A0A093HSK5_STRCA Loading...

Phosphatidylinositol-glycan biosynthesis class F protein

AlphaFold DB , UniProt , Accession A0A093HSK5, Species STRCA (Struthio camelus australis), Gene n/a, Length 219 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
1M55.6Low85.7Confident217 Ų21785.2 Ų85.2100%1.06942%0.424SS*.  0-52.70-75.8168.664.300112.8E3 A4 E5M1-E3 PolarHBondContact O-N 3.29Å; M1-A4 PolarHBondContact O-N 2.95Å; M1-E5 PolarHBondContact O-N 3.15Å
2K73.1Confident86.5Confident69 Ų6978.7 Ų78.730%0.339%0.393SS..Hα-helixtrans-63.6-38.5-178.2-68.9-172.8177.7-174.20115.7A4 E5 I6 I150 T215 S218K2-A4 PolarHBondContact O-N 3.25Å; K2-E5 WeakPolarHBondContact O-CB 3.49Å; K2-E5 PolarHBondContact O-N 3.31Å; K2-I6 VanDerWaalsContact O-CG1 3.31Å; K2-I6 WeakPolarHBondContact O-CG1 3.42Å; K2-I6 PolarHBondContact O-N 3.15Å; K2-I150 HydrophobicContact CB-CD1 4.45Å; K2-T215 VanDerWaalsContact NZ-CA 3.34Å; K2-T215 PolarHBondContact NZ-OG1 2.88Å; K2-S218 PolarHBondContact NZ-OG 3.4Å
3E83.3Confident87.3Confident79 Ų7973.6 Ų73.637%0.36937%0.369SS..Hα-helixtrans-64.2-37.9178.5-74.1-66162.800113.1M1 E5 I6 K7 R211M1-E3 PolarHBondContact O-N 3.29Å; E3-E5 VanDerWaalsContact C-N 3.32Å; E3-E5 PolarHBondContact O-N 3.49Å; E3-I6 PolarHBondContact O-N 3.32Å; E3-K7 WeakPolarHBondContact O-CG 3.46Å; E3-K7 PolarHBondContact O-N 3.46Å; E3-R211 IonicContact OE1-CZ 3.82Å; E3-R211 IonicContact OE1-NH1 2.82Å; E3-R211 PolarHBondContact OE1-NH1 3.33Å
4A86.4Confident88.1Confident52 Ų5275 Ų7543%0.4338%0.377SS..Hα-helixtrans-66.8-36174.700000111.6M1 K2 K7 R8M1-A4 PolarHBondContact O-N 2.95Å; K2-A4 PolarHBondContact O-N 3.25Å; A4-K7 PolarHBondContact O-N 3.07Å; A4-R8 VanDerWaalsContact O-CG 3.31Å; A4-R8 WeakPolarHBondContact O-CG 3.39Å; A4-R8 PolarHBondContact O-N 3.48Å
5E87.1Confident88.7Confident67 Ų6775.3 Ų75.331%0.31338%0.379SS..Hα-helixtrans-68.7-42.1175.6-170.3174.3-163.900112.1M1 K2 E3 K7 R8 L9 I150 W151M1-E5 PolarHBondContact O-N 3.15Å; K2-E5 WeakPolarHBondContact O-CB 3.49Å; K2-E5 PolarHBondContact O-N 3.31Å; E3-E5 VanDerWaalsContact C-N 3.32Å; E3-E5 PolarHBondContact O-N 3.49Å; E5-K7 VanDerWaalsContact C-N 3.34Å; E5-K7 PolarHBondContact O-N 2.85Å; E5-R8 PolarHBondContact O-N 3.39Å; E5-L9 PolarHBondContact O-N 2.94Å; E5-I150 HydrophobicContact CB-CD1 4.43Å; E5-I150 HydrophobicContact CG-CD1 4.28Å; E5-W151 PolarHBondContact OE1-NE1 3.05Å
6I90Very high89.3Confident11 Ų1170.7 Ų70.76%0.05636%0.357CS..Hα-helixtrans-60.2-44173.2-66.3169.4000110.5K2 E3 R8 L9 L10 I150 I207K2-I6 VanDerWaalsContact O-CG1 3.31Å; K2-I6 WeakPolarHBondContact O-CG1 3.42Å; K2-I6 PolarHBondContact O-N 3.15Å; E3-I6 PolarHBondContact O-N 3.32Å; I6-R8 PolarHBondContact O-N 3.04Å; I6-L9 PolarHBondContact O-N 2.75Å; I6-L10 WeakPolarHBondContact O-CB 3.45Å; I6-L10 PolarHBondContact O-N 2.82Å; I6-I150 HydrophobicContact CG1-CD1 3.85Å; I6-I207 HydrophobicContact CD1-CG2 4.28Å; I6-I207 HydrophobicContact CG1-CG2 4.15Å
7K91.6Very high89.8Confident148 Ų14867.5 Ų67.564%0.64334%0.341SS*.Hα-helixtrans-62.3-40.2175.9-73.4179.7-178.4-172.80112.4E3 A4 E5 L10 A11E3-K7 WeakPolarHBondContact O-CG 3.46Å; E3-K7 PolarHBondContact O-N 3.46Å; A4-K7 PolarHBondContact O-N 3.07Å; E5-K7 VanDerWaalsContact C-N 3.34Å; E5-K7 PolarHBondContact O-N 2.85Å; K7-L10 PolarHBondContact O-N 3.15Å; K7-A11 WeakPolarHBondContact O-CB 3.41Å; K7-A11 PolarHBondContact O-N 2.98Å
8R92.1Very high90.3Very high161 Ų16170.1 Ų70.161%0.60835%0.35SS*.Hα-helixtrans-64.8-43.8175.2-74.2174.5-172.3-177.12111.9A4 E5 I6 A11 A12 L62A4-R8 VanDerWaalsContact O-CG 3.31Å; A4-R8 WeakPolarHBondContact O-CG 3.39Å; A4-R8 PolarHBondContact O-N 3.48Å; E5-R8 PolarHBondContact O-N 3.39Å; I6-R8 PolarHBondContact O-N 3.04Å; R8-A11 PolarHBondContact O-N 3.2Å; R8-A12 WeakPolarHBondContact O-CB 3.5Å; R8-A12 PolarHBondContact O-N 3.36Å; R8-L62 HydrophobicContact CB-CD2 4.41Å
9L93.1Very high90.6Very high1 Ų167.4 Ų67.41%0.00534%0.339CS..Hα-helixtrans-59.9-49.2174.4175.768.2000110.7E5 I6 A11 A12 N13 I150 W151 I207E5-L9 PolarHBondContact O-N 2.94Å; I6-L9 PolarHBondContact O-N 2.75Å; L9-A11 VanDerWaalsContact C-N 3.34Å; L9-A11 PolarHBondContact O-N 2.94Å; L9-A12 PolarHBondContact O-N 3.25Å; L9-N13 WeakPolarHBondContact O-CB 3.38Å; L9-N13 PolarHBondContact O-N 3.34Å; L9-N13 PolarHBondContact O-OD1 3.31Å; L9-I150 HydrophobicContact CB-CG2 4.4Å; L9-I150 HydrophobicContact CD2-CG2 3.53Å; L9-W151 HydrophobicContact CB-CH2 4.19Å; L9-W151 HydrophobicContact CB-CZ2 4.4Å; L9-W151 HydrophobicContact CD1-CD2 4.35Å; L9-W151 HydrophobicContact CD1-CE3 3.69Å; L9-W151 HydrophobicContact CD1-CH2 3.94Å; L9-W151 HydrophobicContact CD1-CZ3 3.46Å; L9-W151 VanDerWaalsContact CD1-CZ3 3.46Å; L9-I207 HydrophobicContact CD2-CD1 3.69Å
10L95.1Very high91Very high73 Ų7364.2 Ų64.238%0.38232%0.323SS..Hα-helixtrans-57.9-46.9178.6177.962.9000111.2I6 K7 A12 N13 L14 P204I6-L10 WeakPolarHBondContact O-CB 3.45Å; I6-L10 PolarHBondContact O-N 2.82Å; K7-L10 PolarHBondContact O-N 3.15Å; L10-A12 PolarHBondContact O-N 3.26Å; L10-N13 PolarHBondContact O-N 3.27Å; L10-L14 HydrophobicContact CD1-CD1 4.12Å; L10-L14 HydrophobicContact CD1-CG 4.12Å; L10-L14 HydrophobicContact CG-CD1 4.03Å; L10-L14 HydrophobicContact CG-CG 4.41Å; L10-L14 WeakPolarHBondContact O-CB 3.15Å; L10-L14 VanDerWaalsContact O-CG 3.27Å; L10-L14 WeakPolarHBondContact O-CG 3.37Å; L10-L14 PolarHBondContact O-N 2.88Å; L10-P204 HydrophobicContact CB-CB 4.23Å; L10-P204 HydrophobicContact CD1-CB 3.98Å; L10-P204 HydrophobicContact CD1-CG 3.73Å
11A95.7Very high91.3Very high59 Ų5965 Ų6549%0.48833%0.327SS..Hα-helixtrans-61.5-43.3177.600000112.4K7 R8 L9 L14 L15K7-A11 WeakPolarHBondContact O-CB 3.41Å; K7-A11 PolarHBondContact O-N 2.98Å; R8-A11 PolarHBondContact O-N 3.2Å; L9-A11 VanDerWaalsContact C-N 3.34Å; L9-A11 PolarHBondContact O-N 2.94Å; A11-L14 PolarHBondContact O-N 3.46Å; A11-L15 WeakPolarHBondContact O-CB 3.29Å; A11-L15 PolarHBondContact O-N 2.99Å
12A95.6Very high93.3Very high7 Ų757.7 Ų57.76%0.05829%0.292CS..Hα-helixtrans-61.2-45.4176.100000111.7R8 L9 L10 L15 C16 L58 L62R8-A12 WeakPolarHBondContact O-CB 3.5Å; R8-A12 PolarHBondContact O-N 3.36Å; L9-A12 PolarHBondContact O-N 3.25Å; L10-A12 PolarHBondContact O-N 3.26Å; A12-L15 PolarHBondContact O-N 2.86Å; A12-C16 PolarHBondContact O-N 2.81Å; A12-L58 HydrophobicContact CB-CD1 4.19Å; A12-L58 HydrophobicContact CB-CD2 4.19Å; A12-L62 HydrophobicContact CB-CD1 3.84Å
13N96.8Very high94.4Very high13 Ų1354.6 Ų54.67%0.0728%0.279CS..Hα-helixtrans-65.5-42.7178.8-74.610.4000111.8L9 L10 L15 C16 V17 S154 L200L9-N13 WeakPolarHBondContact O-CB 3.38Å; L9-N13 PolarHBondContact O-N 3.34Å; L9-N13 PolarHBondContact O-OD1 3.31Å; L10-N13 PolarHBondContact O-N 3.27Å; N13-L15 VanDerWaalsContact C-N 3.3Å; N13-L15 PolarHBondContact O-N 2.9Å; N13-C16 WeakPolarHBondContact O-CB 3.29Å; N13-C16 PolarHBondContact O-N 3.49Å; N13-V17 WeakPolarHBondContact O-CG2 3.31Å; N13-V17 PolarHBondContact O-N 3.41Å; N13-S154 PolarHBondContact ND2-OG 3.42Å; N13-L200 HydrophobicContact CB-CB 4.08Å; N13-L200 HydrophobicContact CB-CD2 4.09Å; N13-L200 WeakPolarHBondContact CB-O 3.24Å; N13-L200 PolarHBondContact ND2-O 2.81Å
14L97.6Very high94.9Very high93 Ų9353.2 Ų53.249%0.48728%0.276SS..Hα-helixtrans-62.7-37.7175.4-72175.3000111.9L10 A11 C16 V17 F18L10-L14 HydrophobicContact CD1-CD1 4.12Å; L10-L14 HydrophobicContact CD1-CG 4.12Å; L10-L14 HydrophobicContact CG-CD1 4.03Å; L10-L14 HydrophobicContact CG-CG 4.41Å; L10-L14 WeakPolarHBondContact O-CB 3.15Å; L10-L14 VanDerWaalsContact O-CG 3.27Å; L10-L14 WeakPolarHBondContact O-CG 3.37Å; L10-L14 PolarHBondContact O-N 2.88Å; A11-L14 PolarHBondContact O-N 3.46Å; L14-C16 VanDerWaalsContact C-N 3.35Å; L14-V17 PolarHBondContact O-N 3.4Å; L14-F18 WeakPolarHBondContact O-CB 3.46Å; L14-F18 PolarHBondContact O-N 3.14Å
15L97.6Very high95.3Very high79 Ų7953.9 Ų53.941%0.41428%0.275SS..Hα-helixtrans-64.8-40.1174.7-170.863.7000111.5A11 A12 N13 F18 S19 L54 L58A11-L15 WeakPolarHBondContact O-CB 3.29Å; A11-L15 PolarHBondContact O-N 2.99Å; A12-L15 PolarHBondContact O-N 2.86Å; N13-L15 VanDerWaalsContact C-N 3.3Å; N13-L15 PolarHBondContact O-N 2.9Å; L15-F18 PolarHBondContact O-N 2.64Å; L15-S19 WeakPolarHBondContact O-CB 3.35Å; L15-S19 PolarHBondContact O-N 3.17Å; L15-L54 HydrophobicContact CD2-CD1 3.7Å; L15-L54 HydrophobicContact CG-CD1 4.03Å; L15-L54 HydrophobicContact CG-CD2 4.09Å; L15-L58 HydrophobicContact CD2-CD2 4.08Å
16C97.7Very high95.7Very high2 Ų253.4 Ų53.41%0.01428%0.276CS..Hα-helixtrans-62.7-45.3172.9-74.50000112.3A12 N13 L14 F18 S19 V20 L54 L200A12-C16 PolarHBondContact O-N 2.81Å; N13-C16 WeakPolarHBondContact O-CB 3.29Å; N13-C16 PolarHBondContact O-N 3.49Å; L14-C16 VanDerWaalsContact C-N 3.35Å; C16-F18 PolarHBondContact O-N 3.42Å; C16-S19 WeakPolarHBondContact O-CB 3.25Å; C16-S19 PolarHBondContact O-N 2.87Å; C16-V20 WeakPolarHBondContact O-CG2 3.33Å; C16-V20 PolarHBondContact O-N 3.3Å; C16-L54 HydrophobicContact CB-CD2 4.46Å; C16-L200 HydrophobicContact CB-CD1 3.51Å; C16-L200 HydrophobicContact CB-CD2 4.47Å
17V98.3Very high95.9Very high16 Ų1653.4 Ų53.410%0.09728%0.277CS..Hα-helixtrans-58.7-48.5175.4170.50000110.6N13 L14 S19 V20 I21 M197 L200 I201N13-V17 WeakPolarHBondContact O-CG2 3.31Å; N13-V17 PolarHBondContact O-N 3.41Å; L14-V17 PolarHBondContact O-N 3.4Å; V17-S19 VanDerWaalsContact C-N 3.31Å; V17-S19 PolarHBondContact O-N 2.99Å; V17-V20 PolarHBondContact O-N 3.42Å; V17-I21 HydrophobicContact CG1-CD1 4.24Å; V17-I21 WeakPolarHBondContact O-CG1 3.46Å; V17-I21 PolarHBondContact O-N 2.98Å; V17-I21 VanDerWaalsContact O-N 3.17Å; V17-M197 HydrophobicContact CG1-CE 3.79Å; V17-M197 HydrophobicContact CG2-CB 4.49Å; V17-L200 HydrophobicContact CG2-CB 3.89Å; V17-L200 HydrophobicContact CG2-CD1 3.84Å; V17-I201 HydrophobicContact CG2-CD1 4.47Å; V17-I201 HydrophobicContact CG2-CG1 4.2Å
18F98.1Very high96Very high115 Ų11549 Ų4950%0.50427%0.269SS..Hα-helixtrans-60.2-41.8177.3-177.8-112.8000111.7L14 L15 C16 V20 I21 L22L14-F18 WeakPolarHBondContact O-CB 3.46Å; L14-F18 PolarHBondContact O-N 3.14Å; L15-F18 PolarHBondContact O-N 2.64Å; C16-F18 PolarHBondContact O-N 3.42Å; F18-V20 VanDerWaalsContact C-N 3.34Å; F18-V20 PolarHBondContact O-N 3.35Å; F18-I21 PolarHBondContact O-N 2.61Å; F18-L22 HydrophobicContact CD1-CD1 3.82Å; F18-L22 HydrophobicContact CD1-CG 4.2Å; F18-L22 HydrophobicContact CE1-CD1 3.39Å; F18-L22 HydrophobicContact CE1-CD2 4.25Å; F18-L22 HydrophobicContact CE1-CG 3.88Å; F18-L22 HydrophobicContact CE2-CD2 4.28Å; F18-L22 HydrophobicContact CE2-CG 4.35Å; F18-L22 HydrophobicContact CZ-CD1 3.9Å; F18-L22 HydrophobicContact CZ-CD2 3.86Å; F18-L22 HydrophobicContact CZ-CG 3.95Å; F18-L22 WeakPolarHBondContact O-CG 3.35Å; F18-L22 PolarHBondContact O-N 3.18Å
19S97.8Very high96.1Very high19 Ų1949.4 Ų49.413%0.13328%0.275CS..Hα-helixtrans-62.6-37.2176.4-173.10000112.9L15 C16 V17 L22 T23 L54L15-S19 WeakPolarHBondContact O-CB 3.35Å; L15-S19 PolarHBondContact O-N 3.17Å; C16-S19 WeakPolarHBondContact O-CB 3.25Å; C16-S19 PolarHBondContact O-N 2.87Å; V17-S19 VanDerWaalsContact C-N 3.31Å; V17-S19 PolarHBondContact O-N 2.99Å; S19-L22 PolarHBondContact O-N 2.83Å; S19-T23 WeakPolarHBondContact O-CG2 3.49Å; S19-T23 PolarHBondContact O-N 3.01Å; S19-L54 VanDerWaalsContact CB-CD2 3.5Å
20V97.8Very high96.2Very high3 Ų357.1 Ų57.12%0.01831%0.309CS..Hα-helixtrans-62.2-46.6174.1174.20000110.1C16 V17 F18 L22 T23 I51 T193 Y196 M197C16-V20 WeakPolarHBondContact O-CG2 3.33Å; C16-V20 PolarHBondContact O-N 3.3Å; V17-V20 PolarHBondContact O-N 3.42Å; F18-V20 VanDerWaalsContact C-N 3.34Å; F18-V20 PolarHBondContact O-N 3.35Å; V20-L22 VanDerWaalsContact C-N 3.32Å; V20-L22 PolarHBondContact O-N 3.28Å; V20-T23 WeakPolarHBondContact O-CB 3.31Å; V20-T23 PolarHBondContact O-N 3.35Å; V20-T23 PolarHBondContact O-OG1 3.06Å; V20-I51 HydrophobicContact CG2-CD1 3.52Å; V20-I51 HydrophobicContact CG2-CG1 4.06Å; V20-T193 HydrophobicContact CG1-CG2 3.42Å; V20-T193 VanDerWaalsContact CG1-CG2 3.42Å; V20-Y196 HydrophobicContact CG2-CD1 4.17Å; V20-Y196 HydrophobicContact CG2-CE1 4.08Å; V20-M197 HydrophobicContact CB-CG 4.26Å; V20-M197 HydrophobicContact CB-SD 4.13Å; V20-M197 HydrophobicContact CG1-CG 4.14Å; V20-M197 HydrophobicContact CG1-SD 3.58Å; V20-M197 VanDerWaalsContact CG1-SD 3.58Å; V20-M197 HydrophobicContact CG2-CG 4.3Å
21I97.4Very high96.1Very high80 Ų8057.4 Ų57.441%0.4131%0.31SS..Hα-helixtrans-60.4-43.8178.4-63.3167000110.4V17 F18 T23 T24 T25 M197V17-I21 HydrophobicContact CG1-CD1 4.24Å; V17-I21 WeakPolarHBondContact O-CG1 3.46Å; V17-I21 PolarHBondContact O-N 2.98Å; V17-I21 VanDerWaalsContact O-N 3.17Å; F18-I21 PolarHBondContact O-N 2.61Å; I21-T23 VanDerWaalsContact C-N 3.26Å; I21-T23 PolarHBondContact O-N 3.24Å; I21-T24 PolarHBondContact O-N 3.38Å; I21-T24 PolarHBondContact O-OG1 3.49Å; I21-T25 PolarHBondContact O-OG1 3.23Å; I21-M197 HydrophobicContact CD1-CE 4.13Å; I21-M197 HydrophobicContact CG1-CE 3.85Å
22L97.5Very high95.9Very high64 Ų6462 Ų6234%0.33533%0.327SS..Hα-helixtrans-59.7-35.5175.7-72-177.1000112.4F18 S19 V20 T24 T25 V26F18-L22 HydrophobicContact CD1-CD1 3.82Å; F18-L22 HydrophobicContact CD1-CG 4.2Å; F18-L22 HydrophobicContact CE1-CD1 3.39Å; F18-L22 HydrophobicContact CE1-CD2 4.25Å; F18-L22 HydrophobicContact CE1-CG 3.88Å; F18-L22 HydrophobicContact CE2-CD2 4.28Å; F18-L22 HydrophobicContact CE2-CG 4.35Å; F18-L22 HydrophobicContact CZ-CD1 3.9Å; F18-L22 HydrophobicContact CZ-CD2 3.86Å; F18-L22 HydrophobicContact CZ-CG 3.95Å; F18-L22 WeakPolarHBondContact O-CG 3.35Å; F18-L22 PolarHBondContact O-N 3.18Å; S19-L22 PolarHBondContact O-N 2.83Å; V20-L22 VanDerWaalsContact C-N 3.32Å; V20-L22 PolarHBondContact O-N 3.28Å; L22-T24 PolarHBondContact O-N 3.45Å; L22-T25 PolarHBondContact O-N 3.12Å; L22-T25 VanDerWaalsContact O-N 3.15Å; L22-V26 HydrophobicContact CB-CG2 3.85Å; L22-V26 HydrophobicContact CD2-CG2 3.78Å; L22-V26 HydrophobicContact CG-CG2 4.32Å; L22-V26 VanDerWaalsContact O-CB 3.22Å; L22-V26 WeakPolarHBondContact O-CB 3.21Å; L22-V26 VanDerWaalsContact O-CG2 3.3Å; L22-V26 WeakPolarHBondContact O-CG2 3.46Å; L22-V26 PolarHBondContact O-N 3.18Å
23T96.9Very high95.7Very high4 Ų469 Ų693%0.02536%0.363CS..Hα-helixtrans-64.6-20.4177.5700000113.2S19 V20 I21 P27 W43 V46 C47S19-T23 WeakPolarHBondContact O-CG2 3.49Å; S19-T23 PolarHBondContact O-N 3.01Å; V20-T23 WeakPolarHBondContact O-CB 3.31Å; V20-T23 PolarHBondContact O-N 3.35Å; V20-T23 PolarHBondContact O-OG1 3.06Å; I21-T23 VanDerWaalsContact C-N 3.26Å; I21-T23 PolarHBondContact O-N 3.24Å; T23-P27 VanDerWaalsContact O-CD 3.24Å; T23-P27 WeakPolarHBondContact O-CD 3.45Å; T23-P27 VanDerWaalsContact O-CG 3.31Å; T23-P27 WeakPolarHBondContact O-CG 3.17Å; T23-W43 VanDerWaalsContact O-CD1 3.31Å; T23-W43 PolarHBondContact OG1-NE1 2.88Å; T23-V46 HydrophobicContact CG2-CG1 4.26Å; T23-C47 HydrophobicContact CG2-CB 4.39Å
24T93.9Very high95.7Very high51 Ų5169.5 Ų69.531%0.31337%0.365SS..Hα-helixtrans-85.6-21.717667.30000113.9I21 L22 V36 W43I21-T24 PolarHBondContact O-N 3.38Å; I21-T24 PolarHBondContact O-OG1 3.49Å; L22-T24 PolarHBondContact O-N 3.45Å; T24-V36 HydrophobicContact CG2-CG2 4.04Å; T24-W43 HydrophobicContact CG2-CZ2 4.31Å
25T93.6Very high95.6Very high66 Ų6667.5 Ų67.541%0.40536%0.359SS..Hα-helixtrans-115-40.4-172.254.90000112.8I21 L22 A28 F29I21-T25 PolarHBondContact O-OG1 3.23Å; L22-T25 PolarHBondContact O-N 3.12Å; L22-T25 VanDerWaalsContact O-N 3.15Å; T25-A28 WeakPolarHBondContact O-CB 3.4Å; T25-A28 PolarHBondContact O-N 2.99Å; T25-F29 WeakPolarHBondContact O-CD2 3.33Å
26V94.9Very high95.4Very high56 Ų5665.3 Ų65.334%0.33935%0.348SS..G310 helixtrans-62.6-43.6-175.8176.80000112.8L22 A28 F29 F30L22-V26 HydrophobicContact CB-CG2 3.85Å; L22-V26 HydrophobicContact CD2-CG2 3.78Å; L22-V26 HydrophobicContact CG-CG2 4.32Å; L22-V26 VanDerWaalsContact O-CB 3.22Å; L22-V26 WeakPolarHBondContact O-CB 3.21Å; L22-V26 VanDerWaalsContact O-CG2 3.3Å; L22-V26 WeakPolarHBondContact O-CG2 3.46Å; L22-V26 PolarHBondContact O-N 3.18Å; V26-A28 PolarHBondContact O-N 3.3Å; V26-A28 VanDerWaalsContact O-N 3.15Å; V26-F29 WeakPolarHBondContact O-CD2 3.29Å; V26-F29 PolarHBondContact O-N 2.9Å; V26-F29 VanDerWaalsContact O-N 3.08Å; V26-F30 HydrophobicContact CG1-CD2 4.2Å; V26-F30 HydrophobicContact CG1-CE2 3.73Å; V26-F30 VanDerWaalsContact O-CD2 3.31Å; V26-F30 WeakPolarHBondContact O-CD2 3.19Å
27P95.4Very high95.3Very high11 Ų1168.5 Ų68.57%0.07137%0.365CS..G310 helixtrans-61.5-26.1-179.5-26.238000113.7T23 F29 F30 L31 F34 V46T23-P27 VanDerWaalsContact O-CD 3.24Å; T23-P27 WeakPolarHBondContact O-CD 3.45Å; T23-P27 VanDerWaalsContact O-CG 3.31Å; T23-P27 WeakPolarHBondContact O-CG 3.17Å; P27-F29 PolarHBondContact O-N 3.35Å; P27-F30 PolarHBondContact O-N 2.83Å; P27-L31 HydrophobicContact CB-CD1 4.23Å; P27-L31 WeakPolarHBondContact O-CB 3.32Å; P27-L31 PolarHBondContact O-N 3.5Å; P27-F34 HydrophobicContact CB-CD1 3.94Å; P27-F34 HydrophobicContact CB-CD2 3.81Å; P27-F34 HydrophobicContact CB-CE1 3.85Å; P27-F34 HydrophobicContact CB-CE2 3.71Å; P27-F34 HydrophobicContact CB-CG 3.92Å; P27-F34 HydrophobicContact CB-CZ 3.73Å; P27-F34 HydrophobicContact CG-CE1 4.23Å; P27-F34 HydrophobicContact CG-CE2 4.23Å; P27-F34 HydrophobicContact CG-CZ 3.93Å; P27-V46 HydrophobicContact CG-CB 4.46Å; P27-V46 HydrophobicContact CG-CG1 3.77Å; P27-V46 HydrophobicContact CG-CG2 4.36Å
28A93.3Very high95.1Very high57 Ų5770.9 Ų70.947%0.47139%0.393SS..G310 helixtrans-63.3-20177.200000113.7T25 V26 F34T25-A28 WeakPolarHBondContact O-CB 3.4Å; T25-A28 PolarHBondContact O-N 2.99Å; V26-A28 PolarHBondContact O-N 3.3Å; V26-A28 VanDerWaalsContact O-N 3.15Å; A28-F34 HydrophobicContact CB-CD1 3.98Å
29F93.9Very high95Very high168 Ų16867.4 Ų67.474%0.73738%0.381SS*.G310 helixtrans-83-16.5175.5-64.2-82000113.5T25 V26 P27T25-F29 WeakPolarHBondContact O-CD2 3.33Å; V26-F29 WeakPolarHBondContact O-CD2 3.29Å; V26-F29 PolarHBondContact O-N 2.9Å; V26-F29 VanDerWaalsContact O-N 3.08Å; P27-F29 PolarHBondContact O-N 3.35Å
30F94.7Very high95Very high163 Ų16367 Ų6772%0.71538%0.377SS*.THydrogen-bonded Turntrans-119.5-22.6-172.4-59.8-76.9000113.7V26 P27V26-F30 HydrophobicContact CG1-CD2 4.2Å; V26-F30 HydrophobicContact CG1-CE2 3.73Å; V26-F30 VanDerWaalsContact O-CD2 3.31Å; V26-F30 WeakPolarHBondContact O-CD2 3.19Å; P27-F30 PolarHBondContact O-N 2.83Å
31L93.6Very high95Very high79 Ų7969.3 Ų69.341%0.41439%0.389SS..SBendtrans-119118.6-176-60.2178.3000109.6P27 F34 T42P27-L31 HydrophobicContact CB-CD1 4.23Å; P27-L31 WeakPolarHBondContact O-CB 3.32Å; P27-L31 PolarHBondContact O-N 3.5Å; L31-F34 HydrophobicContact CB-CB 4.03Å; L31-F34 HydrophobicContact CD1-CD2 4.33Å; L31-F34 WeakPolarHBondContact O-CB 2.99Å; L31-F34 PolarHBondContact O-N 3.27Å; L31-T42 HydrophobicContact CD1-CG2 3.78Å
32D91.9Very high95Very high156 Ų15668.3 Ų68.383%0.83439%0.387SS*.THydrogen-bonded Turntrans-60137.9176.2-64.5-37.3000110.8F34D32-F34 PolarHBondContact O-N 2.85Å; D32-F34 VanDerWaalsContact O-N 3.15Å
33N91.5Very high95Very high153 Ų15365.3 Ų65.382%0.81837%0.371SS*.THydrogen-bonded Turntrans59.418.4180-54.7-53.5000115.6S35N33-S35 PolarHBondContact O-N 3.33Å
34F95.5Very high95.1Very high25 Ų2565.2 Ų65.211%0.1137%0.37CS..  trans-61.1128.8175.8175.2-93.1000111.4P27 A28 L31 D32 V36 T39 T42 W43P27-F34 HydrophobicContact CB-CD1 3.94Å; P27-F34 HydrophobicContact CB-CD2 3.81Å; P27-F34 HydrophobicContact CB-CE1 3.85Å; P27-F34 HydrophobicContact CB-CE2 3.71Å; P27-F34 HydrophobicContact CB-CG 3.92Å; P27-F34 HydrophobicContact CB-CZ 3.73Å; P27-F34 HydrophobicContact CG-CE1 4.23Å; P27-F34 HydrophobicContact CG-CE2 4.23Å; P27-F34 HydrophobicContact CG-CZ 3.93Å; A28-F34 HydrophobicContact CB-CD1 3.98Å; L31-F34 HydrophobicContact CB-CB 4.03Å; L31-F34 HydrophobicContact CD1-CD2 4.33Å; L31-F34 WeakPolarHBondContact O-CB 2.99Å; L31-F34 PolarHBondContact O-N 3.27Å; D32-F34 PolarHBondContact O-N 2.85Å; D32-F34 VanDerWaalsContact O-N 3.15Å; F34-V36 HydrophobicContact CE1-CG2 4.49Å; F34-T39 WeakPolarHBondContact CD2-OG1 3.4Å; F34-T42 HydrophobicContact CD2-CG2 4.41Å; F34-T42 HydrophobicContact CE2-CG2 4.45Å; F34-W43 HydrophobicContact CE2-CB 4.02Å; F34-W43 HydrophobicContact CZ-CB 3.98Å; F34-W43 AromaticContact CZ-CD1 3.97Å; F34-W43 HydrophobicContact CZ-CG 4.35Å
35S95.4Very high95.3Very high51 Ų5165.4 Ų65.436%0.35737%0.373SS..  trans-145.2147.2166.464.70000110.4N33 L37 G38 T39N33-S35 PolarHBondContact O-N 3.33Å; S35-L37 PolarHBondContact O-N 2.79Å; S35-G38 VanDerWaalsContact OG-CA 3.23Å; S35-G38 WeakPolarHBondContact OG-CA 3.36Å; S35-G38 PolarHBondContact OG-N 3.12Å; S35-T39 PolarHBondContact N-OG1 3.5Å; S35-T39 CarbonylContact O-C 3.49Å; S35-T39 WeakPolarHBondContact O-CA 3.36Å; S35-T39 PolarHBondContact O-N 3.42Å; S35-T39 PolarHBondContact O-OG1 3.41Å
36V95.2Very high95.5Very high32 Ų3264.1 Ų64.119%0.19437%0.365CS..THydrogen-bonded Turntrans-60.3-32.9179.6175.60000111.8T24 F34 H40 W43 L190T24-V36 HydrophobicContact CG2-CG2 4.04Å; F34-V36 HydrophobicContact CE1-CG2 4.49Å; V36-H40 VanDerWaalsContact O-CA 3.31Å; V36-H40 WeakPolarHBondContact O-CA 3.31Å; V36-H40 WeakPolarHBondContact O-CB 3.37Å; V36-H40 PolarHBondContact O-ND1 3.39Å; V36-W43 HydrophobicContact CG1-CD2 3.88Å; V36-W43 HydrophobicContact CG1-CE3 4.11Å; V36-W43 HydrophobicContact CG1-CG 4.2Å; V36-W43 HydrophobicContact CG2-CG 4.31Å; V36-L190 HydrophobicContact CG1-CD2 4.06Å
37L95.5Very high95.6Very high69 Ų6961.4 Ų61.436%0.36135%0.349SS..THydrogen-bonded Turntrans-90.2-48.9179.8-59-179.9000112.4S35 W181 I186 L190S35-L37 PolarHBondContact O-N 2.79Å; L37-W181 HydrophobicContact CD1-CB 4.41Å; L37-W181 HydrophobicContact CD2-CB 3.95Å; L37-I186 HydrophobicContact CD2-CG2 3.56Å; L37-L190 HydrophobicContact CD2-CD1 4.18Å
38G93.8Very high95.8Very high66 Ų6661.1 Ų61.168%0.6835%0.347SS*.THydrogen-bonded Turntrans-76-30.6-174.300000114.1S35S35-G38 VanDerWaalsContact OG-CA 3.23Å; S35-G38 WeakPolarHBondContact OG-CA 3.36Å; S35-G38 PolarHBondContact OG-N 3.12Å
39T95.6Very high96Very high42 Ų4263.3 Ų63.326%0.25835%0.354SS..THydrogen-bonded Turntrans-11645.1175.157.60000110.8F34 S35 L41 T42 W43F34-T39 WeakPolarHBondContact CD2-OG1 3.4Å; S35-T39 PolarHBondContact N-OG1 3.5Å; S35-T39 CarbonylContact O-C 3.49Å; S35-T39 WeakPolarHBondContact O-CA 3.36Å; S35-T39 PolarHBondContact O-N 3.42Å; S35-T39 PolarHBondContact O-OG1 3.41Å; T39-L41 VanDerWaalsContact C-N 3.34Å; T39-L41 PolarHBondContact O-N 3.01Å; T39-T42 WeakPolarHBondContact O-CB 3.39Å; T39-T42 PolarHBondContact O-N 2.86Å; T39-T42 VanDerWaalsContact O-N 3.09Å; T39-W43 PolarHBondContact O-N 2.9Å
40H97.3Very high96.2Very high10 Ų1057.4 Ų57.45%0.04633%0.333CS..Hα-helixtrans-58.4-40.6-167.3-169.472.2000114.1V36 T42 W43 L44 I186 S189V36-H40 VanDerWaalsContact O-CA 3.31Å; V36-H40 WeakPolarHBondContact O-CA 3.31Å; V36-H40 WeakPolarHBondContact O-CB 3.37Å; V36-H40 PolarHBondContact O-ND1 3.39Å; H40-T42 VanDerWaalsContact C-N 3.3Å; H40-T42 PolarHBondContact O-N 3.45Å; H40-W43 AromaticContact CE1-CE3 3.41Å; H40-W43 VanDerWaalsContact CE1-CE3 3.41Å; H40-W43 AromaticContact CE1-CZ3 3.45Å; H40-W43 VanDerWaalsContact CE1-CZ3 3.45Å; H40-W43 WeakPolarHBondContact CE1-CZ3 3.33Å; H40-W43 AromaticContact ND1-CE3 3.72Å; H40-W43 WeakPolarHBondContact O-CA 3.31Å; H40-W43 WeakPolarHBondContact O-CB 3.36Å; H40-W43 PolarHBondContact O-N 3.32Å; H40-W43 VanDerWaalsContact O-N 3.09Å; H40-L44 WeakPolarHBondContact O-CG 3.4Å; H40-L44 PolarHBondContact O-N 3.22Å; H40-I186 HydrophobicContact CB-CD1 4.11Å; H40-I186 HydrophobicContact CB-CG1 4.09Å; H40-S189 PolarHBondContact CE1-OG 3.29Å; H40-S189 PolarHBondContact NE2-OG 2.81Å
41L97.3Very high96.4Very high52 Ų5249.6 Ų49.627%0.27230%0.299SS..Hα-helixtrans-62.8-37.7178.7-58.8-170.8000112.3T39 W43 L44 C45 T110 E111 L114T39-L41 VanDerWaalsContact C-N 3.34Å; T39-L41 PolarHBondContact O-N 3.01Å; L41-W43 VanDerWaalsContact C-N 3.33Å; L41-L44 HydrophobicContact CD2-CD1 3.97Å; L41-L44 PolarHBondContact O-N 3.46Å; L41-C45 PolarHBondContact O-N 3.2Å; L41-C45 PolarHBondContact O-SG 3.46Å; L41-C45 VanDerWaalsContact O-SG 3.39Å; L41-T110 HydrophobicContact CD1-CG2 4.36Å; L41-E111 HydrophobicContact CD1-CG 4.39Å; L41-E111 HydrophobicContact CD2-CB 4.33Å; L41-E111 HydrophobicContact CD2-CG 4.07Å; L41-L114 HydrophobicContact CB-CD1 3.87Å; L41-L114 HydrophobicContact CD1-CD1 4.36Å; L41-L114 HydrophobicContact CD2-CD1 4.05Å; L41-L114 HydrophobicContact CG-CD1 4.31Å
42T97.2Very high96.6Very high59 Ų5946.9 Ų46.936%0.36229%0.287SS..Hα-helixtrans-61.8-44.5173-53.60000110.6L31 F34 T39 H40 C45 V46L31-T42 HydrophobicContact CD1-CG2 3.78Å; F34-T42 HydrophobicContact CD2-CG2 4.41Å; F34-T42 HydrophobicContact CE2-CG2 4.45Å; T39-T42 WeakPolarHBondContact O-CB 3.39Å; T39-T42 PolarHBondContact O-N 2.86Å; T39-T42 VanDerWaalsContact O-N 3.09Å; H40-T42 VanDerWaalsContact C-N 3.3Å; H40-T42 PolarHBondContact O-N 3.45Å; T42-C45 PolarHBondContact O-N 3.49Å; T42-V46 WeakPolarHBondContact O-CG2 3.47Å; T42-V46 PolarHBondContact O-N 3.33Å
43W98.2Very high96.9Very high2 Ų241.7 Ų41.71%0.00827%0.266CS..Hα-helixtrans-62.6-42175.7175.670.1000112.4T23 T24 F34 V36 T39 H40 L41 C45 V46 C47 L190 T193T23-W43 VanDerWaalsContact O-CD1 3.31Å; T23-W43 PolarHBondContact OG1-NE1 2.88Å; T24-W43 HydrophobicContact CG2-CZ2 4.31Å; F34-W43 HydrophobicContact CE2-CB 4.02Å; F34-W43 HydrophobicContact CZ-CB 3.98Å; F34-W43 AromaticContact CZ-CD1 3.97Å; F34-W43 HydrophobicContact CZ-CG 4.35Å; V36-W43 HydrophobicContact CG1-CD2 3.88Å; V36-W43 HydrophobicContact CG1-CE3 4.11Å; V36-W43 HydrophobicContact CG1-CG 4.2Å; V36-W43 HydrophobicContact CG2-CG 4.31Å; T39-W43 PolarHBondContact O-N 2.9Å; H40-W43 AromaticContact CE1-CE3 3.41Å; H40-W43 VanDerWaalsContact CE1-CE3 3.41Å; H40-W43 AromaticContact CE1-CZ3 3.45Å; H40-W43 VanDerWaalsContact CE1-CZ3 3.45Å; H40-W43 WeakPolarHBondContact CE1-CZ3 3.33Å; H40-W43 AromaticContact ND1-CE3 3.72Å; H40-W43 WeakPolarHBondContact O-CA 3.31Å; H40-W43 WeakPolarHBondContact O-CB 3.36Å; H40-W43 PolarHBondContact O-N 3.32Å; H40-W43 VanDerWaalsContact O-N 3.09Å; L41-W43 VanDerWaalsContact C-N 3.33Å; W43-C45 VanDerWaalsContact C-N 3.33Å; W43-C45 PolarHBondContact O-N 3.01Å; W43-V46 PolarHBondContact O-N 3.47Å; W43-C47 VanDerWaalsContact O-CB 3.22Å; W43-C47 WeakPolarHBondContact O-CB 3.45Å; W43-C47 PolarHBondContact O-N 3.45Å; W43-L190 HydrophobicContact CH2-CD2 3.76Å; W43-L190 HydrophobicContact CZ2-CD2 4.46Å; W43-L190 HydrophobicContact CZ3-CD2 3.99Å; W43-T193 HydrophobicContact CH2-CG2 4.18Å; W43-T193 WeakPolarHBondContact CH2-OG1 3.31Å; W43-T193 HydrophobicContact CZ2-CG2 4.23Å
44L98.3Very high97.1Very high1 Ų135.6 Ų35.61%0.00523%0.233CC..Hα-helixtrans-57.6-45175.2-68.7-179.9000112H40 L41 S48 L114 L118 P185H40-L44 WeakPolarHBondContact O-CG 3.4Å; H40-L44 PolarHBondContact O-N 3.22Å; L41-L44 HydrophobicContact CD2-CD1 3.97Å; L41-L44 PolarHBondContact O-N 3.46Å; L44-S48 VanDerWaalsContact O-CB 3.27Å; L44-S48 WeakPolarHBondContact O-CB 3.48Å; L44-S48 PolarHBondContact O-N 2.91Å; L44-S48 PolarHBondContact O-OG 2.87Å; L44-L114 HydrophobicContact CB-CB 4.42Å; L44-L114 HydrophobicContact CD1-CB 3.96Å; L44-L118 HydrophobicContact CD2-CD2 3.78Å; L44-P185 HydrophobicContact CD1-CG 4.28Å
45C98.1Very high97.1Very high55 Ų5535 Ų3537%0.37223%0.231SC..Hα-helixtrans-62.5-51.2176.8-72.30000111.5L41 T42 W43 C47 S48 V49L41-C45 PolarHBondContact O-N 3.2Å; L41-C45 PolarHBondContact O-SG 3.46Å; L41-C45 VanDerWaalsContact O-SG 3.39Å; T42-C45 PolarHBondContact O-N 3.49Å; W43-C45 VanDerWaalsContact C-N 3.33Å; W43-C45 PolarHBondContact O-N 3.01Å; C45-C47 PolarHBondContact O-N 2.94Å; C45-S48 PolarHBondContact O-N 3.35Å; C45-V49 WeakPolarHBondContact O-CB 3.47Å; C45-V49 VanDerWaalsContact O-CG2 3.3Å; C45-V49 WeakPolarHBondContact O-CG2 3.33Å; C45-V49 PolarHBondContact O-N 3.45Å
46V98.1Very high97.1Very high39 Ų3936.1 Ų36.124%0.23623%0.232CC..Hα-helixtrans-59.4-48.8179.1172.30000110.6T23 P27 T42 W43 S48 V49 S50T23-V46 HydrophobicContact CG2-CG1 4.26Å; P27-V46 HydrophobicContact CG-CB 4.46Å; P27-V46 HydrophobicContact CG-CG1 3.77Å; P27-V46 HydrophobicContact CG-CG2 4.36Å; T42-V46 WeakPolarHBondContact O-CG2 3.47Å; T42-V46 PolarHBondContact O-N 3.33Å; W43-V46 PolarHBondContact O-N 3.47Å; V46-S48 PolarHBondContact O-N 2.97Å; V46-V49 PolarHBondContact O-N 2.84Å; V46-S50 VanDerWaalsContact O-CB 3.31Å; V46-S50 WeakPolarHBondContact O-CB 3.3Å; V46-S50 PolarHBondContact O-N 3.48Å; V46-S50 PolarHBondContact O-OG 3.44Å
47C98.4Very high97.1Very high0 Ų038.9 Ų38.90%025%0.245CC..Hα-helixtrans-59.5-49.9179.9-164.80000111.2T23 W43 C45 V49 S50 I51 L118T23-C47 HydrophobicContact CG2-CB 4.39Å; W43-C47 VanDerWaalsContact O-CB 3.22Å; W43-C47 WeakPolarHBondContact O-CB 3.45Å; W43-C47 PolarHBondContact O-N 3.45Å; C45-C47 PolarHBondContact O-N 2.94Å; C47-V49 PolarHBondContact O-N 2.9Å; C47-S50 PolarHBondContact O-N 2.9Å; C47-I51 WeakPolarHBondContact O-CB 3.38Å; C47-I51 VanDerWaalsContact O-CG1 3.23Å; C47-I51 WeakPolarHBondContact O-CG1 3.48Å; C47-I51 PolarHBondContact O-N 3.13Å; C47-L118 HydrophobicContact CB-CD1 4.2Å
48S98.5Very high97Very high5 Ų536.6 Ų36.64%0.03523%0.233CC..Hα-helixtrans-61.2-44.3-179.7-58.60000112.1L44 C45 V46 S52 L118L44-S48 VanDerWaalsContact O-CB 3.27Å; L44-S48 WeakPolarHBondContact O-CB 3.48Å; L44-S48 PolarHBondContact O-N 2.91Å; L44-S48 PolarHBondContact O-OG 2.87Å; C45-S48 PolarHBondContact O-N 3.35Å; V46-S48 PolarHBondContact O-N 2.97Å; S48-S52 WeakPolarHBondContact O-CB 3.11Å; S48-S52 PolarHBondContact O-N 3.31Å; S48-S52 PolarHBondContact O-OG 3.08Å; S48-L118 WeakPolarHBondContact OG-CA 3.47Å; S48-L118 WeakPolarHBondContact OG-CD1 3.29Å
49V98.3Very high96.8Very high102 Ų10235.7 Ų35.762%0.61821%0.209SC*.Hα-helixtrans-66.9-48.5179.1170.80000111.3C45 V46 C47 I51 S52 A53C45-V49 WeakPolarHBondContact O-CB 3.47Å; C45-V49 VanDerWaalsContact O-CG2 3.3Å; C45-V49 WeakPolarHBondContact O-CG2 3.33Å; C45-V49 PolarHBondContact O-N 3.45Å; V46-V49 PolarHBondContact O-N 2.84Å; C47-V49 PolarHBondContact O-N 2.9Å; V49-I51 PolarHBondContact O-N 3.38Å; V49-S52 PolarHBondContact O-N 3Å; V49-A53 WeakPolarHBondContact O-CB 3.4Å; V49-A53 PolarHBondContact O-N 2.8Å
50S97.9Very high96.5Very high44 Ų4438.6 Ų38.631%0.30822%0.223SC..Hα-helixtrans-61.6-46.8-179.4-64.70000111.8V46 C47 S52 A53 L54V46-S50 VanDerWaalsContact O-CB 3.31Å; V46-S50 WeakPolarHBondContact O-CB 3.3Å; V46-S50 PolarHBondContact O-N 3.48Å; V46-S50 PolarHBondContact O-OG 3.44Å; C47-S50 PolarHBondContact O-N 2.9Å; S50-S52 VanDerWaalsContact C-N 3.35Å; S50-A53 PolarHBondContact O-N 3.45Å; S50-L54 WeakPolarHBondContact O-CB 3.25Å; S50-L54 PolarHBondContact O-N 2.84Å
51I98.3Very high96.1Very high0 Ų044 Ų440%025%0.251CS..Hα-helixtrans-68.9-36.2179.3-61.7-59.3000111V20 C47 V49 N55 T121 F122 Y196V20-I51 HydrophobicContact CG2-CD1 3.52Å; V20-I51 HydrophobicContact CG2-CG1 4.06Å; C47-I51 WeakPolarHBondContact O-CB 3.38Å; C47-I51 VanDerWaalsContact O-CG1 3.23Å; C47-I51 WeakPolarHBondContact O-CG1 3.48Å; C47-I51 PolarHBondContact O-N 3.13Å; V49-I51 PolarHBondContact O-N 3.38Å; I51-N55 WeakPolarHBondContact CG2-ND2 3.22Å; I51-N55 WeakPolarHBondContact O-CB 3.42Å; I51-N55 PolarHBondContact O-N 2.76Å; I51-N55 PolarHBondContact O-ND2 3.29Å; I51-T121 HydrophobicContact CB-CG2 4.1Å; I51-T121 HydrophobicContact CG2-CG2 3.92Å; I51-F122 HydrophobicContact CB-CE1 4.48Å; I51-F122 HydrophobicContact CG1-CE1 4.31Å; I51-F122 HydrophobicContact CG2-CD1 4.25Å; I51-F122 HydrophobicContact CG2-CE1 4.12Å; I51-Y196 HydrophobicContact CG2-CE1 4.21Å
52S98.1Very high95.5Very high22 Ų2243.8 Ų43.815%0.15425%0.249CC..Hα-helixtrans-63-49.9174.5-64.80000112.3S48 V49 S50 L54 N55 I56 T121 L125S48-S52 WeakPolarHBondContact O-CB 3.11Å; S48-S52 PolarHBondContact O-N 3.31Å; S48-S52 PolarHBondContact O-OG 3.08Å; V49-S52 PolarHBondContact O-N 3Å; S50-S52 VanDerWaalsContact C-N 3.35Å; S52-L54 VanDerWaalsContact C-N 3.33Å; S52-L54 PolarHBondContact O-N 2.9Å; S52-N55 PolarHBondContact O-N 3.34Å; S52-I56 VanDerWaalsContact O-CG1 3.27Å; S52-I56 WeakPolarHBondContact O-CG1 3.23Å; S52-I56 PolarHBondContact O-N 2.96Å; S52-T121 WeakPolarHBondContact OG-CG2 3.46Å; S52-L125 VanDerWaalsContact CA-CD2 3.41Å; S52-L125 VanDerWaalsContact OG-CD2 3.26Å; S52-L125 WeakPolarHBondContact OG-CD2 3.42Å
53A97.8Very high94.6Very high47 Ų4746.5 Ų46.539%0.38826%0.256SS..Hα-helixtrans-58.6-46.6178.400000111V49 S50 I56 I57V49-A53 WeakPolarHBondContact O-CB 3.4Å; V49-A53 PolarHBondContact O-N 2.8Å; S50-A53 PolarHBondContact O-N 3.45Å; A53-I56 PolarHBondContact O-N 2.68Å; A53-I57 WeakPolarHBondContact O-CD1 3.35Å; A53-I57 VanDerWaalsContact O-CG1 3.24Å; A53-I57 WeakPolarHBondContact O-CG1 3.1Å; A53-I57 PolarHBondContact O-N 2.88Å
54L97.4Very high93Very high25 Ų2547.9 Ų47.913%0.13127%0.265CS..Hα-helixtrans-62.3-46.1180-178.860.2000112.5L15 C16 S19 S50 S52 I56 I57 L58L15-L54 HydrophobicContact CD2-CD1 3.7Å; L15-L54 HydrophobicContact CG-CD1 4.03Å; L15-L54 HydrophobicContact CG-CD2 4.09Å; C16-L54 HydrophobicContact CB-CD2 4.46Å; S19-L54 VanDerWaalsContact CB-CD2 3.5Å; S50-L54 WeakPolarHBondContact O-CB 3.25Å; S50-L54 PolarHBondContact O-N 2.84Å; S52-L54 VanDerWaalsContact C-N 3.33Å; S52-L54 PolarHBondContact O-N 2.9Å; L54-I56 VanDerWaalsContact C-N 3.32Å; L54-I56 PolarHBondContact O-N 3.41Å; L54-I57 PolarHBondContact O-N 3.41Å; L54-L58 HydrophobicContact CD1-CD1 4.17Å; L54-L58 HydrophobicContact CD1-CG 4.11Å; L54-L58 HydrophobicContact CG-CD1 3.92Å; L54-L58 HydrophobicContact CG-CG 4.31Å; L54-L58 WeakPolarHBondContact O-CB 3.23Å; L54-L58 WeakPolarHBondContact O-CG 3.41Å; L54-L58 PolarHBondContact O-N 2.92Å
55N95.5Very high91.2Very high11 Ų1152 Ų526%0.05929%0.288CS..Hα-helixtrans-65.5-36.1179.4-78.9-67.6000112.6I51 S52 Y59 Q126I51-N55 WeakPolarHBondContact CG2-ND2 3.22Å; I51-N55 WeakPolarHBondContact O-CB 3.42Å; I51-N55 PolarHBondContact O-N 2.76Å; I51-N55 PolarHBondContact O-ND2 3.29Å; S52-N55 PolarHBondContact O-N 3.34Å; N55-Y59 VanDerWaalsContact O-CB 3.28Å; N55-Y59 WeakPolarHBondContact O-CB 3.35Å; N55-Y59 PolarHBondContact O-N 3.45Å; N55-Q126 PolarHBondContact ND2-NE2 3.41Å; N55-Q126 VanDerWaalsContact ND2-NE2 3.11Å; N55-Q126 VanDerWaalsContact OD1-CD 3.31Å; N55-Q126 PolarHBondContact OD1-NE2 3.46Å; N55-Q126 PolarHBondContact OD1-OE1 3.16Å
56I95.3Very high89.2Confident75 Ų7555.5 Ų55.539%0.38530%0.302SS..Hα-helixtrans-64.6-45.6173.2-67.3166.6000110.3S52 A53 L54 Y59 L60S52-I56 VanDerWaalsContact O-CG1 3.27Å; S52-I56 WeakPolarHBondContact O-CG1 3.23Å; S52-I56 PolarHBondContact O-N 2.96Å; A53-I56 PolarHBondContact O-N 2.68Å; L54-I56 VanDerWaalsContact C-N 3.32Å; L54-I56 PolarHBondContact O-N 3.41Å; I56-Y59 WeakPolarHBondContact O-CB 3.4Å; I56-Y59 PolarHBondContact O-N 3.38Å; I56-L60 HydrophobicContact CG2-CD1 4.13Å; I56-L60 VanDerWaalsContact O-CG 3.26Å; I56-L60 WeakPolarHBondContact O-CG 3.29Å; I56-L60 PolarHBondContact O-N 2.97Å
57I95.4Very high87Confident90 Ų9057.8 Ų57.846%0.46232%0.319SS..Hα-helixtrans-61.2-48.6177.2-70164.6000110.7A53 L54 Y59 L60 I61A53-I57 WeakPolarHBondContact O-CD1 3.35Å; A53-I57 VanDerWaalsContact O-CG1 3.24Å; A53-I57 WeakPolarHBondContact O-CG1 3.1Å; A53-I57 PolarHBondContact O-N 2.88Å; L54-I57 PolarHBondContact O-N 3.41Å; I57-Y59 VanDerWaalsContact C-N 3.31Å; I57-Y59 PolarHBondContact O-N 3.49Å; I57-L60 PolarHBondContact O-N 2.71Å; I57-L60 VanDerWaalsContact O-N 3.13Å; I57-I61 HydrophobicContact CG2-CD1 3.64Å; I57-I61 HydrophobicContact CG2-CG1 4.43Å; I57-I61 WeakPolarHBondContact O-CG1 3.26Å; I57-I61 PolarHBondContact O-N 2.75Å
58L93.1Very high84.8Confident22 Ų2264 Ų6412%0.11536%0.36CS..Hα-helixtrans-58.7-43177.3-76.5173.7000111.4A12 L15 L54 L60 I61 L62A12-L58 HydrophobicContact CB-CD1 4.19Å; A12-L58 HydrophobicContact CB-CD2 4.19Å; L15-L58 HydrophobicContact CD2-CD2 4.08Å; L54-L58 HydrophobicContact CD1-CD1 4.17Å; L54-L58 HydrophobicContact CD1-CG 4.11Å; L54-L58 HydrophobicContact CG-CD1 3.92Å; L54-L58 HydrophobicContact CG-CG 4.31Å; L54-L58 WeakPolarHBondContact O-CB 3.23Å; L54-L58 WeakPolarHBondContact O-CG 3.41Å; L54-L58 PolarHBondContact O-N 2.92Å; L58-L60 PolarHBondContact O-N 2.85Å; L58-I61 PolarHBondContact O-N 3.44Å; L58-L62 HydrophobicContact CB-CD1 4.25Å; L58-L62 HydrophobicContact CD2-CD1 4.14Å; L58-L62 WeakPolarHBondContact O-CB 3.35Å; L58-L62 VanDerWaalsContact O-CG 3.29Å; L58-L62 WeakPolarHBondContact O-CG 3.44Å; L58-L62 PolarHBondContact O-N 2.83Å
59Y89.5Confident82.9Confident46 Ų4672.4 Ų72.418%0.1840%0.396CS..Hα-helixtrans-58.3-46.9173.7166.6-108.2000112.3N55 I56 I57 I61 K63 P64 R79 C129N55-Y59 VanDerWaalsContact O-CB 3.28Å; N55-Y59 WeakPolarHBondContact O-CB 3.35Å; N55-Y59 PolarHBondContact O-N 3.45Å; I56-Y59 WeakPolarHBondContact O-CB 3.4Å; I56-Y59 PolarHBondContact O-N 3.38Å; I57-Y59 VanDerWaalsContact C-N 3.31Å; I57-Y59 PolarHBondContact O-N 3.49Å; Y59-I61 VanDerWaalsContact C-N 3.3Å; Y59-I61 PolarHBondContact O-N 3.22Å; Y59-K63 WeakPolarHBondContact O-CA 3.4Å; Y59-K63 PolarHBondContact O-N 2.86Å; Y59-P64 HydrophobicContact CD2-CG 4.38Å; Y59-R79 PolarHBondContact OH-NH1 2.96Å; Y59-R79 PolarHBondContact OH-NH2 2.98Å; Y59-C129 WeakPolarHBondContact CD2-O 3.49Å; Y59-C129 WeakPolarHBondContact CE2-O 3.42Å; Y59-C129 HydrophobicContact CG-CB 4.34Å
60L89.3Confident81.1Confident104 Ų10479.8 Ų79.855%0.54541%0.413SS..Hα-helixtrans-64.9-34.5-178.8-69.3173.3000112.6I56 I57 L58 K63I56-L60 HydrophobicContact CG2-CD1 4.13Å; I56-L60 VanDerWaalsContact O-CG 3.26Å; I56-L60 WeakPolarHBondContact O-CG 3.29Å; I56-L60 PolarHBondContact O-N 2.97Å; I57-L60 PolarHBondContact O-N 2.71Å; I57-L60 VanDerWaalsContact O-N 3.13Å; L58-L60 PolarHBondContact O-N 2.85Å; L60-K63 WeakPolarHBondContact O-CE 3.44Å; L60-K63 WeakPolarHBondContact O-CG 3.27Å
61I88.8Confident79.8Confident123 Ų12380.2 Ų80.263%0.63142%0.416SS*.Hα-helixtrans-79.2-51.5179.1-66170.1000111.2I57 L58 Y59I57-I61 HydrophobicContact CG2-CD1 3.64Å; I57-I61 HydrophobicContact CG2-CG1 4.43Å; I57-I61 WeakPolarHBondContact O-CG1 3.26Å; I57-I61 PolarHBondContact O-N 2.75Å; L58-I61 PolarHBondContact O-N 3.44Å; Y59-I61 VanDerWaalsContact C-N 3.3Å; Y59-I61 PolarHBondContact O-N 3.22Å
62L84.3Confident79.2Confident47 Ų4783.5 Ų83.525%0.24644%0.439CS..Hα-helixtrans-79.3-27.7-170.7-64.2169000112.7R8 A12 L58 W151R8-L62 HydrophobicContact CB-CD2 4.41Å; A12-L62 HydrophobicContact CB-CD1 3.84Å; L58-L62 HydrophobicContact CB-CD1 4.25Å; L58-L62 HydrophobicContact CD2-CD1 4.14Å; L58-L62 WeakPolarHBondContact O-CB 3.35Å; L58-L62 VanDerWaalsContact O-CG 3.29Å; L58-L62 WeakPolarHBondContact O-CG 3.44Å; L58-L62 PolarHBondContact O-N 2.83Å; L62-W151 HydrophobicContact CD1-CH2 3.8Å; L62-W151 HydrophobicContact CD1-CZ3 4.39Å
63K78.6Confident78.6Confident117 Ų11789.9 Ų89.951%0.50946%0.464SS..  trans39.559.2-178.4-62-177.3179.91720112.5Y59 L60 N65 L66Y59-K63 WeakPolarHBondContact O-CA 3.4Å; Y59-K63 PolarHBondContact O-N 2.86Å; L60-K63 WeakPolarHBondContact O-CE 3.44Å; L60-K63 WeakPolarHBondContact O-CG 3.27Å; K63-N65 PolarHBondContact O-N 3.44Å; K63-L66 HydrophobicContact CB-CD1 3.47Å; K63-L66 VanDerWaalsContact CB-CD1 3.47Å; K63-L66 HydrophobicContact CB-CG 4.17Å; K63-L66 HydrophobicContact CD-CD1 4.02Å; K63-L66 HydrophobicContact CD-CG 4.33Å; K63-L66 HydrophobicContact CG-CD1 4.41Å
64P63.4Low78.2Confident30 Ų3090.6 Ų90.620%0.19547%0.47CS..SBendtrans-57.5-26.9-172.421.7-32.3000113.3Y59 W151Y59-P64 HydrophobicContact CD2-CG 4.38Å; P64-W151 HydrophobicContact CB-CD2 3.88Å; P64-W151 HydrophobicContact CB-CE3 4.47Å; P64-W151 HydrophobicContact CB-CG 3.97Å
65N62Low77.8Confident88 Ų8895.5 Ų95.547%0.47149%0.492SS..SBendtrans-125.179.4176.2-69.2-52.9000110.9K63 S67 V130K63-N65 PolarHBondContact O-N 3.44Å; N65-S67 PolarHBondContact O-N 2.95Å; N65-V130 PolarHBondContact ND2-O 3.44Å
66L55.9Low77.4Confident129 Ų129100.8 Ų100.868%0.67552%0.515SS*.  trans-67.9113.5170.4-102.4110.4000110.1K63K63-L66 HydrophobicContact CB-CD1 3.47Å; K63-L66 VanDerWaalsContact CB-CD1 3.47Å; K63-L66 HydrophobicContact CB-CG 4.17Å; K63-L66 HydrophobicContact CD-CD1 4.02Å; K63-L66 HydrophobicContact CD-CG 4.33Å; K63-L66 HydrophobicContact CG-CD1 4.41Å
67S51.9Low77.2Confident86 Ų86100.8 Ų100.860%0.60151%0.514SS*.  trans-83.6122.915567.80000108.6N65 K69N65-S67 PolarHBondContact O-N 2.95Å; S67-K69 PolarHBondContact O-N 2.95Å; S67-K69 VanDerWaalsContact O-N 3.15Å
68P51Low77.1Confident132 Ų13298.9 Ų98.986%0.85751%0.509SS*.  trans-72.5-3.8-175.326.8-33.6000114.4
69K59.8Low77Confident181 Ų181103.4 Ų103.479%0.78753%0.525SS*.SBendtrans-75.8129.1-178.8-87.2-176.7174.9178.80111.8S67 S71S67-K69 PolarHBondContact O-N 2.95Å; S67-K69 VanDerWaalsContact O-N 3.15Å; K69-S71 VanDerWaalsContact C-N 3.31Å; K69-S71 PolarHBondContact O-N 3.32Å
70R59.4Low77.2Confident256 Ų256107.4 Ų107.497%0.96654%0.543SS*.  trans-62.989.6168.9-152178.9-167.4-176.63.7108.5
71S70.4Confident77.5Confident54 Ų54107.4 Ų107.438%0.37854%0.544SS..  trans-76.9132-178.668.10000110.2K69 K76K69-S71 VanDerWaalsContact C-N 3.31Å; K69-S71 PolarHBondContact O-N 3.32Å; S71-K76 VanDerWaalsContact OG-CE 3.27Å; S71-K76 WeakPolarHBondContact OG-CE 3.43Å; S71-K76 WeakPolarHBondContact OG-CG 3.41Å
72S85.5Confident77.9Confident69 Ų69106.6 Ų106.648%0.48354%0.535SS..  trans-52.3149.3170.3176.30000111.6A74 H75 K76S72-A74 PolarHBondContact O-N 2.84Å; S72-A74 PolarHBondContact OG-N 3.34Å; S72-H75 WeakPolarHBondContact O-CB 3.45Å; S72-H75 PolarHBondContact O-N 2.92Å; S72-K76 PolarHBondContact O-N 3.44Å
73F87.3Confident78.5Confident155 Ų155105.5 Ų105.568%0.6853%0.532SS*.Hα-helixtrans-54.1-39.7175.5-178.9-113000112H75 K76 I77F73-H75 VanDerWaalsContact C-N 3.32Å; F73-H75 PolarHBondContact O-N 3.2Å; F73-K76 WeakPolarHBondContact O-CB 3.27Å; F73-K76 PolarHBondContact O-N 3.41Å; F73-K76 VanDerWaalsContact O-N 3.08Å; F73-I77 HydrophobicContact CD1-CD1 3.65Å; F73-I77 HydrophobicContact CE1-CD1 3.2Å; F73-I77 HydrophobicContact CE1-CG1 4.23Å; F73-I77 HydrophobicContact CE2-CD1 4.26Å; F73-I77 HydrophobicContact CE2-CG1 4.5Å; F73-I77 HydrophobicContact CG-CD1 4.36Å; F73-I77 HydrophobicContact CZ-CD1 3.55Å; F73-I77 HydrophobicContact CZ-CG1 4.19Å; F73-I77 PolarHBondContact O-N 2.88Å
74A88.8Confident79.4Confident63 Ų63102.7 Ų102.752%0.52153%0.526SS..Hα-helixtrans-59-40.3175.800000112.7S72 K76 I77 S78S72-A74 PolarHBondContact O-N 2.84Å; S72-A74 PolarHBondContact OG-N 3.34Å; A74-K76 VanDerWaalsContact C-N 3.35Å; A74-K76 PolarHBondContact O-N 3.47Å; A74-I77 PolarHBondContact O-N 2.85Å; A74-S78 WeakPolarHBondContact O-CB 3.47Å; A74-S78 PolarHBondContact O-N 3.23Å
75H87.6Confident81Confident128 Ų128106 Ų10659%0.59354%0.54SS*.Hα-helixtrans-66.7-35.8175.9-74.7-57.9000112.5S72 F73 R79S72-H75 WeakPolarHBondContact O-CB 3.45Å; S72-H75 PolarHBondContact O-N 2.92Å; F73-H75 VanDerWaalsContact C-N 3.32Å; F73-H75 PolarHBondContact O-N 3.2Å; H75-R79 WeakPolarHBondContact O-CB 3.23Å; H75-R79 PolarHBondContact O-N 3.42Å
76K88Confident82.7Confident122 Ų122104.7 Ų104.753%0.5353%0.529SS..Hα-helixtrans-65.7-45176.2-64.3-178.1-177.7178.90111.3S71 S72 F73 A74 R79 F80S71-K76 VanDerWaalsContact OG-CE 3.27Å; S71-K76 WeakPolarHBondContact OG-CE 3.43Å; S71-K76 WeakPolarHBondContact OG-CG 3.41Å; S72-K76 PolarHBondContact O-N 3.44Å; F73-K76 WeakPolarHBondContact O-CB 3.27Å; F73-K76 PolarHBondContact O-N 3.41Å; F73-K76 VanDerWaalsContact O-N 3.08Å; A74-K76 VanDerWaalsContact C-N 3.35Å; A74-K76 PolarHBondContact O-N 3.47Å; K76-R79 PolarHBondContact O-N 3.45Å; K76-F80 PolarHBondContact O-N 3.43Å
77I91.6Very high84.8Confident74 Ų74100.8 Ų100.838%0.37951%0.507SS..Hα-helixtrans-61-49.6175.1-70169000110.5F73 A74 R79 F80 L81F73-I77 HydrophobicContact CD1-CD1 3.65Å; F73-I77 HydrophobicContact CE1-CD1 3.2Å; F73-I77 HydrophobicContact CE1-CG1 4.23Å; F73-I77 HydrophobicContact CE2-CD1 4.26Å; F73-I77 HydrophobicContact CE2-CG1 4.5Å; F73-I77 HydrophobicContact CG-CD1 4.36Å; F73-I77 HydrophobicContact CZ-CD1 3.55Å; F73-I77 HydrophobicContact CZ-CG1 4.19Å; F73-I77 PolarHBondContact O-N 2.88Å; A74-I77 PolarHBondContact O-N 2.85Å; I77-R79 VanDerWaalsContact C-N 3.27Å; I77-R79 PolarHBondContact O-N 2.88Å; I77-F80 WeakPolarHBondContact O-CB 3.37Å; I77-F80 PolarHBondContact O-N 3.32Å; I77-F80 VanDerWaalsContact O-N 3.09Å; I77-L81 HydrophobicContact CG2-CD1 3.92Å; I77-L81 HydrophobicContact CG2-CG 4.25Å; I77-L81 WeakPolarHBondContact O-CG 3.3Å; I77-L81 PolarHBondContact O-N 3.16Å
78S92.8Very high87Confident51 Ų51102.2 Ų102.236%0.35750%0.502SS..Hα-helixtrans-57.1-41.8178.7-179.70000111.9A74 K82A74-S78 WeakPolarHBondContact O-CB 3.47Å; A74-S78 PolarHBondContact O-N 3.23Å; S78-K82 WeakPolarHBondContact O-CG 3.38Å; S78-K82 PolarHBondContact O-N 3.4Å
79R91.8Very high89.3Confident116 Ų116101.5 Ų101.544%0.43849%0.489SS..Hα-helixtrans-64.1-44.2175.7-166.8179.879164.59111.9Y59 H75 K76 I77 K82 C83 P133Y59-R79 PolarHBondContact OH-NH1 2.96Å; Y59-R79 PolarHBondContact OH-NH2 2.98Å; H75-R79 WeakPolarHBondContact O-CB 3.23Å; H75-R79 PolarHBondContact O-N 3.42Å; K76-R79 PolarHBondContact O-N 3.45Å; I77-R79 VanDerWaalsContact C-N 3.27Å; I77-R79 PolarHBondContact O-N 2.88Å; R79-K82 PolarHBondContact O-N 3.02Å; R79-C83 PolarHBondContact O-N 3.16Å; R79-C83 PolarHBondContact O-SG 3.48Å; R79-P133 HydrophobicContact CG-CG 3.92Å
80F92.8Very high91.1Very high130 Ų13093.4 Ų93.457%0.5746%0.455SS*.Hα-helixtrans-59.9-48.5177.5175.4-101000111.7K76 I77 K82 C83 C84K76-F80 PolarHBondContact O-N 3.43Å; I77-F80 WeakPolarHBondContact O-CB 3.37Å; I77-F80 PolarHBondContact O-N 3.32Å; I77-F80 VanDerWaalsContact O-N 3.09Å; F80-K82 VanDerWaalsContact C-N 3.32Å; F80-K82 PolarHBondContact O-N 3.24Å; F80-C83 WeakPolarHBondContact O-CA 3.41Å; F80-C83 WeakPolarHBondContact O-CB 3.29Å; F80-C83 PolarHBondContact O-N 3.31Å; F80-C84 VanDerWaalsContact CZ-SG 3.56Å; F80-C84 PolarHBondContact O-N 3.37Å; F80-C84 PolarHBondContact O-SG 3.08Å; F80-C84 VanDerWaalsContact O-SG 3.42Å
81L95.9Very high93Very high105 Ų10581.4 Ų81.455%0.5541%0.41SS..Hα-helixtrans-59.4-41.3177.2-68.3175.1000112.2I77 C83 C84 M85I77-L81 HydrophobicContact CG2-CD1 3.92Å; I77-L81 HydrophobicContact CG2-CG 4.25Å; I77-L81 WeakPolarHBondContact O-CG 3.3Å; I77-L81 PolarHBondContact O-N 3.16Å; L81-C83 VanDerWaalsContact C-N 3.33Å; L81-C83 PolarHBondContact O-N 3.26Å; L81-C84 PolarHBondContact O-N 3.2Å; L81-M85 WeakPolarHBondContact O-CB 3.43Å; L81-M85 PolarHBondContact O-N 3.11Å
82K96.5Very high94.3Very high105 Ų10582.4 Ų82.446%0.45741%0.41SS..Hα-helixtrans-61.1-40.9173.5-73.8177.9-177.4-1750112.1S78 R79 F80 M85 Y86 P133S78-K82 WeakPolarHBondContact O-CG 3.38Å; S78-K82 PolarHBondContact O-N 3.4Å; R79-K82 PolarHBondContact O-N 3.02Å; F80-K82 VanDerWaalsContact C-N 3.32Å; F80-K82 PolarHBondContact O-N 3.24Å; K82-M85 PolarHBondContact O-N 3.24Å; K82-Y86 WeakPolarHBondContact O-CB 3.42Å; K82-Y86 PolarHBondContact O-N 3.34Å; K82-P133 HydrophobicContact CB-CB 3.98Å; K82-P133 HydrophobicContact CB-CG 3.98Å
83C96.6Very high94.9Very high25 Ų2584.3 Ų84.317%0.16941%0.414CS..Hα-helixtrans-63.2-45.2175.4-660000112.1R79 F80 L81 M85 Y86 F87 L128R79-C83 PolarHBondContact O-N 3.16Å; R79-C83 PolarHBondContact O-SG 3.48Å; F80-C83 WeakPolarHBondContact O-CA 3.41Å; F80-C83 WeakPolarHBondContact O-CB 3.29Å; F80-C83 PolarHBondContact O-N 3.31Å; L81-C83 VanDerWaalsContact C-N 3.33Å; L81-C83 PolarHBondContact O-N 3.26Å; C83-M85 VanDerWaalsContact C-N 3.33Å; C83-M85 PolarHBondContact O-N 3.3Å; C83-Y86 PolarHBondContact O-N 3.2Å; C83-F87 WeakPolarHBondContact O-CB 3.31Å; C83-F87 PolarHBondContact O-N 3.39Å; C83-L128 HydrophobicContact CB-CD1 4.44Å; C83-L128 HydrophobicContact CB-CD2 3.99Å; C83-L128 WeakPolarHBondContact O-CD1 3.47Å
84C97.6Very high95.4Very high57 Ų5778.4 Ų78.439%0.38539%0.389SS..Hα-helixtrans-59.3-44.8176.3-65.40000111.6F80 L81 F87 F88F80-C84 VanDerWaalsContact CZ-SG 3.56Å; F80-C84 PolarHBondContact O-N 3.37Å; F80-C84 PolarHBondContact O-SG 3.08Å; F80-C84 VanDerWaalsContact O-SG 3.42Å; L81-C84 PolarHBondContact O-N 3.2Å; C84-F87 PolarHBondContact O-N 3.19Å; C84-F88 WeakPolarHBondContact O-CB 3.45Å; C84-F88 PolarHBondContact O-N 2.95Å
85M98.3Very high95.9Very high99 Ų9977.2 Ų77.249%0.48837%0.372SS..Hα-helixtrans-61.6-45.4176.9-177.2-179.165.700111.8L81 K82 C83 F88 M89L81-M85 WeakPolarHBondContact O-CB 3.43Å; L81-M85 PolarHBondContact O-N 3.11Å; K82-M85 PolarHBondContact O-N 3.24Å; C83-M85 VanDerWaalsContact C-N 3.33Å; C83-M85 PolarHBondContact O-N 3.3Å; M85-F88 PolarHBondContact O-N 3.04Å; M85-M89 WeakPolarHBondContact O-CB 3.3Å; M85-M89 VanDerWaalsContact O-CG 3.3Å; M85-M89 WeakPolarHBondContact O-CG 3.35Å; M85-M89 PolarHBondContact O-N 3.28Å
86Y98.3Very high96.4Very high62 Ų6273.1 Ų73.124%0.24336%0.361CS..Hα-helixtrans-66.4-38.9178.7-76.89.1000112.3K82 C83 S90 L128 P133 I135 W138K82-Y86 WeakPolarHBondContact O-CB 3.42Å; K82-Y86 PolarHBondContact O-N 3.34Å; C83-Y86 PolarHBondContact O-N 3.2Å; Y86-S90 WeakPolarHBondContact O-CB 3.14Å; Y86-S90 PolarHBondContact O-N 3.48Å; Y86-L128 HydrophobicContact CD2-CD2 4.12Å; Y86-P133 HydrophobicContact CD2-CB 3.67Å; Y86-P133 HydrophobicContact CE2-CB 3.56Å; Y86-I135 HydrophobicContact CE2-CD1 4.25Å; Y86-I135 HydrophobicContact CE2-CG1 3.97Å; Y86-I135 WeakPolarHBondContact OH-CD1 3.42Å; Y86-W138 AromaticContact CD2-CH2 3.97Å; Y86-W138 HydrophobicContact CD2-CH2 3.97Å; Y86-W138 HydrophobicContact CD2-CZ2 4.24Å
87F98.5Very high96.9Very high47 Ų4770.7 Ų70.721%0.20635%0.353CS..Hα-helixtrans-62.9-47.6174.5-177.8-100.1000111.2C83 C84 M89 S90 C91 L125 L128C83-F87 WeakPolarHBondContact O-CB 3.31Å; C83-F87 PolarHBondContact O-N 3.39Å; C84-F87 PolarHBondContact O-N 3.19Å; F87-M89 PolarHBondContact O-N 3.31Å; F87-S90 WeakPolarHBondContact O-CB 3.41Å; F87-S90 PolarHBondContact O-N 2.66Å; F87-S90 VanDerWaalsContact O-N 3.16Å; F87-C91 PolarHBondContact O-N 3.32Å; F87-C91 PolarHBondContact O-SG 3.34Å; F87-C91 VanDerWaalsContact O-SG 3.34Å; F87-L125 HydrophobicContact CD2-CB 4Å; F87-L125 HydrophobicContact CD2-CD1 4.4Å; F87-L125 HydrophobicContact CE2-CB 3.9Å; F87-L128 HydrophobicContact CB-CD1 3.84Å
88F98.5Very high97.1Very high115 Ų11567.9 Ų67.950%0.50434%0.338SS..Hα-helixtrans-60.8-46.4177.5-178.6-102.6000112.1C84 M85 S90 C91 I92C84-F88 WeakPolarHBondContact O-CB 3.45Å; C84-F88 PolarHBondContact O-N 2.95Å; M85-F88 PolarHBondContact O-N 3.04Å; F88-S90 PolarHBondContact O-N 3.35Å; F88-C91 WeakPolarHBondContact O-CB 3.42Å; F88-C91 PolarHBondContact O-N 3.48Å; F88-C91 VanDerWaalsContact O-N 3.08Å; F88-I92 HydrophobicContact CD1-CG1 4.37Å; F88-I92 HydrophobicContact CE1-CD1 4.35Å; F88-I92 HydrophobicContact CE1-CG1 3.95Å; F88-I92 HydrophobicContact CE2-CD1 4.46Å; F88-I92 HydrophobicContact CZ-CD1 3.99Å; F88-I92 HydrophobicContact CZ-CG1 4.06Å; F88-I92 WeakPolarHBondContact O-CG1 3.36Å; F88-I92 PolarHBondContact O-N 2.79Å; F88-I92 VanDerWaalsContact O-N 3.1Å
89M98.4Very high97.3Very high118 Ų11866.6 Ų66.658%0.58133%0.328SS*.Hα-helixtrans-59.6-36.6175.6-73.8-61-158.900112.3M85 F87 I92 L93M85-M89 WeakPolarHBondContact O-CB 3.3Å; M85-M89 VanDerWaalsContact O-CG 3.3Å; M85-M89 WeakPolarHBondContact O-CG 3.35Å; M85-M89 PolarHBondContact O-N 3.28Å; F87-M89 PolarHBondContact O-N 3.31Å; M89-I92 PolarHBondContact O-N 2.89Å; M89-L93 WeakPolarHBondContact O-CB 3.26Å; M89-L93 PolarHBondContact O-N 2.93Å
90S98.5Very high97.6Very high10 Ų1068.2 Ų68.27%0.0735%0.345CS..Hα-helixtrans-63.8-42.4173171.40000112.4Y86 F87 F88 I92 L93 F94 S120 T124Y86-S90 WeakPolarHBondContact O-CB 3.14Å; Y86-S90 PolarHBondContact O-N 3.48Å; F87-S90 WeakPolarHBondContact O-CB 3.41Å; F87-S90 PolarHBondContact O-N 2.66Å; F87-S90 VanDerWaalsContact O-N 3.16Å; F88-S90 PolarHBondContact O-N 3.35Å; S90-I92 VanDerWaalsContact C-N 3.31Å; S90-I92 PolarHBondContact O-N 2.66Å; S90-L93 PolarHBondContact O-N 2.83Å; S90-F94 WeakPolarHBondContact O-CD2 3.44Å; S90-F94 PolarHBondContact O-N 3.39Å; S90-F94 WeakPolarHBondContact OG-CD2 3.39Å; S90-F94 WeakPolarHBondContact OG-CE2 3.41Å; S90-S120 PolarHBondContact O-OG 2.83Å; S90-S120 PolarHBondContact OG-OG 3.31Å; S90-T124 WeakPolarHBondContact CB-OG1 3.46Å; S90-T124 VanDerWaalsContact OG-CB 3.3Å; S90-T124 WeakPolarHBondContact OG-CB 3.4Å; S90-T124 PolarHBondContact OG-OG1 3.21Å
91C98.6Very high97.5Very high4 Ų470.8 Ų70.83%0.02735%0.352CS..Hα-helixtrans-59.7-43.9176.4-62.10000111.2F87 F88 H95 F113 A116 V117 S120F87-C91 PolarHBondContact O-N 3.32Å; F87-C91 PolarHBondContact O-SG 3.34Å; F87-C91 VanDerWaalsContact O-SG 3.34Å; F88-C91 WeakPolarHBondContact O-CB 3.42Å; F88-C91 PolarHBondContact O-N 3.48Å; F88-C91 VanDerWaalsContact O-N 3.08Å; C91-H95 VanDerWaalsContact O-CB 3.3Å; C91-H95 WeakPolarHBondContact O-CB 3.39Å; C91-H95 PolarHBondContact O-N 3.44Å; C91-F113 HydrophobicContact CB-CE2 4.14Å; C91-F113 HydrophobicContact CB-CZ 4.32Å; C91-A116 WeakPolarHBondContact O-CB 3.48Å; C91-V117 HydrophobicContact CB-CG2 4.32Å; C91-S120 WeakPolarHBondContact CA-OG 3.1Å; C91-S120 PolarHBondContact N-OG 2.84Å; C91-S120 VanDerWaalsContact SG-CB 3.6Å; C91-S120 PolarHBondContact SG-OG 3.41Å
92I98.5Very high97.4Very high76 Ų7668.9 Ų68.939%0.3936%0.358SS..Hα-helixtrans-64.1-43.8176.5-59.6-64.3000111.1F88 M89 S90 H95 A96 F113F88-I92 HydrophobicContact CD1-CG1 4.37Å; F88-I92 HydrophobicContact CE1-CD1 4.35Å; F88-I92 HydrophobicContact CE1-CG1 3.95Å; F88-I92 HydrophobicContact CE2-CD1 4.46Å; F88-I92 HydrophobicContact CZ-CD1 3.99Å; F88-I92 HydrophobicContact CZ-CG1 4.06Å; F88-I92 WeakPolarHBondContact O-CG1 3.36Å; F88-I92 PolarHBondContact O-N 2.79Å; F88-I92 VanDerWaalsContact O-N 3.1Å; M89-I92 PolarHBondContact O-N 2.89Å; S90-I92 VanDerWaalsContact C-N 3.31Å; S90-I92 PolarHBondContact O-N 2.66Å; I92-H95 PolarHBondContact O-N 3.04Å; I92-A96 WeakPolarHBondContact O-CB 2.85Å; I92-A96 PolarHBondContact O-N 3.44Å; I92-F113 HydrophobicContact CD1-CE2 4Å
93L98.3Very high97.2Very high108 Ų10864.4 Ų64.457%0.56534%0.34SS*.Hα-helixtrans-62.6-48.2178.5-174.974.8000111.7M89 S90 H95 A96 I97M89-L93 WeakPolarHBondContact O-CB 3.26Å; M89-L93 PolarHBondContact O-N 2.93Å; S90-L93 PolarHBondContact O-N 2.83Å; L93-H95 VanDerWaalsContact C-N 3.35Å; L93-H95 PolarHBondContact O-N 3.4Å; L93-A96 PolarHBondContact O-N 3.44Å; L93-I97 HydrophobicContact CD1-CD1 4.5Å; L93-I97 HydrophobicContact CD2-CD1 4.42Å; L93-I97 HydrophobicContact CG-CD1 3.94Å; L93-I97 VanDerWaalsContact O-CG1 3.29Å; L93-I97 WeakPolarHBondContact O-CG1 3.44Å; L93-I97 PolarHBondContact O-N 3.44Å
94F98.5Very high96.8Very high31 Ų3165.5 Ų65.514%0.13635%0.347CS..Hα-helixtrans-62.6-42.8176.8-86.1-64.8000111.4S90 A96 I97 I98 A116 L119 S120 T123S90-F94 WeakPolarHBondContact O-CD2 3.44Å; S90-F94 PolarHBondContact O-N 3.39Å; S90-F94 WeakPolarHBondContact OG-CD2 3.39Å; S90-F94 WeakPolarHBondContact OG-CE2 3.41Å; F94-A96 VanDerWaalsContact C-N 3.33Å; F94-A96 PolarHBondContact O-N 2.99Å; F94-I97 PolarHBondContact O-N 2.77Å; F94-I98 HydrophobicContact CB-CD1 4.38Å; F94-I98 WeakPolarHBondContact O-CB 3.31Å; F94-I98 VanDerWaalsContact O-CD1 3.24Å; F94-I98 WeakPolarHBondContact O-CD1 3.32Å; F94-I98 WeakPolarHBondContact O-CG1 3.37Å; F94-I98 PolarHBondContact O-N 3.37Å; F94-A116 HydrophobicContact CB-CB 3.79Å; F94-L119 HydrophobicContact CD1-CB 4.27Å; F94-L119 HydrophobicContact CD1-CD1 4.24Å; F94-L119 HydrophobicContact CD2-CB 4.42Å; F94-L119 HydrophobicContact CE1-CB 4.45Å; F94-L119 HydrophobicContact CG-CB 4.26Å; F94-S120 VanDerWaalsContact CD2-OG 3.3Å; F94-S120 WeakPolarHBondContact CD2-OG 3.47Å; F94-T123 VanDerWaalsContact CE2-OG1 3.31Å; F94-T123 WeakPolarHBondContact CE2-OG1 3.34Å; F94-T123 HydrophobicContact CZ-CG2 4.45Å; F94-T123 WeakPolarHBondContact CZ-OG1 3.32Å
95H98.1Very high96Very high38 Ų3868.7 Ų68.718%0.17636%0.36CS..Hα-helixtrans-56.5-49175.7-18091.5000111C91 I92 L93 I97 I98 V99 F113 A116C91-H95 VanDerWaalsContact O-CB 3.3Å; C91-H95 WeakPolarHBondContact O-CB 3.39Å; C91-H95 PolarHBondContact O-N 3.44Å; I92-H95 PolarHBondContact O-N 3.04Å; L93-H95 VanDerWaalsContact C-N 3.35Å; L93-H95 PolarHBondContact O-N 3.4Å; H95-I97 PolarHBondContact O-N 3.49Å; H95-I98 PolarHBondContact O-N 3.36Å; H95-V99 WeakPolarHBondContact O-CB 3.32Å; H95-V99 WeakPolarHBondContact O-CG2 3.46Å; H95-V99 PolarHBondContact O-N 3.47Å; H95-F113 HydrophobicContact CB-CD2 4.3Å; H95-F113 WeakPolarHBondContact ND1-CA 2.91Å; H95-F113 PolarHBondContact ND1-N 3.17Å; H95-A116 HydrophobicContact CB-CB 3.86Å
96A98.1Very high95.5Very high43 Ų4371.1 Ų71.136%0.35537%0.373SS..Hα-helixtrans-60.7-44.8176.900000112.4I92 L93 F94 I98 V99 L100I92-A96 WeakPolarHBondContact O-CB 2.85Å; I92-A96 PolarHBondContact O-N 3.44Å; L93-A96 PolarHBondContact O-N 3.44Å; F94-A96 VanDerWaalsContact C-N 3.33Å; F94-A96 PolarHBondContact O-N 2.99Å; A96-I98 PolarHBondContact O-N 3.14Å; A96-V99 PolarHBondContact O-N 3.24Å; A96-L100 WeakPolarHBondContact O-CB 3.39Å; A96-L100 VanDerWaalsContact O-CG 3.23Å; A96-L100 WeakPolarHBondContact O-CG 3.34Å; A96-L100 PolarHBondContact O-N 3.26Å
97I97.8Very high95Very high70 Ų7076.6 Ų76.636%0.35940%0.401SS..Hα-helixtrans-60.5-47.1176.8-69.9166.6000110.6L93 F94 H95 V99 L100 Y101L93-I97 HydrophobicContact CD1-CD1 4.5Å; L93-I97 HydrophobicContact CD2-CD1 4.42Å; L93-I97 HydrophobicContact CG-CD1 3.94Å; L93-I97 VanDerWaalsContact O-CG1 3.29Å; L93-I97 WeakPolarHBondContact O-CG1 3.44Å; L93-I97 PolarHBondContact O-N 3.44Å; F94-I97 PolarHBondContact O-N 2.77Å; H95-I97 PolarHBondContact O-N 3.49Å; I97-V99 VanDerWaalsContact C-N 3.32Å; I97-V99 PolarHBondContact O-N 2.93Å; I97-L100 PolarHBondContact O-N 3.15Å; I97-L100 VanDerWaalsContact O-N 3.15Å; I97-Y101 HydrophobicContact CG2-CD2 3.94Å; I97-Y101 HydrophobicContact CG2-CE2 4.06Å; I97-Y101 VanDerWaalsContact O-CD2 3.27Å; I97-Y101 WeakPolarHBondContact O-CD2 3.36Å; I97-Y101 PolarHBondContact O-N 3.47Å
98I97.5Very high94.7Very high15 Ų1575.4 Ų75.48%0.07740%0.399CS..Hα-helixtrans-61.8-42.8-178.2-68.7159.2000111F94 H95 A96 Y101 G102 A103 T112 F115 A116 L119 W184F94-I98 HydrophobicContact CB-CD1 4.38Å; F94-I98 WeakPolarHBondContact O-CB 3.31Å; F94-I98 VanDerWaalsContact O-CD1 3.24Å; F94-I98 WeakPolarHBondContact O-CD1 3.32Å; F94-I98 WeakPolarHBondContact O-CG1 3.37Å; F94-I98 PolarHBondContact O-N 3.37Å; H95-I98 PolarHBondContact O-N 3.36Å; A96-I98 PolarHBondContact O-N 3.14Å; I98-Y101 CarbonylContact O-C 3.59Å; I98-Y101 PolarHBondContact O-N 3.41Å; I98-G102 PolarHBondContact O-N 3.39Å; I98-A103 HydrophobicContact CG2-CB 3.58Å; I98-A103 WeakPolarHBondContact O-CB 3.1Å; I98-A103 PolarHBondContact O-N 3.14Å; I98-T112 HydrophobicContact CB-CG2 4.12Å; I98-T112 HydrophobicContact CG2-CG2 3.64Å; I98-F115 HydrophobicContact CD1-CD1 3.66Å; I98-F115 HydrophobicContact CD1-CE1 3.89Å; I98-F115 HydrophobicContact CD1-CG 4.43Å; I98-F115 HydrophobicContact CG1-CD1 4.36Å; I98-F115 HydrophobicContact CG1-CE1 4.22Å; I98-F115 HydrophobicContact CG2-CD1 4.33Å; I98-F115 HydrophobicContact CG2-CE1 4.5Å; I98-A116 HydrophobicContact CD1-CB 4Å; I98-L119 HydrophobicContact CD1-CD1 4.02Å; I98-W184 HydrophobicContact CG2-CH2 3.33Å; I98-W184 HydrophobicContact CG2-CZ2 3.32Å
99V96.9Very high94.6Very high25 Ų2573 Ų7315%0.15239%0.393CS..Hα-helixtrans-59.2-47.4172.2161.80000111.7H95 A96 I97 Y101 G102 L105 T112H95-V99 WeakPolarHBondContact O-CB 3.32Å; H95-V99 WeakPolarHBondContact O-CG2 3.46Å; H95-V99 PolarHBondContact O-N 3.47Å; A96-V99 PolarHBondContact O-N 3.24Å; I97-V99 VanDerWaalsContact C-N 3.32Å; I97-V99 PolarHBondContact O-N 2.93Å; V99-Y101 PolarHBondContact O-N 2.85Å; V99-G102 PolarHBondContact O-N 3.09Å; V99-L105 HydrophobicContact CB-CD2 4.4Å; V99-L105 HydrophobicContact CG1-CD2 3.15Å; V99-L105 HydrophobicContact CG1-CG 3.8Å; V99-L105 HydrophobicContact CG2-CD2 4.4Å; V99-T112 HydrophobicContact CG2-CG2 4.12Å
100L96.4Very high94.6Very high149 Ų14971.4 Ų71.478%0.7839%0.39SS*.Hα-helixtrans-62.9-25.5178-71.1171.6000112.8A96 I97 G102A96-L100 WeakPolarHBondContact O-CB 3.39Å; A96-L100 VanDerWaalsContact O-CG 3.23Å; A96-L100 WeakPolarHBondContact O-CG 3.34Å; A96-L100 PolarHBondContact O-N 3.26Å; I97-L100 PolarHBondContact O-N 3.15Å; I97-L100 VanDerWaalsContact O-N 3.15Å; L100-G102 VanDerWaalsContact C-N 3.27Å
101Y92.6Very high94.5Very high184 Ų18473.3 Ų73.372%0.72240%0.398SS*.THydrogen-bonded Turntrans-85.46.8174.2-88.1-106.1000113.6I97 I98 V99I97-Y101 HydrophobicContact CG2-CD2 3.94Å; I97-Y101 HydrophobicContact CG2-CE2 4.06Å; I97-Y101 VanDerWaalsContact O-CD2 3.27Å; I97-Y101 WeakPolarHBondContact O-CD2 3.36Å; I97-Y101 PolarHBondContact O-N 3.47Å; I98-Y101 CarbonylContact O-C 3.59Å; I98-Y101 PolarHBondContact O-N 3.41Å; V99-Y101 PolarHBondContact O-N 2.85Å
102G92.1Very high94.5Very high66 Ų6673.1 Ų73.168%0.6840%0.397SS*.THydrogen-bonded Turntrans108.39.8169.200000115.6I98 V99 L100I98-G102 PolarHBondContact O-N 3.39Å; V99-G102 PolarHBondContact O-N 3.09Å; L100-G102 VanDerWaalsContact C-N 3.27Å
103A92.6Very high94.5Very high10 Ų1072.6 Ų72.68%0.08339%0.392CS..  trans-68.7149.417300000112.1I98 L105 T112 W184I98-A103 HydrophobicContact CG2-CB 3.58Å; I98-A103 WeakPolarHBondContact O-CB 3.1Å; I98-A103 PolarHBondContact O-N 3.14Å; A103-L105 PolarHBondContact O-N 2.96Å; A103-T112 HydrophobicContact CB-CG2 4.17Å; A103-W184 HydrophobicContact CB-CH2 3.82Å; A103-W184 HydrophobicContact CB-CZ2 3.38Å
104P87.7Confident94.5Very high48 Ų4869 Ų6931%0.31237%0.373SS..  trans-59.3127.9-179.7-23.333.2000113
105L82.8Confident94.5Very high124 Ų12467.7 Ų67.765%0.64937%0.367SS*.SBendtrans-73.2-33.6-176.1-88.4167.1000114.7V99 A103 V109V99-L105 HydrophobicContact CB-CD2 4.4Å; V99-L105 HydrophobicContact CG1-CD2 3.15Å; V99-L105 HydrophobicContact CG1-CG 3.8Å; V99-L105 HydrophobicContact CG2-CD2 4.4Å; A103-L105 PolarHBondContact O-N 2.96Å; L105-V109 WeakPolarHBondContact O-CG2 3.41Å
106I87.1Confident94.5Very high150 Ų15065.9 Ų65.977%0.76936%0.359SS*.SBendtrans-121.7-47.1-169.2-58.1176.3000111S108 V109I106-S108 VanDerWaalsContact C-N 3.33Å; I106-S108 PolarHBondContact O-N 2.95Å; I106-V109 WeakPolarHBondContact O-CG2 3.48Å
107E87.8Confident94.5Very high177 Ų17765.2 Ų65.283%0.82735%0.35SS*.THydrogen-bonded Turntrans-72.4-25.3-171.6-63.6178.6-178.700113.6
108S92.7Very high94.6Very high23 Ų2361.9 Ų61.916%0.16133%0.333CS..THydrogen-bonded Turntrans-131.339-174.9-50.10000112.8I106 T110 E111 T112I106-S108 VanDerWaalsContact C-N 3.33Å; I106-S108 PolarHBondContact O-N 2.95Å; S108-T110 PolarHBondContact O-N 3.02Å; S108-E111 VanDerWaalsContact C-OE2 3.23Å; S108-E111 WeakPolarHBondContact CA-OE2 3.5Å; S108-T112 VanDerWaalsContact O-CB 3.26Å; S108-T112 WeakPolarHBondContact O-CB 3.29Å; S108-T112 PolarHBondContact O-N 3.11Å; S108-T112 PolarHBondContact O-OG1 3.01Å
109V96Very high94.6Very high63 Ų6361.6 Ų61.638%0.38233%0.332SS..Hα-helixtrans-61.8-44.6-178.4174.40000111L105 I106 T112 F113L105-V109 WeakPolarHBondContact O-CG2 3.41Å; I106-V109 WeakPolarHBondContact O-CG2 3.48Å; V109-T112 PolarHBondContact O-N 3Å; V109-F113 VanDerWaalsContact O-CB 3.26Å; V109-F113 WeakPolarHBondContact O-CB 3.22Å; V109-F113 PolarHBondContact O-N 3.03Å
110T97.1Very high94.7Very high85 Ų8560.4 Ų60.452%0.52132%0.324SS..Hα-helixtrans-65.7-46.9-177.6-58.20000111.1L41 S108 T112 F113 L114L41-T110 HydrophobicContact CD1-CG2 4.36Å; S108-T110 PolarHBondContact O-N 3.02Å; T110-T112 PolarHBondContact O-N 3.35Å; T110-F113 PolarHBondContact O-N 3.29Å; T110-L114 HydrophobicContact CG2-CD1 4.09Å; T110-L114 HydrophobicContact CG2-CG 4.44Å; T110-L114 WeakPolarHBondContact O-CB 3.36Å; T110-L114 WeakPolarHBondContact O-CG 3.5Å; T110-L114 PolarHBondContact O-N 2.95Å
111E97.4Very high94.8Very high50 Ų5053.3 Ų53.323%0.23429%0.287CS..Hα-helixtrans-54.2-52.7175.1-69.165.5-157.200110.2L41 S108 F113 L114 F115 P185L41-E111 HydrophobicContact CD1-CG 4.39Å; L41-E111 HydrophobicContact CD2-CB 4.33Å; L41-E111 HydrophobicContact CD2-CG 4.07Å; S108-E111 VanDerWaalsContact C-OE2 3.23Å; S108-E111 WeakPolarHBondContact CA-OE2 3.5Å; E111-F113 VanDerWaalsContact C-N 3.35Å; E111-F113 PolarHBondContact O-N 3.36Å; E111-L114 PolarHBondContact O-N 2.81Å; E111-F115 WeakPolarHBondContact O-CB 3.35Å; E111-F115 PolarHBondContact O-N 3.17Å; E111-P185 HydrophobicContact CB-CG 4.07Å
112T97.9Very high95.1Very high0 Ų044.5 Ų44.50%025%0.253CS..Hα-helixtrans-65.4-39.9-178-56.30000111.2I98 V99 A103 S108 V109 T110 F115 A116 W184I98-T112 HydrophobicContact CB-CG2 4.12Å; I98-T112 HydrophobicContact CG2-CG2 3.64Å; V99-T112 HydrophobicContact CG2-CG2 4.12Å; A103-T112 HydrophobicContact CB-CG2 4.17Å; S108-T112 VanDerWaalsContact O-CB 3.26Å; S108-T112 WeakPolarHBondContact O-CB 3.29Å; S108-T112 PolarHBondContact O-N 3.11Å; S108-T112 PolarHBondContact O-OG1 3.01Å; V109-T112 PolarHBondContact O-N 3Å; T110-T112 PolarHBondContact O-N 3.35Å; T112-F115 PolarHBondContact O-N 3.24Å; T112-A116 WeakPolarHBondContact O-CB 3.32Å; T112-A116 PolarHBondContact O-N 3.5Å; T112-W184 HydrophobicContact CG2-CZ2 4.24Å; T112-W184 PolarHBondContact OG1-NE1 3.36Å
113F98.4Very high95.4Very high65 Ų6541.6 Ų41.629%0.28522%0.222SC..Hα-helixtrans-68-43.9176.8-173.4-104.4000112.3C91 I92 H95 V109 T110 E111 F115 A116 V117C91-F113 HydrophobicContact CB-CE2 4.14Å; C91-F113 HydrophobicContact CB-CZ 4.32Å; I92-F113 HydrophobicContact CD1-CE2 4Å; H95-F113 HydrophobicContact CB-CD2 4.3Å; H95-F113 WeakPolarHBondContact ND1-CA 2.91Å; H95-F113 PolarHBondContact ND1-N 3.17Å; V109-F113 VanDerWaalsContact O-CB 3.26Å; V109-F113 WeakPolarHBondContact O-CB 3.22Å; V109-F113 PolarHBondContact O-N 3.03Å; T110-F113 PolarHBondContact O-N 3.29Å; E111-F113 VanDerWaalsContact C-N 3.35Å; E111-F113 PolarHBondContact O-N 3.36Å; F113-F115 VanDerWaalsContact C-N 3.29Å; F113-F115 PolarHBondContact O-N 3.48Å; F113-A116 CarbonylContact O-C 3.53Å; F113-A116 WeakPolarHBondContact O-CA 3.37Å; F113-A116 WeakPolarHBondContact O-CB 3.23Å; F113-A116 PolarHBondContact O-N 3.45Å; F113-A116 VanDerWaalsContact O-N 3.1Å; F113-V117 HydrophobicContact CD1-CG2 4.2Å; F113-V117 HydrophobicContact CE1-CG2 3.87Å; F113-V117 HydrophobicContact CZ-CG2 4.18Å; F113-V117 WeakPolarHBondContact O-CG2 3.37Å; F113-V117 PolarHBondContact O-N 2.82Å
114L98.6Very high95.7Very high32 Ų3242 Ų4217%0.16822%0.223CC..Hα-helixtrans-64.6-35.2176-71.3179000112L41 L44 T110 E111 V117 L118L41-L114 HydrophobicContact CB-CD1 3.87Å; L41-L114 HydrophobicContact CD1-CD1 4.36Å; L41-L114 HydrophobicContact CD2-CD1 4.05Å; L41-L114 HydrophobicContact CG-CD1 4.31Å; L44-L114 HydrophobicContact CB-CB 4.42Å; L44-L114 HydrophobicContact CD1-CB 3.96Å; T110-L114 HydrophobicContact CG2-CD1 4.09Å; T110-L114 HydrophobicContact CG2-CG 4.44Å; T110-L114 WeakPolarHBondContact O-CB 3.36Å; T110-L114 WeakPolarHBondContact O-CG 3.5Å; T110-L114 PolarHBondContact O-N 2.95Å; E111-L114 PolarHBondContact O-N 2.81Å; L114-V117 PolarHBondContact O-N 2.87Å; L114-L118 PolarHBondContact O-N 3.22Å
115F98.7Very high96.1Very high5 Ų540.4 Ų40.42%0.02221%0.212CC..Hα-helixtrans-65.3-40.5170.4177.5-137000112.2I98 E111 T112 F113 V117 L118 L119 A166 W184 P185 C188 A192I98-F115 HydrophobicContact CD1-CD1 3.66Å; I98-F115 HydrophobicContact CD1-CE1 3.89Å; I98-F115 HydrophobicContact CD1-CG 4.43Å; I98-F115 HydrophobicContact CG1-CD1 4.36Å; I98-F115 HydrophobicContact CG1-CE1 4.22Å; I98-F115 HydrophobicContact CG2-CD1 4.33Å; I98-F115 HydrophobicContact CG2-CE1 4.5Å; E111-F115 WeakPolarHBondContact O-CB 3.35Å; E111-F115 PolarHBondContact O-N 3.17Å; T112-F115 PolarHBondContact O-N 3.24Å; F113-F115 VanDerWaalsContact C-N 3.29Å; F113-F115 PolarHBondContact O-N 3.48Å; F115-V117 VanDerWaalsContact C-N 3.31Å; F115-V117 PolarHBondContact O-N 3.2Å; F115-L118 WeakPolarHBondContact O-CB 3.48Å; F115-L118 PolarHBondContact O-N 3.41Å; F115-L119 HydrophobicContact CD2-CD1 4.41Å; F115-L119 HydrophobicContact CD2-CG 4.45Å; F115-L119 HydrophobicContact CE1-CD1 3.94Å; F115-L119 HydrophobicContact CE2-CD1 3.77Å; F115-L119 HydrophobicContact CE2-CG 3.87Å; F115-L119 HydrophobicContact CZ-CD1 3.51Å; F115-L119 HydrophobicContact CZ-CG 4.11Å; F115-L119 PolarHBondContact O-N 3.15Å; F115-A166 HydrophobicContact CE2-CB 4.49Å; F115-A166 HydrophobicContact CZ-CB 3.89Å; F115-W184 HydrophobicContact CD1-CH2 4.01Å; F115-W184 HydrophobicContact CD1-CZ2 4.07Å; F115-W184 HydrophobicContact CE1-CH2 4.06Å; F115-P185 HydrophobicContact CB-CB 3.97Å; F115-P185 HydrophobicContact CB-CG 4.15Å; F115-P185 HydrophobicContact CD1-CB 4.22Å; F115-P185 HydrophobicContact CG-CB 4.15Å; F115-C188 HydrophobicContact CE1-CB 3.73Å; F115-C188 HydrophobicContact CE2-CB 4.26Å; F115-C188 HydrophobicContact CZ-CB 3.58Å; F115-A192 HydrophobicContact CE2-CB 4.04Å
116A98.6Very high96.7Very high0 Ų035.5 Ų35.50%019%0.186CC..Hα-helixtrans-63.7-34.6173.900000113.1C91 F94 H95 I98 T112 F113 S120C91-A116 WeakPolarHBondContact O-CB 3.48Å; F94-A116 HydrophobicContact CB-CB 3.79Å; H95-A116 HydrophobicContact CB-CB 3.86Å; I98-A116 HydrophobicContact CD1-CB 4Å; T112-A116 WeakPolarHBondContact O-CB 3.32Å; T112-A116 PolarHBondContact O-N 3.5Å; F113-A116 CarbonylContact O-C 3.53Å; F113-A116 WeakPolarHBondContact O-CA 3.37Å; F113-A116 WeakPolarHBondContact O-CB 3.23Å; F113-A116 PolarHBondContact O-N 3.45Å; F113-A116 VanDerWaalsContact O-N 3.1Å; A116-S120 VanDerWaalsContact O-CB 3.32Å; A116-S120 WeakPolarHBondContact O-CB 3.24Å; A116-S120 PolarHBondContact O-N 2.87Å; A116-S120 PolarHBondContact O-OG 3.24Å
117V98.8Very high97.1Very high29 Ų2928.6 Ų28.618%0.17615%0.151CC..Hα-helixtrans-64.7-44.1171.9171.40000110.8C91 F113 L114 F115 S120 T121C91-V117 HydrophobicContact CB-CG2 4.32Å; F113-V117 HydrophobicContact CD1-CG2 4.2Å; F113-V117 HydrophobicContact CE1-CG2 3.87Å; F113-V117 HydrophobicContact CZ-CG2 4.18Å; F113-V117 WeakPolarHBondContact O-CG2 3.37Å; F113-V117 PolarHBondContact O-N 2.82Å; L114-V117 PolarHBondContact O-N 2.87Å; F115-V117 VanDerWaalsContact C-N 3.31Å; F115-V117 PolarHBondContact O-N 3.2Å; V117-S120 PolarHBondContact O-N 3.22Å; V117-T121 WeakPolarHBondContact O-CB 3.36Å; V117-T121 PolarHBondContact O-N 2.9Å; V117-T121 PolarHBondContact O-OG1 3.23Å
118L98.8Very high97.5Very high0 Ų020.6 Ų20.60%011%0.114CC..Hα-helixtrans-60.2-49.3175.7-173.776.6000111.1L44 C47 S48 L114 F115 S120 T121 F122L44-L118 HydrophobicContact CD2-CD2 3.78Å; C47-L118 HydrophobicContact CB-CD1 4.2Å; S48-L118 WeakPolarHBondContact OG-CA 3.47Å; S48-L118 WeakPolarHBondContact OG-CD1 3.29Å; L114-L118 PolarHBondContact O-N 3.22Å; F115-L118 WeakPolarHBondContact O-CB 3.48Å; F115-L118 PolarHBondContact O-N 3.41Å; L118-S120 PolarHBondContact O-N 2.95Å; L118-T121 WeakPolarHBondContact O-CA 3.39Å; L118-T121 VanDerWaalsContact O-CB 3.29Å; L118-T121 WeakPolarHBondContact O-CB 3.36Å; L118-T121 PolarHBondContact O-N 2.95Å; L118-T121 VanDerWaalsContact O-N 3.09Å; L118-F122 HydrophobicContact CD1-CE1 4.13Å; L118-F122 HydrophobicContact CD1-CE2 3.86Å; L118-F122 HydrophobicContact CD1-CZ 3.56Å; L118-F122 HydrophobicContact CD2-CE2 3.88Å; L118-F122 HydrophobicContact CD2-CZ 4.35Å; L118-F122 HydrophobicContact CG-CD2 4.19Å; L118-F122 HydrophobicContact CG-CE2 3.65Å; L118-F122 HydrophobicContact CG-CZ 3.91Å; L118-F122 PolarHBondContact O-N 2.92Å
119L98.6Very high97.5Very high8 Ų820 Ų204%0.04211%0.11CC..Hα-helixtrans-61-42.8177.3-88.8170.8000112.3F94 I98 F115 T121 F122 T123 A166 A192F94-L119 HydrophobicContact CD1-CB 4.27Å; F94-L119 HydrophobicContact CD1-CD1 4.24Å; F94-L119 HydrophobicContact CD2-CB 4.42Å; F94-L119 HydrophobicContact CE1-CB 4.45Å; F94-L119 HydrophobicContact CG-CB 4.26Å; I98-L119 HydrophobicContact CD1-CD1 4.02Å; F115-L119 HydrophobicContact CD2-CD1 4.41Å; F115-L119 HydrophobicContact CD2-CG 4.45Å; F115-L119 HydrophobicContact CE1-CD1 3.94Å; F115-L119 HydrophobicContact CE2-CD1 3.77Å; F115-L119 HydrophobicContact CE2-CG 3.87Å; F115-L119 HydrophobicContact CZ-CD1 3.51Å; F115-L119 HydrophobicContact CZ-CG 4.11Å; F115-L119 PolarHBondContact O-N 3.15Å; L119-T121 PolarHBondContact O-N 3.48Å; L119-F122 PolarHBondContact O-N 3.42Å; L119-T123 WeakPolarHBondContact O-CB 3.41Å; L119-T123 WeakPolarHBondContact O-CG2 3.37Å; L119-T123 PolarHBondContact O-N 2.84Å; L119-T123 PolarHBondContact O-OG1 3Å; L119-A166 HydrophobicContact CD1-CB 4.33Å; L119-A166 HydrophobicContact CD2-CB 4Å; L119-A192 HydrophobicContact CD2-CB 4.15Å
120S98.8Very high97.3Very high0 Ų017.9 Ų17.90%010%0.096CC..Hα-helixtrans-62.3-34.3174.8-63.10000112.1S90 C91 F94 A116 V117 L118 T124 L125S90-S120 PolarHBondContact O-OG 2.83Å; S90-S120 PolarHBondContact OG-OG 3.31Å; C91-S120 WeakPolarHBondContact CA-OG 3.1Å; C91-S120 PolarHBondContact N-OG 2.84Å; C91-S120 VanDerWaalsContact SG-CB 3.6Å; C91-S120 PolarHBondContact SG-OG 3.41Å; F94-S120 VanDerWaalsContact CD2-OG 3.3Å; F94-S120 WeakPolarHBondContact CD2-OG 3.47Å; A116-S120 VanDerWaalsContact O-CB 3.32Å; A116-S120 WeakPolarHBondContact O-CB 3.24Å; A116-S120 PolarHBondContact O-N 2.87Å; A116-S120 PolarHBondContact O-OG 3.24Å; V117-S120 PolarHBondContact O-N 3.22Å; L118-S120 PolarHBondContact O-N 2.95Å; S120-T124 PolarHBondContact O-N 2.97Å; S120-L125 PolarHBondContact O-N 3.41Å
121T98.7Very high97.1Very high0 Ų015 Ų150%08%0.078CC..Hα-helixtrans-66.4-44.4175.6-59.30000111.4I51 S52 V117 L118 L119 T123 L125I51-T121 HydrophobicContact CB-CG2 4.1Å; I51-T121 HydrophobicContact CG2-CG2 3.92Å; S52-T121 WeakPolarHBondContact OG-CG2 3.46Å; V117-T121 WeakPolarHBondContact O-CB 3.36Å; V117-T121 PolarHBondContact O-N 2.9Å; V117-T121 PolarHBondContact O-OG1 3.23Å; L118-T121 WeakPolarHBondContact O-CA 3.39Å; L118-T121 VanDerWaalsContact O-CB 3.29Å; L118-T121 WeakPolarHBondContact O-CB 3.36Å; L118-T121 PolarHBondContact O-N 2.95Å; L118-T121 VanDerWaalsContact O-N 3.09Å; L119-T121 PolarHBondContact O-N 3.48Å; T121-T123 VanDerWaalsContact C-N 3.3Å; T121-T123 PolarHBondContact O-N 3.32Å; T121-L125 HydrophobicContact CG2-CD2 4.17Å
122F98.6Very high96.9Very high0 Ų013.1 Ų13.10%07%0.072CC..Hα-helixtrans-74.5-18.3179.6-64.5-19.8000114.1I51 L118 L119 Q126 A192 T193 Y196I51-F122 HydrophobicContact CB-CE1 4.48Å; I51-F122 HydrophobicContact CG1-CE1 4.31Å; I51-F122 HydrophobicContact CG2-CD1 4.25Å; I51-F122 HydrophobicContact CG2-CE1 4.12Å; L118-F122 HydrophobicContact CD1-CE1 4.13Å; L118-F122 HydrophobicContact CD1-CE2 3.86Å; L118-F122 HydrophobicContact CD1-CZ 3.56Å; L118-F122 HydrophobicContact CD2-CE2 3.88Å; L118-F122 HydrophobicContact CD2-CZ 4.35Å; L118-F122 HydrophobicContact CG-CD2 4.19Å; L118-F122 HydrophobicContact CG-CE2 3.65Å; L118-F122 HydrophobicContact CG-CZ 3.91Å; L118-F122 PolarHBondContact O-N 2.92Å; L119-F122 PolarHBondContact O-N 3.42Å; F122-Q126 WeakPolarHBondContact O-CG 3.3Å; F122-A192 HydrophobicContact CD2-CB 4.48Å; F122-T193 HydrophobicContact CZ-CG2 4.38Å; F122-Y196 HydrophobicContact CB-CD2 3.67Å; F122-Y196 HydrophobicContact CB-CE2 4.23Å; F122-Y196 HydrophobicContact CB-CG 4.1Å; F122-Y196 AromaticContact CD1-CD1 3.7Å; F122-Y196 HydrophobicContact CD1-CD1 3.7Å; F122-Y196 AromaticContact CD1-CD2 3.77Å; F122-Y196 HydrophobicContact CD1-CD2 3.77Å; F122-Y196 AromaticContact CD1-CE1 3.88Å; F122-Y196 HydrophobicContact CD1-CE1 3.88Å; F122-Y196 AromaticContact CD1-CE2 3.97Å; F122-Y196 HydrophobicContact CD1-CE2 3.97Å; F122-Y196 AromaticContact CD1-CG 3.64Å; F122-Y196 HydrophobicContact CD1-CG 3.64Å; F122-Y196 HydrophobicContact CD2-CD2 4.45Å; F122-Y196 HydrophobicContact CD2-CG 4.01Å; F122-Y196 AromaticContact CE1-CD1 3.64Å; F122-Y196 HydrophobicContact CE1-CD1 3.64Å; F122-Y196 AromaticContact CE1-CE1 3.88Å; F122-Y196 HydrophobicContact CE1-CE1 3.88Å; F122-Y196 AromaticContact CE1-CG 4Å; F122-Y196 HydrophobicContact CE1-CG 4Å; F122-Y196 HydrophobicContact CE2-CD1 4.48Å; F122-Y196 HydrophobicContact CE2-CG 4.34Å; F122-Y196 HydrophobicContact CG-CD1 4.17Å; F122-Y196 AromaticContact CG-CD2 3.72Å; F122-Y196 HydrophobicContact CG-CD2 3.72Å; F122-Y196 HydrophobicContact CG-CE2 4.31Å; F122-Y196 AromaticContact CG-CG 3.65Å; F122-Y196 HydrophobicContact CG-CG 3.65Å; F122-Y196 HydrophobicContact CZ-CD1 4.05Å; F122-Y196 HydrophobicContact CZ-CG 4.33Å
123T98.2Very high96.7Very high4 Ų414.5 Ų14.53%0.0258%0.081CC..THydrogen-bonded Turntrans-118.7-76.1-173.561.60000112.7F94 L119 T121 L125 Q126 C127 T159 I163F94-T123 VanDerWaalsContact CE2-OG1 3.31Å; F94-T123 WeakPolarHBondContact CE2-OG1 3.34Å; F94-T123 HydrophobicContact CZ-CG2 4.45Å; F94-T123 WeakPolarHBondContact CZ-OG1 3.32Å; L119-T123 WeakPolarHBondContact O-CB 3.41Å; L119-T123 WeakPolarHBondContact O-CG2 3.37Å; L119-T123 PolarHBondContact O-N 2.84Å; L119-T123 PolarHBondContact O-OG1 3Å; T121-T123 VanDerWaalsContact C-N 3.3Å; T121-T123 PolarHBondContact O-N 3.32Å; T123-L125 PolarHBondContact O-N 3.5Å; T123-Q126 WeakPolarHBondContact O-CB 3.4Å; T123-Q126 PolarHBondContact O-N 2.68Å; T123-C127 PolarHBondContact O-N 2.78Å; T123-C127 VanDerWaalsContact O-N 3.17Å; T123-C127 PolarHBondContact O-SG 3.09Å; T123-C127 VanDerWaalsContact O-SG 3.35Å; T123-T159 HydrophobicContact CG2-CG2 3.82Å; T123-I163 HydrophobicContact CG2-CD1 4.37Å; T123-I163 HydrophobicContact CG2-CG1 4.12Å
124T97.9Very high96.5Very high18 Ų1815.3 Ų15.311%0.119%0.089CC..Hα-helixtrans-64.7-40.2-173.3-59.60000112.8S90 S120 Q126 C127 L128 W138S90-T124 WeakPolarHBondContact CB-OG1 3.46Å; S90-T124 VanDerWaalsContact OG-CB 3.3Å; S90-T124 WeakPolarHBondContact OG-CB 3.4Å; S90-T124 PolarHBondContact OG-OG1 3.21Å; S120-T124 PolarHBondContact O-N 2.97Å; T124-Q126 VanDerWaalsContact C-N 3.28Å; T124-Q126 PolarHBondContact O-N 2.87Å; T124-C127 WeakPolarHBondContact O-CB 3.16Å; T124-C127 PolarHBondContact O-N 3.2Å; T124-C127 VanDerWaalsContact O-N 3.14Å; T124-L128 HydrophobicContact CG2-CD1 3.99Å; T124-L128 HydrophobicContact CG2-CG 4.33Å; T124-L128 WeakPolarHBondContact O-CG 3.43Å; T124-L128 PolarHBondContact O-N 3.49Å; T124-W138 HydrophobicContact CG2-CH2 3.83Å; T124-W138 HydrophobicContact CG2-CZ3 4.21Å
125L97.8Very high96.2Very high16 Ų1617.7 Ų17.78%0.08410%0.1CC..Hα-helixtrans-62.4-39.5177.8-177.264.5000111.5S52 F87 S120 T121 T123 C127 L128 C129S52-L125 VanDerWaalsContact CA-CD2 3.41Å; S52-L125 VanDerWaalsContact OG-CD2 3.26Å; S52-L125 WeakPolarHBondContact OG-CD2 3.42Å; F87-L125 HydrophobicContact CD2-CB 4Å; F87-L125 HydrophobicContact CD2-CD1 4.4Å; F87-L125 HydrophobicContact CE2-CB 3.9Å; S120-L125 PolarHBondContact O-N 3.41Å; T121-L125 HydrophobicContact CG2-CD2 4.17Å; T123-L125 PolarHBondContact O-N 3.5Å; L125-C127 VanDerWaalsContact C-N 3.3Å; L125-C127 PolarHBondContact O-N 2.94Å; L125-L128 WeakPolarHBondContact O-CB 3.3Å; L125-L128 PolarHBondContact O-N 2.83Å; L125-L128 VanDerWaalsContact O-N 3.17Å; L125-C129 WeakPolarHBondContact O-CB 3.33Å; L125-C129 PolarHBondContact O-N 2.86Å; L125-C129 PolarHBondContact O-SG 3.49Å
126Q94.8Very high96Very high20 Ų2024 Ų249%0.09313%0.13CC..Hα-helixtrans-60.8-42.6174.8-62.9-69.9800111.2N55 F122 T123 T124 L128 C129 V130 L155 Y196N55-Q126 PolarHBondContact ND2-NE2 3.41Å; N55-Q126 VanDerWaalsContact ND2-NE2 3.11Å; N55-Q126 VanDerWaalsContact OD1-CD 3.31Å; N55-Q126 PolarHBondContact OD1-NE2 3.46Å; N55-Q126 PolarHBondContact OD1-OE1 3.16Å; F122-Q126 WeakPolarHBondContact O-CG 3.3Å; T123-Q126 WeakPolarHBondContact O-CB 3.4Å; T123-Q126 PolarHBondContact O-N 2.68Å; T124-Q126 VanDerWaalsContact C-N 3.28Å; T124-Q126 PolarHBondContact O-N 2.87Å; Q126-L128 VanDerWaalsContact C-N 3.34Å; Q126-L128 PolarHBondContact O-N 3.42Å; Q126-C129 PolarHBondContact O-N 3.28Å; Q126-V130 WeakPolarHBondContact O-CG2 3.35Å; Q126-V130 PolarHBondContact O-N 3.44Å; Q126-L155 HydrophobicContact CB-CD1 3.39Å; Q126-Y196 PolarHBondContact NE2-OH 2.96Å
127C95.3Very high95.8Very high6 Ų624.9 Ų24.94%0.04114%0.137CC..Hα-helixtrans-61.6-42.7174.6-61.20000111.5T123 T124 L125 V130 L131 G132 W138 L155T123-C127 PolarHBondContact O-N 2.78Å; T123-C127 VanDerWaalsContact O-N 3.17Å; T123-C127 PolarHBondContact O-SG 3.09Å; T123-C127 VanDerWaalsContact O-SG 3.35Å; T124-C127 WeakPolarHBondContact O-CB 3.16Å; T124-C127 PolarHBondContact O-N 3.2Å; T124-C127 VanDerWaalsContact O-N 3.14Å; L125-C127 VanDerWaalsContact C-N 3.3Å; L125-C127 PolarHBondContact O-N 2.94Å; C127-V130 PolarHBondContact O-N 3.2Å; C127-L131 WeakPolarHBondContact O-CA 3.29Å; C127-L131 VanDerWaalsContact O-CB 3.3Å; C127-L131 WeakPolarHBondContact O-CB 3.48Å; C127-L131 PolarHBondContact O-N 3.43Å; C127-G132 PolarHBondContact O-N 2.99Å; C127-W138 HydrophobicContact CB-CD2 4.22Å; C127-W138 HydrophobicContact CB-CH2 4.47Å; C127-W138 HydrophobicContact CB-CZ2 3.98Å; C127-L155 HydrophobicContact CB-CD2 4.35Å
128L95.8Very high95.6Very high9 Ų925.7 Ų25.75%0.04714%0.137CC..Hα-helixtrans-65.5-39.9178.3-73.3167.4000112.4C83 Y86 F87 T124 L125 Q126 G132 P133 W138C83-L128 HydrophobicContact CB-CD1 4.44Å; C83-L128 HydrophobicContact CB-CD2 3.99Å; C83-L128 WeakPolarHBondContact O-CD1 3.47Å; Y86-L128 HydrophobicContact CD2-CD2 4.12Å; F87-L128 HydrophobicContact CB-CD1 3.84Å; T124-L128 HydrophobicContact CG2-CD1 3.99Å; T124-L128 HydrophobicContact CG2-CG 4.33Å; T124-L128 WeakPolarHBondContact O-CG 3.43Å; T124-L128 PolarHBondContact O-N 3.49Å; L125-L128 WeakPolarHBondContact O-CB 3.3Å; L125-L128 PolarHBondContact O-N 2.83Å; L125-L128 VanDerWaalsContact O-N 3.17Å; Q126-L128 VanDerWaalsContact C-N 3.34Å; Q126-L128 PolarHBondContact O-N 3.42Å; L128-G132 WeakPolarHBondContact O-CA 3.43Å; L128-G132 PolarHBondContact O-N 3.26Å; L128-G132 VanDerWaalsContact O-N 3.09Å; L128-P133 HydrophobicContact CD2-CB 4.27Å; L128-W138 HydrophobicContact CD2-CH2 3.92Å; L128-W138 HydrophobicContact CD2-CZ2 3.54Å; L128-W138 HydrophobicContact CG-CH2 4.02Å; L128-W138 HydrophobicContact CG-CZ2 3.78Å
129C93.4Very high95.4Very high11 Ų1130 Ų307%0.07416%0.159CC..Hα-helixtrans-65.2-50.6174.9-77.20000111Y59 L125 Q126Y59-C129 WeakPolarHBondContact CD2-O 3.49Å; Y59-C129 WeakPolarHBondContact CE2-O 3.42Å; Y59-C129 HydrophobicContact CG-CB 4.34Å; L125-C129 WeakPolarHBondContact O-CB 3.33Å; L125-C129 PolarHBondContact O-N 2.86Å; L125-C129 PolarHBondContact O-SG 3.49Å; Q126-C129 PolarHBondContact O-N 3.28Å
130V92.1Very high95.2Very high17 Ų1734 Ų3410%0.10317%0.173CC..Hα-helixtrans-78.6-50.4-173.91790000112N65 Q126 C127 W151 L155N65-V130 PolarHBondContact ND2-O 3.44Å; Q126-V130 WeakPolarHBondContact O-CG2 3.35Å; Q126-V130 PolarHBondContact O-N 3.44Å; C127-V130 PolarHBondContact O-N 3.2Å; V130-W151 HydrophobicContact CG1-CB 3.93Å; V130-L155 HydrophobicContact CB-CD2 4.5Å
131L92.4Very high95Very high24 Ų2434 Ų3413%0.12617%0.173CC..Hα-helixtrans-99.9-13.8-169.7-53.1176.1000113.3C127 A137 W138 V141 L155C127-L131 WeakPolarHBondContact O-CA 3.29Å; C127-L131 VanDerWaalsContact O-CB 3.3Å; C127-L131 WeakPolarHBondContact O-CB 3.48Å; C127-L131 PolarHBondContact O-N 3.43Å; L131-A137 HydrophobicContact CB-CB 4.32Å; L131-W138 HydrophobicContact CD1-CG 4.3Å; L131-V141 HydrophobicContact CD1-CB 4.04Å; L131-V141 HydrophobicContact CD1-CG1 4.47Å; L131-V141 HydrophobicContact CD1-CG2 3.77Å; L131-V141 HydrophobicContact CD2-CG2 3.92Å; L131-L155 HydrophobicContact CD1-CD2 3.64Å; L131-L155 HydrophobicContact CG-CD2 3.95Å
132G92.7Very high94.8Very high12 Ų1238 Ų3812%0.12419%0.191CC..  trans70-174.4-171.400000112.7C127 L128 N134 W138C127-G132 PolarHBondContact O-N 2.99Å; L128-G132 WeakPolarHBondContact O-CA 3.43Å; L128-G132 PolarHBondContact O-N 3.26Å; L128-G132 VanDerWaalsContact O-N 3.09Å; G132-N134 PolarHBondContact O-N 3.37Å; G132-W138 PolarHBondContact O-NE1 2.87Å
133P94Very high94.6Very high28 Ų2840.6 Ų40.618%0.18221%0.209CC..SBendtrans-79.755.9177.934.3-33.2000110.7R79 K82 Y86 L128R79-P133 HydrophobicContact CG-CG 3.92Å; K82-P133 HydrophobicContact CB-CB 3.98Å; K82-P133 HydrophobicContact CB-CG 3.98Å; Y86-P133 HydrophobicContact CD2-CB 3.67Å; Y86-P133 HydrophobicContact CE2-CB 3.56Å; L128-P133 HydrophobicContact CD2-CB 4.27Å
134N93.3Very high94.1Very high83 Ų8349.7 Ų49.744%0.44425%0.248SC..  trans-117.494.3178.3-177.5-11.2000109.9G132 Q136 A137 W138G132-N134 PolarHBondContact O-N 3.37Å; N134-Q136 PolarHBondContact O-N 2.9Å; N134-Q136 WeakPolarHBondContact OD1-CB 3.47Å; N134-Q136 PolarHBondContact OD1-N 3.39Å; N134-Q136 VanDerWaalsContact OD1-N 3.16Å; N134-A137 HydrophobicContact CB-CB 4.03Å; N134-A137 WeakPolarHBondContact O-CB 3.49Å; N134-A137 PolarHBondContact O-N 2.9Å; N134-A137 PolarHBondContact OD1-N 3.47Å; N134-W138 PolarHBondContact O-N 2.85Å; N134-W138 VanDerWaalsContact O-N 3.16Å
135I93.1Very high93.4Very high81 Ų8154.1 Ų54.142%0.41527%0.272SS..Hα-helixtrans-58.9-35.5-177.3-62.5169.3000111.6Y86 A137 W138 I139Y86-I135 HydrophobicContact CE2-CD1 4.25Å; Y86-I135 HydrophobicContact CE2-CG1 3.97Å; Y86-I135 WeakPolarHBondContact OH-CD1 3.42Å; I135-A137 VanDerWaalsContact C-N 3.3Å; I135-A137 PolarHBondContact O-N 3.37Å; I135-W138 WeakPolarHBondContact O-CB 3.48Å; I135-W138 PolarHBondContact O-N 3.17Å; I135-W138 VanDerWaalsContact O-N 3.08Å; I135-I139 HydrophobicContact CG2-CD1 3.84Å; I135-I139 HydrophobicContact CG2-CG1 4.21Å; I135-I139 WeakPolarHBondContact O-CG1 3.21Å; I135-I139 PolarHBondContact O-N 2.8Å
136Q94.8Very high92.9Very high139 Ų13954 Ų5465%0.6527%0.274SS*.Hα-helixtrans-64.2-37.5177.6-63.1-62.1-24.200111.6N134 W138 R140N134-Q136 PolarHBondContact O-N 2.9Å; N134-Q136 WeakPolarHBondContact OD1-CB 3.47Å; N134-Q136 PolarHBondContact OD1-N 3.39Å; N134-Q136 VanDerWaalsContact OD1-N 3.16Å; Q136-W138 VanDerWaalsContact C-N 3.31Å; Q136-R140 VanDerWaalsContact O-CB 3.31Å; Q136-R140 WeakPolarHBondContact O-CB 3.47Å; Q136-R140 PolarHBondContact O-N 3.37Å
137A93.7Very high92.6Very high17 Ų1753.3 Ų53.314%0.1427%0.271CS..Hα-helixtrans-66.3-35.8173.500000111.6L131 N134 I135 V141L131-A137 HydrophobicContact CB-CB 4.32Å; N134-A137 HydrophobicContact CB-CB 4.03Å; N134-A137 WeakPolarHBondContact O-CB 3.49Å; N134-A137 PolarHBondContact O-N 2.9Å; N134-A137 PolarHBondContact OD1-N 3.47Å; I135-A137 VanDerWaalsContact C-N 3.3Å; I135-A137 PolarHBondContact O-N 3.37Å; A137-V141 WeakPolarHBondContact O-CB 3.45Å; A137-V141 VanDerWaalsContact O-CG2 3.3Å; A137-V141 WeakPolarHBondContact O-CG2 3.47Å; A137-V141 PolarHBondContact O-N 2.95Å
138W95.1Very high92.1Very high47 Ų4756.2 Ų56.218%0.17829%0.289CS..Hα-helixtrans-67.7-50.2177.6-61.211.7000110.7Y86 T124 C127 L128 L131 G132 N134 I135 Q136 R140 V141 F142Y86-W138 AromaticContact CD2-CH2 3.97Å; Y86-W138 HydrophobicContact CD2-CH2 3.97Å; Y86-W138 HydrophobicContact CD2-CZ2 4.24Å; T124-W138 HydrophobicContact CG2-CH2 3.83Å; T124-W138 HydrophobicContact CG2-CZ3 4.21Å; C127-W138 HydrophobicContact CB-CD2 4.22Å; C127-W138 HydrophobicContact CB-CH2 4.47Å; C127-W138 HydrophobicContact CB-CZ2 3.98Å; L128-W138 HydrophobicContact CD2-CH2 3.92Å; L128-W138 HydrophobicContact CD2-CZ2 3.54Å; L128-W138 HydrophobicContact CG-CH2 4.02Å; L128-W138 HydrophobicContact CG-CZ2 3.78Å; L131-W138 HydrophobicContact CD1-CG 4.3Å; G132-W138 PolarHBondContact O-NE1 2.87Å; N134-W138 PolarHBondContact O-N 2.85Å; N134-W138 VanDerWaalsContact O-N 3.16Å; I135-W138 WeakPolarHBondContact O-CB 3.48Å; I135-W138 PolarHBondContact O-N 3.17Å; I135-W138 VanDerWaalsContact O-N 3.08Å; Q136-W138 VanDerWaalsContact C-N 3.31Å; W138-R140 VanDerWaalsContact C-N 3.28Å; W138-R140 PolarHBondContact O-N 2.85Å; W138-V141 PolarHBondContact O-N 3Å; W138-V141 VanDerWaalsContact O-N 3.13Å; W138-F142 WeakPolarHBondContact O-CD2 3.4Å; W138-F142 PolarHBondContact O-N 2.69Å
139I95.3Very high91.8Very high90 Ų9057.3 Ų57.346%0.46230%0.298SS..Hα-helixtrans-55.4-47.3176.2-67.5168.4000110I135 F142 S143I135-I139 HydrophobicContact CG2-CD1 3.84Å; I135-I139 HydrophobicContact CG2-CG1 4.21Å; I135-I139 WeakPolarHBondContact O-CG1 3.21Å; I135-I139 PolarHBondContact O-N 2.8Å; I139-F142 PolarHBondContact O-N 3.05Å; I139-S143 WeakPolarHBondContact O-CB 3.37Å; I139-S143 PolarHBondContact O-N 2.72Å; I139-S143 PolarHBondContact O-OG 3.36Å
140R94.8Very high91.7Very high91 Ų9157.4 Ų57.434%0.34330%0.297SS..Hα-helixtrans-56-55175.1179.3-16368.3104.5-1.1110.8Q136 W138 F142 S143 G146 T148 D152Q136-R140 VanDerWaalsContact O-CB 3.31Å; Q136-R140 WeakPolarHBondContact O-CB 3.47Å; Q136-R140 PolarHBondContact O-N 3.37Å; W138-R140 VanDerWaalsContact C-N 3.28Å; W138-R140 PolarHBondContact O-N 2.85Å; R140-F142 VanDerWaalsContact C-N 3.32Å; R140-F142 PolarHBondContact O-N 3.18Å; R140-S143 WeakPolarHBondContact O-CB 3.24Å; R140-S143 PolarHBondContact O-N 2.79Å; R140-S143 VanDerWaalsContact O-N 3.14Å; R140-G146 PolarHBondContact NH1-O 2.62Å; R140-G146 CarbonylContact O-C 3.59Å; R140-G146 WeakPolarHBondContact O-CA 3.26Å; R140-T148 PolarHBondContact NH1-OG1 3.4Å; R140-D152 IonicContact CZ-OD2 3.45Å; R140-D152 IonicContact NH1-OD2 3.28Å; R140-D152 PolarHBondContact NH1-OD2 2.92Å; R140-D152 IonicContact NH2-OD1 3.69Å; R140-D152 IonicContact NH2-OD2 2.8Å; R140-D152 PolarHBondContact NH2-OD2 3.03Å
141V93.8Very high91.6Very high0 Ų058 Ų580%030%0.298CS..Hα-helixtrans-59.4-43.4-176.5168.30000111L131 A137 W138 S143 D152 L155 Q156L131-V141 HydrophobicContact CD1-CB 4.04Å; L131-V141 HydrophobicContact CD1-CG1 4.47Å; L131-V141 HydrophobicContact CD1-CG2 3.77Å; L131-V141 HydrophobicContact CD2-CG2 3.92Å; A137-V141 WeakPolarHBondContact O-CB 3.45Å; A137-V141 VanDerWaalsContact O-CG2 3.3Å; A137-V141 WeakPolarHBondContact O-CG2 3.47Å; A137-V141 PolarHBondContact O-N 2.95Å; W138-V141 PolarHBondContact O-N 3Å; W138-V141 VanDerWaalsContact O-N 3.13Å; V141-S143 VanDerWaalsContact C-N 3.3Å; V141-S143 PolarHBondContact O-N 3.05Å; V141-D152 HydrophobicContact CG1-CB 4.11Å; V141-D152 HydrophobicContact CG2-CB 3.96Å; V141-L155 HydrophobicContact CG1-CD2 4.37Å; V141-Q156 HydrophobicContact CG1-CG 3.74Å; V141-Q156 VanDerWaalsContact O-CD 3.26Å; V141-Q156 PolarHBondContact O-NE2 3.49Å
142F94.6Very high91.6Very high85 Ų8557.1 Ų57.137%0.37329%0.293SS..Hα-helixtrans-84.93.6-179.3-71.4-80.4000114.8W138 I139 R140 L155 Q156 T159W138-F142 WeakPolarHBondContact O-CD2 3.4Å; W138-F142 PolarHBondContact O-N 2.69Å; I139-F142 PolarHBondContact O-N 3.05Å; R140-F142 VanDerWaalsContact C-N 3.32Å; R140-F142 PolarHBondContact O-N 3.18Å; F142-L155 HydrophobicContact CZ-CG 4.42Å; F142-Q156 HydrophobicContact CD1-CG 4.29Å; F142-Q156 HydrophobicContact CE1-CG 4.29Å; F142-T159 HydrophobicContact CE1-CG2 3.78Å; F142-T159 HydrophobicContact CZ-CG2 3.86Å
143S93.5Very high91.6Very high54 Ų5457.1 Ų57.138%0.37829%0.29SS..SBendtrans-83.1158.1171.9-68.20000111.9I139 R140 V141 N145 G146I139-S143 WeakPolarHBondContact O-CB 3.37Å; I139-S143 PolarHBondContact O-N 2.72Å; I139-S143 PolarHBondContact O-OG 3.36Å; R140-S143 WeakPolarHBondContact O-CB 3.24Å; R140-S143 PolarHBondContact O-N 2.79Å; R140-S143 VanDerWaalsContact O-N 3.14Å; V141-S143 VanDerWaalsContact C-N 3.3Å; V141-S143 PolarHBondContact O-N 3.05Å; S143-N145 PolarHBondContact O-N 3.44Å; S143-N145 VanDerWaalsContact O-N 3.15Å; S143-G146 PolarHBondContact O-N 2.89Å
144K87.7Confident91.7Very high195 Ų19556 Ų5685%0.84828%0.283SS*.THydrogen-bonded Turntrans-53.5122.7175.4-174.4177.7-178.6178.20110.1G146K144-G146 PolarHBondContact O-N 3.41Å
145N84.8Confident91.8Very high112 Ų11252.5 Ų52.560%0.59926%0.264SS*.THydrogen-bonded Turntrans61.411.6-177.8-63.9-52.9000116.4S143 K217S143-N145 PolarHBondContact O-N 3.44Å; S143-N145 VanDerWaalsContact O-N 3.15Å; N145-K217 PolarHBondContact OD1-NZ 3.15Å
146G86.1Confident91.9Very high13 Ų1350.8 Ų50.813%0.13426%0.255CS..  trans-85.9-10.4-174.600000115.8R140 S143 K144 T148R140-G146 PolarHBondContact NH1-O 2.62Å; R140-G146 CarbonylContact O-C 3.59Å; R140-G146 WeakPolarHBondContact O-CA 3.26Å; S143-G146 PolarHBondContact O-N 2.89Å; K144-G146 PolarHBondContact O-N 3.41Å; G146-T148 PolarHBondContact O-N 2.81Å
147A88.5Confident92Very high5 Ų545.6 Ų45.64%0.04123%0.231CC..  trans-74.7104.1169.500000111D152 N153 Q156A147-D152 HydrophobicContact CB-CB 3.67Å; A147-N153 PolarHBondContact O-ND2 3Å; A147-Q156 HydrophobicContact CB-CG 4.32Å
148T85.6Confident92.2Very high67 Ų6745 Ų4541%0.41123%0.225SC..  trans-101-21.8-174.960.50000113R140 G146 D152R140-T148 PolarHBondContact NH1-OG1 3.4Å; G146-T148 PolarHBondContact O-N 2.81Å; T148-D152 PolarHBondContact N-OD2 3.23Å
149S88.6Confident92.3Very high32 Ų3243.2 Ų43.222%0.22422%0.22CC..SBendtrans-103.9161179.887.80000112.7W151 D152 N153S149-W151 PolarHBondContact O-N 3.33Å; S149-W151 PolarHBondContact OG-N 2.99Å; S149-D152 PolarHBondContact N-OD2 3.04Å; S149-D152 PolarHBondContact O-N 2.93Å; S149-D152 PolarHBondContact OG-N 2.99Å; S149-D152 PolarHBondContact OG-OD1 3.13Å; S149-D152 PolarHBondContact OG-OD2 3.17Å; S149-N153 PolarHBondContact O-N 3.49Å; S149-N153 VanDerWaalsContact O-N 3.12Å; S149-N153 PolarHBondContact O-ND2 3.4Å
150I90.8Very high92.5Very high14 Ų1442.4 Ų42.47%0.07222%0.219CC..Hα-helixtrans-58.1-40.9172.3-73.8167000110.2K2 E5 I6 L9 N153 S154 I207K2-I150 HydrophobicContact CB-CD1 4.45Å; E5-I150 HydrophobicContact CB-CD1 4.43Å; E5-I150 HydrophobicContact CG-CD1 4.28Å; I6-I150 HydrophobicContact CG1-CD1 3.85Å; L9-I150 HydrophobicContact CB-CG2 4.4Å; L9-I150 HydrophobicContact CD2-CG2 3.53Å; I150-N153 PolarHBondContact O-N 3.3Å; I150-S154 PolarHBondContact O-N 3.41Å; I150-I207 HydrophobicContact CG1-CG2 4.04Å; I150-I207 HydrophobicContact CG2-CD1 4.09Å; I150-I207 HydrophobicContact CG2-CG2 4.19Å; I150-I207 WeakPolarHBondContact O-CD1 3.4Å
151W90.9Very high92.6Very high30 Ų3039.4 Ų39.411%0.11421%0.212CC..Hα-helixtrans-67.9-38.7177.4-61.194.3000112.6E5 L9 L62 P64 V130 S149 S154 L155E5-W151 PolarHBondContact OE1-NE1 3.05Å; L9-W151 HydrophobicContact CB-CH2 4.19Å; L9-W151 HydrophobicContact CB-CZ2 4.4Å; L9-W151 HydrophobicContact CD1-CD2 4.35Å; L9-W151 HydrophobicContact CD1-CE3 3.69Å; L9-W151 HydrophobicContact CD1-CH2 3.94Å; L9-W151 HydrophobicContact CD1-CZ3 3.46Å; L9-W151 VanDerWaalsContact CD1-CZ3 3.46Å; L62-W151 HydrophobicContact CD1-CH2 3.8Å; L62-W151 HydrophobicContact CD1-CZ3 4.39Å; P64-W151 HydrophobicContact CB-CD2 3.88Å; P64-W151 HydrophobicContact CB-CE3 4.47Å; P64-W151 HydrophobicContact CB-CG 3.97Å; V130-W151 HydrophobicContact CG1-CB 3.93Å; S149-W151 PolarHBondContact O-N 3.33Å; S149-W151 PolarHBondContact OG-N 2.99Å; W151-S154 PolarHBondContact O-N 2.91Å; W151-L155 VanDerWaalsContact O-CB 3.29Å; W151-L155 WeakPolarHBondContact O-CB 3.28Å; W151-L155 PolarHBondContact O-N 3.41Å
152D92.9Very high92.9Very high4 Ų439.4 Ų39.42%0.02121%0.212CC..Hα-helixtrans-62.1-45.1177-63.1-2.7000110.6R140 V141 A147 T148 S149 L155 Q156R140-D152 IonicContact CZ-OD2 3.45Å; R140-D152 IonicContact NH1-OD2 3.28Å; R140-D152 PolarHBondContact NH1-OD2 2.92Å; R140-D152 IonicContact NH2-OD1 3.69Å; R140-D152 IonicContact NH2-OD2 2.8Å; R140-D152 PolarHBondContact NH2-OD2 3.03Å; V141-D152 HydrophobicContact CG1-CB 4.11Å; V141-D152 HydrophobicContact CG2-CB 3.96Å; A147-D152 HydrophobicContact CB-CB 3.67Å; T148-D152 PolarHBondContact N-OD2 3.23Å; S149-D152 PolarHBondContact N-OD2 3.04Å; S149-D152 PolarHBondContact O-N 2.93Å; S149-D152 PolarHBondContact OG-N 2.99Å; S149-D152 PolarHBondContact OG-OD1 3.13Å; S149-D152 PolarHBondContact OG-OD2 3.17Å; D152-L155 PolarHBondContact O-N 3.42Å; D152-Q156 WeakPolarHBondContact O-CG 3.44Å; D152-Q156 PolarHBondContact O-N 2.65Å
153N92.8Very high93.1Very high12 Ų1238.9 Ų38.96%0.06421%0.212CC..Hα-helixtrans-65.3-42.8178.3-76.9-90.7000111.1A147 S149 I150 L155 Q156 I157 W206 I207A147-N153 PolarHBondContact O-ND2 3Å; S149-N153 PolarHBondContact O-N 3.49Å; S149-N153 VanDerWaalsContact O-N 3.12Å; S149-N153 PolarHBondContact O-ND2 3.4Å; I150-N153 PolarHBondContact O-N 3.3Å; N153-L155 VanDerWaalsContact C-N 3.32Å; N153-L155 PolarHBondContact O-N 3.06Å; N153-Q156 PolarHBondContact O-N 3.06Å; N153-I157 VanDerWaalsContact O-CG1 3.31Å; N153-I157 WeakPolarHBondContact O-CG1 3.23Å; N153-I157 PolarHBondContact O-N 3.33Å; N153-W206 HydrophobicContact CB-CZ3 4.24Å; N153-W206 WeakPolarHBondContact OD1-CZ3 3.43Å; N153-I207 HydrophobicContact CB-CD1 4.09Å; N153-I207 HydrophobicContact CB-CG1 4.18Å
154S94.8Very high93.3Very high6 Ų640 Ų404%0.04221%0.213CC..Hα-helixtrans-62.3-40.5176-168.30000112.2N13 I150 W151 T158 A203N13-S154 PolarHBondContact ND2-OG 3.42Å; I150-S154 PolarHBondContact O-N 3.41Å; W151-S154 PolarHBondContact O-N 2.91Å; S154-T158 VanDerWaalsContact O-CB 3.26Å; S154-T158 WeakPolarHBondContact O-CB 3.46Å; S154-T158 PolarHBondContact O-N 2.99Å; S154-T158 PolarHBondContact O-OG1 3.2Å; S154-A203 WeakPolarHBondContact OG-CB 3.35Å
155L95.4Very high93.8Very high8 Ų831.1 Ų31.14%0.04218%0.177CC..Hα-helixtrans-62.5-46.9177.4178.564.6000111.6Q126 C127 V130 L131 V141 F142 W151 D152 N153 T159Q126-L155 HydrophobicContact CB-CD1 3.39Å; C127-L155 HydrophobicContact CB-CD2 4.35Å; V130-L155 HydrophobicContact CB-CD2 4.5Å; L131-L155 HydrophobicContact CD1-CD2 3.64Å; L131-L155 HydrophobicContact CG-CD2 3.95Å; V141-L155 HydrophobicContact CG1-CD2 4.37Å; F142-L155 HydrophobicContact CZ-CG 4.42Å; W151-L155 VanDerWaalsContact O-CB 3.29Å; W151-L155 WeakPolarHBondContact O-CB 3.28Å; W151-L155 PolarHBondContact O-N 3.41Å; D152-L155 PolarHBondContact O-N 3.42Å; N153-L155 VanDerWaalsContact C-N 3.32Å; N153-L155 PolarHBondContact O-N 3.06Å; L155-T159 VanDerWaalsContact O-CB 3.25Å; L155-T159 WeakPolarHBondContact O-CB 3.35Å; L155-T159 PolarHBondContact O-N 3.38Å; L155-T159 PolarHBondContact O-OG1 3.42Å
156Q96Very high94.4Very high45 Ų4526.3 Ų26.321%0.2115%0.153CC..Hα-helixtrans-59.5-53.9176.5-75.8-172.4-47.100111.9V141 F142 A147 D152 N153 T158 T159 V160V141-Q156 HydrophobicContact CG1-CG 3.74Å; V141-Q156 VanDerWaalsContact O-CD 3.26Å; V141-Q156 PolarHBondContact O-NE2 3.49Å; F142-Q156 HydrophobicContact CD1-CG 4.29Å; F142-Q156 HydrophobicContact CE1-CG 4.29Å; A147-Q156 HydrophobicContact CB-CG 4.32Å; D152-Q156 WeakPolarHBondContact O-CG 3.44Å; D152-Q156 PolarHBondContact O-N 2.65Å; N153-Q156 PolarHBondContact O-N 3.06Å; Q156-T158 VanDerWaalsContact C-N 3.33Å; Q156-T158 PolarHBondContact O-N 3.32Å; Q156-T159 PolarHBondContact O-N 2.94Å; Q156-V160 WeakPolarHBondContact O-CB 3.34Å; Q156-V160 WeakPolarHBondContact O-CG2 3.26Å; Q156-V160 PolarHBondContact O-N 3.42Å
157I96.8Very high95Very high30 Ų3031.7 Ų31.715%0.15417%0.169CC..Hα-helixtrans-58.7-48.2-176.9-68.6168.3000109.7N153 T159 V160 C161 I202 A203 W206N153-I157 VanDerWaalsContact O-CG1 3.31Å; N153-I157 WeakPolarHBondContact O-CG1 3.23Å; N153-I157 PolarHBondContact O-N 3.33Å; I157-T159 PolarHBondContact O-N 3.24Å; I157-V160 PolarHBondContact O-N 3.1Å; I157-C161 WeakPolarHBondContact O-CB 3.33Å; I157-C161 PolarHBondContact O-N 3.32Å; I157-C161 PolarHBondContact O-SG 3.16Å; I157-I202 HydrophobicContact CG2-CB 4.38Å; I157-I202 HydrophobicContact CG2-CG2 4.1Å; I157-A203 HydrophobicContact CB-CB 4.12Å; I157-A203 HydrophobicContact CD1-CB 4.18Å; I157-A203 HydrophobicContact CG2-CB 4.02Å; I157-W206 HydrophobicContact CD1-CB 4.25Å; I157-W206 HydrophobicContact CD1-CD2 4.08Å; I157-W206 HydrophobicContact CD1-CE3 3.86Å; I157-W206 HydrophobicContact CD1-CG 4.26Å
158T97.7Very high95.4Very high4 Ų436.7 Ų36.73%0.02519%0.191CC..Hα-helixtrans-64.1-42.1-178.8-52.30000111.9S154 Q156 S162 Y196 L200S154-T158 VanDerWaalsContact O-CB 3.26Å; S154-T158 WeakPolarHBondContact O-CB 3.46Å; S154-T158 PolarHBondContact O-N 2.99Å; S154-T158 PolarHBondContact O-OG1 3.2Å; Q156-T158 VanDerWaalsContact C-N 3.33Å; Q156-T158 PolarHBondContact O-N 3.32Å; T158-S162 WeakPolarHBondContact O-CB 3.34Å; T158-S162 PolarHBondContact O-N 2.97Å; T158-S162 PolarHBondContact O-OG 2.95Å; T158-Y196 HydrophobicContact CG2-CD2 3.37Å; T158-Y196 HydrophobicContact CG2-CE2 3.49Å; T158-Y196 VanDerWaalsContact CG2-CE2 3.49Å; T158-Y196 HydrophobicContact CG2-CG 4.44Å; T158-L200 HydrophobicContact CG2-CD2 4.01Å; T158-L200 HydrophobicContact CG2-CG 4.15Å
159T97.9Very high95.9Very high11 Ų1133.9 Ų33.97%0.06718%0.175CC..Hα-helixtrans-62.6-49.4177.6-62.20000111.3T123 F142 L155 Q156 I157 S162 I163T123-T159 HydrophobicContact CG2-CG2 3.82Å; F142-T159 HydrophobicContact CE1-CG2 3.78Å; F142-T159 HydrophobicContact CZ-CG2 3.86Å; L155-T159 VanDerWaalsContact O-CB 3.25Å; L155-T159 WeakPolarHBondContact O-CB 3.35Å; L155-T159 PolarHBondContact O-N 3.38Å; L155-T159 PolarHBondContact O-OG1 3.42Å; Q156-T159 PolarHBondContact O-N 2.94Å; I157-T159 PolarHBondContact O-N 3.24Å; T159-S162 PolarHBondContact O-N 3.08Å; T159-I163 HydrophobicContact CG2-CD1 3.96Å; T159-I163 WeakPolarHBondContact O-CG1 3.43Å; T159-I163 PolarHBondContact O-N 2.91Å; T159-I163 VanDerWaalsContact O-N 3.08Å
160V97.9Very high96.2Very high72 Ų7234 Ų3444%0.43618%0.178SC..Hα-helixtrans-63.4-46.4-179.6171.20000110.7Q156 I157 S162 I163 L164Q156-V160 WeakPolarHBondContact O-CB 3.34Å; Q156-V160 WeakPolarHBondContact O-CG2 3.26Å; Q156-V160 PolarHBondContact O-N 3.42Å; I157-V160 PolarHBondContact O-N 3.1Å; V160-S162 VanDerWaalsContact C-N 3.31Å; V160-S162 PolarHBondContact O-N 2.91Å; V160-I163 PolarHBondContact O-N 3.48Å; V160-L164 HydrophobicContact CG1-CD1 3.72Å; V160-L164 HydrophobicContact CG1-CG 4.19Å; V160-L164 WeakPolarHBondContact O-CB 3.3Å; V160-L164 WeakPolarHBondContact O-CG 3.4Å; V160-L164 PolarHBondContact O-N 2.93Å
161C98.6Very high96.3Very high28 Ų2838.1 Ų38.119%0.18920%0.195CC..Hα-helixtrans-62-37.8178.1-670000112.2I157 G165 G195I157-C161 WeakPolarHBondContact O-CB 3.33Å; I157-C161 PolarHBondContact O-N 3.32Å; I157-C161 PolarHBondContact O-SG 3.16Å; C161-G165 PolarHBondContact O-N 2.71Å; C161-G195 WeakPolarHBondContact CB-O 3.43Å; C161-G195 VanDerWaalsContact O-CA 3.23Å; C161-G195 WeakPolarHBondContact O-CA 3.47Å
162S98.6Very high96.4Very high0 Ų038 Ų380%020%0.198CC..Hα-helixtrans-64.9-45.3177.3-53.70000112.1T158 T159 V160 G165 A166 Y196T158-S162 WeakPolarHBondContact O-CB 3.34Å; T158-S162 PolarHBondContact O-N 2.97Å; T158-S162 PolarHBondContact O-OG 2.95Å; T159-S162 PolarHBondContact O-N 3.08Å; V160-S162 VanDerWaalsContact C-N 3.31Å; V160-S162 PolarHBondContact O-N 2.91Å; S162-G165 PolarHBondContact O-N 3.49Å; S162-A166 PolarHBondContact O-N 2.94Å; S162-Y196 VanDerWaalsContact OG-CA 3.32Å; S162-Y196 WeakPolarHBondContact OG-CA 3.35Å; S162-Y196 WeakPolarHBondContact OG-CB 3.46Å
163I98.4Very high96.4Very high75 Ų7540.6 Ų40.639%0.38521%0.212SC..Hα-helixtrans-67.1-45.3178.6-66.1169.3000110.9T123 T159 V160 G165 A166 W167T123-I163 HydrophobicContact CG2-CD1 4.37Å; T123-I163 HydrophobicContact CG2-CG1 4.12Å; T159-I163 HydrophobicContact CG2-CD1 3.96Å; T159-I163 WeakPolarHBondContact O-CG1 3.43Å; T159-I163 PolarHBondContact O-N 2.91Å; T159-I163 VanDerWaalsContact O-N 3.08Å; V160-I163 PolarHBondContact O-N 3.48Å; I163-G165 VanDerWaalsContact C-N 3.32Å; I163-G165 PolarHBondContact O-N 3.48Å; I163-A166 WeakPolarHBondContact O-CB 3.43Å; I163-A166 PolarHBondContact O-N 3.4Å; I163-W167 WeakPolarHBondContact O-CB 3.3Å; I163-W167 PolarHBondContact O-N 3.48Å
164L98.4Very high96.3Very high76 Ų7645.2 Ų45.240%0.39824%0.242SC..Hα-helixtrans-64.1-39.4176.8-70.8178.4000111.6V160 W167 F168V160-L164 HydrophobicContact CG1-CD1 3.72Å; V160-L164 HydrophobicContact CG1-CG 4.19Å; V160-L164 WeakPolarHBondContact O-CB 3.3Å; V160-L164 WeakPolarHBondContact O-CG 3.4Å; V160-L164 PolarHBondContact O-N 2.93Å; L164-W167 HydrophobicContact CD2-CE3 4.38Å; L164-W167 PolarHBondContact O-N 2.98Å; L164-F168 HydrophobicContact CB-CD2 4.44Å; L164-F168 HydrophobicContact CB-CE2 4.23Å; L164-F168 WeakPolarHBondContact O-CB 3.43Å; L164-F168 WeakPolarHBondContact O-CD2 3.26Å; L164-F168 WeakPolarHBondContact O-CG 3.45Å; L164-F168 PolarHBondContact O-N 2.88Å
165G98.5Very high96Very high9 Ų949.5 Ų49.59%0.09326%0.264CS..Hα-helixtrans-60.1-45.9174.500000112.1C161 S162 I163 W167 F168 G169 G191C161-G165 PolarHBondContact O-N 2.71Å; S162-G165 PolarHBondContact O-N 3.49Å; I163-G165 VanDerWaalsContact C-N 3.32Å; I163-G165 PolarHBondContact O-N 3.48Å; G165-W167 VanDerWaalsContact C-N 3.34Å; G165-W167 PolarHBondContact O-N 2.9Å; G165-F168 PolarHBondContact O-N 3.42Å; G165-G169 PolarHBondContact O-N 3.34Å; G165-G191 CarbonylContact C-O 3.6Å; G165-G191 VanDerWaalsContact C-O 3.31Å; G165-G191 WeakPolarHBondContact CA-O 3.35Å; G165-G191 CarbonylContact O-C 3.31Å; G165-G191 VanDerWaalsContact O-C 3.24Å; G165-G191 VanDerWaalsContact O-CA 3.26Å; G165-G191 WeakPolarHBondContact O-CA 3.49Å
166A98.1Very high95.3Very high11 Ų1154.5 Ų54.59%0.09129%0.291CS..Hα-helixtrans-57.7-47.1173.600000112.2F115 L119 S162 I163 G169 A170 C188 A192F115-A166 HydrophobicContact CE2-CB 4.49Å; F115-A166 HydrophobicContact CZ-CB 3.89Å; L119-A166 HydrophobicContact CD1-CB 4.33Å; L119-A166 HydrophobicContact CD2-CB 4Å; S162-A166 PolarHBondContact O-N 2.94Å; I163-A166 WeakPolarHBondContact O-CB 3.43Å; I163-A166 PolarHBondContact O-N 3.4Å; A166-G169 PolarHBondContact O-N 3.43Å; A166-A170 PolarHBondContact O-N 2.93Å; A166-C188 WeakPolarHBondContact CA-O 3.5Å; A166-A192 HydrophobicContact CB-CB 3.83Å
167W96.9Very high95Very high126 Ų12659.2 Ų59.248%0.47731%0.307SS..Hα-helixtrans-64.1-44.6-179.7-177.763.1000112.4I163 L164 G165 G169 A170 F171I163-W167 WeakPolarHBondContact O-CB 3.3Å; I163-W167 PolarHBondContact O-N 3.48Å; L164-W167 HydrophobicContact CD2-CE3 4.38Å; L164-W167 PolarHBondContact O-N 2.98Å; G165-W167 VanDerWaalsContact C-N 3.34Å; G165-W167 PolarHBondContact O-N 2.9Å; W167-G169 VanDerWaalsContact C-N 3.26Å; W167-G169 PolarHBondContact O-N 3.1Å; W167-A170 VanDerWaalsContact O-CB 3.29Å; W167-A170 WeakPolarHBondContact O-CB 3.37Å; W167-A170 PolarHBondContact O-N 3.4Å; W167-F171 HydrophobicContact CD2-CE1 4.27Å; W167-F171 HydrophobicContact CD2-CZ 4.26Å; W167-F171 AromaticContact CE2-CE1 3.91Å; W167-F171 HydrophobicContact CE3-CZ 4.13Å; W167-F171 HydrophobicContact CH2-CE1 4.32Å; W167-F171 AromaticContact CH2-CZ 3.68Å; W167-F171 HydrophobicContact CH2-CZ 3.68Å; W167-F171 AromaticContact CZ2-CE1 3.95Å; W167-F171 HydrophobicContact CZ2-CE1 3.95Å; W167-F171 AromaticContact CZ2-CZ 3.78Å; W167-F171 HydrophobicContact CZ2-CZ 3.78Å; W167-F171 AromaticContact CZ3-CZ 3.85Å; W167-F171 HydrophobicContact CZ3-CZ 3.85Å
168F97.2Very high94.7Very high111 Ų11164.3 Ų64.349%0.48734%0.335SS..Hα-helixtrans-63.4-33.5173.2-71.6-47.6000112.4L164 G165 A170 F171 P172L164-F168 HydrophobicContact CB-CD2 4.44Å; L164-F168 HydrophobicContact CB-CE2 4.23Å; L164-F168 WeakPolarHBondContact O-CB 3.43Å; L164-F168 WeakPolarHBondContact O-CD2 3.26Å; L164-F168 WeakPolarHBondContact O-CG 3.45Å; L164-F168 PolarHBondContact O-N 2.88Å; G165-F168 PolarHBondContact O-N 3.42Å; F168-A170 PolarHBondContact O-N 2.9Å; F168-F171 AromaticContact CD1-CD2 3.98Å; F168-F171 HydrophobicContact CD1-CD2 3.98Å; F168-F171 AromaticContact CD1-CE2 3.48Å; F168-F171 HydrophobicContact CD1-CE2 3.48Å; F168-F171 VanDerWaalsContact CD1-CE2 3.48Å; F168-F171 AromaticContact CD1-CZ 3.98Å; F168-F171 HydrophobicContact CD1-CZ 3.98Å; F168-F171 AromaticContact CE1-CE2 3.87Å; F168-F171 HydrophobicContact CE1-CE2 3.87Å; F168-F171 HydrophobicContact CE1-CZ 4.29Å; F168-F171 WeakPolarHBondContact O-CB 3.38Å; F168-F171 PolarHBondContact O-N 3.3Å; F168-F171 VanDerWaalsContact O-N 3.11Å; F168-P172 WeakPolarHBondContact O-CD 3.34Å
169G96.7Very high94.6Very high8 Ų871.3 Ų71.38%0.08236%0.361CS..THydrogen-bonded Turntrans-63.7-15.6173.300000113.9G165 A166 W167 P172 S187 C188G165-G169 PolarHBondContact O-N 3.34Å; A166-G169 PolarHBondContact O-N 3.43Å; W167-G169 VanDerWaalsContact C-N 3.26Å; W167-G169 PolarHBondContact O-N 3.1Å; G169-P172 WeakPolarHBondContact O-CD 3.42Å; G169-S187 WeakPolarHBondContact CA-O 3.44Å; G169-S187 CarbonylContact O-C 3.24Å; G169-S187 WeakPolarHBondContact O-CB 3.31Å; G169-S187 PolarHBondContact O-OG 3.01Å; G169-C188 VanDerWaalsContact C-SG 3.58Å
170A94.8Very high94.4Very high35 Ų3574.8 Ų74.829%0.28938%0.383SS..THydrogen-bonded Turntrans-79.7-24.4173.500000112.9A166 W167 F168 I173 P174 C188A166-A170 PolarHBondContact O-N 2.93Å; W167-A170 VanDerWaalsContact O-CB 3.29Å; W167-A170 WeakPolarHBondContact O-CB 3.37Å; W167-A170 PolarHBondContact O-N 3.4Å; F168-A170 PolarHBondContact O-N 2.9Å; A170-I173 WeakPolarHBondContact O-CB 3.49Å; A170-I173 PolarHBondContact O-N 2.95Å; A170-P174 VanDerWaalsContact O-CD 3.3Å; A170-P174 WeakPolarHBondContact O-CD 3.41Å; A170-C188 VanDerWaalsContact CA-SG 3.56Å
171F93.8Very high94.1Very high100 Ų10075.2 Ų75.244%0.43938%0.377SS..THydrogen-bonded Turntrans-62.6-36.2-175.7-66.2-5.9000114.6W167 F168 I173 P174W167-F171 HydrophobicContact CD2-CE1 4.27Å; W167-F171 HydrophobicContact CD2-CZ 4.26Å; W167-F171 AromaticContact CE2-CE1 3.91Å; W167-F171 HydrophobicContact CE3-CZ 4.13Å; W167-F171 HydrophobicContact CH2-CE1 4.32Å; W167-F171 AromaticContact CH2-CZ 3.68Å; W167-F171 HydrophobicContact CH2-CZ 3.68Å; W167-F171 AromaticContact CZ2-CE1 3.95Å; W167-F171 HydrophobicContact CZ2-CE1 3.95Å; W167-F171 AromaticContact CZ2-CZ 3.78Å; W167-F171 HydrophobicContact CZ2-CZ 3.78Å; W167-F171 AromaticContact CZ3-CZ 3.85Å; W167-F171 HydrophobicContact CZ3-CZ 3.85Å; F168-F171 AromaticContact CD1-CD2 3.98Å; F168-F171 HydrophobicContact CD1-CD2 3.98Å; F168-F171 AromaticContact CD1-CE2 3.48Å; F168-F171 HydrophobicContact CD1-CE2 3.48Å; F168-F171 VanDerWaalsContact CD1-CE2 3.48Å; F168-F171 AromaticContact CD1-CZ 3.98Å; F168-F171 HydrophobicContact CD1-CZ 3.98Å; F168-F171 AromaticContact CE1-CE2 3.87Å; F168-F171 HydrophobicContact CE1-CE2 3.87Å; F168-F171 HydrophobicContact CE1-CZ 4.29Å; F168-F171 WeakPolarHBondContact O-CB 3.38Å; F168-F171 PolarHBondContact O-N 3.3Å; F168-F171 VanDerWaalsContact O-N 3.11Å; F171-I173 VanDerWaalsContact C-N 3.26Å; F171-I173 PolarHBondContact O-N 3.3Å; F171-P174 VanDerWaalsContact O-CD 3.23Å; F171-P174 WeakPolarHBondContact O-CD 3.46Å; F171-P174 WeakPolarHBondContact O-CG 3.48Å
172P92.8Very high94Very high26 Ų2674.5 Ų74.517%0.16937%0.371CS..THydrogen-bonded Turntrans-69.6-18.4177.1-24.136.1000115.1F168 G169 L175 W181 Q182F168-P172 WeakPolarHBondContact O-CD 3.34Å; G169-P172 WeakPolarHBondContact O-CD 3.42Å; P172-L175 PolarHBondContact O-N 2.94Å; P172-W181 HydrophobicContact CB-CH2 3.83Å; P172-W181 HydrophobicContact CB-CZ3 3.44Å; P172-W181 VanDerWaalsContact CB-CZ3 3.44Å; P172-W181 HydrophobicContact CG-CH2 4.46Å; P172-W181 HydrophobicContact CG-CZ3 3.97Å; P172-Q182 HydrophobicContact CB-CG 4.27Å; P172-Q182 PolarHBondContact O-NE2 3.29Å
173I91.8Very high93.7Very high60 Ų6078.6 Ų78.631%0.30840%0.396SS..SBendtrans-60.2-54.3-178.1-58.5174.4000111.2A170 F171 L175 D176 W184 S187A170-I173 WeakPolarHBondContact O-CB 3.49Å; A170-I173 PolarHBondContact O-N 2.95Å; F171-I173 VanDerWaalsContact C-N 3.26Å; F171-I173 PolarHBondContact O-N 3.3Å; I173-L175 PolarHBondContact O-N 3.45Å; I173-D176 PolarHBondContact O-N 3.46Å; I173-W184 HydrophobicContact CD1-CE3 3.84Å; I173-W184 HydrophobicContact CD1-CZ3 4.19Å; I173-S187 WeakPolarHBondContact CG1-OG 3.49Å
174P91Very high93.5Very high108 Ų10877.4 Ų77.470%0.70139%0.386SS*.THydrogen-bonded Turntrans-71.9-10.6178.829.6-38.9000114.7A170 F171A170-P174 VanDerWaalsContact O-CD 3.3Å; A170-P174 WeakPolarHBondContact O-CD 3.41Å; F171-P174 VanDerWaalsContact O-CD 3.23Å; F171-P174 WeakPolarHBondContact O-CD 3.46Å; F171-P174 WeakPolarHBondContact O-CG 3.48Å
175L89.6Confident93.5Very high96 Ų9673.9 Ų73.950%0.50337%0.368SS..THydrogen-bonded Turntrans-76.9-15.4176.2-66.8177.2000112.6P172 I173 W177P172-L175 PolarHBondContact O-N 2.94Å; I173-L175 PolarHBondContact O-N 3.45Å; L175-W177 HydrophobicContact CB-CZ2 4.48Å; L175-W177 HydrophobicContact CD1-CH2 4.16Å; L175-W177 HydrophobicContact CD1-CZ2 3.73Å; L175-W177 PolarHBondContact O-N 3Å
176D80.9Confident93.4Very high113 Ų11374 Ų7460%0.60437%0.366SS*.  trans41.763171.3-154.719.4000113.4I173 D178I173-D176 PolarHBondContact O-N 3.46Å; D176-D178 PolarHBondContact O-N 3.03Å
177W89.8Confident93.4Very high144 Ų14473.8 Ų73.855%0.54536%0.364SS..  trans-84.411.9177.8-62.5-27.9000111.7L175 R179 W181 Q182L175-W177 HydrophobicContact CB-CZ2 4.48Å; L175-W177 HydrophobicContact CD1-CH2 4.16Å; L175-W177 HydrophobicContact CD1-CZ2 3.73Å; L175-W177 PolarHBondContact O-N 3Å; W177-R179 HydrophobicContact CB-CG 4.08Å; W177-R179 WeakPolarHBondContact O-CD 3.19Å; W177-R179 VanDerWaalsContact O-CG 3.31Å; W177-R179 WeakPolarHBondContact O-CG 3.33Å; W177-R179 PolarHBondContact O-N 3.42Å; W177-R179 PolarHBondContact O-NE 3.36Å; W177-W181 AromaticContact CE3-CH2 3.38Å; W177-W181 HydrophobicContact CE3-CH2 3.38Å; W177-W181 AromaticContact CE3-CZ2 3.48Å; W177-W181 HydrophobicContact CE3-CZ2 3.48Å; W177-W181 VanDerWaalsContact CE3-CZ2 3.48Å; W177-W181 AromaticContact CZ3-CH2 3.51Å; W177-W181 HydrophobicContact CZ3-CH2 3.51Å; W177-W181 AromaticContact CZ3-CZ2 3.85Å; W177-W181 HydrophobicContact CZ3-CZ2 3.85Å; W177-Q182 VanDerWaalsContact C-OE1 3.25Å; W177-Q182 VanDerWaalsContact CA-OE1 3.23Å; W177-Q182 VanDerWaalsContact CB-OE1 3.28Å
178D89.4Confident93.4Very high138 Ų13868 Ų6874%0.73834%0.343SS*.  trans49.637.8-176.7-70.5-51.6000113.4D176D176-D178 PolarHBondContact O-N 3.03Å
179R94.8Very high93.5Very high151 Ų15162.7 Ų62.757%0.5732%0.319SS*.  trans-102.5143-179.2-58.9-48.9-176.6171.9-1.6112.4W177 W181 Q182W177-R179 HydrophobicContact CB-CG 4.08Å; W177-R179 WeakPolarHBondContact O-CD 3.19Å; W177-R179 VanDerWaalsContact O-CG 3.31Å; W177-R179 WeakPolarHBondContact O-CG 3.33Å; W177-R179 PolarHBondContact O-N 3.42Å; W177-R179 PolarHBondContact O-NE 3.36Å; R179-W181 HydrophobicContact CB-CD2 4.18Å; R179-W181 HydrophobicContact CB-CG 4.16Å; R179-W181 HydrophobicContact CB-CZ2 4.16Å; R179-W181 HydrophobicContact CG-CZ2 4.22Å; R179-W181 PolarHBondContact O-N 3.34Å; R179-Q182 HydrophobicContact CB-CG 4.47Å; R179-Q182 WeakPolarHBondContact O-CB 3.42Å; R179-Q182 PolarHBondContact O-N 3.06Å
180P93.6Very high93.5Very high83 Ų8364 Ų6454%0.53932%0.324SS..G310 helixtrans-60.9-22.3-178.924.2-34.9000113.4I186P180-I186 WeakPolarHBondContact O-CD1 3.44Å
181W93.6Very high93.7Very high82 Ų8263 Ų6331%0.31132%0.317SS..G310 helixtrans-81.1-11.217760.2-102.1000113.9L37 P172 W177 R179 I186 S187L37-W181 HydrophobicContact CD1-CB 4.41Å; L37-W181 HydrophobicContact CD2-CB 3.95Å; P172-W181 HydrophobicContact CB-CH2 3.83Å; P172-W181 HydrophobicContact CB-CZ3 3.44Å; P172-W181 VanDerWaalsContact CB-CZ3 3.44Å; P172-W181 HydrophobicContact CG-CH2 4.46Å; P172-W181 HydrophobicContact CG-CZ3 3.97Å; W177-W181 AromaticContact CE3-CH2 3.38Å; W177-W181 HydrophobicContact CE3-CH2 3.38Å; W177-W181 AromaticContact CE3-CZ2 3.48Å; W177-W181 HydrophobicContact CE3-CZ2 3.48Å; W177-W181 VanDerWaalsContact CE3-CZ2 3.48Å; W177-W181 AromaticContact CZ3-CH2 3.51Å; W177-W181 HydrophobicContact CZ3-CH2 3.51Å; W177-W181 AromaticContact CZ3-CZ2 3.85Å; W177-W181 HydrophobicContact CZ3-CZ2 3.85Å; R179-W181 HydrophobicContact CB-CD2 4.18Å; R179-W181 HydrophobicContact CB-CG 4.16Å; R179-W181 HydrophobicContact CB-CZ2 4.16Å; R179-W181 HydrophobicContact CG-CZ2 4.22Å; R179-W181 PolarHBondContact O-N 3.34Å; W181-I186 HydrophobicContact CB-CG2 4.49Å; W181-S187 WeakPolarHBondContact O-CA 3.41Å; W181-S187 WeakPolarHBondContact O-CB 3.44Å; W181-S187 PolarHBondContact O-N 3.38Å; W181-S187 VanDerWaalsContact O-N 3.16Å
182Q94.9Very high94Very high13 Ų1358.2 Ų58.26%0.06130%0.296CS..G310 helixtrans-84.5-15174.8-72172-58.100113.1P172 W177 R179 W184P172-Q182 HydrophobicContact CB-CG 4.27Å; P172-Q182 PolarHBondContact O-NE2 3.29Å; W177-Q182 VanDerWaalsContact C-OE1 3.25Å; W177-Q182 VanDerWaalsContact CA-OE1 3.23Å; W177-Q182 VanDerWaalsContact CB-OE1 3.28Å; R179-Q182 HydrophobicContact CB-CG 4.47Å; R179-Q182 WeakPolarHBondContact O-CB 3.42Å; R179-Q182 PolarHBondContact O-N 3.06Å; Q182-W184 PolarHBondContact O-N 3.3Å
183V93.2Very high94.2Very high86 Ų8657.3 Ų57.352%0.52129%0.29SS..SBendtrans-60.6136.7-179.8179.10000110I186V183-I186 HydrophobicContact CB-CD1 4.17Å; V183-I186 WeakPolarHBondContact O-CA 3.27Å; V183-I186 WeakPolarHBondContact O-CB 3.37Å; V183-I186 WeakPolarHBondContact O-CG1 3.44Å; V183-I186 PolarHBondContact O-N 2.93Å
184W94.8Very high94.6Very high50 Ų5061.1 Ų61.119%0.18931%0.305CS..THydrogen-bonded Turntrans-62.5134.2176.5179.8-101000111.4I98 A103 T112 F115 I173 Q182 C188I98-W184 HydrophobicContact CG2-CH2 3.33Å; I98-W184 HydrophobicContact CG2-CZ2 3.32Å; A103-W184 HydrophobicContact CB-CH2 3.82Å; A103-W184 HydrophobicContact CB-CZ2 3.38Å; T112-W184 HydrophobicContact CG2-CZ2 4.24Å; T112-W184 PolarHBondContact OG1-NE1 3.36Å; F115-W184 HydrophobicContact CD1-CH2 4.01Å; F115-W184 HydrophobicContact CD1-CZ2 4.07Å; F115-W184 HydrophobicContact CE1-CH2 4.06Å; I173-W184 HydrophobicContact CD1-CE3 3.84Å; I173-W184 HydrophobicContact CD1-CZ3 4.19Å; Q182-W184 PolarHBondContact O-N 3.3Å; W184-C188 HydrophobicContact CZ3-CB 4.29Å; W184-C188 VanDerWaalsContact CZ3-SG 3.6Å
185P96.6Very high94.9Very high2 Ų256.4 Ų56.41%0.01328%0.276CS..THydrogen-bonded Turncis-10222.4-0.139.3-29000112.5L44 E111 F115 S187 C188 S189L44-P185 HydrophobicContact CD1-CG 4.28Å; E111-P185 HydrophobicContact CB-CG 4.07Å; F115-P185 HydrophobicContact CB-CB 3.97Å; F115-P185 HydrophobicContact CB-CG 4.15Å; F115-P185 HydrophobicContact CD1-CB 4.22Å; F115-P185 HydrophobicContact CG-CB 4.15Å; P185-S187 PolarHBondContact O-N 3.01Å; P185-C188 PolarHBondContact O-N 3.35Å; P185-S189 WeakPolarHBondContact O-CB 3.46Å; P185-S189 PolarHBondContact O-N 3.08Å; P185-S189 PolarHBondContact O-OG 2.97Å
186I97.4Very high95.4Very high11 Ų1151.8 Ų51.86%0.05625%0.252CS..Hα-helixtrans-60.1-50.3-164.7-57.4-177.2000112.2L37 H40 P180 W181 V183 C188 S189 L190L37-I186 HydrophobicContact CD2-CG2 3.56Å; H40-I186 HydrophobicContact CB-CD1 4.11Å; H40-I186 HydrophobicContact CB-CG1 4.09Å; P180-I186 WeakPolarHBondContact O-CD1 3.44Å; W181-I186 HydrophobicContact CB-CG2 4.49Å; V183-I186 HydrophobicContact CB-CD1 4.17Å; V183-I186 WeakPolarHBondContact O-CA 3.27Å; V183-I186 WeakPolarHBondContact O-CB 3.37Å; V183-I186 WeakPolarHBondContact O-CG1 3.44Å; V183-I186 PolarHBondContact O-N 2.93Å; I186-C188 VanDerWaalsContact C-N 3.32Å; I186-C188 PolarHBondContact O-N 3.42Å; I186-S189 PolarHBondContact O-N 3.24Å; I186-S189 PolarHBondContact O-OG 2.87Å; I186-L190 HydrophobicContact CG2-CD1 3.78Å; I186-L190 HydrophobicContact CG2-CG 4.27Å; I186-L190 VanDerWaalsContact O-CB 3.32Å; I186-L190 WeakPolarHBondContact O-CB 3.27Å; I186-L190 WeakPolarHBondContact O-CG 3.16Å; I186-L190 PolarHBondContact O-N 3.31Å
187S97.1Very high96.2Very high7 Ų748 Ų485%0.04923%0.231CC..Hα-helixtrans-62.7-41.5-178.963.50000111.7G169 I173 W181 P185 G191G169-S187 WeakPolarHBondContact CA-O 3.44Å; G169-S187 CarbonylContact O-C 3.24Å; G169-S187 WeakPolarHBondContact O-CB 3.31Å; G169-S187 PolarHBondContact O-OG 3.01Å; I173-S187 WeakPolarHBondContact CG1-OG 3.49Å; W181-S187 WeakPolarHBondContact O-CA 3.41Å; W181-S187 WeakPolarHBondContact O-CB 3.44Å; W181-S187 PolarHBondContact O-N 3.38Å; W181-S187 VanDerWaalsContact O-N 3.16Å; P185-S187 PolarHBondContact O-N 3.01Å; S187-G191 PolarHBondContact O-N 2.78Å
188C97.9Very high96.6Very high3 Ų343 Ų432%0.0222%0.22CC..Hα-helixtrans-67.8-43.5178.6-65.80000112.4F115 A166 G169 A170 W184 P185 I186 G191 A192F115-C188 HydrophobicContact CE1-CB 3.73Å; F115-C188 HydrophobicContact CE2-CB 4.26Å; F115-C188 HydrophobicContact CZ-CB 3.58Å; A166-C188 WeakPolarHBondContact CA-O 3.5Å; G169-C188 VanDerWaalsContact C-SG 3.58Å; A170-C188 VanDerWaalsContact CA-SG 3.56Å; W184-C188 HydrophobicContact CZ3-CB 4.29Å; W184-C188 VanDerWaalsContact CZ3-SG 3.6Å; P185-C188 PolarHBondContact O-N 3.35Å; I186-C188 VanDerWaalsContact C-N 3.32Å; I186-C188 PolarHBondContact O-N 3.42Å; C188-G191 PolarHBondContact O-N 2.96Å; C188-A192 WeakPolarHBondContact O-CB 3.27Å; C188-A192 PolarHBondContact O-N 3.38Å
189S98.4Very high97Very high0 Ų036.4 Ų36.40%019%0.185CC..Hα-helixtrans-71-38.4-179.968.50000112.3H40 P185 I186 A192 T193H40-S189 PolarHBondContact CE1-OG 3.29Å; H40-S189 PolarHBondContact NE2-OG 2.81Å; P185-S189 WeakPolarHBondContact O-CB 3.46Å; P185-S189 PolarHBondContact O-N 3.08Å; P185-S189 PolarHBondContact O-OG 2.97Å; I186-S189 PolarHBondContact O-N 3.24Å; I186-S189 PolarHBondContact O-OG 2.87Å; S189-A192 PolarHBondContact O-N 3.09Å; S189-T193 WeakPolarHBondContact O-CB 3.23Å; S189-T193 PolarHBondContact O-N 2.93Å; S189-T193 PolarHBondContact O-OG1 2.69Å
190L98.4Very high97.2Very high36 Ų3629.5 Ų29.519%0.18816%0.159CC..Hα-helixtrans-63.9-45.3171-70.2177.6000110.3V36 L37 W43 I186 A192 T193 F194V36-L190 HydrophobicContact CG1-CD2 4.06Å; L37-L190 HydrophobicContact CD2-CD1 4.18Å; W43-L190 HydrophobicContact CH2-CD2 3.76Å; W43-L190 HydrophobicContact CZ2-CD2 4.46Å; W43-L190 HydrophobicContact CZ3-CD2 3.99Å; I186-L190 HydrophobicContact CG2-CD1 3.78Å; I186-L190 HydrophobicContact CG2-CG 4.27Å; I186-L190 VanDerWaalsContact O-CB 3.32Å; I186-L190 WeakPolarHBondContact O-CB 3.27Å; I186-L190 WeakPolarHBondContact O-CG 3.16Å; I186-L190 PolarHBondContact O-N 3.31Å; L190-A192 PolarHBondContact O-N 2.77Å; L190-T193 WeakPolarHBondContact O-CB 3.48Å; L190-T193 PolarHBondContact O-N 3.4Å; L190-T193 VanDerWaalsContact O-N 3.14Å; L190-F194 HydrophobicContact CB-CD2 4.47Å; L190-F194 HydrophobicContact CB-CE2 4.33Å; L190-F194 WeakPolarHBondContact O-CD2 3.5Å; L190-F194 PolarHBondContact O-N 2.93Å
191G98.5Very high97.4Very high13 Ų1329.3 Ų29.313%0.13415%0.153CC..Hα-helixtrans-55.9-47.3173.600000112.5G165 S187 C188 T193 F194 G195G165-G191 CarbonylContact C-O 3.6Å; G165-G191 VanDerWaalsContact C-O 3.31Å; G165-G191 WeakPolarHBondContact CA-O 3.35Å; G165-G191 CarbonylContact O-C 3.31Å; G165-G191 VanDerWaalsContact O-C 3.24Å; G165-G191 VanDerWaalsContact O-CA 3.26Å; G165-G191 WeakPolarHBondContact O-CA 3.49Å; S187-G191 PolarHBondContact O-N 2.78Å; C188-G191 PolarHBondContact O-N 2.96Å; G191-T193 VanDerWaalsContact C-N 3.29Å; G191-T193 PolarHBondContact O-N 3.48Å; G191-F194 PolarHBondContact O-N 3.32Å; G191-G195 PolarHBondContact O-N 3.43Å
192A98.8Very high97.6Very high0 Ų029.2 Ų29.20%016%0.158CC..Hα-helixtrans-59.4-41.2175.900000112F115 L119 F122 A166 C188 S189 L190 G195 Y196F115-A192 HydrophobicContact CE2-CB 4.04Å; L119-A192 HydrophobicContact CD2-CB 4.15Å; F122-A192 HydrophobicContact CD2-CB 4.48Å; A166-A192 HydrophobicContact CB-CB 3.83Å; C188-A192 WeakPolarHBondContact O-CB 3.27Å; C188-A192 PolarHBondContact O-N 3.38Å; S189-A192 PolarHBondContact O-N 3.09Å; L190-A192 PolarHBondContact O-N 2.77Å; A192-G195 PolarHBondContact O-N 3.38Å; A192-Y196 WeakPolarHBondContact O-CB 3.38Å; A192-Y196 PolarHBondContact O-N 2.91Å
193T98.7Very high97.6Very high7 Ų728.6 Ų28.64%0.04316%0.155CC..Hα-helixtrans-68-45.5-179.9-570000111.7V20 W43 F122 S189 L190 G191 Y196 M197V20-T193 HydrophobicContact CG1-CG2 3.42Å; V20-T193 VanDerWaalsContact CG1-CG2 3.42Å; W43-T193 HydrophobicContact CH2-CG2 4.18Å; W43-T193 WeakPolarHBondContact CH2-OG1 3.31Å; W43-T193 HydrophobicContact CZ2-CG2 4.23Å; F122-T193 HydrophobicContact CZ-CG2 4.38Å; S189-T193 WeakPolarHBondContact O-CB 3.23Å; S189-T193 PolarHBondContact O-N 2.93Å; S189-T193 PolarHBondContact O-OG1 2.69Å; L190-T193 WeakPolarHBondContact O-CB 3.48Å; L190-T193 PolarHBondContact O-N 3.4Å; L190-T193 VanDerWaalsContact O-N 3.14Å; G191-T193 VanDerWaalsContact C-N 3.29Å; G191-T193 PolarHBondContact O-N 3.48Å; T193-Y196 PolarHBondContact O-N 3.25Å; T193-M197 HydrophobicContact CG2-SD 4.35Å; T193-M197 WeakPolarHBondContact O-CG 3.22Å; T193-M197 PolarHBondContact O-N 3.32Å
194F98.5Very high97.7Very high140 Ų14024.8 Ų24.861%0.61413%0.132SC*.Hα-helixtrans-63.5-42.2173.5-74.7-58.8000111.7L190 G191 Y196 M197 A198L190-F194 HydrophobicContact CB-CD2 4.47Å; L190-F194 HydrophobicContact CB-CE2 4.33Å; L190-F194 WeakPolarHBondContact O-CD2 3.5Å; L190-F194 PolarHBondContact O-N 2.93Å; G191-F194 PolarHBondContact O-N 3.32Å; F194-Y196 PolarHBondContact O-N 2.95Å; F194-M197 PolarHBondContact O-N 3.42Å; F194-A198 VanDerWaalsContact O-CB 3.23Å; F194-A198 WeakPolarHBondContact O-CB 3.13Å; F194-A198 PolarHBondContact O-N 3.4Å
195G98.6Very high97.6Very high9 Ų927.8 Ų27.89%0.09315%0.151CC..Hα-helixtrans-58.4-45.7173.700000112.3C161 G191 A192 A198 G199C161-G195 WeakPolarHBondContact CB-O 3.43Å; C161-G195 VanDerWaalsContact O-CA 3.23Å; C161-G195 WeakPolarHBondContact O-CA 3.47Å; G191-G195 PolarHBondContact O-N 3.43Å; A192-G195 PolarHBondContact O-N 3.38Å; G195-A198 PolarHBondContact O-N 2.81Å; G195-G199 PolarHBondContact O-N 3.5Å
196Y98.7Very high97.5Very high0 Ų032.9 Ų32.90%017%0.17CC..Hα-helixtrans-59.8-51.7175.4176.1-110.3000111.9V20 I51 F122 Q126 T158 S162 A192 T193 F194 A198 G199 L200V20-Y196 HydrophobicContact CG2-CD1 4.17Å; V20-Y196 HydrophobicContact CG2-CE1 4.08Å; I51-Y196 HydrophobicContact CG2-CE1 4.21Å; F122-Y196 HydrophobicContact CB-CD2 3.67Å; F122-Y196 HydrophobicContact CB-CE2 4.23Å; F122-Y196 HydrophobicContact CB-CG 4.1Å; F122-Y196 AromaticContact CD1-CD1 3.7Å; F122-Y196 HydrophobicContact CD1-CD1 3.7Å; F122-Y196 AromaticContact CD1-CD2 3.77Å; F122-Y196 HydrophobicContact CD1-CD2 3.77Å; F122-Y196 AromaticContact CD1-CE1 3.88Å; F122-Y196 HydrophobicContact CD1-CE1 3.88Å; F122-Y196 AromaticContact CD1-CE2 3.97Å; F122-Y196 HydrophobicContact CD1-CE2 3.97Å; F122-Y196 AromaticContact CD1-CG 3.64Å; F122-Y196 HydrophobicContact CD1-CG 3.64Å; F122-Y196 HydrophobicContact CD2-CD2 4.45Å; F122-Y196 HydrophobicContact CD2-CG 4.01Å; F122-Y196 AromaticContact CE1-CD1 3.64Å; F122-Y196 HydrophobicContact CE1-CD1 3.64Å; F122-Y196 AromaticContact CE1-CE1 3.88Å; F122-Y196 HydrophobicContact CE1-CE1 3.88Å; F122-Y196 AromaticContact CE1-CG 4Å; F122-Y196 HydrophobicContact CE1-CG 4Å; F122-Y196 HydrophobicContact CE2-CD1 4.48Å; F122-Y196 HydrophobicContact CE2-CG 4.34Å; F122-Y196 HydrophobicContact CG-CD1 4.17Å; F122-Y196 AromaticContact CG-CD2 3.72Å; F122-Y196 HydrophobicContact CG-CD2 3.72Å; F122-Y196 HydrophobicContact CG-CE2 4.31Å; F122-Y196 AromaticContact CG-CG 3.65Å; F122-Y196 HydrophobicContact CG-CG 3.65Å; F122-Y196 HydrophobicContact CZ-CD1 4.05Å; F122-Y196 HydrophobicContact CZ-CG 4.33Å; Q126-Y196 PolarHBondContact NE2-OH 2.96Å; T158-Y196 HydrophobicContact CG2-CD2 3.37Å; T158-Y196 HydrophobicContact CG2-CE2 3.49Å; T158-Y196 VanDerWaalsContact CG2-CE2 3.49Å; T158-Y196 HydrophobicContact CG2-CG 4.44Å; S162-Y196 VanDerWaalsContact OG-CA 3.32Å; S162-Y196 WeakPolarHBondContact OG-CA 3.35Å; S162-Y196 WeakPolarHBondContact OG-CB 3.46Å; A192-Y196 WeakPolarHBondContact O-CB 3.38Å; A192-Y196 PolarHBondContact O-N 2.91Å; T193-Y196 PolarHBondContact O-N 3.25Å; F194-Y196 PolarHBondContact O-N 2.95Å; Y196-A198 PolarHBondContact O-N 2.94Å; Y196-G199 PolarHBondContact O-N 2.96Å; Y196-L200 HydrophobicContact CD1-CD1 3.96Å; Y196-L200 HydrophobicContact CE1-CD1 3.47Å; Y196-L200 VanDerWaalsContact CE1-CD1 3.47Å; Y196-L200 HydrophobicContact CE1-CG 4.35Å; Y196-L200 HydrophobicContact CE2-CD1 4.19Å; Y196-L200 HydrophobicContact CE2-CD2 4.32Å; Y196-L200 HydrophobicContact CE2-CG 4.25Å; Y196-L200 WeakPolarHBondContact O-CG 3.49Å; Y196-L200 PolarHBondContact O-N 2.75Å
197M98.6Very high97.3Very high32 Ų3232.4 Ų32.416%0.15817%0.168CC..Hα-helixtrans-60.6-43.1177.9-69171.973.300112.3V17 V20 I21 T193 F194 L200 I201V17-M197 HydrophobicContact CG1-CE 3.79Å; V17-M197 HydrophobicContact CG2-CB 4.49Å; V20-M197 HydrophobicContact CB-CG 4.26Å; V20-M197 HydrophobicContact CB-SD 4.13Å; V20-M197 HydrophobicContact CG1-CG 4.14Å; V20-M197 HydrophobicContact CG1-SD 3.58Å; V20-M197 VanDerWaalsContact CG1-SD 3.58Å; V20-M197 HydrophobicContact CG2-CG 4.3Å; I21-M197 HydrophobicContact CD1-CE 4.13Å; I21-M197 HydrophobicContact CG1-CE 3.85Å; T193-M197 HydrophobicContact CG2-SD 4.35Å; T193-M197 WeakPolarHBondContact O-CG 3.22Å; T193-M197 PolarHBondContact O-N 3.32Å; F194-M197 PolarHBondContact O-N 3.42Å; M197-L200 PolarHBondContact O-N 3.15Å; M197-I201 WeakPolarHBondContact O-CG1 3.24Å; M197-I201 PolarHBondContact O-N 3.29Å
198A98.4Very high97Very high40 Ų4036 Ų3633%0.33118%0.184SC..Hα-helixtrans-61.7-45.5175.900000110.9F194 G195 Y196 L200 I201 I202F194-A198 VanDerWaalsContact O-CB 3.23Å; F194-A198 WeakPolarHBondContact O-CB 3.13Å; F194-A198 PolarHBondContact O-N 3.4Å; G195-A198 PolarHBondContact O-N 2.81Å; Y196-A198 PolarHBondContact O-N 2.94Å; A198-L200 VanDerWaalsContact C-N 3.33Å; A198-L200 PolarHBondContact O-N 3.43Å; A198-I201 PolarHBondContact O-N 3.02Å; A198-I201 VanDerWaalsContact O-N 3.12Å; A198-I202 HydrophobicContact CB-CD1 4.2Å; A198-I202 WeakPolarHBondContact O-CB 3.31Å; A198-I202 WeakPolarHBondContact O-CD1 3.22Å; A198-I202 WeakPolarHBondContact O-CG1 3.3Å; A198-I202 PolarHBondContact O-N 2.89Å
199G98.3Very high96.6Very high0 Ų046.4 Ų46.40%022%0.222CC..Hα-helixtrans-58.6-42.5176.100000112.9G195 Y196 I201 I202 A203G195-G199 PolarHBondContact O-N 3.5Å; Y196-G199 PolarHBondContact O-N 2.96Å; G199-I201 VanDerWaalsContact C-N 3.26Å; G199-I201 PolarHBondContact O-N 3.45Å; G199-I202 PolarHBondContact O-N 2.9Å; G199-A203 WeakPolarHBondContact O-CB 3.41Å; G199-A203 PolarHBondContact O-N 2.85Å
200L98.1Very high96.2Very high5 Ų547.7 Ų47.73%0.02623%0.23CC..Hα-helixtrans-61.3-31.6175.9-71.9175.9000113.2N13 C16 V17 T158 Y196 M197 A198 P204N13-L200 HydrophobicContact CB-CB 4.08Å; N13-L200 HydrophobicContact CB-CD2 4.09Å; N13-L200 WeakPolarHBondContact CB-O 3.24Å; N13-L200 PolarHBondContact ND2-O 2.81Å; C16-L200 HydrophobicContact CB-CD1 3.51Å; C16-L200 HydrophobicContact CB-CD2 4.47Å; V17-L200 HydrophobicContact CG2-CB 3.89Å; V17-L200 HydrophobicContact CG2-CD1 3.84Å; T158-L200 HydrophobicContact CG2-CD2 4.01Å; T158-L200 HydrophobicContact CG2-CG 4.15Å; Y196-L200 HydrophobicContact CD1-CD1 3.96Å; Y196-L200 HydrophobicContact CE1-CD1 3.47Å; Y196-L200 VanDerWaalsContact CE1-CD1 3.47Å; Y196-L200 HydrophobicContact CE1-CG 4.35Å; Y196-L200 HydrophobicContact CE2-CD1 4.19Å; Y196-L200 HydrophobicContact CE2-CD2 4.32Å; Y196-L200 HydrophobicContact CE2-CG 4.25Å; Y196-L200 WeakPolarHBondContact O-CG 3.49Å; Y196-L200 PolarHBondContact O-N 2.75Å; M197-L200 PolarHBondContact O-N 3.15Å; A198-L200 VanDerWaalsContact C-N 3.33Å; A198-L200 PolarHBondContact O-N 3.43Å; L200-P204 WeakPolarHBondContact O-CD 3.43Å; L200-P204 WeakPolarHBondContact O-CG 3.47Å
201I97.7Very high95.4Very high80 Ų8050.8 Ų50.841%0.4124%0.239SC..Hα-helixtrans-85.9-44.5178.3-64.1167.1000111V17 M197 A198 G199 A203 P204 L205V17-I201 HydrophobicContact CG2-CD1 4.47Å; V17-I201 HydrophobicContact CG2-CG1 4.2Å; M197-I201 WeakPolarHBondContact O-CG1 3.24Å; M197-I201 PolarHBondContact O-N 3.29Å; A198-I201 PolarHBondContact O-N 3.02Å; A198-I201 VanDerWaalsContact O-N 3.12Å; G199-I201 VanDerWaalsContact C-N 3.26Å; G199-I201 PolarHBondContact O-N 3.45Å; I201-A203 PolarHBondContact O-N 3.31Å; I201-P204 VanDerWaalsContact O-CD 3.29Å; I201-P204 WeakPolarHBondContact O-CD 3.47Å; I201-P204 WeakPolarHBondContact O-CG 3.07Å; I201-L205 HydrophobicContact CG2-CD1 3.99Å; I201-L205 WeakPolarHBondContact O-CG 3.15Å
202I97.1Very high94.5Very high80 Ų8058.6 Ų58.641%0.4127%0.269SS..Hα-helixtrans-64.8-41.7-178.4-69.3165.7000110.6I157 A198 G199 L205 W206I157-I202 HydrophobicContact CG2-CB 4.38Å; I157-I202 HydrophobicContact CG2-CG2 4.1Å; A198-I202 HydrophobicContact CB-CD1 4.2Å; A198-I202 WeakPolarHBondContact O-CB 3.31Å; A198-I202 WeakPolarHBondContact O-CD1 3.22Å; A198-I202 WeakPolarHBondContact O-CG1 3.3Å; A198-I202 PolarHBondContact O-N 2.89Å; G199-I202 PolarHBondContact O-N 2.9Å; I202-L205 PolarHBondContact O-N 3.5Å; I202-W206 VanDerWaalsContact O-CB 3.29Å; I202-W206 WeakPolarHBondContact O-CB 3.26Å; I202-W206 PolarHBondContact O-N 2.9Å
203A95.9Very high93.4Very high0 Ų065 Ų650%030%0.299CS..Hα-helixtrans-52.7-58.8-17800000113.9S154 I157 G199 I201 L205 W206 I207S154-A203 WeakPolarHBondContact OG-CB 3.35Å; I157-A203 HydrophobicContact CB-CB 4.12Å; I157-A203 HydrophobicContact CD1-CB 4.18Å; I157-A203 HydrophobicContact CG2-CB 4.02Å; G199-A203 WeakPolarHBondContact O-CB 3.41Å; G199-A203 PolarHBondContact O-N 2.85Å; I201-A203 PolarHBondContact O-N 3.31Å; A203-L205 VanDerWaalsContact C-N 3.32Å; A203-L205 PolarHBondContact O-N 3.47Å; A203-W206 PolarHBondContact O-N 3.09Å; A203-I207 WeakPolarHBondContact O-CB 3.45Å; A203-I207 WeakPolarHBondContact O-CD1 3.34Å; A203-I207 WeakPolarHBondContact O-CG1 3.46Å; A203-I207 PolarHBondContact O-N 3.49Å
204P94.1Very high92.2Very high5 Ų565.7 Ų65.73%0.03230%0.302CS..Hα-helixtrans-64.8-33.9-179.624.6-33.9000112.6L10 L200 I201 H208L10-P204 HydrophobicContact CB-CB 4.23Å; L10-P204 HydrophobicContact CD1-CB 3.98Å; L10-P204 HydrophobicContact CD1-CG 3.73Å; L200-P204 WeakPolarHBondContact O-CD 3.43Å; L200-P204 WeakPolarHBondContact O-CG 3.47Å; I201-P204 VanDerWaalsContact O-CD 3.29Å; I201-P204 WeakPolarHBondContact O-CD 3.47Å; I201-P204 WeakPolarHBondContact O-CG 3.07Å; P204-H208 VanDerWaalsContact O-CB 3.25Å; P204-H208 WeakPolarHBondContact O-CB 3.43Å; P204-H208 PolarHBondContact O-N 3.35Å
205L93.9Very high90.7Very high113 Ų11361.7 Ų61.759%0.59229%0.289SS*.Hα-helixtrans-65.1-47.6175.5-66.8173.6000111.5I201 I202 A203 I207 H208 W209I201-L205 HydrophobicContact CG2-CD1 3.99Å; I201-L205 WeakPolarHBondContact O-CG 3.15Å; I202-L205 PolarHBondContact O-N 3.5Å; A203-L205 VanDerWaalsContact C-N 3.32Å; A203-L205 PolarHBondContact O-N 3.47Å; L205-I207 PolarHBondContact O-N 3.04Å; L205-H208 PolarHBondContact O-N 2.94Å; L205-W209 WeakPolarHBondContact O-CB 3.33Å; L205-W209 PolarHBondContact O-N 3.03Å
206W94.4Very high88.8Confident110 Ų11070.4 Ų70.442%0.41732%0.321SS..Hα-helixtrans-63.2-42.3177.6-176.191.6000111.4N153 I157 I202 A203 W209 N210 L214N153-W206 HydrophobicContact CB-CZ3 4.24Å; N153-W206 WeakPolarHBondContact OD1-CZ3 3.43Å; I157-W206 HydrophobicContact CD1-CB 4.25Å; I157-W206 HydrophobicContact CD1-CD2 4.08Å; I157-W206 HydrophobicContact CD1-CE3 3.86Å; I157-W206 HydrophobicContact CD1-CG 4.26Å; I202-W206 VanDerWaalsContact O-CB 3.29Å; I202-W206 WeakPolarHBondContact O-CB 3.26Å; I202-W206 PolarHBondContact O-N 2.9Å; A203-W206 PolarHBondContact O-N 3.09Å; W206-W209 PolarHBondContact O-N 2.92Å; W206-N210 VanDerWaalsContact CE2-ND2 3.28Å; W206-N210 PolarHBondContact NE1-ND2 3.44Å; W206-N210 WeakPolarHBondContact O-CB 3.34Å; W206-N210 PolarHBondContact O-N 3.48Å; W206-N210 PolarHBondContact O-ND2 3.09Å; W206-L214 HydrophobicContact CZ3-CD1 4.23Å; W206-L214 HydrophobicContact CZ3-CD2 4.39Å
207I92.8Very high87Confident1 Ų175.2 Ų75.21%0.00534%0.341CS..Hα-helixtrans-64.1-43.3176.5-69.7165.6000110.8I6 L9 I150 N153 A203 L205 N210 R211 L214I6-I207 HydrophobicContact CD1-CG2 4.28Å; I6-I207 HydrophobicContact CG1-CG2 4.15Å; L9-I207 HydrophobicContact CD2-CD1 3.69Å; I150-I207 HydrophobicContact CG1-CG2 4.04Å; I150-I207 HydrophobicContact CG2-CD1 4.09Å; I150-I207 HydrophobicContact CG2-CG2 4.19Å; I150-I207 WeakPolarHBondContact O-CD1 3.4Å; N153-I207 HydrophobicContact CB-CD1 4.09Å; N153-I207 HydrophobicContact CB-CG1 4.18Å; A203-I207 WeakPolarHBondContact O-CB 3.45Å; A203-I207 WeakPolarHBondContact O-CD1 3.34Å; A203-I207 WeakPolarHBondContact O-CG1 3.46Å; A203-I207 PolarHBondContact O-N 3.49Å; L205-I207 PolarHBondContact O-N 3.04Å; I207-N210 CarbonylContact O-C 3.49Å; I207-N210 PolarHBondContact O-N 3.26Å; I207-R211 WeakPolarHBondContact O-CA 3.43Å; I207-R211 PolarHBondContact O-N 3.39Å; I207-L214 HydrophobicContact CB-CD1 4.34Å; I207-L214 HydrophobicContact CG1-CD1 4.34Å; I207-L214 HydrophobicContact CG2-CD1 3.98Å
208H90.8Very high85.1Confident83 Ų8376.7 Ų76.738%0.38436%0.355SS..Hα-helixtrans-61.6-45.3177.4-175.780.2000111.4P204 L205 R211P204-H208 VanDerWaalsContact O-CB 3.25Å; P204-H208 WeakPolarHBondContact O-CB 3.43Å; P204-H208 PolarHBondContact O-N 3.35Å; L205-H208 PolarHBondContact O-N 2.94Å; H208-R211 PolarHBondContact CE1-NH1 2.84Å; H208-R211 WeakPolarHBondContact O-CB 3.42Å; H208-R211 WeakPolarHBondContact O-CD 3.43Å; H208-R211 VanDerWaalsContact O-CG 3.29Å; H208-R211 WeakPolarHBondContact O-CG 3.3Å
209W90.6Very high82.9Confident220 Ų22087.8 Ų87.883%0.83339%0.388SS*.Hα-helixtrans-62.4-43.6177.3-169.5-90.1000112.2L205 W206L205-W209 WeakPolarHBondContact O-CB 3.33Å; L205-W209 PolarHBondContact O-N 3.03Å; W206-W209 PolarHBondContact O-N 2.92Å
210N88.7Confident82.1Confident28 Ų2892.2 Ų92.215%0.1541%0.408CS..THydrogen-bonded Turntrans-93.511.5-175-64.9-71.3000114.4W206 I207 K212 Q213 L214W206-N210 VanDerWaalsContact CE2-ND2 3.28Å; W206-N210 PolarHBondContact NE1-ND2 3.44Å; W206-N210 WeakPolarHBondContact O-CB 3.34Å; W206-N210 PolarHBondContact O-N 3.48Å; W206-N210 PolarHBondContact O-ND2 3.09Å; I207-N210 CarbonylContact O-C 3.49Å; I207-N210 PolarHBondContact O-N 3.26Å; N210-K212 PolarHBondContact O-N 3.41Å; N210-Q213 PolarHBondContact O-N 3.17Å; N210-L214 PolarHBondContact O-N 3.15Å; N210-L214 VanDerWaalsContact O-N 3.15Å
211R82.4Confident81.3Confident100 Ų10096.7 Ų96.738%0.37743%0.428SS..Hα-helixtrans-53.9-32.8-172.868.2-175.6174-162.9-13.1114.7E3 I207 H208 T215E3-R211 IonicContact OE1-CZ 3.82Å; E3-R211 IonicContact OE1-NH1 2.82Å; E3-R211 PolarHBondContact OE1-NH1 3.33Å; I207-R211 WeakPolarHBondContact O-CA 3.43Å; I207-R211 PolarHBondContact O-N 3.39Å; H208-R211 PolarHBondContact CE1-NH1 2.84Å; H208-R211 WeakPolarHBondContact O-CB 3.42Å; H208-R211 WeakPolarHBondContact O-CD 3.43Å; H208-R211 VanDerWaalsContact O-CG 3.29Å; H208-R211 WeakPolarHBondContact O-CG 3.3Å; R211-T215 WeakPolarHBondContact O-CB 3.47Å; R211-T215 PolarHBondContact O-N 3.04Å; R211-T215 PolarHBondContact O-OG1 3.47Å
212K79.3Confident80.4Confident178 Ų17897.7 Ų97.777%0.77443%0.429SS*.Hα-helixtrans-66-44.5179.7-67.8-174.3179.8-179.50111.3N210 T215 Y216N210-K212 PolarHBondContact O-N 3.41Å; K212-T215 PolarHBondContact O-N 2.96Å; K212-Y216 PolarHBondContact O-N 3.04Å
213Q75.9Confident79.4Confident135 Ų13598.7 Ų98.763%0.63143%0.43SS*.Hα-helixtrans-71.4-40.1179-63.6-179.72.200111.8N210 T215 Y216 K217N210-Q213 PolarHBondContact O-N 3.17Å; Q213-T215 PolarHBondContact O-N 2.95Å; Q213-Y216 WeakPolarHBondContact O-CB 3.31Å; Q213-Y216 PolarHBondContact O-N 3.29Å; Q213-Y216 VanDerWaalsContact O-N 3.15Å; Q213-K217 PolarHBondContact O-N 3.33Å
214L74.2Confident78.3Confident21 Ų21104.9 Ų104.911%0.1146%0.457CS..Hα-helixtrans-64.5-23.3175.2-65.4173.1000112.4W206 I207 N210W206-L214 HydrophobicContact CZ3-CD1 4.23Å; W206-L214 HydrophobicContact CZ3-CD2 4.39Å; I207-L214 HydrophobicContact CB-CD1 4.34Å; I207-L214 HydrophobicContact CG1-CD1 4.34Å; I207-L214 HydrophobicContact CG2-CD1 3.98Å; N210-L214 PolarHBondContact O-N 3.15Å; N210-L214 VanDerWaalsContact O-N 3.15Å
215T65.5Low77.3Confident55 Ų55111.5 Ų111.534%0.33749%0.485SS..Hα-helixtrans-75.2-31.2175.1-58.40000113.5K2 R211 K212 Q213K2-T215 VanDerWaalsContact NZ-CA 3.34Å; K2-T215 PolarHBondContact NZ-OG1 2.88Å; R211-T215 WeakPolarHBondContact O-CB 3.47Å; R211-T215 PolarHBondContact O-N 3.04Å; R211-T215 PolarHBondContact O-OG1 3.47Å; K212-T215 PolarHBondContact O-N 2.96Å; Q213-T215 PolarHBondContact O-N 2.95Å
216Y60Low76.1Confident193 Ų193111.4 Ų111.476%0.75748%0.477SS*.Hα-helixtrans-70.4-42.3174.3-176.7-99.3000112K212 Q213 S218 R219K212-Y216 PolarHBondContact O-N 3.04Å; Q213-Y216 WeakPolarHBondContact O-CB 3.31Å; Q213-Y216 PolarHBondContact O-N 3.29Å; Q213-Y216 VanDerWaalsContact O-N 3.15Å; Y216-S218 VanDerWaalsContact C-N 3.27Å; Y216-S218 PolarHBondContact O-N 3.18Å; Y216-R219 PolarHBondContact O-N 3.08Å
217K60.9Low74.7Confident100 Ų100111.5 Ų111.544%0.43548%0.482SS..Hα-helixtrans-69.3-16.6-179.9-73.4-174.8173.9-1770115.2N145 Q213N145-K217 PolarHBondContact OD1-NZ 3.15Å; Q213-K217 PolarHBondContact O-N 3.33Å
218S57.8Low73.2Confident64 Ų64120.8 Ų120.845%0.44852%0.522SS..THydrogen-bonded Turntrans-99.63-178101.80000113.9K2 Y216K2-S218 PolarHBondContact NZ-OG 3.4Å; Y216-S218 VanDerWaalsContact C-N 3.27Å; Y216-S218 PolarHBondContact O-N 3.18Å
219R52.3Low71.6Confident272 Ų272124.2 Ų124.2100%1.02653%0.534SS*.  trans-93.40168.7-76.9-174.8176-177.1-1.4108.6Y216Y216-R219 PolarHBondContact O-N 3.08Å

Retrieved 219 of 219 residues in 88.4 ms (Link to these results)

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