 3.36Å; A92-C95 PolarHBondContact O-N 2.87Å; A92-L96 WeakPolarHBondContact O-CB 3.31Å; A92-L96 VanDerWaalsContact O-CG 3.31Å; A92-L96 WeakPolarHBondContact O-CG 3.28Å; A92-L96 PolarHBondContact O-N 3.31Å; A92-L203 HydrophobicContact CB-CB 4.12Å
93C96.3Very high94.9Very high55 Ų5564.6 Ų64.637%0.37238%0.376SS..Hα-helixtrans-60.7-43.1175.8-68.10000111.8F89 S90 L96 S97F89-C93 WeakPolarHBondContact O-CB 3.37Å; F89-C93 PolarHBondContact O-N 3.04Å; F89-C93 PolarHBondContact O-SG 3.21Å; S90-C93 PolarHBondContact O-N 3.36Å; C93-L96 PolarHBondContact O-N 2.97Å; C93-S97 WeakPolarHBondContact O-CB 3.38Å; C93-S97 PolarHBondContact O-N 3.48Å
94A95.4Very high94.8Very high59 Ų5966.3 Ų66.349%0.48838%0.375SS..Hα-helixtrans-61.6-45.5177.100000111.8S90 V91 A92 L96 S97 L98S90-A94 WeakPolarHBondContact O-CB 3.42Å; S90-A94 PolarHBondContact O-N 2.95Å; V91-A94 PolarHBondContact O-N 3.41Å; A92-A94 VanDerWaalsContact C-N 3.35Å; A92-A94 PolarHBondContact O-N 3.36Å; A94-L96 PolarHBondContact O-N 3.34Å; A94-S97 PolarHBondContact O-N 2.87Å; A94-L98 WeakPolarHBondContact O-CB 3.3Å; A94-L98 PolarHBondContact O-N 3.28Å; A94-L98 VanDerWaalsContact O-N 3.14Å
95C96Very high94.7Very high26 Ų2669.3 Ų69.318%0.17639%0.39CS..Hα-helixtrans-64.4-36.8177.5-720000113V91 A92 V195V91-C95 WeakPolarHBondContact O-CB 2.85Å; V91-C95 PolarHBondContact O-N 2.91Å; V91-C95 PolarHBondContact O-SG 3.3Å; A92-C95 PolarHBondContact O-N 2.87Å; C95-V195 HydrophobicContact CB-CB 4.46Å; C95-V195 WeakPolarHBondContact CB-O 3.29Å
96L94.8Very high94.5Very high85 Ų8573.4 Ų73.445%0.44541%0.413SS..Hα-helixtrans-76.9-28.2178.6-70.1170.8000113.1A92 C93 A94 L203A92-L96 WeakPolarHBondContact O-CB 3.31Å; A92-L96 VanDerWaalsContact O-CG 3.31Å; A92-L96 WeakPolarHBondContact O-CG 3.28Å; A92-L96 PolarHBondContact O-N 3.31Å; C93-L96 PolarHBondContact O-N 2.97Å; A94-L96 PolarHBondContact O-N 3.34Å; L96-L203 HydrophobicContact CD1-CD2 4.2Å
97S94.7Very high94.3Very high101 Ų10170.4 Ų70.471%0.70640%0.398SS*.Hα-helixtrans-85.9-15.3179.6-1700000113.5C93 A94 S99C93-S97 WeakPolarHBondContact O-CB 3.38Å; C93-S97 PolarHBondContact O-N 3.48Å; A94-S97 PolarHBondContact O-N 2.87Å; S97-S99 PolarHBondContact O-N 2.9Å; S97-S99 VanDerWaalsContact O-N 3.09Å
98L93.3Very high94.2Very high58 Ų5868.1 Ų68.130%0.30438%0.382SS..  trans-67.5108.2-171.6-166.869.8000112.7A94 Q103 V195A94-L98 WeakPolarHBondContact O-CB 3.3Å; A94-L98 PolarHBondContact O-N 3.28Å; A94-L98 VanDerWaalsContact O-N 3.14Å; L98-Q103 HydrophobicContact CD2-CG 3.56Å; L98-Q103 HydrophobicContact CG-CG 3.78Å; L98-Q103 PolarHBondContact O-NE2 2.82Å; L98-Q103 VanDerWaalsContact O-NE2 3.16Å; L98-V195 HydrophobicContact CD2-CG1 4.26Å
99S92Very high94.1Very high45 Ų4568.1 Ų68.132%0.31539%0.385SS..  trans-73.9159.7177.677.90000113.1S97 D101 Y102 Q103S97-S99 PolarHBondContact O-N 2.9Å; S97-S99 VanDerWaalsContact O-N 3.09Å; S99-D101 VanDerWaalsContact C-N 3.27Å; S99-D101 PolarHBondContact O-N 2.89Å; S99-Y102 PolarHBondContact O-N 3.48Å; S99-Y102 WeakPolarHBondContact OG-CD2 3.31Å; S99-Y102 PolarHBondContact OG-N 3.47Å; S99-Q103 WeakPolarHBondContact O-CG 3.45Å; S99-Q103 PolarHBondContact O-N 3.26Å
100S89.8Confident93.8Very high76 Ų7666.2 Ų66.253%0.53139%0.386SS..Hα-helixtrans-59.6-35.6178.4-54.10000113Q103 Q104S100-Q103 WeakPolarHBondContact O-CB 3.47Å; S100-Q103 PolarHBondContact O-N 3.25Å; S100-Q104 PolarHBondContact O-N 2.83Å
101D91.2Very high93.6Very high120 Ų12063.2 Ų63.264%0.64236%0.363SS*.Hα-helixtrans-67-42.7179.3-59-34.8000111.5S99 Q103 Q104 I105S99-D101 VanDerWaalsContact C-N 3.27Å; S99-D101 PolarHBondContact O-N 2.89Å; D101-Q103 VanDerWaalsContact C-N 3.33Å; D101-Q103 PolarHBondContact O-N 3.25Å; D101-Q104 PolarHBondContact O-N 3.41Å; D101-I105 WeakPolarHBondContact O-CG1 3.44Å; D101-I105 PolarHBondContact O-N 3.42Å; D101-I105 VanDerWaalsContact O-N 3.15Å
102Y92.3Very high93.4Very high158 Ų15864.5 Ų64.562%0.6236%0.363SS*.Hα-helixtrans-65.9-37.5174.6-78.2-63.6000111.9S99 Q104 I105 L106S99-Y102 PolarHBondContact O-N 3.48Å; S99-Y102 WeakPolarHBondContact OG-CD2 3.31Å; S99-Y102 PolarHBondContact OG-N 3.47Å; Y102-Q104 VanDerWaalsContact C-N 3.29Å; Y102-Q104 PolarHBondContact O-N 3.01Å; Y102-I105 PolarHBondContact O-N 3.33Å; Y102-L106 WeakPolarHBondContact O-CB 3.18Å; Y102-L106 PolarHBondContact O-N 3.39Å
103Q93.1Very high93.1Very high6 Ų672.2 Ų72.23%0.02840%0.4CS..Hα-helixtrans-59-42.9173.8-71.2174.23100111.2L98 S99 S100 D101 L106 V107 W184 L191L98-Q103 HydrophobicContact CD2-CG 3.56Å; L98-Q103 HydrophobicContact CG-CG 3.78Å; L98-Q103 PolarHBondContact O-NE2 2.82Å; L98-Q103 VanDerWaalsContact O-NE2 3.16Å; S99-Q103 WeakPolarHBondContact O-CG 3.45Å; S99-Q103 PolarHBondContact O-N 3.26Å; S100-Q103 WeakPolarHBondContact O-CB 3.47Å; S100-Q103 PolarHBondContact O-N 3.25Å; D101-Q103 VanDerWaalsContact C-N 3.33Å; D101-Q103 PolarHBondContact O-N 3.25Å; Q103-L106 PolarHBondContact O-N 3.2Å; Q103-V107 VanDerWaalsContact O-CG2 3.31Å; Q103-V107 WeakPolarHBondContact O-CG2 3.17Å; Q103-V107 PolarHBondContact O-N 2.66Å; Q103-W184 HydrophobicContact CB-CH2 4.24Å; Q103-L191 HydrophobicContact CB-CD2 3.84Å; Q103-L191 HydrophobicContact CG-CD2 3.95Å; Q103-L191 HydrophobicContact CG-CG 4.34Å
104Q93Very high92.8Very high68 Ų6871.6 Ų71.632%0.31840%0.396SS..Hα-helixtrans-62.7-49.7179.2-169.2173.8-31.100112S100 D101 Y102 L106 V107 E108 W184S100-Q104 PolarHBondContact O-N 2.83Å; D101-Q104 PolarHBondContact O-N 3.41Å; Y102-Q104 VanDerWaalsContact C-N 3.29Å; Y102-Q104 PolarHBondContact O-N 3.01Å; Q104-L106 VanDerWaalsContact C-N 3.28Å; Q104-L106 PolarHBondContact O-N 3.32Å; Q104-V107 PolarHBondContact O-N 3.05Å; Q104-E108 WeakPolarHBondContact O-CB 3.4Å; Q104-E108 PolarHBondContact O-N 2.88Å; Q104-W184 HydrophobicContact CB-CH2 3.54Å; Q104-W184 HydrophobicContact CB-CZ2 3.38Å; Q104-W184 HydrophobicContact CB-CZ3 4.26Å; Q104-W184 HydrophobicContact CG-CD2 4.21Å; Q104-W184 HydrophobicContact CG-CE3 4.47Å; Q104-W184 HydrophobicContact CG-CH2 4Å; Q104-W184 HydrophobicContact CG-CZ2 3.61Å; Q104-W184 HydrophobicContact CG-CZ3 4.38Å; Q104-W184 VanDerWaalsContact N-CH2 3.34Å
105I93.1Very high92.5Very high100 Ų10072 Ų7251%0.51340%0.395SS..Hα-helixtrans-59.3-42.2180-65.1166.1000110.8D101 Y102 T109D101-I105 WeakPolarHBondContact O-CG1 3.44Å; D101-I105 PolarHBondContact O-N 3.42Å; D101-I105 VanDerWaalsContact O-N 3.15Å; Y102-I105 PolarHBondContact O-N 3.33Å; I105-T109 WeakPolarHBondContact O-CB 3.46Å; I105-T109 PolarHBondContact O-N 3.42Å; I105-T109 PolarHBondContact O-OG1 3.26Å
106L93.2Very high92.2Very high113 Ų11374.5 Ų74.559%0.59241%0.407SS*.Hα-helixtrans-64.7-49.6179.7-176.764.3000111.9Y102 Q103 Q104 T109 A110Y102-L106 WeakPolarHBondContact O-CB 3.18Å; Y102-L106 PolarHBondContact O-N 3.39Å; Q103-L106 PolarHBondContact O-N 3.2Å; Q104-L106 VanDerWaalsContact C-N 3.28Å; Q104-L106 PolarHBondContact O-N 3.32Å; L106-T109 PolarHBondContact O-N 3.36Å; L106-A110 WeakPolarHBondContact O-CB 3.44Å; L106-A110 PolarHBondContact O-N 3Å
107V93.8Very high91.9Very high25 Ų2575 Ų7515%0.15241%0.41CS..Hα-helixtrans-68.7-37.5-179.71790000110.9Q103 Q104 T109 A110 W111 F131 W184 I187 L191Q103-V107 VanDerWaalsContact O-CG2 3.31Å; Q103-V107 WeakPolarHBondContact O-CG2 3.17Å; Q103-V107 PolarHBondContact O-N 2.66Å; Q104-V107 PolarHBondContact O-N 3.05Å; V107-T109 VanDerWaalsContact C-N 3.33Å; V107-T109 PolarHBondContact O-N 3.41Å; V107-A110 PolarHBondContact O-N 3.25Å; V107-W111 WeakPolarHBondContact O-CB 3.46Å; V107-W111 PolarHBondContact O-N 2.88Å; V107-F131 HydrophobicContact CG1-CE2 3.85Å; V107-W184 HydrophobicContact CB-CE3 4.34Å; V107-W184 HydrophobicContact CB-CZ3 3.84Å; V107-W184 HydrophobicContact CG1-CE3 4.28Å; V107-W184 HydrophobicContact CG1-CZ3 4.21Å; V107-W184 HydrophobicContact CG2-CZ3 4.01Å; V107-I187 HydrophobicContact CG1-CD1 4.29Å; V107-I187 HydrophobicContact CG1-CG2 3.97Å; V107-I187 HydrophobicContact CG2-CG2 4.12Å; V107-L191 HydrophobicContact CG2-CD2 3.66Å
108E93.2Very high91.6Very high44 Ų4472.7 Ų72.721%0.20639%0.394CS..Hα-helixtrans-61.9-43.6175.8-170.4-174.9143.100110.9Q104 W111 K112 F131 L142Q104-E108 WeakPolarHBondContact O-CB 3.4Å; Q104-E108 PolarHBondContact O-N 2.88Å; E108-W111 PolarHBondContact O-N 3.21Å; E108-K112 WeakPolarHBondContact O-CG 3.26Å; E108-K112 PolarHBondContact O-N 3.44Å; E108-K112 WeakPolarHBondContact OE1-CE 3.35Å; E108-K112 IonicContact OE1-NZ 2.67Å; E108-K112 PolarHBondContact OE1-NZ 2.98Å; E108-F131 HydrophobicContact CB-CE1 3.92Å; E108-F131 HydrophobicContact CB-CZ 3.75Å; E108-F131 HydrophobicContact CG-CD1 4.47Å; E108-F131 HydrophobicContact CG-CE1 3.78Å; E108-F131 HydrophobicContact CG-CZ 4.14Å; E108-L142 HydrophobicContact CG-CD1 4.16Å; E108-L142 HydrophobicContact CG-CD2 3.58Å; E108-L142 HydrophobicContact CG-CG 4.44Å
109T92.9Very high91.4Very high60 Ų6070.4 Ų70.437%0.36838%0.381SS..Hα-helixtrans-63.3-44.2175.7-57.20000111I105 L106 V107 W111 K112 Q113I105-T109 WeakPolarHBondContact O-CB 3.46Å; I105-T109 PolarHBondContact O-N 3.42Å; I105-T109 PolarHBondContact O-OG1 3.26Å; L106-T109 PolarHBondContact O-N 3.36Å; V107-T109 VanDerWaalsContact C-N 3.33Å; V107-T109 PolarHBondContact O-N 3.41Å; T109-W111 VanDerWaalsContact C-N 3.33Å; T109-W111 PolarHBondContact O-N 3.47Å; T109-K112 PolarHBondContact O-N 3.28Å; T109-Q113 WeakPolarHBondContact O-CG 3.48Å; T109-Q113 PolarHBondContact O-N 3.13Å
110A92.6Very high91.3Very high49 Ų4969.8 Ų69.841%0.40537%0.374SS..Hα-helixtrans-63-38.9175.600000112.1L106 V107 Q113 S114L106-A110 WeakPolarHBondContact O-CB 3.44Å; L106-A110 PolarHBondContact O-N 3Å; V107-A110 PolarHBondContact O-N 3.25Å; A110-Q113 PolarHBondContact O-N 3.3Å; A110-S114 WeakPolarHBondContact O-CB 3.43Å; A110-S114 PolarHBondContact O-N 2.97Å; A110-S114 PolarHBondContact O-OG 3.31Å
111W92.5Very high91.3Very high11 Ų1169.5 Ų69.54%0.04237%0.37CS..Hα-helixtrans-64.1-45.2176.2-172.1-89.5000111.4V107 E108 T109 Q113 S114 K119 V122 M123 F131 L142 G143V107-W111 WeakPolarHBondContact O-CB 3.46Å; V107-W111 PolarHBondContact O-N 2.88Å; E108-W111 PolarHBondContact O-N 3.21Å; T109-W111 VanDerWaalsContact C-N 3.33Å; T109-W111 PolarHBondContact O-N 3.47Å; W111-Q113 VanDerWaalsContact C-N 3.26Å; W111-Q113 PolarHBondContact O-N 3.2Å; W111-S114 PolarHBondContact O-N 3.4Å; W111-K119 HydrophobicContact CD2-CD 4.42Å; W111-K119 HydrophobicContact CD2-CG 4.15Å; W111-K119 HydrophobicContact CE3-CG 4.34Å; W111-K119 HydrophobicContact CH2-CB 4.06Å; W111-K119 HydrophobicContact CH2-CG 4.17Å; W111-K119 HydrophobicContact CZ2-CB 4.11Å; W111-K119 HydrophobicContact CZ2-CD 4.09Å; W111-K119 HydrophobicContact CZ2-CG 3.96Å; W111-K119 HydrophobicContact CZ3-CB 4.48Å; W111-K119 HydrophobicContact CZ3-CG 4.35Å; W111-K119 WeakPolarHBondContact O-CE 3.46Å; W111-K119 PolarHBondContact O-NZ 3Å; W111-V122 HydrophobicContact CZ3-CB 4.23Å; W111-V122 HydrophobicContact CZ3-CG1 3.89Å; W111-M123 HydrophobicContact CH2-CG 4.18Å; W111-F131 HydrophobicContact CB-CD2 4.2Å; W111-F131 HydrophobicContact CD2-CB 4.15Å; W111-F131 HydrophobicContact CD2-CD2 4.08Å; W111-F131 HydrophobicContact CD2-CG 4.48Å; W111-F131 HydrophobicContact CE3-CD2 4.32Å; W111-F131 HydrophobicContact CG-CB 4.23Å; W111-F131 HydrophobicContact CG-CD2 4.04Å; W111-F131 HydrophobicContact CG-CG 4.29Å; W111-F131 HydrophobicContact CZ2-CB 4.34Å; W111-L142 PolarHBondContact NE1-O 3.46Å; W111-G143 PolarHBondContact NE1-O 3.46Å
112K91.8Very high91.3Very high95 Ų9565.8 Ų65.841%0.41335%0.351SS..Hα-helixtrans-57.3-39.2176.8-74.9168.8171165.90112.4E108 T109 A141 L142E108-K112 WeakPolarHBondContact O-CG 3.26Å; E108-K112 PolarHBondContact O-N 3.44Å; E108-K112 WeakPolarHBondContact OE1-CE 3.35Å; E108-K112 IonicContact OE1-NZ 2.67Å; E108-K112 PolarHBondContact OE1-NZ 2.98Å; T109-K112 PolarHBondContact O-N 3.28Å; K112-A141 HydrophobicContact CG-CB 4.32Å; K112-A141 WeakPolarHBondContact CG-O 3.34Å; K112-L142 HydrophobicContact CD-CD2 4.3Å; K112-L142 HydrophobicContact CG-CD2 3.69Å; K112-L142 HydrophobicContact CG-CG 4.35Å
113Q90.8Very high91.2Very high162 Ų16258.3 Ų58.376%0.75732%0.322SS*.Hα-helixtrans-85.8-11.9-178.9-65.7178.81.500113.9T109 A110 W111T109-Q113 WeakPolarHBondContact O-CG 3.48Å; T109-Q113 PolarHBondContact O-N 3.13Å; A110-Q113 PolarHBondContact O-N 3.3Å; W111-Q113 VanDerWaalsContact C-N 3.26Å; W111-Q113 PolarHBondContact O-N 3.2Å
114S89.6Confident91.1Very high43 Ų4361.2 Ų61.230%0.30134%0.34SS..SBendtrans-76.9140.3-176.9-72.30000112.4A110 W111 K119A110-S114 WeakPolarHBondContact O-CB 3.43Å; A110-S114 PolarHBondContact O-N 2.97Å; A110-S114 PolarHBondContact O-OG 3.31Å; W111-S114 PolarHBondContact O-N 3.4Å; S114-K119 VanDerWaalsContact O-CE 3.31Å; S114-K119 WeakPolarHBondContact O-CE 3.49Å
115S89.1Confident91.1Very high66 Ų6661.4 Ų61.446%0.46235%0.353SS..  trans-66.4159.5172.371.50000111.8N117 S118 K119S115-N117 PolarHBondContact O-N 3.12Å; S115-S118 PolarHBondContact O-N 3.02Å; S115-S118 VanDerWaalsContact O-N 3.08Å; S115-S118 PolarHBondContact OG-N 3.43Å; S115-S118 PolarHBondContact OG-OG 2.98Å; S115-K119 WeakPolarHBondContact O-CG 3.35Å; S115-K119 PolarHBondContact O-N 3.2Å
116N88.8Confident91Very high79 Ų7960.5 Ų60.542%0.42235%0.346SS..Hα-helixtrans-57-34.5175.6-76.5-19.3000112.2K119 L120 P145N116-K119 PolarHBondContact O-N 3.44Å; N116-L120 VanDerWaalsContact O-CB 3.24Å; N116-L120 WeakPolarHBondContact O-CB 3.38Å; N116-L120 PolarHBondContact O-N 3.41Å; N116-P145 HydrophobicContact CB-CB 4.37Å; N116-P145 HydrophobicContact CB-CG 4.19Å
117N88.5Confident90.9Very high95 Ų9562.4 Ų62.451%0.50835%0.349SS..Hα-helixtrans-66.1-43176-17066.9000112.1S115 L120 T121S115-N117 PolarHBondContact O-N 3.12Å; N117-L120 WeakPolarHBondContact O-CB 3.35Å; N117-L120 PolarHBondContact O-N 3.04Å; N117-T121 PolarHBondContact O-N 3.25Å; N117-T121 PolarHBondContact O-OG1 3.39Å; N117-T121 VanDerWaalsContact O-OG1 3.1Å
118S88.4Confident90.8Very high53 Ų5361.2 Ų61.237%0.37134%0.342SS..Hα-helixtrans-64.1-44.2176.3-62.40000111.6S115 L120 T121 V122S115-S118 PolarHBondContact O-N 3.02Å; S115-S118 VanDerWaalsContact O-N 3.08Å; S115-S118 PolarHBondContact OG-N 3.43Å; S115-S118 PolarHBondContact OG-OG 2.98Å; S118-L120 VanDerWaalsContact C-N 3.27Å; S118-L120 PolarHBondContact O-N 3.06Å; S118-T121 PolarHBondContact O-N 2.96Å; S118-V122 WeakPolarHBondContact O-CG2 3.14Å; S118-V122 PolarHBondContact O-N 3.14Å
119K89.6Confident90.5Very high10 Ų1059.4 Ų59.44%0.04333%0.334CS..Hα-helixtrans-58.7-41.8174.2-67.8175.6178.6175.30111.1W111 S114 S115 N116 V122 M123 G143W111-K119 HydrophobicContact CD2-CD 4.42Å; W111-K119 HydrophobicContact CD2-CG 4.15Å; W111-K119 HydrophobicContact CE3-CG 4.34Å; W111-K119 HydrophobicContact CH2-CB 4.06Å; W111-K119 HydrophobicContact CH2-CG 4.17Å; W111-K119 HydrophobicContact CZ2-CB 4.11Å; W111-K119 HydrophobicContact CZ2-CD 4.09Å; W111-K119 HydrophobicContact CZ2-CG 3.96Å; W111-K119 HydrophobicContact CZ3-CB 4.48Å; W111-K119 HydrophobicContact CZ3-CG 4.35Å; W111-K119 WeakPolarHBondContact O-CE 3.46Å; W111-K119 PolarHBondContact O-NZ 3Å; S114-K119 VanDerWaalsContact O-CE 3.31Å; S114-K119 WeakPolarHBondContact O-CE 3.49Å; S115-K119 WeakPolarHBondContact O-CG 3.35Å; S115-K119 PolarHBondContact O-N 3.2Å; N116-K119 PolarHBondContact O-N 3.44Å; K119-V122 PolarHBondContact O-N 3.45Å; K119-M123 VanDerWaalsContact O-CG 3.31Å; K119-M123 WeakPolarHBondContact O-CG 3.28Å; K119-M123 PolarHBondContact O-N 2.92Å; K119-G143 PolarHBondContact NZ-O 2.89Å
120L90Very high90.2Very high32 Ų3256.5 Ų56.517%0.16832%0.316CS..Hα-helixtrans-62-44.1177.2-174.466.3000112.5N116 N117 S118 V122 M123 T124 P145 L149 A150N116-L120 VanDerWaalsContact O-CB 3.24Å; N116-L120 WeakPolarHBondContact O-CB 3.38Å; N116-L120 PolarHBondContact O-N 3.41Å; N117-L120 WeakPolarHBondContact O-CB 3.35Å; N117-L120 PolarHBondContact O-N 3.04Å; S118-L120 VanDerWaalsContact C-N 3.27Å; S118-L120 PolarHBondContact O-N 3.06Å; L120-V122 VanDerWaalsContact C-N 3.33Å; L120-V122 PolarHBondContact O-N 3.32Å; L120-M123 HydrophobicContact CD1-CE 3.98Å; L120-M123 PolarHBondContact O-N 3.3Å; L120-T124 WeakPolarHBondContact O-CB 3.27Å; L120-T124 PolarHBondContact O-N 3.49Å; L120-T124 PolarHBondContact O-OG1 3.38Å; L120-P145 HydrophobicContact CB-CG 4.25Å; L120-P145 HydrophobicContact CD1-CG 4.45Å; L120-L149 VanDerWaalsContact CD1-C 3.46Å; L120-L149 HydrophobicContact CD1-CB 3.46Å; L120-L149 VanDerWaalsContact CD1-CB 3.46Å; L120-L149 HydrophobicContact CD2-CB 4.11Å; L120-L149 HydrophobicContact CD2-CD2 4.47Å; L120-L149 HydrophobicContact CG-CB 4.46Å; L120-A150 HydrophobicContact CD1-CB 3.79Å
121T90.1Very high90Very high71 Ų7154.3 Ų54.344%0.43630%0.298SS..Hα-helixtrans-60.3-44.4175.2-59.70000111.2N117 S118 T124 A125N117-T121 PolarHBondContact O-N 3.25Å; N117-T121 PolarHBondContact O-OG1 3.39Å; N117-T121 VanDerWaalsContact O-OG1 3.1Å; S118-T121 PolarHBondContact O-N 2.96Å; T121-T124 PolarHBondContact O-N 2.83Å; T121-A125 WeakPolarHBondContact O-CB 3.46Å; T121-A125 PolarHBondContact O-N 3.4Å
122V91Very high89.4Confident42 Ų4257 Ų5726%0.25532%0.318SS..Hα-helixtrans-62.4-46.7177.5174.70000111.1W111 S118 K119 L120 T124 A125 F126 I187W111-V122 HydrophobicContact CZ3-CB 4.23Å; W111-V122 HydrophobicContact CZ3-CG1 3.89Å; S118-V122 WeakPolarHBondContact O-CG2 3.14Å; S118-V122 PolarHBondContact O-N 3.14Å; K119-V122 PolarHBondContact O-N 3.45Å; L120-V122 VanDerWaalsContact C-N 3.33Å; L120-V122 PolarHBondContact O-N 3.32Å; V122-T124 VanDerWaalsContact C-N 3.35Å; V122-T124 PolarHBondContact O-N 3.44Å; V122-A125 PolarHBondContact O-N 2.93Å; V122-F126 HydrophobicContact CG1-CD2 3.6Å; V122-F126 HydrophobicContact CG1-CE2 3.91Å; V122-F126 WeakPolarHBondContact O-CB 3.21Å; V122-F126 PolarHBondContact O-N 3.38Å; V122-I187 HydrophobicContact CG1-CD1 4.07Å
123M90.7Very high88.3Confident0 Ų060.4 Ų60.40%033%0.329CS..Hα-helixtrans-60.5-43177-72.3-172.5-55.500112.3W111 K119 L120 K127 C128 Y144 P145 A150W111-M123 HydrophobicContact CH2-CG 4.18Å; K119-M123 VanDerWaalsContact O-CG 3.31Å; K119-M123 WeakPolarHBondContact O-CG 3.28Å; K119-M123 PolarHBondContact O-N 2.92Å; L120-M123 HydrophobicContact CD1-CE 3.98Å; L120-M123 PolarHBondContact O-N 3.3Å; M123-K127 VanDerWaalsContact O-CA 3.25Å; M123-K127 WeakPolarHBondContact O-CA 3.35Å; M123-K127 PolarHBondContact O-N 2.84Å; M123-C128 WeakPolarHBondContact CA-O 3.48Å; M123-C128 VanDerWaalsContact CB-O 3.24Å; M123-C128 WeakPolarHBondContact CB-O 3.45Å; M123-C128 WeakPolarHBondContact CG-O 3.44Å; M123-C128 PolarHBondContact O-N 2.92Å; M123-C128 VanDerWaalsContact O-N 3.14Å; M123-Y144 HydrophobicContact SD-CD2 4Å; M123-P145 HydrophobicContact CE-CG 3.66Å; M123-A150 HydrophobicContact CB-CB 3.79Å
124T91.3Very high86.9Confident68 Ų6855.9 Ų55.942%0.41731%0.314SS..Hα-helixtrans-65.5-47.3177.5-53.20000111.1L120 T121 V122 A150L120-T124 WeakPolarHBondContact O-CB 3.27Å; L120-T124 PolarHBondContact O-N 3.49Å; L120-T124 PolarHBondContact O-OG1 3.38Å; T121-T124 PolarHBondContact O-N 2.83Å; V122-T124 VanDerWaalsContact C-N 3.35Å; V122-T124 PolarHBondContact O-N 3.44Å; T124-A150 WeakPolarHBondContact OG1-CA 3.36Å
125A91.2Very high85.7Confident71 Ų7159.2 Ų59.259%0.58733%0.329SS*.Hα-helixtrans-67.3-39.5-176.300000112.6T121 V122T121-A125 WeakPolarHBondContact O-CB 3.46Å; T121-A125 PolarHBondContact O-N 3.4Å; V122-A125 PolarHBondContact O-N 2.93Å
126F92.3Very high84.6Confident81 Ų8158.6 Ų58.636%0.35532%0.32SS..Hα-helixtrans-97.92.1-178.8-64.1-43.2000114.2V122 C128 V186 I187V122-F126 HydrophobicContact CG1-CD2 3.6Å; V122-F126 HydrophobicContact CG1-CE2 3.91Å; V122-F126 WeakPolarHBondContact O-CB 3.21Å; V122-F126 PolarHBondContact O-N 3.38Å; F126-C128 HydrophobicContact CB-CB 4.48Å; F126-C128 PolarHBondContact O-N 3.01Å; F126-V186 HydrophobicContact CB-CB 4.46Å; F126-V186 HydrophobicContact CB-CG1 3.99Å; F126-V186 HydrophobicContact CD1-CG1 4.27Å; F126-V186 HydrophobicContact CG-CG1 4.24Å; F126-I187 HydrophobicContact CD2-CD1 4.41Å; F126-I187 HydrophobicContact CD2-CG1 3.86Å; F126-I187 HydrophobicContact CE2-CD1 4.44Å; F126-I187 HydrophobicContact CE2-CG1 3.82Å
127K91.7Very high83.5Confident154 Ų15457.2 Ų57.267%0.6732%0.317SS*.THydrogen-bonded Turntrans48.646.5-177.8-57.9-176.5179.4-1780112.2M123M123-K127 VanDerWaalsContact O-CA 3.25Å; M123-K127 WeakPolarHBondContact O-CA 3.35Å; M123-K127 PolarHBondContact O-N 2.84Å
128C90.9Very high82.4Confident0 Ų054.9 Ų54.90%031%0.308CS..  trans-126.8162.2-176.662.70000110.8M123 F126 T181 C183 V186M123-C128 WeakPolarHBondContact CA-O 3.48Å; M123-C128 VanDerWaalsContact CB-O 3.24Å; M123-C128 WeakPolarHBondContact CB-O 3.45Å; M123-C128 WeakPolarHBondContact CG-O 3.44Å; M123-C128 PolarHBondContact O-N 2.92Å; M123-C128 VanDerWaalsContact O-N 3.14Å; F126-C128 HydrophobicContact CB-CB 4.48Å; F126-C128 PolarHBondContact O-N 3.01Å; C128-T181 WeakPolarHBondContact CA-O 3.4Å; C128-T181 HydrophobicContact CB-CG2 4.43Å; C128-C183 VanDerWaalsContact C-SG 3.54Å; C128-C183 HydrophobicContact CB-CB 3.85Å; C128-C183 WeakPolarHBondContact CB-SG 3.34Å; C128-C183 WeakPolarHBondContact SG-CA 3.45Å; C128-C183 WeakPolarHBondContact SG-CB 3.45Å; C128-C183 CovalentContact SG-SG 2.03Å; C128-C183 PolarHBondContact SG-SG 3.27Å; C128-V186 HydrophobicContact CB-CG2 4.39Å
129C87.8Confident81.5Confident5 Ų558 Ų583%0.03433%0.33CS..  trans-132.6123.6-176.3176.50000110C147 L152 C179 T181C129-C147 VanDerWaalsContact CA-SG 3.53Å; C129-C147 HydrophobicContact CB-CB 3.9Å; C129-C147 WeakPolarHBondContact CB-SG 3.25Å; C129-C147 WeakPolarHBondContact SG-CB 3.43Å; C129-C147 CovalentContact SG-SG 2.01Å; C129-C147 PolarHBondContact SG-SG 3.01Å; C129-L152 HydrophobicContact CB-CD2 4.43Å; C129-C179 HydrophobicContact CB-CB 4.27Å; C129-T181 PolarHBondContact N-O 3.05Å
130G85.9Confident80.8Confident0 Ų059.3 Ų59.30%034%0.343CS..SBendtrans68.4164.2-177.200000114.6C183G130-C183 WeakPolarHBondContact O-CB 3.33Å; G130-C183 PolarHBondContact O-N 2.77Å; G130-C183 PolarHBondContact O-SG 2.87Å; G130-C183 VanDerWaalsContact O-SG 3.32Å
131F87.3Confident80.1Confident2 Ų261.1 Ų61.11%0.00936%0.362CS..SBendtrans-72.3-65.8-179.5179.5-110.8000111.9V107 E108 W111 L142 C183 W184V107-F131 HydrophobicContact CG1-CE2 3.85Å; E108-F131 HydrophobicContact CB-CE1 3.92Å; E108-F131 HydrophobicContact CB-CZ 3.75Å; E108-F131 HydrophobicContact CG-CD1 4.47Å; E108-F131 HydrophobicContact CG-CE1 3.78Å; E108-F131 HydrophobicContact CG-CZ 4.14Å; W111-F131 HydrophobicContact CB-CD2 4.2Å; W111-F131 HydrophobicContact CD2-CB 4.15Å; W111-F131 HydrophobicContact CD2-CD2 4.08Å; W111-F131 HydrophobicContact CD2-CG 4.48Å; W111-F131 HydrophobicContact CE3-CD2 4.32Å; W111-F131 HydrophobicContact CG-CB 4.23Å; W111-F131 HydrophobicContact CG-CD2 4.04Å; W111-F131 HydrophobicContact CG-CG 4.29Å; W111-F131 HydrophobicContact CZ2-CB 4.34Å; F131-L142 HydrophobicContact CD1-CD1 4.19Å; F131-L142 HydrophobicContact CD1-CD2 4.05Å; F131-L142 HydrophobicContact CG-CD2 4.4Å; F131-C183 PolarHBondContact O-N 3.44Å; F131-W184 HydrophobicContact CD2-CB 4.49Å; F131-W184 HydrophobicContact CE2-CB 4.22Å; F131-W184 AromaticContact CE2-CE3 3.96Å; F131-W184 HydrophobicContact CE2-CE3 3.96Å; F131-W184 HydrophobicContact CZ-CB 4.34Å; F131-W184 HydrophobicContact CZ-CD2 4.23Å; F131-W184 AromaticContact CZ-CE3 3.93Å; F131-W184 HydrophobicContact CZ-CE3 3.93Å; F131-W184 HydrophobicContact CZ-CG 4.41Å; F131-W184 WeakPolarHBondContact O-CB 3.39Å; F131-W184 PolarHBondContact O-N 2.81Å
132S80.8Confident79.6Confident68 Ų6859.3 Ų59.348%0.47635%0.349SS..SBendtrans-127.4-36.9179.41790000111.7
133R69.3Low79.2Confident167 Ų16757.3 Ų57.363%0.6334%0.337SS*.  trans-118.3146.7172.5-56.8-174.1163.9164-3.2111.6D135 L136R133-D135 WeakPolarHBondContact CB-OD1 3.47Å; R133-L136 HydrophobicContact CB-CD1 4.1Å
134S61.2Low78.8Confident66 Ų6657.8 Ų57.846%0.46234%0.339SS..SBendtrans-96.312.7179.957.70000113.6Y144S134-Y144 WeakPolarHBondContact CA-OH 3.42Å; S134-Y144 PolarHBondContact O-OH 3.09Å
135D64Low78.4Confident113 Ų11355 Ų5560%0.60432%0.322SS*.  trans-105.9-4.9-177.664-18.9000113.2R133 S137R133-D135 WeakPolarHBondContact CB-OD1 3.47Å; D135-S137 PolarHBondContact O-N 3.21Å
136L65.5Low78.1Confident54 Ų5453.2 Ų53.228%0.28330%0.304SS..  trans-81117.5-176.4-76146.3000111.4R133 A140 L142 Y144R133-L136 HydrophobicContact CB-CD1 4.1Å; L136-A140 HydrophobicContact CB-CB 4.38Å; L136-A140 HydrophobicContact CD2-CB 3.62Å; L136-L142 HydrophobicContact CD1-CB 4.08Å; L136-Y144 HydrophobicContact CB-CE1 4.31Å; L136-Y144 WeakPolarHBondContact O-CE1 3.36Å
137S66.3Low77.7Confident50 Ų5049.4 Ų49.435%0.3529%0.288SS..  trans-55.3149.1169.2178.10000111.7D135 S139 A140 G143 S169D135-S137 PolarHBondContact O-N 3.21Å; S137-S139 PolarHBondContact O-N 2.93Å; S137-A140 WeakPolarHBondContact O-CB 3.39Å; S137-A140 PolarHBondContact O-N 3.38Å; S137-G143 WeakPolarHBondContact O-CA 3.36Å; S137-S169 WeakPolarHBondContact CA-OG 3.37Å; S137-S169 WeakPolarHBondContact CB-OG 3.23Å
138S65.3Low77.3Confident46 Ų4647.1 Ų47.132%0.32228%0.278SS..THydrogen-bonded Turntrans-56.2-22.7-179.7-51.40000114.1Y144S138-Y144 WeakPolarHBondContact CB-O 3.5Å; S138-Y144 PolarHBondContact OG-O 2.86Å
139S68.7Low77.1Confident119 Ų11951.6 Ų51.683%0.83230%0.302SS*.THydrogen-bonded Turntrans-80.7-13.1177.4-52.50000114.3S137S137-S139 PolarHBondContact O-N 2.93Å
140A76.1Confident77Confident37 Ų3751.5 Ų51.531%0.30630%0.301SS..SBendtrans-73155.417600000110.9L136 S137 L142 G143L136-A140 HydrophobicContact CB-CB 4.38Å; L136-A140 HydrophobicContact CD2-CB 3.62Å; S137-A140 WeakPolarHBondContact O-CB 3.39Å; S137-A140 PolarHBondContact O-N 3.38Å; A140-L142 PolarHBondContact O-N 3.44Å; A140-L142 VanDerWaalsContact O-N 3.15Å; A140-G143 WeakPolarHBondContact O-CA 3.14Å; A140-G143 PolarHBondContact O-N 2.73Å
141A74.7Confident77Confident69 Ų6960.5 Ų60.557%0.5734%0.34SS*.THydrogen-bonded Turntrans-55.7-36.6179.800000113K112K112-A141 HydrophobicContact CG-CB 4.32Å; K112-A141 WeakPolarHBondContact CG-O 3.34Å
142L80Confident76.9Confident34 Ų3460.8 Ų60.818%0.17834%0.342CS..THydrogen-bonded Turntrans-99.810.5174-67.7175.3000113.7E108 W111 K112 F131 L136 A140E108-L142 HydrophobicContact CG-CD1 4.16Å; E108-L142 HydrophobicContact CG-CD2 3.58Å; E108-L142 HydrophobicContact CG-CG 4.44Å; W111-L142 PolarHBondContact NE1-O 3.46Å; K112-L142 HydrophobicContact CD-CD2 4.3Å; K112-L142 HydrophobicContact CG-CD2 3.69Å; K112-L142 HydrophobicContact CG-CG 4.35Å; F131-L142 HydrophobicContact CD1-CD1 4.19Å; F131-L142 HydrophobicContact CD1-CD2 4.05Å; F131-L142 HydrophobicContact CG-CD2 4.4Å; L136-L142 HydrophobicContact CD1-CB 4.08Å; A140-L142 PolarHBondContact O-N 3.44Å; A140-L142 VanDerWaalsContact O-N 3.15Å
143G81.6Confident77.1Confident0 Ų062.1 Ų62.10%035%0.351CS..  trans-59.3162.2175.200000112.4W111 K119 S137 A140W111-G143 PolarHBondContact NE1-O 3.46Å; K119-G143 PolarHBondContact NZ-O 2.89Å; S137-G143 WeakPolarHBondContact O-CA 3.36Å; A140-G143 WeakPolarHBondContact O-CA 3.14Å; A140-G143 PolarHBondContact O-N 2.73Å
144Y82.3Confident77.8Confident10 Ų1056.1 Ų56.14%0.03933%0.334CS..  trans-149.9156.5-175.557-84.6000109.6M123 S134 L136 S138 C147M123-Y144 HydrophobicContact SD-CD2 4Å; S134-Y144 WeakPolarHBondContact CA-OH 3.42Å; S134-Y144 PolarHBondContact O-OH 3.09Å; L136-Y144 HydrophobicContact CB-CE1 4.31Å; L136-Y144 WeakPolarHBondContact O-CE1 3.36Å; S138-Y144 WeakPolarHBondContact CB-O 3.5Å; S138-Y144 PolarHBondContact OG-O 2.86Å; Y144-C147 WeakPolarHBondContact CE2-SG 3.37Å
145P84.3Confident78.8Confident9 Ų953.1 Ų53.16%0.05831%0.313CS..  trans-68.5157175.227.8-31.7000110.5N116 L120 M123 C147N116-P145 HydrophobicContact CB-CB 4.37Å; N116-P145 HydrophobicContact CB-CG 4.19Å; L120-P145 HydrophobicContact CB-CG 4.25Å; L120-P145 HydrophobicContact CD1-CG 4.45Å; M123-P145 HydrophobicContact CE-CG 3.66Å; P145-C147 PolarHBondContact O-N 3.48Å
146P83.4Confident79.6Confident33 Ų3353 Ų5321%0.21431%0.313CS..  trans-50.1132.3-179.9-27.633.7000113K148 L149 C166 Q167P146-K148 PolarHBondContact O-N 3.28Å; P146-K148 VanDerWaalsContact O-N 3.08Å; P146-L149 HydrophobicContact CB-CD1 3.73Å; P146-L149 HydrophobicContact CG-CD1 4.06Å; P146-L149 WeakPolarHBondContact O-CB 3.39Å; P146-L149 WeakPolarHBondContact O-CD1 3.44Å; P146-L149 PolarHBondContact O-N 3.47Å; P146-C166 CarbonylContact C-O 3.47Å; P146-C166 WeakPolarHBondContact CB-O 3.42Å; P146-Q167 WeakPolarHBondContact CB-O 3.31Å; P146-Q167 VanDerWaalsContact CG-O 3.25Å; P146-Q167 WeakPolarHBondContact CG-O 3.36Å
147C85.7Confident80.1Confident2 Ų252.3 Ų52.31%0.01431%0.311CS..G310 helixtrans-62.4-20.4-176.2-64.80000113.4C129 Y144 P145 L149 A150 C166C129-C147 VanDerWaalsContact CA-SG 3.53Å; C129-C147 HydrophobicContact CB-CB 3.9Å; C129-C147 WeakPolarHBondContact CB-SG 3.25Å; C129-C147 WeakPolarHBondContact SG-CB 3.43Å; C129-C147 CovalentContact SG-SG 2.01Å; C129-C147 PolarHBondContact SG-SG 3.01Å; Y144-C147 WeakPolarHBondContact CE2-SG 3.37Å; P145-C147 PolarHBondContact O-N 3.48Å; C147-L149 PolarHBondContact O-N 3.32Å; C147-A150 PolarHBondContact O-N 2.99Å; C147-C166 HydrophobicContact CB-CB 4.32Å; C147-C166 PolarHBondContact N-O 3.06Å
148K83Confident80.3Confident106 Ų10656.7 Ų56.746%0.46134%0.337SS..G310 helixtrans-50.3-41.6167.7-178175.3-179.3159.40112.7P146 A150 K151 T162 C166P146-K148 PolarHBondContact O-N 3.28Å; P146-K148 VanDerWaalsContact O-N 3.08Å; K148-A150 PolarHBondContact O-N 3.35Å; K148-K151 PolarHBondContact O-N 2.93Å; K148-K151 VanDerWaalsContact O-N 3.07Å; K148-T162 HydrophobicContact CB-CG2 3.91Å; K148-T162 HydrophobicContact CD-CG2 3.85Å; K148-T162 WeakPolarHBondContact CD-OG1 3.44Å; K148-T162 WeakPolarHBondContact CE-OG1 3.1Å; K148-T162 HydrophobicContact CG-CG2 3.75Å; K148-T162 PolarHBondContact NZ-OG1 3.47Å; K148-C166 PolarHBondContact N-O 3.39Å
149L85.8Confident80.6Confident94 Ų9462.2 Ų62.249%0.49236%0.358SS..G310 helixtrans-64.7-25.8-176.3-79.879000111.6L120 P146 C147 K151L120-L149 VanDerWaalsContact CD1-C 3.46Å; L120-L149 HydrophobicContact CD1-CB 3.46Å; L120-L149 VanDerWaalsContact CD1-CB 3.46Å; L120-L149 HydrophobicContact CD2-CB 4.11Å; L120-L149 HydrophobicContact CD2-CD2 4.47Å; L120-L149 HydrophobicContact CG-CB 4.46Å; P146-L149 HydrophobicContact CB-CD1 3.73Å; P146-L149 HydrophobicContact CG-CD1 4.06Å; P146-L149 WeakPolarHBondContact O-CB 3.39Å; P146-L149 WeakPolarHBondContact O-CD1 3.44Å; P146-L149 PolarHBondContact O-N 3.47Å; C147-L149 PolarHBondContact O-N 3.32Å; L149-K151 PolarHBondContact O-N 3.35Å
150A85.6Confident80.6Confident2 Ų259.9 Ų59.92%0.01735%0.353CS..G310 helixtrans-81.20.2-179.600000112.6L120 M123 T124 C147 K148 L152L120-A150 HydrophobicContact CD1-CB 3.79Å; M123-A150 HydrophobicContact CB-CB 3.79Å; T124-A150 WeakPolarHBondContact OG1-CA 3.36Å; C147-A150 PolarHBondContact O-N 2.99Å; K148-A150 PolarHBondContact O-N 3.35Å; A150-L152 HydrophobicContact CB-CD1 3.21Å; A150-L152 PolarHBondContact O-N 3.48Å
151K85.9Confident80.3Confident189 Ų18964.5 Ų64.582%0.82237%0.369SS*.THydrogen-bonded Turntrans51.742.2178.4-57.8-178.6-179.9-179.50112.6K148 L149K148-K151 PolarHBondContact O-N 2.93Å; K148-K151 VanDerWaalsContact O-N 3.07Å; L149-K151 PolarHBondContact O-N 3.35Å
152L85.4Confident79.9Confident9 Ų962.2 Ų62.25%0.04735%0.348CS..  trans-72.8132.3175.2-85.372.5000109.9C129 A150 C154 C155C129-L152 HydrophobicContact CB-CD2 4.43Å; A150-L152 HydrophobicContact CB-CD1 3.21Å; A150-L152 PolarHBondContact O-N 3.48Å; L152-C154 PolarHBondContact O-N 3.45Å; L152-C154 VanDerWaalsContact O-N 3.16Å; L152-C155 WeakPolarHBondContact O-CB 3.39Å; L152-C155 PolarHBondContact O-N 2.94Å
153S85.1Confident79.5Confident96 Ų9661.2 Ų61.267%0.67134%0.344SS*.G310 helixtrans-60.8-24.9177.858.70000113.8C155 D156S153-C155 PolarHBondContact O-N 2.9Å; S153-D156 PolarHBondContact O-N 2.86Å
154C84.5Confident78.9Confident41 Ų4168.5 Ų68.528%0.27738%0.376SS..G310 helixtrans-70.6-18.1175.358.10000112.7L152 D156 P178 C179L152-C154 PolarHBondContact O-N 3.45Å; L152-C154 VanDerWaalsContact O-N 3.16Å; C154-D156 VanDerWaalsContact C-N 3.34Å; C154-P178 HydrophobicContact CB-CB 4.48Å; C154-P178 VanDerWaalsContact O-CB 3.3Å; C154-P178 WeakPolarHBondContact O-CB 3.42Å; C154-P178 WeakPolarHBondContact O-CG 3.4Å; C154-C179 HydrophobicContact CB-CB 4.14Å; C154-C179 WeakPolarHBondContact CB-SG 3.38Å; C154-C179 VanDerWaalsContact SG-CA 3.53Å; C154-C179 WeakPolarHBondContact SG-CB 3.43Å; C154-C179 CovalentContact SG-SG 2.03Å; C154-C179 PolarHBondContact SG-SG 3.15Å
155C81.6Confident78.3Confident2 Ų269.1 Ų69.11%0.01438%0.382CS..G310 helixtrans-83.6-11.5177.5-68.50000113.2L152 S153 T162 A163 C166 C179L152-C155 WeakPolarHBondContact O-CB 3.39Å; L152-C155 PolarHBondContact O-N 2.94Å; S153-C155 PolarHBondContact O-N 2.9Å; C155-T162 HydrophobicContact CB-CG2 3.89Å; C155-T162 WeakPolarHBondContact O-CA 3.3Å; C155-T162 WeakPolarHBondContact O-CG2 3.18Å; C155-A163 PolarHBondContact O-N 3.41Å; C155-C166 VanDerWaalsContact CA-SG 3.54Å; C155-C166 HydrophobicContact CB-CB 3.71Å; C155-C166 WeakPolarHBondContact CB-SG 3.17Å; C155-C166 WeakPolarHBondContact SG-CB 3.35Å; C155-C166 CovalentContact SG-SG 2.05Å; C155-C166 PolarHBondContact SG-SG 3.42Å; C155-C179 PolarHBondContact SG-SG 3.35Å
156D81.1Confident77.9Confident112 Ų11268.7 Ų68.760%0.59938%0.379SS*.BIsolated β-bridgetrans-79.7123.4179.7-59.4-33.9000109.4S153 C154S153-D156 PolarHBondContact O-N 2.86Å; C154-D156 VanDerWaalsContact C-N 3.34Å
157T74.9Confident77.3Confident39 Ų3971.8 Ų71.824%0.23939%0.39CS..  trans-90.3158.2172.368.40000110.5E159 G160 E161 A163T157-E159 PolarHBondContact O-N 3.47Å; T157-E159 VanDerWaalsContact O-N 3.08Å; T157-G160 PolarHBondContact O-N 3.16Å; T157-E161 VanDerWaalsContact CB-O 3.24Å; T157-E161 WeakPolarHBondContact CB-O 3.43Å; T157-E161 VanDerWaalsContact CG2-O 3.25Å; T157-E161 WeakPolarHBondContact CG2-O 2.96Å; T157-E161 PolarHBondContact N-O 2.95Å; T157-E161 VanDerWaalsContact OG1-C 3.25Å; T157-E161 WeakPolarHBondContact OG1-CA 3.36Å; T157-E161 PolarHBondContact OG1-N 3.45Å; T157-E161 VanDerWaalsContact OG1-N 3.08Å; T157-E161 PolarHBondContact OG1-O 3.4Å; T157-A163 HydrophobicContact CG2-CB 4.26Å
158P71.2Confident76.2Confident141 Ų14173.2 Ų73.292%0.91641%0.405SS*.THydrogen-bonded Turntrans-57-23.7176.8-23.833.9000114.1G160P158-G160 VanDerWaalsContact C-N 3.29Å
159E71.8Confident74.9Confident162 Ų16271.6 Ų71.676%0.75741%0.407SS*.THydrogen-bonded Turntrans-86.41.1-179.6-68.5154.8-172.400112.5T157 E161T157-E159 PolarHBondContact O-N 3.47Å; T157-E159 VanDerWaalsContact O-N 3.08Å; E159-E161 PolarHBondContact O-N 2.94Å
160G68.4Low73.4Confident71 Ų7174.7 Ų74.773%0.73242%0.424SS*.SBendtrans77.30.8-175.400000113.8T157 P158T157-G160 PolarHBondContact O-N 3.16Å; P158-G160 VanDerWaalsContact C-N 3.29Å
161E69.8Low71.9Confident134 Ų13477 Ų7763%0.62644%0.438SS*.PPolyproline II helixtrans-83.8158.1173.9-60.1-162.3146.800111.2T157 E159T157-E161 VanDerWaalsContact CB-O 3.24Å; T157-E161 WeakPolarHBondContact CB-O 3.43Å; T157-E161 VanDerWaalsContact CG2-O 3.25Å; T157-E161 WeakPolarHBondContact CG2-O 2.96Å; T157-E161 PolarHBondContact N-O 2.95Å; T157-E161 VanDerWaalsContact OG1-C 3.25Å; T157-E161 WeakPolarHBondContact OG1-CA 3.36Å; T157-E161 PolarHBondContact OG1-N 3.45Å; T157-E161 VanDerWaalsContact OG1-N 3.08Å; T157-E161 PolarHBondContact OG1-O 3.4Å; E159-E161 PolarHBondContact O-N 2.94Å
162T67.4Low70.2Confident21 Ų2170.6 Ų70.613%0.12943%0.425CS..BIsolated β-bridgetrans-91.1130.7177.5-410000110.3K148 C155 K164 C166 Q167K148-T162 HydrophobicContact CB-CG2 3.91Å; K148-T162 HydrophobicContact CD-CG2 3.85Å; K148-T162 WeakPolarHBondContact CD-OG1 3.44Å; K148-T162 WeakPolarHBondContact CE-OG1 3.1Å; K148-T162 HydrophobicContact CG-CG2 3.75Å; K148-T162 PolarHBondContact NZ-OG1 3.47Å; C155-T162 HydrophobicContact CB-CG2 3.89Å; C155-T162 WeakPolarHBondContact O-CA 3.3Å; C155-T162 WeakPolarHBondContact O-CG2 3.18Å; T162-K164 PolarHBondContact O-N 3.27Å; T162-C166 HydrophobicContact CG2-CB 4.03Å; T162-Q167 PolarHBondContact O-NE2 2.93Å
163A69.9Low68.7Low13 Ų1378.9 Ų78.911%0.10747%0.469CS..PPolyproline II helixtrans-49.9128.6176.700000111C155 T157 C165 C166 P178C155-A163 PolarHBondContact O-N 3.41Å; T157-A163 HydrophobicContact CG2-CB 4.26Å; A163-C165 PolarHBondContact O-N 3.5Å; A163-C165 VanDerWaalsContact O-N 3.09Å; A163-C166 WeakPolarHBondContact O-CA 3.33Å; A163-C166 WeakPolarHBondContact O-CB 3.4Å; A163-C166 PolarHBondContact O-N 3.42Å; A163-P178 HydrophobicContact CB-CG 3.96Å
164K69.2Low67.2Low153 Ų15379.7 Ų79.767%0.66548%0.475SS*.G310 helixtrans-54.4-35-173.5-68.1-175.1179.3179.50112.9T162 C166 Q167 V171T162-K164 PolarHBondContact O-N 3.27Å; K164-C166 PolarHBondContact O-N 3.31Å; K164-Q167 WeakPolarHBondContact O-CB 3.32Å; K164-Q167 PolarHBondContact O-N 2.87Å; K164-Q167 VanDerWaalsContact O-N 3.08Å; K164-V171 HydrophobicContact CB-CG2 4.02Å
165C70.3Confident66.1Low23 Ų2381.6 Ų81.616%0.15549%0.486CS..G310 helixtrans-64.4-24.7176.665.90000114.2A163 Q167 V171 C177A163-C165 PolarHBondContact O-N 3.5Å; A163-C165 VanDerWaalsContact O-N 3.09Å; C165-Q167 VanDerWaalsContact C-N 3.3Å; C165-V171 VanDerWaalsContact CA-CG2 3.41Å; C165-V171 HydrophobicContact CB-CG2 3.95Å; C165-C177 HydrophobicContact CB-CB 3.5Å; C165-C177 VanDerWaalsContact CB-CB 3.5Å; C165-C177 WeakPolarHBondContact CB-SG 3.4Å; C165-C177 WeakPolarHBondContact SG-CA 3.43Å; C165-C177 WeakPolarHBondContact SG-CB 3.41Å; C165-C177 CovalentContact SG-SG 2.03Å; C165-C177 PolarHBondContact SG-SG 3.07Å
166C75.9Confident65.4Low0 Ų090 Ų900%052%0.522CS..G310 helixtrans-80.9-8.2175.7-72.10000113.5P146 C147 K148 C155 T162 A163 K164P146-C166 CarbonylContact C-O 3.47Å; P146-C166 WeakPolarHBondContact CB-O 3.42Å; C147-C166 HydrophobicContact CB-CB 4.32Å; C147-C166 PolarHBondContact N-O 3.06Å; K148-C166 PolarHBondContact N-O 3.39Å; C155-C166 VanDerWaalsContact CA-SG 3.54Å; C155-C166 HydrophobicContact CB-CB 3.71Å; C155-C166 WeakPolarHBondContact CB-SG 3.17Å; C155-C166 WeakPolarHBondContact SG-CB 3.35Å; C155-C166 CovalentContact SG-SG 2.05Å; C155-C166 PolarHBondContact SG-SG 3.42Å; T162-C166 HydrophobicContact CG2-CB 4.03Å; A163-C166 WeakPolarHBondContact O-CA 3.33Å; A163-C166 WeakPolarHBondContact O-CB 3.4Å; A163-C166 PolarHBondContact O-N 3.42Å; K164-C166 PolarHBondContact O-N 3.31Å
167Q70.2Confident64.8Low98 Ų9885.8 Ų85.846%0.45850%0.502SS..G310 helixtrans-88.6-7.6-174.6-58.1-172.812.900113.8P146 T162 K164 C165P146-Q167 WeakPolarHBondContact CB-O 3.31Å; P146-Q167 VanDerWaalsContact CG-O 3.25Å; P146-Q167 WeakPolarHBondContact CG-O 3.36Å; T162-Q167 PolarHBondContact O-NE2 2.93Å; K164-Q167 WeakPolarHBondContact O-CB 3.32Å; K164-Q167 PolarHBondContact O-N 2.87Å; K164-Q167 VanDerWaalsContact O-N 3.08Å; C165-Q167 VanDerWaalsContact C-N 3.3Å
168G62.4Low64.8Low31 Ų3186.6 Ų86.632%0.3251%0.507SS..SBendtrans78.5104.5173.900000112.7
169S56.4Low65.1Low72 Ų7280.1 Ų80.150%0.50347%0.465SS..SBendtrans63.370.1175.9-62.90000116.5S137S137-S169 WeakPolarHBondContact CA-OG 3.37Å; S137-S169 WeakPolarHBondContact CB-OG 3.23Å
170D53.6Low65.4Low159 Ų15977.8 Ų77.885%0.8546%0.462SS*.  trans-168.145.5145.3-119.4-17.9000113.5
171V53.8Low66.3Low52 Ų5277.5 Ų77.532%0.31545%0.446SS..  trans-111.594.8175.3-175.40000108.8K164 C165 T175K164-V171 HydrophobicContact CB-CG2 4.02Å; C165-V171 VanDerWaalsContact CA-CG2 3.41Å; C165-V171 HydrophobicContact CB-CG2 3.95Å; V171-T175 VanDerWaalsContact CG1-CB 3.45Å; V171-T175 VanDerWaalsContact CG1-OG1 3.32Å; V171-T175 WeakPolarHBondContact CG1-OG1 3.35Å
172G50.9Low67.2Low53 Ų5371.8 Ų71.855%0.54642%0.422SS..  trans-48.3151.6161.800000110.4S174G172-S174 PolarHBondContact O-N 3.13Å
173N54.8Low68.4Low183 Ų18370.8 Ų70.898%0.97942%0.416SS*.THydrogen-bonded Turntrans-46.412-168.8-90.2-11.1000119.4
174S53.7Low69.5Low113 Ų11371.1 Ų71.179%0.7942%0.415SS*.THydrogen-bonded Turntrans-139.814.9-163.634.80000115.6G172G172-S174 PolarHBondContact O-N 3.13Å
175T61.5Low70.6Confident82 Ų8266.8 Ų66.850%0.50340%0.401SS..  trans-112.3116.6175.4-26.30000111.2V171 C177V171-T175 VanDerWaalsContact CG1-CB 3.45Å; V171-T175 VanDerWaalsContact CG1-OG1 3.32Å; V171-T175 WeakPolarHBondContact CG1-OG1 3.35Å; T175-C177 PolarHBondContact O-N 3.21Å
176F65.2Low71.7Confident178 Ų17867 Ų6778%0.78140%0.402SS*.  trans-54.7123.8175.7174.1-98000110.3P178F176-P178 HydrophobicContact CE1-CB 4.44Å
177C69.6Low72.5Confident24 Ų2468 Ų6816%0.16241%0.407CS..  trans-101.2119.2175.7-165.20000110.6C165 T175 C179 T180C165-C177 HydrophobicContact CB-CB 3.5Å; C165-C177 VanDerWaalsContact CB-CB 3.5Å; C165-C177 WeakPolarHBondContact CB-SG 3.4Å; C165-C177 WeakPolarHBondContact SG-CA 3.43Å; C165-C177 WeakPolarHBondContact SG-CB 3.41Å; C165-C177 CovalentContact SG-SG 2.03Å; C165-C177 PolarHBondContact SG-SG 3.07Å; T175-C177 PolarHBondContact O-N 3.21Å; C177-C179 PolarHBondContact O-N 2.8Å; C177-T180 WeakPolarHBondContact O-CG2 3.34Å
178P74Confident73.7Confident55 Ų5567 Ų6736%0.35740%0.402SS..SBendtrans-65.3-24.9179.825-35.8000113.7C154 A163 F176 T180C154-P178 HydrophobicContact CB-CB 4.48Å; C154-P178 VanDerWaalsContact O-CB 3.3Å; C154-P178 WeakPolarHBondContact O-CB 3.42Å; C154-P178 WeakPolarHBondContact O-CG 3.4Å; A163-P178 HydrophobicContact CB-CG 3.96Å; F176-P178 HydrophobicContact CE1-CB 4.44Å; P178-T180 PolarHBondContact O-N 2.88Å
179C77.6Confident75.1Confident5 Ų571.3 Ų71.33%0.03441%0.414CS..  trans-90.386.3177.5-60.70000111.3C129 C154 C155 C177C129-C179 HydrophobicContact CB-CB 4.27Å; C154-C179 HydrophobicContact CB-CB 4.14Å; C154-C179 WeakPolarHBondContact CB-SG 3.38Å; C154-C179 VanDerWaalsContact SG-CA 3.53Å; C154-C179 WeakPolarHBondContact SG-CB 3.43Å; C154-C179 CovalentContact SG-SG 2.03Å; C154-C179 PolarHBondContact SG-SG 3.15Å; C155-C179 PolarHBondContact SG-SG 3.35Å; C177-C179 PolarHBondContact O-N 2.8Å
180T78.7Confident76.9Confident113 Ų11376 Ų7669%0.69342%0.42SS*.  trans-93.4-11.6-178.856.50000114C177 P178 A182C177-T180 WeakPolarHBondContact O-CG2 3.34Å; P178-T180 PolarHBondContact O-N 2.88Å; T180-A182 PolarHBondContact O-N 3.45Å
181T87.6Confident78.9Confident65 Ų6570.7 Ų70.740%0.39939%0.392SS..  trans-77.2104.8-176.1-51.20000111.9C128 C129 V186C128-T181 WeakPolarHBondContact CA-O 3.4Å; C128-T181 HydrophobicContact CB-CG2 4.43Å; C129-T181 PolarHBondContact N-O 3.05Å; T181-V186 HydrophobicContact CG2-CG2 3.59Å
182A88.7Confident80.7Confident15 Ų1570.1 Ų70.112%0.12439%0.39CS..  trans-72.2140.1172.500000111.5T180 W184 T185T180-A182 PolarHBondContact O-N 3.45Å; A182-W184 PolarHBondContact O-N 3.22Å; A182-T185 HydrophobicContact CB-CG2 4.36Å; A182-T185 PolarHBondContact O-N 2.86Å; A182-T185 VanDerWaalsContact O-N 3.07Å; A182-T185 PolarHBondContact O-OG1 3.36Å
183C92.3Very high82.8Confident0 Ų071.5 Ų71.50%039%0.388CS..Hα-helixtrans-61.6-32.7-177.9-690000113.2C128 G130 F131 T185 V186 I187C128-C183 VanDerWaalsContact C-SG 3.54Å; C128-C183 HydrophobicContact CB-CB 3.85Å; C128-C183 WeakPolarHBondContact CB-SG 3.34Å; C128-C183 WeakPolarHBondContact SG-CA 3.45Å; C128-C183 WeakPolarHBondContact SG-CB 3.45Å; C128-C183 CovalentContact SG-SG 2.03Å; C128-C183 PolarHBondContact SG-SG 3.27Å; G130-C183 WeakPolarHBondContact O-CB 3.33Å; G130-C183 PolarHBondContact O-N 2.77Å; G130-C183 PolarHBondContact O-SG 2.87Å; G130-C183 VanDerWaalsContact O-SG 3.32Å; F131-C183 PolarHBondContact O-N 3.44Å; C183-T185 VanDerWaalsContact C-N 3.25Å; C183-T185 PolarHBondContact O-N 2.89Å; C183-V186 PolarHBondContact O-N 3.38Å; C183-I187 HydrophobicContact CB-CD1 4.06Å; C183-I187 WeakPolarHBondContact O-CB 3.44Å; C183-I187 WeakPolarHBondContact O-CD1 3.42Å; C183-I187 WeakPolarHBondContact O-CG1 3.35Å; C183-I187 PolarHBondContact O-N 3.33Å
184W92.7Very high84.7Confident19 Ų1964.2 Ų64.27%0.07236%0.356CS..Hα-helixtrans-57.1-39.7175.4177.1-117.5000112.2Q103 Q104 V107 F131 A182 V186 I187 Q188Q103-W184 HydrophobicContact CB-CH2 4.24Å; Q104-W184 HydrophobicContact CB-CH2 3.54Å; Q104-W184 HydrophobicContact CB-CZ2 3.38Å; Q104-W184 HydrophobicContact CB-CZ3 4.26Å; Q104-W184 HydrophobicContact CG-CD2 4.21Å; Q104-W184 HydrophobicContact CG-CE3 4.47Å; Q104-W184 HydrophobicContact CG-CH2 4Å; Q104-W184 HydrophobicContact CG-CZ2 3.61Å; Q104-W184 HydrophobicContact CG-CZ3 4.38Å; Q104-W184 VanDerWaalsContact N-CH2 3.34Å; V107-W184 HydrophobicContact CB-CE3 4.34Å; V107-W184 HydrophobicContact CB-CZ3 3.84Å; V107-W184 HydrophobicContact CG1-CE3 4.28Å; V107-W184 HydrophobicContact CG1-CZ3 4.21Å; V107-W184 HydrophobicContact CG2-CZ3 4.01Å; F131-W184 HydrophobicContact CD2-CB 4.49Å; F131-W184 HydrophobicContact CE2-CB 4.22Å; F131-W184 AromaticContact CE2-CE3 3.96Å; F131-W184 HydrophobicContact CE2-CE3 3.96Å; F131-W184 HydrophobicContact CZ-CB 4.34Å; F131-W184 HydrophobicContact CZ-CD2 4.23Å; F131-W184 AromaticContact CZ-CE3 3.93Å; F131-W184 HydrophobicContact CZ-CE3 3.93Å; F131-W184 HydrophobicContact CZ-CG 4.41Å; F131-W184 WeakPolarHBondContact O-CB 3.39Å; F131-W184 PolarHBondContact O-N 2.81Å; A182-W184 PolarHBondContact O-N 3.22Å; W184-V186 VanDerWaalsContact C-N 3.32Å; W184-V186 PolarHBondContact O-N 2.87Å; W184-I187 HydrophobicContact CZ3-CG2 4.45Å; W184-I187 PolarHBondContact O-N 2.94Å; W184-Q188 HydrophobicContact CD2-CB 4.33Å; W184-Q188 HydrophobicContact CH2-CB 3.92Å; W184-Q188 HydrophobicContact CZ2-CB 3.72Å; W184-Q188 HydrophobicContact CZ3-CB 4.35Å; W184-Q188 WeakPolarHBondContact O-CB 3.4Å; W184-Q188 VanDerWaalsContact O-CG 3.29Å; W184-Q188 WeakPolarHBondContact O-CG 3.32Å; W184-Q188 PolarHBondContact O-N 3.45Å
185T91.9Very high86.7Confident62 Ų6259.9 Ų59.938%0.3833%0.325SS..Hα-helixtrans-65.8-34.8-17864.40000113.2A182 C183 Q188A182-T185 HydrophobicContact CB-CG2 4.36Å; A182-T185 PolarHBondContact O-N 2.86Å; A182-T185 VanDerWaalsContact O-N 3.07Å; A182-T185 PolarHBondContact O-OG1 3.36Å; C183-T185 VanDerWaalsContact C-N 3.25Å; C183-T185 PolarHBondContact O-N 2.89Å; T185-Q188 WeakPolarHBondContact O-CG 3.47Å
186V93.7Very high88.3Confident28 Ų2864.4 Ų64.417%0.1733%0.333CS..Hα-helixtrans-79.4-42.9176.2-174.10000110.4F126 C128 T181 C183 W184 R190F126-V186 HydrophobicContact CB-CB 4.46Å; F126-V186 HydrophobicContact CB-CG1 3.99Å; F126-V186 HydrophobicContact CD1-CG1 4.27Å; F126-V186 HydrophobicContact CG-CG1 4.24Å; C128-V186 HydrophobicContact CB-CG2 4.39Å; T181-V186 HydrophobicContact CG2-CG2 3.59Å; C183-V186 PolarHBondContact O-N 3.38Å; W184-V186 VanDerWaalsContact C-N 3.32Å; W184-V186 PolarHBondContact O-N 2.87Å; V186-R190 HydrophobicContact CG1-CG 4.46Å; V186-R190 VanDerWaalsContact O-CG 3.25Å; V186-R190 WeakPolarHBondContact O-CG 3.35Å; V186-R190 PolarHBondContact O-N 2.97Å
187I94.2Very high89.8Confident20 Ų2060 Ų6010%0.10332%0.32CS..Hα-helixtrans-64-44.6-179.2-68.5165.3000110.7V107 V122 F126 C183 W184 E189 R190 L191V107-I187 HydrophobicContact CG1-CD1 4.29Å; V107-I187 HydrophobicContact CG1-CG2 3.97Å; V107-I187 HydrophobicContact CG2-CG2 4.12Å; V122-I187 HydrophobicContact CG1-CD1 4.07Å; F126-I187 HydrophobicContact CD2-CD1 4.41Å; F126-I187 HydrophobicContact CD2-CG1 3.86Å; F126-I187 HydrophobicContact CE2-CD1 4.44Å; F126-I187 HydrophobicContact CE2-CG1 3.82Å; C183-I187 HydrophobicContact CB-CD1 4.06Å; C183-I187 WeakPolarHBondContact O-CB 3.44Å; C183-I187 WeakPolarHBondContact O-CD1 3.42Å; C183-I187 WeakPolarHBondContact O-CG1 3.35Å; C183-I187 PolarHBondContact O-N 3.33Å; W184-I187 HydrophobicContact CZ3-CG2 4.45Å; W184-I187 PolarHBondContact O-N 2.94Å; I187-E189 VanDerWaalsContact C-N 3.32Å; I187-E189 PolarHBondContact O-N 2.98Å; I187-R190 PolarHBondContact O-N 3.41Å; I187-L191 HydrophobicContact CG2-CB 4.45Å; I187-L191 WeakPolarHBondContact O-CA 3.46Å; I187-L191 WeakPolarHBondContact O-CB 3.27Å; I187-L191 PolarHBondContact O-N 3.39Å
188Q94.5Very high91.1Very high77 Ų7762.3 Ų62.336%0.3633%0.334SS..Hα-helixtrans-61.2-39.7-177.871.2-176.1-15.600112.2W184 T185 S192W184-Q188 HydrophobicContact CD2-CB 4.33Å; W184-Q188 HydrophobicContact CH2-CB 3.92Å; W184-Q188 HydrophobicContact CZ2-CB 3.72Å; W184-Q188 HydrophobicContact CZ3-CB 4.35Å; W184-Q188 WeakPolarHBondContact O-CB 3.4Å; W184-Q188 VanDerWaalsContact O-CG 3.29Å; W184-Q188 WeakPolarHBondContact O-CG 3.32Å; W184-Q188 PolarHBondContact O-N 3.45Å; T185-Q188 WeakPolarHBondContact O-CG 3.47Å; Q188-S192 WeakPolarHBondContact O-CB 3.25Å; Q188-S192 PolarHBondContact O-N 3.4Å; Q188-S192 PolarHBondContact O-OG 2.77Å
189E93Very high92.2Very high122 Ų12259.7 Ų59.757%0.5732%0.317SS*.Hα-helixtrans-69.1-45.3-179.9-173.1-173.7173.200110.6I187 S192 T193I187-E189 VanDerWaalsContact C-N 3.32Å; I187-E189 PolarHBondContact O-N 2.98Å; E189-S192 PolarHBondContact O-OG 3.01Å; E189-S192 VanDerWaalsContact O-OG 3.1Å; E189-T193 WeakPolarHBondContact O-CB 3.42Å; E189-T193 PolarHBondContact O-N 3.01Å; E189-T193 PolarHBondContact O-OG1 2.93Å
190R93.9Very high93Very high170 Ų17061.9 Ų61.964%0.64234%0.336SS*.Hα-helixtrans-67.2-41.4178-64.2-64.4-177.3-176.9-1.7111.9V186 I187 G194V186-R190 HydrophobicContact CG1-CG 4.46Å; V186-R190 VanDerWaalsContact O-CG 3.25Å; V186-R190 WeakPolarHBondContact O-CG 3.35Å; V186-R190 PolarHBondContact O-N 2.97Å; I187-R190 PolarHBondContact O-N 3.41Å; R190-G194 WeakPolarHBondContact O-CA 3.37Å; R190-G194 PolarHBondContact O-N 3.49Å
191L94.3Very high93.9Very high49 Ų4959.5 Ų59.526%0.25732%0.321SS..Hα-helixtrans-69.8-50-178.5-176.261.7000110.6Q103 V107 I187 T193 G194 V195Q103-L191 HydrophobicContact CB-CD2 3.84Å; Q103-L191 HydrophobicContact CG-CD2 3.95Å; Q103-L191 HydrophobicContact CG-CG 4.34Å; V107-L191 HydrophobicContact CG2-CD2 3.66Å; I187-L191 HydrophobicContact CG2-CB 4.45Å; I187-L191 WeakPolarHBondContact O-CA 3.46Å; I187-L191 WeakPolarHBondContact O-CB 3.27Å; I187-L191 PolarHBondContact O-N 3.39Å; L191-T193 VanDerWaalsContact C-N 3.31Å; L191-T193 PolarHBondContact O-N 3.01Å; L191-G194 PolarHBondContact O-N 2.94Å; L191-G194 VanDerWaalsContact O-N 3.13Å; L191-V195 HydrophobicContact CD1-CG1 3.74Å; L191-V195 HydrophobicContact CG-CG1 4.22Å; L191-V195 WeakPolarHBondContact O-CG1 3.19Å; L191-V195 WeakPolarHBondContact O-CG2 3.46Å; L191-V195 PolarHBondContact O-N 3.33Å
192S93.2Very high94.3Very high39 Ų3957.7 Ų57.727%0.27331%0.311SS..Hα-helixtrans-58.7-4217959.30000112.5Q188 E189 V195 R196Q188-S192 WeakPolarHBondContact O-CB 3.25Å; Q188-S192 PolarHBondContact O-N 3.4Å; Q188-S192 PolarHBondContact O-OG 2.77Å; E189-S192 PolarHBondContact O-OG 3.01Å; E189-S192 VanDerWaalsContact O-OG 3.1Å; S192-V195 WeakPolarHBondContact O-CG2 3.39Å; S192-R196 WeakPolarHBondContact O-CB 3.31Å; S192-R196 PolarHBondContact O-N 2.96Å
193T94.3Very high94.7Very high82 Ų8260 Ų6050%0.50332%0.321SS..Hα-helixtrans-67.1-47174-55.80000111E189 L191 R196 V197E189-T193 WeakPolarHBondContact O-CB 3.42Å; E189-T193 PolarHBondContact O-N 3.01Å; E189-T193 PolarHBondContact O-OG1 2.93Å; L191-T193 VanDerWaalsContact C-N 3.31Å; L191-T193 PolarHBondContact O-N 3.01Å; T193-R196 PolarHBondContact O-N 2.87Å; T193-V197 HydrophobicContact CG2-CG2 4.39Å; T193-V197 WeakPolarHBondContact O-CG2 3.37Å; T193-V197 PolarHBondContact O-N 2.88Å
194G95.1Very high94.9Very high30 Ų3066.2 Ų66.231%0.30935%0.348SS..Hα-helixtrans-62.2-45.8-177.800000113.5R190 L191 V197 T198R190-G194 WeakPolarHBondContact O-CA 3.37Å; R190-G194 PolarHBondContact O-N 3.49Å; L191-G194 PolarHBondContact O-N 2.94Å; L191-G194 VanDerWaalsContact O-N 3.13Å; G194-V197 PolarHBondContact O-N 3.43Å; G194-T198 WeakPolarHBondContact O-CB 3.3Å; G194-T198 PolarHBondContact O-N 3.48Å; G194-T198 PolarHBondContact O-OG1 2.87Å
195V95.3Very high95Very high22 Ų2270.3 Ų70.313%0.13337%0.367CS..Hα-helixtrans-66.7-37.7178.2-610000111.3C95 L98 L191 S192 G199C95-V195 HydrophobicContact CB-CB 4.46Å; C95-V195 WeakPolarHBondContact CB-O 3.29Å; L98-V195 HydrophobicContact CD2-CG1 4.26Å; L191-V195 HydrophobicContact CD1-CG1 3.74Å; L191-V195 HydrophobicContact CG-CG1 4.22Å; L191-V195 WeakPolarHBondContact O-CG1 3.19Å; L191-V195 WeakPolarHBondContact O-CG2 3.46Å; L191-V195 PolarHBondContact O-N 3.33Å; S192-V195 WeakPolarHBondContact O-CG2 3.39Å; V195-G199 PolarHBondContact O-N 3.28Å
196R95.1Very high95.2Very high177 Ų17767.5 Ų67.567%0.66835%0.349SS*.Hα-helixtrans-66.2-47.1177.3-172.9-180-65.7177.20.2111.6S192 T193 G199 A200S192-R196 WeakPolarHBondContact O-CB 3.31Å; S192-R196 PolarHBondContact O-N 2.96Å; T193-R196 PolarHBondContact O-N 2.87Å; R196-G199 PolarHBondContact O-N 3.35Å; R196-A200 WeakPolarHBondContact O-CB 3.4Å; R196-A200 PolarHBondContact O-N 3.5Å
197V96.6Very high95.2Very high86 Ų8670 Ų7052%0.52137%0.365SS..Hα-helixtrans-64.2-44.6177.7172.10000110.8T193 G194 A200 T201T193-V197 HydrophobicContact CG2-CG2 4.39Å; T193-V197 WeakPolarHBondContact O-CG2 3.37Å; T193-V197 PolarHBondContact O-N 2.88Å; G194-V197 PolarHBondContact O-N 3.43Å; V197-A200 PolarHBondContact O-N 3.46Å; V197-T201 VanDerWaalsContact O-CB 3.26Å; V197-T201 WeakPolarHBondContact O-CB 3.37Å; V197-T201 PolarHBondContact O-N 3.28Å; V197-T201 PolarHBondContact O-OG1 2.95Å
198T96Very high95.3Very high72 Ų7271.9 Ų71.944%0.44237%0.374SS..Hα-helixtrans-62.8-46.2177.7-58.30000110.9G194 A200 T201 S202G194-T198 WeakPolarHBondContact O-CB 3.3Å; G194-T198 PolarHBondContact O-N 3.48Å; G194-T198 PolarHBondContact O-OG1 2.87Å; T198-A200 PolarHBondContact O-N 2.97Å; T198-T201 PolarHBondContact O-N 3.41Å; T198-S202 WeakPolarHBondContact O-CB 3.5Å; T198-S202 PolarHBondContact O-N 3.45Å; T198-S202 PolarHBondContact O-OG 2.86Å; T198-S202 VanDerWaalsContact O-OG 3.07Å
199G96.8Very high95.3Very high0 Ų068.4 Ų68.40%036%0.358CS..Hα-helixtrans-60.4-46.3177.700000112.6V195 R196 S202 L203V195-G199 PolarHBondContact O-N 3.28Å; R196-G199 PolarHBondContact O-N 3.35Å; G199-S202 PolarHBondContact O-N 2.82Å; G199-L203 WeakPolarHBondContact O-CB 3.41Å; G199-L203 PolarHBondContact O-N 3.35Å
200A96.3Very high95.4Very high52 Ų5266.4 Ų66.443%0.4335%0.351SS..Hα-helixtrans-63.8-41.7176.300000112.4R196 V197 T198 L203 F204R196-A200 WeakPolarHBondContact O-CB 3.4Å; R196-A200 PolarHBondContact O-N 3.5Å; V197-A200 PolarHBondContact O-N 3.46Å; T198-A200 PolarHBondContact O-N 2.97Å; A200-L203 PolarHBondContact O-N 2.93Å; A200-F204 PolarHBondContact O-N 3.42Å
201T96.6Very high95.5Very high63 Ų6363.1 Ų63.139%0.38735%0.346SS..Hα-helixtrans-64.9-47.4178.2-58.50000111.1V197 T198 L203 F204 F205V197-T201 VanDerWaalsContact O-CB 3.26Å; V197-T201 WeakPolarHBondContact O-CB 3.37Å; V197-T201 PolarHBondContact O-N 3.28Å; V197-T201 PolarHBondContact O-OG1 2.95Å; T198-T201 PolarHBondContact O-N 3.41Å; T201-L203 VanDerWaalsContact C-N 3.32Å; T201-L203 PolarHBondContact O-N 2.9Å; T201-F204 WeakPolarHBondContact O-CB 3.4Å; T201-F204 PolarHBondContact O-N 2.96Å; T201-F205 HydrophobicContact CG2-CD2 3.76Å; T201-F205 HydrophobicContact CG2-CE2 3.48Å; T201-F205 VanDerWaalsContact CG2-CE2 3.48Å; T201-F205 WeakPolarHBondContact O-CD2 3.46Å; T201-F205 PolarHBondContact O-N 3.07Å
202S96.3Very high95.5Very high27 Ų2761 Ų6119%0.18934%0.335CS..Hα-helixtrans-62.9-37.4176.2-64.90000112T198 G199 F205 S206T198-S202 WeakPolarHBondContact O-CB 3.5Å; T198-S202 PolarHBondContact O-N 3.45Å; T198-S202 PolarHBondContact O-OG 2.86Å; T198-S202 VanDerWaalsContact O-OG 3.07Å; G199-S202 PolarHBondContact O-N 2.82Å; S202-F205 PolarHBondContact O-N 3.18Å; S202-S206 WeakPolarHBondContact O-CB 3.37Å; S202-S206 PolarHBondContact O-N 2.92Å
203L96.6Very high95.7Very high64 Ų6459.4 Ų59.434%0.33532%0.324SS..Hα-helixtrans-63.4-44.4174.8-175.163.7000111.3F89 A92 L96 G199 A200 T201 F205 S206 V207F89-L203 HydrophobicContact CD2-CD1 3.87Å; F89-L203 HydrophobicContact CE2-CD1 3.78Å; A92-L203 HydrophobicContact CB-CB 4.12Å; L96-L203 HydrophobicContact CD1-CD2 4.2Å; G199-L203 WeakPolarHBondContact O-CB 3.41Å; G199-L203 PolarHBondContact O-N 3.35Å; A200-L203 PolarHBondContact O-N 2.93Å; T201-L203 VanDerWaalsContact C-N 3.32Å; T201-L203 PolarHBondContact O-N 2.9Å; L203-F205 PolarHBondContact O-N 3.49Å; L203-S206 PolarHBondContact O-N 3.29Å; L203-S206 PolarHBondContact O-OG 3.38Å; L203-V207 PolarHBondContact O-N 2.82Å
204F96.4Very high95.7Very high130 Ų13060.8 Ų60.857%0.5732%0.32SS*.Hα-helixtrans-59.1-46.3175.2175.1-100.6000112.1A200 T201 S206 V207 I208A200-F204 PolarHBondContact O-N 3.42Å; T201-F204 WeakPolarHBondContact O-CB 3.4Å; T201-F204 PolarHBondContact O-N 2.96Å; F204-S206 VanDerWaalsContact C-N 3.34Å; F204-S206 PolarHBondContact O-N 2.87Å; F204-V207 PolarHBondContact O-N 3.11Å; F204-I208 HydrophobicContact CD1-CD1 3.98Å; F204-I208 HydrophobicContact CE1-CD1 3.35Å; F204-I208 HydrophobicContact CE1-CG1 4.42Å; F204-I208 HydrophobicContact CE2-CD1 4.41Å; F204-I208 HydrophobicContact CZ-CD1 3.61Å; F204-I208 HydrophobicContact CZ-CG1 4.46Å; F204-I208 PolarHBondContact O-N 3.32Å
205F94.7Very high95.7Very high105 Ų10559.6 Ų59.646%0.46131%0.306SS..Hα-helixtrans-64.5-37.1176.5-76.9-63.8000112.8T201 S202 L203 V207 I208 E209T201-F205 HydrophobicContact CG2-CD2 3.76Å; T201-F205 HydrophobicContact CG2-CE2 3.48Å; T201-F205 VanDerWaalsContact CG2-CE2 3.48Å; T201-F205 WeakPolarHBondContact O-CD2 3.46Å; T201-F205 PolarHBondContact O-N 3.07Å; S202-F205 PolarHBondContact O-N 3.18Å; L203-F205 PolarHBondContact O-N 3.49Å; F205-V207 VanDerWaalsContact C-N 3.25Å; F205-V207 PolarHBondContact O-N 3.49Å; F205-I208 PolarHBondContact O-N 3.31Å; F205-I208 VanDerWaalsContact O-N 3.14Å; F205-E209 WeakPolarHBondContact O-CB 3.26Å; F205-E209 PolarHBondContact O-N 3.34Å
206S96Very high95.7Very high2 Ų258.5 Ų58.51%0.01430%0.3CS..Hα-helixtrans-61.5-33.4176.576.50000112.6F85 S202 L203 F204 E209 L210F85-S206 WeakPolarHBondContact CD2-O 3.37Å; S202-S206 WeakPolarHBondContact O-CB 3.37Å; S202-S206 PolarHBondContact O-N 2.92Å; L203-S206 PolarHBondContact O-N 3.29Å; L203-S206 PolarHBondContact O-OG 3.38Å; F204-S206 VanDerWaalsContact C-N 3.34Å; F204-S206 PolarHBondContact O-N 2.87Å; S206-E209 PolarHBondContact O-N 3.1Å; S206-L210 WeakPolarHBondContact O-CB 3.28Å; S206-L210 PolarHBondContact O-N 3.43Å
207V94.8Very high95.6Very high81 Ų8153.3 Ų53.349%0.49129%0.285SS..Hα-helixtrans-69.2-44.5174.4174.80000110.9L203 F204 F205 E209 L210 L211L203-V207 PolarHBondContact O-N 2.82Å; F204-V207 PolarHBondContact O-N 3.11Å; F205-V207 VanDerWaalsContact C-N 3.25Å; F205-V207 PolarHBondContact O-N 3.49Å; V207-E209 VanDerWaalsContact C-N 3.29Å; V207-E209 PolarHBondContact O-N 3.23Å; V207-L210 PolarHBondContact O-N 2.91Å; V207-L211 WeakPolarHBondContact O-CG 3.42Å; V207-L211 PolarHBondContact O-N 3.32Å
208I94.7Very high95.4Very high60 Ų6056 Ų5631%0.30829%0.286SS..Hα-helixtrans-60.7-42.6175.4-66.6175.9000110.5L15 F204 F205 L211 G212L15-I208 HydrophobicContact CD1-CG2 4.49Å; F204-I208 HydrophobicContact CD1-CD1 3.98Å; F204-I208 HydrophobicContact CE1-CD1 3.35Å; F204-I208 HydrophobicContact CE1-CG1 4.42Å; F204-I208 HydrophobicContact CE2-CD1 4.41Å; F204-I208 HydrophobicContact CZ-CD1 3.61Å; F204-I208 HydrophobicContact CZ-CG1 4.46Å; F204-I208 PolarHBondContact O-N 3.32Å; F205-I208 PolarHBondContact O-N 3.31Å; F205-I208 VanDerWaalsContact O-N 3.14Å; I208-L211 WeakPolarHBondContact O-CB 3.47Å; I208-L211 PolarHBondContact O-N 3.46Å; I208-G212 PolarHBondContact O-N 2.97Å
209E94.9Very high95.2Very high3 Ų352.6 Ų52.61%0.01427%0.265CS..Hα-helixtrans-64.6-41.9178.5-175.4164.5-152.800111.8L81 L84 F85 Q88 F205 S206 V207 L211 G212 V213L81-E209 HydrophobicContact CD2-CG 4.28Å; L81-E209 WeakPolarHBondContact CD2-OE1 3.37Å; L84-E209 WeakPolarHBondContact CB-OE1 3.21Å; F85-E209 WeakPolarHBondContact CA-OE2 3.32Å; F85-E209 HydrophobicContact CB-CG 4.04Å; F85-E209 PolarHBondContact N-OE2 2.98Å; Q88-E209 PolarHBondContact OE1-OE2 3.46Å; Q88-E209 VanDerWaalsContact OE1-OE2 3.09Å; F205-E209 WeakPolarHBondContact O-CB 3.26Å; F205-E209 PolarHBondContact O-N 3.34Å; S206-E209 PolarHBondContact O-N 3.1Å; V207-E209 VanDerWaalsContact C-N 3.29Å; V207-E209 PolarHBondContact O-N 3.23Å; E209-L211 VanDerWaalsContact C-N 3.29Å; E209-L211 PolarHBondContact O-N 2.9Å; E209-G212 CarbonylContact O-C 3.53Å; E209-G212 WeakPolarHBondContact O-CA 3.33Å; E209-G212 PolarHBondContact O-N 2.73Å; E209-V213 WeakPolarHBondContact O-CG2 3.5Å; E209-V213 PolarHBondContact O-N 3.42Å
210L95.7Very high95Very high81 Ų8156 Ų5642%0.42428%0.278SS..Hα-helixtrans-60.7-39.1174.2-175.862.8000111.9F85 S206 V207 G212 V213 W214F85-L210 HydrophobicContact CD2-CB 4.24Å; F85-L210 HydrophobicContact CE2-CB 4.18Å; F85-L210 HydrophobicContact CE2-CD2 4.49Å; F85-L210 HydrophobicContact CZ-CD1 4.42Å; S206-L210 WeakPolarHBondContact O-CB 3.28Å; S206-L210 PolarHBondContact O-N 3.43Å; V207-L210 PolarHBondContact O-N 2.91Å; L210-G212 VanDerWaalsContact C-N 3.32Å; L210-V213 PolarHBondContact O-N 3.29Å; L210-W214 WeakPolarHBondContact O-CB 3.24Å; L210-W214 PolarHBondContact O-N 3.1Å
211L94.9Very high94.6Very high101 Ų10160.4 Ų60.453%0.52929%0.289SS..Hα-helixtrans-65-36.3172-67174.9000111.9V207 I208 E209 T215V207-L211 WeakPolarHBondContact O-CG 3.42Å; V207-L211 PolarHBondContact O-N 3.32Å; I208-L211 WeakPolarHBondContact O-CB 3.47Å; I208-L211 PolarHBondContact O-N 3.46Å; E209-L211 VanDerWaalsContact C-N 3.29Å; E209-L211 PolarHBondContact O-N 2.9Å; L211-T215 WeakPolarHBondContact O-CB 3.12Å; L211-T215 PolarHBondContact O-N 2.83Å; L211-T215 PolarHBondContact O-OG1 3.38Å
212G95.6Very high94.2Very high3 Ų359.8 Ų59.83%0.03128%0.282CS..Hα-helixtrans-61.8-49.6172.400000112.3I208 E209 L210 W214 T215 A216I208-G212 PolarHBondContact O-N 2.97Å; E209-G212 CarbonylContact O-C 3.53Å; E209-G212 WeakPolarHBondContact O-CA 3.33Å; E209-G212 PolarHBondContact O-N 2.73Å; L210-G212 VanDerWaalsContact C-N 3.32Å; G212-W214 PolarHBondContact O-N 2.84Å; G212-T215 PolarHBondContact O-N 3.19Å; G212-A216 WeakPolarHBondContact O-CB 3.35Å; G212-A216 PolarHBondContact O-N 3.24Å
213V96.2Very high93.2Very high6 Ų669 Ų694%0.03631%0.312CS..Hα-helixtrans-58.3-48.1174.7171.80000110.7I78 L81 F82 E209 L210 T215 A216 L217I78-V213 HydrophobicContact CG2-CG1 4.37Å; L81-V213 HydrophobicContact CB-CG2 3.62Å; L81-V213 HydrophobicContact CD1-CG2 4.34Å; F82-V213 HydrophobicContact CB-CG2 4.43Å; F82-V213 HydrophobicContact CD2-CG1 4.42Å; E209-V213 WeakPolarHBondContact O-CG2 3.5Å; E209-V213 PolarHBondContact O-N 3.42Å; L210-V213 PolarHBondContact O-N 3.29Å; V213-T215 VanDerWaalsContact C-N 3.34Å; V213-T215 PolarHBondContact O-N 3.49Å; V213-A216 PolarHBondContact O-N 3.1Å; V213-L217 HydrophobicContact CG1-CD1 3.91Å; V213-L217 HydrophobicContact CG1-CG 4.45Å; V213-L217 WeakPolarHBondContact O-CB 3.46Å; V213-L217 WeakPolarHBondContact O-CG 3.34Å; V213-L217 PolarHBondContact O-N 3.14Å
214W95.1Very high92.3Very high112 Ų11267.7 Ų67.742%0.42431%0.306SS..Hα-helixtrans-60.7-43.2177.9179.785.2000112.1L210 G212 L217 R218L210-W214 WeakPolarHBondContact O-CB 3.24Å; L210-W214 PolarHBondContact O-N 3.1Å; G212-W214 PolarHBondContact O-N 2.84Å; W214-L217 PolarHBondContact O-N 3.47Å; W214-R218 HydrophobicContact CD2-CG 4.23Å; W214-R218 HydrophobicContact CH2-CG 4.45Å; W214-R218 HydrophobicContact CZ2-CG 4.09Å; W214-R218 WeakPolarHBondContact O-CB 3.41Å; W214-R218 WeakPolarHBondContact O-CG 3.46Å; W214-R218 PolarHBondContact O-N 3.01Å
215T94.4Very high91.3Very high4 Ų466.1 Ų66.13%0.02531%0.309CS..Hα-helixtrans-65.1-42.9177.1-57.60000111.4L3 L11 L12 L211 G212 V213 R218 Y219L3-T215 HydrophobicContact CD2-CG2 3.87Å; L11-T215 HydrophobicContact CB-CG2 4.44Å; L11-T215 HydrophobicContact CD2-CG2 3.68Å; L11-T215 WeakPolarHBondContact CD2-OG1 2.97Å; L12-T215 HydrophobicContact CD1-CG2 4.43Å; L12-T215 HydrophobicContact CD2-CG2 4.36Å; L12-T215 HydrophobicContact CG-CG2 4.08Å; L211-T215 WeakPolarHBondContact O-CB 3.12Å; L211-T215 PolarHBondContact O-N 2.83Å; L211-T215 PolarHBondContact O-OG1 3.38Å; G212-T215 PolarHBondContact O-N 3.19Å; V213-T215 VanDerWaalsContact C-N 3.34Å; V213-T215 PolarHBondContact O-N 3.49Å; T215-R218 PolarHBondContact O-N 3.25Å; T215-Y219 VanDerWaalsContact O-CB 3.26Å; T215-Y219 WeakPolarHBondContact O-CB 3.44Å; T215-Y219 PolarHBondContact O-N 3.22Å
216A94.9Very high90.4Very high0 Ų068.4 Ų68.40%033%0.325CS..Hα-helixtrans-64-42.8177.200000112L12 L74 Y77 I78 G212 V213 R218 Y219 R220L12-A216 HydrophobicContact CD2-CB 3.87Å; L74-A216 HydrophobicContact CD1-CB 4.25Å; Y77-A216 HydrophobicContact CD1-CB 4.27Å; Y77-A216 HydrophobicContact CE1-CB 4.09Å; I78-A216 HydrophobicContact CD1-CB 3.97Å; I78-A216 HydrophobicContact CG1-CB 3.52Å; G212-A216 WeakPolarHBondContact O-CB 3.35Å; G212-A216 PolarHBondContact O-N 3.24Å; V213-A216 PolarHBondContact O-N 3.1Å; A216-R218 PolarHBondContact O-N 3.35Å; A216-Y219 PolarHBondContact O-N 2.98Å; A216-R220 WeakPolarHBondContact O-CB 3.37Å; A216-R220 PolarHBondContact O-N 3.16Å
217L94Very high89.3Confident67 Ų6773.6 Ų73.635%0.35135%0.352SS..Hα-helixtrans-61.5-42.1174.4-78.8168.9000112.2I78 V213 W214 H221I78-L217 HydrophobicContact CD1-CD2 4.07Å; I78-L217 HydrophobicContact CD1-CG 4.24Å; I78-L217 HydrophobicContact CG2-CD2 3.87Å; I78-L217 HydrophobicContact CG2-CG 3.98Å; V213-L217 HydrophobicContact CG1-CD1 3.91Å; V213-L217 HydrophobicContact CG1-CG 4.45Å; V213-L217 WeakPolarHBondContact O-CB 3.46Å; V213-L217 WeakPolarHBondContact O-CG 3.34Å; V213-L217 PolarHBondContact O-N 3.14Å; W214-L217 PolarHBondContact O-N 3.47Å; L217-H221 PolarHBondContact O-N 3.46Å; L217-H221 PolarHBondContact O-ND1 3.34Å
218R92.5Very high88.1Confident143 Ų14374.2 Ų74.254%0.5435%0.352SS..Hα-helixtrans-65.8-49.3175.1-76.7-72.2-170.9177.5-0.8111.2W214 T215 A216 R220 H221 Q222W214-R218 HydrophobicContact CD2-CG 4.23Å; W214-R218 HydrophobicContact CH2-CG 4.45Å; W214-R218 HydrophobicContact CZ2-CG 4.09Å; W214-R218 WeakPolarHBondContact O-CB 3.41Å; W214-R218 WeakPolarHBondContact O-CG 3.46Å; W214-R218 PolarHBondContact O-N 3.01Å; T215-R218 PolarHBondContact O-N 3.25Å; A216-R218 PolarHBondContact O-N 3.35Å; R218-R220 VanDerWaalsContact C-N 3.26Å; R218-R220 PolarHBondContact O-N 3.23Å; R218-H221 PolarHBondContact O-N 3.04Å; R218-H221 VanDerWaalsContact O-N 3.11Å; R218-Q222 WeakPolarHBondContact O-CG 3.37Å; R218-Q222 PolarHBondContact O-N 3.41Å
219Y92.6Very high86.9Confident0 Ų076.7 Ų76.70%037%0.372CS..Hα-helixtrans-57.1-40.2179.6-177.7-117.1000112.3F5 K9 L12 A66 H69 L74 T215 A216 H221 Q222F5-Y219 HydrophobicContact CD2-CD2 4.19Å; F5-Y219 AromaticContact CD2-CE2 3.87Å; F5-Y219 HydrophobicContact CD2-CE2 3.87Å; F5-Y219 HydrophobicContact CE1-CE2 4.29Å; F5-Y219 HydrophobicContact CE2-CD2 4.22Å; F5-Y219 AromaticContact CE2-CE2 3.57Å; F5-Y219 HydrophobicContact CE2-CE2 3.57Å; F5-Y219 HydrophobicContact CG-CE2 4.38Å; F5-Y219 AromaticContact CZ-CE2 3.8Å; F5-Y219 HydrophobicContact CZ-CE2 3.8Å; K9-Y219 HydrophobicContact CB-CE2 3.74Å; K9-Y219 HydrophobicContact CG-CE2 4.4Å; L12-Y219 HydrophobicContact CD1-CD1 3.54Å; L12-Y219 HydrophobicContact CD1-CE1 4.29Å; L12-Y219 HydrophobicContact CD1-CG 3.69Å; A66-Y219 PolarHBondContact O-OH 3.17Å; H69-Y219 AromaticContact CD2-CE1 3.58Å; H69-Y219 AromaticContact CD2-CE2 3.76Å; H69-Y219 AromaticContact CD2-CZ 3.31Å; H69-Y219 PolarHBondContact CD2-OH 3.06Å; H69-Y219 PolarHBondContact NE2-O 3.28Å; L74-Y219 HydrophobicContact CD1-CD1 4.38Å; L74-Y219 HydrophobicContact CD2-CD1 3.71Å; L74-Y219 HydrophobicContact CD2-CE1 4.33Å; T215-Y219 VanDerWaalsContact O-CB 3.26Å; T215-Y219 WeakPolarHBondContact O-CB 3.44Å; T215-Y219 PolarHBondContact O-N 3.22Å; A216-Y219 PolarHBondContact O-N 2.98Å; Y219-H221 VanDerWaalsContact C-N 3.31Å; Y219-H221 PolarHBondContact O-N 3.04Å; Y219-Q222 PolarHBondContact O-N 2.99Å
220R91.5Very high85.7Confident72 Ų7282.7 Ų82.727%0.27241%0.405SS..Hα-helixtrans-57.4-42.6176.3-172.4-175.9172.3-165.81112.7Q71 L74 I78 A216 R218 Q222Q71-R220 PolarHBondContact NE2-O 3.43Å; Q71-R220 VanDerWaalsContact NE2-O 3.1Å; L74-R220 HydrophobicContact CD2-CB 3.55Å; L74-R220 HydrophobicContact CD2-CG 4.01Å; L74-R220 HydrophobicContact CG-CB 4.34Å; I78-R220 HydrophobicContact CD1-CB 4.44Å; A216-R220 WeakPolarHBondContact O-CB 3.37Å; A216-R220 PolarHBondContact O-N 3.16Å; R218-R220 VanDerWaalsContact C-N 3.26Å; R218-R220 PolarHBondContact O-N 3.23Å; R220-Q222 VanDerWaalsContact C-N 3.35Å
221H89.3Confident84.3Confident145 Ų14581.5 Ų81.567%0.67140%0.403SS*.Hα-helixtrans-83.2-8.7-178.6-65.6116000113.7L217 R218 Y219L217-H221 PolarHBondContact O-N 3.46Å; L217-H221 PolarHBondContact O-ND1 3.34Å; R218-H221 PolarHBondContact O-N 3.04Å; R218-H221 VanDerWaalsContact O-N 3.11Å; Y219-H221 VanDerWaalsContact C-N 3.31Å; Y219-H221 PolarHBondContact O-N 3.04Å
222Q86.9Confident82.4Confident49 Ų4983.4 Ų83.423%0.22942%0.418CS..SBendtrans-81.4129.5174.4-70.3173.3-3600109.6L3 F5 S8 H69 R218 Y219 R220L3-Q222 PolarHBondContact O-NE2 2.95Å; F5-Q222 HydrophobicContact CD2-CB 3.83Å; S8-Q222 PolarHBondContact OG-OE1 3.29Å; H69-Q222 PolarHBondContact CE1-O 3.15Å; H69-Q222 PolarHBondContact NE2-O 3.15Å; R218-Q222 WeakPolarHBondContact O-CG 3.37Å; R218-Q222 PolarHBondContact O-N 3.41Å; Y219-Q222 PolarHBondContact O-N 2.99Å; R220-Q222 VanDerWaalsContact C-N 3.35Å
223R76.6Confident80.1Confident220 Ų22094.6 Ų94.683%0.8348%0.476SS*.PPolyproline II helixtrans-69.5140.6168.2-71.4-173.1-179.9176.6-0.7109.4P225R223-P225 WeakPolarHBondContact O-CD 3.16Å
224D77.3Confident79.3Confident37 Ų3799 Ų9920%0.19850%0.498CS..PPolyproline II helixtrans-64.4117.9172.3-166.3-26.8000108.8F5 L226 L227F5-D224 HydrophobicContact CE2-CB 4.15Å; F5-D224 HydrophobicContact CZ-CB 3.85Å; D224-L226 PolarHBondContact O-N 3.42Å; D224-L226 VanDerWaalsContact O-N 3.14Å; D224-L226 WeakPolarHBondContact OD1-CB 3.13Å; D224-L226 PolarHBondContact OD1-N 3.25Å; D224-L227 HydrophobicContact CB-CD1 4.41Å; D224-L227 PolarHBondContact O-N 3.32Å; D224-L227 VanDerWaalsContact O-N 3.16Å
225P75.7Confident78.5Confident98 Ų9898.3 Ų98.364%0.63650%0.502SS*.THydrogen-bonded Turntrans-66.6-10.2179.828.9-36.4000113.4F5 R223F5-P225 HydrophobicContact CB-CG 4.46Å; F5-P225 VanDerWaalsContact CD1-CD 3.47Å; F5-P225 HydrophobicContact CD1-CG 3.96Å; F5-P225 HydrophobicContact CE1-CG 4.46Å; F5-P225 HydrophobicContact CG-CG 4.26Å; R223-P225 WeakPolarHBondContact O-CD 3.16Å
226L75.5Confident77.6Confident153 Ų153103.6 Ų103.680%0.80153%0.529SS*.THydrogen-bonded Turntrans-85.9-14.5175.6-63170.6000113.3D224D224-L226 PolarHBondContact O-N 3.42Å; D224-L226 VanDerWaalsContact O-N 3.14Å; D224-L226 WeakPolarHBondContact OD1-CB 3.13Å; D224-L226 PolarHBondContact OD1-N 3.25Å
227L72.1Confident76.5Confident110 Ų110109.6 Ų109.658%0.57656%0.56SS**SBendtrans-77.6132.3171.7-11075.5000109.2D224D224-L227 HydrophobicContact CB-CD1 4.41Å; D224-L227 PolarHBondContact O-N 3.32Å; D224-L227 VanDerWaalsContact O-N 3.16Å
228D70.6Confident75.5Confident94 Ų94112.3 Ų112.350%0.50357%0.573SS.*  trans-56.8124.8172.4-174.6-19.9000108.5N230 S231D228-N230 PolarHBondContact O-N 2.92Å; D228-N230 WeakPolarHBondContact OD1-CB 3.44Å; D228-N230 PolarHBondContact OD1-N 2.99Å; D228-S231 PolarHBondContact O-N 2.92Å; D228-S231 PolarHBondContact O-OG 2.92Å
229P68.2Low74.3Confident112 Ų112110.3 Ų110.373%0.72758%0.575SS**THydrogen-bonded Turntrans-57.2-19.7178.123.2-34.3000113.1
230N70.7Confident73Confident130 Ų130118.1 Ų118.170%0.69562%0.616SS**THydrogen-bonded Turntrans-99.3-2178.5-56.1-45.7000113.9D228 V232D228-N230 PolarHBondContact O-N 2.92Å; D228-N230 WeakPolarHBondContact OD1-CB 3.44Å; D228-N230 PolarHBondContact OD1-N 2.99Å; N230-V232 PolarHBondContact O-N 2.95Å
231S66.3Low71.6Confident56 Ų56121.7 Ų121.739%0.39264%0.643SS.*  trans-72.196.2172.464.60000109.1D228 L233D228-S231 PolarHBondContact O-N 2.92Å; D228-S231 PolarHBondContact O-OG 2.92Å; S231-L233 VanDerWaalsContact C-N 3.33Å; S231-L233 PolarHBondContact O-N 3.15Å; S231-L233 VanDerWaalsContact O-N 3.15Å
232V55Low70.1Confident140 Ų140119.8 Ų119.885%0.84864%0.64SS**  trans-75.285.2164.5-83.10000108.8N230N230-V232 PolarHBondContact O-N 2.95Å
233L46.7Very low68.6Low238 Ų238126.2 Ų126.2100%1.24668%0.678SS**  trans-1430160.4-108.8121.7000110.1S231S231-L233 VanDerWaalsContact C-N 3.33Å; S231-L233 PolarHBondContact O-N 3.15Å; S231-L233 VanDerWaalsContact O-N 3.15Å

Retrieved 233 of 233 residues in 93.8 ms (Link to these results)