A0A087Y0K2_POEFO Loading...

Phospholipid phosphatase 5

AlphaFold DB , UniProt , Accession A0A087Y0K2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 266 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M60.1Low75.9Confident200 Ų200126.4 Ų126.499%0.98560%0.596SS**  0-56.30-149.5163.98200113.1R3 R4 L5M1-R3 PolarHBondContact O-N 3.37Å; M1-R4 PolarHBondContact O-N 3.12Å; M1-L5 PolarHBondContact O-N 3.3Å
2K66.6Low77.2Confident189 Ų189119.6 Ų119.682%0.82256%0.564SS**Hα-helixtrans-55.5-40.8180-71.3-177.7177.4179.80115L5 L6K2-L5 PolarHBondContact O-N 3.37Å; K2-L6 WeakPolarHBondContact O-CB 3.09Å; K2-L6 PolarHBondContact O-N 2.98Å
3R69.3Low78.4Confident203 Ų203114.6 Ų114.677%0.76654%0.542SS*.Hα-helixtrans-64.8-40-179.8-159.5173.9-177.2-179.70.8113.5M1 Q7M1-R3 PolarHBondContact O-N 3.37Å; R3-Q7 WeakPolarHBondContact O-CB 3.31Å; R3-Q7 VanDerWaalsContact O-CG 3.27Å; R3-Q7 WeakPolarHBondContact O-CG 3.42Å; R3-Q7 PolarHBondContact O-N 3.49Å
4R70.3Confident79.5Confident208 Ų208110.9 Ų110.979%0.78554%0.535SS*.Hα-helixtrans-69.1-39.5175.3-73.6-172.6-176.8179.10.6112.2M1 Q7 G8M1-R4 PolarHBondContact O-N 3.12Å; R4-Q7 PolarHBondContact O-N 2.99Å; R4-G8 PolarHBondContact O-N 3.31Å
5L71.4Confident80.6Confident91 Ų91109.5 Ų109.548%0.47653%0.53SS..Hα-helixtrans-64.5-40.3175.5-113.5154.6000112.1M1 K2 F9M1-L5 PolarHBondContact O-N 3.3Å; K2-L5 PolarHBondContact O-N 3.37Å; L5-F9 PolarHBondContact O-N 3.38Å; L5-F9 VanDerWaalsContact O-N 3.08Å
6L75.8Confident81.5Confident121 Ų121104.1 Ų104.163%0.63450%0.502SS*.Hα-helixtrans-67.6-43.6175.4-172.169.6000111.7K2 G8 F9 L10K2-L6 WeakPolarHBondContact O-CB 3.09Å; K2-L6 PolarHBondContact O-N 2.98Å; L6-G8 PolarHBondContact O-N 2.81Å; L6-F9 PolarHBondContact O-N 2.61Å; L6-L10 WeakPolarHBondContact O-CB 3.25Å; L6-L10 PolarHBondContact O-N 2.84Å
7Q76.8Confident82.4Confident114 Ų114106.1 Ų106.153%0.53351%0.508SS..Hα-helixtrans-59.8-45.5175.3-78.4172-31.800112R3 R4 F9 L10 S11R3-Q7 WeakPolarHBondContact O-CB 3.31Å; R3-Q7 VanDerWaalsContact O-CG 3.27Å; R3-Q7 WeakPolarHBondContact O-CG 3.42Å; R3-Q7 PolarHBondContact O-N 3.49Å; R4-Q7 PolarHBondContact O-N 2.99Å; Q7-F9 VanDerWaalsContact C-N 3.31Å; Q7-F9 PolarHBondContact O-N 2.85Å; Q7-L10 PolarHBondContact O-N 3.38Å; Q7-S11 PolarHBondContact O-N 3.31Å; Q7-S11 PolarHBondContact O-OG 3.23Å
8G82.6Confident83.3Confident28 Ų28103.3 Ų103.329%0.28951%0.506SS..Hα-helixtrans-65.3-31.5176.400000113.4R4 L6 S11 E12R4-G8 PolarHBondContact O-N 3.31Å; L6-G8 PolarHBondContact O-N 2.81Å; G8-S11 WeakPolarHBondContact CA-OG 3.3Å; G8-S11 PolarHBondContact O-OG 3.35Å; G8-E12 VanDerWaalsContact O-CG 3.28Å; G8-E12 WeakPolarHBondContact O-CG 3.38Å; G8-E12 PolarHBondContact O-N 3.33Å
9F82.4Confident84.1Confident72 Ų7299.6 Ų99.632%0.31649%0.488SS..Hα-helixtrans-73.8-38174-174.5-122.2000112.5L5 L6 Q7 S11 E12 I13 L90L5-F9 PolarHBondContact O-N 3.38Å; L5-F9 VanDerWaalsContact O-N 3.08Å; L6-F9 PolarHBondContact O-N 2.61Å; Q7-F9 VanDerWaalsContact C-N 3.31Å; Q7-F9 PolarHBondContact O-N 2.85Å; F9-S11 VanDerWaalsContact C-N 3.34Å; F9-E12 WeakPolarHBondContact O-CB 3.22Å; F9-E12 PolarHBondContact O-N 3.31Å; F9-I13 HydrophobicContact CD1-CD1 3.88Å; F9-I13 HydrophobicContact CE1-CD1 3.44Å; F9-I13 VanDerWaalsContact CE1-CD1 3.44Å; F9-I13 HydrophobicContact CE1-CG1 4.5Å; F9-I13 HydrophobicContact CE2-CD1 4.19Å; F9-I13 HydrophobicContact CE2-CG1 4.45Å; F9-I13 HydrophobicContact CG-CD1 4.43Å; F9-I13 HydrophobicContact CZ-CD1 3.63Å; F9-I13 HydrophobicContact CZ-CG1 4.33Å; F9-I13 PolarHBondContact O-N 2.99Å; F9-I13 VanDerWaalsContact O-N 3.14Å; F9-L90 HydrophobicContact CE2-CD2 4.35Å
10L88.8Confident84.7Confident110 Ų11098 Ų9858%0.57648%0.482SS*.Hα-helixtrans-65.5-38.4177.3-167.869.4000111.5L6 Q7 I13 S14L6-L10 WeakPolarHBondContact O-CB 3.25Å; L6-L10 PolarHBondContact O-N 2.84Å; Q7-L10 PolarHBondContact O-N 3.38Å; L10-I13 PolarHBondContact O-N 3.24Å; L10-S14 WeakPolarHBondContact O-CB 3.35Å; L10-S14 PolarHBondContact O-N 2.93Å; L10-S14 PolarHBondContact O-OG 2.98Å
11S90.6Very high85.4Confident54 Ų54100 Ų10038%0.37849%0.488SS..Hα-helixtrans-63.1-41.8174.6570000112.1Q7 G8 F9 I13 S14 I15Q7-S11 PolarHBondContact O-N 3.31Å; Q7-S11 PolarHBondContact O-OG 3.23Å; G8-S11 WeakPolarHBondContact CA-OG 3.3Å; G8-S11 PolarHBondContact O-OG 3.35Å; F9-S11 VanDerWaalsContact C-N 3.34Å; S11-I13 PolarHBondContact O-N 2.77Å; S11-S14 PolarHBondContact O-N 3.37Å; S11-I15 WeakPolarHBondContact O-CG1 3.47Å; S11-I15 PolarHBondContact O-N 2.73Å
12E92Very high87.2Confident45 Ų4593.3 Ų93.321%0.2146%0.458CS..Hα-helixtrans-58.5-47.7175.5-72.8-69.4150.300111.7G8 F9 R16 L90G8-E12 VanDerWaalsContact O-CG 3.28Å; G8-E12 WeakPolarHBondContact O-CG 3.38Å; G8-E12 PolarHBondContact O-N 3.33Å; F9-E12 WeakPolarHBondContact O-CB 3.22Å; F9-E12 PolarHBondContact O-N 3.31Å; E12-R16 PolarHBondContact O-N 3.23Å; E12-R16 PolarHBondContact O-NH1 3.4Å; E12-R16 IonicContact OE2-CZ 3.12Å; E12-R16 VanDerWaalsContact OE2-CZ 3.31Å; E12-R16 IonicContact OE2-NH1 3.86Å; E12-R16 PolarHBondContact OE2-NH1 3.35Å; E12-R16 IonicContact OE2-NH2 3.75Å; E12-R16 PolarHBondContact OE2-NH2 3.18Å; E12-L90 HydrophobicContact CB-CD2 4.29Å
13I92.1Very high88.7Confident55 Ų5585.5 Ų85.528%0.28242%0.424SS..Hα-helixtrans-63.4-44.7178.2-70170.7000110.8F9 L10 S11 I15 R16 F17F9-I13 HydrophobicContact CD1-CD1 3.88Å; F9-I13 HydrophobicContact CE1-CD1 3.44Å; F9-I13 VanDerWaalsContact CE1-CD1 3.44Å; F9-I13 HydrophobicContact CE1-CG1 4.5Å; F9-I13 HydrophobicContact CE2-CD1 4.19Å; F9-I13 HydrophobicContact CE2-CG1 4.45Å; F9-I13 HydrophobicContact CG-CD1 4.43Å; F9-I13 HydrophobicContact CZ-CD1 3.63Å; F9-I13 HydrophobicContact CZ-CG1 4.33Å; F9-I13 PolarHBondContact O-N 2.99Å; F9-I13 VanDerWaalsContact O-N 3.14Å; L10-I13 PolarHBondContact O-N 3.24Å; S11-I13 PolarHBondContact O-N 2.77Å; I13-I15 PolarHBondContact O-N 3.19Å; I13-R16 PolarHBondContact O-N 3.49Å; I13-F17 HydrophobicContact CG2-CD2 3.52Å; I13-F17 HydrophobicContact CG2-CE2 3.36Å; I13-F17 WeakPolarHBondContact O-CD2 3.44Å; I13-F17 PolarHBondContact O-N 3.28Å
14S94.3Very high90Very high62 Ų6280.4 Ų80.443%0.43441%0.412SS..Hα-helixtrans-62-43.1-177.3-56.60000112L10 S11 R16 F17 A18L10-S14 WeakPolarHBondContact O-CB 3.35Å; L10-S14 PolarHBondContact O-N 2.93Å; L10-S14 PolarHBondContact O-OG 2.98Å; S11-S14 PolarHBondContact O-N 3.37Å; S14-R16 VanDerWaalsContact C-N 3.32Å; S14-R16 PolarHBondContact O-N 3.44Å; S14-F17 PolarHBondContact O-N 2.97Å; S14-A18 WeakPolarHBondContact O-CB 2.68Å; S14-A18 PolarHBondContact O-N 3.23Å
15I95.6Very high91.4Very high91 Ų9173.5 Ų73.547%0.46739%0.393SS..Hα-helixtrans-61.3-41176.9-69.9166.8000110.9S11 I13 A18 L19S11-I15 WeakPolarHBondContact O-CG1 3.47Å; S11-I15 PolarHBondContact O-N 2.73Å; I13-I15 PolarHBondContact O-N 3.19Å; I15-A18 PolarHBondContact O-N 3.08Å; I15-L19 HydrophobicContact CG2-CD1 3.89Å; I15-L19 HydrophobicContact CG2-CG 4.35Å; I15-L19 WeakPolarHBondContact O-CB 3.25Å; I15-L19 VanDerWaalsContact O-CG 3.31Å; I15-L19 WeakPolarHBondContact O-CG 3.42Å; I15-L19 PolarHBondContact O-N 3.5Å
16R95.9Very high92.6Very high23 Ų2369.9 Ų69.99%0.08737%0.374CS..Hα-helixtrans-66.6-41.6179.3-73.5167.3-178.370.2-1112.3E12 I13 S14 L19 L20 L90 T93E12-R16 PolarHBondContact O-N 3.23Å; E12-R16 PolarHBondContact O-NH1 3.4Å; E12-R16 IonicContact OE2-CZ 3.12Å; E12-R16 VanDerWaalsContact OE2-CZ 3.31Å; E12-R16 IonicContact OE2-NH1 3.86Å; E12-R16 PolarHBondContact OE2-NH1 3.35Å; E12-R16 IonicContact OE2-NH2 3.75Å; E12-R16 PolarHBondContact OE2-NH2 3.18Å; I13-R16 PolarHBondContact O-N 3.49Å; S14-R16 VanDerWaalsContact C-N 3.32Å; S14-R16 PolarHBondContact O-N 3.44Å; R16-L19 PolarHBondContact O-N 3Å; R16-L20 VanDerWaalsContact O-CB 3.31Å; R16-L20 WeakPolarHBondContact O-CB 3.36Å; R16-L20 PolarHBondContact O-N 3.38Å; R16-L90 PolarHBondContact NE-O 2.93Å; R16-L90 PolarHBondContact NH2-O 3.27Å; R16-T93 WeakPolarHBondContact CD-OG1 3.39Å; R16-T93 PolarHBondContact NE-OG1 3.47Å
17F96.6Very high93.5Very high137 Ų13767 Ų6760%0.60136%0.357SS*.Hα-helixtrans-65.1-40.3174.3-79.6-63.3000112.1I13 S14 L20 F21I13-F17 HydrophobicContact CG2-CD2 3.52Å; I13-F17 HydrophobicContact CG2-CE2 3.36Å; I13-F17 WeakPolarHBondContact O-CD2 3.44Å; I13-F17 PolarHBondContact O-N 3.28Å; S14-F17 PolarHBondContact O-N 2.97Å; F17-L20 PolarHBondContact O-N 3.42Å; F17-F21 WeakPolarHBondContact O-CB 3.27Å; F17-F21 PolarHBondContact O-N 2.91Å
18A97.9Very high94.4Very high56 Ų5669 Ų6946%0.46337%0.367SS..Hα-helixtrans-61.9-46.1174.800000111.7S14 I15 F21 V22S14-A18 WeakPolarHBondContact O-CB 2.68Å; S14-A18 PolarHBondContact O-N 3.23Å; I15-A18 PolarHBondContact O-N 3.08Å; A18-F21 WeakPolarHBondContact O-CB 2.88Å; A18-F21 PolarHBondContact O-N 3.35Å; A18-V22 WeakPolarHBondContact O-CG2 3.46Å; A18-V22 PolarHBondContact O-N 2.82Å
19L98.1Very high95Very high33 Ų3371.4 Ų71.417%0.17337%0.372CS..Hα-helixtrans-64-40.7176.2-71.1171.8000112.2I15 R16 F21 V22 F23 L94 V97 L98 V101I15-L19 HydrophobicContact CG2-CD1 3.89Å; I15-L19 HydrophobicContact CG2-CG 4.35Å; I15-L19 WeakPolarHBondContact O-CB 3.25Å; I15-L19 VanDerWaalsContact O-CG 3.31Å; I15-L19 WeakPolarHBondContact O-CG 3.42Å; I15-L19 PolarHBondContact O-N 3.5Å; R16-L19 PolarHBondContact O-N 3Å; L19-F21 VanDerWaalsContact C-N 3.33Å; L19-F21 PolarHBondContact O-N 3.4Å; L19-V22 PolarHBondContact O-N 3.29Å; L19-F23 WeakPolarHBondContact O-CB 3.28Å; L19-F23 PolarHBondContact O-N 3.01Å; L19-L94 HydrophobicContact CD1-CD1 4.01Å; L19-V97 HydrophobicContact CB-CB 4.05Å; L19-V97 HydrophobicContact CB-CG2 3.79Å; L19-V97 HydrophobicContact CD1-CG2 3.87Å; L19-L98 HydrophobicContact CD1-CD1 4.28Å; L19-L98 HydrophobicContact CD2-CD1 4.33Å; L19-V101 HydrophobicContact CB-CG2 4.39Å; L19-V101 HydrophobicContact CD2-CG2 4.23Å; L19-V101 VanDerWaalsContact O-CG2 3.24Å; L19-V101 WeakPolarHBondContact O-CG2 3.01Å
20L97.8Very high95.7Very high68 Ų6871.4 Ų71.436%0.35638%0.38SS..Hα-helixtrans-61.9-42.8174.9179.562000111.2R16 F17 F23 L24 V97R16-L20 VanDerWaalsContact O-CB 3.31Å; R16-L20 WeakPolarHBondContact O-CB 3.36Å; R16-L20 PolarHBondContact O-N 3.38Å; F17-L20 PolarHBondContact O-N 3.42Å; L20-F23 HydrophobicContact CD1-CD1 4.17Å; L20-F23 WeakPolarHBondContact O-CB 3.24Å; L20-F23 PolarHBondContact O-N 3.1Å; L20-L24 HydrophobicContact CD1-CG 4.4Å; L20-L24 HydrophobicContact CG-CD1 4.28Å; L20-L24 VanDerWaalsContact O-CG 3.31Å; L20-L24 WeakPolarHBondContact O-CG 3.38Å; L20-L24 PolarHBondContact O-N 3.34Å; L20-V97 HydrophobicContact CB-CG1 4.31Å
21F98.1Very high96.1Very high139 Ų13966.4 Ų66.461%0.6135%0.354SS*.Hα-helixtrans-60.6-46.5175.1176.8-101.6000111.5F17 A18 L19 F23 L24 V25F17-F21 WeakPolarHBondContact O-CB 3.27Å; F17-F21 PolarHBondContact O-N 2.91Å; A18-F21 WeakPolarHBondContact O-CB 2.88Å; A18-F21 PolarHBondContact O-N 3.35Å; L19-F21 VanDerWaalsContact C-N 3.33Å; L19-F21 PolarHBondContact O-N 3.4Å; F21-F23 VanDerWaalsContact C-N 3.31Å; F21-F23 PolarHBondContact O-N 3.47Å; F21-L24 PolarHBondContact O-N 3.34Å; F21-V25 HydrophobicContact CD1-CG2 4.34Å; F21-V25 HydrophobicContact CD2-CG2 4.39Å; F21-V25 HydrophobicContact CE1-CG2 3.91Å; F21-V25 HydrophobicContact CE2-CG2 3.96Å; F21-V25 HydrophobicContact CZ-CG2 3.7Å; F21-V25 WeakPolarHBondContact O-CG2 3.37Å; F21-V25 PolarHBondContact O-N 2.88Å
22V98.4Very high96.4Very high60 Ų6069.8 Ų69.836%0.36436%0.362SS..Hα-helixtrans-59.5-42.8175.2173.50000111.2A18 L19 V25 T26 V101A18-V22 WeakPolarHBondContact O-CG2 3.46Å; A18-V22 PolarHBondContact O-N 2.82Å; L19-V22 PolarHBondContact O-N 3.29Å; V22-V25 PolarHBondContact O-N 2.71Å; V22-T26 HydrophobicContact CG1-CG2 4.13Å; V22-T26 WeakPolarHBondContact O-CB 3.34Å; V22-T26 VanDerWaalsContact O-CG2 3.26Å; V22-T26 WeakPolarHBondContact O-CG2 3.46Å; V22-T26 PolarHBondContact O-N 3.14Å; V22-T26 PolarHBondContact O-OG1 2.73Å; V22-V101 HydrophobicContact CB-CG2 4.14Å; V22-V101 HydrophobicContact CG1-CG1 3.88Å; V22-V101 HydrophobicContact CG1-CG2 3.99Å
23F98Very high96.6Very high25 Ų2573.6 Ų73.611%0.1138%0.375CS..Hα-helixtrans-58.4-49.7175.4167.1-103.3000111.8L19 L20 F21 V25 T26 E27 F60 V101 N104 F154L19-F23 WeakPolarHBondContact O-CB 3.28Å; L19-F23 PolarHBondContact O-N 3.01Å; L20-F23 HydrophobicContact CD1-CD1 4.17Å; L20-F23 WeakPolarHBondContact O-CB 3.24Å; L20-F23 PolarHBondContact O-N 3.1Å; F21-F23 VanDerWaalsContact C-N 3.31Å; F21-F23 PolarHBondContact O-N 3.47Å; F23-V25 PolarHBondContact O-N 3.3Å; F23-T26 WeakPolarHBondContact CA-OG1 3.44Å; F23-T26 PolarHBondContact O-N 3.32Å; F23-T26 PolarHBondContact O-OG1 3.33Å; F23-E27 PolarHBondContact O-N 2.98Å; F23-F60 HydrophobicContact CZ-CZ 4.23Å; F23-V101 HydrophobicContact CB-CG2 4.01Å; F23-N104 VanDerWaalsContact CD2-ND2 3.28Å; F23-N104 WeakPolarHBondContact CD2-ND2 3.08Å; F23-N104 VanDerWaalsContact CE2-ND2 3.27Å; F23-N104 WeakPolarHBondContact CE2-ND2 3.32Å; F23-N104 PolarHBondContact O-ND2 3.44Å; F23-F154 HydrophobicContact CD2-CZ 4.27Å; F23-F154 AromaticContact CE2-CE2 3.87Å; F23-F154 HydrophobicContact CE2-CE2 3.87Å; F23-F154 AromaticContact CE2-CZ 3.59Å; F23-F154 HydrophobicContact CE2-CZ 3.59Å; F23-F154 HydrophobicContact CZ-CE2 4.2Å; F23-F154 AromaticContact CZ-CZ 3.84Å; F23-F154 HydrophobicContact CZ-CZ 3.84Å
24L97.4Very high96.6Very high97 Ų9775.4 Ų75.451%0.50838%0.379SS..Hα-helixtrans-62.6-40.7-179.8-68.3173.4000112.3L20 F21L20-L24 HydrophobicContact CD1-CG 4.4Å; L20-L24 HydrophobicContact CG-CD1 4.28Å; L20-L24 VanDerWaalsContact O-CG 3.31Å; L20-L24 WeakPolarHBondContact O-CG 3.38Å; L20-L24 PolarHBondContact O-N 3.34Å; F21-L24 PolarHBondContact O-N 3.34Å
25V97.8Very high96.4Very high63 Ų6381.1 Ų81.138%0.38240%0.398SS..Hα-helixtrans-66-49.9176.2171.50000110.5F21 V22 F23 E27 Q28 L29F21-V25 HydrophobicContact CD1-CG2 4.34Å; F21-V25 HydrophobicContact CD2-CG2 4.39Å; F21-V25 HydrophobicContact CE1-CG2 3.91Å; F21-V25 HydrophobicContact CE2-CG2 3.96Å; F21-V25 HydrophobicContact CZ-CG2 3.7Å; F21-V25 WeakPolarHBondContact O-CG2 3.37Å; F21-V25 PolarHBondContact O-N 2.88Å; V22-V25 PolarHBondContact O-N 2.71Å; F23-V25 PolarHBondContact O-N 3.3Å; V25-E27 VanDerWaalsContact C-N 3.26Å; V25-E27 PolarHBondContact O-N 2.93Å; V25-Q28 PolarHBondContact O-N 3.47Å; V25-Q28 VanDerWaalsContact O-N 3.08Å; V25-L29 PolarHBondContact O-N 3.4Å
26T97.2Very high96.2Very high14 Ų1478 Ų789%0.08638%0.382CS..Hα-helixtrans-64.7-27.8-177.752.50000113.3V22 F23 Q28 L29 N104 L108V22-T26 HydrophobicContact CG1-CG2 4.13Å; V22-T26 WeakPolarHBondContact O-CB 3.34Å; V22-T26 VanDerWaalsContact O-CG2 3.26Å; V22-T26 WeakPolarHBondContact O-CG2 3.46Å; V22-T26 PolarHBondContact O-N 3.14Å; V22-T26 PolarHBondContact O-OG1 2.73Å; F23-T26 WeakPolarHBondContact CA-OG1 3.44Å; F23-T26 PolarHBondContact O-N 3.32Å; F23-T26 PolarHBondContact O-OG1 3.33Å; T26-Q28 PolarHBondContact O-N 3.43Å; T26-L29 HydrophobicContact CG2-CD1 4.48Å; T26-L29 PolarHBondContact O-N 3.15Å; T26-N104 WeakPolarHBondContact OG1-CB 3.2Å; T26-N104 PolarHBondContact OG1-ND2 3.11Å; T26-L108 HydrophobicContact CG2-CD1 4.23Å
27E95Very high95.9Very high61 Ų6183.2 Ų83.229%0.28541%0.408SS..Hα-helixtrans-60.6-36.3173.6-168.167.4-173.300111.8F23 V25 N104 K145F23-E27 PolarHBondContact O-N 2.98Å; V25-E27 VanDerWaalsContact C-N 3.26Å; V25-E27 PolarHBondContact O-N 2.93Å; E27-N104 PolarHBondContact N-ND2 2.67Å; E27-N104 VanDerWaalsContact OE2-CG 3.25Å; E27-N104 PolarHBondContact OE2-ND2 3.33Å; E27-N104 PolarHBondContact OE2-OD1 3.4Å; E27-N104 VanDerWaalsContact OE2-OD1 3.12Å; E27-K145 PolarHBondContact O-NZ 3.5Å
28Q95Very high95.4Very high157 Ų15779.3 Ų79.373%0.73440%0.401SS*.Hα-helixtrans-86.7-12.2-175.5-57.8-60.3-1800113.9V25 T26V25-Q28 PolarHBondContact O-N 3.47Å; V25-Q28 VanDerWaalsContact O-N 3.08Å; T26-Q28 PolarHBondContact O-N 3.43Å
29L96.5Very high95Very high77 Ų7783.2 Ų83.240%0.40341%0.41SS..SBendtrans-73.4146.2-177.8-66.3178.3000111.6V25 T26 L108 K145V25-L29 PolarHBondContact O-N 3.4Å; T26-L29 HydrophobicContact CG2-CD1 4.48Å; T26-L29 PolarHBondContact O-N 3.15Å; L29-L108 HydrophobicContact CB-CD1 3.87Å; L29-L108 HydrophobicContact CB-CD2 3.83Å; L29-L108 HydrophobicContact CD1-CD1 3.99Å; L29-L108 WeakPolarHBondContact O-CD2 3.24Å; L29-K145 WeakPolarHBondContact O-CE 3.46Å; L29-K145 PolarHBondContact O-NZ 3.25Å
30P96.9Very high94.7Very high73 Ų7383.8 Ų83.847%0.47441%0.411SS..PPolyproline II helixtrans-70.9140.1170.229.9-33.6000110Y33P30-Y33 HydrophobicContact CB-CE2 4.27Å
31P97.4Very high94.3Very high4 Ų481.4 Ų81.43%0.02640%0.398CS..PPolyproline II helixtrans-79.4172176.436.1-35.6000111.3Y33 L108 R144 K145P31-Y33 VanDerWaalsContact O-CD2 3.27Å; P31-Y33 WeakPolarHBondContact O-CD2 3.19Å; P31-Y33 WeakPolarHBondContact O-CE2 3.28Å; P31-Y33 PolarHBondContact O-N 3.45Å; P31-L108 CarbonylContact C-O 3.27Å; P31-L108 WeakPolarHBondContact CA-O 3.09Å; P31-L108 HydrophobicContact CB-CD2 4.29Å; P31-R144 HydrophobicContact CG-CB 3.68Å; P31-K145 HydrophobicContact CB-CG 4.17Å; P31-K145 HydrophobicContact CG-CG 3.9Å
32F97.1Very high94Very high125 Ų12583.7 Ų83.755%0.54840%0.403SS..PPolyproline II helixtrans-52.6132.4164.9174.4-109.6000110.8R34 L108 V109 G111F32-R34 HydrophobicContact CD1-CB 4.32Å; F32-R34 HydrophobicContact CE1-CB 4.19Å; F32-R34 PolarHBondContact O-N 2.9Å; F32-R34 VanDerWaalsContact O-N 3.14Å; F32-L108 WeakPolarHBondContact CB-O 3.43Å; F32-L108 PolarHBondContact N-O 2.78Å; F32-V109 WeakPolarHBondContact CB-O 3.33Å; F32-G111 WeakPolarHBondContact O-CA 3.48Å
33Y94.5Very high93.8Very high126 Ų12683 Ų8349%0.49440%0.397SS..  trans-86.588.2179.8-73.3-104.6000109.4P30 P31 E35P30-Y33 HydrophobicContact CB-CE2 4.27Å; P31-Y33 VanDerWaalsContact O-CD2 3.27Å; P31-Y33 WeakPolarHBondContact O-CD2 3.19Å; P31-Y33 WeakPolarHBondContact O-CE2 3.28Å; P31-Y33 PolarHBondContact O-N 3.45Å; Y33-E35 PolarHBondContact O-N 3.05Å
34R92Very high93.8Very high93 Ų9381.9 Ų81.935%0.35139%0.392SS..  trans-65126.9171.6-176.6170.7171.4167.5-5.6110.2F32 E40 R144F32-R34 HydrophobicContact CD1-CB 4.32Å; F32-R34 HydrophobicContact CE1-CB 4.19Å; F32-R34 PolarHBondContact O-N 2.9Å; F32-R34 VanDerWaalsContact O-N 3.14Å; R34-E40 IonicContact NH2-OE1 2.67Å; R34-R144 PolarHBondContact O-NH1 2.9Å
35E90.9Very high93.7Very high181 Ų18182.2 Ų82.285%0.84639%0.389SS*.  trans-67.7137.3170.9-67.1-177.6-179.600109.9Y33Y33-E35 PolarHBondContact O-N 3.05Å
36I91.1Very high93.5Very high26 Ų2683.3 Ų83.313%0.13339%0.389CS..  trans-115.7116.9180-55.4174.7000106.8M41 Y44 P113 F117I36-M41 HydrophobicContact CB-CE 4.19Å; I36-M41 HydrophobicContact CG2-CE 3.58Å; I36-M41 HydrophobicContact CG2-SD 4.01Å; I36-Y44 HydrophobicContact CD1-CD2 4.37Å; I36-Y44 HydrophobicContact CG2-CD2 3.81Å; I36-Y44 HydrophobicContact CG2-CE2 3.83Å; I36-P113 HydrophobicContact CD1-CB 3.94Å; I36-P113 HydrophobicContact CD1-CG 3.47Å; I36-P113 VanDerWaalsContact CD1-CG 3.47Å; I36-P113 HydrophobicContact CG1-CG 3.82Å; I36-F117 HydrophobicContact CD1-CD1 3.53Å; I36-F117 HydrophobicContact CD1-CE1 3.37Å; I36-F117 HydrophobicContact CD1-CZ 4.31Å
37Q89.2Confident93.3Very high132 Ų13287.7 Ų87.762%0.61741%0.409SS*.  trans-70.5148.5175-66-179.2-1200110.2E39 E40 M41Q37-E39 PolarHBondContact O-N 2.73Å; Q37-E40 HydrophobicContact CB-CB 4.43Å; Q37-E40 PolarHBondContact O-N 2.77Å; Q37-M41 PolarHBondContact O-N 3.12Å
38A87.2Confident93.1Very high55 Ų5589.5 Ų89.546%0.45541%0.413SS..G310 helixtrans-60.2-35.1-179.200000111.5E40 M41A38-E40 VanDerWaalsContact C-N 3.28Å; A38-E40 PolarHBondContact O-N 3.35Å; A38-M41 VanDerWaalsContact O-CB 3.3Å; A38-M41 WeakPolarHBondContact O-CB 3.36Å; A38-M41 PolarHBondContact O-N 2.72Å
39E89.4Confident93Very high139 Ų13983.3 Ų83.365%0.6539%0.386SS*.G310 helixtrans-70.8-20.6178.2-56.373.8-160.500112.8Q37 W42Q37-E39 PolarHBondContact O-N 2.73Å; E39-W42 PolarHBondContact O-NE1 3.16Å
40E91.3Very high92.5Very high45 Ų4588.2 Ų88.221%0.2141%0.407CS..G310 helixtrans-90.5-13.5175.9-162.7-175.2158.900111.7R34 Q37 A38 W42 L43 Y44R34-E40 IonicContact NH2-OE1 2.67Å; Q37-E40 HydrophobicContact CB-CB 4.43Å; Q37-E40 PolarHBondContact O-N 2.77Å; A38-E40 VanDerWaalsContact C-N 3.28Å; A38-E40 PolarHBondContact O-N 3.35Å; E40-W42 PolarHBondContact O-N 2.74Å; E40-L43 HydrophobicContact CG-CD2 4.45Å; E40-L43 VanDerWaalsContact O-CB 3.28Å; E40-L43 WeakPolarHBondContact O-CB 3.46Å; E40-L43 PolarHBondContact O-N 2.77Å; E40-Y44 HydrophobicContact CG-CE2 3.88Å; E40-Y44 WeakPolarHBondContact OE1-CE2 3.41Å; E40-Y44 PolarHBondContact OE1-OH 2.95Å
41M90Very high92.2Very high17 Ų1789.5 Ų89.58%0.08442%0.417CS..G310 helixtrans-59.8-28.4-169.9-163.666.562.300113.7I36 Q37 A38 L43 Y44 K45 F118 M127I36-M41 HydrophobicContact CB-CE 4.19Å; I36-M41 HydrophobicContact CG2-CE 3.58Å; I36-M41 HydrophobicContact CG2-SD 4.01Å; Q37-M41 PolarHBondContact O-N 3.12Å; A38-M41 VanDerWaalsContact O-CB 3.3Å; A38-M41 WeakPolarHBondContact O-CB 3.36Å; A38-M41 PolarHBondContact O-N 2.72Å; M41-L43 PolarHBondContact O-N 3.39Å; M41-Y44 PolarHBondContact O-N 2.8Å; M41-K45 PolarHBondContact O-N 2.97Å; M41-F118 HydrophobicContact CG-CD2 3.67Å; M41-F118 HydrophobicContact CG-CE2 4.23Å; M41-F118 HydrophobicContact SD-CD2 3.92Å; M41-M127 HydrophobicContact CB-CE 4.19Å; M41-M127 HydrophobicContact CE-CE 3.88Å; M41-M127 HydrophobicContact CG-CE 3.55Å; M41-M127 HydrophobicContact SD-CE 4.27Å
42W92Very high92Very high188 Ų18891 Ų9171%0.71243%0.425SS*.G310 helixtrans-58.8-29.7176.969.9-92.1000112.6E39 E40 Y44 K45E39-W42 PolarHBondContact O-NE1 3.16Å; E40-W42 PolarHBondContact O-N 2.74Å; W42-Y44 PolarHBondContact O-N 3.28Å; W42-K45 PolarHBondContact O-N 2.95Å
43L94.9Very high92Very high44 Ų4491.4 Ų91.423%0.2343%0.428CS..G310 helixtrans-65.8-25.8178.2-176.462.1000112.2E40 M41E40-L43 HydrophobicContact CG-CD2 4.45Å; E40-L43 VanDerWaalsContact O-CB 3.28Å; E40-L43 WeakPolarHBondContact O-CB 3.46Å; E40-L43 PolarHBondContact O-N 2.77Å; M41-L43 PolarHBondContact O-N 3.39Å
44Y96.1Very high92.1Very high2 Ų286.3 Ų86.31%0.00841%0.41CS..G310 helixtrans-107.312.2-174.5-54.1-58.6000113I36 E40 M41 W42 P113 R114 P115 F117 F118 H208I36-Y44 HydrophobicContact CD1-CD2 4.37Å; I36-Y44 HydrophobicContact CG2-CD2 3.81Å; I36-Y44 HydrophobicContact CG2-CE2 3.83Å; E40-Y44 HydrophobicContact CG-CE2 3.88Å; E40-Y44 WeakPolarHBondContact OE1-CE2 3.41Å; E40-Y44 PolarHBondContact OE1-OH 2.95Å; M41-Y44 PolarHBondContact O-N 2.8Å; W42-Y44 PolarHBondContact O-N 3.28Å; Y44-P113 HydrophobicContact CD1-CB 3.81Å; Y44-P113 HydrophobicContact CE1-CB 3.69Å; Y44-P113 HydrophobicContact CE1-CG 4.12Å; Y44-P113 WeakPolarHBondContact CE1-O 3.23Å; Y44-P113 HydrophobicContact CE2-CB 4.44Å; Y44-P113 HydrophobicContact CE2-CG 4.31Å; Y44-P113 HydrophobicContact CG-CB 4.21Å; Y44-R114 VanDerWaalsContact CD1-O 3.28Å; Y44-R114 WeakPolarHBondContact CD1-O 3.36Å; Y44-P115 CarbonylContact C-O 3.58Å; Y44-P115 VanDerWaalsContact CA-O 3.24Å; Y44-P115 WeakPolarHBondContact CA-O 3.36Å; Y44-F117 PolarHBondContact O-N 3.2Å; Y44-F118 WeakPolarHBondContact O-CB 3.25Å; Y44-F118 PolarHBondContact O-N 3.38Å; Y44-H208 AromaticContact CE1-CE1 3.93Å; Y44-H208 AromaticContact CE1-NE2 4Å
45K95.4Very high92.3Very high104 Ų10484.6 Ų84.645%0.45241%0.411SS..  trans-102.723-173.4-156.1171.8-177178.70113.7M41 W42 P115 F118 Y119M41-K45 PolarHBondContact O-N 2.97Å; W42-K45 PolarHBondContact O-N 2.95Å; K45-P115 PolarHBondContact N-O 2.94Å; K45-F118 HydrophobicContact CB-CB 4.26Å; K45-F118 HydrophobicContact CB-CG 4.41Å; K45-F118 HydrophobicContact CD-CD1 4.27Å; K45-F118 HydrophobicContact CD-CE1 4.32Å; K45-F118 HydrophobicContact CD-CG 4.44Å; K45-F118 HydrophobicContact CG-CB 4.22Å; K45-F118 HydrophobicContact CG-CD1 3.71Å; K45-F118 HydrophobicContact CG-CE1 4.21Å; K45-F118 HydrophobicContact CG-CG 3.89Å; K45-Y119 HydrophobicContact CG-CE2 4.19Å; K45-Y119 WeakPolarHBondContact O-CE2 3.31Å
46F95.3Very high92.5Very high86 Ų8678.7 Ų78.738%0.37739%0.387SS..SBendtrans-69.2146.5170.4-72-86.7000110.5P115 Y119 Y205F46-P115 HydrophobicContact CB-CB 4.48Å; F46-P115 WeakPolarHBondContact CB-O 3.27Å; F46-P115 HydrophobicContact CD2-CB 3.7Å; F46-P115 HydrophobicContact CE2-CB 4.36Å; F46-P115 HydrophobicContact CG-CB 4.37Å; F46-P115 PolarHBondContact N-O 2.91Å; F46-Y119 WeakPolarHBondContact O-CD2 3.26Å; F46-Y205 HydrophobicContact CB-CD1 3.87Å; F46-Y205 HydrophobicContact CB-CD2 4.5Å; F46-Y205 HydrophobicContact CB-CG 3.76Å; F46-Y205 AromaticContact CD1-CD1 3.28Å; F46-Y205 HydrophobicContact CD1-CD1 3.28Å; F46-Y205 AromaticContact CD1-CE1 3.4Å; F46-Y205 HydrophobicContact CD1-CE1 3.4Å; F46-Y205 HydrophobicContact CD1-CG 4.01Å; F46-Y205 HydrophobicContact CD2-CD1 4.46Å; F46-Y205 AromaticContact CE1-CD1 3.9Å; F46-Y205 HydrophobicContact CE1-CD1 3.9Å; F46-Y205 AromaticContact CE1-CE1 3.74Å; F46-Y205 HydrophobicContact CE1-CE1 3.74Å; F46-Y205 AromaticContact CG-CD1 3.62Å; F46-Y205 HydrophobicContact CG-CD1 3.62Å; F46-Y205 HydrophobicContact CG-CE1 4.21Å; F46-Y205 HydrophobicContact CG-CG 4.06Å
47H91.5Very high92.8Very high106 Ų10681.9 Ų81.949%0.49141%0.41SS..PPolyproline II helixtrans-59.4143.5-179.671.878.4000110.8V49 Y205H47-V49 VanDerWaalsContact CE1-CG2 3.45Å; H47-V49 WeakPolarHBondContact CE1-CG2 3.31Å; H47-V49 PolarHBondContact O-N 3.34Å; H47-Y205 AromaticContact CD2-CE2 3.93Å; H47-Y205 AromaticContact CE1-CD2 3.9Å; H47-Y205 AromaticContact CE1-CE2 3.74Å; H47-Y205 AromaticContact NE2-CD2 3.8Å; H47-Y205 AromaticContact NE2-CE2 3.25Å; H47-Y205 VanDerWaalsContact NE2-CE2 3.25Å; H47-Y205 WeakPolarHBondContact NE2-CE2 3.43Å
48R91.5Very high93.2Very high100 Ų10079.9 Ų79.938%0.37740%0.403SS..PPolyproline II helixtrans-74.5119.3176.9-175.9177173-179.3-2.8109.4
49V91.8Very high93.7Very high26 Ų2677.4 Ų77.416%0.15838%0.382CS..PPolyproline II helixtrans-83.6125.6166.2179.10000108.4H47 S51 Y205 K206H47-V49 VanDerWaalsContact CE1-CG2 3.45Å; H47-V49 WeakPolarHBondContact CE1-CG2 3.31Å; H47-V49 PolarHBondContact O-N 3.34Å; V49-S51 WeakPolarHBondContact CG1-O 3.42Å; V49-Y205 HydrophobicContact CG2-CD2 4.17Å; V49-K206 WeakPolarHBondContact O-CE 3.47Å; V49-K206 PolarHBondContact O-NZ 3.14Å
50E86.3Confident94.1Very high181 Ų18173.8 Ų73.885%0.84636%0.364SS*.SBendtrans-86.3-36.8178.8-64.3-170.9166.500112.6
51S91.6Very high94.4Very high100 Ų10074.3 Ų74.370%0.69937%0.373SS*.SBendtrans-104.9108.6178.4-178.30000110.6V49V49-S51 WeakPolarHBondContact CG1-O 3.42Å
52D93.4Very high94.8Very high34 Ų3475.2 Ų75.218%0.18238%0.379CS..  trans-66.6138.3176.3-73.43.5000111.1V54 R201 K206D52-V54 PolarHBondContact O-N 2.88Å; D52-R201 IonicContact OD1-NH1 2.64Å; D52-R201 IonicContact OD1-NH2 3.49Å; D52-R201 IonicContact OD2-CZ 3.39Å; D52-R201 VanDerWaalsContact OD2-CZ 3.28Å; D52-R201 IonicContact OD2-NH1 3.92Å; D52-R201 PolarHBondContact OD2-NH1 3.36Å; D52-R201 IonicContact OD2-NH2 2.64Å; D52-R201 PolarHBondContact OD2-NH2 3.34Å; D52-K206 WeakPolarHBondContact OD1-CE 3.32Å
53H96.1Very high95.1Very high134 Ų13466.2 Ų66.262%0.6235%0.345SS*.SBendtrans-59.2-37.7173.8-77.581.2000112D204H53-D204 IonicContact CE1-OD1 3.63Å; H53-D204 IonicContact CG-OD1 3.58Å; H53-D204 PolarHBondContact N-OD1 3.38Å; H53-D204 PolarHBondContact N-OD2 2.95Å; H53-D204 IonicContact ND1-OD1 3.45Å; H53-D204 PolarHBondContact ND1-OD1 3.05Å
54V96.9Very high95.2Very high19 Ų1966.9 Ų66.912%0.11535%0.351CS..SBendtrans-124.4100.7172-176.40000108.9D52 L58 M59 I197D52-V54 PolarHBondContact O-N 2.88Å; V54-L58 HydrophobicContact CG1-CD2 4.29Å; V54-L58 HydrophobicContact CG1-CG 4.4Å; V54-M59 HydrophobicContact CG1-CB 4.14Å; V54-I197 HydrophobicContact CG1-CG1 4.29Å; V54-I197 HydrophobicContact CG1-CG2 4.12Å; V54-I197 HydrophobicContact CG2-CG1 4.44Å
55P96.8Very high95.3Very high58 Ų5871.1 Ų71.138%0.37737%0.373SS..  trans-61.2148.8177.4-25.235000112.5L58 M59P55-L58 WeakPolarHBondContact O-CB 3.23Å; P55-L58 PolarHBondContact O-N 3.43Å; P55-M59 PolarHBondContact O-N 3.2Å
56T95.8Very high95.4Very high56 Ų5668 Ų6834%0.34436%0.363SS..Hα-helixtrans-54.3-43.4179.4-54.80000114L58 M59 F60 H151T56-L58 VanDerWaalsContact C-N 3.31Å; T56-L58 PolarHBondContact O-N 3.38Å; T56-M59 HydrophobicContact CG2-CE 4.32Å; T56-M59 PolarHBondContact O-N 3.36Å; T56-F60 HydrophobicContact CG2-CD2 3.66Å; T56-F60 HydrophobicContact CG2-CE2 3.53Å; T56-F60 WeakPolarHBondContact O-CD2 3.24Å; T56-F60 PolarHBondContact O-N 3.42Å; T56-H151 PolarHBondContact OG1-CE1 3.07Å; T56-H151 PolarHBondContact OG1-NE2 2.86Å
57P97.1Very high95.5Very high93 Ų9364 Ų6460%0.60435%0.346SS*.Hα-helixtrans-61.7-38176.1-23.935.2000113.1S61P57-S61 VanDerWaalsContact O-CB 3.29Å; P57-S61 WeakPolarHBondContact O-CB 3.31Å; P57-S61 PolarHBondContact O-N 3.23Å; P57-S61 PolarHBondContact O-OG 2.89Å
58L97.6Very high95.7Very high90 Ų9062 Ų6247%0.47134%0.338SS..Hα-helixtrans-66.4-45.3177178.859.8000110.6V54 P55 T56 F60 S61 V62V54-L58 HydrophobicContact CG1-CD2 4.29Å; V54-L58 HydrophobicContact CG1-CG 4.4Å; P55-L58 WeakPolarHBondContact O-CB 3.23Å; P55-L58 PolarHBondContact O-N 3.43Å; T56-L58 VanDerWaalsContact C-N 3.31Å; T56-L58 PolarHBondContact O-N 3.38Å; L58-F60 PolarHBondContact O-N 2.93Å; L58-S61 PolarHBondContact O-N 2.93Å; L58-V62 HydrophobicContact CD1-CG2 4.13Å; L58-V62 WeakPolarHBondContact O-CG2 3.39Å; L58-V62 PolarHBondContact O-N 3.11Å
59M97.6Very high96Very high3 Ų362 Ų622%0.01534%0.344CS..Hα-helixtrans-57.1-49.9176.5179.2-78.1-61.500111.5V54 P55 T56 S61 V62 A63 H151 F154 I197V54-M59 HydrophobicContact CG1-CB 4.14Å; P55-M59 PolarHBondContact O-N 3.2Å; T56-M59 HydrophobicContact CG2-CE 4.32Å; T56-M59 PolarHBondContact O-N 3.36Å; M59-S61 PolarHBondContact O-N 3.14Å; M59-V62 PolarHBondContact O-N 2.96Å; M59-A63 WeakPolarHBondContact O-CB 3.38Å; M59-A63 PolarHBondContact O-N 2.79Å; M59-H151 HydrophobicContact CG-CB 4.29Å; M59-F154 HydrophobicContact CE-CB 4.12Å; M59-F154 HydrophobicContact SD-CB 3.46Å; M59-F154 WeakPolarHBondContact SD-CB 3.14Å; M59-F154 HydrophobicContact SD-CG 4.45Å; M59-I197 HydrophobicContact CB-CG2 4.42Å; M59-I197 HydrophobicContact CG-CG2 3.85Å
60F97.4Very high96.3Very high64 Ų6462.6 Ų62.628%0.28135%0.347SS..Hα-helixtrans-63-41.2177-83.1-65.1000112.3F23 T56 L58 V62 A63 V64 F154F23-F60 HydrophobicContact CZ-CZ 4.23Å; T56-F60 HydrophobicContact CG2-CD2 3.66Å; T56-F60 HydrophobicContact CG2-CE2 3.53Å; T56-F60 WeakPolarHBondContact O-CD2 3.24Å; T56-F60 PolarHBondContact O-N 3.42Å; L58-F60 PolarHBondContact O-N 2.93Å; F60-V62 PolarHBondContact O-N 2.87Å; F60-A63 PolarHBondContact O-N 3.36Å; F60-V64 WeakPolarHBondContact O-CB 3.28Å; F60-V64 VanDerWaalsContact O-CG2 3.29Å; F60-V64 WeakPolarHBondContact O-CG2 3.36Å; F60-V64 PolarHBondContact O-N 3.19Å; F60-F154 HydrophobicContact CD1-CD1 4.31Å; F60-F154 HydrophobicContact CD1-CG 4.46Å; F60-F154 AromaticContact CE1-CD1 3.73Å; F60-F154 HydrophobicContact CE1-CD1 3.73Å; F60-F154 AromaticContact CE1-CD2 3.87Å; F60-F154 HydrophobicContact CE1-CD2 3.87Å; F60-F154 AromaticContact CE1-CE1 3.73Å; F60-F154 HydrophobicContact CE1-CE1 3.73Å; F60-F154 AromaticContact CE1-CE2 3.87Å; F60-F154 HydrophobicContact CE1-CE2 3.87Å; F60-F154 AromaticContact CE1-CG 3.8Å; F60-F154 HydrophobicContact CE1-CG 3.8Å; F60-F154 AromaticContact CE1-CZ 3.78Å; F60-F154 HydrophobicContact CE1-CZ 3.78Å; F60-F154 HydrophobicContact CZ-CD2 4.09Å; F60-F154 AromaticContact CZ-CE2 3.98Å; F60-F154 HydrophobicContact CZ-CE2 3.98Å; F60-F154 HydrophobicContact CZ-CG 4.44Å; F60-F154 HydrophobicContact CZ-CZ 4.24Å
61S97.7Very high96.8Very high56 Ų5654.1 Ų54.139%0.39231%0.307SS..Hα-helixtrans-59.3-46.6176.8-61.10000111.2P57 L58 M59 L65P57-S61 VanDerWaalsContact O-CB 3.29Å; P57-S61 WeakPolarHBondContact O-CB 3.31Å; P57-S61 PolarHBondContact O-N 3.23Å; P57-S61 PolarHBondContact O-OG 2.89Å; L58-S61 PolarHBondContact O-N 2.93Å; M59-S61 PolarHBondContact O-N 3.14Å; S61-L65 WeakPolarHBondContact O-CB 3.47Å; S61-L65 VanDerWaalsContact O-CG 3.22Å; S61-L65 WeakPolarHBondContact O-CG 3Å; S61-L65 PolarHBondContact O-N 3.21Å
62V97.8Very high97Very high35 Ų3552.5 Ų52.521%0.21229%0.293CS..Hα-helixtrans-64.7-45.5177.3172.30000111.1L58 M59 F60 V64 T66 L159 I193 I197L58-V62 HydrophobicContact CD1-CG2 4.13Å; L58-V62 WeakPolarHBondContact O-CG2 3.39Å; L58-V62 PolarHBondContact O-N 3.11Å; M59-V62 PolarHBondContact O-N 2.96Å; F60-V62 PolarHBondContact O-N 2.87Å; V62-V64 VanDerWaalsContact C-N 3.34Å; V62-V64 PolarHBondContact O-N 3.41Å; V62-T66 WeakPolarHBondContact O-CB 3.48Å; V62-T66 PolarHBondContact O-N 2.91Å; V62-T66 PolarHBondContact O-OG1 2.7Å; V62-L159 HydrophobicContact CG1-CD1 3.99Å; V62-L159 HydrophobicContact CG1-CD2 4.06Å; V62-L159 HydrophobicContact CG1-CG 4.36Å; V62-I193 HydrophobicContact CG1-CG2 4.44Å; V62-I197 HydrophobicContact CB-CD1 4.45Å; V62-I197 HydrophobicContact CG1-CD1 4.02Å
63A98Very high97.1Very high0 Ų053.8 Ų53.80%030%0.302CS..Hα-helixtrans-65-34.1-17800000113.3M59 F60 P67 L96 F154 G158M59-A63 WeakPolarHBondContact O-CB 3.38Å; M59-A63 PolarHBondContact O-N 2.79Å; F60-A63 PolarHBondContact O-N 3.36Å; A63-P67 VanDerWaalsContact O-CD 3.25Å; A63-P67 WeakPolarHBondContact O-CD 3.22Å; A63-P67 VanDerWaalsContact O-CG 3.26Å; A63-P67 WeakPolarHBondContact O-CG 3.4Å; A63-L96 HydrophobicContact CB-CD2 4.44Å; A63-F154 WeakPolarHBondContact CB-O 3.34Å; A63-G158 WeakPolarHBondContact O-CA 3.49Å
64V97.4Very high97Very high57 Ų5748.4 Ų48.435%0.34528%0.276SS..Hα-helixtrans-89.1-49.7-179.4176.40000111.9F60 V62 P67 L68 L96F60-V64 WeakPolarHBondContact O-CB 3.28Å; F60-V64 VanDerWaalsContact O-CG2 3.29Å; F60-V64 WeakPolarHBondContact O-CG2 3.36Å; F60-V64 PolarHBondContact O-N 3.19Å; V62-V64 VanDerWaalsContact C-N 3.34Å; V62-V64 PolarHBondContact O-N 3.41Å; V64-P67 WeakPolarHBondContact O-CD 3.42Å; V64-P67 WeakPolarHBondContact O-CG 3.36Å; V64-L68 HydrophobicContact CG1-CD1 4.01Å; V64-L68 VanDerWaalsContact O-CG 3.29Å; V64-L68 WeakPolarHBondContact O-CG 3.37Å; V64-L96 HydrophobicContact CG2-CD1 3.99Å
65L97.4Very high96.7Very high91 Ų9150.3 Ų50.348%0.47629%0.286SS..Hα-helixtrans-75.5-38.2-170.3-60.2177.9000112.3S61 L68 I69S61-L65 WeakPolarHBondContact O-CB 3.47Å; S61-L65 VanDerWaalsContact O-CG 3.22Å; S61-L65 WeakPolarHBondContact O-CG 3Å; S61-L65 PolarHBondContact O-N 3.21Å; L65-L68 PolarHBondContact O-N 3.33Å; L65-I69 HydrophobicContact CB-CD1 4.19Å; L65-I69 WeakPolarHBondContact O-CB 3.34Å; L65-I69 VanDerWaalsContact O-CG1 3.24Å; L65-I69 WeakPolarHBondContact O-CG1 3.24Å; L65-I69 PolarHBondContact O-N 3.43Å
66T97.8Very high96.5Very high40 Ų4053.7 Ų53.725%0.24530%0.3CS..Hα-helixtrans-55.8-53.6-178.7-52.10000112.8V62 L68 I69 I70 L159 T162V62-T66 WeakPolarHBondContact O-CB 3.48Å; V62-T66 PolarHBondContact O-N 2.91Å; V62-T66 PolarHBondContact O-OG1 2.7Å; T66-L68 VanDerWaalsContact C-N 3.33Å; T66-L68 PolarHBondContact O-N 3.43Å; T66-I69 PolarHBondContact O-N 2.81Å; T66-I70 HydrophobicContact CG2-CG1 4.43Å; T66-I70 WeakPolarHBondContact O-CB 3.49Å; T66-I70 VanDerWaalsContact O-CG1 3.29Å; T66-I70 WeakPolarHBondContact O-CG1 3.38Å; T66-I70 PolarHBondContact O-N 3.16Å; T66-L159 HydrophobicContact CG2-CD2 3.71Å; T66-T162 HydrophobicContact CG2-CG2 4.19Å
67P97.6Very high96.3Very high1 Ų156 Ų561%0.00631%0.31CS..Hα-helixtrans-62.6-39.7178.320.6-30.7000112.4A63 V64 I70 I71 V92 F161 T162A63-P67 VanDerWaalsContact O-CD 3.25Å; A63-P67 WeakPolarHBondContact O-CD 3.22Å; A63-P67 VanDerWaalsContact O-CG 3.26Å; A63-P67 WeakPolarHBondContact O-CG 3.4Å; V64-P67 WeakPolarHBondContact O-CD 3.42Å; V64-P67 WeakPolarHBondContact O-CG 3.36Å; P67-I70 PolarHBondContact O-N 3.1Å; P67-I71 WeakPolarHBondContact O-CB 3.44Å; P67-I71 WeakPolarHBondContact O-CD1 3.35Å; P67-I71 WeakPolarHBondContact O-CG1 3.39Å; P67-I71 PolarHBondContact O-N 2.64Å; P67-V92 HydrophobicContact CB-CG2 3.71Å; P67-V92 HydrophobicContact CG-CG2 3.68Å; P67-F161 HydrophobicContact CB-CD1 4.3Å; P67-T162 WeakPolarHBondContact CA-OG1 3.49Å; P67-T162 VanDerWaalsContact CB-OG1 3.31Å; P67-T162 WeakPolarHBondContact CB-OG1 3.33Å
68L96.9Very high95.5Very high63 Ų6362.6 Ų62.633%0.3332%0.323SS..Hα-helixtrans-62.6-45.6179.1-65.4177.1000111.8V64 L65 T66 I71 V72 V92V64-L68 HydrophobicContact CG1-CD1 4.01Å; V64-L68 VanDerWaalsContact O-CG 3.29Å; V64-L68 WeakPolarHBondContact O-CG 3.37Å; L65-L68 PolarHBondContact O-N 3.33Å; T66-L68 VanDerWaalsContact C-N 3.33Å; T66-L68 PolarHBondContact O-N 3.43Å; L68-I71 PolarHBondContact O-N 3.09Å; L68-V72 VanDerWaalsContact O-CG2 3.31Å; L68-V72 WeakPolarHBondContact O-CG2 3.23Å; L68-V72 PolarHBondContact O-N 2.75Å; L68-V92 HydrophobicContact CD2-CG1 4.32Å
69I97.3Very high94.7Very high100 Ų10063.7 Ų63.751%0.51332%0.324SS..Hα-helixtrans-60.4-48.6176.3-68.9165.4000109.9L65 T66 I71 V72 V73L65-I69 HydrophobicContact CB-CD1 4.19Å; L65-I69 WeakPolarHBondContact O-CB 3.34Å; L65-I69 VanDerWaalsContact O-CG1 3.24Å; L65-I69 WeakPolarHBondContact O-CG1 3.24Å; L65-I69 PolarHBondContact O-N 3.43Å; T66-I69 PolarHBondContact O-N 2.81Å; I69-I71 PolarHBondContact O-N 2.86Å; I69-V72 PolarHBondContact O-N 2.57Å; I69-V73 HydrophobicContact CG2-CG2 4.18Å; I69-V73 WeakPolarHBondContact O-CB 3.14Å; I69-V73 VanDerWaalsContact O-CG2 3.23Å; I69-V73 WeakPolarHBondContact O-CG2 3.39Å; I69-V73 PolarHBondContact O-N 3.49Å
70I97.6Very high94Very high40 Ų4064.5 Ų64.521%0.20533%0.33CS..Hα-helixtrans-62.1-44-179.8-69.1-65.5000111.3T66 P67 V72 V73 F74 T162 Y165 I166T66-I70 HydrophobicContact CG2-CG1 4.43Å; T66-I70 WeakPolarHBondContact O-CB 3.49Å; T66-I70 VanDerWaalsContact O-CG1 3.29Å; T66-I70 WeakPolarHBondContact O-CG1 3.38Å; T66-I70 PolarHBondContact O-N 3.16Å; P67-I70 PolarHBondContact O-N 3.1Å; I70-V72 PolarHBondContact O-N 2.88Å; I70-V73 PolarHBondContact O-N 3.06Å; I70-F74 HydrophobicContact CG2-CD2 3.84Å; I70-F74 HydrophobicContact CG2-CE2 3.96Å; I70-F74 WeakPolarHBondContact O-CD2 3.44Å; I70-F74 PolarHBondContact O-N 3.46Å; I70-T162 HydrophobicContact CB-CG2 4.26Å; I70-T162 HydrophobicContact CG1-CG2 3.91Å; I70-T162 HydrophobicContact CG2-CG2 4.31Å; I70-Y165 HydrophobicContact CG2-CD1 3.92Å; I70-Y165 HydrophobicContact CG2-CE1 4.08Å; I70-I166 HydrophobicContact CD1-CD1 4.45Å; I70-I166 HydrophobicContact CG2-CD1 4.14Å; I70-I166 HydrophobicContact CG2-CG1 3.8Å
71I96.6Very high93.2Very high2 Ų264.3 Ų64.31%0.0133%0.33CS..Hα-helixtrans-58-49.5176.4-69.9163000110.4P67 L68 I69 F74 N75 L85 A88 V92 F161 Y165P67-I71 WeakPolarHBondContact O-CB 3.44Å; P67-I71 WeakPolarHBondContact O-CD1 3.35Å; P67-I71 WeakPolarHBondContact O-CG1 3.39Å; P67-I71 PolarHBondContact O-N 2.64Å; L68-I71 PolarHBondContact O-N 3.09Å; I69-I71 PolarHBondContact O-N 2.86Å; I71-F74 PolarHBondContact O-N 2.74Å; I71-N75 WeakPolarHBondContact O-CB 3.31Å; I71-N75 PolarHBondContact O-N 2.94Å; I71-L85 HydrophobicContact CG2-CD1 3.5Å; I71-L85 VanDerWaalsContact CG2-CD1 3.5Å; I71-L85 HydrophobicContact CG2-CG 4.49Å; I71-A88 HydrophobicContact CD1-CB 3.65Å; I71-A88 HydrophobicContact CG1-CB 3.79Å; I71-A88 HydrophobicContact CG2-CB 3.95Å; I71-V92 HydrophobicContact CD1-CG1 4.22Å; I71-F161 HydrophobicContact CD1-CE1 4.3Å; I71-Y165 HydrophobicContact CB-CE1 4.4Å; I71-Y165 HydrophobicContact CG1-CD1 4.21Å; I71-Y165 HydrophobicContact CG1-CE1 3.85Å; I71-Y165 HydrophobicContact CG1-CE2 4.3Å
72V95.5Very high92.3Very high66 Ų6670.5 Ų70.540%0.435%0.352SS..Hα-helixtrans-62.3-45.1179.1170.90000111.1L68 I69 I70 F74 N75 L76 L85L68-V72 VanDerWaalsContact O-CG2 3.31Å; L68-V72 WeakPolarHBondContact O-CG2 3.23Å; L68-V72 PolarHBondContact O-N 2.75Å; I69-V72 PolarHBondContact O-N 2.57Å; I70-V72 PolarHBondContact O-N 2.88Å; V72-F74 PolarHBondContact O-N 3.48Å; V72-N75 WeakPolarHBondContact O-CB 3.34Å; V72-N75 PolarHBondContact O-N 3.49Å; V72-N75 VanDerWaalsContact O-N 3.17Å; V72-L76 HydrophobicContact CG1-CD1 3.81Å; V72-L76 HydrophobicContact CG1-CG 4.11Å; V72-L76 WeakPolarHBondContact O-CG 3.37Å; V72-L76 PolarHBondContact O-N 2.94Å; V72-L85 HydrophobicContact CG2-CD1 4.12Å
73V95.7Very high91.6Very high61 Ų6170.3 Ų70.337%0.3736%0.357SS..Hα-helixtrans-59.4-47.5178.5167.50000111.2I69 I70 N75 L76 L77I69-V73 HydrophobicContact CG2-CG2 4.18Å; I69-V73 WeakPolarHBondContact O-CB 3.14Å; I69-V73 VanDerWaalsContact O-CG2 3.23Å; I69-V73 WeakPolarHBondContact O-CG2 3.39Å; I69-V73 PolarHBondContact O-N 3.49Å; I70-V73 PolarHBondContact O-N 3.06Å; V73-N75 VanDerWaalsContact C-N 3.28Å; V73-N75 PolarHBondContact O-N 2.88Å; V73-L76 PolarHBondContact O-N 3.34Å; V73-L77 HydrophobicContact CG1-CD1 3.81Å; V73-L77 HydrophobicContact CG1-CG 4.32Å; V73-L77 WeakPolarHBondContact O-CB 3.31Å; V73-L77 VanDerWaalsContact O-CG 3.26Å; V73-L77 WeakPolarHBondContact O-CG 3.43Å; V73-L77 PolarHBondContact O-N 2.99Å
74F94.4Very high91.3Very high21 Ų2170.3 Ų70.39%0.09236%0.357CS..Hα-helixtrans-62.9-35.6177.2-90.3-91000112.6I70 I71 V72 K79 Y165 I166 K169 L170I70-F74 HydrophobicContact CG2-CD2 3.84Å; I70-F74 HydrophobicContact CG2-CE2 3.96Å; I70-F74 WeakPolarHBondContact O-CD2 3.44Å; I70-F74 PolarHBondContact O-N 3.46Å; I71-F74 PolarHBondContact O-N 2.74Å; V72-F74 PolarHBondContact O-N 3.48Å; F74-K79 HydrophobicContact CD1-CB 3.76Å; F74-K79 HydrophobicContact CD1-CD 4.11Å; F74-K79 HydrophobicContact CE1-CB 4.44Å; F74-K79 HydrophobicContact CE1-CD 4.1Å; F74-K79 PolarHBondContact O-N 2.91Å; F74-Y165 HydrophobicContact CB-CE1 4.31Å; F74-Y165 HydrophobicContact CD2-CE1 4.19Å; F74-Y165 HydrophobicContact CG-CE1 4.35Å; F74-I166 HydrophobicContact CE2-CG1 4.25Å; F74-K169 HydrophobicContact CD1-CB 3.64Å; F74-K169 HydrophobicContact CD1-CD 4.36Å; F74-K169 HydrophobicContact CD1-CG 3.93Å; F74-K169 HydrophobicContact CE1-CB 3.41Å; F74-K169 VanDerWaalsContact CE1-CB 3.41Å; F74-K169 HydrophobicContact CE1-CG 4.18Å; F74-K169 HydrophobicContact CG-CB 4.41Å; F74-K169 HydrophobicContact CG-CG 4.31Å; F74-K169 HydrophobicContact CZ-CB 4.01Å; F74-L170 HydrophobicContact CE1-CD2 3.89Å; F74-L170 HydrophobicContact CE1-CG 4.41Å; F74-L170 HydrophobicContact CZ-CD2 3.9Å; F74-L170 HydrophobicContact CZ-CG 4.12Å
75N91.4Very high91.1Very high59 Ų5970.8 Ų70.832%0.31636%0.357SS..Hα-helixtrans-67.3-44.9174.8-172.973.3000112.1I71 V72 V73 R78I71-N75 WeakPolarHBondContact O-CB 3.31Å; I71-N75 PolarHBondContact O-N 2.94Å; V72-N75 WeakPolarHBondContact O-CB 3.34Å; V72-N75 PolarHBondContact O-N 3.49Å; V72-N75 VanDerWaalsContact O-N 3.17Å; V73-N75 VanDerWaalsContact C-N 3.28Å; V73-N75 PolarHBondContact O-N 2.88Å; N75-R78 PolarHBondContact O-N 3.15Å; N75-R78 VanDerWaalsContact O-N 3.14Å
76L92.2Very high90.9Very high129 Ų12970.6 Ų70.668%0.67535%0.35SS*.Hα-helixtrans-65.4-38.3178.1-70.2177.4000112.7V72 V73 R78V72-L76 HydrophobicContact CG1-CD1 3.81Å; V72-L76 HydrophobicContact CG1-CG 4.11Å; V72-L76 WeakPolarHBondContact O-CG 3.37Å; V72-L76 PolarHBondContact O-N 2.94Å; V73-L76 PolarHBondContact O-N 3.34Å; L76-R78 PolarHBondContact O-N 2.98Å; L76-R78 VanDerWaalsContact O-N 3.08Å
77L91.9Very high90.7Very high104 Ų10469.4 Ų69.455%0.54534%0.342SS..THydrogen-bonded Turntrans-725.9175.4-65.8177.5000113.5V73 K79V73-L77 HydrophobicContact CG1-CD1 3.81Å; V73-L77 HydrophobicContact CG1-CG 4.32Å; V73-L77 WeakPolarHBondContact O-CB 3.31Å; V73-L77 VanDerWaalsContact O-CG 3.26Å; V73-L77 WeakPolarHBondContact O-CG 3.43Å; V73-L77 PolarHBondContact O-N 2.99Å; L77-K79 HydrophobicContact CB-CD 4.38Å; L77-K79 HydrophobicContact CB-CG 4.13Å; L77-K79 PolarHBondContact O-N 3.47Å
78R80.7Confident90.6Very high232 Ų23269.4 Ų69.488%0.87534%0.342SS*.THydrogen-bonded Turntrans51.527.9-174.5-57.4-169.8-178.6-164.61.8113.5N75 L76N75-R78 PolarHBondContact O-N 3.15Å; N75-R78 VanDerWaalsContact O-N 3.14Å; L76-R78 PolarHBondContact O-N 2.98Å; L76-R78 VanDerWaalsContact O-N 3.08Å
79K79.6Confident90.5Very high113 Ų11368.1 Ų68.149%0.49134%0.338SS..  trans-88.17.3172.8-68.2-173.6178.1177.40111.8F74 L77F74-K79 HydrophobicContact CD1-CB 3.76Å; F74-K79 HydrophobicContact CD1-CD 4.11Å; F74-K79 HydrophobicContact CE1-CB 4.44Å; F74-K79 HydrophobicContact CE1-CD 4.1Å; F74-K79 PolarHBondContact O-N 2.91Å; L77-K79 HydrophobicContact CB-CD 4.38Å; L77-K79 HydrophobicContact CB-CG 4.13Å; L77-K79 PolarHBondContact O-N 3.47Å
80S82.1Confident90.4Very high21 Ų2164 Ų6415%0.14732%0.317CS..SBendtrans-130.4149.9-178.3-145.30000112.9D84 K169S80-D84 WeakPolarHBondContact OG-CB 3.24Å; S80-D84 PolarHBondContact OG-OD2 2.66Å; S80-K169 PolarHBondContact OG-NZ 2.91Å
81E80.8Confident90.4Very high60 Ų6062.1 Ų62.128%0.2831%0.308SS..  trans-90.4166.3-177.8-62.7-161.5154.900112.6G83 D84 R241E81-G83 PolarHBondContact O-N 3.24Å; E81-G83 VanDerWaalsContact O-N 3.11Å; E81-D84 VanDerWaalsContact O-CB 3.24Å; E81-D84 WeakPolarHBondContact O-CB 3.44Å; E81-D84 PolarHBondContact O-N 2.84Å; E81-R241 HydrophobicContact CG-CG 4.49Å; E81-R241 IonicContact OE1-CZ 2.98Å; E81-R241 IonicContact OE1-NE 3.1Å; E81-R241 PolarHBondContact OE1-NE 3.3Å; E81-R241 IonicContact OE1-NH2 2.67Å; E81-R241 PolarHBondContact OE1-NH2 3.37Å; E81-R241 WeakPolarHBondContact OE2-CD 3.37Å; E81-R241 VanDerWaalsContact OE2-CG 3.28Å; E81-R241 WeakPolarHBondContact OE2-CG 3.12Å; E81-R241 IonicContact OE2-CZ 3.31Å; E81-R241 IonicContact OE2-NE 3.87Å; E81-R241 PolarHBondContact OE2-NE 3.39Å; E81-R241 VanDerWaalsContact OE2-NE 3.12Å
82H79.3Confident90.5Very high186 Ų18662.1 Ų62.186%0.86131%0.308SS*.THydrogen-bonded Turntrans-64.5112.7-173.3-168.885.3000112.1Q245H82-Q245 PolarHBondContact O-NE2 3.23Å; H82-Q245 PolarHBondContact O-OE1 2.93Å
83G83.9Confident90.6Very high30 Ų3061.5 Ų61.531%0.30930%0.304SS..THydrogen-bonded Turntrans101.2-2.5-178.700000114.1E81 R86 E87 Q245E81-G83 PolarHBondContact O-N 3.24Å; E81-G83 VanDerWaalsContact O-N 3.11Å; G83-R86 WeakPolarHBondContact O-CB 3.45Å; G83-R86 PolarHBondContact O-N 3.19Å; G83-E87 PolarHBondContact O-N 3.28Å; G83-E87 VanDerWaalsContact O-N 3.15Å; G83-Q245 VanDerWaalsContact C-NE2 3.3Å
84D91.5Very high90.7Very high0 Ų059.3 Ų59.30%029%0.29CS..Hα-helixtrans-63.8-41.6176.9-179.184.6000113.4S80 E81 R86 E87 A88 Y165 K169 F231 P242S80-D84 WeakPolarHBondContact OG-CB 3.24Å; S80-D84 PolarHBondContact OG-OD2 2.66Å; E81-D84 VanDerWaalsContact O-CB 3.24Å; E81-D84 WeakPolarHBondContact O-CB 3.44Å; E81-D84 PolarHBondContact O-N 2.84Å; D84-R86 PolarHBondContact O-N 3.02Å; D84-E87 PolarHBondContact O-N 3.3Å; D84-E87 VanDerWaalsContact O-N 3.16Å; D84-A88 VanDerWaalsContact O-CB 3.28Å; D84-A88 WeakPolarHBondContact O-CB 3.24Å; D84-A88 PolarHBondContact O-N 2.95Å; D84-Y165 PolarHBondContact OD2-OH 3.29Å; D84-K169 WeakPolarHBondContact OD1-CE 3.36Å; D84-K169 IonicContact OD1-NZ 2.74Å; D84-K169 PolarHBondContact OD1-NZ 3.38Å; D84-K169 WeakPolarHBondContact OD2-CE 3.44Å; D84-K169 IonicContact OD2-NZ 3.35Å; D84-K169 PolarHBondContact OD2-NZ 2.95Å; D84-K169 VanDerWaalsContact OD2-NZ 3.1Å; D84-F231 VanDerWaalsContact OD1-CE1 3.24Å; D84-F231 WeakPolarHBondContact OD1-CE1 3.37Å; D84-P242 HydrophobicContact CB-CG 3.97Å; D84-P242 WeakPolarHBondContact OD1-CD 3.37Å; D84-P242 WeakPolarHBondContact OD1-CG 3.4Å
85L93.1Very high90.9Very high68 Ų6858.3 Ų58.336%0.35629%0.286SS..Hα-helixtrans-48.3-47173-176.574.2000110.6I71 V72 S89I71-L85 HydrophobicContact CG2-CD1 3.5Å; I71-L85 VanDerWaalsContact CG2-CD1 3.5Å; I71-L85 HydrophobicContact CG2-CG 4.49Å; V72-L85 HydrophobicContact CG2-CD1 4.12Å; L85-S89 VanDerWaalsContact O-CB 3.23Å; L85-S89 WeakPolarHBondContact O-CB 3.4Å; L85-S89 PolarHBondContact O-N 3.37Å; L85-S89 PolarHBondContact O-OG 3.41Å
86R92.3Very high91.2Very high86 Ų8656.5 Ų56.533%0.32528%0.276SS..Hα-helixtrans-65.6-51.6-179.5-178.6-174.2179.9-159.40.3111.5G83 D84 S89 L90G83-R86 WeakPolarHBondContact O-CB 3.45Å; G83-R86 PolarHBondContact O-N 3.19Å; D84-R86 PolarHBondContact O-N 3.02Å; R86-S89 PolarHBondContact O-N 3.09Å; R86-L90 HydrophobicContact CG-CD1 4Å; R86-L90 HydrophobicContact CG-CG 4.45Å; R86-L90 WeakPolarHBondContact O-CB 3.47Å; R86-L90 VanDerWaalsContact O-CG 3.24Å; R86-L90 WeakPolarHBondContact O-CG 3.42Å; R86-L90 PolarHBondContact O-N 3.26Å
87E93.7Very high91.5Very high16 Ų1651.5 Ų51.58%0.07525%0.251CS..Hα-helixtrans-65.6-39.3-177-62-62.5143.300111.4G83 D84 L90 A91 H230 P242 R244G83-E87 PolarHBondContact O-N 3.28Å; G83-E87 VanDerWaalsContact O-N 3.15Å; D84-E87 PolarHBondContact O-N 3.3Å; D84-E87 VanDerWaalsContact O-N 3.16Å; E87-L90 PolarHBondContact O-N 3.5Å; E87-A91 WeakPolarHBondContact O-CB 3.26Å; E87-A91 PolarHBondContact O-N 3.06Å; E87-H230 PolarHBondContact O-CD2 3.09Å; E87-H230 IonicContact OE2-CD2 2.84Å; E87-H230 PolarHBondContact OE2-CD2 3.31Å; E87-P242 HydrophobicContact CB-CB 3.99Å; E87-P242 HydrophobicContact CB-CG 4.2Å; E87-P242 HydrophobicContact CG-CB 3.93Å; E87-P242 HydrophobicContact CG-CG 4.36Å; E87-R244 IonicContact OE1-NH1 3.82Å
88A96Very high91.8Very high0 Ų048.4 Ų48.40%024%0.235CC..Hα-helixtrans-66.2-43174.700000112.3I71 D84 A91 V92 Y165 F231I71-A88 HydrophobicContact CD1-CB 3.65Å; I71-A88 HydrophobicContact CG1-CB 3.79Å; I71-A88 HydrophobicContact CG2-CB 3.95Å; D84-A88 VanDerWaalsContact O-CB 3.28Å; D84-A88 WeakPolarHBondContact O-CB 3.24Å; D84-A88 PolarHBondContact O-N 2.95Å; A88-A91 PolarHBondContact O-N 3.37Å; A88-V92 WeakPolarHBondContact O-CG1 3.41Å; A88-V92 PolarHBondContact O-N 2.97Å; A88-Y165 HydrophobicContact CB-CD2 4.16Å; A88-Y165 HydrophobicContact CB-CE2 3.68Å; A88-F231 HydrophobicContact CB-CE2 4.24Å; A88-F231 HydrophobicContact CB-CZ 3.97Å
89S95.6Very high92.6Very high37 Ų3737.4 Ų37.426%0.25919%0.193SC..Hα-helixtrans-63.6-41.3174.6-68.50000112.1L85 R86 T93L85-S89 VanDerWaalsContact O-CB 3.23Å; L85-S89 WeakPolarHBondContact O-CB 3.4Å; L85-S89 PolarHBondContact O-N 3.37Å; L85-S89 PolarHBondContact O-OG 3.41Å; R86-S89 PolarHBondContact O-N 3.09Å; S89-T93 WeakPolarHBondContact O-CB 3.37Å; S89-T93 VanDerWaalsContact O-CG2 3.24Å; S89-T93 WeakPolarHBondContact O-CG2 3.46Å; S89-T93 PolarHBondContact O-N 3.24Å; S89-T93 VanDerWaalsContact O-N 3.09Å; S89-T93 PolarHBondContact O-OG1 2.99Å
90L95.4Very high93.5Very high14 Ų1432 Ų327%0.07317%0.169CC..Hα-helixtrans-63.3-42.3175-74174.6000111.2F9 E12 R16 R86 E87 T93 L94F9-L90 HydrophobicContact CE2-CD2 4.35Å; E12-L90 HydrophobicContact CB-CD2 4.29Å; R16-L90 PolarHBondContact NE-O 2.93Å; R16-L90 PolarHBondContact NH2-O 3.27Å; R86-L90 HydrophobicContact CG-CD1 4Å; R86-L90 HydrophobicContact CG-CG 4.45Å; R86-L90 WeakPolarHBondContact O-CB 3.47Å; R86-L90 VanDerWaalsContact O-CG 3.24Å; R86-L90 WeakPolarHBondContact O-CG 3.42Å; R86-L90 PolarHBondContact O-N 3.26Å; E87-L90 PolarHBondContact O-N 3.5Å; L90-T93 PolarHBondContact O-OG1 3.08Å; L90-T93 VanDerWaalsContact O-OG1 3.11Å; L90-L94 WeakPolarHBondContact O-CB 3.35Å; L90-L94 PolarHBondContact O-N 3.17Å
91A96.8Very high94.3Very high0 Ų031.7 Ų31.70%017%0.167CC..Hα-helixtrans-65.1-50.9178.600000112.1E87 A88 T93 L94 T95 F161 H230E87-A91 WeakPolarHBondContact O-CB 3.26Å; E87-A91 PolarHBondContact O-N 3.06Å; A88-A91 PolarHBondContact O-N 3.37Å; A91-T93 PolarHBondContact O-N 3.28Å; A91-L94 PolarHBondContact O-N 2.93Å; A91-T95 PolarHBondContact O-N 3.47Å; A91-T95 PolarHBondContact O-OG1 3.42Å; A91-F161 HydrophobicContact CB-CE2 3.47Å; A91-F161 VanDerWaalsContact CB-CE2 3.47Å; A91-F161 HydrophobicContact CB-CZ 3.68Å; A91-H230 HydrophobicContact CB-CB 3.97Å; A91-H230 WeakPolarHBondContact CB-ND1 3.02Å
92V97.9Very high95.1Very high2 Ų233.5 Ų33.51%0.01217%0.174CC..Hα-helixtrans-67.4-39.1-176.871.30000112.8P67 L68 I71 A88 L94 T95 L96 F161P67-V92 HydrophobicContact CB-CG2 3.71Å; P67-V92 HydrophobicContact CG-CG2 3.68Å; L68-V92 HydrophobicContact CD2-CG1 4.32Å; I71-V92 HydrophobicContact CD1-CG1 4.22Å; A88-V92 WeakPolarHBondContact O-CG1 3.41Å; A88-V92 PolarHBondContact O-N 2.97Å; V92-L94 VanDerWaalsContact C-N 3.31Å; V92-L94 PolarHBondContact O-N 3.28Å; V92-T95 WeakPolarHBondContact O-CB 3.46Å; V92-T95 PolarHBondContact O-N 2.84Å; V92-L96 HydrophobicContact CG2-CD1 4.26Å; V92-L96 WeakPolarHBondContact O-CG 3.35Å; V92-L96 PolarHBondContact O-N 3.03Å; V92-F161 HydrophobicContact CB-CD1 3.66Å; V92-F161 HydrophobicContact CB-CE1 3.67Å; V92-F161 HydrophobicContact CB-CG 4.15Å; V92-F161 HydrophobicContact CB-CZ 4.14Å; V92-F161 HydrophobicContact CG2-CB 4.45Å; V92-F161 HydrophobicContact CG2-CD1 3.68Å; V92-F161 HydrophobicContact CG2-CE1 4.21Å; V92-F161 HydrophobicContact CG2-CG 4.08Å
93T97.7Very high96.1Very high52 Ų5224.7 Ų24.732%0.31913%0.133SC..Hα-helixtrans-64.5-40.117850.30000111.1R16 S89 L90 A91 L96 V97R16-T93 WeakPolarHBondContact CD-OG1 3.39Å; R16-T93 PolarHBondContact NE-OG1 3.47Å; S89-T93 WeakPolarHBondContact O-CB 3.37Å; S89-T93 VanDerWaalsContact O-CG2 3.24Å; S89-T93 WeakPolarHBondContact O-CG2 3.46Å; S89-T93 PolarHBondContact O-N 3.24Å; S89-T93 VanDerWaalsContact O-N 3.09Å; S89-T93 PolarHBondContact O-OG1 2.99Å; L90-T93 PolarHBondContact O-OG1 3.08Å; L90-T93 VanDerWaalsContact O-OG1 3.11Å; A91-T93 PolarHBondContact O-N 3.28Å; T93-L96 PolarHBondContact O-N 3.06Å; T93-V97 WeakPolarHBondContact O-CG2 3.12Å; T93-V97 PolarHBondContact O-N 3.36Å
94L97.7Very high96.8Very high16 Ų1623.4 Ų23.48%0.08412%0.119CC..Hα-helixtrans-64.5-45.4174-17762000111.5L19 L90 A91 V92 L96 V97 L98L19-L94 HydrophobicContact CD1-CD1 4.01Å; L90-L94 WeakPolarHBondContact O-CB 3.35Å; L90-L94 PolarHBondContact O-N 3.17Å; A91-L94 PolarHBondContact O-N 2.93Å; V92-L94 VanDerWaalsContact C-N 3.31Å; V92-L94 PolarHBondContact O-N 3.28Å; L94-L96 VanDerWaalsContact C-N 3.31Å; L94-L96 PolarHBondContact O-N 2.86Å; L94-V97 PolarHBondContact O-N 3.05Å; L94-L98 HydrophobicContact CD1-CB 4.49Å; L94-L98 WeakPolarHBondContact O-CB 3.11Å; L94-L98 PolarHBondContact O-N 3.48Å
95T98.6Very high97.1Very high0 Ų026.6 Ų26.60%014%0.138CC..Hα-helixtrans-50.2-51.5175.2-61.90000111.3A91 V92 N99 A157 A223 C226A91-T95 PolarHBondContact O-N 3.47Å; A91-T95 PolarHBondContact O-OG1 3.42Å; V92-T95 WeakPolarHBondContact O-CB 3.46Å; V92-T95 PolarHBondContact O-N 2.84Å; T95-N99 WeakPolarHBondContact O-CB 3.12Å; T95-N99 PolarHBondContact O-N 3.34Å; T95-A157 HydrophobicContact CG2-CB 3.94Å; T95-A157 WeakPolarHBondContact CG2-O 3.37Å; T95-A223 HydrophobicContact CG2-CB 4.08Å; T95-C226 WeakPolarHBondContact OG1-CB 3.4Å
96L98.4Very high97.3Very high21 Ų2125.6 Ų25.611%0.1113%0.133CC..Hα-helixtrans-67.7-49.1-174-69.4168.6000112.5A63 V64 V92 T93 L94 G100 F154 A157A63-L96 HydrophobicContact CB-CD2 4.44Å; V64-L96 HydrophobicContact CG2-CD1 3.99Å; V92-L96 HydrophobicContact CG2-CD1 4.26Å; V92-L96 WeakPolarHBondContact O-CG 3.35Å; V92-L96 PolarHBondContact O-N 3.03Å; T93-L96 PolarHBondContact O-N 3.06Å; L94-L96 VanDerWaalsContact C-N 3.31Å; L94-L96 PolarHBondContact O-N 2.86Å; L96-G100 PolarHBondContact O-N 2.95Å; L96-F154 HydrophobicContact CD2-CD1 4.24Å; L96-F154 WeakPolarHBondContact O-CE1 3.37Å; L96-A157 HydrophobicContact CD2-CB 4.43Å
97V98.1Very high97.6Very high24 Ų2422 Ų2215%0.14512%0.12CC..Hα-helixtrans-70.8-39-177.4-59.90000112L19 L20 T93 L94 G100 V101L19-V97 HydrophobicContact CB-CB 4.05Å; L19-V97 HydrophobicContact CB-CG2 3.79Å; L19-V97 HydrophobicContact CD1-CG2 3.87Å; L20-V97 HydrophobicContact CB-CG1 4.31Å; T93-V97 WeakPolarHBondContact O-CG2 3.12Å; T93-V97 PolarHBondContact O-N 3.36Å; L94-V97 PolarHBondContact O-N 3.05Å; V97-G100 PolarHBondContact O-N 3.49Å; V97-V101 WeakPolarHBondContact O-CG2 3.36Å; V97-V101 PolarHBondContact O-N 3.21Å
98L97.8Very high97.9Very high39 Ų3922.6 Ų22.620%0.20412%0.123CC..Hα-helixtrans-68.2-45.4179.3-170.562.8000111L19 L94 G100 V101 F102 F222L19-L98 HydrophobicContact CD1-CD1 4.28Å; L19-L98 HydrophobicContact CD2-CD1 4.33Å; L94-L98 HydrophobicContact CD1-CB 4.49Å; L94-L98 WeakPolarHBondContact O-CB 3.11Å; L94-L98 PolarHBondContact O-N 3.48Å; L98-G100 VanDerWaalsContact C-N 3.31Å; L98-G100 PolarHBondContact O-N 3.05Å; L98-V101 PolarHBondContact O-N 3.33Å; L98-F102 HydrophobicContact CD1-CD2 4.09Å; L98-F102 HydrophobicContact CD1-CE2 3.79Å; L98-F102 HydrophobicContact CG-CD2 4.34Å; L98-F102 HydrophobicContact CG-CE2 4.33Å; L98-F102 WeakPolarHBondContact O-CD2 3.29Å; L98-F102 PolarHBondContact O-N 3.46Å; L98-F102 VanDerWaalsContact O-N 3.14Å; L98-F222 HydrophobicContact CB-CD1 4.44Å; L98-F222 HydrophobicContact CD2-CD1 3.63Å; L98-F222 HydrophobicContact CD2-CE1 3.56Å; L98-F222 HydrophobicContact CG-CD1 3.86Å; L98-F222 HydrophobicContact CG-CE1 3.61Å; L98-F222 HydrophobicContact CG-CZ 4.29Å
99N98.7Very high98Very high0 Ų027.5 Ų27.50%015%0.153CC..Hα-helixtrans-56.9-45.2172.7172.678.4000111.8T95 V101 F102 T103 S153 A157 G219 F222T95-N99 WeakPolarHBondContact O-CB 3.12Å; T95-N99 PolarHBondContact O-N 3.34Å; N99-V101 PolarHBondContact O-N 2.93Å; N99-F102 PolarHBondContact O-N 2.93Å; N99-T103 VanDerWaalsContact O-CB 3.32Å; N99-T103 WeakPolarHBondContact O-CB 3.35Å; N99-T103 PolarHBondContact O-N 3.42Å; N99-T103 PolarHBondContact O-OG1 3.49Å; N99-T103 VanDerWaalsContact O-OG1 3.07Å; N99-S153 PolarHBondContact ND2-OG 3.29Å; N99-S153 PolarHBondContact OD1-OG 2.98Å; N99-A157 HydrophobicContact CB-CB 4.01Å; N99-G219 WeakPolarHBondContact OD1-CA 3.46Å; N99-F222 HydrophobicContact CB-CB 4.13Å; N99-F222 HydrophobicContact CB-CD2 3.93Å; N99-F222 HydrophobicContact CB-CG 4.25Å
100G98.4Very high98.1Very high0 Ų028 Ų280%015%0.154CC..Hα-helixtrans-58.1-48.7178.500000113.1L96 V97 L98 F102 T103 N104L96-G100 PolarHBondContact O-N 2.95Å; V97-G100 PolarHBondContact O-N 3.49Å; L98-G100 VanDerWaalsContact C-N 3.31Å; L98-G100 PolarHBondContact O-N 3.05Å; G100-F102 PolarHBondContact O-N 3.03Å; G100-T103 PolarHBondContact O-N 3.14Å; G100-N104 WeakPolarHBondContact O-CB 3.45Å; G100-N104 PolarHBondContact O-N 2.98Å
101V98.6Very high98.2Very high15 Ų1527.3 Ų27.39%0.09115%0.151CC..Hα-helixtrans-57.7-50.3177.7169.80000111L19 V22 F23 V97 L98 N99 N104 V105L19-V101 HydrophobicContact CB-CG2 4.39Å; L19-V101 HydrophobicContact CD2-CG2 4.23Å; L19-V101 VanDerWaalsContact O-CG2 3.24Å; L19-V101 WeakPolarHBondContact O-CG2 3.01Å; V22-V101 HydrophobicContact CB-CG2 4.14Å; V22-V101 HydrophobicContact CG1-CG1 3.88Å; V22-V101 HydrophobicContact CG1-CG2 3.99Å; F23-V101 HydrophobicContact CB-CG2 4.01Å; V97-V101 WeakPolarHBondContact O-CG2 3.36Å; V97-V101 PolarHBondContact O-N 3.21Å; L98-V101 PolarHBondContact O-N 3.33Å; N99-V101 PolarHBondContact O-N 2.93Å; V101-N104 PolarHBondContact O-N 3.4Å; V101-V105 HydrophobicContact CG1-CG2 4.37Å; V101-V105 VanDerWaalsContact O-CG2 3.28Å; V101-V105 WeakPolarHBondContact O-CG2 3.39Å; V101-V105 PolarHBondContact O-N 3.32Å
102F98.7Very high98.2Very high98 Ų9829 Ų2943%0.4316%0.157SC..Hα-helixtrans-64.7-43.1-178.6-87.6-102.6000112.4L98 N99 G100 N104 V105 I106 F222L98-F102 HydrophobicContact CD1-CD2 4.09Å; L98-F102 HydrophobicContact CD1-CE2 3.79Å; L98-F102 HydrophobicContact CG-CD2 4.34Å; L98-F102 HydrophobicContact CG-CE2 4.33Å; L98-F102 WeakPolarHBondContact O-CD2 3.29Å; L98-F102 PolarHBondContact O-N 3.46Å; L98-F102 VanDerWaalsContact O-N 3.14Å; N99-F102 PolarHBondContact O-N 2.93Å; G100-F102 PolarHBondContact O-N 3.03Å; F102-N104 VanDerWaalsContact C-N 3.31Å; F102-N104 PolarHBondContact O-N 2.87Å; F102-V105 PolarHBondContact O-N 3.42Å; F102-I106 WeakPolarHBondContact O-CD1 3.3Å; F102-I106 VanDerWaalsContact O-CG1 3.23Å; F102-I106 WeakPolarHBondContact O-CG1 3.31Å; F102-I106 PolarHBondContact O-N 2.87Å; F102-F222 HydrophobicContact CB-CE2 3.7Å; F102-F222 HydrophobicContact CB-CZ 3.91Å; F102-F222 HydrophobicContact CD1-CE2 4.35Å; F102-F222 AromaticContact CD1-CZ 3.87Å; F102-F222 HydrophobicContact CD1-CZ 3.87Å; F102-F222 HydrophobicContact CD2-CE1 4.29Å; F102-F222 HydrophobicContact CD2-CE2 4.18Å; F102-F222 AromaticContact CD2-CZ 3.53Å; F102-F222 HydrophobicContact CD2-CZ 3.53Å; F102-F222 HydrophobicContact CE1-CZ 4.25Å; F102-F222 HydrophobicContact CE2-CE1 4.41Å; F102-F222 AromaticContact CE2-CZ 3.95Å; F102-F222 HydrophobicContact CE2-CZ 3.95Å; F102-F222 AromaticContact CG-CE2 3.82Å; F102-F222 HydrophobicContact CG-CE2 3.82Å; F102-F222 AromaticContact CG-CZ 3.48Å; F102-F222 HydrophobicContact CG-CZ 3.48Å; F102-F222 VanDerWaalsContact CG-CZ 3.48Å; F102-F222 HydrophobicContact CZ-CZ 4.28Å
103T98.6Very high98.2Very high0 Ų028.9 Ų28.90%016%0.156CC..Hα-helixtrans-56.7-46.2175.4-71.90000111.6N99 G100 I106 K107 P148 S153 L218N99-T103 VanDerWaalsContact O-CB 3.32Å; N99-T103 WeakPolarHBondContact O-CB 3.35Å; N99-T103 PolarHBondContact O-N 3.42Å; N99-T103 PolarHBondContact O-OG1 3.49Å; N99-T103 VanDerWaalsContact O-OG1 3.07Å; G100-T103 PolarHBondContact O-N 3.14Å; T103-I106 PolarHBondContact O-N 3.37Å; T103-K107 HydrophobicContact CG2-CD 4.34Å; T103-K107 WeakPolarHBondContact O-CG 3.29Å; T103-K107 PolarHBondContact O-N 3.25Å; T103-P148 HydrophobicContact CG2-CG 4.33Å; T103-S153 WeakPolarHBondContact OG1-CB 3.5Å; T103-S153 PolarHBondContact OG1-OG 3.38Å; T103-L218 VanDerWaalsContact OG1-CD2 3.3Å; T103-L218 WeakPolarHBondContact OG1-CD2 3.3Å
104N98.4Very high98.2Very high4 Ų426.8 Ų26.82%0.02114%0.143CC..Hα-helixtrans-69.2-43.9-179.3-76.24.7000112.2F23 T26 E27 G100 V101 F102 I106 K107 L108F23-N104 VanDerWaalsContact CD2-ND2 3.28Å; F23-N104 WeakPolarHBondContact CD2-ND2 3.08Å; F23-N104 VanDerWaalsContact CE2-ND2 3.27Å; F23-N104 WeakPolarHBondContact CE2-ND2 3.32Å; F23-N104 PolarHBondContact O-ND2 3.44Å; T26-N104 WeakPolarHBondContact OG1-CB 3.2Å; T26-N104 PolarHBondContact OG1-ND2 3.11Å; E27-N104 PolarHBondContact N-ND2 2.67Å; E27-N104 VanDerWaalsContact OE2-CG 3.25Å; E27-N104 PolarHBondContact OE2-ND2 3.33Å; E27-N104 PolarHBondContact OE2-OD1 3.4Å; E27-N104 VanDerWaalsContact OE2-OD1 3.12Å; G100-N104 WeakPolarHBondContact O-CB 3.45Å; G100-N104 PolarHBondContact O-N 2.98Å; V101-N104 PolarHBondContact O-N 3.4Å; F102-N104 VanDerWaalsContact C-N 3.31Å; F102-N104 PolarHBondContact O-N 2.87Å; N104-I106 VanDerWaalsContact C-N 3.3Å; N104-I106 PolarHBondContact O-N 3.34Å; N104-K107 WeakPolarHBondContact O-CB 3.39Å; N104-K107 PolarHBondContact O-N 2.94Å; N104-K107 VanDerWaalsContact O-N 3.17Å; N104-L108 VanDerWaalsContact O-CG 3.29Å; N104-L108 WeakPolarHBondContact O-CG 3.36Å; N104-L108 PolarHBondContact O-N 2.95Å
105V98.5Very high98.2Very high66 Ų6626.4 Ų26.440%0.414%0.141SC..Hα-helixtrans-56.8-46.2175.7169.60000110.8V101 F102 K107 L108 V109V101-V105 HydrophobicContact CG1-CG2 4.37Å; V101-V105 VanDerWaalsContact O-CG2 3.28Å; V101-V105 WeakPolarHBondContact O-CG2 3.39Å; V101-V105 PolarHBondContact O-N 3.32Å; F102-V105 PolarHBondContact O-N 3.42Å; V105-K107 PolarHBondContact O-N 2.87Å; V105-L108 PolarHBondContact O-N 3.45Å; V105-V109 HydrophobicContact CG1-CG2 4.46Å; V105-V109 WeakPolarHBondContact O-CG2 3.43Å; V105-V109 PolarHBondContact O-N 3.45Å
106I98.6Very high98.1Very high47 Ų4726.4 Ų26.424%0.24114%0.141CC..Hα-helixtrans-64.8-42178.9-60.4162.7000110.7F102 T103 N104 L108 V109 V110 F147 P148 L218F102-I106 WeakPolarHBondContact O-CD1 3.3Å; F102-I106 VanDerWaalsContact O-CG1 3.23Å; F102-I106 WeakPolarHBondContact O-CG1 3.31Å; F102-I106 PolarHBondContact O-N 2.87Å; T103-I106 PolarHBondContact O-N 3.37Å; N104-I106 VanDerWaalsContact C-N 3.3Å; N104-I106 PolarHBondContact O-N 3.34Å; I106-L108 VanDerWaalsContact C-N 3.32Å; I106-L108 PolarHBondContact O-N 3.45Å; I106-V109 PolarHBondContact O-N 3.08Å; I106-V110 HydrophobicContact CG2-CG2 3.88Å; I106-V110 WeakPolarHBondContact O-CB 3.24Å; I106-V110 WeakPolarHBondContact O-CG2 3.41Å; I106-V110 PolarHBondContact O-N 3.31Å; I106-F147 HydrophobicContact CG2-CD1 3.94Å; I106-F147 HydrophobicContact CG2-CE1 3.88Å; I106-P148 HydrophobicContact CB-CG 4.41Å; I106-P148 VanDerWaalsContact CG2-CD 3.46Å; I106-P148 HydrophobicContact CG2-CG 4.36Å; I106-L218 HydrophobicContact CD1-CD2 3.98Å
107K98.5Very high98.1Very high12 Ų1225.5 Ų25.55%0.05214%0.136CC..Hα-helixtrans-55.8-46174.4-78.5175.2162.7-155.80112.7T103 N104 V105 G111 K145 F147 P148T103-K107 HydrophobicContact CG2-CD 4.34Å; T103-K107 WeakPolarHBondContact O-CG 3.29Å; T103-K107 PolarHBondContact O-N 3.25Å; N104-K107 WeakPolarHBondContact O-CB 3.39Å; N104-K107 PolarHBondContact O-N 2.94Å; N104-K107 VanDerWaalsContact O-N 3.17Å; V105-K107 PolarHBondContact O-N 2.87Å; K107-G111 PolarHBondContact O-N 3.42Å; K107-K145 HydrophobicContact CB-CB 4.47Å; K107-K145 HydrophobicContact CD-CB 4.31Å; K107-K145 WeakPolarHBondContact CE-O 3.47Å; K107-F147 WeakPolarHBondContact CA-O 3.29Å; K107-F147 WeakPolarHBondContact CG-O 3.4Å; K107-P148 WeakPolarHBondContact CE-O 3.3Å
108L98.4Very high98Very high27 Ų2724.6 Ų24.614%0.14113%0.13CC..Hα-helixtrans-65.8-41.8-179.9-65.9175.5000111.6T26 L29 P31 F32 N104 V105 I106T26-L108 HydrophobicContact CG2-CD1 4.23Å; L29-L108 HydrophobicContact CB-CD1 3.87Å; L29-L108 HydrophobicContact CB-CD2 3.83Å; L29-L108 HydrophobicContact CD1-CD1 3.99Å; L29-L108 WeakPolarHBondContact O-CD2 3.24Å; P31-L108 CarbonylContact C-O 3.27Å; P31-L108 WeakPolarHBondContact CA-O 3.09Å; P31-L108 HydrophobicContact CB-CD2 4.29Å; F32-L108 WeakPolarHBondContact CB-O 3.43Å; F32-L108 PolarHBondContact N-O 2.78Å; N104-L108 VanDerWaalsContact O-CG 3.29Å; N104-L108 WeakPolarHBondContact O-CG 3.36Å; N104-L108 PolarHBondContact O-N 2.95Å; V105-L108 PolarHBondContact O-N 3.45Å; I106-L108 VanDerWaalsContact C-N 3.32Å; I106-L108 PolarHBondContact O-N 3.45Å
109V98.2Very high97.9Very high104 Ų10426.3 Ų26.363%0.6313%0.134SC*.Hα-helixtrans-70.6-40.9-179.7172.60000111.8F32 V105 I106F32-V109 WeakPolarHBondContact CB-O 3.33Å; V105-V109 HydrophobicContact CG1-CG2 4.46Å; V105-V109 WeakPolarHBondContact O-CG2 3.43Å; V105-V109 PolarHBondContact O-N 3.45Å; I106-V109 PolarHBondContact O-N 3.08Å
110V98Very high97.7Very high47 Ų4727.1 Ų27.129%0.28514%0.138SC..Hα-helixtrans-82.7-39.6-173.11760000112.4I106 R112 F147I106-V110 HydrophobicContact CG2-CG2 3.88Å; I106-V110 WeakPolarHBondContact O-CB 3.24Å; I106-V110 WeakPolarHBondContact O-CG2 3.41Å; I106-V110 PolarHBondContact O-N 3.31Å; V110-R112 HydrophobicContact CG1-CB 3.97Å; V110-R112 PolarHBondContact O-N 2.88Å; V110-R112 VanDerWaalsContact O-N 3.14Å; V110-F147 HydrophobicContact CB-CD1 4.15Å; V110-F147 HydrophobicContact CG1-CB 4.02Å; V110-F147 HydrophobicContact CG1-CD1 3.91Å; V110-F147 HydrophobicContact CG1-CG 4.27Å; V110-F147 HydrophobicContact CG2-CD1 3.9Å; V110-F147 HydrophobicContact CG2-CE1 4.32Å
111G97.4Very high97.6Very high0 Ų027.3 Ų27.30%014%0.139CC..  trans58.928.9175.800000115.2F32 K107 R144F32-G111 WeakPolarHBondContact O-CA 3.48Å; K107-G111 PolarHBondContact O-N 3.42Å; G111-R144 CarbonylContact C-O 3.59Å; G111-R144 VanDerWaalsContact CA-O 3.26Å; G111-R144 WeakPolarHBondContact CA-O 3.32Å
112R97.4Very high97.4Very high35 Ų3526.8 Ų26.813%0.13214%0.135CC..PPolyproline II helixtrans-67.4128.7-176.4-171.8-176.3-176.5178.43.7110.5V110 R144 S146 F147 H208 D211V110-R112 HydrophobicContact CG1-CB 3.97Å; V110-R112 PolarHBondContact O-N 2.88Å; V110-R112 VanDerWaalsContact O-N 3.14Å; R112-R144 CarbonylContact C-O 3.59Å; R112-R144 PolarHBondContact N-O 3.28Å; R112-R144 CarbonylContact O-C 3.52Å; R112-S146 WeakPolarHBondContact O-CB 3.35Å; R112-S146 PolarHBondContact O-N 3.47Å; R112-F147 HydrophobicContact CB-CB 3.79Å; R112-F147 HydrophobicContact CG-CB 4.46Å; R112-H208 VanDerWaalsContact CZ-CG 3.45Å; R112-H208 VanDerWaalsContact CZ-ND1 3.34Å; R112-H208 PolarHBondContact NE-ND1 2.9Å; R112-H208 PolarHBondContact NH2-CD2 3.25Å; R112-H208 VanDerWaalsContact NH2-CD2 3.26Å; R112-H208 PolarHBondContact NH2-ND1 2.88Å; R112-D211 WeakPolarHBondContact CD-OD1 3.34Å; R112-D211 IonicContact CZ-OD1 3.17Å; R112-D211 IonicContact NE-OD1 2.83Å; R112-D211 IonicContact NH1-OD1 3.27Å; R112-D211 PolarHBondContact NH1-OD1 3.38Å
113P97.6Very high97.2Very high0 Ų025.7 Ų25.70%014%0.138CC..PPolyproline II helixtrans-65145.6172.2-15.128.1000112I36 Y44 F117 G143 S146 H208I36-P113 HydrophobicContact CD1-CB 3.94Å; I36-P113 HydrophobicContact CD1-CG 3.47Å; I36-P113 VanDerWaalsContact CD1-CG 3.47Å; I36-P113 HydrophobicContact CG1-CG 3.82Å; Y44-P113 HydrophobicContact CD1-CB 3.81Å; Y44-P113 HydrophobicContact CE1-CB 3.69Å; Y44-P113 HydrophobicContact CE1-CG 4.12Å; Y44-P113 WeakPolarHBondContact CE1-O 3.23Å; Y44-P113 HydrophobicContact CE2-CB 4.44Å; Y44-P113 HydrophobicContact CE2-CG 4.31Å; Y44-P113 HydrophobicContact CG-CB 4.21Å; P113-F117 HydrophobicContact CB-CB 3.89Å; P113-F117 HydrophobicContact CB-CD1 4.08Å; P113-F117 HydrophobicContact CB-CD2 4.35Å; P113-F117 HydrophobicContact CB-CG 3.83Å; P113-G143 CarbonylContact C-O 3.02Å; P113-G143 WeakPolarHBondContact CA-O 3.23Å; P113-S146 WeakPolarHBondContact O-CB 3.35Å; P113-H208 PolarHBondContact O-CE1 2.93Å
114R97.8Very high96.9Very high8 Ų830.6 Ų30.63%0.0317%0.165CC..PPolyproline II helixtrans-75.4156.8174.4-67.6-179.4-179.4-101.55.4111.2Y44 D116 F117 E142 G143 K206 H207Y44-R114 VanDerWaalsContact CD1-O 3.28Å; Y44-R114 WeakPolarHBondContact CD1-O 3.36Å; R114-D116 WeakPolarHBondContact CB-OD1 3.41Å; R114-D116 PolarHBondContact O-N 3.03Å; R114-D116 VanDerWaalsContact O-N 3.11Å; R114-F117 WeakPolarHBondContact O-CB 3.43Å; R114-F117 PolarHBondContact O-N 3.07Å; R114-E142 IonicContact CZ-OE1 3.49Å; R114-E142 PolarHBondContact NE-O 3.12Å; R114-E142 IonicContact NE-OE1 3.44Å; R114-E142 IonicContact NH2-OE1 2.86Å; R114-E142 PolarHBondContact NH2-OE1 3Å; R114-G143 WeakPolarHBondContact CG-O 3.35Å; R114-G143 PolarHBondContact N-O 3.36Å; R114-K206 WeakPolarHBondContact CD-O 3.26Å; R114-K206 VanDerWaalsContact CG-O 3.29Å; R114-K206 WeakPolarHBondContact CG-O 3.45Å; R114-K206 PolarHBondContact NH1-O 3.36Å; R114-H207 PolarHBondContact NH1-CE1 2.83Å; R114-H207 VanDerWaalsContact NH1-CE1 3.32Å; R114-H207 PolarHBondContact NH1-NE2 3.34Å
115P97.9Very high96.6Very high7 Ų731.6 Ų31.65%0.04518%0.176CC..THydrogen-bonded Turntrans-58.8-22.8175.6-18.628.6000114.2Y44 K45 F46 Y205Y44-P115 CarbonylContact C-O 3.58Å; Y44-P115 VanDerWaalsContact CA-O 3.24Å; Y44-P115 WeakPolarHBondContact CA-O 3.36Å; K45-P115 PolarHBondContact N-O 2.94Å; F46-P115 HydrophobicContact CB-CB 4.48Å; F46-P115 WeakPolarHBondContact CB-O 3.27Å; F46-P115 HydrophobicContact CD2-CB 3.7Å; F46-P115 HydrophobicContact CE2-CB 4.36Å; F46-P115 HydrophobicContact CG-CB 4.37Å; F46-P115 PolarHBondContact N-O 2.91Å; P115-Y205 WeakPolarHBondContact CB-O 3.49Å; P115-Y205 WeakPolarHBondContact CD-O 3.41Å
116D96.8Very high96.2Very high0 Ų035.3 Ų35.30%019%0.189CC..THydrogen-bonded Turntrans-96.211.3175.171.4-16.4000113.9R114 F118 Y119 R120 Y205 K206R114-D116 WeakPolarHBondContact CB-OD1 3.41Å; R114-D116 PolarHBondContact O-N 3.03Å; R114-D116 VanDerWaalsContact O-N 3.11Å; D116-F118 VanDerWaalsContact C-N 3.32Å; D116-F118 PolarHBondContact O-N 2.98Å; D116-Y119 PolarHBondContact O-N 3.33Å; D116-R120 VanDerWaalsContact CG-NE 3.27Å; D116-R120 PolarHBondContact O-N 2.91Å; D116-R120 IonicContact OD1-CZ 3.28Å; D116-R120 IonicContact OD1-NE 2.78Å; D116-R120 PolarHBondContact OD1-NE 3.44Å; D116-R120 IonicContact OD1-NH2 2.88Å; D116-R120 PolarHBondContact OD1-NH2 3.3Å; D116-R120 IonicContact OD2-CZ 3.81Å; D116-R120 IonicContact OD2-NE 3.89Å; D116-R120 PolarHBondContact OD2-NE 3.08Å; D116-R120 IonicContact OD2-NH2 3.77Å; D116-R120 PolarHBondContact OD2-NH2 3.43Å; D116-Y205 PolarHBondContact N-O 3.37Å; D116-K206 WeakPolarHBondContact OD2-CD 3.28Å; D116-K206 WeakPolarHBondContact OD2-CE 3.49Å; D116-K206 IonicContact OD2-NZ 2.72Å; D116-K206 PolarHBondContact OD2-NZ 2.69Å
117F96.9Very high95.7Very high3 Ų336.9 Ų36.91%0.01320%0.196CC..Hα-helixtrans-61.6-34.9-172.1176.5-98.6000113.7I36 Y44 P113 R114 Y119 R120 C121 V140 G143 R144I36-F117 HydrophobicContact CD1-CD1 3.53Å; I36-F117 HydrophobicContact CD1-CE1 3.37Å; I36-F117 HydrophobicContact CD1-CZ 4.31Å; Y44-F117 PolarHBondContact O-N 3.2Å; P113-F117 HydrophobicContact CB-CB 3.89Å; P113-F117 HydrophobicContact CB-CD1 4.08Å; P113-F117 HydrophobicContact CB-CD2 4.35Å; P113-F117 HydrophobicContact CB-CG 3.83Å; R114-F117 WeakPolarHBondContact O-CB 3.43Å; R114-F117 PolarHBondContact O-N 3.07Å; F117-Y119 PolarHBondContact O-N 3.27Å; F117-R120 WeakPolarHBondContact O-CB 3.37Å; F117-R120 PolarHBondContact O-N 2.85Å; F117-R120 VanDerWaalsContact O-N 3.08Å; F117-C121 HydrophobicContact CE1-CB 4.01Å; F117-C121 HydrophobicContact CZ-CB 4.08Å; F117-C121 WeakPolarHBondContact O-CB 3.29Å; F117-C121 PolarHBondContact O-N 3.43Å; F117-V140 HydrophobicContact CE2-CG1 4.04Å; F117-V140 HydrophobicContact CZ-CG1 4.3Å; F117-G143 WeakPolarHBondContact CD2-O 3.41Å; F117-R144 HydrophobicContact CD2-CG 4.27Å; F117-R144 HydrophobicContact CE2-CG 3.6Å; F117-R144 HydrophobicContact CZ-CG 4.2Å
118F96.1Very high95.1Very high4 Ų439.1 Ų39.12%0.01821%0.209CC..Hα-helixtrans-55.8-50.2-179.7178.3-94.7000111.8M41 Y44 K45 D116 R120 C121 F122 M127M41-F118 HydrophobicContact CG-CD2 3.67Å; M41-F118 HydrophobicContact CG-CE2 4.23Å; M41-F118 HydrophobicContact SD-CD2 3.92Å; Y44-F118 WeakPolarHBondContact O-CB 3.25Å; Y44-F118 PolarHBondContact O-N 3.38Å; K45-F118 HydrophobicContact CB-CB 4.26Å; K45-F118 HydrophobicContact CB-CG 4.41Å; K45-F118 HydrophobicContact CD-CD1 4.27Å; K45-F118 HydrophobicContact CD-CE1 4.32Å; K45-F118 HydrophobicContact CD-CG 4.44Å; K45-F118 HydrophobicContact CG-CB 4.22Å; K45-F118 HydrophobicContact CG-CD1 3.71Å; K45-F118 HydrophobicContact CG-CE1 4.21Å; K45-F118 HydrophobicContact CG-CG 3.89Å; D116-F118 VanDerWaalsContact C-N 3.32Å; D116-F118 PolarHBondContact O-N 2.98Å; F118-R120 VanDerWaalsContact C-N 3.25Å; F118-R120 PolarHBondContact O-N 3.24Å; F118-C121 PolarHBondContact O-N 3.34Å; F118-C121 VanDerWaalsContact O-N 3.14Å; F118-F122 HydrophobicContact CD2-CD2 4Å; F118-F122 AromaticContact CE2-CD2 3.78Å; F118-F122 HydrophobicContact CE2-CD2 3.78Å; F118-F122 HydrophobicContact CE2-CE2 4.39Å; F118-F122 HydrophobicContact CZ-CB 4.46Å; F118-F122 HydrophobicContact CZ-CD2 4.3Å; F118-F122 PolarHBondContact O-N 2.86Å; F118-M127 HydrophobicContact CD2-CE 4.34Å; F118-M127 HydrophobicContact CE2-CB 4.29Å; F118-M127 HydrophobicContact CE2-CE 3.76Å
119Y95.9Very high94.3Very high75 Ų7546.6 Ų46.629%0.29425%0.248SC..Hα-helixtrans-77.2-9.9-179.6-67.6-73.6000113.7K45 F46 D116 F117K45-Y119 HydrophobicContact CG-CE2 4.19Å; K45-Y119 WeakPolarHBondContact O-CE2 3.31Å; F46-Y119 WeakPolarHBondContact O-CD2 3.26Å; D116-Y119 PolarHBondContact O-N 3.33Å; F117-Y119 PolarHBondContact O-N 3.27Å
120R95.6Very high93.6Very high17 Ų1747.9 Ų47.96%0.06425%0.247CC..Hα-helixtrans-77.2-41.9165.2-63.4175.2-178.2-108-3.8110.6D116 F117 F118 V139 V140 G143 K206D116-R120 VanDerWaalsContact CG-NE 3.27Å; D116-R120 PolarHBondContact O-N 2.91Å; D116-R120 IonicContact OD1-CZ 3.28Å; D116-R120 IonicContact OD1-NE 2.78Å; D116-R120 PolarHBondContact OD1-NE 3.44Å; D116-R120 IonicContact OD1-NH2 2.88Å; D116-R120 PolarHBondContact OD1-NH2 3.3Å; D116-R120 IonicContact OD2-CZ 3.81Å; D116-R120 IonicContact OD2-NE 3.89Å; D116-R120 PolarHBondContact OD2-NE 3.08Å; D116-R120 IonicContact OD2-NH2 3.77Å; D116-R120 PolarHBondContact OD2-NH2 3.43Å; F117-R120 WeakPolarHBondContact O-CB 3.37Å; F117-R120 PolarHBondContact O-N 2.85Å; F117-R120 VanDerWaalsContact O-N 3.08Å; F118-R120 VanDerWaalsContact C-N 3.25Å; F118-R120 PolarHBondContact O-N 3.24Å; R120-V139 HydrophobicContact CB-CG1 4.02Å; R120-V139 HydrophobicContact CG-CG1 3.87Å; R120-V139 PolarHBondContact NH1-O 3.32Å; R120-V140 VanDerWaalsContact O-CG2 3.3Å; R120-V140 WeakPolarHBondContact O-CG2 3.38Å; R120-G143 VanDerWaalsContact CD-CA 3.46Å; R120-K206 VanDerWaalsContact NH2-CD 3.32Å
121C95.1Very high92.8Very high5 Ų549.7 Ų49.73%0.03425%0.254CS..Hα-helixtrans-75.1-41.5-178.4-173.80000112.5F117 F118 C133 S134 G135F117-C121 HydrophobicContact CE1-CB 4.01Å; F117-C121 HydrophobicContact CZ-CB 4.08Å; F117-C121 WeakPolarHBondContact O-CB 3.29Å; F117-C121 PolarHBondContact O-N 3.43Å; F118-C121 PolarHBondContact O-N 3.34Å; F118-C121 VanDerWaalsContact O-N 3.14Å; C121-C133 HydrophobicContact CB-CB 3.92Å; C121-C133 WeakPolarHBondContact CB-SG 3.27Å; C121-C133 CarbonylContact O-C 2.88Å; C121-C133 WeakPolarHBondContact O-CA 3.32Å; C121-C133 WeakPolarHBondContact SG-CA 3.2Å; C121-C133 WeakPolarHBondContact SG-CB 3.47Å; C121-C133 CovalentContact SG-SG 2.04Å; C121-C133 PolarHBondContact SG-SG 3.48Å; C121-S134 PolarHBondContact O-N 3.34Å; C121-S134 PolarHBondContact O-OG 2.98Å; C121-G135 PolarHBondContact O-N 3.37Å
122F95.3Very high92.3Very high3 Ų357.6 Ų57.61%0.01328%0.284CS..  trans-125.985.2179.6-55.7-74000109.9F118 D124 G125 Q126 M127 R132F118-F122 HydrophobicContact CD2-CD2 4Å; F118-F122 AromaticContact CE2-CD2 3.78Å; F118-F122 HydrophobicContact CE2-CD2 3.78Å; F118-F122 HydrophobicContact CE2-CE2 4.39Å; F118-F122 HydrophobicContact CZ-CB 4.46Å; F118-F122 HydrophobicContact CZ-CD2 4.3Å; F118-F122 PolarHBondContact O-N 2.86Å; F122-D124 PolarHBondContact O-N 3.39Å; F122-G125 PolarHBondContact O-N 3.4Å; F122-Q126 VanDerWaalsContact CD1-O 3.23Å; F122-Q126 WeakPolarHBondContact CD1-O 3.48Å; F122-M127 HydrophobicContact CE2-CB 4.43Å; F122-M127 HydrophobicContact CE2-CG 4.04Å; F122-M127 HydrophobicContact CZ-CG 4.01Å; F122-R132 VanDerWaalsContact CE1-O 3.26Å; F122-R132 WeakPolarHBondContact CE1-O 3.48Å
123P94.4Very high92.1Very high76 Ų7658.2 Ų58.249%0.49429%0.293SS..THydrogen-bonded Turntrans-63-26.9-176.4-24.234.9000114.4G125P123-G125 PolarHBondContact O-N 2.84Å
124D92.5Very high91.9Very high103 Ų10361.8 Ų61.855%0.55132%0.319SS*.THydrogen-bonded Turntrans-78.8-5.6174.460.7-6.7000113.4F122 Q126F122-D124 PolarHBondContact O-N 3.39Å; D124-Q126 PolarHBondContact O-N 3.22Å; D124-Q126 PolarHBondContact OD1-N 3.41Å
125G91.7Very high91.8Very high25 Ų2562.1 Ų62.126%0.25833%0.325SS..SBendtrans72.87.5-176.500000114.3F122 P123F122-G125 PolarHBondContact O-N 3.4Å; P123-G125 PolarHBondContact O-N 2.84Å
126Q90.8Very high91.7Very high143 Ų14366 Ų6667%0.66835%0.345SS*.  trans-105.1116.1-177.9-59.4-167.412.700110.6F122 D124F122-Q126 VanDerWaalsContact CD1-O 3.23Å; F122-Q126 WeakPolarHBondContact CD1-O 3.48Å; D124-Q126 PolarHBondContact O-N 3.22Å; D124-Q126 PolarHBondContact OD1-N 3.41Å
127M87.3Confident91.6Very high80 Ų8070.3 Ų70.339%0.39437%0.373SS..  trans-79.7132.8176.1-174.9-173-70.800110M41 F118 F122 L131M41-M127 HydrophobicContact CB-CE 4.19Å; M41-M127 HydrophobicContact CE-CE 3.88Å; M41-M127 HydrophobicContact CG-CE 3.55Å; M41-M127 HydrophobicContact SD-CE 4.27Å; F118-M127 HydrophobicContact CD2-CE 4.34Å; F118-M127 HydrophobicContact CE2-CB 4.29Å; F118-M127 HydrophobicContact CE2-CE 3.76Å; F122-M127 HydrophobicContact CE2-CB 4.43Å; F122-M127 HydrophobicContact CE2-CG 4.04Å; F122-M127 HydrophobicContact CZ-CG 4.01Å; M127-L131 HydrophobicContact CE-CD2 4.3Å; M127-L131 HydrophobicContact CG-CD2 3.7Å; M127-L131 HydrophobicContact SD-CD2 3.3Å; M127-L131 WeakPolarHBondContact SD-CD2 3.28Å
128N85.5Confident91.5Very high60 Ų6076 Ų7632%0.32140%0.404SS..  trans-87.9159.6172.460.930.9000112E130 L131 R132N128-E130 PolarHBondContact O-N 3.35Å; N128-L131 PolarHBondContact O-N 2.86Å; N128-L131 VanDerWaalsContact OD1-CA 3.3Å; N128-L131 WeakPolarHBondContact OD1-CA 3.35Å; N128-L131 PolarHBondContact OD1-N 2.97Å; N128-R132 PolarHBondContact ND2-O 3Å; N128-R132 PolarHBondContact OD1-N 3.45Å
129L82.8Confident91.5Very high184 Ų18477.4 Ų77.496%0.96341%0.412SS*.THydrogen-bonded Turntrans-63.4-25.5178.9-69.2167.1000112.9L131L129-L131 VanDerWaalsContact C-N 3.33Å
130E82.4Confident91.5Very high131 Ų13174.4 Ų74.461%0.61240%0.402SS*.THydrogen-bonded Turntrans-83.1-6.4-179.9-61.5-175.3-173.400113.6N128 R132N128-E130 PolarHBondContact O-N 3.35Å; E130-R132 HydrophobicContact CB-CB 4.46Å; E130-R132 HydrophobicContact CB-CG 4.02Å; E130-R132 PolarHBondContact O-N 3.45Å; E130-R132 VanDerWaalsContact O-N 3.14Å; E130-R132 WeakPolarHBondContact OE2-CD 3.38Å; E130-R132 IonicContact OE2-CZ 3.56Å; E130-R132 IonicContact OE2-NE 3.76Å; E130-R132 IonicContact OE2-NH1 3.54Å; E130-R132 PolarHBondContact OE2-NH1 2.77Å
131L81.2Confident91.6Very high84 Ų8475.6 Ų75.644%0.4441%0.409SS..  trans51.929-173.3-59.4175.7000114.2M127 N128 L129M127-L131 HydrophobicContact CE-CD2 4.3Å; M127-L131 HydrophobicContact CG-CD2 3.7Å; M127-L131 HydrophobicContact SD-CD2 3.3Å; M127-L131 WeakPolarHBondContact SD-CD2 3.28Å; N128-L131 PolarHBondContact O-N 2.86Å; N128-L131 VanDerWaalsContact OD1-CA 3.3Å; N128-L131 WeakPolarHBondContact OD1-CA 3.35Å; N128-L131 PolarHBondContact OD1-N 2.97Å; L129-L131 VanDerWaalsContact C-N 3.33Å
132R87.7Confident91.6Very high166 Ų16678 Ų7863%0.62642%0.419SS*.  trans-93.1127.1179.4-70.8-177.7176.5167.7-11.1110.6F122 N128 E130 S134F122-R132 VanDerWaalsContact CE1-O 3.26Å; F122-R132 WeakPolarHBondContact CE1-O 3.48Å; N128-R132 PolarHBondContact ND2-O 3Å; N128-R132 PolarHBondContact OD1-N 3.45Å; E130-R132 HydrophobicContact CB-CB 4.46Å; E130-R132 HydrophobicContact CB-CG 4.02Å; E130-R132 PolarHBondContact O-N 3.45Å; E130-R132 VanDerWaalsContact O-N 3.14Å; E130-R132 WeakPolarHBondContact OE2-CD 3.38Å; E130-R132 IonicContact OE2-CZ 3.56Å; E130-R132 IonicContact OE2-NE 3.76Å; E130-R132 IonicContact OE2-NH1 3.54Å; E130-R132 PolarHBondContact OE2-NH1 2.77Å; R132-S134 PolarHBondContact O-N 2.88Å
133C92.6Very high91.7Very high48 Ų4877.8 Ų77.832%0.32442%0.419SS..  trans-61.8137.1177.9-59.20000111.7C121 V140C121-C133 HydrophobicContact CB-CB 3.92Å; C121-C133 WeakPolarHBondContact CB-SG 3.27Å; C121-C133 CarbonylContact O-C 2.88Å; C121-C133 WeakPolarHBondContact O-CA 3.32Å; C121-C133 WeakPolarHBondContact SG-CA 3.2Å; C121-C133 WeakPolarHBondContact SG-CB 3.47Å; C121-C133 CovalentContact SG-SG 2.04Å; C121-C133 PolarHBondContact SG-SG 3.48Å; C133-V140 HydrophobicContact CB-CG1 4.16Å; C133-V140 HydrophobicContact CB-CG2 4.07Å
134S94.5Very high91.8Very high76 Ų7675.8 Ų75.853%0.53140%0.401SS..  trans-103.6-11174.556.10000113.1C121 R132C121-S134 PolarHBondContact O-N 3.34Å; C121-S134 PolarHBondContact O-OG 2.98Å; R132-S134 PolarHBondContact O-N 2.88Å
135G94.1Very high92Very high15 Ų1571.5 Ų71.516%0.15538%0.378CS..SBendtrans-74.8174.617900000114.9C121C121-G135 PolarHBondContact O-N 3.37Å
136D96.1Very high92.3Very high89 Ų8970.3 Ų70.348%0.47637%0.365SS..  trans-55.1125.9177-178.9-60.6000111.4D138 V139 V140D136-D138 VanDerWaalsContact C-N 3.32Å; D136-D138 PolarHBondContact O-N 2.98Å; D136-D138 WeakPolarHBondContact OD1-CB 3.29Å; D136-D138 PolarHBondContact OD1-N 2.83Å; D136-V139 HydrophobicContact CB-CB 4.06Å; D136-V139 HydrophobicContact CB-CG2 3.85Å; D136-V139 PolarHBondContact O-N 3.4Å; D136-V139 PolarHBondContact OD1-N 2.93Å; D136-V140 VanDerWaalsContact O-CG2 3.29Å; D136-V140 WeakPolarHBondContact O-CG2 3.07Å; D136-V140 PolarHBondContact O-N 2.72Å
137P95.5Very high92.7Very high90 Ų9065.5 Ų65.558%0.58434%0.342SS*.Hα-helixtrans-55.9-39.9-176.4-27.235.1000114.5V140 I141P137-V140 PolarHBondContact O-N 3.41Å; P137-I141 WeakPolarHBondContact O-CB 3.34Å; P137-I141 VanDerWaalsContact O-CG1 3.24Å; P137-I141 WeakPolarHBondContact O-CG1 3.47Å; P137-I141 PolarHBondContact O-N 3.38Å
138D95Very high93.2Very high123 Ų12361.7 Ų61.766%0.65832%0.324SS*.Hα-helixtrans-71.1-40.2-177.6-68-27.2000110.4D136 V140 I141 E142D136-D138 VanDerWaalsContact C-N 3.32Å; D136-D138 PolarHBondContact O-N 2.98Å; D136-D138 WeakPolarHBondContact OD1-CB 3.29Å; D136-D138 PolarHBondContact OD1-N 2.83Å; D138-V140 VanDerWaalsContact C-N 3.34Å; D138-V140 PolarHBondContact O-N 3.4Å; D138-I141 PolarHBondContact O-N 3.49Å; D138-E142 WeakPolarHBondContact O-CB 3.47Å; D138-E142 PolarHBondContact O-N 3.07Å
139V95.5Very high93.9Very high32 Ų3258.8 Ų58.819%0.19431%0.308CS..Hα-helixtrans-64.9-39.6175.6178.80000111.4R120 D136 G143R120-V139 HydrophobicContact CB-CG1 4.02Å; R120-V139 HydrophobicContact CG-CG1 3.87Å; R120-V139 PolarHBondContact NH1-O 3.32Å; D136-V139 HydrophobicContact CB-CB 4.06Å; D136-V139 HydrophobicContact CB-CG2 3.85Å; D136-V139 PolarHBondContact O-N 3.4Å; D136-V139 PolarHBondContact OD1-N 2.93Å; V139-G143 PolarHBondContact O-N 2.98Å
140V96.4Very high94.6Very high13 Ų1350.3 Ų50.38%0.07927%0.265CS..Hα-helixtrans-67.6-46.6177171.40000110.9F117 R120 C133 D136 P137 D138 E142 G143 R144F117-V140 HydrophobicContact CE2-CG1 4.04Å; F117-V140 HydrophobicContact CZ-CG1 4.3Å; R120-V140 VanDerWaalsContact O-CG2 3.3Å; R120-V140 WeakPolarHBondContact O-CG2 3.38Å; C133-V140 HydrophobicContact CB-CG1 4.16Å; C133-V140 HydrophobicContact CB-CG2 4.07Å; D136-V140 VanDerWaalsContact O-CG2 3.29Å; D136-V140 WeakPolarHBondContact O-CG2 3.07Å; D136-V140 PolarHBondContact O-N 2.72Å; P137-V140 PolarHBondContact O-N 3.41Å; D138-V140 VanDerWaalsContact C-N 3.34Å; D138-V140 PolarHBondContact O-N 3.4Å; V140-E142 VanDerWaalsContact C-N 3.32Å; V140-E142 PolarHBondContact O-N 3Å; V140-G143 WeakPolarHBondContact O-CA 3.37Å; V140-G143 PolarHBondContact O-N 2.91Å; V140-G143 VanDerWaalsContact O-N 3.08Å; V140-R144 PolarHBondContact O-N 3.47Å
141I96.6Very high95.3Very high42 Ų4244.8 Ų44.822%0.21524%0.239CC..Hα-helixtrans-59.7-44.9176.5-74.5168.7000110.2P137 D138 G143 R144P137-I141 WeakPolarHBondContact O-CB 3.34Å; P137-I141 VanDerWaalsContact O-CG1 3.24Å; P137-I141 WeakPolarHBondContact O-CG1 3.47Å; P137-I141 PolarHBondContact O-N 3.38Å; D138-I141 PolarHBondContact O-N 3.49Å; I141-G143 PolarHBondContact O-N 2.72Å; I141-R144 WeakPolarHBondContact O-CB 3.32Å; I141-R144 PolarHBondContact O-N 2.78Å
142E95.8Very high96.2Very high54 Ų5440.8 Ų40.825%0.25222%0.218SC..Hα-helixtrans-66-30.1176.4-17651.6-148.100112.4R114 D138 V140 R144 K145R114-E142 IonicContact CZ-OE1 3.49Å; R114-E142 PolarHBondContact NE-O 3.12Å; R114-E142 IonicContact NE-OE1 3.44Å; R114-E142 IonicContact NH2-OE1 2.86Å; R114-E142 PolarHBondContact NH2-OE1 3Å; D138-E142 WeakPolarHBondContact O-CB 3.47Å; D138-E142 PolarHBondContact O-N 3.07Å; V140-E142 VanDerWaalsContact C-N 3.32Å; V140-E142 PolarHBondContact O-N 3Å; E142-R144 PolarHBondContact O-N 2.83Å; E142-K145 PolarHBondContact O-N 3.3Å
143G96.6Very high96.7Very high0 Ų032.9 Ų32.90%019%0.189CC..Hα-helixtrans-61.1-20170.200000114.2P113 R114 F117 R120 V139 V140 I141P113-G143 CarbonylContact C-O 3.02Å; P113-G143 WeakPolarHBondContact CA-O 3.23Å; R114-G143 WeakPolarHBondContact CG-O 3.35Å; R114-G143 PolarHBondContact N-O 3.36Å; F117-G143 WeakPolarHBondContact CD2-O 3.41Å; R120-G143 VanDerWaalsContact CD-CA 3.46Å; V139-G143 PolarHBondContact O-N 2.98Å; V140-G143 WeakPolarHBondContact O-CA 3.37Å; V140-G143 PolarHBondContact O-N 2.91Å; V140-G143 VanDerWaalsContact O-N 3.08Å; I141-G143 PolarHBondContact O-N 2.72Å
144R97.4Very high97Very high34 Ų3431.2 Ų31.213%0.12818%0.176CC..THydrogen-bonded Turntrans-962.2178.5-64.3179.8173.7-87.22.2113.8P31 R34 G111 R112 F117 V140 I141 E142P31-R144 HydrophobicContact CG-CB 3.68Å; R34-R144 PolarHBondContact O-NH1 2.9Å; G111-R144 CarbonylContact C-O 3.59Å; G111-R144 VanDerWaalsContact CA-O 3.26Å; G111-R144 WeakPolarHBondContact CA-O 3.32Å; R112-R144 CarbonylContact C-O 3.59Å; R112-R144 PolarHBondContact N-O 3.28Å; R112-R144 CarbonylContact O-C 3.52Å; F117-R144 HydrophobicContact CD2-CG 4.27Å; F117-R144 HydrophobicContact CE2-CG 3.6Å; F117-R144 HydrophobicContact CZ-CG 4.2Å; V140-R144 PolarHBondContact O-N 3.47Å; I141-R144 WeakPolarHBondContact O-CB 3.32Å; I141-R144 PolarHBondContact O-N 2.78Å; E142-R144 PolarHBondContact O-N 2.83Å
145K97.6Very high97.2Very high12 Ų1227.6 Ų27.65%0.05215%0.151CC..  trans-106.746.9-177.6-64.9179.9-178173.70112.3E27 L29 P31 K107 E142E27-K145 PolarHBondContact O-NZ 3.5Å; L29-K145 WeakPolarHBondContact O-CE 3.46Å; L29-K145 PolarHBondContact O-NZ 3.25Å; P31-K145 HydrophobicContact CB-CG 4.17Å; P31-K145 HydrophobicContact CG-CG 3.9Å; K107-K145 HydrophobicContact CB-CB 4.47Å; K107-K145 HydrophobicContact CD-CB 4.31Å; K107-K145 WeakPolarHBondContact CE-O 3.47Å; E142-K145 PolarHBondContact O-N 3.3Å
146S97.9Very high97.4Very high0 Ų028 Ų280%015%0.148CC..  trans-77.1-43.2-175.2-159.80000113.9R112 P113 P148 H207 D211R112-S146 WeakPolarHBondContact O-CB 3.35Å; R112-S146 PolarHBondContact O-N 3.47Å; P113-S146 WeakPolarHBondContact O-CB 3.35Å; S146-P148 CarbonylContact O-C 3.53Å; S146-P148 VanDerWaalsContact O-C 3.27Å; S146-H207 PolarHBondContact O-CE1 3.18Å; S146-H207 PolarHBondContact O-ND1 2.89Å; S146-H207 PolarHBondContact OG-ND1 2.93Å; S146-D211 WeakPolarHBondContact O-CB 3.27Å; S146-D211 PolarHBondContact OG-OD2 2.89Å
147F98.4Very high97.5Very high42 Ų4223.7 Ų23.718%0.18413%0.126CC..SBendtrans-106.4130.1-171.2-178.5-87.3000112.4I106 K107 V110 R112 D211 V214I106-F147 HydrophobicContact CG2-CD1 3.94Å; I106-F147 HydrophobicContact CG2-CE1 3.88Å; K107-F147 WeakPolarHBondContact CA-O 3.29Å; K107-F147 WeakPolarHBondContact CG-O 3.4Å; V110-F147 HydrophobicContact CB-CD1 4.15Å; V110-F147 HydrophobicContact CG1-CB 4.02Å; V110-F147 HydrophobicContact CG1-CD1 3.91Å; V110-F147 HydrophobicContact CG1-CG 4.27Å; V110-F147 HydrophobicContact CG2-CD1 3.9Å; V110-F147 HydrophobicContact CG2-CE1 4.32Å; R112-F147 HydrophobicContact CB-CB 3.79Å; R112-F147 HydrophobicContact CG-CB 4.46Å; F147-D211 WeakPolarHBondContact CB-OD1 3.47Å; F147-D211 HydrophobicContact CD2-CB 4.4Å; F147-D211 VanDerWaalsContact CD2-OD1 3.27Å; F147-D211 WeakPolarHBondContact CD2-OD1 3.38Å; F147-V214 HydrophobicContact CE1-CG1 4.43Å; F147-V214 HydrophobicContact CE2-CB 3.81Å; F147-V214 HydrophobicContact CE2-CG1 4.13Å; F147-V214 HydrophobicContact CE2-CG2 3.73Å; F147-V214 HydrophobicContact CZ-CB 3.9Å; F147-V214 HydrophobicContact CZ-CG1 3.68Å; F147-V214 HydrophobicContact CZ-CG2 3.86Å
148P98.6Very high97.7Very high0 Ų019.4 Ų19.40%010%0.098CC..SBendcis-78.1169.4-14.333-36.3000111.8T103 I106 K107 S146 G150 V214 L218T103-P148 HydrophobicContact CG2-CG 4.33Å; I106-P148 HydrophobicContact CB-CG 4.41Å; I106-P148 VanDerWaalsContact CG2-CD 3.46Å; I106-P148 HydrophobicContact CG2-CG 4.36Å; K107-P148 WeakPolarHBondContact CE-O 3.3Å; S146-P148 CarbonylContact O-C 3.53Å; S146-P148 VanDerWaalsContact O-C 3.27Å; P148-G150 PolarHBondContact O-N 3.48Å; P148-V214 HydrophobicContact CB-CB 4.5Å; P148-V214 HydrophobicContact CB-CG1 4.26Å; P148-L218 HydrophobicContact CG-CD2 4.32Å
149S98.6Very high97.9Very high0 Ų013.6 Ų13.60%07%0.067CC..  trans-68.7115.7176.1173.10000111.3S152 S153 H207 D211S149-S152 PolarHBondContact O-N 3.3Å; S149-S152 WeakPolarHBondContact OG-CB 3.45Å; S149-S152 PolarHBondContact OG-N 3.48Å; S149-S153 WeakPolarHBondContact O-CB 3.28Å; S149-S153 PolarHBondContact O-N 2.87Å; S149-H207 PolarHBondContact OG-CD2 2.99Å; S149-D211 WeakPolarHBondContact CB-O 3.47Å; S149-D211 PolarHBondContact N-O 3.24Å
150G98.1Very high98Very high6 Ų612.1 Ų12.16%0.0626%0.058CC..Hα-helixtrans-64.4-38.917600000113.2P148 S152 S153 F154P148-G150 PolarHBondContact O-N 3.48Å; G150-S152 VanDerWaalsContact C-N 3.33Å; G150-S152 PolarHBondContact O-N 2.99Å; G150-S153 PolarHBondContact O-N 2.93Å; G150-F154 WeakPolarHBondContact O-CB 3.11Å; G150-F154 WeakPolarHBondContact O-CD2 3.2Å; G150-F154 PolarHBondContact O-N 3.43Å
151H98.1Very high98.1Very high14 Ų1411.5 Ų11.57%0.0655%0.054CC..Hα-helixtrans-61.6-44.5176.1-74.366.1000111.1T56 M59 A155 R201T56-H151 PolarHBondContact OG1-CE1 3.07Å; T56-H151 PolarHBondContact OG1-NE2 2.86Å; M59-H151 HydrophobicContact CG-CB 4.29Å; H151-A155 WeakPolarHBondContact O-CB 3.48Å; H151-A155 PolarHBondContact O-N 3.37Å; H151-R201 HydrophobicContact CB-CG 3.81Å
152S98.7Very high98.2Very high0 Ų09.6 Ų9.60%04%0.044CC..Hα-helixtrans-63.3-50.4177.6-170.30000111.2S149 G150 A155 F156 A198 V212 S216S149-S152 PolarHBondContact O-N 3.3Å; S149-S152 WeakPolarHBondContact OG-CB 3.45Å; S149-S152 PolarHBondContact OG-N 3.48Å; G150-S152 VanDerWaalsContact C-N 3.33Å; G150-S152 PolarHBondContact O-N 2.99Å; S152-A155 PolarHBondContact O-N 2.99Å; S152-F156 WeakPolarHBondContact O-CD2 3.32Å; S152-F156 PolarHBondContact O-N 2.98Å; S152-A198 WeakPolarHBondContact OG-CB 3.47Å; S152-V212 PolarHBondContact OG-O 3.46Å; S152-S216 PolarHBondContact OG-N 2.78Å; S152-S216 VanDerWaalsContact OG-N 3.17Å; S152-S216 PolarHBondContact OG-OG 2.97Å
153S98.7Very high98.4Very high0 Ų07.1 Ų7.10%03%0.033CC..Hα-helixtrans-59.5-50-179.1160.40000113.1N99 T103 S149 G150 A157 G215 G219N99-S153 PolarHBondContact ND2-OG 3.29Å; N99-S153 PolarHBondContact OD1-OG 2.98Å; T103-S153 WeakPolarHBondContact OG1-CB 3.5Å; T103-S153 PolarHBondContact OG1-OG 3.38Å; S149-S153 WeakPolarHBondContact O-CB 3.28Å; S149-S153 PolarHBondContact O-N 2.87Å; G150-S153 PolarHBondContact O-N 2.93Å; S153-A157 WeakPolarHBondContact O-CB 3.37Å; S153-A157 PolarHBondContact O-N 2.84Å; S153-G215 WeakPolarHBondContact CA-O 3.44Å; S153-G215 WeakPolarHBondContact CB-O 3.22Å; S153-G219 WeakPolarHBondContact O-CA 3.37Å
154F98.7Very high98.5Very high13 Ų138.1 Ų8.16%0.0574%0.038CC..Hα-helixtrans-68.4-38.3178.9-85.3-77.9000113F23 M59 F60 A63 L96 G150 A157 G158F23-F154 HydrophobicContact CD2-CZ 4.27Å; F23-F154 AromaticContact CE2-CE2 3.87Å; F23-F154 HydrophobicContact CE2-CE2 3.87Å; F23-F154 AromaticContact CE2-CZ 3.59Å; F23-F154 HydrophobicContact CE2-CZ 3.59Å; F23-F154 HydrophobicContact CZ-CE2 4.2Å; F23-F154 AromaticContact CZ-CZ 3.84Å; F23-F154 HydrophobicContact CZ-CZ 3.84Å; M59-F154 HydrophobicContact CE-CB 4.12Å; M59-F154 HydrophobicContact SD-CB 3.46Å; M59-F154 WeakPolarHBondContact SD-CB 3.14Å; M59-F154 HydrophobicContact SD-CG 4.45Å; F60-F154 HydrophobicContact CD1-CD1 4.31Å; F60-F154 HydrophobicContact CD1-CG 4.46Å; F60-F154 AromaticContact CE1-CD1 3.73Å; F60-F154 HydrophobicContact CE1-CD1 3.73Å; F60-F154 AromaticContact CE1-CD2 3.87Å; F60-F154 HydrophobicContact CE1-CD2 3.87Å; F60-F154 AromaticContact CE1-CE1 3.73Å; F60-F154 HydrophobicContact CE1-CE1 3.73Å; F60-F154 AromaticContact CE1-CE2 3.87Å; F60-F154 HydrophobicContact CE1-CE2 3.87Å; F60-F154 AromaticContact CE1-CG 3.8Å; F60-F154 HydrophobicContact CE1-CG 3.8Å; F60-F154 AromaticContact CE1-CZ 3.78Å; F60-F154 HydrophobicContact CE1-CZ 3.78Å; F60-F154 HydrophobicContact CZ-CD2 4.09Å; F60-F154 AromaticContact CZ-CE2 3.98Å; F60-F154 HydrophobicContact CZ-CE2 3.98Å; F60-F154 HydrophobicContact CZ-CG 4.44Å; F60-F154 HydrophobicContact CZ-CZ 4.24Å; A63-F154 WeakPolarHBondContact CB-O 3.34Å; L96-F154 HydrophobicContact CD2-CD1 4.24Å; L96-F154 WeakPolarHBondContact O-CE1 3.37Å; G150-F154 WeakPolarHBondContact O-CB 3.11Å; G150-F154 WeakPolarHBondContact O-CD2 3.2Å; G150-F154 PolarHBondContact O-N 3.43Å; F154-A157 PolarHBondContact O-N 3.28Å; F154-G158 PolarHBondContact O-N 3.24Å
155A98.8Very high98.5Very high1 Ų16.7 Ų6.71%0.0083%0.033CC..Hα-helixtrans-60.4-49.8175.900000111.1H151 S152 A157 L159 A194 I197H151-A155 WeakPolarHBondContact O-CB 3.48Å; H151-A155 PolarHBondContact O-N 3.37Å; S152-A155 PolarHBondContact O-N 2.99Å; A155-A157 PolarHBondContact O-N 3.37Å; A155-L159 WeakPolarHBondContact O-CB 3.16Å; A155-L159 PolarHBondContact O-N 3.47Å; A155-A194 HydrophobicContact CB-CB 4.28Å; A155-I197 HydrophobicContact CB-CB 4.08Å; A155-I197 HydrophobicContact CB-CD1 4.3Å; A155-I197 HydrophobicContact CB-CG2 3.83Å
156F98.8Very high98.5Very high22 Ų226.7 Ų6.710%0.0963%0.033CC..Hα-helixtrans-70.8-27.6177.8-85.3-81.4000113.5S152 G160 A194 A195 A198 S216 L220S152-F156 WeakPolarHBondContact O-CD2 3.32Å; S152-F156 PolarHBondContact O-N 2.98Å; F156-G160 WeakPolarHBondContact O-CA 3.29Å; F156-G160 PolarHBondContact O-N 3.32Å; F156-A194 HydrophobicContact CD1-CB 3.98Å; F156-A194 HydrophobicContact CD2-CB 4.02Å; F156-A194 HydrophobicContact CE1-CB 4.01Å; F156-A194 HydrophobicContact CE2-CB 4.02Å; F156-A194 HydrophobicContact CG-CB 4.01Å; F156-A194 HydrophobicContact CZ-CB 4.03Å; F156-A195 HydrophobicContact CZ-CB 4.16Å; F156-A198 HydrophobicContact CD2-CB 4.36Å; F156-A198 HydrophobicContact CE2-CB 3.8Å; F156-S216 VanDerWaalsContact CD2-CB 3.42Å; F156-S216 VanDerWaalsContact CD2-OG 3.29Å; F156-S216 WeakPolarHBondContact CD2-OG 3.29Å; F156-S216 WeakPolarHBondContact CE2-OG 3.4Å; F156-L220 HydrophobicContact CB-CG 4.21Å; F156-L220 HydrophobicContact CD1-CD1 3.84Å; F156-L220 HydrophobicContact CD1-CD2 3.85Å; F156-L220 HydrophobicContact CD1-CG 3.61Å; F156-L220 HydrophobicContact CE1-CD1 4.16Å; F156-L220 HydrophobicContact CE1-CG 4.41Å; F156-L220 HydrophobicContact CG-CG 4.27Å
157A98.8Very high98.4Very high0 Ų06.7 Ų6.70%03%0.033CC..Hα-helixtrans-66.1-54.1172.900000111.7T95 L96 N99 S153 F154 A155 F161 G219T95-A157 HydrophobicContact CG2-CB 3.94Å; T95-A157 WeakPolarHBondContact CG2-O 3.37Å; L96-A157 HydrophobicContact CD2-CB 4.43Å; N99-A157 HydrophobicContact CB-CB 4.01Å; S153-A157 WeakPolarHBondContact O-CB 3.37Å; S153-A157 PolarHBondContact O-N 2.84Å; F154-A157 PolarHBondContact O-N 3.28Å; A155-A157 PolarHBondContact O-N 3.37Å; A157-F161 VanDerWaalsContact O-CB 3.27Å; A157-F161 WeakPolarHBondContact O-CB 3.35Å; A157-F161 PolarHBondContact O-N 3.46Å; A157-F161 VanDerWaalsContact O-N 3.12Å; A157-G219 WeakPolarHBondContact CA-O 3.46Å
158G98.7Very high98.3Very high0 Ų04.8 Ų4.80%03%0.025CC..Hα-helixtrans-71.8-49.2-17800000113.5A63 F154 T162A63-G158 WeakPolarHBondContact O-CA 3.49Å; F154-G158 PolarHBondContact O-N 3.24Å; G158-T162 PolarHBondContact O-N 2.92Å; G158-T162 PolarHBondContact O-OG1 3.33Å
159L98.8Very high98.1Very high1 Ų15.7 Ų5.71%0.0053%0.029CC..Hα-helixtrans-80.1-29.7-178.2-61.6172.4000112.4V62 T66 A155 T162 A163 P190 I193 A194 I197V62-L159 HydrophobicContact CG1-CD1 3.99Å; V62-L159 HydrophobicContact CG1-CD2 4.06Å; V62-L159 HydrophobicContact CG1-CG 4.36Å; T66-L159 HydrophobicContact CG2-CD2 3.71Å; A155-L159 WeakPolarHBondContact O-CB 3.16Å; A155-L159 PolarHBondContact O-N 3.47Å; L159-T162 WeakPolarHBondContact O-CB 3.42Å; L159-T162 PolarHBondContact O-N 2.84Å; L159-A163 WeakPolarHBondContact O-CB 3.27Å; L159-A163 PolarHBondContact O-N 2.81Å; L159-P190 HydrophobicContact CB-CB 4.04Å; L159-P190 WeakPolarHBondContact CB-O 3.41Å; L159-P190 HydrophobicContact CD2-CB 4.36Å; L159-P190 WeakPolarHBondContact O-CB 3.49Å; L159-I193 HydrophobicContact CD1-CB 4.05Å; L159-I193 HydrophobicContact CD1-CG2 3.71Å; L159-A194 HydrophobicContact CB-CB 4.02Å; L159-A194 HydrophobicContact CD1-CB 3.81Å; L159-I197 HydrophobicContact CD1-CD1 4.23Å
160G98.8Very high97.9Very high1 Ų16.4 Ų6.41%0.013%0.033CC..Hα-helixtrans-65-41.3169.500000111.7F156 T162 A163 L164F156-G160 WeakPolarHBondContact O-CA 3.29Å; F156-G160 PolarHBondContact O-N 3.32Å; G160-T162 VanDerWaalsContact C-N 3.34Å; G160-T162 PolarHBondContact O-N 3.41Å; G160-A163 WeakPolarHBondContact O-CB 3.48Å; G160-A163 PolarHBondContact O-N 2.76Å; G160-L164 WeakPolarHBondContact O-CG 3.44Å; G160-L164 PolarHBondContact O-N 2.93Å
161F98.8Very high97.7Very high0 Ų010 Ų100%05%0.045CC..Hα-helixtrans-61.5-45171.1-179.9-87.2000111.1P67 I71 A91 V92 A157 A163 L164 Y165 A223 Y227P67-F161 HydrophobicContact CB-CD1 4.3Å; I71-F161 HydrophobicContact CD1-CE1 4.3Å; A91-F161 HydrophobicContact CB-CE2 3.47Å; A91-F161 VanDerWaalsContact CB-CE2 3.47Å; A91-F161 HydrophobicContact CB-CZ 3.68Å; V92-F161 HydrophobicContact CB-CD1 3.66Å; V92-F161 HydrophobicContact CB-CE1 3.67Å; V92-F161 HydrophobicContact CB-CG 4.15Å; V92-F161 HydrophobicContact CB-CZ 4.14Å; V92-F161 HydrophobicContact CG2-CB 4.45Å; V92-F161 HydrophobicContact CG2-CD1 3.68Å; V92-F161 HydrophobicContact CG2-CE1 4.21Å; V92-F161 HydrophobicContact CG2-CG 4.08Å; A157-F161 VanDerWaalsContact O-CB 3.27Å; A157-F161 WeakPolarHBondContact O-CB 3.35Å; A157-F161 PolarHBondContact O-N 3.46Å; A157-F161 VanDerWaalsContact O-N 3.12Å; F161-A163 VanDerWaalsContact C-N 3.29Å; F161-A163 PolarHBondContact O-N 3.41Å; F161-L164 PolarHBondContact O-N 3.23Å; F161-Y165 WeakPolarHBondContact O-CB 3.41Å; F161-Y165 PolarHBondContact O-N 3.41Å; F161-A223 HydrophobicContact CB-CB 4.12Å; F161-Y227 HydrophobicContact CE2-CD2 4.2Å
162T98.7Very high97.5Very high2 Ų29.9 Ų9.91%0.0125%0.045CC..Hα-helixtrans-55-45.7175.2-57.10000111.5T66 P67 I70 G158 L159 G160 Y165 I166 P190T66-T162 HydrophobicContact CG2-CG2 4.19Å; P67-T162 WeakPolarHBondContact CA-OG1 3.49Å; P67-T162 VanDerWaalsContact CB-OG1 3.31Å; P67-T162 WeakPolarHBondContact CB-OG1 3.33Å; I70-T162 HydrophobicContact CB-CG2 4.26Å; I70-T162 HydrophobicContact CG1-CG2 3.91Å; I70-T162 HydrophobicContact CG2-CG2 4.31Å; G158-T162 PolarHBondContact O-N 2.92Å; G158-T162 PolarHBondContact O-OG1 3.33Å; L159-T162 WeakPolarHBondContact O-CB 3.42Å; L159-T162 PolarHBondContact O-N 2.84Å; G160-T162 VanDerWaalsContact C-N 3.34Å; G160-T162 PolarHBondContact O-N 3.41Å; T162-Y165 PolarHBondContact O-N 2.79Å; T162-I166 HydrophobicContact CG2-CD1 3.85Å; T162-I166 HydrophobicContact CG2-CG1 4.42Å; T162-I166 WeakPolarHBondContact O-CB 3.2Å; T162-I166 VanDerWaalsContact O-CG1 3.29Å; T162-I166 WeakPolarHBondContact O-CG1 3.3Å; T162-I166 PolarHBondContact O-N 2.88Å; T162-P190 HydrophobicContact CG2-CB 4.26Å; T162-P190 HydrophobicContact CG2-CG 3.94Å
163A98.7Very high97.2Very high1 Ų113.2 Ų13.21%0.0086%0.06CC..Hα-helixtrans-59.9-52.6177.300000111L159 G160 F161 Y165 I166 A167 F187 P190 L191L159-A163 WeakPolarHBondContact O-CB 3.27Å; L159-A163 PolarHBondContact O-N 2.81Å; G160-A163 WeakPolarHBondContact O-CB 3.48Å; G160-A163 PolarHBondContact O-N 2.76Å; F161-A163 VanDerWaalsContact C-N 3.29Å; F161-A163 PolarHBondContact O-N 3.41Å; A163-Y165 VanDerWaalsContact C-N 3.3Å; A163-Y165 PolarHBondContact O-N 2.91Å; A163-I166 PolarHBondContact O-N 2.99Å; A163-A167 WeakPolarHBondContact O-CB 3.44Å; A163-A167 PolarHBondContact O-N 3.12Å; A163-F187 HydrophobicContact CB-CD2 3.81Å; A163-F187 HydrophobicContact CB-CE2 3.8Å; A163-F187 VanDerWaalsContact CB-O 3.32Å; A163-F187 WeakPolarHBondContact CB-O 3.35Å; A163-F187 VanDerWaalsContact O-CD2 3.3Å; A163-F187 WeakPolarHBondContact O-CD2 3.17Å; A163-P190 HydrophobicContact CB-CB 4.28Å; A163-P190 HydrophobicContact CB-CG 4.44Å; A163-L191 HydrophobicContact CB-CD1 4.26Å; A163-L191 HydrophobicContact CB-CD2 3.86Å; A163-L191 HydrophobicContact CB-CG 3.74Å
164L98.5Very high96.8Very high22 Ų2213.2 Ų13.212%0.1156%0.06CC..Hα-helixtrans-57.2-43.6178.2-67.8172.7000112.1G160 F161 A167 G168 A223 W224 Y227 L234G160-L164 WeakPolarHBondContact O-CG 3.44Å; G160-L164 PolarHBondContact O-N 2.93Å; F161-L164 PolarHBondContact O-N 3.23Å; L164-A167 PolarHBondContact O-N 2.92Å; L164-G168 PolarHBondContact O-N 2.69Å; L164-A223 HydrophobicContact CD1-CB 4.31Å; L164-W224 HydrophobicContact CD1-CB 4.21Å; L164-Y227 HydrophobicContact CB-CD1 4.33Å; L164-Y227 HydrophobicContact CB-CD2 3.77Å; L164-Y227 HydrophobicContact CB-CE2 4.11Å; L164-Y227 HydrophobicContact CB-CG 3.9Å; L164-Y227 HydrophobicContact CD1-CG 4.17Å; L164-L234 HydrophobicContact CD2-CD1 3.91Å
165Y98.1Very high96.2Very high3 Ų317.6 Ų17.61%0.0129%0.089CC..Hα-helixtrans-63.2-47177.5-180-99.9000112.1I70 I71 F74 D84 A88 F161 T162 A163 A167 G168 K169 F231I70-Y165 HydrophobicContact CG2-CD1 3.92Å; I70-Y165 HydrophobicContact CG2-CE1 4.08Å; I71-Y165 HydrophobicContact CB-CE1 4.4Å; I71-Y165 HydrophobicContact CG1-CD1 4.21Å; I71-Y165 HydrophobicContact CG1-CE1 3.85Å; I71-Y165 HydrophobicContact CG1-CE2 4.3Å; F74-Y165 HydrophobicContact CB-CE1 4.31Å; F74-Y165 HydrophobicContact CD2-CE1 4.19Å; F74-Y165 HydrophobicContact CG-CE1 4.35Å; D84-Y165 PolarHBondContact OD2-OH 3.29Å; A88-Y165 HydrophobicContact CB-CD2 4.16Å; A88-Y165 HydrophobicContact CB-CE2 3.68Å; F161-Y165 WeakPolarHBondContact O-CB 3.41Å; F161-Y165 PolarHBondContact O-N 3.41Å; T162-Y165 PolarHBondContact O-N 2.79Å; A163-Y165 VanDerWaalsContact C-N 3.3Å; A163-Y165 PolarHBondContact O-N 2.91Å; Y165-A167 VanDerWaalsContact C-N 3.29Å; Y165-A167 PolarHBondContact O-N 3.4Å; Y165-G168 PolarHBondContact O-N 3.28Å; Y165-K169 HydrophobicContact CD1-CG 4.27Å; Y165-K169 HydrophobicContact CD2-CG 4.43Å; Y165-K169 HydrophobicContact CE1-CG 3.92Å; Y165-K169 HydrophobicContact CE2-CD 4.33Å; Y165-K169 HydrophobicContact CE2-CG 4.09Å; Y165-K169 VanDerWaalsContact CZ-CE 3.43Å; Y165-K169 WeakPolarHBondContact O-CB 3.46Å; Y165-K169 VanDerWaalsContact O-CG 3.29Å; Y165-K169 WeakPolarHBondContact O-CG 3.21Å; Y165-K169 PolarHBondContact O-N 3Å; Y165-K169 WeakPolarHBondContact OH-CE 3.44Å; Y165-F231 HydrophobicContact CD2-CZ 4.15Å; Y165-F231 HydrophobicContact CE2-CE1 4.42Å; Y165-F231 HydrophobicContact CE2-CZ 4.06Å
166I97.4Very high95.3Very high13 Ų1320.4 Ų20.47%0.06711%0.113CC..Hα-helixtrans-58.8-43.2173.5-70.6171.9000110.4I70 F74 T162 A163 G168 K169 L170 A186 P190I70-I166 HydrophobicContact CD1-CD1 4.45Å; I70-I166 HydrophobicContact CG2-CD1 4.14Å; I70-I166 HydrophobicContact CG2-CG1 3.8Å; F74-I166 HydrophobicContact CE2-CG1 4.25Å; T162-I166 HydrophobicContact CG2-CD1 3.85Å; T162-I166 HydrophobicContact CG2-CG1 4.42Å; T162-I166 WeakPolarHBondContact O-CB 3.2Å; T162-I166 VanDerWaalsContact O-CG1 3.29Å; T162-I166 WeakPolarHBondContact O-CG1 3.3Å; T162-I166 PolarHBondContact O-N 2.88Å; A163-I166 PolarHBondContact O-N 2.99Å; I166-G168 PolarHBondContact O-N 3.17Å; I166-K169 PolarHBondContact O-N 3.47Å; I166-L170 HydrophobicContact CG2-CD1 3.63Å; I166-L170 HydrophobicContact CG2-CG 4.15Å; I166-L170 WeakPolarHBondContact O-CB 3.42Å; I166-L170 WeakPolarHBondContact O-CG 3.21Å; I166-L170 PolarHBondContact O-N 3.34Å; I166-A186 HydrophobicContact CG2-CB 3.97Å; I166-P190 HydrophobicContact CD1-CG 4.04Å
167A96.8Very high94.3Very high0 Ų019.4 Ų19.40%011%0.109CC..Hα-helixtrans-61.9-42.8179.500000112.9A163 L164 Y165 R171 C172 F173 F187 L234A163-A167 WeakPolarHBondContact O-CB 3.44Å; A163-A167 PolarHBondContact O-N 3.12Å; L164-A167 PolarHBondContact O-N 2.92Å; Y165-A167 VanDerWaalsContact C-N 3.29Å; Y165-A167 PolarHBondContact O-N 3.4Å; A167-R171 WeakPolarHBondContact O-CA 3.42Å; A167-R171 PolarHBondContact O-N 3.36Å; A167-C172 HydrophobicContact CB-CB 4.15Å; A167-C172 PolarHBondContact O-N 2.75Å; A167-F173 HydrophobicContact CB-CD2 4.29Å; A167-F173 HydrophobicContact CB-CE2 4.13Å; A167-F187 HydrophobicContact CB-CB 4.47Å; A167-F187 HydrophobicContact CB-CD2 3.59Å; A167-F187 HydrophobicContact CB-CE2 4.12Å; A167-F187 HydrophobicContact CB-CG 4.24Å; A167-L234 HydrophobicContact CB-CD1 3.96Å; A167-L234 HydrophobicContact CB-CD2 3.94Å
168G95.5Very high93.7Very high1 Ų126 Ų261%0.0114%0.14CC..Hα-helixtrans-63.6-49.517400000111.7L164 Y165 I166 L170 R171 H240L164-G168 PolarHBondContact O-N 2.69Å; Y165-G168 PolarHBondContact O-N 3.28Å; I166-G168 PolarHBondContact O-N 3.17Å; G168-L170 PolarHBondContact O-N 2.87Å; G168-R171 PolarHBondContact O-N 3.38Å; G168-H240 WeakPolarHBondContact O-CA 3.26Å; G168-H240 WeakPolarHBondContact O-CB 3.1Å; G168-H240 PolarHBondContact O-N 2.67Å
169K95Very high93.2Very high19 Ų1929.9 Ų29.98%0.08318%0.179CC..Hα-helixtrans-65-38-177.7-66.8-65.8169.5-171.30113.9F74 S80 D84 Y165 I166 R171 H240F74-K169 HydrophobicContact CD1-CB 3.64Å; F74-K169 HydrophobicContact CD1-CD 4.36Å; F74-K169 HydrophobicContact CD1-CG 3.93Å; F74-K169 HydrophobicContact CE1-CB 3.41Å; F74-K169 VanDerWaalsContact CE1-CB 3.41Å; F74-K169 HydrophobicContact CE1-CG 4.18Å; F74-K169 HydrophobicContact CG-CB 4.41Å; F74-K169 HydrophobicContact CG-CG 4.31Å; F74-K169 HydrophobicContact CZ-CB 4.01Å; S80-K169 PolarHBondContact OG-NZ 2.91Å; D84-K169 WeakPolarHBondContact OD1-CE 3.36Å; D84-K169 IonicContact OD1-NZ 2.74Å; D84-K169 PolarHBondContact OD1-NZ 3.38Å; D84-K169 WeakPolarHBondContact OD2-CE 3.44Å; D84-K169 IonicContact OD2-NZ 3.35Å; D84-K169 PolarHBondContact OD2-NZ 2.95Å; D84-K169 VanDerWaalsContact OD2-NZ 3.1Å; Y165-K169 HydrophobicContact CD1-CG 4.27Å; Y165-K169 HydrophobicContact CD2-CG 4.43Å; Y165-K169 HydrophobicContact CE1-CG 3.92Å; Y165-K169 HydrophobicContact CE2-CD 4.33Å; Y165-K169 HydrophobicContact CE2-CG 4.09Å; Y165-K169 VanDerWaalsContact CZ-CE 3.43Å; Y165-K169 WeakPolarHBondContact O-CB 3.46Å; Y165-K169 VanDerWaalsContact O-CG 3.29Å; Y165-K169 WeakPolarHBondContact O-CG 3.21Å; Y165-K169 PolarHBondContact O-N 3Å; Y165-K169 WeakPolarHBondContact OH-CE 3.44Å; I166-K169 PolarHBondContact O-N 3.47Å; K169-R171 VanDerWaalsContact C-N 3.28Å; K169-H240 PolarHBondContact NZ-O 3.46Å
170L94.6Very high92.8Very high16 Ų1636 Ų368%0.08420%0.203CC..THydrogen-bonded Turntrans-85.5-3.4176.2-61.2-175.8000112.9F74 I166 G168 C172 W182 R183 A186F74-L170 HydrophobicContact CE1-CD2 3.89Å; F74-L170 HydrophobicContact CE1-CG 4.41Å; F74-L170 HydrophobicContact CZ-CD2 3.9Å; F74-L170 HydrophobicContact CZ-CG 4.12Å; I166-L170 HydrophobicContact CG2-CD1 3.63Å; I166-L170 HydrophobicContact CG2-CG 4.15Å; I166-L170 WeakPolarHBondContact O-CB 3.42Å; I166-L170 WeakPolarHBondContact O-CG 3.21Å; I166-L170 PolarHBondContact O-N 3.34Å; G168-L170 PolarHBondContact O-N 2.87Å; L170-C172 PolarHBondContact O-N 2.92Å; L170-W182 HydrophobicContact CD1-CE3 4.43Å; L170-W182 HydrophobicContact CD1-CH2 4.3Å; L170-W182 HydrophobicContact CD1-CZ3 3.69Å; L170-W182 HydrophobicContact CD2-CH2 3.92Å; L170-W182 HydrophobicContact CD2-CZ3 4.01Å; L170-W182 HydrophobicContact CG-CZ3 4.43Å; L170-R183 HydrophobicContact CB-CG 4.3Å; L170-R183 VanDerWaalsContact O-CD 3.3Å; L170-R183 WeakPolarHBondContact O-CD 3.48Å; L170-R183 VanDerWaalsContact O-CZ 3.26Å; L170-R183 PolarHBondContact O-NE 3.5Å; L170-R183 PolarHBondContact O-NH1 2.96Å; L170-A186 HydrophobicContact CD1-CB 3.82Å
171R93.5Very high92.6Very high82 Ų8239.5 Ų39.531%0.30923%0.231SC..THydrogen-bonded Turntrans53.543-176.7-57.7-171.7-167.7171.33.2111.5A167 G168 K169 F173 S174 G177 H240A167-R171 WeakPolarHBondContact O-CA 3.42Å; A167-R171 PolarHBondContact O-N 3.36Å; G168-R171 PolarHBondContact O-N 3.38Å; K169-R171 VanDerWaalsContact C-N 3.28Å; R171-F173 PolarHBondContact O-N 3.04Å; R171-S174 PolarHBondContact O-N 2.89Å; R171-G177 CarbonylContact O-C 3.52Å; R171-G177 VanDerWaalsContact O-CA 3.31Å; R171-G177 WeakPolarHBondContact O-CA 3.49Å; R171-H240 HydrophobicContact CG-CB 4.24Å; R171-H240 VanDerWaalsContact CZ-CE1 3.48Å; R171-H240 PolarHBondContact NE-ND1 3.27Å; R171-H240 VanDerWaalsContact NE-ND1 3.15Å; R171-H240 PolarHBondContact NH2-CE1 3.14Å; R171-H240 PolarHBondContact NH2-ND1 3.33Å; R171-H240 PolarHBondContact NH2-NE2 2.94Å
172C93.4Very high92.4Very high11 Ų1146 Ų467%0.07426%0.256CS..THydrogen-bonded Turntrans-55.4-37.5-171.8-69.50000113.5A167 L170 R183A167-C172 HydrophobicContact CB-CB 4.15Å; A167-C172 PolarHBondContact O-N 2.75Å; L170-C172 PolarHBondContact O-N 2.92Å; C172-R183 HydrophobicContact CB-CB 4.5Å; C172-R183 VanDerWaalsContact SG-CB 3.58Å; C172-R183 PolarHBondContact SG-O 3.33Å
173F92.6Very high92.2Very high69 Ų6947.6 Ų47.630%0.30326%0.261SS..THydrogen-bonded Turntrans-1168.4-173.7-57.3-73000113.3A167 R171 L184 F187 L234 Q235A167-F173 HydrophobicContact CB-CD2 4.29Å; A167-F173 HydrophobicContact CB-CE2 4.13Å; R171-F173 PolarHBondContact O-N 3.04Å; F173-L184 HydrophobicContact CE1-CD1 4.44Å; F173-L184 HydrophobicContact CZ-CD1 4.19Å; F173-F187 HydrophobicContact CE2-CD1 4.2Å; F173-F187 HydrophobicContact CE2-CE1 4.19Å; F173-F187 HydrophobicContact CE2-CG 4.36Å; F173-F187 HydrophobicContact CE2-CZ 4.35Å; F173-F187 HydrophobicContact CZ-CD1 4.01Å; F173-F187 AromaticContact CZ-CE1 3.99Å; F173-F187 HydrophobicContact CZ-CE1 3.99Å; F173-L234 CarbonylContact C-O 3.43Å; F173-L234 HydrophobicContact CB-CB 4.21Å; F173-L234 HydrophobicContact CD2-CB 4.05Å; F173-L234 HydrophobicContact CD2-CD1 3.86Å; F173-L234 HydrophobicContact CE2-CD1 4.15Å; F173-Q235 WeakPolarHBondContact O-CA 3.3Å
174S90.3Very high92Very high0 Ų051.3 Ų51.30%028%0.281CS..SBendtrans-85.2151.21761760000110.1R171 A176 G177 Q178 D236 P237R171-S174 PolarHBondContact O-N 2.89Å; S174-A176 PolarHBondContact O-N 3.29Å; S174-A176 VanDerWaalsContact O-N 3.09Å; S174-G177 CarbonylContact O-C 3.6Å; S174-G177 PolarHBondContact O-N 3.1Å; S174-Q178 PolarHBondContact O-N 2.88Å; S174-D236 PolarHBondContact OG-O 2.86Å; S174-P237 WeakPolarHBondContact OG-CA 3.47Å
175P85.7Confident92Very high105 Ų10553.8 Ų53.868%0.68230%0.299SS*.THydrogen-bonded Turntrans-52.6-33.4174.9-27.534.7000113.6G177 Q235P175-G177 PolarHBondContact O-N 3.31Å; P175-Q235 WeakPolarHBondContact CD-O 3.38Å
176A81.1Confident91.9Very high61 Ų6155 Ų5550%0.50431%0.31SS..THydrogen-bonded Turntrans-71-11178.300000113.9S174S174-A176 PolarHBondContact O-N 3.29Å; S174-A176 VanDerWaalsContact O-N 3.09Å
177G77.3Confident91.9Very high1 Ų155.8 Ų55.81%0.0131%0.313CS..THydrogen-bonded Turntrans-144.8-2.8-16800000119R171 S174 P175 R183R171-G177 CarbonylContact O-C 3.52Å; R171-G177 VanDerWaalsContact O-CA 3.31Å; R171-G177 WeakPolarHBondContact O-CA 3.49Å; S174-G177 CarbonylContact O-C 3.6Å; S174-G177 PolarHBondContact O-N 3.1Å; P175-G177 PolarHBondContact O-N 3.31Å; G177-R183 PolarHBondContact O-NH1 3.17Å
178Q86.1Confident92Very high138 Ų13859.7 Ų59.765%0.64533%0.333SS*.THydrogen-bonded Turntrans-61.4155.1173.6-167172.60.100111.9S174S174-Q178 PolarHBondContact O-N 2.88Å
179G87.1Confident92.1Very high81 Ų8163.1 Ų63.184%0.83535%0.354SS*.THydrogen-bonded Turntrans87.24.7174.400000116.1
180R91.8Very high92.3Very high131 Ų13162.7 Ų62.749%0.49435%0.353SS..  trans-106.4108.6179.7-57.8-174.2-169.8-169.70.5111.7W182 R183R180-W182 PolarHBondContact O-N 2.86Å; R180-R183 HydrophobicContact CB-CG 4.08Å; R180-R183 WeakPolarHBondContact O-CB 3.32Å; R180-R183 PolarHBondContact O-N 3.48Å; R180-R183 VanDerWaalsContact O-N 3.13Å
181A93.9Very high92.5Very high73 Ų7363.6 Ų63.660%0.60336%0.358SS*.Hα-helixtrans-55.2-43.1-175.100000114R183 L184 C185A181-R183 PolarHBondContact O-N 3.2Å; A181-R183 VanDerWaalsContact O-N 3.15Å; A181-L184 WeakPolarHBondContact O-CA 3.47Å; A181-L184 WeakPolarHBondContact O-CB 3.35Å; A181-L184 PolarHBondContact O-N 3.45Å; A181-C185 PolarHBondContact O-N 3.03Å; A181-C185 PolarHBondContact O-SG 2.91Å; A181-C185 VanDerWaalsContact O-SG 3.35Å
182W95Very high92.7Very high137 Ų13765.2 Ų65.252%0.51937%0.372SS..Hα-helixtrans-60-30.3-178.672.6-95.9000113.5L170 R180 A186L170-W182 HydrophobicContact CD1-CE3 4.43Å; L170-W182 HydrophobicContact CD1-CH2 4.3Å; L170-W182 HydrophobicContact CD1-CZ3 3.69Å; L170-W182 HydrophobicContact CD2-CH2 3.92Å; L170-W182 HydrophobicContact CD2-CZ3 4.01Å; L170-W182 HydrophobicContact CG-CZ3 4.43Å; R180-W182 PolarHBondContact O-N 2.86Å; W182-A186 WeakPolarHBondContact O-CB 3.45Å; W182-A186 PolarHBondContact O-N 3.3Å
183R94.6Very high93Very high35 Ų3568.4 Ų68.413%0.13239%0.388CS..Hα-helixtrans-71.6-39.6177-63.8-173170.9170.4-9111.1L170 C172 G177 R180 A181 A186 F187L170-R183 HydrophobicContact CB-CG 4.3Å; L170-R183 VanDerWaalsContact O-CD 3.3Å; L170-R183 WeakPolarHBondContact O-CD 3.48Å; L170-R183 VanDerWaalsContact O-CZ 3.26Å; L170-R183 PolarHBondContact O-NE 3.5Å; L170-R183 PolarHBondContact O-NH1 2.96Å; C172-R183 HydrophobicContact CB-CB 4.5Å; C172-R183 VanDerWaalsContact SG-CB 3.58Å; C172-R183 PolarHBondContact SG-O 3.33Å; G177-R183 PolarHBondContact O-NH1 3.17Å; R180-R183 HydrophobicContact CB-CG 4.08Å; R180-R183 WeakPolarHBondContact O-CB 3.32Å; R180-R183 PolarHBondContact O-N 3.48Å; R180-R183 VanDerWaalsContact O-N 3.13Å; A181-R183 PolarHBondContact O-N 3.2Å; A181-R183 VanDerWaalsContact O-N 3.15Å; R183-A186 PolarHBondContact O-N 2.87Å; R183-F187 PolarHBondContact O-N 3.43Å
184L95Very high93.2Very high79 Ų7965.1 Ų65.141%0.41437%0.373SS..Hα-helixtrans-64.9-44.4173-176.964.8000110.7F173 A181 A186 F187 L188F173-L184 HydrophobicContact CE1-CD1 4.44Å; F173-L184 HydrophobicContact CZ-CD1 4.19Å; A181-L184 WeakPolarHBondContact O-CA 3.47Å; A181-L184 WeakPolarHBondContact O-CB 3.35Å; A181-L184 PolarHBondContact O-N 3.45Å; L184-A186 VanDerWaalsContact C-N 3.33Å; L184-A186 PolarHBondContact O-N 3.34Å; L184-F187 HydrophobicContact CD1-CD1 4.09Å; L184-F187 WeakPolarHBondContact O-CB 3.34Å; L184-F187 PolarHBondContact O-N 3.17Å; L184-F187 VanDerWaalsContact O-N 3.17Å; L184-L188 HydrophobicContact CD1-CD1 4.15Å; L184-L188 HydrophobicContact CD1-CG 4.18Å; L184-L188 HydrophobicContact CD2-CD1 4.46Å; L184-L188 HydrophobicContact CG-CD1 3.89Å; L184-L188 HydrophobicContact CG-CG 4.3Å; L184-L188 WeakPolarHBondContact O-CB 3.45Å; L184-L188 WeakPolarHBondContact O-CG 3.45Å; L184-L188 PolarHBondContact O-N 2.95Å
185C97.1Very high93.6Very high75 Ų7566.4 Ų66.451%0.50738%0.384SS..Hα-helixtrans-59.2-43.7175.1-62.30000111.7A181 F187 L188 T189A181-C185 PolarHBondContact O-N 3.03Å; A181-C185 PolarHBondContact O-SG 2.91Å; A181-C185 VanDerWaalsContact O-SG 3.35Å; C185-F187 VanDerWaalsContact C-N 3.32Å; C185-F187 PolarHBondContact O-N 3.01Å; C185-L188 PolarHBondContact O-N 3.41Å; C185-T189 WeakPolarHBondContact O-CB 3.48Å; C185-T189 PolarHBondContact O-N 3.47Å; C185-T189 PolarHBondContact O-OG1 2.97Å
186A96.8Very high94.3Very high29 Ų2965.7 Ų65.724%0.2438%0.378CS..Hα-helixtrans-62.4-38176.300000112.6I166 L170 W182 R183 L184 P190I166-A186 HydrophobicContact CG2-CB 3.97Å; L170-A186 HydrophobicContact CD1-CB 3.82Å; W182-A186 WeakPolarHBondContact O-CB 3.45Å; W182-A186 PolarHBondContact O-N 3.3Å; R183-A186 PolarHBondContact O-N 2.87Å; L184-A186 VanDerWaalsContact C-N 3.33Å; L184-A186 PolarHBondContact O-N 3.34Å; A186-P190 WeakPolarHBondContact O-CD 3.39Å
187F97Very high95.1Very high29 Ų2963.2 Ų63.213%0.12736%0.356CS..Hα-helixtrans-67.1-43173.8165-108.4000113A163 A167 F173 R183 L184 C185 P190 L191A163-F187 HydrophobicContact CB-CD2 3.81Å; A163-F187 HydrophobicContact CB-CE2 3.8Å; A163-F187 VanDerWaalsContact CB-O 3.32Å; A163-F187 WeakPolarHBondContact CB-O 3.35Å; A163-F187 VanDerWaalsContact O-CD2 3.3Å; A163-F187 WeakPolarHBondContact O-CD2 3.17Å; A167-F187 HydrophobicContact CB-CB 4.47Å; A167-F187 HydrophobicContact CB-CD2 3.59Å; A167-F187 HydrophobicContact CB-CE2 4.12Å; A167-F187 HydrophobicContact CB-CG 4.24Å; F173-F187 HydrophobicContact CE2-CD1 4.2Å; F173-F187 HydrophobicContact CE2-CE1 4.19Å; F173-F187 HydrophobicContact CE2-CG 4.36Å; F173-F187 HydrophobicContact CE2-CZ 4.35Å; F173-F187 HydrophobicContact CZ-CD1 4.01Å; F173-F187 AromaticContact CZ-CE1 3.99Å; F173-F187 HydrophobicContact CZ-CE1 3.99Å; R183-F187 PolarHBondContact O-N 3.43Å; L184-F187 HydrophobicContact CD1-CD1 4.09Å; L184-F187 WeakPolarHBondContact O-CB 3.34Å; L184-F187 PolarHBondContact O-N 3.17Å; L184-F187 VanDerWaalsContact O-N 3.17Å; C185-F187 VanDerWaalsContact C-N 3.32Å; C185-F187 PolarHBondContact O-N 3.01Å; F187-P190 WeakPolarHBondContact O-CD 3.4Å; F187-L191 HydrophobicContact CE1-CD1 4.06Å; F187-L191 HydrophobicContact CE2-CD1 4.3Å; F187-L191 HydrophobicContact CZ-CD1 3.83Å
188L98Very high96.1Very high81 Ų8163.3 Ų63.342%0.42436%0.356SS..Hα-helixtrans-76.4-26.2-176.4-69176.9000113.1L184 C185 L191 L192L184-L188 HydrophobicContact CD1-CD1 4.15Å; L184-L188 HydrophobicContact CD1-CG 4.18Å; L184-L188 HydrophobicContact CD2-CD1 4.46Å; L184-L188 HydrophobicContact CG-CD1 3.89Å; L184-L188 HydrophobicContact CG-CG 4.3Å; L184-L188 WeakPolarHBondContact O-CB 3.45Å; L184-L188 WeakPolarHBondContact O-CG 3.45Å; L184-L188 PolarHBondContact O-N 2.95Å; C185-L188 PolarHBondContact O-N 3.41Å; L188-L191 HydrophobicContact CD2-CD1 4.37Å; L188-L191 WeakPolarHBondContact O-CB 3.46Å; L188-L191 PolarHBondContact O-N 2.89Å; L188-L191 VanDerWaalsContact O-N 3.1Å; L188-L192 PolarHBondContact O-N 3.15Å
189T98.5Very high96.7Very high74 Ų7461.5 Ų61.545%0.45435%0.35SS..Hα-helixtrans-57.3-50.2-175.4-61.50000113.1C185 L191 L192 I193C185-T189 WeakPolarHBondContact O-CB 3.48Å; C185-T189 PolarHBondContact O-N 3.47Å; C185-T189 PolarHBondContact O-OG1 2.97Å; T189-L191 VanDerWaalsContact C-N 3.28Å; T189-L191 PolarHBondContact O-N 3.03Å; T189-L192 PolarHBondContact O-N 3.42Å; T189-I193 HydrophobicContact CG2-CD1 4.13Å; T189-I193 WeakPolarHBondContact O-CG1 3.37Å; T189-I193 PolarHBondContact O-N 3.27Å
190P98.6Very high97.2Very high9 Ų958.1 Ų58.16%0.05831%0.314CS..Hα-helixtrans-60.2-36.5175.2-22.332.1000113.2L159 T162 A163 I166 A186 F187 I193 A194L159-P190 HydrophobicContact CB-CB 4.04Å; L159-P190 WeakPolarHBondContact CB-O 3.41Å; L159-P190 HydrophobicContact CD2-CB 4.36Å; L159-P190 WeakPolarHBondContact O-CB 3.49Å; T162-P190 HydrophobicContact CG2-CB 4.26Å; T162-P190 HydrophobicContact CG2-CG 3.94Å; A163-P190 HydrophobicContact CB-CB 4.28Å; A163-P190 HydrophobicContact CB-CG 4.44Å; I166-P190 HydrophobicContact CD1-CG 4.04Å; A186-P190 WeakPolarHBondContact O-CD 3.39Å; F187-P190 WeakPolarHBondContact O-CD 3.4Å; P190-I193 PolarHBondContact O-N 3.36Å; P190-A194 WeakPolarHBondContact O-CB 3.24Å; P190-A194 PolarHBondContact O-N 3.05Å
191L98.7Very high97.5Very high36 Ų3652.1 Ų52.119%0.18829%0.291CS..Hα-helixtrans-67.9-37.9178.2-62178.8000111.9A163 F187 L188 T189 A194 A195 L220A163-L191 HydrophobicContact CB-CD1 4.26Å; A163-L191 HydrophobicContact CB-CD2 3.86Å; A163-L191 HydrophobicContact CB-CG 3.74Å; F187-L191 HydrophobicContact CE1-CD1 4.06Å; F187-L191 HydrophobicContact CE2-CD1 4.3Å; F187-L191 HydrophobicContact CZ-CD1 3.83Å; L188-L191 HydrophobicContact CD2-CD1 4.37Å; L188-L191 WeakPolarHBondContact O-CB 3.46Å; L188-L191 PolarHBondContact O-N 2.89Å; L188-L191 VanDerWaalsContact O-N 3.1Å; T189-L191 VanDerWaalsContact C-N 3.28Å; T189-L191 PolarHBondContact O-N 3.03Å; L191-A194 WeakPolarHBondContact O-CB 3.45Å; L191-A194 PolarHBondContact O-N 3.01Å; L191-A195 WeakPolarHBondContact O-CB 3.39Å; L191-A195 PolarHBondContact O-N 2.97Å; L191-L220 HydrophobicContact CD2-CD2 3.98Å
192L98.6Very high97.6Very high116 Ų11650.9 Ų50.961%0.60728%0.276SS*.Hα-helixtrans-64.1-44.4174.3179.562.5000111L188 T189 A194 A195 V196L188-L192 PolarHBondContact O-N 3.15Å; T189-L192 PolarHBondContact O-N 3.42Å; L192-A194 VanDerWaalsContact C-N 3.31Å; L192-A194 PolarHBondContact O-N 3.28Å; L192-A195 WeakPolarHBondContact O-CB 3.36Å; L192-A195 PolarHBondContact O-N 3.13Å; L192-V196 WeakPolarHBondContact O-CG2 3.29Å; L192-V196 PolarHBondContact O-N 3.35Å
193I98.6Very high97.6Very high77 Ų7747.7 Ų47.740%0.39528%0.275SS..Hα-helixtrans-60.8-43.1175.4-64.1167.1000110.4V62 L159 T189 P190 A195 V196 I197V62-I193 HydrophobicContact CG1-CG2 4.44Å; L159-I193 HydrophobicContact CD1-CB 4.05Å; L159-I193 HydrophobicContact CD1-CG2 3.71Å; T189-I193 HydrophobicContact CG2-CD1 4.13Å; T189-I193 WeakPolarHBondContact O-CG1 3.37Å; T189-I193 PolarHBondContact O-N 3.27Å; P190-I193 PolarHBondContact O-N 3.36Å; I193-A195 VanDerWaalsContact C-N 3.32Å; I193-A195 PolarHBondContact O-N 2.94Å; I193-V196 PolarHBondContact O-N 2.7Å; I193-I197 HydrophobicContact CG2-CD1 4.12Å; I193-I197 WeakPolarHBondContact O-CG1 3.26Å; I193-I197 PolarHBondContact O-N 3.02Å
194A98.7Very high97.7Very high0 Ų046 Ų460%027%0.268CS..Hα-helixtrans-60.1-42.5175.500000112A155 F156 L159 P190 L191 L192 I197 A198A155-A194 HydrophobicContact CB-CB 4.28Å; F156-A194 HydrophobicContact CD1-CB 3.98Å; F156-A194 HydrophobicContact CD2-CB 4.02Å; F156-A194 HydrophobicContact CE1-CB 4.01Å; F156-A194 HydrophobicContact CE2-CB 4.02Å; F156-A194 HydrophobicContact CG-CB 4.01Å; F156-A194 HydrophobicContact CZ-CB 4.03Å; L159-A194 HydrophobicContact CB-CB 4.02Å; L159-A194 HydrophobicContact CD1-CB 3.81Å; P190-A194 WeakPolarHBondContact O-CB 3.24Å; P190-A194 PolarHBondContact O-N 3.05Å; L191-A194 WeakPolarHBondContact O-CB 3.45Å; L191-A194 PolarHBondContact O-N 3.01Å; L192-A194 VanDerWaalsContact C-N 3.31Å; L192-A194 PolarHBondContact O-N 3.28Å; A194-I197 PolarHBondContact O-N 3.38Å; A194-A198 VanDerWaalsContact O-CB 3.25Å; A194-A198 WeakPolarHBondContact O-CB 3.38Å; A194-A198 PolarHBondContact O-N 3.47Å
195A98.6Very high97.8Very high28 Ų2846.1 Ų46.123%0.23126%0.264CS..Hα-helixtrans-63.3-42.317700000112F156 L191 L192 I193 A198 L199F156-A195 HydrophobicContact CZ-CB 4.16Å; L191-A195 WeakPolarHBondContact O-CB 3.39Å; L191-A195 PolarHBondContact O-N 2.97Å; L192-A195 WeakPolarHBondContact O-CB 3.36Å; L192-A195 PolarHBondContact O-N 3.13Å; I193-A195 VanDerWaalsContact C-N 3.32Å; I193-A195 PolarHBondContact O-N 2.94Å; A195-A198 PolarHBondContact O-N 2.99Å; A195-L199 WeakPolarHBondContact O-CB 3.13Å; A195-L199 VanDerWaalsContact O-CG 3.24Å; A195-L199 WeakPolarHBondContact O-CG 3.48Å; A195-L199 PolarHBondContact O-N 2.64Å
196V98.5Very high97.7Very high89 Ų8943 Ų4354%0.53924%0.242SC..Hα-helixtrans-61.3-45.7175.6171.90000111L192 I193 A198 L199 S200L192-V196 WeakPolarHBondContact O-CG2 3.29Å; L192-V196 PolarHBondContact O-N 3.35Å; I193-V196 PolarHBondContact O-N 2.7Å; V196-A198 VanDerWaalsContact C-N 3.33Å; V196-A198 PolarHBondContact O-N 3.35Å; V196-L199 PolarHBondContact O-N 3.04Å; V196-S200 PolarHBondContact O-N 3.32Å
197I98.5Very high97.8Very high10 Ų1041.9 Ų41.95%0.05123%0.231CC..Hα-helixtrans-60.9-44.2175.4-65.5168.9000110.8V54 M59 V62 A155 L159 I193 A194 S200V54-I197 HydrophobicContact CG1-CG1 4.29Å; V54-I197 HydrophobicContact CG1-CG2 4.12Å; V54-I197 HydrophobicContact CG2-CG1 4.44Å; M59-I197 HydrophobicContact CB-CG2 4.42Å; M59-I197 HydrophobicContact CG-CG2 3.85Å; V62-I197 HydrophobicContact CB-CD1 4.45Å; V62-I197 HydrophobicContact CG1-CD1 4.02Å; A155-I197 HydrophobicContact CB-CB 4.08Å; A155-I197 HydrophobicContact CB-CD1 4.3Å; A155-I197 HydrophobicContact CB-CG2 3.83Å; L159-I197 HydrophobicContact CD1-CD1 4.23Å; I193-I197 HydrophobicContact CG2-CD1 4.12Å; I193-I197 WeakPolarHBondContact O-CG1 3.26Å; I193-I197 PolarHBondContact O-N 3.02Å; A194-I197 PolarHBondContact O-N 3.38Å; I197-S200 WeakPolarHBondContact O-CB 3.14Å; I197-S200 PolarHBondContact O-N 2.93Å; I197-S200 PolarHBondContact O-OG 3.23Å
198A98.4Very high97.8Very high2 Ų241.4 Ų41.42%0.01723%0.229CC..Hα-helixtrans-64.4-46.3-179.200000112.3S152 F156 A194 A195 V196 S200 R201 V212S152-A198 WeakPolarHBondContact OG-CB 3.47Å; F156-A198 HydrophobicContact CD2-CB 4.36Å; F156-A198 HydrophobicContact CE2-CB 3.8Å; A194-A198 VanDerWaalsContact O-CB 3.25Å; A194-A198 WeakPolarHBondContact O-CB 3.38Å; A194-A198 PolarHBondContact O-N 3.47Å; A195-A198 PolarHBondContact O-N 2.99Å; V196-A198 VanDerWaalsContact C-N 3.33Å; V196-A198 PolarHBondContact O-N 3.35Å; A198-S200 VanDerWaalsContact C-N 3.33Å; A198-S200 PolarHBondContact O-N 3.22Å; A198-R201 WeakPolarHBondContact O-CB 3.48Å; A198-R201 PolarHBondContact O-N 3.24Å; A198-V212 HydrophobicContact CB-CG1 3.75Å
199L98.3Very high97.8Very high100 Ų10045.4 Ų45.452%0.52424%0.239SC..Hα-helixtrans-69.7-27.7-180-69.2172000112.9A195 V196 R201 T202 C203A195-L199 WeakPolarHBondContact O-CB 3.13Å; A195-L199 VanDerWaalsContact O-CG 3.24Å; A195-L199 WeakPolarHBondContact O-CG 3.48Å; A195-L199 PolarHBondContact O-N 2.64Å; V196-L199 PolarHBondContact O-N 3.04Å; L199-R201 PolarHBondContact O-N 3.37Å; L199-T202 PolarHBondContact O-N 3.45Å; L199-T202 PolarHBondContact O-OG1 2.93Å; L199-C203 PolarHBondContact O-N 3.03Å
200S97.8Very high97.8Very high10 Ų1044.8 Ų44.87%0.0723%0.231CC..Hα-helixtrans-53.4-30.8173.676.90000112.3V196 I197 A198 T202 C203 D204V196-S200 PolarHBondContact O-N 3.32Å; I197-S200 WeakPolarHBondContact O-CB 3.14Å; I197-S200 PolarHBondContact O-N 2.93Å; I197-S200 PolarHBondContact O-OG 3.23Å; A198-S200 VanDerWaalsContact C-N 3.33Å; A198-S200 PolarHBondContact O-N 3.22Å; S200-T202 VanDerWaalsContact C-N 3.33Å; S200-T202 PolarHBondContact O-N 3.32Å; S200-C203 WeakPolarHBondContact O-CB 3.25Å; S200-C203 PolarHBondContact O-N 3.01Å; S200-C203 VanDerWaalsContact O-N 3.13Å; S200-D204 VanDerWaalsContact O-CG 3.29Å; S200-D204 PolarHBondContact O-N 3.28Å
201R97.5Very high97.8Very high5 Ų544.3 Ų44.32%0.01923%0.228CC..Hα-helixtrans-69.6-27.4179.3-59.8-42.7-59.7168.5-24114.8D52 H151 A198 L199 D204 K206 H207 V212D52-R201 IonicContact OD1-NH1 2.64Å; D52-R201 IonicContact OD1-NH2 3.49Å; D52-R201 IonicContact OD2-CZ 3.39Å; D52-R201 VanDerWaalsContact OD2-CZ 3.28Å; D52-R201 IonicContact OD2-NH1 3.92Å; D52-R201 PolarHBondContact OD2-NH1 3.36Å; D52-R201 IonicContact OD2-NH2 2.64Å; D52-R201 PolarHBondContact OD2-NH2 3.34Å; H151-R201 HydrophobicContact CB-CG 3.81Å; A198-R201 WeakPolarHBondContact O-CB 3.48Å; A198-R201 PolarHBondContact O-N 3.24Å; L199-R201 PolarHBondContact O-N 3.37Å; R201-D204 IonicContact CZ-OD2 3.1Å; R201-D204 IonicContact NH1-OD2 3.64Å; R201-D204 PolarHBondContact NH1-OD2 2.87Å; R201-K206 VanDerWaalsContact CZ-CB 3.49Å; R201-K206 VanDerWaalsContact NH2-CB 3.3Å; R201-K206 PolarHBondContact O-N 2.7Å; R201-H207 HydrophobicContact CB-CB 4.04Å; R201-H207 PolarHBondContact O-N 3.45Å; R201-V212 HydrophobicContact CB-CG2 4.25Å
202T96.6Very high97.8Very high47 Ų4743.1 Ų43.129%0.28822%0.222SC..Hα-helixtrans-76.8-35.3171.453.80000111L199 S200 D204 Y205 V212L199-T202 PolarHBondContact O-N 3.45Å; L199-T202 PolarHBondContact O-OG1 2.93Å; S200-T202 VanDerWaalsContact C-N 3.33Å; S200-T202 PolarHBondContact O-N 3.32Å; T202-D204 VanDerWaalsContact C-N 3.29Å; T202-D204 PolarHBondContact O-N 3.43Å; T202-Y205 PolarHBondContact O-N 3.19Å; T202-V212 HydrophobicContact CG2-CG2 3.95Å
203C95.6Very high97.8Very high71 Ų7141.6 Ų41.648%0.4821%0.214SC..Hα-helixtrans-64.6-35.1174.1-56.90000112L199 S200 Y205L199-C203 PolarHBondContact O-N 3.03Å; S200-C203 WeakPolarHBondContact O-CB 3.25Å; S200-C203 PolarHBondContact O-N 3.01Å; S200-C203 VanDerWaalsContact O-N 3.13Å; C203-Y205 VanDerWaalsContact C-N 3.27Å; C203-Y205 PolarHBondContact O-N 3.23Å
204D96.3Very high97.8Very high0 Ų040.3 Ų40.30%021%0.21CC..THydrogen-bonded Turntrans-80-2.9178-64.6-36000113.9H53 S200 R201 T202 K206H53-D204 IonicContact CE1-OD1 3.63Å; H53-D204 IonicContact CG-OD1 3.58Å; H53-D204 PolarHBondContact N-OD1 3.38Å; H53-D204 PolarHBondContact N-OD2 2.95Å; H53-D204 IonicContact ND1-OD1 3.45Å; H53-D204 PolarHBondContact ND1-OD1 3.05Å; S200-D204 VanDerWaalsContact O-CG 3.29Å; S200-D204 PolarHBondContact O-N 3.28Å; R201-D204 IonicContact CZ-OD2 3.1Å; R201-D204 IonicContact NH1-OD2 3.64Å; R201-D204 PolarHBondContact NH1-OD2 2.87Å; T202-D204 VanDerWaalsContact C-N 3.29Å; T202-D204 PolarHBondContact O-N 3.43Å; D204-K206 HydrophobicContact CB-CB 4.25Å; D204-K206 HydrophobicContact CB-CG 3.47Å; D204-K206 VanDerWaalsContact CB-CG 3.47Å; D204-K206 WeakPolarHBondContact O-CG 3.47Å; D204-K206 PolarHBondContact O-N 3.14Å
205Y96.3Very high97.8Very high81 Ų8140.3 Ų40.332%0.31821%0.21SC..THydrogen-bonded Turntrans56.529.5-171.3-52.5-73.9000114.1F46 H47 V49 P115 D116 T202 C203F46-Y205 HydrophobicContact CB-CD1 3.87Å; F46-Y205 HydrophobicContact CB-CD2 4.5Å; F46-Y205 HydrophobicContact CB-CG 3.76Å; F46-Y205 AromaticContact CD1-CD1 3.28Å; F46-Y205 HydrophobicContact CD1-CD1 3.28Å; F46-Y205 AromaticContact CD1-CE1 3.4Å; F46-Y205 HydrophobicContact CD1-CE1 3.4Å; F46-Y205 HydrophobicContact CD1-CG 4.01Å; F46-Y205 HydrophobicContact CD2-CD1 4.46Å; F46-Y205 AromaticContact CE1-CD1 3.9Å; F46-Y205 HydrophobicContact CE1-CD1 3.9Å; F46-Y205 AromaticContact CE1-CE1 3.74Å; F46-Y205 HydrophobicContact CE1-CE1 3.74Å; F46-Y205 AromaticContact CG-CD1 3.62Å; F46-Y205 HydrophobicContact CG-CD1 3.62Å; F46-Y205 HydrophobicContact CG-CE1 4.21Å; F46-Y205 HydrophobicContact CG-CG 4.06Å; H47-Y205 AromaticContact CD2-CE2 3.93Å; H47-Y205 AromaticContact CE1-CD2 3.9Å; H47-Y205 AromaticContact CE1-CE2 3.74Å; H47-Y205 AromaticContact NE2-CD2 3.8Å; H47-Y205 AromaticContact NE2-CE2 3.25Å; H47-Y205 VanDerWaalsContact NE2-CE2 3.25Å; H47-Y205 WeakPolarHBondContact NE2-CE2 3.43Å; V49-Y205 HydrophobicContact CG2-CD2 4.17Å; P115-Y205 WeakPolarHBondContact CB-O 3.49Å; P115-Y205 WeakPolarHBondContact CD-O 3.41Å; D116-Y205 PolarHBondContact N-O 3.37Å; T202-Y205 PolarHBondContact O-N 3.19Å; C203-Y205 VanDerWaalsContact C-N 3.27Å; C203-Y205 PolarHBondContact O-N 3.23Å
206K96.1Very high97.8Very high10 Ų1039.6 Ų39.64%0.04320%0.203CC..SBendtrans-94.9-20.5-174.9-64.9-75.3179.2-162.90112.7V49 D52 R114 D116 R120 R201 D204V49-K206 WeakPolarHBondContact O-CE 3.47Å; V49-K206 PolarHBondContact O-NZ 3.14Å; D52-K206 WeakPolarHBondContact OD1-CE 3.32Å; R114-K206 WeakPolarHBondContact CD-O 3.26Å; R114-K206 VanDerWaalsContact CG-O 3.29Å; R114-K206 WeakPolarHBondContact CG-O 3.45Å; R114-K206 PolarHBondContact NH1-O 3.36Å; D116-K206 WeakPolarHBondContact OD2-CD 3.28Å; D116-K206 WeakPolarHBondContact OD2-CE 3.49Å; D116-K206 IonicContact OD2-NZ 2.72Å; D116-K206 PolarHBondContact OD2-NZ 2.69Å; R120-K206 VanDerWaalsContact NH2-CD 3.32Å; R201-K206 VanDerWaalsContact CZ-CB 3.49Å; R201-K206 VanDerWaalsContact NH2-CB 3.3Å; R201-K206 PolarHBondContact O-N 2.7Å; D204-K206 HydrophobicContact CB-CB 4.25Å; D204-K206 HydrophobicContact CB-CG 3.47Å; D204-K206 VanDerWaalsContact CB-CG 3.47Å; D204-K206 WeakPolarHBondContact O-CG 3.47Å; D204-K206 PolarHBondContact O-N 3.14Å
207H98Very high97.8Very high4 Ų440.9 Ų40.92%0.01921%0.205CC..SBendtrans-147.4145.4-177.6-74.9-66.3000110.3R114 S146 S149 R201 D211 V212R114-H207 PolarHBondContact NH1-CE1 2.83Å; R114-H207 VanDerWaalsContact NH1-CE1 3.32Å; R114-H207 PolarHBondContact NH1-NE2 3.34Å; S146-H207 PolarHBondContact O-CE1 3.18Å; S146-H207 PolarHBondContact O-ND1 2.89Å; S146-H207 PolarHBondContact OG-ND1 2.93Å; S149-H207 PolarHBondContact OG-CD2 2.99Å; R201-H207 HydrophobicContact CB-CB 4.04Å; R201-H207 PolarHBondContact O-N 3.45Å; H207-D211 HydrophobicContact CB-CB 4.01Å; H207-D211 IonicContact ND1-OD2 2.69Å; H207-V212 HydrophobicContact CB-CG2 3.94Å
208H97.9Very high97.8Very high20 Ų2041.9 Ų41.99%0.09321%0.21CC..  trans-75159.2167.9-52.780.2000109.7Y44 R112 P113 Q210 D211 V212Y44-H208 AromaticContact CE1-CE1 3.93Å; Y44-H208 AromaticContact CE1-NE2 4Å; R112-H208 VanDerWaalsContact CZ-CG 3.45Å; R112-H208 VanDerWaalsContact CZ-ND1 3.34Å; R112-H208 PolarHBondContact NE-ND1 2.9Å; R112-H208 PolarHBondContact NH2-CD2 3.25Å; R112-H208 VanDerWaalsContact NH2-CD2 3.26Å; R112-H208 PolarHBondContact NH2-ND1 2.88Å; P113-H208 PolarHBondContact O-CE1 2.93Å; H208-Q210 PolarHBondContact O-N 3.4Å; H208-D211 IonicContact CG-OD2 3.62Å; H208-D211 PolarHBondContact N-OD2 3.25Å; H208-D211 IonicContact ND1-OD2 2.78Å; H208-D211 PolarHBondContact ND1-OD2 3.22Å; H208-D211 VanDerWaalsContact ND1-OD2 3.12Å; H208-D211 WeakPolarHBondContact O-CB 3.45Å; H208-D211 PolarHBondContact O-N 2.75Å; H208-V212 PolarHBondContact O-N 2.86Å
209W97.7Very high97.9Very high165 Ų16541.8 Ų41.863%0.62521%0.209SC*.Hα-helixtrans-59.1-31.5178.770.3-98.7000112.6V212 L213W209-V212 PolarHBondContact O-N 3.28Å; W209-L213 HydrophobicContact CE3-CD2 4.38Å; W209-L213 HydrophobicContact CZ3-CD2 3.87Å; W209-L213 WeakPolarHBondContact O-CB 3.12Å; W209-L213 PolarHBondContact O-N 3.45Å
210Q98.4Very high97.9Very high60 Ų6040.3 Ų40.328%0.2820%0.201SC..Hα-helixtrans-66.4-39.8176-53.489.7-8.700111.6H208 V212 L213 V214H208-Q210 PolarHBondContact O-N 3.4Å; Q210-V212 PolarHBondContact O-N 2.94Å; Q210-L213 PolarHBondContact O-N 2.86Å; Q210-V214 WeakPolarHBondContact O-CB 3.4Å; Q210-V214 WeakPolarHBondContact O-CG2 3.46Å; Q210-V214 PolarHBondContact O-N 3.08Å
211D98.6Very high97.9Very high0 Ų042 Ų420%022%0.216CC..Hα-helixtrans-61.4-40.9178.3-51.2-22000109.7R112 S146 F147 S149 H207 H208 G215R112-D211 WeakPolarHBondContact CD-OD1 3.34Å; R112-D211 IonicContact CZ-OD1 3.17Å; R112-D211 IonicContact NE-OD1 2.83Å; R112-D211 IonicContact NH1-OD1 3.27Å; R112-D211 PolarHBondContact NH1-OD1 3.38Å; S146-D211 WeakPolarHBondContact O-CB 3.27Å; S146-D211 PolarHBondContact OG-OD2 2.89Å; F147-D211 WeakPolarHBondContact CB-OD1 3.47Å; F147-D211 HydrophobicContact CD2-CB 4.4Å; F147-D211 VanDerWaalsContact CD2-OD1 3.27Å; F147-D211 WeakPolarHBondContact CD2-OD1 3.38Å; S149-D211 WeakPolarHBondContact CB-O 3.47Å; S149-D211 PolarHBondContact N-O 3.24Å; H207-D211 HydrophobicContact CB-CB 4.01Å; H207-D211 IonicContact ND1-OD2 2.69Å; H208-D211 IonicContact CG-OD2 3.62Å; H208-D211 PolarHBondContact N-OD2 3.25Å; H208-D211 IonicContact ND1-OD2 2.78Å; H208-D211 PolarHBondContact ND1-OD2 3.22Å; H208-D211 VanDerWaalsContact ND1-OD2 3.12Å; H208-D211 WeakPolarHBondContact O-CB 3.45Å; H208-D211 PolarHBondContact O-N 2.75Å; D211-G215 PolarHBondContact O-N 3.39Å
212V98.8Very high98Very high10 Ų1042.6 Ų42.66%0.06122%0.218CC..Hα-helixtrans-67.8-50.1177.6178.50000111.1S152 A198 R201 T202 H207 H208 W209 Q210 G215 S216S152-V212 PolarHBondContact OG-O 3.46Å; A198-V212 HydrophobicContact CB-CG1 3.75Å; R201-V212 HydrophobicContact CB-CG2 4.25Å; T202-V212 HydrophobicContact CG2-CG2 3.95Å; H207-V212 HydrophobicContact CB-CG2 3.94Å; H208-V212 PolarHBondContact O-N 2.86Å; W209-V212 PolarHBondContact O-N 3.28Å; Q210-V212 PolarHBondContact O-N 2.94Å; V212-G215 PolarHBondContact O-N 2.94Å; V212-S216 PolarHBondContact O-N 2.72Å; V212-S216 PolarHBondContact O-OG 2.92Å
213L98.7Very high98.1Very high84 Ų8440.3 Ų40.344%0.4421%0.205SC..Hα-helixtrans-60.1-51.3-179.3177.863.3000112W209 Q210 G215 S216 M217W209-L213 HydrophobicContact CE3-CD2 4.38Å; W209-L213 HydrophobicContact CZ3-CD2 3.87Å; W209-L213 WeakPolarHBondContact O-CB 3.12Å; W209-L213 PolarHBondContact O-N 3.45Å; Q210-L213 PolarHBondContact O-N 2.86Å; L213-G215 VanDerWaalsContact C-N 3.32Å; L213-G215 PolarHBondContact O-N 3.43Å; L213-S216 WeakPolarHBondContact O-CB 3.42Å; L213-S216 PolarHBondContact O-N 3.24Å; L213-M217 HydrophobicContact CD1-CG 4.44Å; L213-M217 HydrophobicContact CD1-SD 4.3Å; L213-M217 HydrophobicContact CG-SD 4.18Å; L213-M217 WeakPolarHBondContact O-CG 3.29Å; L213-M217 PolarHBondContact O-N 3.29Å
214V98.8Very high98.2Very high50 Ų5043.5 Ų43.530%0.30321%0.207SC..Hα-helixtrans-65.5-38.9179.6176.50000110.6F147 P148 Q210 S216 M217 L218F147-V214 HydrophobicContact CE1-CG1 4.43Å; F147-V214 HydrophobicContact CE2-CB 3.81Å; F147-V214 HydrophobicContact CE2-CG1 4.13Å; F147-V214 HydrophobicContact CE2-CG2 3.73Å; F147-V214 HydrophobicContact CZ-CB 3.9Å; F147-V214 HydrophobicContact CZ-CG1 3.68Å; F147-V214 HydrophobicContact CZ-CG2 3.86Å; P148-V214 HydrophobicContact CB-CB 4.5Å; P148-V214 HydrophobicContact CB-CG1 4.26Å; Q210-V214 WeakPolarHBondContact O-CB 3.4Å; Q210-V214 WeakPolarHBondContact O-CG2 3.46Å; Q210-V214 PolarHBondContact O-N 3.08Å; V214-S216 PolarHBondContact O-N 2.82Å; V214-M217 PolarHBondContact O-N 3.49Å; V214-L218 VanDerWaalsContact O-CB 3.32Å; V214-L218 WeakPolarHBondContact O-CB 3.36Å; V214-L218 PolarHBondContact O-N 2.96Å
215G98.8Very high98.3Very high0 Ų047.8 Ų47.80%023%0.229CC..Hα-helixtrans-56.1-49.4171.500000112S153 D211 V212 L213 M217 L218 G219S153-G215 WeakPolarHBondContact CA-O 3.44Å; S153-G215 WeakPolarHBondContact CB-O 3.22Å; D211-G215 PolarHBondContact O-N 3.39Å; V212-G215 PolarHBondContact O-N 2.94Å; L213-G215 VanDerWaalsContact C-N 3.32Å; L213-G215 PolarHBondContact O-N 3.43Å; G215-M217 PolarHBondContact O-N 2.88Å; G215-L218 PolarHBondContact O-N 3.4Å; G215-G219 PolarHBondContact O-N 2.87Å
216S98.9Very high98.4Very high14 Ų1444 Ų4410%0.09822%0.215CC..Hα-helixtrans-59.5-46.6178.5-55.20000111.9S152 F156 V212 L213 V214 G219 L220S152-S216 PolarHBondContact OG-N 2.78Å; S152-S216 VanDerWaalsContact OG-N 3.17Å; S152-S216 PolarHBondContact OG-OG 2.97Å; F156-S216 VanDerWaalsContact CD2-CB 3.42Å; F156-S216 VanDerWaalsContact CD2-OG 3.29Å; F156-S216 WeakPolarHBondContact CD2-OG 3.29Å; F156-S216 WeakPolarHBondContact CE2-OG 3.4Å; V212-S216 PolarHBondContact O-N 2.72Å; V212-S216 PolarHBondContact O-OG 2.92Å; L213-S216 WeakPolarHBondContact O-CB 3.42Å; L213-S216 PolarHBondContact O-N 3.24Å; V214-S216 PolarHBondContact O-N 2.82Å; S216-G219 PolarHBondContact O-N 3.04Å; S216-L220 WeakPolarHBondContact O-CB 3.47Å; S216-L220 WeakPolarHBondContact O-CG 3.46Å; S216-L220 PolarHBondContact O-N 3.29Å
217M98.8Very high98.5Very high116 Ų11643.7 Ų43.757%0.57121%0.213SC*.Hα-helixtrans-62.3-43.1179.6-71.917766.100111.5L213 V214 G215 L220 A221L213-M217 HydrophobicContact CD1-CG 4.44Å; L213-M217 HydrophobicContact CD1-SD 4.3Å; L213-M217 HydrophobicContact CG-SD 4.18Å; L213-M217 WeakPolarHBondContact O-CG 3.29Å; L213-M217 PolarHBondContact O-N 3.29Å; V214-M217 PolarHBondContact O-N 3.49Å; G215-M217 PolarHBondContact O-N 2.88Å; M217-L220 PolarHBondContact O-N 2.61Å; M217-A221 VanDerWaalsContact O-CB 3.28Å; M217-A221 WeakPolarHBondContact O-CB 3.43Å; M217-A221 PolarHBondContact O-N 3.47Å
218L98.7Very high98.4Very high30 Ų3047 Ų4716%0.15723%0.226CC..Hα-helixtrans-61.9-46.5177.4-170.766.8000111.3T103 I106 P148 V214 G215 A221 F222T103-L218 VanDerWaalsContact OG1-CD2 3.3Å; T103-L218 WeakPolarHBondContact OG1-CD2 3.3Å; I106-L218 HydrophobicContact CD1-CD2 3.98Å; P148-L218 HydrophobicContact CG-CD2 4.32Å; V214-L218 VanDerWaalsContact O-CB 3.32Å; V214-L218 WeakPolarHBondContact O-CB 3.36Å; V214-L218 PolarHBondContact O-N 2.96Å; G215-L218 PolarHBondContact O-N 3.4Å; L218-A221 PolarHBondContact O-N 2.77Å; L218-F222 HydrophobicContact CD1-CD2 4.13Å; L218-F222 HydrophobicContact CD1-CE2 3.61Å; L218-F222 HydrophobicContact CG-CD2 4.14Å; L218-F222 HydrophobicContact CG-CE2 3.98Å; L218-F222 WeakPolarHBondContact O-CD2 3.37Å; L218-F222 PolarHBondContact O-N 3.26Å; L218-F222 VanDerWaalsContact O-N 3.08Å
219G98.8Very high98.2Very high0 Ų051.7 Ų51.70%025%0.247CC..Hα-helixtrans-60.2-47.5176.300000112.7N99 S153 A157 G215 S216 A221 F222 A223N99-G219 WeakPolarHBondContact OD1-CA 3.46Å; S153-G219 WeakPolarHBondContact O-CA 3.37Å; A157-G219 WeakPolarHBondContact CA-O 3.46Å; G215-G219 PolarHBondContact O-N 2.87Å; S216-G219 PolarHBondContact O-N 3.04Å; G219-A221 PolarHBondContact O-N 3.47Å; G219-F222 PolarHBondContact O-N 3.45Å; G219-A223 WeakPolarHBondContact O-CB 3.33Å; G219-A223 PolarHBondContact O-N 3.05Å
220L98.8Very high98.1Very high69 Ų6944.4 Ų44.436%0.36122%0.22SC..Hα-helixtrans-62.6-39.8176-77.9173.3000112.6F156 L191 S216 M217 A223 W224F156-L220 HydrophobicContact CB-CG 4.21Å; F156-L220 HydrophobicContact CD1-CD1 3.84Å; F156-L220 HydrophobicContact CD1-CD2 3.85Å; F156-L220 HydrophobicContact CD1-CG 3.61Å; F156-L220 HydrophobicContact CE1-CD1 4.16Å; F156-L220 HydrophobicContact CE1-CG 4.41Å; F156-L220 HydrophobicContact CG-CG 4.27Å; L191-L220 HydrophobicContact CD2-CD2 3.98Å; S216-L220 WeakPolarHBondContact O-CB 3.47Å; S216-L220 WeakPolarHBondContact O-CG 3.46Å; S216-L220 PolarHBondContact O-N 3.29Å; M217-L220 PolarHBondContact O-N 2.61Å; L220-A223 PolarHBondContact O-N 3.35Å; L220-W224 VanDerWaalsContact O-CB 3.32Å; L220-W224 WeakPolarHBondContact O-CB 3.44Å; L220-W224 PolarHBondContact O-N 3.12Å
221A98.7Very high97.9Very high45 Ų4541.6 Ų41.637%0.37221%0.207SC..Hα-helixtrans-61.6-48.3178.700000111.1M217 L218 G219 W224 L225M217-A221 VanDerWaalsContact O-CB 3.28Å; M217-A221 WeakPolarHBondContact O-CB 3.43Å; M217-A221 PolarHBondContact O-N 3.47Å; L218-A221 PolarHBondContact O-N 2.77Å; G219-A221 PolarHBondContact O-N 3.47Å; A221-W224 PolarHBondContact O-N 3.01Å; A221-L225 WeakPolarHBondContact O-CB 3.29Å; A221-L225 VanDerWaalsContact O-CG 3.3Å; A221-L225 WeakPolarHBondContact O-CG 3.21Å; A221-L225 PolarHBondContact O-N 2.88Å
222F98.6Very high97.7Very high18 Ų1841.7 Ų41.78%0.07921%0.208CC..Hα-helixtrans-68.6-37.6177.6-77.7-62.4000113.1L98 N99 F102 L218 G219 W224 L225 C226L98-F222 HydrophobicContact CB-CD1 4.44Å; L98-F222 HydrophobicContact CD2-CD1 3.63Å; L98-F222 HydrophobicContact CD2-CE1 3.56Å; L98-F222 HydrophobicContact CG-CD1 3.86Å; L98-F222 HydrophobicContact CG-CE1 3.61Å; L98-F222 HydrophobicContact CG-CZ 4.29Å; N99-F222 HydrophobicContact CB-CB 4.13Å; N99-F222 HydrophobicContact CB-CD2 3.93Å; N99-F222 HydrophobicContact CB-CG 4.25Å; F102-F222 HydrophobicContact CB-CE2 3.7Å; F102-F222 HydrophobicContact CB-CZ 3.91Å; F102-F222 HydrophobicContact CD1-CE2 4.35Å; F102-F222 AromaticContact CD1-CZ 3.87Å; F102-F222 HydrophobicContact CD1-CZ 3.87Å; F102-F222 HydrophobicContact CD2-CE1 4.29Å; F102-F222 HydrophobicContact CD2-CE2 4.18Å; F102-F222 AromaticContact CD2-CZ 3.53Å; F102-F222 HydrophobicContact CD2-CZ 3.53Å; F102-F222 HydrophobicContact CE1-CZ 4.25Å; F102-F222 HydrophobicContact CE2-CE1 4.41Å; F102-F222 AromaticContact CE2-CZ 3.95Å; F102-F222 HydrophobicContact CE2-CZ 3.95Å; F102-F222 AromaticContact CG-CE2 3.82Å; F102-F222 HydrophobicContact CG-CE2 3.82Å; F102-F222 AromaticContact CG-CZ 3.48Å; F102-F222 HydrophobicContact CG-CZ 3.48Å; F102-F222 VanDerWaalsContact CG-CZ 3.48Å; F102-F222 HydrophobicContact CZ-CZ 4.28Å; L218-F222 HydrophobicContact CD1-CD2 4.13Å; L218-F222 HydrophobicContact CD1-CE2 3.61Å; L218-F222 HydrophobicContact CG-CD2 4.14Å; L218-F222 HydrophobicContact CG-CE2 3.98Å; L218-F222 WeakPolarHBondContact O-CD2 3.37Å; L218-F222 PolarHBondContact O-N 3.26Å; L218-F222 VanDerWaalsContact O-N 3.08Å; G219-F222 PolarHBondContact O-N 3.45Å; F222-W224 VanDerWaalsContact C-N 3.31Å; F222-W224 PolarHBondContact O-N 3.48Å; F222-L225 HydrophobicContact CD1-CD1 4.3Å; F222-L225 PolarHBondContact O-N 2.6Å; F222-C226 WeakPolarHBondContact O-CB 3.5Å; F222-C226 PolarHBondContact O-N 3.18Å; F222-C226 PolarHBondContact O-SG 2.59Å
223A98.7Very high97.5Very high0 Ų043.4 Ų43.40%022%0.219CC..Hα-helixtrans-57.7-45.9172.200000111.4T95 F161 L164 G219 L220 Y227T95-A223 HydrophobicContact CG2-CB 4.08Å; F161-A223 HydrophobicContact CB-CB 4.12Å; L164-A223 HydrophobicContact CD1-CB 4.31Å; G219-A223 WeakPolarHBondContact O-CB 3.33Å; G219-A223 PolarHBondContact O-N 3.05Å; L220-A223 PolarHBondContact O-N 3.35Å; A223-Y227 WeakPolarHBondContact O-CB 3.47Å; A223-Y227 PolarHBondContact O-N 3.26Å
224W98.6Very high97.3Very high138 Ų13840.6 Ų40.652%0.52320%0.204SC..Hα-helixtrans-65.9-48.9177.7179.287.6000112.4L164 L220 A221 F222 C226 Y227 R228L164-W224 HydrophobicContact CD1-CB 4.21Å; L220-W224 VanDerWaalsContact O-CB 3.32Å; L220-W224 WeakPolarHBondContact O-CB 3.44Å; L220-W224 PolarHBondContact O-N 3.12Å; A221-W224 PolarHBondContact O-N 3.01Å; F222-W224 VanDerWaalsContact C-N 3.31Å; F222-W224 PolarHBondContact O-N 3.48Å; W224-C226 PolarHBondContact O-N 3.02Å; W224-Y227 PolarHBondContact O-N 2.84Å; W224-R228 HydrophobicContact CD2-CG 3.98Å; W224-R228 HydrophobicContact CG-CG 4.33Å; W224-R228 HydrophobicContact CZ2-CG 3.92Å; W224-R228 WeakPolarHBondContact O-CB 3.34Å; W224-R228 VanDerWaalsContact O-CG 3.22Å; W224-R228 WeakPolarHBondContact O-CG 3.45Å; W224-R228 PolarHBondContact O-N 3.01Å
225L98.3Very high97.1Very high90 Ų9044.2 Ų44.247%0.47122%0.218SC..Hα-helixtrans-58.1-51-179.8-75169.6000111.5A221 F222 R228 Q229A221-L225 WeakPolarHBondContact O-CB 3.29Å; A221-L225 VanDerWaalsContact O-CG 3.3Å; A221-L225 WeakPolarHBondContact O-CG 3.21Å; A221-L225 PolarHBondContact O-N 2.88Å; F222-L225 HydrophobicContact CD1-CD1 4.3Å; F222-L225 PolarHBondContact O-N 2.6Å; L225-R228 PolarHBondContact O-N 3.46Å; L225-Q229 PolarHBondContact O-N 3.43Å
226C97.8Very high96.8Very high2 Ų246 Ų461%0.01423%0.228CC..Hα-helixtrans-70.5-35.6-177.6-61.80000111.9T95 F222 W224 Q229 H230T95-C226 WeakPolarHBondContact OG1-CB 3.4Å; F222-C226 WeakPolarHBondContact O-CB 3.5Å; F222-C226 PolarHBondContact O-N 3.18Å; F222-C226 PolarHBondContact O-SG 2.59Å; W224-C226 PolarHBondContact O-N 3.02Å; C226-Q229 PolarHBondContact O-N 2.85Å; C226-H230 PolarHBondContact O-N 3.5Å; C226-H230 PolarHBondContact O-ND1 3.14Å
227Y97.8Very high96.3Very high2 Ų249.1 Ų49.11%0.00825%0.248CC..Hα-helixtrans-58.9-50.5169.6177.4-91.6000110.2F161 L164 A223 W224 Q229 H230 F231 P232 L234F161-Y227 HydrophobicContact CE2-CD2 4.2Å; L164-Y227 HydrophobicContact CB-CD1 4.33Å; L164-Y227 HydrophobicContact CB-CD2 3.77Å; L164-Y227 HydrophobicContact CB-CE2 4.11Å; L164-Y227 HydrophobicContact CB-CG 3.9Å; L164-Y227 HydrophobicContact CD1-CG 4.17Å; A223-Y227 WeakPolarHBondContact O-CB 3.47Å; A223-Y227 PolarHBondContact O-N 3.26Å; W224-Y227 PolarHBondContact O-N 2.84Å; Y227-Q229 VanDerWaalsContact C-N 3.26Å; Y227-Q229 PolarHBondContact O-N 2.84Å; Y227-H230 PolarHBondContact O-N 3.45Å; Y227-F231 HydrophobicContact CD1-CB 4.11Å; Y227-F231 HydrophobicContact CD2-CB 4.06Å; Y227-F231 AromaticContact CD2-CD2 3.89Å; Y227-F231 HydrophobicContact CD2-CD2 3.89Å; Y227-F231 HydrophobicContact CD2-CG 4.14Å; Y227-F231 HydrophobicContact CE1-CB 3.69Å; Y227-F231 HydrophobicContact CE2-CB 3.62Å; Y227-F231 HydrophobicContact CE2-CD1 4.41Å; Y227-F231 AromaticContact CE2-CD2 3.89Å; Y227-F231 HydrophobicContact CE2-CD2 3.89Å; Y227-F231 AromaticContact CE2-CG 3.71Å; Y227-F231 HydrophobicContact CE2-CG 3.71Å; Y227-F231 HydrophobicContact CG-CB 4.28Å; Y227-F231 VanDerWaalsContact CZ-CB 3.41Å; Y227-F231 AromaticContact CZ-CG 3.98Å; Y227-F231 WeakPolarHBondContact O-CA 3.05Å; Y227-F231 WeakPolarHBondContact O-CB 3.36Å; Y227-F231 PolarHBondContact O-N 2.95Å; Y227-P232 WeakPolarHBondContact CE1-O 3.29Å; Y227-L234 HydrophobicContact CE1-CD2 3.83Å; Y227-L234 WeakPolarHBondContact OH-CD2 3.46Å
228R96.2Very high95.9Very high75 Ų7546.4 Ų46.428%0.28324%0.235SC..Hα-helixtrans-66-26-177.7-70.5-63.6-65.3104.76.4114W224 L225 H230 F231 P233W224-R228 HydrophobicContact CD2-CG 3.98Å; W224-R228 HydrophobicContact CG-CG 4.33Å; W224-R228 HydrophobicContact CZ2-CG 3.92Å; W224-R228 WeakPolarHBondContact O-CB 3.34Å; W224-R228 VanDerWaalsContact O-CG 3.22Å; W224-R228 WeakPolarHBondContact O-CG 3.45Å; W224-R228 PolarHBondContact O-N 3.01Å; L225-R228 PolarHBondContact O-N 3.46Å; R228-H230 VanDerWaalsContact C-N 3.31Å; R228-F231 CarbonylContact C-O 3.21Å; R228-F231 WeakPolarHBondContact CA-O 3.24Å; R228-F231 PolarHBondContact NH1-O 3.36Å; R228-P233 VanDerWaalsContact CZ-CD 3.48Å; R228-P233 VanDerWaalsContact NH1-N 3.19Å
229Q94.8Very high95.5Very high117 Ų11745 Ų4555%0.54723%0.228SC..Hα-helixtrans-67.4-29.9173-176.1175.5-4.300112.8L225 C226 Y227L225-Q229 PolarHBondContact O-N 3.43Å; C226-Q229 PolarHBondContact O-N 2.85Å; Y227-Q229 VanDerWaalsContact C-N 3.26Å; Y227-Q229 PolarHBondContact O-N 2.84Å
230H94.3Very high95.1Very high12 Ų1245.9 Ų45.96%0.05623%0.232CC..Hα-helixtrans-109.7-26.1-175.6-63.577.6000113.1E87 A91 C226 Y227 R228 P242 I243E87-H230 PolarHBondContact O-CD2 3.09Å; E87-H230 IonicContact OE2-CD2 2.84Å; E87-H230 PolarHBondContact OE2-CD2 3.31Å; A91-H230 HydrophobicContact CB-CB 3.97Å; A91-H230 WeakPolarHBondContact CB-ND1 3.02Å; C226-H230 PolarHBondContact O-N 3.5Å; C226-H230 PolarHBondContact O-ND1 3.14Å; Y227-H230 PolarHBondContact O-N 3.45Å; R228-H230 VanDerWaalsContact C-N 3.31Å; H230-P242 WeakPolarHBondContact O-CA 3.43Å; H230-I243 PolarHBondContact O-N 2.93Å
231F94.9Very high94.8Very high1 Ų146.7 Ų46.70%0.00423%0.23CC..SBendtrans-128.1145.9-174-66.9-87.3000111.5D84 A88 Y165 Y227 R228 P242D84-F231 VanDerWaalsContact OD1-CE1 3.24Å; D84-F231 WeakPolarHBondContact OD1-CE1 3.37Å; A88-F231 HydrophobicContact CB-CE2 4.24Å; A88-F231 HydrophobicContact CB-CZ 3.97Å; Y165-F231 HydrophobicContact CD2-CZ 4.15Å; Y165-F231 HydrophobicContact CE2-CE1 4.42Å; Y165-F231 HydrophobicContact CE2-CZ 4.06Å; Y227-F231 HydrophobicContact CD1-CB 4.11Å; Y227-F231 HydrophobicContact CD2-CB 4.06Å; Y227-F231 AromaticContact CD2-CD2 3.89Å; Y227-F231 HydrophobicContact CD2-CD2 3.89Å; Y227-F231 HydrophobicContact CD2-CG 4.14Å; Y227-F231 HydrophobicContact CE1-CB 3.69Å; Y227-F231 HydrophobicContact CE2-CB 3.62Å; Y227-F231 HydrophobicContact CE2-CD1 4.41Å; Y227-F231 AromaticContact CE2-CD2 3.89Å; Y227-F231 HydrophobicContact CE2-CD2 3.89Å; Y227-F231 AromaticContact CE2-CG 3.71Å; Y227-F231 HydrophobicContact CE2-CG 3.71Å; Y227-F231 HydrophobicContact CG-CB 4.28Å; Y227-F231 VanDerWaalsContact CZ-CB 3.41Å; Y227-F231 AromaticContact CZ-CG 3.98Å; Y227-F231 WeakPolarHBondContact O-CA 3.05Å; Y227-F231 WeakPolarHBondContact O-CB 3.36Å; Y227-F231 PolarHBondContact O-N 2.95Å; R228-F231 CarbonylContact C-O 3.21Å; R228-F231 WeakPolarHBondContact CA-O 3.24Å; R228-F231 PolarHBondContact NH1-O 3.36Å; F231-P242 HydrophobicContact CE1-CB 4.29Å; F231-P242 HydrophobicContact CE1-CG 3.82Å; F231-P242 HydrophobicContact CZ-CG 4.26Å
232P94.2Very high94.4Very high2 Ų244.5 Ų44.51%0.01321%0.212CC..  trans-61.6170.3174.333.4-46.4000114Y227 D236 R241 R246Y227-P232 WeakPolarHBondContact CE1-O 3.29Å; P232-D236 HydrophobicContact CB-CB 3.95Å; P232-R241 WeakPolarHBondContact CD-O 3.48Å; P232-R246 VanDerWaalsContact CB-NH2 3.27Å
233P95.1Very high94Very high47 Ų4746.2 Ų46.231%0.30522%0.222SC..  trans-55.8152.1169.8-20.231000111.9R228 Q235 D236 S239R228-P233 VanDerWaalsContact CZ-CD 3.48Å; R228-P233 VanDerWaalsContact NH1-N 3.19Å; P233-Q235 PolarHBondContact O-N 3.08Å; P233-D236 WeakPolarHBondContact O-CB 3.4Å; P233-D236 PolarHBondContact O-N 3.45Å; P233-D236 VanDerWaalsContact O-N 3.09Å; P233-S239 WeakPolarHBondContact O-CB 3.18Å
234L94.6Very high93.1Very high24 Ų2451.9 Ų51.913%0.12624%0.243CC..THydrogen-bonded Turntrans-66.6-25.1-178.5-61.8179.6000113.4L164 A167 F173 Y227 D236 S239L164-L234 HydrophobicContact CD2-CD1 3.91Å; A167-L234 HydrophobicContact CB-CD1 3.96Å; A167-L234 HydrophobicContact CB-CD2 3.94Å; F173-L234 CarbonylContact C-O 3.43Å; F173-L234 HydrophobicContact CB-CB 4.21Å; F173-L234 HydrophobicContact CD2-CB 4.05Å; F173-L234 HydrophobicContact CD2-CD1 3.86Å; F173-L234 HydrophobicContact CE2-CD1 4.15Å; Y227-L234 HydrophobicContact CE1-CD2 3.83Å; Y227-L234 WeakPolarHBondContact OH-CD2 3.46Å; L234-D236 VanDerWaalsContact C-N 3.27Å; L234-S239 PolarHBondContact O-OG 2.78Å
235Q93.9Very high91.8Very high126 Ų12646.9 Ų46.959%0.58923%0.225SC*.THydrogen-bonded Turntrans-77.1-14176.6-59.383.41.200113.3F173 P175 P233F173-Q235 WeakPolarHBondContact O-CA 3.3Å; P175-Q235 WeakPolarHBondContact CD-O 3.38Å; P233-Q235 PolarHBondContact O-N 3.08Å
236D91.8Very high90.4Very high39 Ų3945.7 Ų45.721%0.20922%0.215CC..SBendtrans-63.1136.2-179.4-170.5-61.7000110.5S174 P232 P233 L234 D238 S239 R246S174-D236 PolarHBondContact OG-O 2.86Å; P232-D236 HydrophobicContact CB-CB 3.95Å; P233-D236 WeakPolarHBondContact O-CB 3.4Å; P233-D236 PolarHBondContact O-N 3.45Å; P233-D236 VanDerWaalsContact O-N 3.09Å; L234-D236 VanDerWaalsContact C-N 3.27Å; D236-D238 PolarHBondContact O-N 3.27Å; D236-D238 VanDerWaalsContact O-N 3.16Å; D236-D238 WeakPolarHBondContact OD1-CA 3.4Å; D236-D238 PolarHBondContact OD1-N 3.17Å; D236-S239 VanDerWaalsContact O-CB 3.23Å; D236-S239 WeakPolarHBondContact O-CB 3.34Å; D236-S239 PolarHBondContact O-N 2.79Å; D236-S239 PolarHBondContact O-OG 3.3Å; D236-R246 IonicContact OD1-CZ 3.71Å; D236-R246 IonicContact OD1-NH1 3.5Å; D236-R246 PolarHBondContact OD1-NH1 3.46Å; D236-R246 IonicContact OD1-NH2 2.72Å; D236-R246 PolarHBondContact OD1-NH2 3.13Å; D236-R246 IonicContact OD2-CZ 2.73Å; D236-R246 IonicContact OD2-NH1 3.53Å; D236-R246 PolarHBondContact OD2-NH1 3.32Å; D236-R246 IonicContact OD2-NH2 3.12Å; D236-R246 PolarHBondContact OD2-NH2 3.39Å
237P89.4Confident88.5Confident79 Ų7951.8 Ų51.851%0.51324%0.243SC..THydrogen-bonded Turntrans-52.2-34.8175.8-28.136.3000113.6S174S174-P237 WeakPolarHBondContact OG-CA 3.47Å
238D89.8Confident86.5Confident59 Ų5956.4 Ų56.432%0.31627%0.272SS..THydrogen-bonded Turntrans-10227.4-179.1-74.7-43.7000111.9D236 H240 R241 R246D236-D238 PolarHBondContact O-N 3.27Å; D236-D238 VanDerWaalsContact O-N 3.16Å; D236-D238 WeakPolarHBondContact OD1-CA 3.4Å; D236-D238 PolarHBondContact OD1-N 3.17Å; D238-H240 PolarHBondContact O-N 2.83Å; D238-H240 IonicContact OD1-CE1 2.77Å; D238-H240 PolarHBondContact OD1-CE1 2.8Å; D238-R241 PolarHBondContact O-N 2.04Å; D238-R241 IonicContact OD1-NH1 3.43Å; D238-R246 PolarHBondContact O-NH2 3.06Å
239S91.1Very high84.5Confident0 Ų056.6 Ų56.60%028%0.281CS..THydrogen-bonded Turntrans-57.1-20.8-17657.60000115.2P233 L234 D236 R241P233-S239 WeakPolarHBondContact O-CB 3.18Å; L234-S239 PolarHBondContact O-OG 2.78Å; D236-S239 VanDerWaalsContact O-CB 3.23Å; D236-S239 WeakPolarHBondContact O-CB 3.34Å; D236-S239 PolarHBondContact O-N 2.79Å; D236-S239 PolarHBondContact O-OG 3.3Å; S239-R241 VanDerWaalsContact C-N 3.32Å; S239-R241 PolarHBondContact O-N 2.86Å
240H90.9Very high82.6Confident18 Ų1853.9 Ų53.98%0.08327%0.273CS..THydrogen-bonded Turntrans-74.9-8.6174.571.1-61.6000115.3G168 K169 R171 D238G168-H240 WeakPolarHBondContact O-CA 3.26Å; G168-H240 WeakPolarHBondContact O-CB 3.1Å; G168-H240 PolarHBondContact O-N 2.67Å; K169-H240 PolarHBondContact NZ-O 3.46Å; R171-H240 HydrophobicContact CG-CB 4.24Å; R171-H240 VanDerWaalsContact CZ-CE1 3.48Å; R171-H240 PolarHBondContact NE-ND1 3.27Å; R171-H240 VanDerWaalsContact NE-ND1 3.15Å; R171-H240 PolarHBondContact NH2-CE1 3.14Å; R171-H240 PolarHBondContact NH2-ND1 3.33Å; R171-H240 PolarHBondContact NH2-NE2 2.94Å; D238-H240 PolarHBondContact O-N 2.83Å; D238-H240 IonicContact OD1-CE1 2.77Å; D238-H240 PolarHBondContact OD1-CE1 2.8Å
241R90.8Very high80.6Confident86 Ų8657.3 Ų57.333%0.32530%0.295SS..SBendtrans-109.9136.4-175.6-60.2-178.2168.3174.1-18.1112.3E81 P232 D238 S239E81-R241 HydrophobicContact CG-CG 4.49Å; E81-R241 IonicContact OE1-CZ 2.98Å; E81-R241 IonicContact OE1-NE 3.1Å; E81-R241 PolarHBondContact OE1-NE 3.3Å; E81-R241 IonicContact OE1-NH2 2.67Å; E81-R241 PolarHBondContact OE1-NH2 3.37Å; E81-R241 WeakPolarHBondContact OE2-CD 3.37Å; E81-R241 VanDerWaalsContact OE2-CG 3.28Å; E81-R241 WeakPolarHBondContact OE2-CG 3.12Å; E81-R241 IonicContact OE2-CZ 3.31Å; E81-R241 IonicContact OE2-NE 3.87Å; E81-R241 PolarHBondContact OE2-NE 3.39Å; E81-R241 VanDerWaalsContact OE2-NE 3.12Å; P232-R241 WeakPolarHBondContact CD-O 3.48Å; D238-R241 PolarHBondContact O-N 2.04Å; D238-R241 IonicContact OD1-NH1 3.43Å; S239-R241 VanDerWaalsContact C-N 3.32Å; S239-R241 PolarHBondContact O-N 2.86Å
242P92Very high78.6Confident0 Ų059.9 Ų59.90%032%0.316CS..  trans-61.6148.2171.3-21.432.2000113.2D84 E87 H230 F231 R244 Q245D84-P242 HydrophobicContact CB-CG 3.97Å; D84-P242 WeakPolarHBondContact OD1-CD 3.37Å; D84-P242 WeakPolarHBondContact OD1-CG 3.4Å; E87-P242 HydrophobicContact CB-CB 3.99Å; E87-P242 HydrophobicContact CB-CG 4.2Å; E87-P242 HydrophobicContact CG-CB 3.93Å; E87-P242 HydrophobicContact CG-CG 4.36Å; H230-P242 WeakPolarHBondContact O-CA 3.43Å; F231-P242 HydrophobicContact CE1-CB 4.29Å; F231-P242 HydrophobicContact CE1-CG 3.82Å; F231-P242 HydrophobicContact CZ-CG 4.26Å; P242-R244 PolarHBondContact O-N 3.26Å; P242-Q245 PolarHBondContact O-N 3.01Å
243I88.7Confident76.8Confident53 Ų5365.8 Ų65.827%0.27234%0.344SS..Hα-helixtrans-61.9-46.5-176.9-65.7171.6000111.7H230 Q245 R246 E247H230-I243 PolarHBondContact O-N 2.93Å; I243-Q245 PolarHBondContact O-N 3.43Å; I243-Q245 VanDerWaalsContact O-N 3.1Å; I243-R246 WeakPolarHBondContact O-CA 3.34Å; I243-R246 VanDerWaalsContact O-CB 3.24Å; I243-R246 WeakPolarHBondContact O-CB 3.36Å; I243-R246 PolarHBondContact O-N 3.43Å; I243-E247 PolarHBondContact O-N 3.11Å
244R80.6Confident74.9Confident119 Ų11970 Ų7045%0.44936%0.36SS..Hα-helixtrans-56.7-30.9-178.3-99.8-176.5160.8167.62.9114.2E87 P242 E247E87-R244 IonicContact OE1-NH1 3.82Å; P242-R244 PolarHBondContact O-N 3.26Å; R244-E247 PolarHBondContact O-N 3.24Å
245Q70.9Confident72.9Confident33 Ų3377.4 Ų77.415%0.15439%0.386CS..Hα-helixtrans-75-32.4177.1-68.7172.428.400111.1H82 G83 P242 I243 E247 T248H82-Q245 PolarHBondContact O-NE2 3.23Å; H82-Q245 PolarHBondContact O-OE1 2.93Å; G83-Q245 VanDerWaalsContact C-NE2 3.3Å; P242-Q245 PolarHBondContact O-N 3.01Å; I243-Q245 PolarHBondContact O-N 3.43Å; I243-Q245 VanDerWaalsContact O-N 3.1Å; Q245-E247 PolarHBondContact O-N 3.43Å; Q245-T248 PolarHBondContact O-N 3.3Å; Q245-T248 PolarHBondContact O-OG1 3.04Å
246R68.2Low71Confident65 Ų6578.8 Ų78.825%0.24539%0.39CS..Hα-helixtrans-67-16.3172.1-56.7178.1177.3-154-7.5113.7P232 D236 D238 I243 P250P232-R246 VanDerWaalsContact CB-NH2 3.27Å; D236-R246 IonicContact OD1-CZ 3.71Å; D236-R246 IonicContact OD1-NH1 3.5Å; D236-R246 PolarHBondContact OD1-NH1 3.46Å; D236-R246 IonicContact OD1-NH2 2.72Å; D236-R246 PolarHBondContact OD1-NH2 3.13Å; D236-R246 IonicContact OD2-CZ 2.73Å; D236-R246 IonicContact OD2-NH1 3.53Å; D236-R246 PolarHBondContact OD2-NH1 3.32Å; D236-R246 IonicContact OD2-NH2 3.12Å; D236-R246 PolarHBondContact OD2-NH2 3.39Å; D238-R246 PolarHBondContact O-NH2 3.06Å; I243-R246 WeakPolarHBondContact O-CA 3.34Å; I243-R246 VanDerWaalsContact O-CB 3.24Å; I243-R246 WeakPolarHBondContact O-CB 3.36Å; I243-R246 PolarHBondContact O-N 3.43Å; R246-P250 WeakPolarHBondContact O-CD 3.42Å; R246-P250 WeakPolarHBondContact O-CG 3.24Å
247E59.3Low69.4Low130 Ų13083 Ų8361%0.60741%0.412SS*.Hα-helixtrans-83.5-25.2174.1-68.4177.5171.700111.6I243 R244 Q245I243-E247 PolarHBondContact O-N 3.11Å; R244-E247 PolarHBondContact O-N 3.24Å; Q245-E247 PolarHBondContact O-N 3.43Å
248T55.5Low67.9Low99 Ų9981.9 Ų81.961%0.60741%0.409SS*.Hα-helixtrans-78-24.9-179620000113.7Q245Q245-T248 PolarHBondContact O-N 3.3Å; Q245-T248 PolarHBondContact O-OG1 3.04Å
249V53.9Low66.2Low79 Ų7984.5 Ų84.548%0.47942%0.423SS..Hα-helixtrans-85.2-45.8-176.5-179.60000113.7V251 A252 Q253V249-V251 PolarHBondContact O-N 3.31Å; V249-A252 PolarHBondContact O-N 2.73Å; V249-Q253 VanDerWaalsContact O-CB 3.25Å; V249-Q253 WeakPolarHBondContact O-CB 3.28Å; V249-Q253 PolarHBondContact O-N 3.41Å
250P55.5Low64.6Low60 Ų6088.4 Ų88.439%0.3945%0.451SS..Hα-helixtrans-63.7-46.4-175.2-19.729.6000112R246 A252 Q253 E254R246-P250 WeakPolarHBondContact O-CD 3.42Å; R246-P250 WeakPolarHBondContact O-CG 3.24Å; P250-A252 VanDerWaalsContact C-N 3.32Å; P250-A252 PolarHBondContact O-N 3.02Å; P250-Q253 PolarHBondContact O-N 3.26Å; P250-E254 VanDerWaalsContact O-CB 3.25Å; P250-E254 WeakPolarHBondContact O-CB 3.23Å; P250-E254 WeakPolarHBondContact O-CG 3.05Å; P250-E254 PolarHBondContact O-N 3.31Å
251V51.1Low62.9Low84 Ų8492.5 Ų92.551%0.50948%0.477SS..Hα-helixtrans-67.2-34.7-177-177.40000111.8V249 R255V249-V251 PolarHBondContact O-N 3.31Å; V251-R255 VanDerWaalsContact O-CB 3.3Å; V251-R255 WeakPolarHBondContact O-CB 3.21Å; V251-R255 WeakPolarHBondContact O-CG 3.45Å; V251-R255 PolarHBondContact O-N 2.98Å
252A52.8Low61.2Low55 Ų5597.5 Ų97.546%0.45550%0.501SS..Hα-helixtrans-74.7-34.2177.700000112.2V249 P250 K256V249-A252 PolarHBondContact O-N 2.73Å; P250-A252 VanDerWaalsContact C-N 3.32Å; P250-A252 PolarHBondContact O-N 3.02Å; A252-K256 WeakPolarHBondContact O-CG 3.28Å; A252-K256 PolarHBondContact O-N 2.98Å; A252-K256 VanDerWaalsContact O-N 3.12Å
253Q56Low59.4Low126 Ų126104.2 Ų104.259%0.58954%0.536SS*.Hα-helixtrans-84.6-36.9-177.6-158.2159.5-1700112.2V249 P250 K256 L257V249-Q253 VanDerWaalsContact O-CB 3.25Å; V249-Q253 WeakPolarHBondContact O-CB 3.28Å; V249-Q253 PolarHBondContact O-N 3.41Å; P250-Q253 PolarHBondContact O-N 3.26Å; Q253-K256 PolarHBondContact O-N 3.27Å; Q253-L257 WeakPolarHBondContact O-CB 3.3Å; Q253-L257 PolarHBondContact O-N 3.21Å
254E55.4Low57.6Low137 Ų137109.2 Ų109.264%0.6456%0.563SS**Hα-helixtrans-62.5-42.4167.9-76.6-178.3165.500111.5P250 K256 L257 A258P250-E254 VanDerWaalsContact O-CB 3.25Å; P250-E254 WeakPolarHBondContact O-CB 3.23Å; P250-E254 WeakPolarHBondContact O-CG 3.05Å; P250-E254 PolarHBondContact O-N 3.31Å; E254-K256 PolarHBondContact O-N 3.31Å; E254-L257 PolarHBondContact O-N 3.04Å; E254-A258 WeakPolarHBondContact O-CB 3.3Å; E254-A258 PolarHBondContact O-N 2.96Å
255R54Low56.2Low178 Ų178108.7 Ų108.767%0.67258%0.575SS**Hα-helixtrans-63.8-38.9173.2-87.6-178.2171.1-178.9-2.4113V251 N259V251-R255 VanDerWaalsContact O-CB 3.3Å; V251-R255 WeakPolarHBondContact O-CB 3.21Å; V251-R255 WeakPolarHBondContact O-CG 3.45Å; V251-R255 PolarHBondContact O-N 2.98Å; R255-N259 VanDerWaalsContact O-CB 3.31Å; R255-N259 WeakPolarHBondContact O-CB 3.3Å; R255-N259 PolarHBondContact O-N 2.79Å
256K54.2Low54.9Low156 Ų156119 Ų11968%0.67863%0.63SS**Hα-helixtrans-67.3-41.5175.1-85.3-175.5176-175.20111.6A252 Q253 E254 N259 S260A252-K256 WeakPolarHBondContact O-CG 3.28Å; A252-K256 PolarHBondContact O-N 2.98Å; A252-K256 VanDerWaalsContact O-N 3.12Å; Q253-K256 PolarHBondContact O-N 3.27Å; E254-K256 PolarHBondContact O-N 3.31Å; K256-N259 PolarHBondContact O-N 3.27Å; K256-S260 WeakPolarHBondContact O-CB 3.25Å; K256-S260 PolarHBondContact O-N 2.84Å; K256-S260 PolarHBondContact O-OG 3.2Å
257L57.2Low54.2Low127 Ų127121.8 Ų121.867%0.66565%0.649SS**Hα-helixtrans-66.5-44.6177.6-159.873.7000110.8Q253 E254 N259 S260 T261Q253-L257 WeakPolarHBondContact O-CB 3.3Å; Q253-L257 PolarHBondContact O-N 3.21Å; E254-L257 PolarHBondContact O-N 3.04Å; L257-N259 VanDerWaalsContact C-N 3.32Å; L257-N259 PolarHBondContact O-N 3.39Å; L257-S260 PolarHBondContact O-N 3.24Å; L257-T261 PolarHBondContact O-N 3.19Å; L257-T261 PolarHBondContact O-OG1 3.43Å
258A57.8Low54Low55 Ų55121.3 Ų121.346%0.45565%0.652SS.*Hα-helixtrans-59.4-40.1174.500000112.5E254E254-A258 WeakPolarHBondContact O-CB 3.3Å; E254-A258 PolarHBondContact O-N 2.96Å
259N55.5Low53.9Low114 Ų114122.6 Ų122.661%0.6165%0.654SS**Hα-helixtrans-75.8-35.8177.9-73.3-3.7000113.2R255 K256 L257 T261 F262R255-N259 VanDerWaalsContact O-CB 3.31Å; R255-N259 WeakPolarHBondContact O-CB 3.3Å; R255-N259 PolarHBondContact O-N 2.79Å; K256-N259 PolarHBondContact O-N 3.27Å; L257-N259 VanDerWaalsContact C-N 3.32Å; L257-N259 PolarHBondContact O-N 3.39Å; N259-T261 VanDerWaalsContact C-N 3.32Å; N259-F262 PolarHBondContact O-N 3.05Å
260S57.2Low53.9Low83 Ų83125.1 Ų125.158%0.5866%0.664SS**Hα-helixtrans-69.1-30.7175.4-74.20000112.5K256 L257 F262 L263K256-S260 WeakPolarHBondContact O-CB 3.25Å; K256-S260 PolarHBondContact O-N 2.84Å; K256-S260 PolarHBondContact O-OG 3.2Å; L257-S260 PolarHBondContact O-N 3.24Å; S260-F262 PolarHBondContact O-N 3.49Å; S260-L263 PolarHBondContact O-N 3.35Å
261T54.4Low53.8Low104 Ų104129.2 Ų129.264%0.63868%0.682SS**THydrogen-bonded Turntrans-73.3-14.9176.6-36.60000112.2L257 N259L257-T261 PolarHBondContact O-N 3.19Å; L257-T261 PolarHBondContact O-OG1 3.43Å; N259-T261 VanDerWaalsContact C-N 3.32Å
262F54.7Low54Low190 Ų190132.2 Ų132.283%0.83369%0.693SS**THydrogen-bonded Turntrans-87.7-5.8175.8-114.1-86.7000114.2N259 S260N259-F262 PolarHBondContact O-N 3.05Å; S260-F262 PolarHBondContact O-N 3.49Å
263L54.2Low54Low141 Ų141137.7 Ų137.774%0.73871%0.71SS**  trans-10920.4-175.1-82.6169.4000114.4S260 P265S260-L263 PolarHBondContact O-N 3.35Å; L263-P265 WeakPolarHBondContact O-CD 3.47Å
264L52Low53.9Low159 Ų159138.6 Ų138.683%0.83272%0.719SS**  trans-103.884.4164-83.9160.3000110.5
265P49.5Very low53.8Low108 Ų108138.8 Ų138.870%0.70173%0.726SS**  trans-75.3139.6147.825-14.4000109.4L263L263-P265 WeakPolarHBondContact O-CD 3.47Å
266L44.5Very low53.7Low250 Ų250135.2 Ų135.2100%1.30973%0.731SS**  trans-43.70172.6-79.1146.4000114.1

Retrieved 266 of 266 residues in 420.6 ms (Link to these results)

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