A0A096MWS2_PAPAN Loading...

Bcl-2-like protein 15

AlphaFold DB , UniProt , Accession A0A096MWS2, Species PAPAN (Papio anubis, Olive baboon), Gene BCL2L15, Length 163 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
1M40.9Very low77Confident244 Ų24494.5 Ų94.5100%1.20249%0.488SS*.  01270-70.6166.9173.300106.7
2K46.2Very low78.4Confident209 Ų20995.4 Ų95.491%0.90949%0.489SS*.PPolyproline II helixtrans-65.5138.2171.3-75.6178.9176.2178.40107.5
3S55.3Low79.5Confident96 Ų9691.8 Ų91.867%0.67148%0.476SS*.PPolyproline II helixtrans-56.3141.8171.342.40000109.5Q5S3-Q5 PolarHBondContact O-N 3.22Å
4P65.1Low80.6Confident121 Ų12185.4 Ų85.479%0.78644%0.443SS*.PPolyproline II helixtrans-57.5134.2170.623.5-30.4000108.7
5Q80.9Confident81.4Confident88 Ų8879.9 Ų79.941%0.41142%0.415SS..PPolyproline II helixtrans-61.9139.7179.8-70.9178-57.400110.2S3 E9 K10 F48S3-Q5 PolarHBondContact O-N 3.22Å; Q5-E9 VanDerWaalsContact CA-OE2 3.24Å; Q5-E9 WeakPolarHBondContact CA-OE2 3.37Å; Q5-E9 HydrophobicContact CB-CB 4.32Å; Q5-K10 HydrophobicContact CB-CG 3.94Å; Q5-F48 VanDerWaalsContact OE1-CD1 3.29Å
6T91.5Very high82.1Confident63 Ų6378.9 Ų78.939%0.38741%0.41SS..PPolyproline II helixtrans-70.1166.1174.868.50000110.9E8 E9 K10T6-E8 WeakPolarHBondContact CB-OE2 3.35Å; T6-E8 PolarHBondContact O-N 2.61Å; T6-E8 PolarHBondContact OG1-OE2 2.94Å; T6-E9 PolarHBondContact N-OE2 2.99Å; T6-E9 PolarHBondContact O-N 2.85Å; T6-E9 WeakPolarHBondContact OG1-CB 3.4Å; T6-E9 VanDerWaalsContact OG1-CG 3.25Å; T6-E9 WeakPolarHBondContact OG1-CG 3.43Å; T6-E9 PolarHBondContact OG1-N 3.5Å; T6-E9 VanDerWaalsContact OG1-N 3.13Å; T6-K10 WeakPolarHBondContact O-CB 3.3Å; T6-K10 WeakPolarHBondContact O-CG 3.34Å; T6-K10 PolarHBondContact O-N 3.15Å
7F92.1Very high82.6Confident24 Ų2475.9 Ų75.911%0.10540%0.399CS..Hα-helixtrans-58.1-41.8173.8177.5-91.1000110.6K10 T11 N143 R149 I152 W158F7-K10 PolarHBondContact O-N 3.15Å; F7-T11 WeakPolarHBondContact CE1-OG1 3.34Å; F7-T11 WeakPolarHBondContact O-CB 3.5Å; F7-T11 PolarHBondContact O-N 3.08Å; F7-T11 PolarHBondContact O-OG1 3.45Å; F7-N143 WeakPolarHBondContact CD1-OD1 3.47Å; F7-N143 WeakPolarHBondContact CE1-OD1 3.28Å; F7-R149 HydrophobicContact CD1-CG 4.37Å; F7-R149 HydrophobicContact CD2-CG 4.32Å; F7-R149 HydrophobicContact CE1-CB 4.32Å; F7-R149 HydrophobicContact CE1-CG 4.25Å; F7-R149 HydrophobicContact CE2-CG 4.2Å; F7-R149 HydrophobicContact CG-CG 4.4Å; F7-R149 HydrophobicContact CZ-CB 4.14Å; F7-R149 HydrophobicContact CZ-CG 4.17Å; F7-I152 HydrophobicContact CE2-CB 4.12Å; F7-I152 HydrophobicContact CE2-CD1 3.96Å; F7-I152 HydrophobicContact CE2-CG2 3.96Å; F7-I152 HydrophobicContact CZ-CD1 3.9Å; F7-W158 AromaticContact CD2-NE1 3.63Å; F7-W158 AromaticContact CE2-CD1 3.97Å; F7-W158 AromaticContact CE2-CE2 3.87Å; F7-W158 HydrophobicContact CE2-CZ2 4.26Å; F7-W158 AromaticContact CE2-NE1 3.3Å; F7-W158 VanDerWaalsContact CE2-NE1 3.3Å; F7-W158 AromaticContact CZ-CZ2 3.96Å; F7-W158 HydrophobicContact CZ-CZ2 3.96Å; F7-W158 AromaticContact CZ-NE1 3.71Å
8E94.6Very high83.2Confident74 Ų7471.9 Ų71.935%0.34638%0.378SS..Hα-helixtrans-63.8-45.8-178.8-64.175.6-169.600111.9T6 K10 T11 E12 N143 R149T6-E8 WeakPolarHBondContact CB-OE2 3.35Å; T6-E8 PolarHBondContact O-N 2.61Å; T6-E8 PolarHBondContact OG1-OE2 2.94Å; E8-K10 VanDerWaalsContact C-N 3.35Å; E8-T11 PolarHBondContact O-N 3.1Å; E8-E12 WeakPolarHBondContact O-CB 3.44Å; E8-E12 PolarHBondContact O-N 3.47Å; E8-N143 HydrophobicContact CG-CB 4.4Å; E8-R149 IonicContact OE1-CZ 3.9Å; E8-R149 IonicContact OE1-NH1 2.77Å; E8-R149 PolarHBondContact OE1-NH1 3.38Å; E8-R149 IonicContact OE1-NH2 2.95Å; E8-R149 PolarHBondContact OE1-NH2 3.47Å; E8-R149 IonicContact OE2-NH1 2.64Å
9E92.1Very high83.6Confident86 Ų8668.6 Ų68.640%0.40236%0.361SS..Hα-helixtrans-63.7-40.6176.6-72.4170.1161.800111.4Q5 T6 C13Q5-E9 VanDerWaalsContact CA-OE2 3.24Å; Q5-E9 WeakPolarHBondContact CA-OE2 3.37Å; Q5-E9 HydrophobicContact CB-CB 4.32Å; T6-E9 PolarHBondContact N-OE2 2.99Å; T6-E9 PolarHBondContact O-N 2.85Å; T6-E9 WeakPolarHBondContact OG1-CB 3.4Å; T6-E9 VanDerWaalsContact OG1-CG 3.25Å; T6-E9 WeakPolarHBondContact OG1-CG 3.43Å; T6-E9 PolarHBondContact OG1-N 3.5Å; T6-E9 VanDerWaalsContact OG1-N 3.13Å; E9-C13 WeakPolarHBondContact O-CB 3.26Å; E9-C13 PolarHBondContact O-N 2.63Å; E9-C13 PolarHBondContact O-SG 3.49Å
10K93.4Very high83.9Confident33 Ų3371.3 Ų71.314%0.14337%0.373CS..Hα-helixtrans-63.2-47.9174.8-74.7-176.1173.3-171.60111.1Q5 T6 F7 E8 E12 C13 I14 F48 E159Q5-K10 HydrophobicContact CB-CG 3.94Å; T6-K10 WeakPolarHBondContact O-CB 3.3Å; T6-K10 WeakPolarHBondContact O-CG 3.34Å; T6-K10 PolarHBondContact O-N 3.15Å; F7-K10 PolarHBondContact O-N 3.15Å; E8-K10 VanDerWaalsContact C-N 3.35Å; K10-E12 PolarHBondContact O-N 3.44Å; K10-C13 PolarHBondContact O-N 3.35Å; K10-I14 WeakPolarHBondContact O-CD1 3.2Å; K10-I14 VanDerWaalsContact O-CG1 3.28Å; K10-I14 WeakPolarHBondContact O-CG1 3.12Å; K10-I14 PolarHBondContact O-N 3.29Å; K10-F48 HydrophobicContact CB-CD2 4.48Å; K10-F48 HydrophobicContact CB-CE2 3.64Å; K10-F48 HydrophobicContact CB-CZ 3.7Å; K10-F48 HydrophobicContact CD-CD2 3.8Å; K10-F48 HydrophobicContact CD-CE2 3.8Å; K10-F48 HydrophobicContact CD-CG 4.45Å; K10-F48 HydrophobicContact CD-CZ 4.45Å; K10-F48 HydrophobicContact CG-CD2 3.94Å; K10-F48 HydrophobicContact CG-CE1 4.2Å; K10-F48 HydrophobicContact CG-CE2 3.57Å; K10-F48 HydrophobicContact CG-CG 4.41Å; K10-F48 HydrophobicContact CG-CZ 3.72Å; K10-E159 VanDerWaalsContact NZ-CD 3.32Å; K10-E159 IonicContact NZ-OE1 3.04Å; K10-E159 PolarHBondContact NZ-OE1 3.36Å; K10-E159 IonicContact NZ-OE2 2.63Å; K10-E159 PolarHBondContact NZ-OE2 3.2Å
11T95Very high84.1Confident1 Ų170.1 Ų70.11%0.00637%0.367CS..Hα-helixtrans-58.4-47.5178.1-57.30000111.2F7 E8 C13 I14 V15 T139 I142 N143 W158F7-T11 WeakPolarHBondContact CE1-OG1 3.34Å; F7-T11 WeakPolarHBondContact O-CB 3.5Å; F7-T11 PolarHBondContact O-N 3.08Å; F7-T11 PolarHBondContact O-OG1 3.45Å; E8-T11 PolarHBondContact O-N 3.1Å; T11-C13 PolarHBondContact O-N 3.03Å; T11-I14 PolarHBondContact O-N 3.35Å; T11-V15 HydrophobicContact CG2-CG2 4.39Å; T11-V15 WeakPolarHBondContact O-CG2 3.35Å; T11-V15 PolarHBondContact O-N 3.44Å; T11-T139 HydrophobicContact CG2-CG2 4.21Å; T11-I142 HydrophobicContact CG2-CB 3.9Å; T11-I142 HydrophobicContact CG2-CD1 4.36Å; T11-I142 HydrophobicContact CG2-CG2 3.61Å; T11-N143 WeakPolarHBondContact CB-OD1 3.44Å; T11-N143 WeakPolarHBondContact CG2-OD1 3.28Å; T11-N143 PolarHBondContact OG1-OD1 2.89Å; T11-W158 HydrophobicContact CG2-CZ2 4.06Å; T11-W158 WeakPolarHBondContact OG1-CZ2 3.31Å; T11-W158 PolarHBondContact OG1-NE1 3.2Å; T11-W158 VanDerWaalsContact OG1-NE1 3.15Å
12E93.7Very high86.4Confident106 Ų10659.1 Ų59.150%0.49531%0.313SS..Hα-helixtrans-60.2-44.8178.1-179.2177.2-169.600111.6E8 K10 I14 V15 N16 T139E8-E12 WeakPolarHBondContact O-CB 3.44Å; E8-E12 PolarHBondContact O-N 3.47Å; K10-E12 PolarHBondContact O-N 3.44Å; E12-I14 VanDerWaalsContact C-N 3.33Å; E12-I14 PolarHBondContact O-N 2.93Å; E12-V15 PolarHBondContact O-N 3.16Å; E12-N16 WeakPolarHBondContact O-CB 3.45Å; E12-N16 PolarHBondContact O-N 3.12Å; E12-N16 PolarHBondContact O-ND2 2.99Å; E12-N16 VanDerWaalsContact O-ND2 3.12Å; E12-T139 HydrophobicContact CB-CG2 4.06Å
13C92.6Very high88.3Confident49 Ų4952.4 Ų52.433%0.33129%0.287SS..Hα-helixtrans-59.3-43.2176.7-74.80000112E9 K10 T11 A17 F48 V50E9-C13 WeakPolarHBondContact O-CB 3.26Å; E9-C13 PolarHBondContact O-N 2.63Å; E9-C13 PolarHBondContact O-SG 3.49Å; K10-C13 PolarHBondContact O-N 3.35Å; T11-C13 PolarHBondContact O-N 3.03Å; C13-A17 WeakPolarHBondContact O-CB 3.37Å; C13-A17 PolarHBondContact O-N 3.44Å; C13-F48 HydrophobicContact CB-CE1 4.3Å; C13-F48 HydrophobicContact CB-CZ 4.29Å; C13-V50 HydrophobicContact CB-CG2 4.3Å; C13-V50 WeakPolarHBondContact O-CG2 3.45Å
14I94.4Very high89.5Confident2 Ų250.6 Ų50.61%0.0128%0.277CS..Hα-helixtrans-66.1-47.8179.1-68.7160.3000111.4K10 T11 E12 N16 A17 L18 F48 V50 I53 L57 W158K10-I14 WeakPolarHBondContact O-CD1 3.2Å; K10-I14 VanDerWaalsContact O-CG1 3.28Å; K10-I14 WeakPolarHBondContact O-CG1 3.12Å; K10-I14 PolarHBondContact O-N 3.29Å; T11-I14 PolarHBondContact O-N 3.35Å; E12-I14 VanDerWaalsContact C-N 3.33Å; E12-I14 PolarHBondContact O-N 2.93Å; I14-N16 VanDerWaalsContact C-N 3.3Å; I14-N16 PolarHBondContact O-N 2.77Å; I14-A17 PolarHBondContact O-N 2.94Å; I14-A17 VanDerWaalsContact O-N 3.15Å; I14-L18 HydrophobicContact CG2-CD1 4.15Å; I14-L18 PolarHBondContact O-N 3.39Å; I14-F48 HydrophobicContact CD1-CE2 3.92Å; I14-F48 HydrophobicContact CD1-CZ 4.2Å; I14-F48 HydrophobicContact CG1-CE2 4.18Å; I14-F48 HydrophobicContact CG1-CZ 4.02Å; I14-V50 HydrophobicContact CG1-CG2 4.06Å; I14-I53 HydrophobicContact CD1-CG2 3.65Å; I14-I53 HydrophobicContact CG1-CB 4.47Å; I14-I53 HydrophobicContact CG1-CG2 3.97Å; I14-I53 HydrophobicContact CG2-CG2 4.31Å; I14-L57 HydrophobicContact CG2-CD1 3.35Å; I14-W158 HydrophobicContact CD1-CB 3.8Å; I14-W158 HydrophobicContact CD1-CD2 3.4Å; I14-W158 HydrophobicContact CD1-CE3 3.65Å; I14-W158 HydrophobicContact CD1-CG 3.5Å; I14-W158 VanDerWaalsContact CD1-CG 3.5Å; I14-W158 HydrophobicContact CD1-CZ3 4.33Å
15V93.9Very high89.4Confident3 Ų349.4 Ų49.42%0.01827%0.27CS..Hα-helixtrans-62.3-40.8179.8174.10000110.7T11 E12 L18 L19 L120 A135 I142T11-V15 HydrophobicContact CG2-CG2 4.39Å; T11-V15 WeakPolarHBondContact O-CG2 3.35Å; T11-V15 PolarHBondContact O-N 3.44Å; E12-V15 PolarHBondContact O-N 3.16Å; V15-L18 PolarHBondContact O-N 2.91Å; V15-L19 WeakPolarHBondContact O-CB 3.36Å; V15-L19 PolarHBondContact O-N 3.37Å; V15-L120 HydrophobicContact CG1-CD2 4.31Å; V15-A135 HydrophobicContact CG1-CB 3.88Å; V15-I142 HydrophobicContact CG2-CD1 4.19Å
16N91.3Very high88Confident64 Ų6449.2 Ų49.234%0.34227%0.274SS..Hα-helixtrans-64.4-39.1174.5-76-36.2000112.4E12 I14 L19 M20E12-N16 WeakPolarHBondContact O-CB 3.45Å; E12-N16 PolarHBondContact O-N 3.12Å; E12-N16 PolarHBondContact O-ND2 2.99Å; E12-N16 VanDerWaalsContact O-ND2 3.12Å; I14-N16 VanDerWaalsContact C-N 3.3Å; I14-N16 PolarHBondContact O-N 2.77Å; N16-L19 PolarHBondContact O-N 3.05Å; N16-M20 VanDerWaalsContact O-CG 3.26Å; N16-M20 WeakPolarHBondContact O-CG 3.37Å; N16-M20 PolarHBondContact O-N 3.4Å
17A91.7Very high85.7Confident27 Ų2754 Ų5422%0.22330%0.297CS..Hα-helixtrans-64.8-43.6176.200000112C13 I14 M20 D21 V50 A54C13-A17 WeakPolarHBondContact O-CB 3.37Å; C13-A17 PolarHBondContact O-N 3.44Å; I14-A17 PolarHBondContact O-N 2.94Å; I14-A17 VanDerWaalsContact O-N 3.15Å; A17-M20 PolarHBondContact O-N 3.2Å; A17-D21 WeakPolarHBondContact O-CB 3.47Å; A17-D21 PolarHBondContact O-N 3.4Å; A17-V50 HydrophobicContact CB-CG2 3.62Å; A17-A54 HydrophobicContact CB-CB 4.26Å
18L92.7Very high83.5Confident4 Ų459.3 Ų59.32%0.02132%0.322CS..Hα-helixtrans-59-46.7172.9-76.1167.3000111.5I14 V15 M20 D21 F22 A54 L57 V117 L120I14-L18 HydrophobicContact CG2-CD1 4.15Å; I14-L18 PolarHBondContact O-N 3.39Å; V15-L18 PolarHBondContact O-N 2.91Å; L18-M20 PolarHBondContact O-N 2.95Å; L18-D21 PolarHBondContact O-N 3.37Å; L18-F22 HydrophobicContact CB-CD2 4.44Å; L18-F22 HydrophobicContact CB-CE2 3.99Å; L18-F22 HydrophobicContact CD2-CE2 4.19Å; L18-F22 HydrophobicContact CD2-CZ 3.91Å; L18-F22 WeakPolarHBondContact O-CD2 3.47Å; L18-F22 WeakPolarHBondContact O-CG 3.29Å; L18-F22 PolarHBondContact O-N 3.05Å; L18-A54 HydrophobicContact CD2-CB 3.92Å; L18-A54 WeakPolarHBondContact CD2-O 3.05Å; L18-A54 HydrophobicContact CG-CB 3.96Å; L18-L57 HydrophobicContact CD1-CB 4.32Å; L18-L57 HydrophobicContact CD1-CD1 4.09Å; L18-L57 HydrophobicContact CD2-CB 4.42Å; L18-V117 HydrophobicContact CD1-CG2 4.06Å; L18-V117 HydrophobicContact CD2-CG1 4.24Å; L18-L120 HydrophobicContact CB-CD2 4.09Å
19L91.1Very high80.9Confident9 Ų962.3 Ų62.35%0.04735%0.345CS..Hα-helixtrans-58.3-47.7178.8-177.366.3000112.2V15 N16 D21 F22 L23 L120 V131 A135V15-L19 WeakPolarHBondContact O-CB 3.36Å; V15-L19 PolarHBondContact O-N 3.37Å; N16-L19 PolarHBondContact O-N 3.05Å; L19-D21 VanDerWaalsContact C-N 3.32Å; L19-D21 PolarHBondContact O-N 2.96Å; L19-F22 PolarHBondContact O-N 2.97Å; L19-L23 HydrophobicContact CD1-CD1 3.97Å; L19-L23 HydrophobicContact CD1-CG 4.27Å; L19-L23 HydrophobicContact CD2-CD1 4.46Å; L19-L23 HydrophobicContact CG-CD1 3.86Å; L19-L23 HydrophobicContact CG-CG 4.48Å; L19-L23 WeakPolarHBondContact O-CB 3.43Å; L19-L23 WeakPolarHBondContact O-CG 3.43Å; L19-L23 PolarHBondContact O-N 3.16Å; L19-L120 HydrophobicContact CD1-CD1 4.29Å; L19-V131 HydrophobicContact CD1-CB 4.09Å; L19-V131 HydrophobicContact CD1-CG1 3.59Å; L19-V131 HydrophobicContact CD1-CG2 3.54Å; L19-A135 HydrophobicContact CD2-CB 3.99Å
20M89.6Confident78.2Confident123 Ų12361.3 Ų61.361%0.60635%0.352SS*.Hα-helixtrans-63.9-40.4179.8-70.2-65.4164.100111.6N16 A17 L18 A24N16-M20 VanDerWaalsContact O-CG 3.26Å; N16-M20 WeakPolarHBondContact O-CG 3.37Å; N16-M20 PolarHBondContact O-N 3.4Å; A17-M20 PolarHBondContact O-N 3.2Å; L18-M20 PolarHBondContact O-N 2.95Å; M20-A24 PolarHBondContact O-N 3.31Å
21D88.9Confident75.8Confident47 Ų4766 Ų6625%0.25138%0.378SS..Hα-helixtrans-64.9-39.7176.9176.390.7000112.7A17 L18 L19 A24 P25 R58A17-D21 WeakPolarHBondContact O-CB 3.47Å; A17-D21 PolarHBondContact O-N 3.4Å; L18-D21 PolarHBondContact O-N 3.37Å; L19-D21 VanDerWaalsContact C-N 3.32Å; L19-D21 PolarHBondContact O-N 2.96Å; D21-A24 CarbonylContact O-C 3.59Å; D21-A24 VanDerWaalsContact O-C 3.31Å; D21-P25 WeakPolarHBondContact O-CA 3.48Å; D21-R58 IonicContact OD1-CZ 3.66Å; D21-R58 IonicContact OD1-NH2 2.83Å; D21-R58 PolarHBondContact OD1-NH2 2.97Å; D21-R58 IonicContact OD2-CZ 3.04Å; D21-R58 IonicContact OD2-NE 2.72Å; D21-R58 PolarHBondContact OD2-NE 3.12Å; D21-R58 IonicContact OD2-NH2 2.59Å; D21-R58 PolarHBondContact OD2-NH2 3.42Å
22F89.2Confident73.3Confident12 Ų1273.5 Ų73.55%0.05341%0.406CS..Hα-helixtrans-73.6-35.4176.7-60.2-36.8000113.5L18 L19 R58 V117 L120 E121 A124L18-F22 HydrophobicContact CB-CD2 4.44Å; L18-F22 HydrophobicContact CB-CE2 3.99Å; L18-F22 HydrophobicContact CD2-CE2 4.19Å; L18-F22 HydrophobicContact CD2-CZ 3.91Å; L18-F22 WeakPolarHBondContact O-CD2 3.47Å; L18-F22 WeakPolarHBondContact O-CG 3.29Å; L18-F22 PolarHBondContact O-N 3.05Å; L19-F22 PolarHBondContact O-N 2.97Å; F22-R58 HydrophobicContact CE1-CG 4.12Å; F22-V117 HydrophobicContact CE2-CG1 4.27Å; F22-V117 HydrophobicContact CZ-CG1 3.82Å; F22-L120 HydrophobicContact CD2-CB 4.45Å; F22-L120 HydrophobicContact CD2-CD2 4.27Å; F22-L120 HydrophobicContact CD2-CG 4.13Å; F22-L120 HydrophobicContact CE2-CB 4.2Å; F22-L120 HydrophobicContact CE2-CD2 4.15Å; F22-L120 HydrophobicContact CE2-CG 4.23Å; F22-E121 HydrophobicContact CD1-CB 4.04Å; F22-E121 HydrophobicContact CD1-CG 3.8Å; F22-E121 HydrophobicContact CD2-CB 4Å; F22-E121 HydrophobicContact CE1-CB 3.84Å; F22-E121 HydrophobicContact CE1-CG 3.81Å; F22-E121 HydrophobicContact CE2-CB 3.8Å; F22-E121 HydrophobicContact CG-CB 4.13Å; F22-E121 HydrophobicContact CG-CG 4.2Å; F22-E121 HydrophobicContact CZ-CB 3.72Å; F22-E121 HydrophobicContact CZ-CG 4.23Å; F22-A124 HydrophobicContact CB-CB 3.54Å
23L86.3Confident70.5Confident69 Ų6974.3 Ų74.336%0.36141%0.414SS..Hα-helixtrans-77.1-36.4-179.9-79175.6000113.2L19 A124 P128 V131L19-L23 HydrophobicContact CD1-CD1 3.97Å; L19-L23 HydrophobicContact CD1-CG 4.27Å; L19-L23 HydrophobicContact CD2-CD1 4.46Å; L19-L23 HydrophobicContact CG-CD1 3.86Å; L19-L23 HydrophobicContact CG-CG 4.48Å; L19-L23 WeakPolarHBondContact O-CB 3.43Å; L19-L23 WeakPolarHBondContact O-CG 3.43Å; L19-L23 PolarHBondContact O-N 3.16Å; L23-A124 HydrophobicContact CD2-CB 4.27Å; L23-A124 HydrophobicContact CG-CB 4.46Å; L23-P128 HydrophobicContact CD2-CB 3.55Å; L23-V131 HydrophobicContact CD1-CG1 4Å; L23-V131 HydrophobicContact CD2-CG1 3.59Å; L23-V131 HydrophobicContact CG-CG1 3.99Å
24A80.1Confident68Low58 Ų5879.7 Ų79.748%0.47944%0.439SS..SBendtrans-124.482.8174.200000106.6M20 D21 T26M20-A24 PolarHBondContact O-N 3.31Å; D21-A24 CarbonylContact O-C 3.59Å; D21-A24 VanDerWaalsContact O-C 3.31Å; A24-T26 PolarHBondContact O-N 3.06Å
25P62.4Low65Low96 Ų9684.4 Ų84.462%0.62347%0.471SS*.  trans-65.679170.226.4-31000106.9D21 L27D21-P25 WeakPolarHBondContact O-CA 3.48Å; P25-L27 PolarHBondContact O-N 3.49Å
26T51.3Low62.4Low83 Ų8389.7 Ų89.751%0.50951%0.506SS..  trans-54.4130.616641.70000104.8A24 Q28A24-T26 PolarHBondContact O-N 3.06Å; T26-Q28 PolarHBondContact O-N 3.42Å; T26-Q28 PolarHBondContact OG1-NE2 3.24Å
27L43.9Very low59.8Low164 Ų16491.4 Ų91.486%0.85952%0.519SS*.  trans-57.859.2167.8-78158.3000110.3P25 V29P25-L27 PolarHBondContact O-N 3.49Å; L27-V29 PolarHBondContact O-N 2.85Å; L27-V29 VanDerWaalsContact O-N 3.12Å
28Q45.1Very low57.7Low136 Ų13698.1 Ų98.164%0.63655%0.551SS**  trans-85.847.2166.7-73.1-170.156.100109T26 A30T26-Q28 PolarHBondContact O-N 3.42Å; T26-Q28 PolarHBondContact OG1-NE2 3.24Å; Q28-A30 PolarHBondContact O-N 3.07Å; Q28-A30 VanDerWaalsContact O-N 3.16Å
29V40.2Very low55.1Low137 Ų137106.3 Ų106.383%0.8359%0.59SS**  trans-7551.7135-167.20000107.3L27 N31L27-V29 PolarHBondContact O-N 2.85Å; L27-V29 VanDerWaalsContact O-N 3.12Å; V29-N31 VanDerWaalsContact C-N 3.31Å
30A36.1Very low52.9Low65 Ų65112.4 Ų112.454%0.53763%0.627SS.*  trans-99.675.6161.900000105Q28 R32Q28-A30 PolarHBondContact O-N 3.07Å; Q28-A30 VanDerWaalsContact O-N 3.16Å; A30-R32 VanDerWaalsContact C-N 3.3Å; A30-R32 PolarHBondContact O-N 2.73Å
31N41.5Very low51Low131 Ų131113.5 Ų113.570%0.70164%0.635SS**  trans27.167.3139.3-153.3-1.8000113.2V29 N33V29-N31 VanDerWaalsContact C-N 3.31Å; N31-N33 PolarHBondContact O-N 3.28Å
32R42.4Very low48.8Very low158 Ų158115.4 Ų115.460%0.59665%0.652SS**  trans-72.692.1161.9-76.5-171.7-176.9-171-0.5103.6A30 L34A30-R32 VanDerWaalsContact C-N 3.3Å; A30-R32 PolarHBondContact O-N 2.73Å; R32-L34 PolarHBondContact O-N 2.62Å
33N36.6Very low46.8Very low124 Ų124118.6 Ų118.666%0.66369%0.688SS**  trans-34.7113.2161.2-82.1-62000106.8N31 C35N31-N33 PolarHBondContact O-N 3.28Å; N33-C35 PolarHBondContact O-N 3.46Å
34L39.4Very low44.8Very low161 Ų161122.6 Ų122.684%0.84371%0.705SS**  trans-59.478.6157.3-79.8154.7000105.6R32 C36R32-L34 PolarHBondContact O-N 2.62Å; L34-C36 PolarHBondContact O-N 2.82Å
35C31.6Very low43.2Very low101 Ų101124.9 Ų124.968%0.68272%0.715SS**  trans-73.176.2155.7-83.50000105.1N33 V37N33-C35 PolarHBondContact O-N 3.46Å; C35-V37 HydrophobicContact CB-CG2 4.04Å; C35-V37 PolarHBondContact O-N 2.9Å
36C38.7Very low42.9Very low114 Ų114123.6 Ų123.677%0.7771%0.707SS**  trans-61.376.7145.1-60.30000105.8L34L34-C36 PolarHBondContact O-N 2.82Å
37V36.6Very low44Very low100 Ų100124.4 Ų124.461%0.60672%0.717SS**  trans-89.2113.4158-1770000103.2C35 E39C35-V37 HydrophobicContact CB-CG2 4.04Å; C35-V37 PolarHBondContact O-N 2.9Å; V37-E39 HydrophobicContact CG1-CG 3.94Å; V37-E39 PolarHBondContact O-N 2.59Å
38D47.1Very low45.9Very low169 Ų169119 Ų11990%0.90469%0.686SS**  trans-47.993.5158.4-93.1-32.5000107.7
39E38.8Very low48Very low176 Ų176115.2 Ų115.282%0.82267%0.671SS**  trans-114.5113.6159.1-74.4-157.7156.200107.6V37 D41V37-E39 HydrophobicContact CG1-CG 3.94Å; V37-E39 PolarHBondContact O-N 2.59Å; E39-D41 PolarHBondContact O-N 3Å
40V44.5Very low50.3Low137 Ų137110.7 Ų110.783%0.8364%0.643SS**  trans-49.9128.1172.8171.90000109.6S42V40-S42 PolarHBondContact O-N 2.83Å
41D49.7Very low52.8Low145 Ų145111.1 Ų111.178%0.77564%0.639SS**  trans-8.692.9157.2-174.321.5000114.8E39 G43E39-D41 PolarHBondContact O-N 3Å; D41-G43 PolarHBondContact OD1-N 2.76Å
42S44Very low55.1Low88 Ų88108.1 Ų108.162%0.61562%0.622SS**  trans-102.3106.614764.90000106.4V40 E44V40-S42 PolarHBondContact O-N 2.83Å; S42-E44 PolarHBondContact O-N 2.95Å
43G46.2Very low57.4Low79 Ų79100.8 Ų100.881%0.81459%0.594SS**  trans-6161.6176.700000113.9D41D41-G43 PolarHBondContact OD1-N 2.76Å
44E43.8Very low60Low153 Ų15395 Ų9572%0.71556%0.564SS**  trans-103126.4174.4-133.7150-160.700106.6S42 C46S42-E44 PolarHBondContact O-N 2.95Å; E44-C46 PolarHBondContact O-N 2.64Å; E44-C46 VanDerWaalsContact O-N 3.13Å
45P48.5Very low62.5Low106 Ų10688.2 Ų88.269%0.68853%0.533SS*.  trans-57.5125.2-175.220.5-29.7000109.1S47P45-S47 PolarHBondContact O-N 3.03Å
46C54.6Low65.4Low68 Ų6886.3 Ų86.346%0.45951%0.511SS..  trans-43.8116.1174-88.80000108.4E44 F48 E159E44-C46 PolarHBondContact O-N 2.64Å; E44-C46 VanDerWaalsContact O-N 3.13Å; C46-F48 PolarHBondContact O-N 3.15Å; C46-E159 HydrophobicContact CB-CB 4.13Å; C46-E159 VanDerWaalsContact O-CB 3.3Å; C46-E159 WeakPolarHBondContact O-CB 3.44Å
47S75.6Confident68Low100 Ų10081 Ų8170%0.69948%0.475SS*.  trans-55.5138177.859.70000108.4P45 D49P45-S47 PolarHBondContact O-N 3.03Å; S47-D49 VanDerWaalsContact C-N 3.28Å; S47-D49 PolarHBondContact O-N 2.99Å
48F83.9Confident70.6Confident51 Ų5179.8 Ų79.822%0.22446%0.46CS..  trans-60.488177.8178.7-104.7000110.8Q5 K10 C13 I14 C46 V50 I53 W158Q5-F48 VanDerWaalsContact OE1-CD1 3.29Å; K10-F48 HydrophobicContact CB-CD2 4.48Å; K10-F48 HydrophobicContact CB-CE2 3.64Å; K10-F48 HydrophobicContact CB-CZ 3.7Å; K10-F48 HydrophobicContact CD-CD2 3.8Å; K10-F48 HydrophobicContact CD-CE2 3.8Å; K10-F48 HydrophobicContact CD-CG 4.45Å; K10-F48 HydrophobicContact CD-CZ 4.45Å; K10-F48 HydrophobicContact CG-CD2 3.94Å; K10-F48 HydrophobicContact CG-CE1 4.2Å; K10-F48 HydrophobicContact CG-CE2 3.57Å; K10-F48 HydrophobicContact CG-CG 4.41Å; K10-F48 HydrophobicContact CG-CZ 3.72Å; C13-F48 HydrophobicContact CB-CE1 4.3Å; C13-F48 HydrophobicContact CB-CZ 4.29Å; I14-F48 HydrophobicContact CD1-CE2 3.92Å; I14-F48 HydrophobicContact CD1-CZ 4.2Å; I14-F48 HydrophobicContact CG1-CE2 4.18Å; I14-F48 HydrophobicContact CG1-CZ 4.02Å; C46-F48 PolarHBondContact O-N 3.15Å; F48-V50 HydrophobicContact CE1-CB 4.38Å; F48-I53 HydrophobicContact CD2-CD1 3.5Å; F48-I53 HydrophobicContact CE2-CD1 3.58Å; F48-I53 HydrophobicContact CG-CD1 4.41Å; F48-W158 HydrophobicContact CE2-CB 4.17Å
49D89.1Confident72.7Confident57 Ų5777.6 Ų77.631%0.30545%0.446SS..  trans-97.598.4174.7-173.6-30.8000108.7S47 V51 I52 I53S47-D49 VanDerWaalsContact C-N 3.28Å; S47-D49 PolarHBondContact O-N 2.99Å; D49-V51 PolarHBondContact O-N 2.93Å; D49-V51 VanDerWaalsContact O-N 3.17Å; D49-V51 WeakPolarHBondContact OD1-CB 2.97Å; D49-V51 PolarHBondContact OD1-N 2.98Å; D49-I52 HydrophobicContact CB-CB 4.15Å; D49-I52 HydrophobicContact CB-CD1 3.93Å; D49-I52 HydrophobicContact CB-CG1 4.09Å; D49-I52 PolarHBondContact O-N 3.41Å; D49-I52 PolarHBondContact OD1-N 3.38Å; D49-I52 WeakPolarHBondContact OD2-CD1 3.49Å; D49-I53 VanDerWaalsContact O-CG1 3.31Å; D49-I53 WeakPolarHBondContact O-CG1 3.32Å; D49-I53 PolarHBondContact O-N 3.42Å
50V88.4Confident75.2Confident41 Ų4169.3 Ų69.325%0.24841%0.407CS..Hα-helixtrans-57.3-30.4-177.771.60000112.8C13 I14 A17 F48 A54C13-V50 HydrophobicContact CB-CG2 4.3Å; C13-V50 WeakPolarHBondContact O-CG2 3.45Å; I14-V50 HydrophobicContact CG1-CG2 4.06Å; A17-V50 HydrophobicContact CB-CG2 3.62Å; F48-V50 HydrophobicContact CE1-CB 4.38Å; V50-A54 WeakPolarHBondContact O-CB 3.15Å; V50-A54 PolarHBondContact O-N 3.21Å
51V88.4Confident77.3Confident74 Ų7462.8 Ų62.845%0.44837%0.368SS..Hα-helixtrans-75.1-40.4-178.5-178.60000110.4D49 G55D49-V51 PolarHBondContact O-N 2.93Å; D49-V51 VanDerWaalsContact O-N 3.17Å; D49-V51 WeakPolarHBondContact OD1-CB 2.97Å; D49-V51 PolarHBondContact OD1-N 2.98Å; V51-G55 PolarHBondContact O-N 2.95Å
52I89.6Confident79.2Confident68 Ų6860.1 Ų60.135%0.34935%0.353SS..Hα-helixtrans-64.2-46.8174.6-66176.8000110.1D49 G55 R56D49-I52 HydrophobicContact CB-CB 4.15Å; D49-I52 HydrophobicContact CB-CD1 3.93Å; D49-I52 HydrophobicContact CB-CG1 4.09Å; D49-I52 PolarHBondContact O-N 3.41Å; D49-I52 PolarHBondContact OD1-N 3.38Å; D49-I52 WeakPolarHBondContact OD2-CD1 3.49Å; I52-G55 PolarHBondContact O-N 3.41Å; I52-R56 WeakPolarHBondContact O-CG 3.42Å; I52-R56 PolarHBondContact O-N 3.45Å
53I91.6Very high81.3Confident4 Ų460.8 Ų60.82%0.02135%0.346CS..Hα-helixtrans-63.7-45.6-178.9-60.8162.2000110.8I14 F48 D49 G55 R56 L57 W158I14-I53 HydrophobicContact CD1-CG2 3.65Å; I14-I53 HydrophobicContact CG1-CB 4.47Å; I14-I53 HydrophobicContact CG1-CG2 3.97Å; I14-I53 HydrophobicContact CG2-CG2 4.31Å; F48-I53 HydrophobicContact CD2-CD1 3.5Å; F48-I53 HydrophobicContact CE2-CD1 3.58Å; F48-I53 HydrophobicContact CG-CD1 4.41Å; D49-I53 VanDerWaalsContact O-CG1 3.31Å; D49-I53 WeakPolarHBondContact O-CG1 3.32Å; D49-I53 PolarHBondContact O-N 3.42Å; I53-G55 VanDerWaalsContact C-N 3.3Å; I53-G55 PolarHBondContact O-N 3.47Å; I53-R56 PolarHBondContact O-N 3.34Å; I53-L57 HydrophobicContact CG2-CD1 4.24Å; I53-L57 PolarHBondContact O-N 2.94Å; I53-W158 HydrophobicContact CD1-CB 4.19Å; I53-W158 HydrophobicContact CG2-CE3 4.23Å
54A91.3Very high83.1Confident4 Ų457.5 Ų57.53%0.03331%0.31CS..Hα-helixtrans-59.8-40.5174.400000111.7A17 L18 V50 L57 R58A17-A54 HydrophobicContact CB-CB 4.26Å; L18-A54 HydrophobicContact CD2-CB 3.92Å; L18-A54 WeakPolarHBondContact CD2-O 3.05Å; L18-A54 HydrophobicContact CG-CB 3.96Å; V50-A54 WeakPolarHBondContact O-CB 3.15Å; V50-A54 PolarHBondContact O-N 3.21Å; A54-L57 PolarHBondContact O-N 3.5Å; A54-R58 PolarHBondContact O-N 2.96Å
55G90.2Very high85Confident17 Ų1752.2 Ų52.218%0.17529%0.287CS..Hα-helixtrans-60.2-44.917500000113.1V51 I52 I53 R58 M59V51-G55 PolarHBondContact O-N 2.95Å; I52-G55 PolarHBondContact O-N 3.41Å; I53-G55 VanDerWaalsContact C-N 3.3Å; I53-G55 PolarHBondContact O-N 3.47Å; G55-R58 WeakPolarHBondContact O-CB 3.44Å; G55-R58 PolarHBondContact O-N 3.49Å; G55-M59 WeakPolarHBondContact O-CG 3.14Å; G55-M59 PolarHBondContact O-N 3.47Å
56R92.8Very high86.4Confident61 Ų6150.2 Ų50.223%0.2328%0.279CS..Hα-helixtrans-64-43.1176-68178.9-176.4158.6-7.5112I52 I53 R58 M59 L60 E159 L161 S163I52-R56 WeakPolarHBondContact O-CG 3.42Å; I52-R56 PolarHBondContact O-N 3.45Å; I53-R56 PolarHBondContact O-N 3.34Å; R56-R58 VanDerWaalsContact C-N 3.31Å; R56-R58 PolarHBondContact O-N 3.46Å; R56-M59 WeakPolarHBondContact O-CB 3.49Å; R56-M59 PolarHBondContact O-N 2.95Å; R56-L60 WeakPolarHBondContact O-CB 3.5Å; R56-L60 PolarHBondContact O-N 3.04Å; R56-E159 PolarHBondContact NH1-O 3.15Å; R56-L161 WeakPolarHBondContact CD-O 3.44Å; R56-L161 PolarHBondContact NH1-O 3.2Å; R56-S163 PolarHBondContact NH1-OG 3.42Å; R56-S163 PolarHBondContact NH2-OG 3.25Å; R56-S163 VanDerWaalsContact NH2-OG 3.08Å
57L93.5Very high87.5Confident4 Ų454.1 Ų54.12%0.02129%0.29CS..Hα-helixtrans-62.1-37.9175.1-81171.6000112.4I14 L18 I53 A54 L60 G61 L113 V117 W158 L161I14-L57 HydrophobicContact CG2-CD1 3.35Å; L18-L57 HydrophobicContact CD1-CB 4.32Å; L18-L57 HydrophobicContact CD1-CD1 4.09Å; L18-L57 HydrophobicContact CD2-CB 4.42Å; I53-L57 HydrophobicContact CG2-CD1 4.24Å; I53-L57 PolarHBondContact O-N 2.94Å; A54-L57 PolarHBondContact O-N 3.5Å; L57-L60 HydrophobicContact CD2-CD2 4.35Å; L57-L60 WeakPolarHBondContact O-CB 3.44Å; L57-L60 PolarHBondContact O-N 2.99Å; L57-G61 PolarHBondContact O-N 3Å; L57-L113 HydrophobicContact CD2-CB 4.2Å; L57-L113 HydrophobicContact CD2-CD1 4.47Å; L57-V117 HydrophobicContact CB-CG2 3.97Å; L57-V117 HydrophobicContact CD2-CG2 4.21Å; L57-W158 HydrophobicContact CD1-CZ3 3.98Å; L57-W158 HydrophobicContact CD2-CZ3 4.41Å; L57-L161 HydrophobicContact CD1-CD2 4.46Å; L57-L161 HydrophobicContact CD2-CD2 3.62Å; L57-L161 HydrophobicContact CG-CD2 3.94Å
58R91.9Very high87.6Confident73 Ų7350 Ų5028%0.27526%0.261SS..Hα-helixtrans-61.6-49.3172.3-168.6-170.5-50.7120.410.7111D21 F22 A54 G55 R56 L60 G61 D62D21-R58 IonicContact OD1-CZ 3.66Å; D21-R58 IonicContact OD1-NH2 2.83Å; D21-R58 PolarHBondContact OD1-NH2 2.97Å; D21-R58 IonicContact OD2-CZ 3.04Å; D21-R58 IonicContact OD2-NE 2.72Å; D21-R58 PolarHBondContact OD2-NE 3.12Å; D21-R58 IonicContact OD2-NH2 2.59Å; D21-R58 PolarHBondContact OD2-NH2 3.42Å; F22-R58 HydrophobicContact CE1-CG 4.12Å; A54-R58 PolarHBondContact O-N 2.96Å; G55-R58 WeakPolarHBondContact O-CB 3.44Å; G55-R58 PolarHBondContact O-N 3.49Å; R56-R58 VanDerWaalsContact C-N 3.31Å; R56-R58 PolarHBondContact O-N 3.46Å; R58-L60 PolarHBondContact O-N 3.28Å; R58-G61 CarbonylContact O-C 3.19Å; R58-G61 WeakPolarHBondContact O-CA 3.24Å; R58-G61 PolarHBondContact O-N 3.25Å; R58-D62 PolarHBondContact O-N 3.04Å
59M91.1Very high87.2Confident124 Ų12449.3 Ų49.361%0.61126%0.258SS*.Hα-helixtrans-58.9-33.1176.1-69.2176.862.500112.7G55 R56 Q63G55-M59 WeakPolarHBondContact O-CG 3.14Å; G55-M59 PolarHBondContact O-N 3.47Å; R56-M59 WeakPolarHBondContact O-CB 3.49Å; R56-M59 PolarHBondContact O-N 2.95Å; M59-Q63 WeakPolarHBondContact O-CG 3.42Å; M59-Q63 PolarHBondContact O-NE2 2.99Å
60L90.9Very high86.7Confident2 Ų250.5 Ų50.51%0.0127%0.268CS..Hα-helixtrans-70.1-43173.217759.1000111.4R56 L57 R58 D62 Q63 R110 L113 A114R56-L60 WeakPolarHBondContact O-CB 3.5Å; R56-L60 PolarHBondContact O-N 3.04Å; L57-L60 HydrophobicContact CD2-CD2 4.35Å; L57-L60 WeakPolarHBondContact O-CB 3.44Å; L57-L60 PolarHBondContact O-N 2.99Å; R58-L60 PolarHBondContact O-N 3.28Å; L60-D62 VanDerWaalsContact C-N 3.33Å; L60-D62 PolarHBondContact O-N 3.39Å; L60-Q63 WeakPolarHBondContact O-CB 3.36Å; L60-Q63 PolarHBondContact O-N 2.78Å; L60-R110 HydrophobicContact CD1-CG 4.2Å; L60-R110 VanDerWaalsContact CD1-NH2 3.32Å; L60-R110 HydrophobicContact CD2-CG 4.4Å; L60-L113 HydrophobicContact CD2-CB 3.81Å; L60-A114 HydrophobicContact CD1-CB 4.02Å; L60-A114 HydrophobicContact CG-CB 3.77Å; L60-A114 WeakPolarHBondContact O-CB 3.49Å
61G89.3Confident86.1Confident0 Ų055 Ų550%028%0.281CS..Hα-helixtrans-63.2-34.917400000113.6L57 R58 Q63 F64 A114L57-G61 PolarHBondContact O-N 3Å; R58-G61 CarbonylContact O-C 3.19Å; R58-G61 WeakPolarHBondContact O-CA 3.24Å; R58-G61 PolarHBondContact O-N 3.25Å; G61-Q63 PolarHBondContact O-N 3.44Å; G61-F64 WeakPolarHBondContact O-CB 3.49Å; G61-F64 PolarHBondContact O-N 3.37Å; G61-A114 WeakPolarHBondContact CA-O 3.48Å
62D88.8Confident85.4Confident89 Ų8951.5 Ų51.548%0.47626%0.26SS..THydrogen-bonded Turntrans-68.6-16.5175.9-71.2-28.9000113.5R58 L60 K118R58-D62 PolarHBondContact O-N 3.04Å; L60-D62 VanDerWaalsContact C-N 3.33Å; L60-D62 PolarHBondContact O-N 3.39Å; D62-K118 IonicContact OD1-NZ 3Å; D62-K118 PolarHBondContact OD1-NZ 3.27Å
63Q87.9Confident84.8Confident101 Ų10151 Ų5147%0.47226%0.255SS..THydrogen-bonded Turntrans-80.8-6.2171.4-6616542.300112.2M59 L60 G61 N65 W99M59-Q63 WeakPolarHBondContact O-CG 3.42Å; M59-Q63 PolarHBondContact O-NE2 2.99Å; L60-Q63 WeakPolarHBondContact O-CB 3.36Å; L60-Q63 PolarHBondContact O-N 2.78Å; G61-Q63 PolarHBondContact O-N 3.44Å; Q63-N65 PolarHBondContact O-N 3.25Å; Q63-W99 HydrophobicContact CB-CH2 4.43Å; Q63-W99 VanDerWaalsContact O-CH2 3.24Å; Q63-W99 WeakPolarHBondContact O-CH2 3.34Å; Q63-W99 WeakPolarHBondContact O-CZ2 3.31Å
64F84.3Confident83.9Confident10 Ų1055.5 Ų55.54%0.04428%0.279CS..SBendtrans-58.4137.4-179.7-174.4-137.8000111.9G61 A66 L68 E69 L95 W99 V115 K118G61-F64 WeakPolarHBondContact O-CB 3.49Å; G61-F64 PolarHBondContact O-N 3.37Å; F64-A66 PolarHBondContact O-N 2.83Å; F64-L68 HydrophobicContact CE1-CB 4.37Å; F64-L68 HydrophobicContact CE2-CB 3.81Å; F64-L68 HydrophobicContact CE2-CD1 4.19Å; F64-L68 HydrophobicContact CZ-CB 3.54Å; F64-E69 HydrophobicContact CD1-CB 3.84Å; F64-E69 HydrophobicContact CD1-CG 4.19Å; F64-E69 HydrophobicContact CE1-CB 3.83Å; F64-E69 HydrophobicContact CE1-CG 4.34Å; F64-L95 HydrophobicContact CZ-CB 4.23Å; F64-L95 HydrophobicContact CZ-CD1 4.12Å; F64-L95 HydrophobicContact CZ-CD2 4.47Å; F64-W99 VanDerWaalsContact CA-CH2 3.41Å; F64-W99 HydrophobicContact CB-CH2 4.33Å; F64-W99 HydrophobicContact CB-CZ3 4.19Å; F64-W99 HydrophobicContact CD2-CD2 4.09Å; F64-W99 AromaticContact CD2-CE3 3.44Å; F64-W99 HydrophobicContact CD2-CE3 3.44Å; F64-W99 VanDerWaalsContact CD2-CE3 3.44Å; F64-W99 HydrophobicContact CD2-CH2 4.22Å; F64-W99 AromaticContact CD2-CZ3 3.49Å; F64-W99 HydrophobicContact CD2-CZ3 3.49Å; F64-W99 VanDerWaalsContact CD2-CZ3 3.49Å; F64-W99 HydrophobicContact CE2-CD2 4.4Å; F64-W99 AromaticContact CE2-CE3 3.89Å; F64-W99 HydrophobicContact CE2-CE3 3.89Å; F64-W99 HydrophobicContact CE2-CZ3 4.37Å; F64-W99 HydrophobicContact CG-CZ3 4.3Å; F64-V115 HydrophobicContact CD2-CG2 3.74Å; F64-V115 HydrophobicContact CE2-CG2 3.4Å; F64-V115 HydrophobicContact CZ-CG1 4.48Å; F64-V115 HydrophobicContact CZ-CG2 3.88Å; F64-K118 HydrophobicContact CB-CB 4.16Å; F64-K118 HydrophobicContact CB-CG 4.03Å; F64-K118 HydrophobicContact CD1-CB 3.96Å; F64-K118 HydrophobicContact CD1-CG 3.71Å; F64-K118 HydrophobicContact CG-CB 4.38Å; F64-K118 HydrophobicContact CG-CG 4.32Å
65N82.7Confident82.9Confident43 Ų4357.5 Ų57.523%0.2329%0.289CS..  trans-59.5120179.2179.4-70.1000111Q63 E67 L68 E69Q63-N65 PolarHBondContact O-N 3.25Å; N65-E67 VanDerWaalsContact C-N 3.28Å; N65-E67 PolarHBondContact O-N 2.98Å; N65-E67 WeakPolarHBondContact OD1-CA 3.26Å; N65-E67 VanDerWaalsContact OD1-CB 3.3Å; N65-E67 WeakPolarHBondContact OD1-CB 3.17Å; N65-E67 PolarHBondContact OD1-N 2.96Å; N65-L68 HydrophobicContact CB-CB 4.21Å; N65-L68 HydrophobicContact CB-CD1 4.1Å; N65-L68 HydrophobicContact CB-CG 4.16Å; N65-L68 PolarHBondContact O-N 3.35Å; N65-L68 PolarHBondContact OD1-N 3.07Å; N65-E69 PolarHBondContact O-N 2.92Å
66A78.8Confident81.9Confident64 Ų6456.9 Ų56.953%0.52928%0.282SS..Hα-helixtrans-64.2-27.2-175.100000114.3F64 T70F64-A66 PolarHBondContact O-N 2.83Å; A66-T70 PolarHBondContact O-N 3.36Å; A66-T70 VanDerWaalsContact O-N 3.15Å; A66-T70 PolarHBondContact O-OG1 2.92Å
67E77.9Confident80.7Confident149 Ų14956.5 Ų56.570%0.69629%0.291SS*.Hα-helixtrans-71.7-45.5176.2-57.3-178.6173.700110.5N65 E69 T70 Y71N65-E67 VanDerWaalsContact C-N 3.28Å; N65-E67 PolarHBondContact O-N 2.98Å; N65-E67 WeakPolarHBondContact OD1-CA 3.26Å; N65-E67 VanDerWaalsContact OD1-CB 3.3Å; N65-E67 WeakPolarHBondContact OD1-CB 3.17Å; N65-E67 PolarHBondContact OD1-N 2.96Å; E67-E69 VanDerWaalsContact C-N 3.29Å; E67-E69 PolarHBondContact O-N 3.32Å; E67-T70 PolarHBondContact O-N 3.08Å; E67-Y71 PolarHBondContact O-N 3.2Å
68L76.5Confident79.2Confident15 Ų1564.5 Ų64.58%0.07933%0.328CS..Hα-helixtrans-64.9-34.4174.5-66.6-175.6000112F64 N65 Y71 A72 L95 T98 W99F64-L68 HydrophobicContact CE1-CB 4.37Å; F64-L68 HydrophobicContact CE2-CB 3.81Å; F64-L68 HydrophobicContact CE2-CD1 4.19Å; F64-L68 HydrophobicContact CZ-CB 3.54Å; N65-L68 HydrophobicContact CB-CB 4.21Å; N65-L68 HydrophobicContact CB-CD1 4.1Å; N65-L68 HydrophobicContact CB-CG 4.16Å; N65-L68 PolarHBondContact O-N 3.35Å; N65-L68 PolarHBondContact OD1-N 3.07Å; L68-Y71 PolarHBondContact O-N 2.95Å; L68-A72 WeakPolarHBondContact O-CB 3.24Å; L68-A72 PolarHBondContact O-N 2.85Å; L68-L95 HydrophobicContact CB-CD2 4.15Å; L68-L95 HydrophobicContact CD2-CD2 4.39Å; L68-T98 HydrophobicContact CD1-CG2 4.19Å; L68-T98 HydrophobicContact CD2-CG2 3.66Å; L68-W99 HydrophobicContact CD1-CB 3.69Å; L68-W99 HydrophobicContact CD1-CG 4.2Å
69E76.9Confident77.6Confident36 Ų3662.5 Ų62.517%0.16833%0.325CS..Hα-helixtrans-58.9-48.9172.5-167.4-171.6158.300111.3F64 N65 E67 Y71 A72 K73 K118F64-E69 HydrophobicContact CD1-CB 3.84Å; F64-E69 HydrophobicContact CD1-CG 4.19Å; F64-E69 HydrophobicContact CE1-CB 3.83Å; F64-E69 HydrophobicContact CE1-CG 4.34Å; N65-E69 PolarHBondContact O-N 2.92Å; E67-E69 VanDerWaalsContact C-N 3.29Å; E67-E69 PolarHBondContact O-N 3.32Å; E69-Y71 VanDerWaalsContact C-N 3.3Å; E69-Y71 PolarHBondContact O-N 3.4Å; E69-A72 WeakPolarHBondContact O-CB 3.15Å; E69-A72 PolarHBondContact O-N 3.28Å; E69-A72 VanDerWaalsContact O-N 3.15Å; E69-K73 HydrophobicContact CG-CD 4.43Å; E69-K73 VanDerWaalsContact O-CG 3.24Å; E69-K73 WeakPolarHBondContact O-CG 3.41Å; E69-K73 PolarHBondContact O-N 3.05Å; E69-K73 WeakPolarHBondContact OE1-CE 3.29Å; E69-K73 IonicContact OE1-NZ 2.76Å; E69-K73 PolarHBondContact OE1-NZ 2.92Å; E69-K118 HydrophobicContact CG-CG 4.34Å
70T78.5Confident76.1Confident82 Ų8260.5 Ų60.550%0.50332%0.315SS..Hα-helixtrans-60.6-40.4179.5-57.60000112A66 E67 K73 N74A66-T70 PolarHBondContact O-N 3.36Å; A66-T70 VanDerWaalsContact O-N 3.15Å; A66-T70 PolarHBondContact O-OG1 2.92Å; E67-T70 PolarHBondContact O-N 3.08Å; T70-K73 PolarHBondContact O-N 3.18Å; T70-N74 PolarHBondContact O-N 3.24Å; T70-N74 PolarHBondContact O-ND2 2.72Å
71Y75.7Confident74.6Confident136 Ų13668.2 Ų68.253%0.53335%0.351SS..Hα-helixtrans-63.2-43.9175.2178.6-105.9000112.2E67 L68 E69 K73 N74 I75 L95E67-Y71 PolarHBondContact O-N 3.2Å; L68-Y71 PolarHBondContact O-N 2.95Å; E69-Y71 VanDerWaalsContact C-N 3.3Å; E69-Y71 PolarHBondContact O-N 3.4Å; Y71-K73 PolarHBondContact O-N 3.17Å; Y71-N74 PolarHBondContact O-N 2.98Å; Y71-I75 HydrophobicContact CD1-CD1 3.91Å; Y71-I75 HydrophobicContact CE1-CD1 3.35Å; Y71-I75 HydrophobicContact CE2-CD1 4.27Å; Y71-I75 PolarHBondContact O-N 3Å; Y71-L95 HydrophobicContact CD1-CD2 4.02Å
72A73.7Confident73.1Confident0 Ų078 Ų780%040%0.397CS..Hα-helixtrans-64.9-38.4179.700000113.1L68 E69 N74 I75 I76 T91 L95 L119L68-A72 WeakPolarHBondContact O-CB 3.24Å; L68-A72 PolarHBondContact O-N 2.85Å; E69-A72 WeakPolarHBondContact O-CB 3.15Å; E69-A72 PolarHBondContact O-N 3.28Å; E69-A72 VanDerWaalsContact O-N 3.15Å; A72-N74 VanDerWaalsContact C-N 3.29Å; A72-N74 PolarHBondContact O-N 3.18Å; A72-I75 PolarHBondContact O-N 3.29Å; A72-I76 WeakPolarHBondContact O-CG1 3.31Å; A72-I76 PolarHBondContact O-N 3.41Å; A72-T91 HydrophobicContact CB-CG2 4.33Å; A72-L95 HydrophobicContact CB-CD1 3.41Å; A72-L95 VanDerWaalsContact CB-CD1 3.41Å; A72-L95 HydrophobicContact CB-CD2 4.43Å; A72-L119 HydrophobicContact CB-CD2 3.63Å
73K75.7Confident71.9Confident57 Ų5780 Ų8025%0.24840%0.404CS..Hα-helixtrans-57.7-41178.1-73.9-179.2174.2163.10112.4E69 T70 Y71 A77 Y122E69-K73 HydrophobicContact CG-CD 4.43Å; E69-K73 VanDerWaalsContact O-CG 3.24Å; E69-K73 WeakPolarHBondContact O-CG 3.41Å; E69-K73 PolarHBondContact O-N 3.05Å; E69-K73 WeakPolarHBondContact OE1-CE 3.29Å; E69-K73 IonicContact OE1-NZ 2.76Å; E69-K73 PolarHBondContact OE1-NZ 2.92Å; T70-K73 PolarHBondContact O-N 3.18Å; Y71-K73 PolarHBondContact O-N 3.17Å; K73-A77 VanDerWaalsContact O-CB 3.32Å; K73-A77 WeakPolarHBondContact O-CB 3.5Å; K73-A77 PolarHBondContact O-N 2.97Å; K73-Y122 HydrophobicContact CB-CD1 4.45Å; K73-Y122 HydrophobicContact CB-CE1 3.77Å; K73-Y122 HydrophobicContact CB-CE2 4.03Å; K73-Y122 WeakPolarHBondContact CB-OH 3.49Å; K73-Y122 HydrophobicContact CD-CD2 3.78Å; K73-Y122 HydrophobicContact CD-CE2 3.45Å; K73-Y122 VanDerWaalsContact CD-CE2 3.45Å; K73-Y122 HydrophobicContact CD-CG 4.43Å; K73-Y122 HydrophobicContact CG-CD1 3.86Å; K73-Y122 HydrophobicContact CG-CD2 3.68Å; K73-Y122 HydrophobicContact CG-CE1 3.62Å; K73-Y122 HydrophobicContact CG-CE2 3.41Å; K73-Y122 VanDerWaalsContact CG-CE2 3.41Å; K73-Y122 HydrophobicContact CG-CG 3.87Å
74N72.6Confident70.9Confident99 Ų9976.7 Ų76.753%0.52939%0.393SS..Hα-helixtrans-67.1-43.6178.8-67-24000111.6T70 Y71 A72 I76 E78T70-N74 PolarHBondContact O-N 3.24Å; T70-N74 PolarHBondContact O-ND2 2.72Å; Y71-N74 PolarHBondContact O-N 2.98Å; A72-N74 VanDerWaalsContact C-N 3.29Å; A72-N74 PolarHBondContact O-N 3.18Å; N74-I76 PolarHBondContact O-N 2.97Å; N74-E78 WeakPolarHBondContact O-CG 3.42Å; N74-E78 PolarHBondContact O-N 3.26Å
75I71.3Confident70.2Confident46 Ų4677.3 Ų77.324%0.23640%0.403CS..Hα-helixtrans-64.1-43.9178.9-64.8172000111.2Y71 A72 E78 T79 I87Y71-I75 HydrophobicContact CD1-CD1 3.91Å; Y71-I75 HydrophobicContact CE1-CD1 3.35Å; Y71-I75 HydrophobicContact CE2-CD1 4.27Å; Y71-I75 PolarHBondContact O-N 3Å; A72-I75 PolarHBondContact O-N 3.29Å; I75-E78 PolarHBondContact O-N 2.86Å; I75-T79 PolarHBondContact O-OG1 3.24Å; I75-I87 HydrophobicContact CG2-CG2 4.25Å
76I69.8Low69.9Low4 Ų478 Ų782%0.02141%0.414CS..Hα-helixtrans-70.8-40.6-176.2-75.3168.2000111.9A72 N74 E78 T79 I80 L119 Y122 M123 I126A72-I76 WeakPolarHBondContact O-CG1 3.31Å; A72-I76 PolarHBondContact O-N 3.41Å; N74-I76 PolarHBondContact O-N 2.97Å; I76-E78 PolarHBondContact O-N 3.35Å; I76-T79 PolarHBondContact O-N 2.88Å; I76-I80 WeakPolarHBondContact O-CG1 3.45Å; I76-L119 HydrophobicContact CD1-CB 4.23Å; I76-L119 HydrophobicContact CD1-CD1 3.99Å; I76-L119 HydrophobicContact CD1-CD2 3.6Å; I76-L119 HydrophobicContact CD1-CG 4.12Å; I76-Y122 HydrophobicContact CB-CE1 4.47Å; I76-Y122 HydrophobicContact CG2-CD1 4.33Å; I76-Y122 HydrophobicContact CG2-CE1 4.22Å; I76-M123 HydrophobicContact CB-CE 4.33Å; I76-M123 HydrophobicContact CD1-CE 4.38Å; I76-M123 HydrophobicContact CG1-CE 4.21Å; I76-M123 HydrophobicContact CG2-CE 3.29Å; I76-M123 HydrophobicContact CG2-CG 3.77Å; I76-M123 HydrophobicContact CG2-SD 4.29Å; I76-I126 HydrophobicContact CG2-CD1 4.38Å
77A66.6Low69.8Low52 Ų5277 Ų7743%0.4340%0.4SS..Hα-helixtrans-60.1-33.2178.100000112.4K73 T79K73-A77 VanDerWaalsContact O-CB 3.32Å; K73-A77 WeakPolarHBondContact O-CB 3.5Å; K73-A77 PolarHBondContact O-N 2.97Å; A77-T79 VanDerWaalsContact C-N 3.29Å; A77-T79 PolarHBondContact O-N 3.01Å
78E63.3Low70Confident172 Ų17270 Ų7080%0.80437%0.367SS*.THydrogen-bonded Turntrans-77-11.9178.6-70.1178.6-177.300113.6N74 I75 I76N74-E78 WeakPolarHBondContact O-CG 3.42Å; N74-E78 PolarHBondContact O-N 3.26Å; I75-E78 PolarHBondContact O-N 2.86Å; I76-E78 PolarHBondContact O-N 3.35Å
79T57.6Low70.4Confident32 Ų3273.3 Ų73.320%0.19638%0.382CS..THydrogen-bonded Turntrans-12026.1-166.1-40.90000114.5I75 I76 A77 Q81 I87I75-T79 PolarHBondContact O-OG1 3.24Å; I76-T79 PolarHBondContact O-N 2.88Å; A77-T79 VanDerWaalsContact C-N 3.29Å; A77-T79 PolarHBondContact O-N 3.01Å; T79-Q81 PolarHBondContact O-N 3.23Å; T79-I87 HydrophobicContact CG2-CB 3.95Å; T79-I87 HydrophobicContact CG2-CD1 3.09Å; T79-I87 HydrophobicContact CG2-CG1 4.04Å; T79-I87 HydrophobicContact CG2-CG2 3.85Å
80I59.8Low70.8Confident81 Ų8176.4 Ų76.442%0.41540%0.4SS..  trans-77.236.8-178.1-50.6-179.9000112.4I76 I126 A127 V130I76-I80 WeakPolarHBondContact O-CG1 3.45Å; I80-I126 HydrophobicContact CD1-CD1 4.24Å; I80-A127 HydrophobicContact CD1-CB 4Å; I80-V130 HydrophobicContact CG2-CG2 3.87Å
81Q58.9Low71.3Confident165 Ų16573 Ų7377%0.77138%0.379SS*.SBendtrans-139.7147.3175.2-97.9-178.1-37.300111.2T79 Q83T79-Q81 PolarHBondContact O-N 3.23Å; Q81-Q83 PolarHBondContact O-N 2.84Å
82E57.8Low71.9Confident204 Ų20466.6 Ų66.695%0.95335%0.354SS*.SBendtrans23.8-23171.8-67.9-175.2175.600122.1
83Q63Low72.8Confident132 Ų13268.9 Ų68.962%0.61737%0.365SS*.  trans-112.714.3178.7-61.1-172.925.700114Q81 G85 A86 I87Q81-Q83 PolarHBondContact O-N 2.84Å; Q83-G85 PolarHBondContact O-N 3.28Å; Q83-G85 VanDerWaalsContact O-N 3.08Å; Q83-A86 PolarHBondContact O-N 3.48Å; Q83-I87 HydrophobicContact CB-CD1 3.96Å; Q83-I87 PolarHBondContact O-N 2.98Å
84A67Low73.5Confident31 Ų3169.1 Ų69.126%0.25637%0.373SS..Hα-helixtrans-52.4-36.2-174.500000114L88A84-L88 WeakPolarHBondContact O-CB 3.18Å; A84-L88 PolarHBondContact O-N 3.45Å
85G70.1Confident74.3Confident24 Ų2464.5 Ų64.525%0.24735%0.349CS..Hα-helixtrans-68.6-47.2-178.700000114.6Q83 Q89Q83-G85 PolarHBondContact O-N 3.28Å; Q83-G85 VanDerWaalsContact O-N 3.08Å; G85-Q89 PolarHBondContact O-N 2.91Å; G85-Q89 VanDerWaalsContact O-N 3.09Å
86A76Confident75.3Confident57 Ų5762.3 Ų62.347%0.47134%0.338SS..Hα-helixtrans-70.3-37-17900000111.7Q83 Q89 N90Q83-A86 PolarHBondContact O-N 3.48Å; A86-Q89 PolarHBondContact O-N 3.22Å; A86-N90 WeakPolarHBondContact O-CB 3.44Å; A86-N90 VanDerWaalsContact O-CG 3.29Å; A86-N90 PolarHBondContact O-N 3.39Å; A86-N90 PolarHBondContact O-ND2 2.95Å
87I78Confident76.3Confident43 Ų4367.8 Ų67.822%0.22136%0.361CS..Hα-helixtrans-71.1-41.8179.3-69.4171.5000110.1I75 T79 Q83 Q89 N90 T91I75-I87 HydrophobicContact CG2-CG2 4.25Å; T79-I87 HydrophobicContact CG2-CB 3.95Å; T79-I87 HydrophobicContact CG2-CD1 3.09Å; T79-I87 HydrophobicContact CG2-CG1 4.04Å; T79-I87 HydrophobicContact CG2-CG2 3.85Å; Q83-I87 HydrophobicContact CB-CD1 3.96Å; Q83-I87 PolarHBondContact O-N 2.98Å; I87-Q89 VanDerWaalsContact C-N 3.34Å; I87-Q89 PolarHBondContact O-N 3.27Å; I87-N90 PolarHBondContact O-N 3.27Å; I87-T91 VanDerWaalsContact O-CB 3.29Å; I87-T91 WeakPolarHBondContact O-CB 3.41Å; I87-T91 PolarHBondContact O-N 2.95Å; I87-T91 PolarHBondContact O-OG1 3.15Å
88L81.9Confident77.5Confident3 Ų367.8 Ų67.82%0.01636%0.356CS..Hα-helixtrans-54.2-50.2170.8178.973.2000111.8A84 N90 T91 V92 L119 V134 M138A84-L88 WeakPolarHBondContact O-CB 3.18Å; A84-L88 PolarHBondContact O-N 3.45Å; L88-N90 PolarHBondContact O-N 3.19Å; L88-T91 PolarHBondContact O-N 3.25Å; L88-V92 HydrophobicContact CD1-CG2 4.29Å; L88-V92 HydrophobicContact CG-CG2 4.37Å; L88-V92 VanDerWaalsContact O-CG2 3.26Å; L88-V92 WeakPolarHBondContact O-CG2 3.46Å; L88-V92 PolarHBondContact O-N 3.46Å; L88-L119 HydrophobicContact CD1-CB 4.29Å; L88-L119 HydrophobicContact CD1-CD1 4.17Å; L88-V134 HydrophobicContact CD1-CG1 4.45Å; L88-V134 HydrophobicContact CD2-CG1 3.5Å; L88-V134 VanDerWaalsContact CD2-CG1 3.5Å; L88-M138 HydrophobicContact CD1-CE 4.33Å; L88-M138 HydrophobicContact CD2-CB 4.31Å; L88-M138 HydrophobicContact CD2-CE 4.07Å
89Q84.6Confident78.8Confident83 Ų8360.7 Ų60.739%0.38832%0.322SS..Hα-helixtrans-59.7-49.3-179.8177.5174-4.400111.8G85 A86 I87 T91 V92 E93 M141G85-Q89 PolarHBondContact O-N 2.91Å; G85-Q89 VanDerWaalsContact O-N 3.09Å; A86-Q89 PolarHBondContact O-N 3.22Å; I87-Q89 VanDerWaalsContact C-N 3.34Å; I87-Q89 PolarHBondContact O-N 3.27Å; Q89-T91 VanDerWaalsContact C-N 3.29Å; Q89-T91 PolarHBondContact O-N 3.38Å; Q89-V92 PolarHBondContact O-N 2.99Å; Q89-E93 HydrophobicContact CG-CG 4.48Å; Q89-E93 PolarHBondContact NE2-OE1 3.35Å; Q89-E93 WeakPolarHBondContact O-CG 3.45Å; Q89-E93 PolarHBondContact O-N 3Å; Q89-M141 HydrophobicContact CB-CG 4.34Å; Q89-M141 HydrophobicContact CB-SD 4.07Å; Q89-M141 HydrophobicContact CG-CG 3.94Å; Q89-M141 HydrophobicContact CG-SD 4.01Å
90N86Confident80.4Confident102 Ų10260.6 Ų60.655%0.54532%0.322SS..Hα-helixtrans-60.6-40.5178.6-71.8-27.2000111.9A86 I87 L88 S94A86-N90 WeakPolarHBondContact O-CB 3.44Å; A86-N90 VanDerWaalsContact O-CG 3.29Å; A86-N90 PolarHBondContact O-N 3.39Å; A86-N90 PolarHBondContact O-ND2 2.95Å; I87-N90 PolarHBondContact O-N 3.27Å; L88-N90 PolarHBondContact O-N 3.19Å; N90-S94 WeakPolarHBondContact O-CB 3.1Å; N90-S94 PolarHBondContact O-N 3.41Å
91T87.6Confident81.8Confident11 Ų1160.9 Ų60.97%0.06734%0.337CS..Hα-helixtrans-64.4-47.3176.8-64.60000110.9A72 I87 L88 Q89 E93 S94 L95 L119A72-T91 HydrophobicContact CB-CG2 4.33Å; I87-T91 VanDerWaalsContact O-CB 3.29Å; I87-T91 WeakPolarHBondContact O-CB 3.41Å; I87-T91 PolarHBondContact O-N 2.95Å; I87-T91 PolarHBondContact O-OG1 3.15Å; L88-T91 PolarHBondContact O-N 3.25Å; Q89-T91 VanDerWaalsContact C-N 3.29Å; Q89-T91 PolarHBondContact O-N 3.38Å; T91-E93 PolarHBondContact O-N 3.22Å; T91-S94 PolarHBondContact O-N 3.26Å; T91-L95 HydrophobicContact CG2-CD1 3.49Å; T91-L95 VanDerWaalsContact CG2-CD1 3.49Å; T91-L95 HydrophobicContact CG2-CG 4.2Å; T91-L95 WeakPolarHBondContact O-CB 3.28Å; T91-L95 WeakPolarHBondContact O-CD1 3.39Å; T91-L95 WeakPolarHBondContact O-CG 3.2Å; T91-L95 PolarHBondContact O-N 3.37Å; T91-L119 HydrophobicContact CG2-CD1 3.94Å
92V89.8Confident83.2Confident0 Ų058 Ų580%032%0.323CS..Hα-helixtrans-58.9-51.5177.2173.40000110.3L88 Q89 S94 L95 S96 F112 V115 A116 L119 M141L88-V92 HydrophobicContact CD1-CG2 4.29Å; L88-V92 HydrophobicContact CG-CG2 4.37Å; L88-V92 VanDerWaalsContact O-CG2 3.26Å; L88-V92 WeakPolarHBondContact O-CG2 3.46Å; L88-V92 PolarHBondContact O-N 3.46Å; Q89-V92 PolarHBondContact O-N 2.99Å; V92-S94 PolarHBondContact O-N 2.86Å; V92-L95 PolarHBondContact O-N 3.01Å; V92-S96 VanDerWaalsContact O-CB 3.26Å; V92-S96 WeakPolarHBondContact O-CB 3.45Å; V92-S96 PolarHBondContact O-N 3.13Å; V92-S96 PolarHBondContact O-OG 2.95Å; V92-F112 HydrophobicContact CG1-CD1 4.49Å; V92-F112 HydrophobicContact CG1-CD2 3.59Å; V92-F112 HydrophobicContact CG1-CE1 4.42Å; V92-F112 HydrophobicContact CG1-CE2 3.51Å; V92-F112 HydrophobicContact CG1-CG 4.11Å; V92-F112 HydrophobicContact CG1-CZ 3.96Å; V92-V115 HydrophobicContact CB-CG1 4.24Å; V92-V115 HydrophobicContact CG1-CB 4.42Å; V92-V115 HydrophobicContact CG1-CG1 4.12Å; V92-V115 HydrophobicContact CG2-CG1 4.19Å; V92-A116 HydrophobicContact CG1-CB 4.34Å; V92-A116 HydrophobicContact CG2-CB 4.47Å; V92-L119 HydrophobicContact CG2-CD1 3.72Å; V92-M141 HydrophobicContact CB-CE 4.21Å; V92-M141 HydrophobicContact CB-SD 3.92Å; V92-M141 HydrophobicContact CG1-CE 3.95Å; V92-M141 HydrophobicContact CG1-SD 4.03Å; V92-M141 HydrophobicContact CG2-CE 4Å; V92-M141 HydrophobicContact CG2-SD 4.14Å
93E90.9Very high84.5Confident49 Ų4951.1 Ų51.123%0.22929%0.293CS..Hα-helixtrans-62-43-179.1-71.9-176.4-161.500112.5Q89 T91 K97 F112Q89-E93 HydrophobicContact CG-CG 4.48Å; Q89-E93 PolarHBondContact NE2-OE1 3.35Å; Q89-E93 WeakPolarHBondContact O-CG 3.45Å; Q89-E93 PolarHBondContact O-N 3Å; T91-E93 PolarHBondContact O-N 3.22Å; E93-K97 VanDerWaalsContact O-CG 3.28Å; E93-K97 WeakPolarHBondContact O-CG 3.45Å; E93-K97 PolarHBondContact O-N 2.88Å; E93-K97 VanDerWaalsContact O-N 3.08Å; E93-K97 IonicContact OE2-NZ 3.73Å; E93-F112 HydrophobicContact CG-CE2 4.3Å
94S90.4Very high85.5Confident61 Ų6150.7 Ų50.743%0.42731%0.305SS..Hα-helixtrans-63.1-52.3179.5-174.60000111N90 T91 V92 S96 K97 T98N90-S94 WeakPolarHBondContact O-CB 3.1Å; N90-S94 PolarHBondContact O-N 3.41Å; T91-S94 PolarHBondContact O-N 3.26Å; V92-S94 PolarHBondContact O-N 2.86Å; S94-S96 VanDerWaalsContact C-N 3.32Å; S94-S96 PolarHBondContact O-N 3.42Å; S94-K97 PolarHBondContact O-N 3.47Å; S94-T98 PolarHBondContact O-N 2.92Å; S94-T98 PolarHBondContact O-OG1 3.47Å; S94-T98 VanDerWaalsContact O-OG1 3.06Å
95L90.4Very high86.4Confident3 Ų354.1 Ų54.12%0.01633%0.327CS..Hα-helixtrans-63.4-38.4-179.6-67.4169.9000112.1F64 L68 Y71 A72 T91 V92 T98 W99 V115 L119F64-L95 HydrophobicContact CZ-CB 4.23Å; F64-L95 HydrophobicContact CZ-CD1 4.12Å; F64-L95 HydrophobicContact CZ-CD2 4.47Å; L68-L95 HydrophobicContact CB-CD2 4.15Å; L68-L95 HydrophobicContact CD2-CD2 4.39Å; Y71-L95 HydrophobicContact CD1-CD2 4.02Å; A72-L95 HydrophobicContact CB-CD1 3.41Å; A72-L95 VanDerWaalsContact CB-CD1 3.41Å; A72-L95 HydrophobicContact CB-CD2 4.43Å; T91-L95 HydrophobicContact CG2-CD1 3.49Å; T91-L95 VanDerWaalsContact CG2-CD1 3.49Å; T91-L95 HydrophobicContact CG2-CG 4.2Å; T91-L95 WeakPolarHBondContact O-CB 3.28Å; T91-L95 WeakPolarHBondContact O-CD1 3.39Å; T91-L95 WeakPolarHBondContact O-CG 3.2Å; T91-L95 PolarHBondContact O-N 3.37Å; V92-L95 PolarHBondContact O-N 3.01Å; L95-T98 PolarHBondContact O-N 3.33Å; L95-W99 WeakPolarHBondContact O-CB 3.38Å; L95-W99 PolarHBondContact O-N 2.87Å; L95-V115 HydrophobicContact CB-CG1 3.93Å; L95-V115 HydrophobicContact CB-CG2 4.17Å; L95-V115 HydrophobicContact CD1-CG1 3.93Å; L95-L119 HydrophobicContact CD1-CD1 4.28Å
96S91.4Very high87.3Confident0 Ų054.1 Ų54.10%032%0.321CS..Hα-helixtrans-61.7-45.6176.6-55.80000111V92 S94 W99 C100 F112V92-S96 VanDerWaalsContact O-CB 3.26Å; V92-S96 WeakPolarHBondContact O-CB 3.45Å; V92-S96 PolarHBondContact O-N 3.13Å; V92-S96 PolarHBondContact O-OG 2.95Å; S94-S96 VanDerWaalsContact C-N 3.32Å; S94-S96 PolarHBondContact O-N 3.42Å; S96-W99 PolarHBondContact O-N 3.45Å; S96-C100 PolarHBondContact O-N 3.03Å; S96-C100 PolarHBondContact O-SG 3.09Å; S96-C100 VanDerWaalsContact O-SG 3.32Å; S96-F112 WeakPolarHBondContact OG-CA 3.25Å
97K92Very high88Confident118 Ų11853.4 Ų53.451%0.51332%0.315SS..Hα-helixtrans-64.4-43.3175.9-71.5167.2-173.6161.80111.7E93 S94 W99 C100 A101 Y108E93-K97 VanDerWaalsContact O-CG 3.28Å; E93-K97 WeakPolarHBondContact O-CG 3.45Å; E93-K97 PolarHBondContact O-N 2.88Å; E93-K97 VanDerWaalsContact O-N 3.08Å; E93-K97 IonicContact OE2-NZ 3.73Å; S94-K97 PolarHBondContact O-N 3.47Å; K97-W99 VanDerWaalsContact C-N 3.34Å; K97-C100 PolarHBondContact O-N 3.25Å; K97-A101 WeakPolarHBondContact O-CB 3.49Å; K97-A101 PolarHBondContact O-N 2.96Å; K97-Y108 HydrophobicContact CG-CD2 4.46Å; K97-Y108 HydrophobicContact CG-CE2 3.93Å
98T90.9Very high88.8Confident53 Ų5354.2 Ų54.233%0.32532%0.316SS..Hα-helixtrans-62.3-42.7177.5-58.50000111.3L68 S94 L95 A101 Q102L68-T98 HydrophobicContact CD1-CG2 4.19Å; L68-T98 HydrophobicContact CD2-CG2 3.66Å; S94-T98 PolarHBondContact O-N 2.92Å; S94-T98 PolarHBondContact O-OG1 3.47Å; S94-T98 VanDerWaalsContact O-OG1 3.06Å; L95-T98 PolarHBondContact O-N 3.33Å; T98-A101 WeakPolarHBondContact O-CB 3.42Å; T98-A101 PolarHBondContact O-N 3.39Å; T98-Q102 WeakPolarHBondContact O-CG 3.25Å; T98-Q102 PolarHBondContact O-N 3.42Å; T98-Q102 VanDerWaalsContact O-N 3.11Å
99W90.4Very high89.4Confident22 Ų2256.4 Ų56.48%0.08333%0.326CS..Hα-helixtrans-66.4-45.2179-167.87000111.6Q63 F64 L68 L95 S96 K97 A101 Q102 D103 L106 A111 A114 V115Q63-W99 HydrophobicContact CB-CH2 4.43Å; Q63-W99 VanDerWaalsContact O-CH2 3.24Å; Q63-W99 WeakPolarHBondContact O-CH2 3.34Å; Q63-W99 WeakPolarHBondContact O-CZ2 3.31Å; F64-W99 VanDerWaalsContact CA-CH2 3.41Å; F64-W99 HydrophobicContact CB-CH2 4.33Å; F64-W99 HydrophobicContact CB-CZ3 4.19Å; F64-W99 HydrophobicContact CD2-CD2 4.09Å; F64-W99 AromaticContact CD2-CE3 3.44Å; F64-W99 HydrophobicContact CD2-CE3 3.44Å; F64-W99 VanDerWaalsContact CD2-CE3 3.44Å; F64-W99 HydrophobicContact CD2-CH2 4.22Å; F64-W99 AromaticContact CD2-CZ3 3.49Å; F64-W99 HydrophobicContact CD2-CZ3 3.49Å; F64-W99 VanDerWaalsContact CD2-CZ3 3.49Å; F64-W99 HydrophobicContact CE2-CD2 4.4Å; F64-W99 AromaticContact CE2-CE3 3.89Å; F64-W99 HydrophobicContact CE2-CE3 3.89Å; F64-W99 HydrophobicContact CE2-CZ3 4.37Å; F64-W99 HydrophobicContact CG-CZ3 4.3Å; L68-W99 HydrophobicContact CD1-CB 3.69Å; L68-W99 HydrophobicContact CD1-CG 4.2Å; L95-W99 WeakPolarHBondContact O-CB 3.38Å; L95-W99 PolarHBondContact O-N 2.87Å; S96-W99 PolarHBondContact O-N 3.45Å; K97-W99 VanDerWaalsContact C-N 3.34Å; W99-A101 PolarHBondContact O-N 2.93Å; W99-Q102 CarbonylContact O-C 3.56Å; W99-Q102 PolarHBondContact O-N 3.45Å; W99-D103 PolarHBondContact O-N 3.39Å; W99-L106 HydrophobicContact CD2-CD2 3.33Å; W99-L106 HydrophobicContact CE3-CD2 3.71Å; W99-L106 HydrophobicContact CG-CD2 3.71Å; W99-L106 HydrophobicContact CH2-CD2 4.08Å; W99-L106 HydrophobicContact CZ2-CD2 3.74Å; W99-L106 HydrophobicContact CZ3-CD2 4.08Å; W99-A111 HydrophobicContact CE3-CB 3.99Å; W99-A114 HydrophobicContact CH2-CB 4.04Å; W99-A114 HydrophobicContact CZ3-CB 3.54Å; W99-V115 HydrophobicContact CE3-CG2 4.17Å
100C90.8Very high89.8Confident30 Ų3054.8 Ų54.820%0.20332%0.317CS..Hα-helixtrans-61-29.7173.2-69.20000113.4S96 K97 Q102 D103 L106 Y108S96-C100 PolarHBondContact O-N 3.03Å; S96-C100 PolarHBondContact O-SG 3.09Å; S96-C100 VanDerWaalsContact O-SG 3.32Å; K97-C100 PolarHBondContact O-N 3.25Å; C100-Q102 VanDerWaalsContact C-N 3.33Å; C100-D103 CarbonylContact O-C 3.34Å; C100-D103 VanDerWaalsContact O-O 3.06Å; C100-L106 PolarHBondContact SG-O 3.38Å; C100-L106 VanDerWaalsContact SG-O 3.34Å; C100-Y108 VanDerWaalsContact SG-CA 3.54Å
101A90.3Very high90.1Very high88 Ų8850 Ų5073%0.72729%0.291SS*.Hα-helixtrans-72.4-28.2174.400000112.5K97 T98 W99K97-A101 WeakPolarHBondContact O-CB 3.49Å; K97-A101 PolarHBondContact O-N 2.96Å; T98-A101 WeakPolarHBondContact O-CB 3.42Å; T98-A101 PolarHBondContact O-N 3.39Å; W99-A101 PolarHBondContact O-N 2.93Å
102Q87.4Confident90.4Very high104 Ų10449.4 Ų49.449%0.48629%0.287SS..Hα-helixtrans-83.7-35.1175.6-68.5177.23.300112.4T98 W99 C100T98-Q102 WeakPolarHBondContact O-CG 3.25Å; T98-Q102 PolarHBondContact O-N 3.42Å; T98-Q102 VanDerWaalsContact O-N 3.11Å; W99-Q102 CarbonylContact O-C 3.56Å; W99-Q102 PolarHBondContact O-N 3.45Å; C100-Q102 VanDerWaalsContact C-N 3.33Å
103D86.1Confident90.6Very high59 Ų5949.5 Ų49.532%0.31629%0.288SS..  trans-122.397.2178-174.9-8.9000110.1W99 C100 S105 L106W99-D103 PolarHBondContact O-N 3.39Å; C100-D103 CarbonylContact O-C 3.34Å; C100-D103 VanDerWaalsContact O-O 3.06Å; D103-S105 PolarHBondContact O-N 2.85Å; D103-S105 WeakPolarHBondContact OD1-CB 3.26Å; D103-S105 PolarHBondContact OD1-N 3.27Å; D103-S105 PolarHBondContact OD1-OG 3.4Å; D103-L106 HydrophobicContact CB-CB 4.12Å; D103-L106 WeakPolarHBondContact O-CB 3.45Å; D103-L106 PolarHBondContact O-N 3.5Å; D103-L106 VanDerWaalsContact O-N 3.15Å
104S83Confident90.8Very high124 Ų12447.2 Ų47.287%0.86728%0.277SS*.THydrogen-bonded Turntrans-69.5-10.6-178.657.40000114.2
105S87.6Confident90.8Very high103 Ų10344.3 Ų44.372%0.7226%0.257SS*.THydrogen-bonded Turntrans-86.6-14.917575.40000112.8D103D103-S105 PolarHBondContact O-N 2.85Å; D103-S105 WeakPolarHBondContact OD1-CB 3.26Å; D103-S105 PolarHBondContact OD1-N 3.27Å; D103-S105 PolarHBondContact OD1-OG 3.4Å
106L87.4Confident90.9Very high23 Ų2344.2 Ų44.212%0.1226%0.257CS..SBendtrans-85.4118.3-176-174.364.3000111.6W99 C100 D103 R110 A111W99-L106 HydrophobicContact CD2-CD2 3.33Å; W99-L106 HydrophobicContact CE3-CD2 3.71Å; W99-L106 HydrophobicContact CG-CD2 3.71Å; W99-L106 HydrophobicContact CH2-CD2 4.08Å; W99-L106 HydrophobicContact CZ2-CD2 3.74Å; W99-L106 HydrophobicContact CZ3-CD2 4.08Å; C100-L106 PolarHBondContact SG-O 3.38Å; C100-L106 VanDerWaalsContact SG-O 3.34Å; D103-L106 HydrophobicContact CB-CB 4.12Å; D103-L106 WeakPolarHBondContact O-CB 3.45Å; D103-L106 PolarHBondContact O-N 3.5Å; D103-L106 VanDerWaalsContact O-N 3.15Å; L106-R110 HydrophobicContact CD1-CB 3.99Å; L106-A111 HydrophobicContact CD2-CB 3.63Å; L106-A111 HydrophobicContact CG-CB 4.02Å
107A92.3Very high91Very high43 Ų4344.6 Ų44.636%0.35526%0.259SS..  trans-63.3140.1171.300000111.1E109 R110 A111A107-E109 PolarHBondContact O-N 3.29Å; A107-R110 PolarHBondContact O-N 2.91Å; A107-A111 PolarHBondContact O-N 3.01Å
108Y93Very high90.9Very high60 Ų6040 Ų4024%0.23524%0.239CC..Hα-helixtrans-57.2-39.1-179.4174.1-100.7000112.2K97 C100 R110 A111 F112K97-Y108 HydrophobicContact CG-CD2 4.46Å; K97-Y108 HydrophobicContact CG-CE2 3.93Å; C100-Y108 VanDerWaalsContact SG-CA 3.54Å; Y108-R110 VanDerWaalsContact C-N 3.35Å; Y108-R110 PolarHBondContact O-N 2.93Å; Y108-A111 PolarHBondContact O-N 2.92Å; Y108-F112 HydrophobicContact CE1-CB 4.47Å; Y108-F112 HydrophobicContact CE1-CD2 4.3Å; Y108-F112 WeakPolarHBondContact O-CB 3.49Å; Y108-F112 PolarHBondContact O-N 2.86Å
109E94.6Very high90.8Very high48 Ų4837.6 Ų37.622%0.22422%0.224CC..Hα-helixtrans-67-38-177.5-61.885177.600112.1A107 L113 A147 I148 F151A107-E109 PolarHBondContact O-N 3.29Å; E109-L113 WeakPolarHBondContact O-CG 3.38Å; E109-L113 PolarHBondContact O-N 3.04Å; E109-A147 HydrophobicContact CG-CB 4.36Å; E109-I148 VanDerWaalsContact CA-CD1 3.47Å; E109-I148 HydrophobicContact CB-CD1 3.68Å; E109-I148 HydrophobicContact CG-CD1 3.85Å; E109-F151 HydrophobicContact CB-CB 3.8Å; E109-F151 HydrophobicContact CB-CD1 3.52Å; E109-F151 HydrophobicContact CB-CD2 4.01Å; E109-F151 HydrophobicContact CB-CE1 4.02Å; E109-F151 HydrophobicContact CB-CE2 4.48Å; E109-F151 HydrophobicContact CB-CG 3.5Å; E109-F151 HydrophobicContact CB-CZ 4.48Å; E109-F151 HydrophobicContact CG-CB 3.66Å; E109-F151 HydrophobicContact CG-CD1 4.36Å; E109-F151 HydrophobicContact CG-CD2 4.43Å; E109-F151 HydrophobicContact CG-CG 3.92Å
110R92.9Very high90.7Very high50 Ų5036.5 Ų36.519%0.18922%0.22CC..Hα-helixtrans-65.9-48.2171.5-104.1-17667.498.91.1111.6L60 L106 A107 Y108 F112 L113 A114 F151 E162L60-R110 HydrophobicContact CD1-CG 4.2Å; L60-R110 VanDerWaalsContact CD1-NH2 3.32Å; L60-R110 HydrophobicContact CD2-CG 4.4Å; L106-R110 HydrophobicContact CD1-CB 3.99Å; A107-R110 PolarHBondContact O-N 2.91Å; Y108-R110 VanDerWaalsContact C-N 3.35Å; Y108-R110 PolarHBondContact O-N 2.93Å; R110-F112 PolarHBondContact O-N 3.48Å; R110-L113 PolarHBondContact O-N 2.85Å; R110-A114 VanDerWaalsContact O-CB 3.29Å; R110-A114 WeakPolarHBondContact O-CB 3.49Å; R110-A114 PolarHBondContact O-N 2.72Å; R110-F151 HydrophobicContact CG-CZ 4.08Å; R110-E162 WeakPolarHBondContact CD-OE1 3.46Å; R110-E162 WeakPolarHBondContact CG-OE1 3.5Å; R110-E162 IonicContact CZ-OE1 3.13Å; R110-E162 IonicContact CZ-OE2 2.94Å; R110-E162 IonicContact NE-OE1 3.94Å; R110-E162 IonicContact NH1-OE1 2.66Å; R110-E162 PolarHBondContact NH1-OE1 3.24Å; R110-E162 IonicContact NH1-OE2 3.82Å; R110-E162 PolarHBondContact NH1-OE2 2.85Å
111A92.8Very high90.7Very high0 Ų036.9 Ų36.90%022%0.219CC..Hα-helixtrans-57.2-43.1177.600000111.1W99 L106 A107 Y108 A114 V115W99-A111 HydrophobicContact CE3-CB 3.99Å; L106-A111 HydrophobicContact CD2-CB 3.63Å; L106-A111 HydrophobicContact CG-CB 4.02Å; A107-A111 PolarHBondContact O-N 3.01Å; Y108-A111 PolarHBondContact O-N 2.92Å; A111-A114 PolarHBondContact O-N 3.08Å; A111-V115 WeakPolarHBondContact O-CB 3.16Å; A111-V115 WeakPolarHBondContact O-CG2 3.24Å; A111-V115 PolarHBondContact O-N 2.82Å
112F94.4Very high90.4Very high0 Ų034.7 Ų34.70%019%0.192CC..Hα-helixtrans-62.5-49.3178.7-177.7-81.3000113.1V92 E93 S96 Y108 R110 V115 A116 M141 I142 I148V92-F112 HydrophobicContact CG1-CD1 4.49Å; V92-F112 HydrophobicContact CG1-CD2 3.59Å; V92-F112 HydrophobicContact CG1-CE1 4.42Å; V92-F112 HydrophobicContact CG1-CE2 3.51Å; V92-F112 HydrophobicContact CG1-CG 4.11Å; V92-F112 HydrophobicContact CG1-CZ 3.96Å; E93-F112 HydrophobicContact CG-CE2 4.3Å; S96-F112 WeakPolarHBondContact OG-CA 3.25Å; Y108-F112 HydrophobicContact CE1-CB 4.47Å; Y108-F112 HydrophobicContact CE1-CD2 4.3Å; Y108-F112 WeakPolarHBondContact O-CB 3.49Å; Y108-F112 PolarHBondContact O-N 2.86Å; R110-F112 PolarHBondContact O-N 3.48Å; F112-V115 PolarHBondContact O-N 2.96Å; F112-A116 VanDerWaalsContact O-CB 3.31Å; F112-A116 WeakPolarHBondContact O-CB 3.44Å; F112-A116 PolarHBondContact O-N 3.25Å; F112-M141 HydrophobicContact CE1-CE 3.85Å; F112-M141 HydrophobicContact CE1-SD 4.46Å; F112-M141 HydrophobicContact CE2-CE 4.33Å; F112-M141 HydrophobicContact CE2-CG 4.44Å; F112-M141 HydrophobicContact CE2-SD 3.99Å; F112-M141 HydrophobicContact CZ-CE 3.49Å; F112-M141 VanDerWaalsContact CZ-CE 3.49Å; F112-M141 HydrophobicContact CZ-CG 3.73Å; F112-M141 HydrophobicContact CZ-SD 3.53Å; F112-M141 VanDerWaalsContact CZ-SD 3.53Å; F112-I142 HydrophobicContact CE1-CG1 4.25Å; F112-I148 HydrophobicContact CB-CD1 3.73Å; F112-I148 HydrophobicContact CD1-CD1 3.42Å; F112-I148 VanDerWaalsContact CD1-CD1 3.42Å; F112-I148 HydrophobicContact CD1-CG1 3.71Å; F112-I148 HydrophobicContact CE1-CD1 4.16Å; F112-I148 HydrophobicContact CE1-CG1 3.93Å; F112-I148 HydrophobicContact CG-CD1 3.68Å; F112-I148 HydrophobicContact CG-CG1 4.22Å
113L94.6Very high90.2Very high2 Ų230.5 Ų30.51%0.0117%0.173CC..Hα-helixtrans-63.2-43.9177.7-71.2172.8000111.2L57 L60 E109 R110 A116 V117 I148 F151 W158 L161L57-L113 HydrophobicContact CD2-CB 4.2Å; L57-L113 HydrophobicContact CD2-CD1 4.47Å; L60-L113 HydrophobicContact CD2-CB 3.81Å; E109-L113 WeakPolarHBondContact O-CG 3.38Å; E109-L113 PolarHBondContact O-N 3.04Å; R110-L113 PolarHBondContact O-N 2.85Å; L113-A116 PolarHBondContact O-N 2.98Å; L113-V117 WeakPolarHBondContact O-CG2 3.49Å; L113-V117 PolarHBondContact O-N 2.89Å; L113-I148 HydrophobicContact CD2-CG2 3.96Å; L113-I148 HydrophobicContact CG-CG2 4.34Å; L113-F151 HydrophobicContact CD1-CE1 4.27Å; L113-W158 HydrophobicContact CD2-CH2 4.09Å; L113-W158 HydrophobicContact CD2-CZ3 4.49Å; L113-L161 HydrophobicContact CD1-CD1 4.25Å; L113-L161 HydrophobicContact CD1-CD2 4.34Å
114A93.3Very high90.2Very high0 Ų028 Ų280%016%0.16CC..Hα-helixtrans-58-51.3176.200000112.3L60 G61 W99 R110 A111 V117 K118L60-A114 HydrophobicContact CD1-CB 4.02Å; L60-A114 HydrophobicContact CG-CB 3.77Å; L60-A114 WeakPolarHBondContact O-CB 3.49Å; G61-A114 WeakPolarHBondContact CA-O 3.48Å; W99-A114 HydrophobicContact CH2-CB 4.04Å; W99-A114 HydrophobicContact CZ3-CB 3.54Å; R110-A114 VanDerWaalsContact O-CB 3.29Å; R110-A114 WeakPolarHBondContact O-CB 3.49Å; R110-A114 PolarHBondContact O-N 2.72Å; A111-A114 PolarHBondContact O-N 3.08Å; A114-V117 PolarHBondContact O-N 3.2Å; A114-K118 WeakPolarHBondContact O-CB 3.32Å; A114-K118 PolarHBondContact O-N 2.77Å
115V92.1Very high90.3Very high0 Ų027.9 Ų27.90%015%0.145CC..Hα-helixtrans-60.4-48.9178.6173.10000110.2F64 V92 L95 W99 A111 F112 V117 K118 L119F64-V115 HydrophobicContact CD2-CG2 3.74Å; F64-V115 HydrophobicContact CE2-CG2 3.4Å; F64-V115 HydrophobicContact CZ-CG1 4.48Å; F64-V115 HydrophobicContact CZ-CG2 3.88Å; V92-V115 HydrophobicContact CB-CG1 4.24Å; V92-V115 HydrophobicContact CG1-CB 4.42Å; V92-V115 HydrophobicContact CG1-CG1 4.12Å; V92-V115 HydrophobicContact CG2-CG1 4.19Å; L95-V115 HydrophobicContact CB-CG1 3.93Å; L95-V115 HydrophobicContact CB-CG2 4.17Å; L95-V115 HydrophobicContact CD1-CG1 3.93Å; W99-V115 HydrophobicContact CE3-CG2 4.17Å; A111-V115 WeakPolarHBondContact O-CB 3.16Å; A111-V115 WeakPolarHBondContact O-CG2 3.24Å; A111-V115 PolarHBondContact O-N 2.82Å; F112-V115 PolarHBondContact O-N 2.96Å; V115-V117 PolarHBondContact O-N 3.47Å; V115-K118 PolarHBondContact O-N 3.36Å; V115-L119 HydrophobicContact CG1-CD1 3.89Å; V115-L119 HydrophobicContact CG1-CG 4.2Å; V115-L119 WeakPolarHBondContact O-CB 3.47Å; V115-L119 VanDerWaalsContact O-CG 3.25Å; V115-L119 WeakPolarHBondContact O-CG 3.18Å; V115-L119 PolarHBondContact O-N 3.24Å
116A92Very high90Very high2 Ų226.3 Ų26.32%0.01713%0.128CC..Hα-helixtrans-57.2-47.3-179.800000111.9V92 F112 L113 L119 L120 M138 M141V92-A116 HydrophobicContact CG1-CB 4.34Å; V92-A116 HydrophobicContact CG2-CB 4.47Å; F112-A116 VanDerWaalsContact O-CB 3.31Å; F112-A116 WeakPolarHBondContact O-CB 3.44Å; F112-A116 PolarHBondContact O-N 3.25Å; L113-A116 PolarHBondContact O-N 2.98Å; A116-L119 PolarHBondContact O-N 3.26Å; A116-L120 PolarHBondContact O-N 2.88Å; A116-M138 HydrophobicContact CB-CE 4.46Å; A116-M138 HydrophobicContact CB-SD 4.4Å; A116-M138 WeakPolarHBondContact O-CE 3.34Å; A116-M141 HydrophobicContact CB-CE 4.02Å
117V92.8Very high89.8Confident7 Ų725.9 Ų25.94%0.04213%0.128CC..Hα-helixtrans-63-45.3178.3175.80000111.2L18 F22 L57 L113 A114 V115 L119 L120 E121L18-V117 HydrophobicContact CD1-CG2 4.06Å; L18-V117 HydrophobicContact CD2-CG1 4.24Å; F22-V117 HydrophobicContact CE2-CG1 4.27Å; F22-V117 HydrophobicContact CZ-CG1 3.82Å; L57-V117 HydrophobicContact CB-CG2 3.97Å; L57-V117 HydrophobicContact CD2-CG2 4.21Å; L113-V117 WeakPolarHBondContact O-CG2 3.49Å; L113-V117 PolarHBondContact O-N 2.89Å; A114-V117 PolarHBondContact O-N 3.2Å; V115-V117 PolarHBondContact O-N 3.47Å; V117-L119 VanDerWaalsContact C-N 3.32Å; V117-L119 PolarHBondContact O-N 3.41Å; V117-L120 WeakPolarHBondContact O-CB 3.39Å; V117-L120 PolarHBondContact O-N 3.03Å; V117-E121 PolarHBondContact O-N 3.47Å
118K91.3Very high89.3Confident22 Ų2227.2 Ų27.210%0.09613%0.133CC..Hα-helixtrans-66.1-35.4-177.8-16352.5160.3-173.10112.6D62 F64 E69 A114 V115 E121 Y122D62-K118 IonicContact OD1-NZ 3Å; D62-K118 PolarHBondContact OD1-NZ 3.27Å; F64-K118 HydrophobicContact CB-CB 4.16Å; F64-K118 HydrophobicContact CB-CG 4.03Å; F64-K118 HydrophobicContact CD1-CB 3.96Å; F64-K118 HydrophobicContact CD1-CG 3.71Å; F64-K118 HydrophobicContact CG-CB 4.38Å; F64-K118 HydrophobicContact CG-CG 4.32Å; E69-K118 HydrophobicContact CG-CG 4.34Å; A114-K118 WeakPolarHBondContact O-CB 3.32Å; A114-K118 PolarHBondContact O-N 2.77Å; V115-K118 PolarHBondContact O-N 3.36Å; K118-E121 WeakPolarHBondContact CD-OE2 3.47Å; K118-E121 WeakPolarHBondContact CE-OE2 3.15Å; K118-E121 IonicContact NZ-OE1 3.82Å; K118-E121 IonicContact NZ-OE2 3.87Å; K118-E121 PolarHBondContact NZ-OE2 3.45Å; K118-Y122 PolarHBondContact O-N 2.94Å
119L88Confident88.8Confident2 Ų233.2 Ų33.21%0.0116%0.163CC..Hα-helixtrans-70.4-37.8174.2-65-175.1000112.5A72 I76 L88 T91 V92 L95 V115 A116 V117 Y122 M123A72-L119 HydrophobicContact CB-CD2 3.63Å; I76-L119 HydrophobicContact CD1-CB 4.23Å; I76-L119 HydrophobicContact CD1-CD1 3.99Å; I76-L119 HydrophobicContact CD1-CD2 3.6Å; I76-L119 HydrophobicContact CD1-CG 4.12Å; L88-L119 HydrophobicContact CD1-CB 4.29Å; L88-L119 HydrophobicContact CD1-CD1 4.17Å; T91-L119 HydrophobicContact CG2-CD1 3.94Å; V92-L119 HydrophobicContact CG2-CD1 3.72Å; L95-L119 HydrophobicContact CD1-CD1 4.28Å; V115-L119 HydrophobicContact CG1-CD1 3.89Å; V115-L119 HydrophobicContact CG1-CG 4.2Å; V115-L119 WeakPolarHBondContact O-CB 3.47Å; V115-L119 VanDerWaalsContact O-CG 3.25Å; V115-L119 WeakPolarHBondContact O-CG 3.18Å; V115-L119 PolarHBondContact O-N 3.24Å; A116-L119 PolarHBondContact O-N 3.26Å; V117-L119 VanDerWaalsContact C-N 3.32Å; V117-L119 PolarHBondContact O-N 3.41Å; L119-Y122 PolarHBondContact O-N 3.35Å; L119-M123 WeakPolarHBondContact O-CB 3.48Å; L119-M123 WeakPolarHBondContact O-CG 3.47Å; L119-M123 PolarHBondContact O-N 3.34Å
120L88.8Confident88.2Confident0 Ų033.1 Ų33.10%017%0.166CC..Hα-helixtrans-60.8-46.7173.2-169.563.6000111.1V15 L18 L19 F22 A116 V117 M123 A124 V131 M138V15-L120 HydrophobicContact CG1-CD2 4.31Å; L18-L120 HydrophobicContact CB-CD2 4.09Å; L19-L120 HydrophobicContact CD1-CD1 4.29Å; F22-L120 HydrophobicContact CD2-CB 4.45Å; F22-L120 HydrophobicContact CD2-CD2 4.27Å; F22-L120 HydrophobicContact CD2-CG 4.13Å; F22-L120 HydrophobicContact CE2-CB 4.2Å; F22-L120 HydrophobicContact CE2-CD2 4.15Å; F22-L120 HydrophobicContact CE2-CG 4.23Å; A116-L120 PolarHBondContact O-N 2.88Å; V117-L120 WeakPolarHBondContact O-CB 3.39Å; V117-L120 PolarHBondContact O-N 3.03Å; L120-M123 PolarHBondContact O-N 3.15Å; L120-A124 PolarHBondContact O-N 2.82Å; L120-V131 HydrophobicContact CD1-CG2 3.73Å; L120-M138 HydrophobicContact CB-CE 3.73Å; L120-M138 HydrophobicContact CB-SD 3.77Å; L120-M138 HydrophobicContact CD1-CE 4.1Å; L120-M138 HydrophobicContact CD1-SD 4.02Å; L120-M138 HydrophobicContact CD2-SD 3.86Å; L120-M138 HydrophobicContact CG-CE 4.4Å; L120-M138 HydrophobicContact CG-SD 4.1Å
121E89.6Confident87.7Confident38 Ų3830.8 Ų30.818%0.17816%0.157CC..Hα-helixtrans-57.1-50.6175.7-176.4-173.1-17400110.6F22 V117 K118 M123 A124 H125F22-E121 HydrophobicContact CD1-CB 4.04Å; F22-E121 HydrophobicContact CD1-CG 3.8Å; F22-E121 HydrophobicContact CD2-CB 4Å; F22-E121 HydrophobicContact CE1-CB 3.84Å; F22-E121 HydrophobicContact CE1-CG 3.81Å; F22-E121 HydrophobicContact CE2-CB 3.8Å; F22-E121 HydrophobicContact CG-CB 4.13Å; F22-E121 HydrophobicContact CG-CG 4.2Å; F22-E121 HydrophobicContact CZ-CB 3.72Å; F22-E121 HydrophobicContact CZ-CG 4.23Å; V117-E121 PolarHBondContact O-N 3.47Å; K118-E121 WeakPolarHBondContact CD-OE2 3.47Å; K118-E121 WeakPolarHBondContact CE-OE2 3.15Å; K118-E121 IonicContact NZ-OE1 3.82Å; K118-E121 IonicContact NZ-OE2 3.87Å; K118-E121 PolarHBondContact NZ-OE2 3.45Å; E121-M123 PolarHBondContact O-N 3.05Å; E121-A124 WeakPolarHBondContact O-CB 3.41Å; E121-A124 PolarHBondContact O-N 2.6Å; E121-H125 PolarHBondContact O-N 3.39Å; E121-H125 VanDerWaalsContact O-N 3.16Å; E121-H125 PolarHBondContact O-ND1 3.49Å; E121-H125 IonicContact OE1-CE1 3.96Å
122Y84.9Confident87.2Confident41 Ų4132.5 Ų32.516%0.16117%0.174CC..Hα-helixtrans-58.6-47179.6175.9-113.5000112.2K73 I76 K118 L119 A124 H125 I126K73-Y122 HydrophobicContact CB-CD1 4.45Å; K73-Y122 HydrophobicContact CB-CE1 3.77Å; K73-Y122 HydrophobicContact CB-CE2 4.03Å; K73-Y122 WeakPolarHBondContact CB-OH 3.49Å; K73-Y122 HydrophobicContact CD-CD2 3.78Å; K73-Y122 HydrophobicContact CD-CE2 3.45Å; K73-Y122 VanDerWaalsContact CD-CE2 3.45Å; K73-Y122 HydrophobicContact CD-CG 4.43Å; K73-Y122 HydrophobicContact CG-CD1 3.86Å; K73-Y122 HydrophobicContact CG-CD2 3.68Å; K73-Y122 HydrophobicContact CG-CE1 3.62Å; K73-Y122 HydrophobicContact CG-CE2 3.41Å; K73-Y122 VanDerWaalsContact CG-CE2 3.41Å; K73-Y122 HydrophobicContact CG-CG 3.87Å; I76-Y122 HydrophobicContact CB-CE1 4.47Å; I76-Y122 HydrophobicContact CG2-CD1 4.33Å; I76-Y122 HydrophobicContact CG2-CE1 4.22Å; K118-Y122 PolarHBondContact O-N 2.94Å; L119-Y122 PolarHBondContact O-N 3.35Å; Y122-A124 VanDerWaalsContact C-N 3.3Å; Y122-A124 PolarHBondContact O-N 2.93Å; Y122-H125 WeakPolarHBondContact O-CB 3.42Å; Y122-H125 PolarHBondContact O-N 2.83Å; Y122-I126 HydrophobicContact CD1-CD1 4.04Å; Y122-I126 HydrophobicContact CD1-CG1 4.12Å; Y122-I126 HydrophobicContact CD2-CG2 4.03Å; Y122-I126 HydrophobicContact CE1-CD1 3.34Å; Y122-I126 HydrophobicContact CE1-CG1 3.8Å; Y122-I126 HydrophobicContact CE1-CG2 4.34Å; Y122-I126 HydrophobicContact CE2-CB 4.47Å; Y122-I126 HydrophobicContact CE2-CD1 4.49Å; Y122-I126 HydrophobicContact CE2-CG1 4.3Å; Y122-I126 HydrophobicContact CE2-CG2 3.38Å; Y122-I126 VanDerWaalsContact O-CG1 3.29Å; Y122-I126 WeakPolarHBondContact O-CG1 3.44Å; Y122-I126 PolarHBondContact O-N 2.93Å
123M82.8Confident86.6Confident17 Ų1739.2 Ų39.28%0.08421%0.206CC..Hα-helixtrans-63.3-35.7178.4-76.9-17915100112.8I76 L119 L120 E121 H125 I126 A127 V131 V134I76-M123 HydrophobicContact CB-CE 4.33Å; I76-M123 HydrophobicContact CD1-CE 4.38Å; I76-M123 HydrophobicContact CG1-CE 4.21Å; I76-M123 HydrophobicContact CG2-CE 3.29Å; I76-M123 HydrophobicContact CG2-CG 3.77Å; I76-M123 HydrophobicContact CG2-SD 4.29Å; L119-M123 WeakPolarHBondContact O-CB 3.48Å; L119-M123 WeakPolarHBondContact O-CG 3.47Å; L119-M123 PolarHBondContact O-N 3.34Å; L120-M123 PolarHBondContact O-N 3.15Å; E121-M123 PolarHBondContact O-N 3.05Å; M123-H125 PolarHBondContact O-N 3.33Å; M123-I126 PolarHBondContact O-N 3.44Å; M123-A127 CarbonylContact O-C 3.31Å; M123-A127 WeakPolarHBondContact O-CA 3.15Å; M123-A127 PolarHBondContact O-N 3.06Å; M123-V131 HydrophobicContact CB-CB 4.37Å; M123-V131 HydrophobicContact CB-CG2 3.88Å; M123-V134 HydrophobicContact CE-CG1 4.39Å; M123-V134 HydrophobicContact CE-CG2 4.14Å; M123-V134 HydrophobicContact SD-CB 4.02Å; M123-V134 HydrophobicContact SD-CG1 3.52Å; M123-V134 VanDerWaalsContact SD-CG1 3.52Å; M123-V134 HydrophobicContact SD-CG2 3.76Å
124A86.9Confident86Confident5 Ų539.4 Ų39.44%0.04121%0.207CC..Hα-helixtrans-61.9-33.9173.400000112F22 L23 L120 E121 Y122 P128 V131F22-A124 HydrophobicContact CB-CB 3.54Å; L23-A124 HydrophobicContact CD2-CB 4.27Å; L23-A124 HydrophobicContact CG-CB 4.46Å; L120-A124 PolarHBondContact O-N 2.82Å; E121-A124 WeakPolarHBondContact O-CB 3.41Å; E121-A124 PolarHBondContact O-N 2.6Å; Y122-A124 VanDerWaalsContact C-N 3.3Å; Y122-A124 PolarHBondContact O-N 2.93Å; A124-P128 WeakPolarHBondContact O-CB 3.34Å; A124-V131 HydrophobicContact CB-CG1 4.25Å; A124-V131 HydrophobicContact CB-CG2 4.14Å
125H84.3Confident85.6Confident122 Ų12239.6 Ų39.657%0.56521%0.209SC*.Hα-helixtrans-76.4-44.5177.5-72.981.9000113.3E121 Y122 M123E121-H125 PolarHBondContact O-N 3.39Å; E121-H125 VanDerWaalsContact O-N 3.16Å; E121-H125 PolarHBondContact O-ND1 3.49Å; E121-H125 IonicContact OE1-CE1 3.96Å; Y122-H125 WeakPolarHBondContact O-CB 3.42Å; Y122-H125 PolarHBondContact O-N 2.83Å; M123-H125 PolarHBondContact O-N 3.33Å
126I81.4Confident85.3Confident71 Ų7145.7 Ų45.736%0.36424%0.24SC..Hα-helixtrans-90.3-25.1-173.260.2145.5000114I76 I80 Y122 M123I76-I126 HydrophobicContact CG2-CD1 4.38Å; I80-I126 HydrophobicContact CD1-CD1 4.24Å; Y122-I126 HydrophobicContact CD1-CD1 4.04Å; Y122-I126 HydrophobicContact CD1-CG1 4.12Å; Y122-I126 HydrophobicContact CD2-CG2 4.03Å; Y122-I126 HydrophobicContact CE1-CD1 3.34Å; Y122-I126 HydrophobicContact CE1-CG1 3.8Å; Y122-I126 HydrophobicContact CE1-CG2 4.34Å; Y122-I126 HydrophobicContact CE2-CB 4.47Å; Y122-I126 HydrophobicContact CE2-CD1 4.49Å; Y122-I126 HydrophobicContact CE2-CG1 4.3Å; Y122-I126 HydrophobicContact CE2-CG2 3.38Å; Y122-I126 VanDerWaalsContact O-CG1 3.29Å; Y122-I126 WeakPolarHBondContact O-CG1 3.44Å; Y122-I126 PolarHBondContact O-N 2.93Å; M123-I126 PolarHBondContact O-N 3.44Å
127A82.3Confident85Confident14 Ų1447.6 Ų47.612%0.11625%0.252CS..  trans-146.459.3-173.700000111.2I80 M123 E129 V130 V131I80-A127 HydrophobicContact CD1-CB 4Å; M123-A127 CarbonylContact O-C 3.31Å; M123-A127 WeakPolarHBondContact O-CA 3.15Å; M123-A127 PolarHBondContact O-N 3.06Å; A127-E129 PolarHBondContact O-N 3.21Å; A127-E129 VanDerWaalsContact O-N 3.1Å; A127-V130 HydrophobicContact CB-CG2 3.48Å; A127-V130 VanDerWaalsContact CB-CG2 3.48Å; A127-V130 VanDerWaalsContact O-CG2 3.3Å; A127-V130 WeakPolarHBondContact O-CG2 3.24Å; A127-V130 PolarHBondContact O-N 3.38Å; A127-V130 VanDerWaalsContact O-N 3.08Å; A127-V131 PolarHBondContact O-N 3.4Å; A127-V131 VanDerWaalsContact O-N 3.15Å
128P83.4Confident84.7Confident70 Ų7047.4 Ų47.446%0.45525%0.251SS..THydrogen-bonded Turntrans-59.1-26.5-175.722.7-33.9000113.5L23 A124 V130 V131L23-P128 HydrophobicContact CD2-CB 3.55Å; A124-P128 WeakPolarHBondContact O-CB 3.34Å; P128-V130 VanDerWaalsContact C-N 3.3Å; P128-V130 PolarHBondContact O-N 2.88Å; P128-V131 WeakPolarHBondContact O-CG1 3.32Å
129E82.8Confident84.7Confident186 Ų18647.2 Ų47.287%0.86925%0.251SS*.THydrogen-bonded Turntrans-72.2-23.1-179.6-58.2-162.1-15600113.5A127A127-E129 PolarHBondContact O-N 3.21Å; A127-E129 VanDerWaalsContact O-N 3.1Å
130V80.1Confident84.8Confident47 Ų4749.2 Ų49.229%0.28527%0.273SS..THydrogen-bonded Turntrans-113.4-13.9-175.7-59.10000113.4I80 A127 P128 G132 Q133 V134I80-V130 HydrophobicContact CG2-CG2 3.87Å; A127-V130 HydrophobicContact CB-CG2 3.48Å; A127-V130 VanDerWaalsContact CB-CG2 3.48Å; A127-V130 VanDerWaalsContact O-CG2 3.3Å; A127-V130 WeakPolarHBondContact O-CG2 3.24Å; A127-V130 PolarHBondContact O-N 3.38Å; A127-V130 VanDerWaalsContact O-N 3.08Å; P128-V130 VanDerWaalsContact C-N 3.3Å; P128-V130 PolarHBondContact O-N 2.88Å; V130-G132 PolarHBondContact O-N 2.9Å; V130-G132 VanDerWaalsContact O-N 3.15Å; V130-Q133 WeakPolarHBondContact O-CA 3.08Å; V130-Q133 WeakPolarHBondContact O-CB 3.29Å; V130-Q133 PolarHBondContact O-N 2.72Å; V130-V134 PolarHBondContact O-N 3.45Å
131V83.4Confident84.9Confident0 Ų049.8 Ų49.80%028%0.276CS..Hα-helixtrans-60.7-28.3-177.166.50000113L19 L23 L120 M123 A124 A127 P128 Q133 V134 A135L19-V131 HydrophobicContact CD1-CB 4.09Å; L19-V131 HydrophobicContact CD1-CG1 3.59Å; L19-V131 HydrophobicContact CD1-CG2 3.54Å; L23-V131 HydrophobicContact CD1-CG1 4Å; L23-V131 HydrophobicContact CD2-CG1 3.59Å; L23-V131 HydrophobicContact CG-CG1 3.99Å; L120-V131 HydrophobicContact CD1-CG2 3.73Å; M123-V131 HydrophobicContact CB-CB 4.37Å; M123-V131 HydrophobicContact CB-CG2 3.88Å; A124-V131 HydrophobicContact CB-CG1 4.25Å; A124-V131 HydrophobicContact CB-CG2 4.14Å; A127-V131 PolarHBondContact O-N 3.4Å; A127-V131 VanDerWaalsContact O-N 3.15Å; P128-V131 WeakPolarHBondContact O-CG1 3.32Å; V131-Q133 PolarHBondContact O-N 3.29Å; V131-V134 WeakPolarHBondContact O-CA 3.3Å; V131-V134 WeakPolarHBondContact O-CB 3.3Å; V131-V134 PolarHBondContact O-N 3.19Å; V131-A135 PolarHBondContact O-N 2.66Å
132G83Confident85.1Confident36 Ų3648.5 Ų48.537%0.37127%0.27SS..Hα-helixtrans-61-32.4172.200000113.2V130 V134V130-G132 PolarHBondContact O-N 2.9Å; V130-G132 VanDerWaalsContact O-N 3.15Å; G132-V134 VanDerWaalsContact C-N 3.28Å
133Q81Confident85.4Confident142 Ų14247.9 Ų47.966%0.66427%0.269SS*.Hα-helixtrans-74.5-22.1174.3-57.6-179.28.200112.1V130 V131 P137V130-Q133 WeakPolarHBondContact O-CA 3.08Å; V130-Q133 WeakPolarHBondContact O-CB 3.29Å; V130-Q133 PolarHBondContact O-N 2.72Å; V131-Q133 PolarHBondContact O-N 3.29Å; Q133-P137 WeakPolarHBondContact O-CD 3.36Å
134V81.1Confident85.8Confident6 Ų650.3 Ų50.34%0.03630%0.298CS..Hα-helixtrans-84.5-27.6178.9177.60000112.4L88 M123 V130 V131 G132 I136 P137 M138L88-V134 HydrophobicContact CD1-CG1 4.45Å; L88-V134 HydrophobicContact CD2-CG1 3.5Å; L88-V134 VanDerWaalsContact CD2-CG1 3.5Å; M123-V134 HydrophobicContact CE-CG1 4.39Å; M123-V134 HydrophobicContact CE-CG2 4.14Å; M123-V134 HydrophobicContact SD-CB 4.02Å; M123-V134 HydrophobicContact SD-CG1 3.52Å; M123-V134 VanDerWaalsContact SD-CG1 3.52Å; M123-V134 HydrophobicContact SD-CG2 3.76Å; V130-V134 PolarHBondContact O-N 3.45Å; V131-V134 WeakPolarHBondContact O-CA 3.3Å; V131-V134 WeakPolarHBondContact O-CB 3.3Å; V131-V134 PolarHBondContact O-N 3.19Å; G132-V134 VanDerWaalsContact C-N 3.28Å; V134-I136 PolarHBondContact O-N 2.95Å; V134-P137 WeakPolarHBondContact O-CD 3.45Å; V134-P137 VanDerWaalsContact O-CG 3.26Å; V134-P137 WeakPolarHBondContact O-CG 3.37Å; V134-M138 WeakPolarHBondContact O-CB 3.43Å; V134-M138 PolarHBondContact O-N 3.23Å
135A84.9Confident86.1Confident4 Ų451.4 Ų51.43%0.03330%0.304CS..Hα-helixtrans-58.4-32.9173.500000112.8V15 L19 V131 T139V15-A135 HydrophobicContact CG1-CB 3.88Å; L19-A135 HydrophobicContact CD2-CB 3.99Å; V131-A135 PolarHBondContact O-N 2.66Å; A135-T139 WeakPolarHBondContact O-CB 3.21Å; A135-T139 PolarHBondContact O-N 3.31Å; A135-T139 PolarHBondContact O-OG1 3.39Å
136I86.2Confident86.5Confident128 Ų12853.8 Ų53.866%0.65631%0.308SS*.Hα-helixtrans-64.3-59.9178.5-59.5169.2000111.9V134 M138 T139 G140V134-I136 PolarHBondContact O-N 2.95Å; I136-M138 VanDerWaalsContact C-N 3.25Å; I136-M138 PolarHBondContact O-N 2.81Å; I136-T139 PolarHBondContact O-N 3.13Å; I136-G140 PolarHBondContact O-N 3.29Å
137P86Confident87.1Confident42 Ų4252 Ų5227%0.27330%0.303SS..Hα-helixtrans-63.4-3117724.5-33.2000112.2Q133 V134 G140 M141Q133-P137 WeakPolarHBondContact O-CD 3.36Å; V134-P137 WeakPolarHBondContact O-CD 3.45Å; V134-P137 VanDerWaalsContact O-CG 3.26Å; V134-P137 WeakPolarHBondContact O-CG 3.37Å; P137-G140 PolarHBondContact O-N 3.24Å; P137-M141 VanDerWaalsContact O-CB 3.24Å; P137-M141 WeakPolarHBondContact O-CB 3.08Å; P137-M141 PolarHBondContact O-N 3.3Å
138M87.7Confident87.7Confident3 Ų351.3 Ų51.32%0.01530%0.298CS..Hα-helixtrans-63.3-46.1173.8-176167.1-6600112.5L88 A116 L120 V134 I136 G140 M141 I142L88-M138 HydrophobicContact CD1-CE 4.33Å; L88-M138 HydrophobicContact CD2-CB 4.31Å; L88-M138 HydrophobicContact CD2-CE 4.07Å; A116-M138 HydrophobicContact CB-CE 4.46Å; A116-M138 HydrophobicContact CB-SD 4.4Å; A116-M138 WeakPolarHBondContact O-CE 3.34Å; L120-M138 HydrophobicContact CB-CE 3.73Å; L120-M138 HydrophobicContact CB-SD 3.77Å; L120-M138 HydrophobicContact CD1-CE 4.1Å; L120-M138 HydrophobicContact CD1-SD 4.02Å; L120-M138 HydrophobicContact CD2-SD 3.86Å; L120-M138 HydrophobicContact CG-CE 4.4Å; L120-M138 HydrophobicContact CG-SD 4.1Å; V134-M138 WeakPolarHBondContact O-CB 3.43Å; V134-M138 PolarHBondContact O-N 3.23Å; I136-M138 VanDerWaalsContact C-N 3.25Å; I136-M138 PolarHBondContact O-N 2.81Å; M138-G140 VanDerWaalsContact C-N 3.32Å; M138-G140 PolarHBondContact O-N 3.1Å; M138-M141 HydrophobicContact CG-CE 4.44Å; M138-M141 WeakPolarHBondContact O-CB 3.33Å; M138-M141 PolarHBondContact O-N 2.63Å; M138-I142 HydrophobicContact CG-CD1 4.31Å; M138-I142 WeakPolarHBondContact O-CG1 3.46Å; M138-I142 PolarHBondContact O-N 3.29Å
139T91.1Very high88.2Confident17 Ų1750.7 Ų50.710%0.10429%0.286CS..Hα-helixtrans-60.1-45174.7-60.10000110.6T11 E12 A135 I136 M141 I142 N143T11-T139 HydrophobicContact CG2-CG2 4.21Å; E12-T139 HydrophobicContact CB-CG2 4.06Å; A135-T139 WeakPolarHBondContact O-CB 3.21Å; A135-T139 PolarHBondContact O-N 3.31Å; A135-T139 PolarHBondContact O-OG1 3.39Å; I136-T139 PolarHBondContact O-N 3.13Å; T139-M141 VanDerWaalsContact C-N 3.34Å; T139-M141 PolarHBondContact O-N 2.94Å; T139-I142 PolarHBondContact O-N 2.94Å; T139-N143 WeakPolarHBondContact CG2-ND2 3.26Å; T139-N143 VanDerWaalsContact O-CB 3.32Å; T139-N143 WeakPolarHBondContact O-CB 3.21Å; T139-N143 PolarHBondContact O-N 3.04Å; T139-N143 PolarHBondContact O-ND2 3.26Å
140G90.1Very high88.8Confident44 Ų4446 Ų4645%0.45426%0.264SS..Hα-helixtrans-60.7-41.1176.100000113I136 P137 M138 N143 G144I136-G140 PolarHBondContact O-N 3.29Å; P137-G140 PolarHBondContact O-N 3.24Å; M138-G140 VanDerWaalsContact C-N 3.32Å; M138-G140 PolarHBondContact O-N 3.1Å; G140-N143 PolarHBondContact O-N 2.82Å; G140-G144 PolarHBondContact O-N 3.3Å
141M90.5Very high89.4Confident13 Ų1346.1 Ų46.16%0.06426%0.261CS..Hα-helixtrans-64.8-43.2178.7-170.2-163.549.500111.9Q89 V92 F112 A116 P137 M138 T139 N145Q89-M141 HydrophobicContact CB-CG 4.34Å; Q89-M141 HydrophobicContact CB-SD 4.07Å; Q89-M141 HydrophobicContact CG-CG 3.94Å; Q89-M141 HydrophobicContact CG-SD 4.01Å; V92-M141 HydrophobicContact CB-CE 4.21Å; V92-M141 HydrophobicContact CB-SD 3.92Å; V92-M141 HydrophobicContact CG1-CE 3.95Å; V92-M141 HydrophobicContact CG1-SD 4.03Å; V92-M141 HydrophobicContact CG2-CE 4Å; V92-M141 HydrophobicContact CG2-SD 4.14Å; F112-M141 HydrophobicContact CE1-CE 3.85Å; F112-M141 HydrophobicContact CE1-SD 4.46Å; F112-M141 HydrophobicContact CE2-CE 4.33Å; F112-M141 HydrophobicContact CE2-CG 4.44Å; F112-M141 HydrophobicContact CE2-SD 3.99Å; F112-M141 HydrophobicContact CZ-CE 3.49Å; F112-M141 VanDerWaalsContact CZ-CE 3.49Å; F112-M141 HydrophobicContact CZ-CG 3.73Å; F112-M141 HydrophobicContact CZ-SD 3.53Å; F112-M141 VanDerWaalsContact CZ-SD 3.53Å; A116-M141 HydrophobicContact CB-CE 4.02Å; P137-M141 VanDerWaalsContact O-CB 3.24Å; P137-M141 WeakPolarHBondContact O-CB 3.08Å; P137-M141 PolarHBondContact O-N 3.3Å; M138-M141 HydrophobicContact CG-CE 4.44Å; M138-M141 WeakPolarHBondContact O-CB 3.33Å; M138-M141 PolarHBondContact O-N 2.63Å; T139-M141 VanDerWaalsContact C-N 3.34Å; T139-M141 PolarHBondContact O-N 2.94Å; M141-N145 VanDerWaalsContact O-CB 3.28Å; M141-N145 WeakPolarHBondContact O-CB 3.48Å; M141-N145 PolarHBondContact O-N 3.02Å
142I92.4Very high89.9Confident10 Ų1046.1 Ų46.15%0.05126%0.261CS..Hα-helixtrans-67.4-47.2175.6-65.2166.8000110.5T11 V15 F112 M138 T139 G144 N145 I148 W158T11-I142 HydrophobicContact CG2-CB 3.9Å; T11-I142 HydrophobicContact CG2-CD1 4.36Å; T11-I142 HydrophobicContact CG2-CG2 3.61Å; V15-I142 HydrophobicContact CG2-CD1 4.19Å; F112-I142 HydrophobicContact CE1-CG1 4.25Å; M138-I142 HydrophobicContact CG-CD1 4.31Å; M138-I142 WeakPolarHBondContact O-CG1 3.46Å; M138-I142 PolarHBondContact O-N 3.29Å; T139-I142 PolarHBondContact O-N 2.94Å; I142-G144 VanDerWaalsContact C-N 3.32Å; I142-G144 PolarHBondContact O-N 3.26Å; I142-N145 PolarHBondContact O-N 3.19Å; I142-I148 HydrophobicContact CG2-CG2 4.11Å; I142-W158 HydrophobicContact CG2-CH2 4.06Å; I142-W158 HydrophobicContact CG2-CZ2 3.83Å
143N92.8Very high90.4Very high29 Ų2949.5 Ų49.516%0.15527%0.267CS..Hα-helixtrans-64.8-35.6-178.4-76.4-23.7000113.1F7 E8 T11 T139 G140 R149F7-N143 WeakPolarHBondContact CD1-OD1 3.47Å; F7-N143 WeakPolarHBondContact CE1-OD1 3.28Å; E8-N143 HydrophobicContact CG-CB 4.4Å; T11-N143 WeakPolarHBondContact CB-OD1 3.44Å; T11-N143 WeakPolarHBondContact CG2-OD1 3.28Å; T11-N143 PolarHBondContact OG1-OD1 2.89Å; T139-N143 WeakPolarHBondContact CG2-ND2 3.26Å; T139-N143 VanDerWaalsContact O-CB 3.32Å; T139-N143 WeakPolarHBondContact O-CB 3.21Å; T139-N143 PolarHBondContact O-N 3.04Å; T139-N143 PolarHBondContact O-ND2 3.26Å; G140-N143 PolarHBondContact O-N 2.82Å; N143-R149 PolarHBondContact O-NH2 3.32Å
144G91.2Very high90.9Very high67 Ų6746.1 Ų46.169%0.69127%0.27SS*.Hα-helixtrans-81.3-14.5179.100000114.4G140 I142 R146G140-G144 PolarHBondContact O-N 3.3Å; I142-G144 VanDerWaalsContact C-N 3.32Å; I142-G144 PolarHBondContact O-N 3.26Å; G144-R146 PolarHBondContact O-N 3Å
145N92.4Very high91.3Very high29 Ų2948.5 Ų48.516%0.15528%0.281CS..  trans-87.1101.8-179.7-168.8-30.7000111M141 I142 A147 I148 R149M141-N145 VanDerWaalsContact O-CB 3.28Å; M141-N145 WeakPolarHBondContact O-CB 3.48Å; M141-N145 PolarHBondContact O-N 3.02Å; I142-N145 PolarHBondContact O-N 3.19Å; N145-A147 VanDerWaalsContact C-N 3.29Å; N145-A147 PolarHBondContact O-N 3.11Å; N145-A147 PolarHBondContact OD1-N 2.89Å; N145-A147 VanDerWaalsContact OD1-N 3.13Å; N145-I148 HydrophobicContact CB-CB 4.09Å; N145-I148 HydrophobicContact CB-CG1 3.75Å; N145-I148 WeakPolarHBondContact ND2-CG1 2.95Å; N145-I148 PolarHBondContact O-N 2.88Å; N145-I148 PolarHBondContact OD1-N 3.46Å; N145-R149 PolarHBondContact O-N 3.47Å
146R93.3Very high91.6Very high172 Ų17250.2 Ų50.265%0.64930%0.299SS*.Hα-helixtrans-57-39.8-179.3-176.2175.2178-81-1.1112.7G144 R149 E150G144-R146 PolarHBondContact O-N 3Å; R146-R149 PolarHBondContact O-N 2.97Å; R146-E150 HydrophobicContact CG-CG 4.3Å; R146-E150 VanDerWaalsContact CZ-CD 3.44Å; R146-E150 IonicContact CZ-OE1 2.8Å; R146-E150 IonicContact CZ-OE2 3.41Å; R146-E150 IonicContact NE-OE1 3.36Å; R146-E150 PolarHBondContact NE-OE1 3.08Å; R146-E150 VanDerWaalsContact NH1-CD 3.35Å; R146-E150 IonicContact NH1-OE1 3.12Å; R146-E150 PolarHBondContact NH1-OE1 3.41Å; R146-E150 VanDerWaalsContact NH1-OE1 3.12Å; R146-E150 IonicContact NH1-OE2 2.85Å; R146-E150 PolarHBondContact NH1-OE2 2.98Å; R146-E150 IonicContact NH2-OE1 2.62Å; R146-E150 PolarHBondContact NH2-OE1 3.23Å; R146-E150 IonicContact NH2-OE2 3.8Å; R146-E150 WeakPolarHBondContact O-CB 3.16Å; R146-E150 VanDerWaalsContact O-CG 3.31Å; R146-E150 WeakPolarHBondContact O-CG 3.11Å; R146-E150 PolarHBondContact O-N 3.01Å
147A93.1Very high91.8Very high33 Ų3344.8 Ų44.827%0.27327%0.274SS..Hα-helixtrans-63.9-44.5-179.600000111.2E109 N145 R149 E150 F151E109-A147 HydrophobicContact CG-CB 4.36Å; N145-A147 VanDerWaalsContact C-N 3.29Å; N145-A147 PolarHBondContact O-N 3.11Å; N145-A147 PolarHBondContact OD1-N 2.89Å; N145-A147 VanDerWaalsContact OD1-N 3.13Å; A147-R149 PolarHBondContact O-N 3.36Å; A147-E150 PolarHBondContact O-N 3.47Å; A147-F151 VanDerWaalsContact O-CB 3.3Å; A147-F151 WeakPolarHBondContact O-CB 3.42Å; A147-F151 PolarHBondContact O-N 2.91Å
148I94.5Very high92.2Very high0 Ų043 Ų430%026%0.262CS..Hα-helixtrans-62.1-45176.8-57.2-64.6000111.1E109 F112 L113 I142 N145 F151 I152E109-I148 VanDerWaalsContact CA-CD1 3.47Å; E109-I148 HydrophobicContact CB-CD1 3.68Å; E109-I148 HydrophobicContact CG-CD1 3.85Å; F112-I148 HydrophobicContact CB-CD1 3.73Å; F112-I148 HydrophobicContact CD1-CD1 3.42Å; F112-I148 VanDerWaalsContact CD1-CD1 3.42Å; F112-I148 HydrophobicContact CD1-CG1 3.71Å; F112-I148 HydrophobicContact CE1-CD1 4.16Å; F112-I148 HydrophobicContact CE1-CG1 3.93Å; F112-I148 HydrophobicContact CG-CD1 3.68Å; F112-I148 HydrophobicContact CG-CG1 4.22Å; L113-I148 HydrophobicContact CD2-CG2 3.96Å; L113-I148 HydrophobicContact CG-CG2 4.34Å; I142-I148 HydrophobicContact CG2-CG2 4.11Å; N145-I148 HydrophobicContact CB-CB 4.09Å; N145-I148 HydrophobicContact CB-CG1 3.75Å; N145-I148 WeakPolarHBondContact ND2-CG1 2.95Å; N145-I148 PolarHBondContact O-N 2.88Å; N145-I148 PolarHBondContact OD1-N 3.46Å; I148-F151 PolarHBondContact O-N 3.21Å; I148-I152 HydrophobicContact CG2-CD1 3.65Å; I148-I152 HydrophobicContact CG2-CG1 4.5Å; I148-I152 WeakPolarHBondContact O-CD1 3.31Å; I148-I152 VanDerWaalsContact O-CG1 3.31Å; I148-I152 WeakPolarHBondContact O-CG1 3.38Å; I148-I152 PolarHBondContact O-N 3.36Å
149R94.8Very high92.3Very high56 Ų5644.3 Ų44.321%0.21127%0.268CS..Hα-helixtrans-60-48.6176.6-177.7-176.8-63.2-121.50.8111.6F7 E8 N143 N145 R146 A147 F151 I152 Q153F7-R149 HydrophobicContact CD1-CG 4.37Å; F7-R149 HydrophobicContact CD2-CG 4.32Å; F7-R149 HydrophobicContact CE1-CB 4.32Å; F7-R149 HydrophobicContact CE1-CG 4.25Å; F7-R149 HydrophobicContact CE2-CG 4.2Å; F7-R149 HydrophobicContact CG-CG 4.4Å; F7-R149 HydrophobicContact CZ-CB 4.14Å; F7-R149 HydrophobicContact CZ-CG 4.17Å; E8-R149 IonicContact OE1-CZ 3.9Å; E8-R149 IonicContact OE1-NH1 2.77Å; E8-R149 PolarHBondContact OE1-NH1 3.38Å; E8-R149 IonicContact OE1-NH2 2.95Å; E8-R149 PolarHBondContact OE1-NH2 3.47Å; E8-R149 IonicContact OE2-NH1 2.64Å; N143-R149 PolarHBondContact O-NH2 3.32Å; N145-R149 PolarHBondContact O-N 3.47Å; R146-R149 PolarHBondContact O-N 2.97Å; A147-R149 PolarHBondContact O-N 3.36Å; R149-F151 VanDerWaalsContact C-N 3.33Å; R149-F151 PolarHBondContact O-N 3.33Å; R149-I152 PolarHBondContact O-N 3.05Å; R149-Q153 HydrophobicContact CG-CG 4.33Å; R149-Q153 WeakPolarHBondContact O-CB 3.36Å; R149-Q153 VanDerWaalsContact O-CG 3.27Å; R149-Q153 WeakPolarHBondContact O-CG 3.48Å; R149-Q153 PolarHBondContact O-N 3.39Å
150E94.4Very high92.2Very high87 Ų8746 Ų4641%0.40728%0.276SS..Hα-helixtrans-63.4-39.6179.9-73.1-178.7152.300111.7R146 A147 G154R146-E150 HydrophobicContact CG-CG 4.3Å; R146-E150 VanDerWaalsContact CZ-CD 3.44Å; R146-E150 IonicContact CZ-OE1 2.8Å; R146-E150 IonicContact CZ-OE2 3.41Å; R146-E150 IonicContact NE-OE1 3.36Å; R146-E150 PolarHBondContact NE-OE1 3.08Å; R146-E150 VanDerWaalsContact NH1-CD 3.35Å; R146-E150 IonicContact NH1-OE1 3.12Å; R146-E150 PolarHBondContact NH1-OE1 3.41Å; R146-E150 VanDerWaalsContact NH1-OE1 3.12Å; R146-E150 IonicContact NH1-OE2 2.85Å; R146-E150 PolarHBondContact NH1-OE2 2.98Å; R146-E150 IonicContact NH2-OE1 2.62Å; R146-E150 PolarHBondContact NH2-OE1 3.23Å; R146-E150 IonicContact NH2-OE2 3.8Å; R146-E150 WeakPolarHBondContact O-CB 3.16Å; R146-E150 VanDerWaalsContact O-CG 3.31Å; R146-E150 WeakPolarHBondContact O-CG 3.11Å; R146-E150 PolarHBondContact O-N 3.01Å; A147-E150 PolarHBondContact O-N 3.47Å; E150-G154 PolarHBondContact O-N 3.13Å
151F94.5Very high92.1Very high50 Ų5043.9 Ų43.922%0.21926%0.255CS..Hα-helixtrans-62.3-46.4174.9170.4-105.6000112.8E109 R110 L113 A147 I148 R149 G154 Q155 L161E109-F151 HydrophobicContact CB-CB 3.8Å; E109-F151 HydrophobicContact CB-CD1 3.52Å; E109-F151 HydrophobicContact CB-CD2 4.01Å; E109-F151 HydrophobicContact CB-CE1 4.02Å; E109-F151 HydrophobicContact CB-CE2 4.48Å; E109-F151 HydrophobicContact CB-CG 3.5Å; E109-F151 HydrophobicContact CB-CZ 4.48Å; E109-F151 HydrophobicContact CG-CB 3.66Å; E109-F151 HydrophobicContact CG-CD1 4.36Å; E109-F151 HydrophobicContact CG-CD2 4.43Å; E109-F151 HydrophobicContact CG-CG 3.92Å; R110-F151 HydrophobicContact CG-CZ 4.08Å; L113-F151 HydrophobicContact CD1-CE1 4.27Å; A147-F151 VanDerWaalsContact O-CB 3.3Å; A147-F151 WeakPolarHBondContact O-CB 3.42Å; A147-F151 PolarHBondContact O-N 2.91Å; I148-F151 PolarHBondContact O-N 3.21Å; R149-F151 VanDerWaalsContact C-N 3.33Å; R149-F151 PolarHBondContact O-N 3.33Å; F151-G154 PolarHBondContact O-N 3.41Å; F151-Q155 PolarHBondContact O-N 3.01Å; F151-Q155 PolarHBondContact O-NE2 3.36Å; F151-L161 HydrophobicContact CE1-CD1 4.06Å
152I94Very high91.7Very high0 Ų046.3 Ų46.30%027%0.266CS..Hα-helixtrans-67.9-43178.6-67.1160.4000110.5F7 I148 R149 G154 Q155 G156 G157 W158F7-I152 HydrophobicContact CE2-CB 4.12Å; F7-I152 HydrophobicContact CE2-CD1 3.96Å; F7-I152 HydrophobicContact CE2-CG2 3.96Å; F7-I152 HydrophobicContact CZ-CD1 3.9Å; I148-I152 HydrophobicContact CG2-CD1 3.65Å; I148-I152 HydrophobicContact CG2-CG1 4.5Å; I148-I152 WeakPolarHBondContact O-CD1 3.31Å; I148-I152 VanDerWaalsContact O-CG1 3.31Å; I148-I152 WeakPolarHBondContact O-CG1 3.38Å; I148-I152 PolarHBondContact O-N 3.36Å; R149-I152 PolarHBondContact O-N 3.05Å; I152-G154 VanDerWaalsContact C-N 3.31Å; I152-G154 PolarHBondContact O-N 3.48Å; I152-Q155 PolarHBondContact O-N 3.23Å; I152-G156 PolarHBondContact O-N 3.31Å; I152-G157 WeakPolarHBondContact O-CA 3.27Å; I152-G157 PolarHBondContact O-N 2.99Å; I152-W158 HydrophobicContact CD1-CD2 4.1Å; I152-W158 HydrophobicContact CD1-CE3 4.05Å; I152-W158 HydrophobicContact CD1-CH2 3.38Å; I152-W158 HydrophobicContact CD1-CZ2 3.42Å; I152-W158 VanDerWaalsContact CD1-CZ2 3.42Å; I152-W158 HydrophobicContact CD1-CZ3 3.7Å; I152-W158 HydrophobicContact CG1-CZ3 4.43Å; I152-W158 HydrophobicContact CG2-CB 4.49Å; I152-W158 HydrophobicContact CG2-CD2 3.94Å; I152-W158 HydrophobicContact CG2-CE3 4.34Å; I152-W158 HydrophobicContact CG2-CG 3.98Å
153Q92.3Very high91Very high108 Ų10851.5 Ų51.551%0.50530%0.303SS..Hα-helixtrans-65.3-36.3176.8-72.9179.6-25.600112R149 Q155 G156R149-Q153 HydrophobicContact CG-CG 4.33Å; R149-Q153 WeakPolarHBondContact O-CB 3.36Å; R149-Q153 VanDerWaalsContact O-CG 3.27Å; R149-Q153 WeakPolarHBondContact O-CG 3.48Å; R149-Q153 PolarHBondContact O-N 3.39Å; Q153-Q155 PolarHBondContact O-N 2.67Å; Q153-G156 WeakPolarHBondContact O-CA 3.44Å; Q153-G156 PolarHBondContact O-N 2.62Å
154G91.8Very high90.9Very high70 Ų7052.6 Ų52.672%0.72231%0.311SS*.Hα-helixtrans-64-26.6174.600000113.6E150 F151 I152 G156E150-G154 PolarHBondContact O-N 3.13Å; F151-G154 PolarHBondContact O-N 3.41Å; I152-G154 VanDerWaalsContact C-N 3.31Å; I152-G154 PolarHBondContact O-N 3.48Å; G154-G156 VanDerWaalsContact C-N 3.27Å
155Q89.5Confident90.9Very high57 Ų5751.8 Ų51.827%0.26629%0.291SS..THydrogen-bonded Turntrans-80.9-3.9170.4-73.4173.383.700113.3F151 I152 Q153 N160F151-Q155 PolarHBondContact O-N 3.01Å; F151-Q155 PolarHBondContact O-NE2 3.36Å; I152-Q155 PolarHBondContact O-N 3.23Å; Q153-Q155 PolarHBondContact O-N 2.67Å; Q155-N160 WeakPolarHBondContact O-CB 3.41Å
156G90.1Very high90.8Very high40 Ų4053.1 Ų53.141%0.41230%0.298SS..THydrogen-bonded Turntrans91.120.9-175.300000113.7I152 Q153 G154 N160I152-G156 PolarHBondContact O-N 3.31Å; Q153-G156 WeakPolarHBondContact O-CA 3.44Å; Q153-G156 PolarHBondContact O-N 2.62Å; G154-G156 VanDerWaalsContact C-N 3.27Å; G156-N160 PolarHBondContact O-ND2 2.8Å
157G92.1Very high90.6Very high13 Ų1346.1 Ų46.113%0.13428%0.277CS..SBendtrans101.8177.7176.500000113.9I152 E159 N160 L161I152-G157 WeakPolarHBondContact O-CA 3.27Å; I152-G157 PolarHBondContact O-N 2.99Å; G157-E159 PolarHBondContact O-N 2.93Å; G157-N160 PolarHBondContact O-N 3.41Å; G157-N160 VanDerWaalsContact O-N 3.1Å; G157-L161 PolarHBondContact O-N 3.48Å
158W93Very high90.5Very high4 Ų446.9 Ų46.92%0.01528%0.278CS..G310 helixtrans-58.7-34.6-179.2-78.5114.5000113F7 T11 I14 F48 I53 L57 L113 I142 I152 N160 L161F7-W158 AromaticContact CD2-NE1 3.63Å; F7-W158 AromaticContact CE2-CD1 3.97Å; F7-W158 AromaticContact CE2-CE2 3.87Å; F7-W158 HydrophobicContact CE2-CZ2 4.26Å; F7-W158 AromaticContact CE2-NE1 3.3Å; F7-W158 VanDerWaalsContact CE2-NE1 3.3Å; F7-W158 AromaticContact CZ-CZ2 3.96Å; F7-W158 HydrophobicContact CZ-CZ2 3.96Å; F7-W158 AromaticContact CZ-NE1 3.71Å; T11-W158 HydrophobicContact CG2-CZ2 4.06Å; T11-W158 WeakPolarHBondContact OG1-CZ2 3.31Å; T11-W158 PolarHBondContact OG1-NE1 3.2Å; T11-W158 VanDerWaalsContact OG1-NE1 3.15Å; I14-W158 HydrophobicContact CD1-CB 3.8Å; I14-W158 HydrophobicContact CD1-CD2 3.4Å; I14-W158 HydrophobicContact CD1-CE3 3.65Å; I14-W158 HydrophobicContact CD1-CG 3.5Å; I14-W158 VanDerWaalsContact CD1-CG 3.5Å; I14-W158 HydrophobicContact CD1-CZ3 4.33Å; F48-W158 HydrophobicContact CE2-CB 4.17Å; I53-W158 HydrophobicContact CD1-CB 4.19Å; I53-W158 HydrophobicContact CG2-CE3 4.23Å; L57-W158 HydrophobicContact CD1-CZ3 3.98Å; L57-W158 HydrophobicContact CD2-CZ3 4.41Å; L113-W158 HydrophobicContact CD2-CH2 4.09Å; L113-W158 HydrophobicContact CD2-CZ3 4.49Å; I142-W158 HydrophobicContact CG2-CH2 4.06Å; I142-W158 HydrophobicContact CG2-CZ2 3.83Å; I152-W158 HydrophobicContact CD1-CD2 4.1Å; I152-W158 HydrophobicContact CD1-CE3 4.05Å; I152-W158 HydrophobicContact CD1-CH2 3.38Å; I152-W158 HydrophobicContact CD1-CZ2 3.42Å; I152-W158 VanDerWaalsContact CD1-CZ2 3.42Å; I152-W158 HydrophobicContact CD1-CZ3 3.7Å; I152-W158 HydrophobicContact CG1-CZ3 4.43Å; I152-W158 HydrophobicContact CG2-CB 4.49Å; I152-W158 HydrophobicContact CG2-CD2 3.94Å; I152-W158 HydrophobicContact CG2-CE3 4.34Å; I152-W158 HydrophobicContact CG2-CG 3.98Å; W158-N160 PolarHBondContact O-N 3.34Å; W158-L161 HydrophobicContact CE3-CD2 3.66Å; W158-L161 HydrophobicContact CZ3-CD2 3.58Å; W158-L161 WeakPolarHBondContact O-CB 3.33Å; W158-L161 PolarHBondContact O-N 3.15Å
159E90.8Very high90.2Very high32 Ų3250.1 Ų50.115%0.1530%0.296CS..G310 helixtrans-56.1-30.7175.548.4-92.7-138.400114K10 C46 R56 G157K10-E159 VanDerWaalsContact NZ-CD 3.32Å; K10-E159 IonicContact NZ-OE1 3.04Å; K10-E159 PolarHBondContact NZ-OE1 3.36Å; K10-E159 IonicContact NZ-OE2 2.63Å; K10-E159 PolarHBondContact NZ-OE2 3.2Å; C46-E159 HydrophobicContact CB-CB 4.13Å; C46-E159 VanDerWaalsContact O-CB 3.3Å; C46-E159 WeakPolarHBondContact O-CB 3.44Å; R56-E159 PolarHBondContact NH1-O 3.15Å; G157-E159 PolarHBondContact O-N 2.93Å
160N89.1Confident89.9Confident51 Ų5149.6 Ų49.627%0.27330%0.302SS..G310 helixtrans-106.43.6-176.2-66.8-52000112.9Q155 G156 G157 W158 E162 S163Q155-N160 WeakPolarHBondContact O-CB 3.41Å; G156-N160 PolarHBondContact O-ND2 2.8Å; G157-N160 PolarHBondContact O-N 3.41Å; G157-N160 VanDerWaalsContact O-N 3.1Å; W158-N160 PolarHBondContact O-N 3.34Å; N160-E162 PolarHBondContact O-N 2.88Å; N160-S163 WeakPolarHBondContact CA-OG 3.3Å; N160-S163 PolarHBondContact O-N 2.62Å; N160-S163 PolarHBondContact O-OG 3.36Å
161L88.3Confident89.6Confident1 Ų146.8 Ų46.81%0.00529%0.294CS..THydrogen-bonded Turntrans-58.7124.5176.4178.564.6000109.7R56 L57 L113 F151 G157 W158 S163R56-L161 WeakPolarHBondContact CD-O 3.44Å; R56-L161 PolarHBondContact NH1-O 3.2Å; L57-L161 HydrophobicContact CD1-CD2 4.46Å; L57-L161 HydrophobicContact CD2-CD2 3.62Å; L57-L161 HydrophobicContact CG-CD2 3.94Å; L113-L161 HydrophobicContact CD1-CD1 4.25Å; L113-L161 HydrophobicContact CD1-CD2 4.34Å; F151-L161 HydrophobicContact CE1-CD1 4.06Å; G157-L161 PolarHBondContact O-N 3.48Å; W158-L161 HydrophobicContact CE3-CD2 3.66Å; W158-L161 HydrophobicContact CZ3-CD2 3.58Å; W158-L161 WeakPolarHBondContact O-CB 3.33Å; W158-L161 PolarHBondContact O-N 3.15Å; L161-S163 PolarHBondContact O-N 3.12Å
162E81.3Confident89.1Confident64 Ų6446.5 Ų46.530%0.29930%0.3SS..THydrogen-bonded Turntrans55.433.2177.8-55.3-61.8163.600114.1R110 N160R110-E162 WeakPolarHBondContact CD-OE1 3.46Å; R110-E162 WeakPolarHBondContact CG-OE1 3.5Å; R110-E162 IonicContact CZ-OE1 3.13Å; R110-E162 IonicContact CZ-OE2 2.94Å; R110-E162 IonicContact NE-OE1 3.94Å; R110-E162 IonicContact NH1-OE1 2.66Å; R110-E162 PolarHBondContact NH1-OE1 3.24Å; R110-E162 IonicContact NH1-OE2 3.82Å; R110-E162 PolarHBondContact NH1-OE2 2.85Å; N160-E162 PolarHBondContact O-N 2.88Å
163S77.5Confident88.7Confident118 Ų11850.7 Ų50.783%0.82533%0.328SS*.  trans-89.80176.3-56.90000113.3R56 N160 L161R56-S163 PolarHBondContact NH1-OG 3.42Å; R56-S163 PolarHBondContact NH2-OG 3.25Å; R56-S163 VanDerWaalsContact NH2-OG 3.08Å; N160-S163 WeakPolarHBondContact CA-OG 3.3Å; N160-S163 PolarHBondContact O-N 2.62Å; N160-S163 PolarHBondContact O-OG 3.36Å; L161-S163 PolarHBondContact O-N 3.12Å

Retrieved 163 of 163 residues in 98 ms (Link to these results)

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