A0A087Y7F4_POEFO Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession A0A087Y7F4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 217 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M51.1Low75.1Confident240 Ų24085.2 Ų85.2100%1.18249%0.488SS*.  01320-69.2176.9-160.100108K3M1-K3 PolarHBondContact O-N 3.34Å
2S60.6Low76.2Confident50 Ų5079.6 Ų79.635%0.3545%0.454SS..  trans-59.7134.1171.6-57.70000109.6V4 E83S2-V4 VanDerWaalsContact C-N 3.26Å; S2-V4 PolarHBondContact O-N 3.33Å; S2-E83 WeakPolarHBondContact CA-OE1 3.38Å; S2-E83 WeakPolarHBondContact CB-OE1 3.31Å
3K64.2Low77.2Confident113 Ų11384.3 Ų84.349%0.49146%0.461SS..SBendtrans-73.8-18.8-177.2-65177.9177.3-178.50113M1 E83M1-K3 PolarHBondContact O-N 3.34Å; K3-E83 VanDerWaalsContact CB-OE2 3.23Å; K3-E83 WeakPolarHBondContact CB-OE2 3.46Å; K3-E83 WeakPolarHBondContact CG-OE2 3.39Å; K3-E83 PolarHBondContact N-OE1 3.45Å; K3-E83 PolarHBondContact N-OE2 2.95Å
4V70.3Confident78.1Confident5 Ų585.2 Ų85.23%0.0347%0.465CS..  trans-94.6136.3-177.7-98.60000112.9S2 M8 K9 K12 E83 L206 A209S2-V4 VanDerWaalsContact C-N 3.26Å; S2-V4 PolarHBondContact O-N 3.33Å; V4-M8 HydrophobicContact CB-CB 4.06Å; V4-M8 HydrophobicContact CB-CG 3.89Å; V4-M8 HydrophobicContact CG1-CB 3.98Å; V4-M8 HydrophobicContact CG1-CG 3.4Å; V4-M8 VanDerWaalsContact CG1-CG 3.4Å; V4-K9 WeakPolarHBondContact O-CE 3.3Å; V4-K9 WeakPolarHBondContact O-CG 3.43Å; V4-K12 HydrophobicContact CG2-CD 4.33Å; V4-E83 WeakPolarHBondContact CG2-OE1 3.35Å; V4-L206 HydrophobicContact CG2-CD1 4.47Å; V4-A209 HydrophobicContact CG1-CB 3.87Å
5Q78.5Confident78.9Confident172 Ų17279.9 Ų79.980%0.80444%0.435SS*.  trans-113.1158-179-75.5-178.9-9.400112.7
6G80.8Confident79.8Confident58 Ų5878.3 Ų78.360%0.59842%0.423SS*.THydrogen-bonded Turntrans65.5-141174.600000114.7M8 K9G6-M8 PolarHBondContact O-N 3.41Å; G6-M8 VanDerWaalsContact O-N 3.1Å; G6-K9 WeakPolarHBondContact O-CB 3.23Å; G6-K9 PolarHBondContact O-N 3.42Å
7G80.4Confident80.6Confident60 Ų6076.5 Ų76.562%0.61942%0.421SS*.Hα-helixtrans-58.2-22.6-176.800000114.9K9 C10 V11G7-K9 PolarHBondContact O-N 2.96Å; G7-C10 VanDerWaalsContact O-CB 3.29Å; G7-C10 WeakPolarHBondContact O-CB 3.33Å; G7-C10 PolarHBondContact O-N 3.2Å; G7-V11 PolarHBondContact O-N 3.5Å
8M81.3Confident81.2Confident43 Ų4377.4 Ų77.421%0.21242%0.421CS..Hα-helixtrans-66-24.9176.1-160.95662.900112.9V4 G6 C10 V11 K12 V205 L206 A209V4-M8 HydrophobicContact CB-CB 4.06Å; V4-M8 HydrophobicContact CB-CG 3.89Å; V4-M8 HydrophobicContact CG1-CB 3.98Å; V4-M8 HydrophobicContact CG1-CG 3.4Å; V4-M8 VanDerWaalsContact CG1-CG 3.4Å; G6-M8 PolarHBondContact O-N 3.41Å; G6-M8 VanDerWaalsContact O-N 3.1Å; M8-C10 VanDerWaalsContact C-N 3.33Å; M8-V11 PolarHBondContact O-N 3.17Å; M8-V11 HydrophobicContact SD-CB 4.21Å; M8-V11 HydrophobicContact SD-CG1 4.47Å; M8-K12 WeakPolarHBondContact O-CB 3.46Å; M8-K12 PolarHBondContact O-N 3.3Å; M8-V205 HydrophobicContact CE-CG1 3.38Å; M8-V205 HydrophobicContact SD-CG1 3.82Å; M8-L206 HydrophobicContact CG-CD1 4.03Å; M8-L206 HydrophobicContact SD-CD1 4.13Å; M8-A209 HydrophobicContact CE-CB 3.99Å; M8-A209 HydrophobicContact CG-CB 3.93Å; M8-A209 HydrophobicContact SD-CB 4.11Å
9K84.7Confident81.8Confident93 Ų9373.7 Ų73.740%0.40440%0.401SS..Hα-helixtrans-64.4-40.8170.8-69-173.9176.7178.50111V4 G6 G7 K12 Y13V4-K9 WeakPolarHBondContact O-CE 3.3Å; V4-K9 WeakPolarHBondContact O-CG 3.43Å; G6-K9 WeakPolarHBondContact O-CB 3.23Å; G6-K9 PolarHBondContact O-N 3.42Å; G7-K9 PolarHBondContact O-N 2.96Å; K9-K12 WeakPolarHBondContact O-CB 3.47Å; K9-K12 PolarHBondContact O-N 2.99Å; K9-Y13 HydrophobicContact CB-CE2 4.45Å; K9-Y13 WeakPolarHBondContact O-CD2 3.48Å; K9-Y13 PolarHBondContact O-N 3.48Å
10C86.5Confident82.5Confident76 Ų7673.9 Ų73.951%0.51440%0.397SS..Hα-helixtrans-61-48.9176.9-171.50000110.5G7 M8 K12 Y13 L14G7-C10 VanDerWaalsContact O-CB 3.29Å; G7-C10 WeakPolarHBondContact O-CB 3.33Å; G7-C10 PolarHBondContact O-N 3.2Å; M8-C10 VanDerWaalsContact C-N 3.33Å; C10-K12 VanDerWaalsContact C-N 3.32Å; C10-K12 PolarHBondContact O-N 3.34Å; C10-Y13 PolarHBondContact O-N 3.06Å; C10-L14 WeakPolarHBondContact O-CB 3.18Å; C10-L14 WeakPolarHBondContact O-CG 3.47Å; C10-L14 PolarHBondContact O-N 3.33Å
11V87.3Confident83.1Confident27 Ų2775.6 Ų75.616%0.16441%0.405CS..Hα-helixtrans-57.6-43.7176.6179.80000111.5G7 M8 Y13 L14 L15 F202G7-V11 PolarHBondContact O-N 3.5Å; M8-V11 PolarHBondContact O-N 3.17Å; M8-V11 HydrophobicContact SD-CB 4.21Å; M8-V11 HydrophobicContact SD-CG1 4.47Å; V11-Y13 PolarHBondContact O-N 3.3Å; V11-L14 PolarHBondContact O-N 2.85Å; V11-L15 VanDerWaalsContact O-CB 3.29Å; V11-L15 WeakPolarHBondContact O-CB 3.39Å; V11-L15 PolarHBondContact O-N 3.35Å; V11-F202 HydrophobicContact CG1-CB 3.95Å; V11-F202 HydrophobicContact CG1-CD1 4Å; V11-F202 HydrophobicContact CG1-CG 3.94Å
12K88.4Confident85Confident18 Ų1868 Ų688%0.07837%0.366CS..Hα-helixtrans-58.2-48.8175.9175.9179.8174.1169.10112.2V4 M8 K9 C10 F16 A80 E83 L206V4-K12 HydrophobicContact CG2-CD 4.33Å; M8-K12 WeakPolarHBondContact O-CB 3.46Å; M8-K12 PolarHBondContact O-N 3.3Å; K9-K12 WeakPolarHBondContact O-CB 3.47Å; K9-K12 PolarHBondContact O-N 2.99Å; C10-K12 VanDerWaalsContact C-N 3.32Å; C10-K12 PolarHBondContact O-N 3.34Å; K12-F16 WeakPolarHBondContact O-CB 3.17Å; K12-F16 PolarHBondContact O-N 2.78Å; K12-A80 WeakPolarHBondContact CE-O 3.41Å; K12-E83 IonicContact NZ-OE1 3.8Å; K12-E83 PolarHBondContact NZ-OE1 2.94Å; K12-L206 HydrophobicContact CB-CD1 4.26Å
13Y89.9Confident86.7Confident141 Ų14168.7 Ų68.755%0.55336%0.361SS*.Hα-helixtrans-70.5-37.1-178.4-74.3-67000112.5K9 C10 V11 F16 A17K9-Y13 HydrophobicContact CB-CE2 4.45Å; K9-Y13 WeakPolarHBondContact O-CD2 3.48Å; K9-Y13 PolarHBondContact O-N 3.48Å; C10-Y13 PolarHBondContact O-N 3.06Å; V11-Y13 PolarHBondContact O-N 3.3Å; Y13-F16 PolarHBondContact O-N 3.31Å; Y13-A17 VanDerWaalsContact O-CB 3.3Å; Y13-A17 WeakPolarHBondContact O-CB 3.19Å; Y13-A17 PolarHBondContact O-N 3.39Å
14L90.1Very high88.3Confident97 Ų9767.2 Ų67.251%0.50836%0.358SS..Hα-helixtrans-63.2-47.9173.8-72.8174.3000111.3C10 V11 F16 A17 F18C10-L14 WeakPolarHBondContact O-CB 3.18Å; C10-L14 WeakPolarHBondContact O-CG 3.47Å; C10-L14 PolarHBondContact O-N 3.33Å; V11-L14 PolarHBondContact O-N 2.85Å; L14-F16 VanDerWaalsContact C-N 3.32Å; L14-F16 PolarHBondContact O-N 2.94Å; L14-A17 PolarHBondContact O-N 2.94Å; L14-F18 VanDerWaalsContact O-CB 3.3Å; L14-F18 WeakPolarHBondContact O-CB 3.3Å; L14-F18 PolarHBondContact O-N 3.29Å
15L89.8Confident89.4Confident5 Ų569.1 Ų69.13%0.02637%0.371CS..Hα-helixtrans-62.2-41.5177.6-167151.4000110.7V11 N19 G76 A80 F202V11-L15 VanDerWaalsContact O-CB 3.29Å; V11-L15 WeakPolarHBondContact O-CB 3.39Å; V11-L15 PolarHBondContact O-N 3.35Å; L15-N19 WeakPolarHBondContact CD2-ND2 3.44Å; L15-N19 VanDerWaalsContact O-CB 3.31Å; L15-N19 WeakPolarHBondContact O-CB 3.16Å; L15-N19 PolarHBondContact O-N 3.16Å; L15-N19 VanDerWaalsContact O-N 3.08Å; L15-N19 PolarHBondContact O-ND2 2.96Å; L15-G76 WeakPolarHBondContact CD2-O 3.29Å; L15-A80 HydrophobicContact CD2-CB 3.76Å; L15-F202 HydrophobicContact CD1-CB 3.69Å
16F92.9Very high90.3Very high55 Ų5560.9 Ų60.924%0.24133%0.333CS..Hα-helixtrans-62.2-52.7175171.8-108.2000112.3K12 Y13 L14 F18 N19 F20 C77 A80 I81K12-F16 WeakPolarHBondContact O-CB 3.17Å; K12-F16 PolarHBondContact O-N 2.78Å; Y13-F16 PolarHBondContact O-N 3.31Å; L14-F16 VanDerWaalsContact C-N 3.32Å; L14-F16 PolarHBondContact O-N 2.94Å; F16-F18 PolarHBondContact O-N 3.46Å; F16-N19 PolarHBondContact O-N 3.18Å; F16-F20 HydrophobicContact CE2-CB 4.26Å; F16-F20 HydrophobicContact CE2-CD2 4.18Å; F16-F20 HydrophobicContact CE2-CG 4.43Å; F16-F20 HydrophobicContact CZ-CB 4.26Å; F16-F20 HydrophobicContact CZ-CD2 4.08Å; F16-F20 HydrophobicContact CZ-CG 4.16Å; F16-F20 WeakPolarHBondContact O-CB 3.37Å; F16-F20 PolarHBondContact O-N 2.94Å; F16-C77 HydrophobicContact CD2-CB 4.01Å; F16-C77 HydrophobicContact CE2-CB 4.03Å; F16-A80 HydrophobicContact CB-CB 4.23Å; F16-I81 HydrophobicContact CD2-CD1 3.44Å; F16-I81 VanDerWaalsContact CD2-CD1 3.44Å; F16-I81 HydrophobicContact CD2-CG1 3.59Å; F16-I81 HydrophobicContact CE1-CD1 4.36Å; F16-I81 HydrophobicContact CE2-CD1 3.12Å; F16-I81 HydrophobicContact CE2-CG1 3.86Å; F16-I81 HydrophobicContact CG-CD1 4.21Å; F16-I81 HydrophobicContact CG-CG1 4.14Å; F16-I81 HydrophobicContact CZ-CD1 3.64Å
17A93.4Very high91Very high47 Ų4761.2 Ų61.239%0.38832%0.32SS..Hα-helixtrans-61.6-46-176.100000111.7Y13 L14 F20 I21Y13-A17 VanDerWaalsContact O-CB 3.3Å; Y13-A17 WeakPolarHBondContact O-CB 3.19Å; Y13-A17 PolarHBondContact O-N 3.39Å; L14-A17 PolarHBondContact O-N 2.94Å; A17-F20 PolarHBondContact O-N 3.12Å; A17-I21 WeakPolarHBondContact O-CG1 3.5Å; A17-I21 PolarHBondContact O-N 3.46Å; A17-I21 VanDerWaalsContact O-N 3.08Å
18F91.6Very high91.7Very high93 Ų9363.9 Ų63.941%0.40832%0.32SS..Hα-helixtrans-61.9-52.3178.2-174-98000111.6L14 F16 F20 I21 F22 V195L14-F18 VanDerWaalsContact O-CB 3.3Å; L14-F18 WeakPolarHBondContact O-CB 3.3Å; L14-F18 PolarHBondContact O-N 3.29Å; F16-F18 PolarHBondContact O-N 3.46Å; F18-F20 PolarHBondContact O-N 3.29Å; F18-I21 PolarHBondContact O-N 2.97Å; F18-F22 AromaticContact CD1-CD2 3.92Å; F18-F22 HydrophobicContact CD1-CD2 3.92Å; F18-F22 HydrophobicContact CD1-CE2 4.04Å; F18-F22 HydrophobicContact CD2-CD2 4.47Å; F18-F22 HydrophobicContact CD2-CE2 4.19Å; F18-F22 AromaticContact CE1-CD2 3.58Å; F18-F22 HydrophobicContact CE1-CD2 3.58Å; F18-F22 AromaticContact CE1-CE2 3.3Å; F18-F22 HydrophobicContact CE1-CE2 3.3Å; F18-F22 HydrophobicContact CE1-CG 4.5Å; F18-F22 AromaticContact CE1-CZ 3.98Å; F18-F22 HydrophobicContact CE1-CZ 3.98Å; F18-F22 HydrophobicContact CE2-CD2 4.19Å; F18-F22 AromaticContact CE2-CE2 3.49Å; F18-F22 HydrophobicContact CE2-CE2 3.49Å; F18-F22 VanDerWaalsContact CE2-CE2 3.49Å; F18-F22 HydrophobicContact CE2-CZ 4.38Å; F18-F22 HydrophobicContact CG-CD2 4.36Å; F18-F22 HydrophobicContact CG-CE2 4.43Å; F18-F22 AromaticContact CZ-CD2 3.74Å; F18-F22 HydrophobicContact CZ-CD2 3.74Å; F18-F22 AromaticContact CZ-CE2 2.98Å; F18-F22 HydrophobicContact CZ-CE2 2.98Å; F18-F22 AromaticContact CZ-CZ 3.61Å; F18-F22 HydrophobicContact CZ-CZ 3.61Å; F18-F22 WeakPolarHBondContact O-CD2 3.35Å; F18-F22 PolarHBondContact O-N 2.71Å; F18-F22 VanDerWaalsContact O-N 3.08Å; F18-V195 HydrophobicContact CE1-CG1 3.76Å; F18-V195 HydrophobicContact CE2-CG1 4.44Å; F18-V195 HydrophobicContact CZ-CG1 3.36Å
19N93.3Very high92.3Very high8 Ų863.5 Ų63.54%0.04332%0.32CS..Hα-helixtrans-64-28178.7-77.1-79000112.5L15 F16 F22 W23 C77 F91L15-N19 WeakPolarHBondContact CD2-ND2 3.44Å; L15-N19 VanDerWaalsContact O-CB 3.31Å; L15-N19 WeakPolarHBondContact O-CB 3.16Å; L15-N19 PolarHBondContact O-N 3.16Å; L15-N19 VanDerWaalsContact O-N 3.08Å; L15-N19 PolarHBondContact O-ND2 2.96Å; F16-N19 PolarHBondContact O-N 3.18Å; N19-F22 PolarHBondContact O-N 2.88Å; N19-W23 WeakPolarHBondContact O-CB 3.05Å; N19-W23 PolarHBondContact O-N 2.9Å; N19-C77 VanDerWaalsContact CB-SG 3.57Å; N19-C77 PolarHBondContact O-SG 2.89Å; N19-F91 WeakPolarHBondContact OD1-CE2 3.35Å; N19-F91 VanDerWaalsContact OD1-CZ 3.28Å; N19-F91 WeakPolarHBondContact OD1-CZ 3.5Å
20F94.6Very high92.7Very high76 Ų7660.5 Ų60.533%0.33331%0.308SS..Hα-helixtrans-71.6-39179.4-173.8-105.5000111.2F16 A17 F18 F22 W23 L24 C77F16-F20 HydrophobicContact CE2-CB 4.26Å; F16-F20 HydrophobicContact CE2-CD2 4.18Å; F16-F20 HydrophobicContact CE2-CG 4.43Å; F16-F20 HydrophobicContact CZ-CB 4.26Å; F16-F20 HydrophobicContact CZ-CD2 4.08Å; F16-F20 HydrophobicContact CZ-CG 4.16Å; F16-F20 WeakPolarHBondContact O-CB 3.37Å; F16-F20 PolarHBondContact O-N 2.94Å; A17-F20 PolarHBondContact O-N 3.12Å; F18-F20 PolarHBondContact O-N 3.29Å; F20-F22 VanDerWaalsContact C-N 3.35Å; F20-W23 AromaticContact CD2-CE3 3.86Å; F20-W23 HydrophobicContact CD2-CE3 3.86Å; F20-W23 HydrophobicContact CD2-CZ3 4.32Å; F20-W23 AromaticContact CE2-CE3 3.6Å; F20-W23 HydrophobicContact CE2-CE3 3.6Å; F20-W23 AromaticContact CE2-CZ3 3.59Å; F20-W23 HydrophobicContact CE2-CZ3 3.59Å; F20-W23 HydrophobicContact CZ-CE3 4.35Å; F20-W23 HydrophobicContact CZ-CZ3 4.18Å; F20-W23 PolarHBondContact O-N 3.44Å; F20-L24 HydrophobicContact CD1-CD1 4.07Å; F20-L24 HydrophobicContact CE1-CD1 3.63Å; F20-L24 HydrophobicContact CE1-CG 4.21Å; F20-L24 HydrophobicContact CZ-CD1 4.17Å; F20-L24 HydrophobicContact CZ-CD2 4.46Å; F20-L24 HydrophobicContact CZ-CG 4.37Å; F20-L24 WeakPolarHBondContact O-CG 3.43Å; F20-L24 PolarHBondContact O-N 2.93Å; F20-C77 WeakPolarHBondContact CA-SG 3.3Å; F20-C77 PolarHBondContact N-SG 3.5Å
21I94.7Very high92.9Very high110 Ų11059.6 Ų59.656%0.56431%0.306SS*.Hα-helixtrans-62.5-44.5171.5-65164000110.1A17 F18 W23 L24 S25A17-I21 WeakPolarHBondContact O-CG1 3.5Å; A17-I21 PolarHBondContact O-N 3.46Å; A17-I21 VanDerWaalsContact O-N 3.08Å; F18-I21 PolarHBondContact O-N 2.97Å; I21-W23 VanDerWaalsContact C-N 3.3Å; I21-W23 PolarHBondContact O-N 3.3Å; I21-L24 PolarHBondContact O-N 3.26Å; I21-S25 PolarHBondContact O-N 3.5Å; I21-S25 PolarHBondContact O-OG 2.9Å
22F92.5Very high92.9Very high81 Ų8161.8 Ų61.836%0.35532%0.32SS..Hα-helixtrans-62.9-35.7176-90.4-96.9000113.3F18 N19 F20 S25 G26F18-F22 AromaticContact CD1-CD2 3.92Å; F18-F22 HydrophobicContact CD1-CD2 3.92Å; F18-F22 HydrophobicContact CD1-CE2 4.04Å; F18-F22 HydrophobicContact CD2-CD2 4.47Å; F18-F22 HydrophobicContact CD2-CE2 4.19Å; F18-F22 AromaticContact CE1-CD2 3.58Å; F18-F22 HydrophobicContact CE1-CD2 3.58Å; F18-F22 AromaticContact CE1-CE2 3.3Å; F18-F22 HydrophobicContact CE1-CE2 3.3Å; F18-F22 HydrophobicContact CE1-CG 4.5Å; F18-F22 AromaticContact CE1-CZ 3.98Å; F18-F22 HydrophobicContact CE1-CZ 3.98Å; F18-F22 HydrophobicContact CE2-CD2 4.19Å; F18-F22 AromaticContact CE2-CE2 3.49Å; F18-F22 HydrophobicContact CE2-CE2 3.49Å; F18-F22 VanDerWaalsContact CE2-CE2 3.49Å; F18-F22 HydrophobicContact CE2-CZ 4.38Å; F18-F22 HydrophobicContact CG-CD2 4.36Å; F18-F22 HydrophobicContact CG-CE2 4.43Å; F18-F22 AromaticContact CZ-CD2 3.74Å; F18-F22 HydrophobicContact CZ-CD2 3.74Å; F18-F22 AromaticContact CZ-CE2 2.98Å; F18-F22 HydrophobicContact CZ-CE2 2.98Å; F18-F22 AromaticContact CZ-CZ 3.61Å; F18-F22 HydrophobicContact CZ-CZ 3.61Å; F18-F22 WeakPolarHBondContact O-CD2 3.35Å; F18-F22 PolarHBondContact O-N 2.71Å; F18-F22 VanDerWaalsContact O-N 3.08Å; N19-F22 PolarHBondContact O-N 2.88Å; F20-F22 VanDerWaalsContact C-N 3.35Å; F22-S25 WeakPolarHBondContact CA-OG 3.48Å; F22-S25 PolarHBondContact O-OG 3.42Å; F22-G26 PolarHBondContact O-N 3.23Å
23W96.4Very high92.8Very high64 Ų6461 Ų6124%0.24232%0.316CS..Hα-helixtrans-66.3-44.4175.6177.865.7000111.5N19 F20 I21 G26 L27 M70N19-W23 WeakPolarHBondContact O-CB 3.05Å; N19-W23 PolarHBondContact O-N 2.9Å; F20-W23 AromaticContact CD2-CE3 3.86Å; F20-W23 HydrophobicContact CD2-CE3 3.86Å; F20-W23 HydrophobicContact CD2-CZ3 4.32Å; F20-W23 AromaticContact CE2-CE3 3.6Å; F20-W23 HydrophobicContact CE2-CE3 3.6Å; F20-W23 AromaticContact CE2-CZ3 3.59Å; F20-W23 HydrophobicContact CE2-CZ3 3.59Å; F20-W23 HydrophobicContact CZ-CE3 4.35Å; F20-W23 HydrophobicContact CZ-CZ3 4.18Å; F20-W23 PolarHBondContact O-N 3.44Å; I21-W23 VanDerWaalsContact C-N 3.3Å; I21-W23 PolarHBondContact O-N 3.3Å; W23-G26 PolarHBondContact O-N 2.91Å; W23-L27 HydrophobicContact CD2-CD1 4.15Å; W23-L27 HydrophobicContact CE3-CD1 4.3Å; W23-L27 HydrophobicContact CH2-CD1 3.9Å; W23-L27 HydrophobicContact CZ2-CD1 3.72Å; W23-L27 HydrophobicContact CZ3-CD1 4.18Å; W23-L27 PolarHBondContact O-N 2.98Å; W23-M70 VanDerWaalsContact CD1-O 3.29Å
24L96.3Very high92.7Very high83 Ų8357.9 Ų57.944%0.43531%0.309SS..Hα-helixtrans-66-39.6175.9-69178.9000112.4F20 I21 G26 L27 L28F20-L24 HydrophobicContact CD1-CD1 4.07Å; F20-L24 HydrophobicContact CE1-CD1 3.63Å; F20-L24 HydrophobicContact CE1-CG 4.21Å; F20-L24 HydrophobicContact CZ-CD1 4.17Å; F20-L24 HydrophobicContact CZ-CD2 4.46Å; F20-L24 HydrophobicContact CZ-CG 4.37Å; F20-L24 WeakPolarHBondContact O-CG 3.43Å; F20-L24 PolarHBondContact O-N 2.93Å; I21-L24 PolarHBondContact O-N 3.26Å; L24-G26 VanDerWaalsContact C-N 3.35Å; L24-L27 HydrophobicContact CD2-CD1 4.33Å; L24-L27 WeakPolarHBondContact O-CB 3.36Å; L24-L27 PolarHBondContact O-N 2.86Å; L24-L28 PolarHBondContact O-N 3.23Å
25S95.1Very high92.4Very high44 Ų4461.3 Ų61.331%0.30832%0.315SS..Hα-helixtrans-65.5-39.3174.967.30000111.5I21 F22 L27 L28 V29I21-S25 PolarHBondContact O-N 3.5Å; I21-S25 PolarHBondContact O-OG 2.9Å; F22-S25 WeakPolarHBondContact CA-OG 3.48Å; F22-S25 PolarHBondContact O-OG 3.42Å; S25-L27 VanDerWaalsContact C-N 3.34Å; S25-L27 PolarHBondContact O-N 3.27Å; S25-L28 WeakPolarHBondContact O-CB 3.5Å; S25-L28 PolarHBondContact O-N 3.43Å; S25-V29 WeakPolarHBondContact O-CG2 3.39Å; S25-V29 PolarHBondContact O-N 2.93Å
26G96.1Very high91.8Very high0 Ų062.6 Ų62.60%032%0.322CS..Hα-helixtrans-58.5-43.4172.400000112.8F22 W23 L24 V29 L30F22-G26 PolarHBondContact O-N 3.23Å; W23-G26 PolarHBondContact O-N 2.91Å; L24-G26 VanDerWaalsContact C-N 3.35Å; G26-V29 PolarHBondContact O-N 3.44Å; G26-L30 WeakPolarHBondContact O-CB 3.31Å; G26-L30 WeakPolarHBondContact O-CG 3.31Å; G26-L30 PolarHBondContact O-N 2.99Å
27L96.1Very high91.1Very high64 Ų6463.1 Ų63.134%0.33532%0.322SS..Hα-helixtrans-62-42.7174-75.2171.5000112.5W23 L24 S25 L30 A31 M70W23-L27 HydrophobicContact CD2-CD1 4.15Å; W23-L27 HydrophobicContact CE3-CD1 4.3Å; W23-L27 HydrophobicContact CH2-CD1 3.9Å; W23-L27 HydrophobicContact CZ2-CD1 3.72Å; W23-L27 HydrophobicContact CZ3-CD1 4.18Å; W23-L27 PolarHBondContact O-N 2.98Å; L24-L27 HydrophobicContact CD2-CD1 4.33Å; L24-L27 WeakPolarHBondContact O-CB 3.36Å; L24-L27 PolarHBondContact O-N 2.86Å; S25-L27 VanDerWaalsContact C-N 3.34Å; S25-L27 PolarHBondContact O-N 3.27Å; L27-L30 PolarHBondContact O-N 3.44Å; L27-A31 WeakPolarHBondContact O-CB 3.46Å; L27-A31 PolarHBondContact O-N 3.42Å; L27-M70 HydrophobicContact CD2-CG 4.2Å; L27-M70 HydrophobicContact CD2-SD 3.43Å; L27-M70 WeakPolarHBondContact CD2-SD 3.5Å; L27-M70 HydrophobicContact CG-CG 4.36Å; L27-M70 HydrophobicContact CG-SD 4.22Å
28L95.4Very high90.3Very high116 Ų11667.8 Ų67.861%0.60733%0.334SS*.Hα-helixtrans-62.1-47.8177.3-177.470.6000111.2L24 S25 L30 A31 V32L24-L28 PolarHBondContact O-N 3.23Å; S25-L28 WeakPolarHBondContact O-CB 3.5Å; S25-L28 PolarHBondContact O-N 3.43Å; L28-L30 VanDerWaalsContact C-N 3.34Å; L28-L30 PolarHBondContact O-N 2.86Å; L28-A31 WeakPolarHBondContact O-CB 3.24Å; L28-A31 PolarHBondContact O-N 3.04Å; L28-A31 VanDerWaalsContact O-N 3.15Å; L28-V32 WeakPolarHBondContact O-CG2 3.32Å; L28-V32 PolarHBondContact O-N 3.41Å
29V93.1Very high89.5Confident36 Ų3664.7 Ų64.722%0.21832%0.322CS..Hα-helixtrans-62.8-41.8179.2172.80000111.2S25 G26 A31 V32 G33 L62 M69S25-V29 WeakPolarHBondContact O-CG2 3.39Å; S25-V29 PolarHBondContact O-N 2.93Å; G26-V29 PolarHBondContact O-N 3.44Å; V29-A31 PolarHBondContact O-N 3.38Å; V29-V32 PolarHBondContact O-N 3.33Å; V29-G33 PolarHBondContact O-N 2.87Å; V29-L62 HydrophobicContact CG1-CD1 3.63Å; V29-L62 HydrophobicContact CG1-CG 3.9Å; V29-M69 HydrophobicContact CB-CE 4.06Å; V29-M69 HydrophobicContact CG1-CE 4.1Å; V29-M69 HydrophobicContact CG2-CE 3.94Å
30L93.8Very high87.9Confident29 Ų2968.2 Ų68.215%0.15235%0.345CS..Hα-helixtrans-60.1-43.9172-81.5175.9000112.2G26 L27 L28 V32 G33 L34 L63 M70G26-L30 WeakPolarHBondContact O-CB 3.31Å; G26-L30 WeakPolarHBondContact O-CG 3.31Å; G26-L30 PolarHBondContact O-N 2.99Å; L27-L30 PolarHBondContact O-N 3.44Å; L28-L30 VanDerWaalsContact C-N 3.34Å; L28-L30 PolarHBondContact O-N 2.86Å; L30-V32 VanDerWaalsContact C-N 3.32Å; L30-V32 PolarHBondContact O-N 3.49Å; L30-G33 PolarHBondContact O-N 3.33Å; L30-L34 WeakPolarHBondContact O-CB 3.38Å; L30-L34 WeakPolarHBondContact O-CG 3.37Å; L30-L34 PolarHBondContact O-N 2.91Å; L30-L63 HydrophobicContact CD2-CD2 4.17Å; L30-L63 VanDerWaalsContact CD2-O 3.25Å; L30-L63 WeakPolarHBondContact CD2-O 3.1Å; L30-M70 HydrophobicContact CD1-CB 4.22Å; L30-M70 HydrophobicContact CD1-CE 3.99Å; L30-M70 HydrophobicContact CD1-SD 3.76Å
31A91.3Very high86.3Confident57 Ų5769.8 Ų69.847%0.47136%0.357SS..Hα-helixtrans-60.8-43.5179.600000111.1L27 L28 V29 L34 W35L27-A31 WeakPolarHBondContact O-CB 3.46Å; L27-A31 PolarHBondContact O-N 3.42Å; L28-A31 WeakPolarHBondContact O-CB 3.24Å; L28-A31 PolarHBondContact O-N 3.04Å; L28-A31 VanDerWaalsContact O-N 3.15Å; V29-A31 PolarHBondContact O-N 3.38Å; A31-L34 PolarHBondContact O-N 3.32Å; A31-W35 VanDerWaalsContact O-CB 3.31Å; A31-W35 WeakPolarHBondContact O-CB 3.43Å; A31-W35 PolarHBondContact O-N 2.94Å
32V86.6Confident84.5Confident74 Ų7465 Ų6545%0.44833%0.332SS..Hα-helixtrans-64.4-46.5174.9175.30000111.3L28 V29 L30 L34 W35 L36 L62L28-V32 WeakPolarHBondContact O-CG2 3.32Å; L28-V32 PolarHBondContact O-N 3.41Å; V29-V32 PolarHBondContact O-N 3.33Å; L30-V32 VanDerWaalsContact C-N 3.32Å; L30-V32 PolarHBondContact O-N 3.49Å; V32-L34 VanDerWaalsContact C-N 3.33Å; V32-L34 PolarHBondContact O-N 2.98Å; V32-W35 WeakPolarHBondContact O-CB 3.49Å; V32-W35 PolarHBondContact O-N 3.23Å; V32-L36 HydrophobicContact CG1-CD1 4.2Å; V32-L36 WeakPolarHBondContact O-CG 3.32Å; V32-L36 PolarHBondContact O-N 3.03Å; V32-L62 HydrophobicContact CG1-CD2 4.32Å
33G86.5Confident82.7Confident0 Ų063 Ų630%033%0.327CS..Hα-helixtrans-62.1-39.117800000113.1V29 L30 L36 R37 L63V29-G33 PolarHBondContact O-N 2.87Å; L30-G33 PolarHBondContact O-N 3.33Å; G33-L36 PolarHBondContact O-N 3.4Å; G33-R37 WeakPolarHBondContact O-CB 3.41Å; G33-R37 PolarHBondContact O-N 3.34Å; G33-L63 VanDerWaalsContact C-CD2 3.48Å
34L88.2Confident80.5Confident77 Ų7767.9 Ų67.940%0.40335%0.35SS..Hα-helixtrans-69.4-40.6176-70.5170.5000110.9L30 A31 V32 R37 F38 L63L30-L34 WeakPolarHBondContact O-CB 3.38Å; L30-L34 WeakPolarHBondContact O-CG 3.37Å; L30-L34 PolarHBondContact O-N 2.91Å; A31-L34 PolarHBondContact O-N 3.32Å; V32-L34 VanDerWaalsContact C-N 3.33Å; V32-L34 PolarHBondContact O-N 2.98Å; L34-R37 PolarHBondContact O-N 3.26Å; L34-R37 VanDerWaalsContact O-N 3.12Å; L34-F38 HydrophobicContact CB-CD2 4.26Å; L34-F38 HydrophobicContact CD2-CD2 4.02Å; L34-F38 HydrophobicContact CD2-CE2 3.6Å; L34-F38 WeakPolarHBondContact O-CB 3.43Å; L34-F38 WeakPolarHBondContact O-CD2 3.36Å; L34-F38 PolarHBondContact O-N 3.09Å; L34-L63 HydrophobicContact CB-CD2 4.5Å; L34-L63 HydrophobicContact CD2-CD2 3.83Å; L34-L63 HydrophobicContact CG-CD2 3.75Å
35W83.8Confident78.2Confident168 Ų16867.3 Ų67.364%0.63635%0.347SS*.Hα-helixtrans-57.1-49.9173.5-176.7-86000111A31 V32 R37 F38 D39A31-W35 VanDerWaalsContact O-CB 3.31Å; A31-W35 WeakPolarHBondContact O-CB 3.43Å; A31-W35 PolarHBondContact O-N 2.94Å; V32-W35 WeakPolarHBondContact O-CB 3.49Å; V32-W35 PolarHBondContact O-N 3.23Å; W35-R37 PolarHBondContact O-N 2.96Å; W35-F38 PolarHBondContact O-N 3.46Å; W35-D39 WeakPolarHBondContact O-CB 3.21Å; W35-D39 PolarHBondContact O-N 2.93Å
36L76.7Confident75.9Confident33 Ų3366.3 Ų66.317%0.17334%0.338CS..Hα-helixtrans-59.2-34.7175.6-68.4173.4000112.1V32 G33 T42 V59 L62V32-L36 HydrophobicContact CG1-CD1 4.2Å; V32-L36 WeakPolarHBondContact O-CG 3.32Å; V32-L36 PolarHBondContact O-N 3.03Å; G33-L36 PolarHBondContact O-N 3.4Å; L36-T42 WeakPolarHBondContact O-CG2 3.28Å; L36-V59 HydrophobicContact CB-CG1 4.19Å; L36-V59 HydrophobicContact CB-CG2 4.22Å; L36-V59 HydrophobicContact CD1-CG2 4.47Å; L36-L62 HydrophobicContact CD1-CD2 4.07Å
37R77.4Confident73.7Confident66 Ų6671.6 Ų71.625%0.24937%0.371CS..Hα-helixtrans-81-33-178-177.658.5-174.389-5.7114.7G33 L34 W35 V43 V59 Y60 L63G33-R37 WeakPolarHBondContact O-CB 3.41Å; G33-R37 PolarHBondContact O-N 3.34Å; L34-R37 PolarHBondContact O-N 3.26Å; L34-R37 VanDerWaalsContact O-N 3.12Å; W35-R37 PolarHBondContact O-N 2.96Å; R37-V43 WeakPolarHBondContact O-CG2 3.41Å; R37-V59 HydrophobicContact CB-CG1 4.13Å; R37-Y60 PolarHBondContact NE-OH 3.44Å; R37-L63 HydrophobicContact CB-CD1 4.38Å
38F76.9Confident71.2Confident145 Ų14570.6 Ų70.664%0.63638%0.375SS*.Hα-helixtrans-109.6-10.9-168.3-75.5-69.5000114.7L34 W35 P40L34-F38 HydrophobicContact CB-CD2 4.26Å; L34-F38 HydrophobicContact CD2-CD2 4.02Å; L34-F38 HydrophobicContact CD2-CE2 3.6Å; L34-F38 WeakPolarHBondContact O-CB 3.43Å; L34-F38 WeakPolarHBondContact O-CD2 3.36Å; L34-F38 PolarHBondContact O-N 3.09Å; W35-F38 PolarHBondContact O-N 3.46Å; F38-P40 WeakPolarHBondContact O-CD 3.36Å; F38-P40 VanDerWaalsContact O-N 3.11Å
39D74.6Confident68.7Low28 Ų2873.8 Ų73.815%0.1539%0.393CS..  trans-59.8118.8173.7-171.4-54000109.1W35 N41 T42 V43W35-D39 WeakPolarHBondContact O-CB 3.21Å; W35-D39 PolarHBondContact O-N 2.93Å; D39-N41 PolarHBondContact O-N 3.29Å; D39-N41 WeakPolarHBondContact OD1-CA 3.49Å; D39-N41 WeakPolarHBondContact OD1-CB 3.45Å; D39-N41 PolarHBondContact OD1-N 3.48Å; D39-N41 PolarHBondContact OD1-ND2 3.3Å; D39-T42 WeakPolarHBondContact CB-OG1 3.28Å; D39-T42 CarbonylContact O-C 3.57Å; D39-T42 WeakPolarHBondContact O-CA 3.24Å; D39-T42 WeakPolarHBondContact O-CB 3.46Å; D39-T42 PolarHBondContact O-N 3.03Å; D39-T42 PolarHBondContact OD1-N 3Å; D39-V43 PolarHBondContact O-N 3.42Å
40P60.5Low66.6Low81 Ų8175.8 Ų75.853%0.52642%0.421SS..Hα-helixtrans-67.9-19.4-173.626.7-34.1000112.7F38 K44F38-P40 WeakPolarHBondContact O-CD 3.36Å; F38-P40 VanDerWaalsContact O-N 3.11Å; P40-K44 WeakPolarHBondContact O-CB 3.25Å; P40-K44 VanDerWaalsContact O-CG 3.29Å; P40-K44 WeakPolarHBondContact O-CG 3.34Å; P40-K44 PolarHBondContact O-N 2.99Å
41N60.9Low64.4Low110 Ų11076 Ų7659%0.58843%0.428SS*.Hα-helixtrans-68.3-53.6167.5-52.3-64.6000107.6D39 V43 K44 L45D39-N41 PolarHBondContact O-N 3.29Å; D39-N41 WeakPolarHBondContact OD1-CA 3.49Å; D39-N41 WeakPolarHBondContact OD1-CB 3.45Å; D39-N41 PolarHBondContact OD1-N 3.48Å; D39-N41 PolarHBondContact OD1-ND2 3.3Å; N41-V43 PolarHBondContact O-N 2.98Å; N41-K44 PolarHBondContact O-N 3.29Å; N41-L45 WeakPolarHBondContact O-CB 3.05Å; N41-L45 WeakPolarHBondContact O-CD1 3.34Å; N41-L45 WeakPolarHBondContact O-CG 3.41Å; N41-L45 PolarHBondContact O-N 3.1Å; N41-L45 VanDerWaalsContact O-N 3.12Å
42T56.6Low62.7Low8 Ų875.4 Ų75.45%0.04942%0.418CS..Hα-helixtrans-54.8-48177.5-480000112.6L36 D39 K44 L45 L46 N134L36-T42 WeakPolarHBondContact O-CG2 3.28Å; D39-T42 WeakPolarHBondContact CB-OG1 3.28Å; D39-T42 CarbonylContact O-C 3.57Å; D39-T42 WeakPolarHBondContact O-CA 3.24Å; D39-T42 WeakPolarHBondContact O-CB 3.46Å; D39-T42 PolarHBondContact O-N 3.03Å; D39-T42 PolarHBondContact OD1-N 3Å; T42-K44 PolarHBondContact O-N 2.96Å; T42-L45 PolarHBondContact O-N 3.35Å; T42-L46 HydrophobicContact CG2-CD1 3.67Å; T42-L46 HydrophobicContact CG2-CG 4.36Å; T42-L46 WeakPolarHBondContact O-CB 3.44Å; T42-L46 VanDerWaalsContact O-CD1 3.25Å; T42-L46 WeakPolarHBondContact O-CD1 3.37Å; T42-L46 WeakPolarHBondContact O-CG 3.25Å; T42-L46 PolarHBondContact O-N 3.39Å; T42-N134 PolarHBondContact OG1-ND2 3.33Å
43V54.1Low61.5Low41 Ų4178.1 Ų78.125%0.24843%0.43CS..Hα-helixtrans-68.4-37.8-177.7178.80000113.6R37 D39 N41 L45 L46 T47R37-V43 WeakPolarHBondContact O-CG2 3.41Å; D39-V43 PolarHBondContact O-N 3.42Å; N41-V43 PolarHBondContact O-N 2.98Å; V43-L45 VanDerWaalsContact C-N 3.29Å; V43-L45 PolarHBondContact O-N 3.28Å; V43-L46 PolarHBondContact O-N 2.94Å; V43-T47 PolarHBondContact O-N 3.49Å; V43-T47 PolarHBondContact O-OG1 2.9Å
44K50.4Low60.4Low166 Ų16678.9 Ų78.972%0.72244%0.435SS*.Hα-helixtrans-69.1-31.1177.3-76.1179.4177-179.40112.2P40 N41 T42 L46 G48P40-K44 WeakPolarHBondContact O-CB 3.25Å; P40-K44 VanDerWaalsContact O-CG 3.29Å; P40-K44 WeakPolarHBondContact O-CG 3.34Å; P40-K44 PolarHBondContact O-N 2.99Å; N41-K44 PolarHBondContact O-N 3.29Å; T42-K44 PolarHBondContact O-N 2.96Å; K44-L46 VanDerWaalsContact C-N 3.32Å; K44-G48 PolarHBondContact O-N 2.92Å
45L47.6Very low59.4Low71 Ų7176.3 Ų76.337%0.37242%0.421SS..Hα-helixtrans-73.3-27.3173.8-64.2163.9000112.4N41 T42 V43 N132N41-L45 WeakPolarHBondContact O-CB 3.05Å; N41-L45 WeakPolarHBondContact O-CD1 3.34Å; N41-L45 WeakPolarHBondContact O-CG 3.41Å; N41-L45 PolarHBondContact O-N 3.1Å; N41-L45 VanDerWaalsContact O-N 3.12Å; T42-L45 PolarHBondContact O-N 3.35Å; V43-L45 VanDerWaalsContact C-N 3.29Å; V43-L45 PolarHBondContact O-N 3.28Å; L45-N132 HydrophobicContact CD1-CB 3.62Å; L45-N132 WeakPolarHBondContact CD1-ND2 3.43Å; L45-N132 WeakPolarHBondContact CD1-OD1 3.46Å; L45-N132 WeakPolarHBondContact CD2-ND2 3.4Å; L45-N132 WeakPolarHBondContact CD2-OD1 3.2Å; L45-N132 WeakPolarHBondContact CG-ND2 3.27Å
46L46.8Very low58.9Low23 Ų2370.2 Ų70.212%0.1240%0.399CS..THydrogen-bonded Turntrans-85.2-4.8178.3-69.1166.2000114.8T42 V43 K44 A51 F55 F56T42-L46 HydrophobicContact CG2-CD1 3.67Å; T42-L46 HydrophobicContact CG2-CG 4.36Å; T42-L46 WeakPolarHBondContact O-CB 3.44Å; T42-L46 VanDerWaalsContact O-CD1 3.25Å; T42-L46 WeakPolarHBondContact O-CD1 3.37Å; T42-L46 WeakPolarHBondContact O-CG 3.25Å; T42-L46 PolarHBondContact O-N 3.39Å; V43-L46 PolarHBondContact O-N 2.94Å; K44-L46 VanDerWaalsContact C-N 3.32Å; L46-A51 WeakPolarHBondContact O-CB 3.33Å; L46-F55 HydrophobicContact CD1-CD1 4.39Å; L46-F55 HydrophobicContact CD1-CE1 4.34Å; L46-F55 HydrophobicContact CD2-CB 4.5Å; L46-F55 HydrophobicContact CD2-CD1 3.47Å; L46-F55 VanDerWaalsContact CD2-CD1 3.47Å; L46-F55 HydrophobicContact CD2-CE1 4.03Å; L46-F55 HydrophobicContact CD2-CG 4.27Å; L46-F56 HydrophobicContact CB-CE1 4.25Å; L46-F56 HydrophobicContact CB-CE2 3.63Å; L46-F56 HydrophobicContact CB-CZ 3.33Å; L46-F56 HydrophobicContact CD1-CD1 4.41Å; L46-F56 HydrophobicContact CD1-CE1 3.66Å; L46-F56 HydrophobicContact CD1-CE2 4.29Å; L46-F56 HydrophobicContact CD1-CZ 3.62Å; L46-F56 HydrophobicContact CD2-CD2 4.35Å; L46-F56 HydrophobicContact CD2-CE2 3.91Å; L46-F56 HydrophobicContact CD2-CZ 4.11Å; L46-F56 HydrophobicContact CG-CE1 4.4Å; L46-F56 HydrophobicContact CG-CE2 4.16Å; L46-F56 HydrophobicContact CG-CZ 3.88Å
47T50.1Low59Low111 Ų11172.6 Ų72.668%0.68141%0.411SS*.SBendtrans-121.2-1.3-179.3-28.90000112.7V43V43-T47 PolarHBondContact O-N 3.49Å; V43-T47 PolarHBondContact O-OG1 2.9Å
48G44.9Very low59Low42 Ų4271.1 Ų71.143%0.43341%0.413SS..SBendtrans-75.4140.217300000110.8K44 G50 A51K44-G48 PolarHBondContact O-N 2.92Å; G48-G50 PolarHBondContact O-N 3.42Å; G48-A51 PolarHBondContact O-N 2.89Å
49D42.9Very low59.2Low183 Ų18364.5 Ų64.598%0.97938%0.384SS*.THydrogen-bonded Turntrans-27.1100.9-172.8-80.3-63000115.2
50G48.8Very low59.8Low78 Ų7869 Ų6980%0.80440%0.4SS*.THydrogen-bonded Turntrans104.619.1169.200000117.8G48G48-G50 PolarHBondContact O-N 3.42Å
51A47.5Very low61.2Low35 Ų3570.5 Ų70.529%0.28940%0.403SS..  trans-60.3132.1178.700000113L46 G48 D53L46-A51 WeakPolarHBondContact O-CB 3.33Å; G48-A51 PolarHBondContact O-N 2.89Å; A51-D53 PolarHBondContact O-N 2.97Å
52P56Low62.6Low43 Ų4368.1 Ų68.128%0.27939%0.39SS..  trans-74.6125.9-179.725.5-29000111.4T54 F55 D126P52-T54 PolarHBondContact O-N 3.35Å; P52-F55 PolarHBondContact O-N 3.3Å; P52-D126 HydrophobicContact CB-CB 4.13Å; P52-D126 WeakPolarHBondContact CB-OD2 3.39Å; P52-D126 HydrophobicContact CG-CB 3.5Å; P52-D126 VanDerWaalsContact CG-CB 3.5Å
53D61.6Low64.3Low131 Ų13169.1 Ų69.170%0.70139%0.394SS*.Hα-helixtrans-53.2-24.3175.8-66.9-47.5000113A51 F55 F56 I57A51-D53 PolarHBondContact O-N 2.97Å; D53-F55 VanDerWaalsContact C-N 3.34Å; D53-F55 PolarHBondContact O-N 3.27Å; D53-F56 PolarHBondContact O-N 3.39Å; D53-I57 WeakPolarHBondContact O-CG1 2.99Å; D53-I57 PolarHBondContact O-N 3.25Å
54T61.9Low66.2Low16 Ų1669.3 Ų69.310%0.09841%0.405CS..Hα-helixtrans-59.4-36.4-178-23.50000113.6P52 I57 A58 F123 D126P52-T54 PolarHBondContact O-N 3.35Å; T54-I57 WeakPolarHBondContact O-CB 3.2Å; T54-I57 PolarHBondContact O-N 2.93Å; T54-A58 PolarHBondContact O-N 2.94Å; T54-F123 HydrophobicContact CG2-CB 4.35Å; T54-F123 HydrophobicContact CG2-CD2 4.32Å; T54-D126 PolarHBondContact OG1-OD2 3.26Å; T54-D126 VanDerWaalsContact OG1-OD2 3.07Å
55F67.8Low68.3Low23 Ų2363.6 Ų63.610%0.10139%0.388CS..Hα-helixtrans-68.8-43.9-178.3-177.7-96000112.2L46 P52 D53 I57 A58 V59 F123 I138L46-F55 HydrophobicContact CD1-CD1 4.39Å; L46-F55 HydrophobicContact CD1-CE1 4.34Å; L46-F55 HydrophobicContact CD2-CB 4.5Å; L46-F55 HydrophobicContact CD2-CD1 3.47Å; L46-F55 VanDerWaalsContact CD2-CD1 3.47Å; L46-F55 HydrophobicContact CD2-CE1 4.03Å; L46-F55 HydrophobicContact CD2-CG 4.27Å; P52-F55 PolarHBondContact O-N 3.3Å; D53-F55 VanDerWaalsContact C-N 3.34Å; D53-F55 PolarHBondContact O-N 3.27Å; F55-I57 PolarHBondContact O-N 3.39Å; F55-A58 PolarHBondContact O-N 2.86Å; F55-V59 HydrophobicContact CD1-CG2 4.12Å; F55-V59 HydrophobicContact CE1-CG2 3.65Å; F55-V59 HydrophobicContact CZ-CG2 3.97Å; F55-V59 PolarHBondContact O-N 3.4Å; F55-F123 HydrophobicContact CB-CE2 4.48Å; F55-F123 AromaticContact CD2-CE2 3.92Å; F55-F123 HydrophobicContact CD2-CE2 3.92Å; F55-F123 AromaticContact CD2-CZ 3.93Å; F55-F123 HydrophobicContact CD2-CZ 3.93Å; F55-F123 HydrophobicContact CE2-CZ 4.32Å; F55-I138 HydrophobicContact CE2-CD1 3.69Å; F55-I138 HydrophobicContact CZ-CD1 4.12Å
56F73.1Confident70.6Confident40 Ų4060.2 Ų60.218%0.17537%0.371CS..Hα-helixtrans-60.1-37.9175.9-78.8-74.6000111.8L46 D53 A58 V59 Y60L46-F56 HydrophobicContact CB-CE1 4.25Å; L46-F56 HydrophobicContact CB-CE2 3.63Å; L46-F56 HydrophobicContact CB-CZ 3.33Å; L46-F56 HydrophobicContact CD1-CD1 4.41Å; L46-F56 HydrophobicContact CD1-CE1 3.66Å; L46-F56 HydrophobicContact CD1-CE2 4.29Å; L46-F56 HydrophobicContact CD1-CZ 3.62Å; L46-F56 HydrophobicContact CD2-CD2 4.35Å; L46-F56 HydrophobicContact CD2-CE2 3.91Å; L46-F56 HydrophobicContact CD2-CZ 4.11Å; L46-F56 HydrophobicContact CG-CE1 4.4Å; L46-F56 HydrophobicContact CG-CE2 4.16Å; L46-F56 HydrophobicContact CG-CZ 3.88Å; D53-F56 PolarHBondContact O-N 3.39Å; F56-A58 PolarHBondContact O-N 3.41Å; F56-V59 PolarHBondContact O-N 2.91Å; F56-Y60 HydrophobicContact CB-CD2 4.23Å; F56-Y60 HydrophobicContact CB-CE2 4.01Å; F56-Y60 HydrophobicContact CD1-CE2 4.32Å; F56-Y60 WeakPolarHBondContact O-CD2 3.44Å; F56-Y60 PolarHBondContact O-N 3.28Å
57I77.9Confident73Confident83 Ų8360 Ų6043%0.42638%0.375SS..Hα-helixtrans-57.5-48.2176.7-66.9169.1000110.4D53 T54 F55 V59 Y60 I61D53-I57 WeakPolarHBondContact O-CG1 2.99Å; D53-I57 PolarHBondContact O-N 3.25Å; T54-I57 WeakPolarHBondContact O-CB 3.2Å; T54-I57 PolarHBondContact O-N 2.93Å; F55-I57 PolarHBondContact O-N 3.39Å; I57-V59 PolarHBondContact O-N 3.41Å; I57-Y60 PolarHBondContact O-N 2.92Å; I57-I61 HydrophobicContact CG2-CD1 3.81Å; I57-I61 HydrophobicContact CG2-CG1 4.44Å; I57-I61 VanDerWaalsContact O-CG1 3.28Å; I57-I61 WeakPolarHBondContact O-CG1 3.34Å; I57-I61 PolarHBondContact O-N 2.89Å
58A77.8Confident75.2Confident35 Ų3558.9 Ų58.929%0.28936%0.364SS..Hα-helixtrans-63.8-40.3178.600000113.1T54 F55 F56 I61 L62 F123T54-A58 PolarHBondContact O-N 2.94Å; F55-A58 PolarHBondContact O-N 2.86Å; F56-A58 PolarHBondContact O-N 3.41Å; A58-I61 PolarHBondContact O-N 2.96Å; A58-L62 WeakPolarHBondContact O-CB 3.43Å; A58-L62 PolarHBondContact O-N 2.94Å; A58-F123 HydrophobicContact CB-CD2 4.13Å; A58-F123 HydrophobicContact CB-CE2 3.28Å; A58-F123 HydrophobicContact CB-CZ 3.72Å
59V81.8Confident77.6Confident7 Ų759.7 Ų59.74%0.04236%0.357CS..Hα-helixtrans-64.5-40.4176.1177.30000111.1L36 R37 F55 F56 I57 L62 L63L36-V59 HydrophobicContact CB-CG1 4.19Å; L36-V59 HydrophobicContact CB-CG2 4.22Å; L36-V59 HydrophobicContact CD1-CG2 4.47Å; R37-V59 HydrophobicContact CB-CG1 4.13Å; F55-V59 HydrophobicContact CD1-CG2 4.12Å; F55-V59 HydrophobicContact CE1-CG2 3.65Å; F55-V59 HydrophobicContact CZ-CG2 3.97Å; F55-V59 PolarHBondContact O-N 3.4Å; F56-V59 PolarHBondContact O-N 2.91Å; I57-V59 PolarHBondContact O-N 3.41Å; V59-L62 PolarHBondContact O-N 3.12Å; V59-L63 HydrophobicContact CG1-CD1 4.27Å; V59-L63 WeakPolarHBondContact O-CG 3.28Å; V59-L63 PolarHBondContact O-N 2.82Å
60Y87.1Confident80.1Confident123 Ų12353.7 Ų53.748%0.48232%0.324SS..Hα-helixtrans-66.9-37.7174.9-73.7-57.7000112.4R37 F56 I57 L62 L63 G64R37-Y60 PolarHBondContact NE-OH 3.44Å; F56-Y60 HydrophobicContact CB-CD2 4.23Å; F56-Y60 HydrophobicContact CB-CE2 4.01Å; F56-Y60 HydrophobicContact CD1-CE2 4.32Å; F56-Y60 WeakPolarHBondContact O-CD2 3.44Å; F56-Y60 PolarHBondContact O-N 3.28Å; I57-Y60 PolarHBondContact O-N 2.92Å; Y60-L62 VanDerWaalsContact C-N 3.34Å; Y60-L63 HydrophobicContact CD1-CD1 4.33Å; Y60-L63 PolarHBondContact O-N 2.88Å; Y60-G64 PolarHBondContact O-N 2.91Å
61I90Very high82.3Confident112 Ų11253 Ų5357%0.57430%0.304SS*.Hα-helixtrans-61-44.7172.1-69.3166.3000110.1I57 A58 G64 A65I57-I61 HydrophobicContact CG2-CD1 3.81Å; I57-I61 HydrophobicContact CG2-CG1 4.44Å; I57-I61 VanDerWaalsContact O-CG1 3.28Å; I57-I61 WeakPolarHBondContact O-CG1 3.34Å; I57-I61 PolarHBondContact O-N 2.89Å; A58-I61 PolarHBondContact O-N 2.96Å; I61-G64 PolarHBondContact O-N 3.15Å; I61-A65 VanDerWaalsContact O-CB 3.31Å; I61-A65 WeakPolarHBondContact O-CB 3.44Å; I61-A65 PolarHBondContact O-N 3.03Å
62L89.3Confident84.6Confident60 Ų6052 Ų5231%0.31429%0.294SS..Hα-helixtrans-62.6-44.4178.3-169.769.6000111.9V29 V32 L36 A58 V59 Y60 A65 G66V29-L62 HydrophobicContact CG1-CD1 3.63Å; V29-L62 HydrophobicContact CG1-CG 3.9Å; V32-L62 HydrophobicContact CG1-CD2 4.32Å; L36-L62 HydrophobicContact CD1-CD2 4.07Å; A58-L62 WeakPolarHBondContact O-CB 3.43Å; A58-L62 PolarHBondContact O-N 2.94Å; V59-L62 PolarHBondContact O-N 3.12Å; Y60-L62 VanDerWaalsContact C-N 3.34Å; L62-A65 PolarHBondContact O-N 3.45Å; L62-G66 PolarHBondContact O-N 3.43Å
63L92.9Very high86.5Confident28 Ų2850 Ų5015%0.14728%0.281CS..Hα-helixtrans-62.1-44.7174.5-75.8171.7000111.9L30 G33 L34 R37 V59 Y60 G67L30-L63 HydrophobicContact CD2-CD2 4.17Å; L30-L63 VanDerWaalsContact CD2-O 3.25Å; L30-L63 WeakPolarHBondContact CD2-O 3.1Å; G33-L63 VanDerWaalsContact C-CD2 3.48Å; L34-L63 HydrophobicContact CB-CD2 4.5Å; L34-L63 HydrophobicContact CD2-CD2 3.83Å; L34-L63 HydrophobicContact CG-CD2 3.75Å; R37-L63 HydrophobicContact CB-CD1 4.38Å; V59-L63 HydrophobicContact CG1-CD1 4.27Å; V59-L63 WeakPolarHBondContact O-CG 3.28Å; V59-L63 PolarHBondContact O-N 2.82Å; Y60-L63 HydrophobicContact CD1-CD1 4.33Å; Y60-L63 PolarHBondContact O-N 2.88Å; L63-G67 PolarHBondContact O-N 2.79Å
64G94.6Very high88Confident46 Ų4647.8 Ų47.847%0.47427%0.265SS..Hα-helixtrans-62-47.3177.100000112.1Y60 I61 G67 L68Y60-G64 PolarHBondContact O-N 2.91Å; I61-G64 PolarHBondContact O-N 3.15Å; G64-G67 PolarHBondContact O-N 3.32Å; G64-L68 WeakPolarHBondContact O-CB 3.43Å; G64-L68 PolarHBondContact O-N 3.27Å
65A94.2Very high89.5Confident45 Ų4549.7 Ų49.737%0.37227%0.273SS..Hα-helixtrans-63-46.8177.600000111.8I61 L62 G67 L68 M69I61-A65 VanDerWaalsContact O-CB 3.31Å; I61-A65 WeakPolarHBondContact O-CB 3.44Å; I61-A65 PolarHBondContact O-N 3.03Å; L62-A65 PolarHBondContact O-N 3.45Å; A65-G67 PolarHBondContact O-N 2.99Å; A65-L68 PolarHBondContact O-N 3.32Å; A65-M69 WeakPolarHBondContact O-CB 3.39Å; A65-M69 WeakPolarHBondContact O-CG 3.32Å; A65-M69 PolarHBondContact O-N 2.93Å
66G96.2Very high90.7Very high0 Ų048.6 Ų48.60%027%0.268CS..Hα-helixtrans-60-44.2175.600000112.6L62 M69 M70L62-G66 PolarHBondContact O-N 3.43Å; G66-M69 PolarHBondContact O-N 2.94Å; G66-M70 WeakPolarHBondContact O-CB 3.45Å; G66-M70 PolarHBondContact O-N 3.22Å
67G96.6Very high91.7Very high20 Ų2046.9 Ų46.921%0.20626%0.26CS..Hα-helixtrans-60.9-46.917600000112.5L63 G64 A65 M70 V71L63-G67 PolarHBondContact O-N 2.79Å; G64-G67 PolarHBondContact O-N 3.32Å; A65-G67 PolarHBondContact O-N 2.99Å; G67-M70 PolarHBondContact O-N 3.35Å; G67-V71 WeakPolarHBondContact O-CG2 3.34Å; G67-V71 PolarHBondContact O-N 3.01Å
68L95.6Very high92.3Very high87 Ų8746 Ų4646%0.45525%0.254SS..Hα-helixtrans-61.8-46.8177.4-176.163.6000111.5G64 A65 M70 V71 V72 I98G64-L68 WeakPolarHBondContact O-CB 3.43Å; G64-L68 PolarHBondContact O-N 3.27Å; A65-L68 PolarHBondContact O-N 3.32Å; L68-M70 VanDerWaalsContact C-N 3.31Å; L68-M70 PolarHBondContact O-N 3.42Å; L68-V71 PolarHBondContact O-N 2.83Å; L68-V72 HydrophobicContact CD1-CG2 4.16Å; L68-V72 HydrophobicContact CG-CG2 4.41Å; L68-V72 WeakPolarHBondContact O-CB 3.41Å; L68-V72 VanDerWaalsContact O-CG2 3.27Å; L68-V72 WeakPolarHBondContact O-CG2 3.31Å; L68-V72 PolarHBondContact O-N 2.86Å; L68-I98 HydrophobicContact CD1-CD1 4.23Å; L68-I98 HydrophobicContact CD2-CD1 4Å; L68-I98 HydrophobicContact CD2-CG1 4.17Å; L68-I98 HydrophobicContact CG-CD1 4.12Å
69M95.5Very high92.9Very high59 Ų5944.3 Ų44.329%0.29124%0.24SC..Hα-helixtrans-58.4-43.2175.8-74.8-171.8-70.900111.9V29 A65 G66 G73V29-M69 HydrophobicContact CB-CE 4.06Å; V29-M69 HydrophobicContact CG1-CE 4.1Å; V29-M69 HydrophobicContact CG2-CE 3.94Å; A65-M69 WeakPolarHBondContact O-CB 3.39Å; A65-M69 WeakPolarHBondContact O-CG 3.32Å; A65-M69 PolarHBondContact O-N 2.93Å; G66-M69 PolarHBondContact O-N 2.94Å; M69-G73 PolarHBondContact O-N 3.23Å
70M95.9Very high93.3Very high57 Ų5744 Ų4428%0.28124%0.238SC..Hα-helixtrans-62.6-46.2177.2-173.7-173.667.700111.7W23 L27 L30 G66 G67 L68 F74W23-M70 VanDerWaalsContact CD1-O 3.29Å; L27-M70 HydrophobicContact CD2-CG 4.2Å; L27-M70 HydrophobicContact CD2-SD 3.43Å; L27-M70 WeakPolarHBondContact CD2-SD 3.5Å; L27-M70 HydrophobicContact CG-CG 4.36Å; L27-M70 HydrophobicContact CG-SD 4.22Å; L30-M70 HydrophobicContact CD1-CB 4.22Å; L30-M70 HydrophobicContact CD1-CE 3.99Å; L30-M70 HydrophobicContact CD1-SD 3.76Å; G66-M70 WeakPolarHBondContact O-CB 3.45Å; G66-M70 PolarHBondContact O-N 3.22Å; G67-M70 PolarHBondContact O-N 3.35Å; L68-M70 VanDerWaalsContact C-N 3.31Å; L68-M70 PolarHBondContact O-N 3.42Å; M70-F74 VanDerWaalsContact O-CB 3.28Å; M70-F74 WeakPolarHBondContact O-CB 3.29Å; M70-F74 PolarHBondContact O-N 3.36Å
71V95.7Very high93.4Very high63 Ų6342.3 Ų42.338%0.38224%0.236SC..Hα-helixtrans-65.4-46.1-179.6171.10000111.4G67 L68 F74 F75G67-V71 WeakPolarHBondContact O-CG2 3.34Å; G67-V71 PolarHBondContact O-N 3.01Å; L68-V71 PolarHBondContact O-N 2.83Å; V71-F74 WeakPolarHBondContact O-CB 3.3Å; V71-F74 PolarHBondContact O-N 3.44Å; V71-F75 HydrophobicContact CG1-CD2 3.99Å; V71-F75 HydrophobicContact CG1-CE2 3.42Å; V71-F75 VanDerWaalsContact CG1-CE2 3.42Å; V71-F75 HydrophobicContact CG1-CZ 3.86Å; V71-F75 PolarHBondContact O-N 3.08Å
72V95.6Very high93.3Very high14 Ų1445.4 Ų45.49%0.08524%0.241CC..Hα-helixtrans-63.8-46.8179.1173.50000110.7L68 F74 F75 G76 F91 C94 L95 I98L68-V72 HydrophobicContact CD1-CG2 4.16Å; L68-V72 HydrophobicContact CG-CG2 4.41Å; L68-V72 WeakPolarHBondContact O-CB 3.41Å; L68-V72 VanDerWaalsContact O-CG2 3.27Å; L68-V72 WeakPolarHBondContact O-CG2 3.31Å; L68-V72 PolarHBondContact O-N 2.86Å; V72-F74 VanDerWaalsContact C-N 3.32Å; V72-F74 PolarHBondContact O-N 3.08Å; V72-F75 PolarHBondContact O-N 2.95Å; V72-G76 PolarHBondContact O-N 3.44Å; V72-F91 HydrophobicContact CG1-CD2 3.87Å; V72-F91 HydrophobicContact CG1-CE2 3.68Å; V72-F91 WeakPolarHBondContact O-CD2 3.29Å; V72-C94 HydrophobicContact CG2-CB 4.04Å; V72-L95 HydrophobicContact CG1-CD2 4.07Å; V72-I98 HydrophobicContact CG2-CD1 3.76Å
73G95.1Very high93.3Very high1 Ų143.5 Ų43.51%0.0123%0.23CC..Hα-helixtrans-60-4117600000112.2M69 G76 C77M69-G73 PolarHBondContact O-N 3.23Å; G73-G76 PolarHBondContact O-N 3.44Å; G73-C77 WeakPolarHBondContact O-CB 3.17Å; G73-C77 PolarHBondContact O-N 3.36Å; G73-C77 PolarHBondContact O-SG 3.28Å
74F93.9Very high93.2Very high84 Ų8443.8 Ų43.837%0.36824%0.235SC..Hα-helixtrans-59.5-50174.7177.1-90.5000111.7M70 V71 V72 G76 C77 F78M70-F74 VanDerWaalsContact O-CB 3.28Å; M70-F74 WeakPolarHBondContact O-CB 3.29Å; M70-F74 PolarHBondContact O-N 3.36Å; V71-F74 WeakPolarHBondContact O-CB 3.3Å; V71-F74 PolarHBondContact O-N 3.44Å; V72-F74 VanDerWaalsContact C-N 3.32Å; V72-F74 PolarHBondContact O-N 3.08Å; F74-G76 VanDerWaalsContact C-N 3.32Å; F74-G76 PolarHBondContact O-N 2.89Å; F74-C77 PolarHBondContact O-N 3.45Å; F74-F78 HydrophobicContact CD1-CD2 4.27Å; F74-F78 AromaticContact CD2-CD2 3.22Å; F74-F78 HydrophobicContact CD2-CD2 3.22Å; F74-F78 AromaticContact CD2-CE2 3.17Å; F74-F78 HydrophobicContact CD2-CE2 3.17Å; F74-F78 HydrophobicContact CD2-CG 4.28Å; F74-F78 HydrophobicContact CD2-CZ 4.18Å; F74-F78 HydrophobicContact CE1-CD2 4.26Å; F74-F78 HydrophobicContact CE2-CD1 4.44Å; F74-F78 AromaticContact CE2-CD2 3.22Å; F74-F78 HydrophobicContact CE2-CD2 3.22Å; F74-F78 HydrophobicContact CE2-CE1 4.35Å; F74-F78 AromaticContact CE2-CE2 3.11Å; F74-F78 HydrophobicContact CE2-CE2 3.11Å; F74-F78 AromaticContact CE2-CG 3.92Å; F74-F78 HydrophobicContact CE2-CG 3.92Å; F74-F78 AromaticContact CE2-CZ 3.72Å; F74-F78 HydrophobicContact CE2-CZ 3.72Å; F74-F78 AromaticContact CG-CD2 3.77Å; F74-F78 HydrophobicContact CG-CD2 3.77Å; F74-F78 HydrophobicContact CG-CE2 4.14Å; F74-F78 AromaticContact CZ-CD2 3.76Å; F74-F78 HydrophobicContact CZ-CD2 3.76Å; F74-F78 HydrophobicContact CZ-CE2 4.06Å; F74-F78 HydrophobicContact CZ-CG 4.05Å; F74-F78 WeakPolarHBondContact O-CB 3.37Å; F74-F78 WeakPolarHBondContact O-CD2 3.47Å; F74-F78 PolarHBondContact O-N 3.47Å
75F93.9Very high92.9Very high57 Ų5743.6 Ų43.625%0.2522%0.222CC..Hα-helixtrans-62.1-39.1178-64.8-32.5000112.4V71 V72 G79 F91V71-F75 HydrophobicContact CG1-CD2 3.99Å; V71-F75 HydrophobicContact CG1-CE2 3.42Å; V71-F75 VanDerWaalsContact CG1-CE2 3.42Å; V71-F75 HydrophobicContact CG1-CZ 3.86Å; V71-F75 PolarHBondContact O-N 3.08Å; V72-F75 PolarHBondContact O-N 2.95Å; F75-G79 VanDerWaalsContact O-CA 3.3Å; F75-G79 WeakPolarHBondContact O-CA 3.22Å; F75-G79 PolarHBondContact O-N 3.02Å; F75-F91 HydrophobicContact CB-CB 3.97Å
76G93.1Very high92.8Very high0 Ų045.8 Ų45.80%023%0.233CC..Hα-helixtrans-62.9-52.117500000112.8L15 V72 G73 F74 A80L15-G76 WeakPolarHBondContact CD2-O 3.29Å; V72-G76 PolarHBondContact O-N 3.44Å; G73-G76 PolarHBondContact O-N 3.44Å; F74-G76 VanDerWaalsContact C-N 3.32Å; F74-G76 PolarHBondContact O-N 2.89Å; G76-A80 WeakPolarHBondContact O-CB 3.35Å; G76-A80 PolarHBondContact O-N 3.31Å
77C92.4Very high92.7Very high3 Ų347.6 Ų47.62%0.0224%0.243CC..Hα-helixtrans-63-54-179.3-69.40000113F16 N19 F20 G73 F74 G79 A80 I81F16-C77 HydrophobicContact CD2-CB 4.01Å; F16-C77 HydrophobicContact CE2-CB 4.03Å; N19-C77 VanDerWaalsContact CB-SG 3.57Å; N19-C77 PolarHBondContact O-SG 2.89Å; F20-C77 WeakPolarHBondContact CA-SG 3.3Å; F20-C77 PolarHBondContact N-SG 3.5Å; G73-C77 WeakPolarHBondContact O-CB 3.17Å; G73-C77 PolarHBondContact O-N 3.36Å; G73-C77 PolarHBondContact O-SG 3.28Å; F74-C77 PolarHBondContact O-N 3.45Å; C77-G79 VanDerWaalsContact C-N 3.34Å; C77-A80 PolarHBondContact O-N 3.28Å; C77-I81 PolarHBondContact O-N 3.03Å
78F91.1Very high92.5Very high65 Ų6546.7 Ų46.729%0.28523%0.233SC..Hα-helixtrans-73.5-30.2-176.2-74.8-87.8000111.5F74 R82 L87F74-F78 HydrophobicContact CD1-CD2 4.27Å; F74-F78 AromaticContact CD2-CD2 3.22Å; F74-F78 HydrophobicContact CD2-CD2 3.22Å; F74-F78 AromaticContact CD2-CE2 3.17Å; F74-F78 HydrophobicContact CD2-CE2 3.17Å; F74-F78 HydrophobicContact CD2-CG 4.28Å; F74-F78 HydrophobicContact CD2-CZ 4.18Å; F74-F78 HydrophobicContact CE1-CD2 4.26Å; F74-F78 HydrophobicContact CE2-CD1 4.44Å; F74-F78 AromaticContact CE2-CD2 3.22Å; F74-F78 HydrophobicContact CE2-CD2 3.22Å; F74-F78 HydrophobicContact CE2-CE1 4.35Å; F74-F78 AromaticContact CE2-CE2 3.11Å; F74-F78 HydrophobicContact CE2-CE2 3.11Å; F74-F78 AromaticContact CE2-CG 3.92Å; F74-F78 HydrophobicContact CE2-CG 3.92Å; F74-F78 AromaticContact CE2-CZ 3.72Å; F74-F78 HydrophobicContact CE2-CZ 3.72Å; F74-F78 AromaticContact CG-CD2 3.77Å; F74-F78 HydrophobicContact CG-CD2 3.77Å; F74-F78 HydrophobicContact CG-CE2 4.14Å; F74-F78 AromaticContact CZ-CD2 3.76Å; F74-F78 HydrophobicContact CZ-CD2 3.76Å; F74-F78 HydrophobicContact CZ-CE2 4.06Å; F74-F78 HydrophobicContact CZ-CG 4.05Å; F74-F78 WeakPolarHBondContact O-CB 3.37Å; F74-F78 WeakPolarHBondContact O-CD2 3.47Å; F74-F78 PolarHBondContact O-N 3.47Å; F78-R82 WeakPolarHBondContact O-CB 3.47Å; F78-R82 WeakPolarHBondContact O-CG 2.96Å; F78-R82 PolarHBondContact O-N 3.18Å; F78-L87 HydrophobicContact CB-CD2 3.64Å
79G90.4Very high92.4Very high0 Ų044.6 Ų44.60%023%0.228CC..Hα-helixtrans-60.5-46169.700000112.1F75 C77 E83 S84F75-G79 VanDerWaalsContact O-CA 3.3Å; F75-G79 WeakPolarHBondContact O-CA 3.22Å; F75-G79 PolarHBondContact O-N 3.02Å; C77-G79 VanDerWaalsContact C-N 3.34Å; G79-E83 WeakPolarHBondContact O-CA 3.45Å; G79-E83 PolarHBondContact O-N 3.35Å; G79-S84 PolarHBondContact O-N 3.3Å
80A90.4Very high92.3Very high0 Ų043.8 Ų43.80%023%0.229CC..Hα-helixtrans-66-51.3177.600000112.6K12 L15 F16 G76 C77 E83 L206K12-A80 WeakPolarHBondContact CE-O 3.41Å; L15-A80 HydrophobicContact CD2-CB 3.76Å; F16-A80 HydrophobicContact CB-CB 4.23Å; G76-A80 WeakPolarHBondContact O-CB 3.35Å; G76-A80 PolarHBondContact O-N 3.31Å; C77-A80 PolarHBondContact O-N 3.28Å; A80-E83 PolarHBondContact O-N 2.86Å; A80-L206 HydrophobicContact CB-CD2 4.36Å
81I89.6Confident92.3Very high88 Ų8841.3 Ų41.345%0.45122%0.216SC..Hα-helixtrans-65.6-50.5-176.5-74.2-179.7000111.3F16 C77 E83F16-I81 HydrophobicContact CD2-CD1 3.44Å; F16-I81 VanDerWaalsContact CD2-CD1 3.44Å; F16-I81 HydrophobicContact CD2-CG1 3.59Å; F16-I81 HydrophobicContact CE1-CD1 4.36Å; F16-I81 HydrophobicContact CE2-CD1 3.12Å; F16-I81 HydrophobicContact CE2-CG1 3.86Å; F16-I81 HydrophobicContact CG-CD1 4.21Å; F16-I81 HydrophobicContact CG-CG1 4.14Å; F16-I81 HydrophobicContact CZ-CD1 3.64Å; C77-I81 PolarHBondContact O-N 3.03Å; I81-E83 PolarHBondContact O-N 3.16Å
82R88.1Confident92.3Very high176 Ų17641.3 Ų41.366%0.66421%0.211SC*.Hα-helixtrans-77-4.8-175.3-62.2-173.8169.8-167.6-0.9112.7F78 S84F78-R82 WeakPolarHBondContact O-CB 3.47Å; F78-R82 WeakPolarHBondContact O-CG 2.96Å; F78-R82 PolarHBondContact O-N 3.18Å; R82-S84 PolarHBondContact O-N 3.08Å; R82-S84 VanDerWaalsContact O-N 3.16Å
83E88.4Confident92.4Very high20 Ų2044.4 Ų44.49%0.09323%0.23CC..THydrogen-bonded Turntrans49.640.4-175.1-63.7177177.800110.6S2 K3 V4 K12 G79 A80 I81 I210S2-E83 WeakPolarHBondContact CA-OE1 3.38Å; S2-E83 WeakPolarHBondContact CB-OE1 3.31Å; K3-E83 VanDerWaalsContact CB-OE2 3.23Å; K3-E83 WeakPolarHBondContact CB-OE2 3.46Å; K3-E83 WeakPolarHBondContact CG-OE2 3.39Å; K3-E83 PolarHBondContact N-OE1 3.45Å; K3-E83 PolarHBondContact N-OE2 2.95Å; V4-E83 WeakPolarHBondContact CG2-OE1 3.35Å; K12-E83 IonicContact NZ-OE1 3.8Å; K12-E83 PolarHBondContact NZ-OE1 2.94Å; G79-E83 WeakPolarHBondContact O-CA 3.45Å; G79-E83 PolarHBondContact O-N 3.35Å; A80-E83 PolarHBondContact O-N 2.86Å; I81-E83 PolarHBondContact O-N 3.16Å; E83-I210 HydrophobicContact CB-CD1 3.86Å; E83-I210 HydrophobicContact CB-CG1 4.12Å; E83-I210 HydrophobicContact CG-CD1 4.35Å; E83-I210 WeakPolarHBondContact O-CG2 3.25Å
84S90.3Very high92.4Very high35 Ų3545.9 Ų45.925%0.24524%0.24CC..  trans-97.6114.9-1761780000110.5G79 R82 C86 L87 L88G79-S84 PolarHBondContact O-N 3.3Å; R82-S84 PolarHBondContact O-N 3.08Å; R82-S84 VanDerWaalsContact O-N 3.16Å; S84-C86 VanDerWaalsContact C-N 3.27Å; S84-C86 PolarHBondContact O-N 3.48Å; S84-L87 PolarHBondContact O-N 2.85Å; S84-L88 WeakPolarHBondContact O-CB 3.49Å; S84-L88 PolarHBondContact O-N 3.37Å
85Q89.4Confident92.5Very high42 Ų4242.6 Ų42.620%0.19623%0.226CC..Hα-helixtrans-61-36-179.2-62.9173.1-86.300112.3L88 A89 I210 R211Q85-L88 PolarHBondContact O-N 2.79Å; Q85-A89 WeakPolarHBondContact O-CB 3.42Å; Q85-A89 PolarHBondContact O-N 3.44Å; Q85-I210 HydrophobicContact CG-CB 4.26Å; Q85-I210 HydrophobicContact CG-CG2 3.68Å; Q85-R211 VanDerWaalsContact NE2-CB 3.27Å
86C92.4Very high92.6Very high90 Ų9044.3 Ų44.361%0.60824%0.237SC*.Hα-helixtrans-67.1-42.4179.5-178.30000112.1S84 S90S84-C86 VanDerWaalsContact C-N 3.27Å; S84-C86 PolarHBondContact O-N 3.48Å; C86-S90 WeakPolarHBondContact O-CB 3.5Å; C86-S90 PolarHBondContact O-N 3.49Å; C86-S90 PolarHBondContact O-OG 3.28Å
87L93.1Very high92.8Very high39 Ų3949.5 Ų49.520%0.20426%0.264CS..Hα-helixtrans-68.1-40.6176.7-86.674.8000111.3F78 S84 S90 F91F78-L87 HydrophobicContact CB-CD2 3.64Å; S84-L87 PolarHBondContact O-N 2.85Å; L87-S90 WeakPolarHBondContact O-CB 3.3Å; L87-S90 PolarHBondContact O-N 3.3Å; L87-F91 PolarHBondContact O-N 3.5Å
88L92.3Very high93Very high0 Ų051.2 Ų51.20%027%0.272CS..Hα-helixtrans-69-37.1179.8-163.158.5000112S84 Q85 F91 F92 S203 L206 C207 I210S84-L88 WeakPolarHBondContact O-CB 3.49Å; S84-L88 PolarHBondContact O-N 3.37Å; Q85-L88 PolarHBondContact O-N 2.79Å; L88-F91 HydrophobicContact CD1-CD1 4.44Å; L88-F91 PolarHBondContact O-N 2.82Å; L88-F92 PolarHBondContact O-N 3.3Å; L88-S203 VanDerWaalsContact CD1-OG 3.31Å; L88-S203 WeakPolarHBondContact CD1-OG 3.4Å; L88-S203 VanDerWaalsContact CD2-O 3.32Å; L88-S203 WeakPolarHBondContact CD2-O 3.35Å; L88-S203 VanDerWaalsContact CG-OG 3.31Å; L88-S203 WeakPolarHBondContact CG-OG 3.12Å; L88-S203 PolarHBondContact O-OG 3.47Å; L88-L206 HydrophobicContact CD2-CB 3.86Å; L88-L206 HydrophobicContact CD2-CD2 4.01Å; L88-L206 HydrophobicContact CD2-CG 3.87Å; L88-C207 HydrophobicContact CD2-CB 3.73Å; L88-C207 VanDerWaalsContact CD2-N 3.33Å; L88-C207 HydrophobicContact CG-CB 4.24Å; L88-I210 HydrophobicContact CD2-CD1 4.24Å
89A93.3Very high93.2Very high44 Ų4450.7 Ų50.736%0.36427%0.27SS..Hα-helixtrans-64.8-41.3170.100000111.8Q85 F91 F92 V93Q85-A89 WeakPolarHBondContact O-CB 3.42Å; Q85-A89 PolarHBondContact O-N 3.44Å; A89-F91 PolarHBondContact O-N 3.3Å; A89-F92 WeakPolarHBondContact O-CB 3.13Å; A89-F92 PolarHBondContact O-N 3.25Å; A89-V93 WeakPolarHBondContact O-CG2 3.05Å; A89-V93 PolarHBondContact O-N 2.84Å
90S95Very high93.5Very high42 Ų4252.2 Ų52.229%0.29429%0.285SS..Hα-helixtrans-61.1-45.1175.1-56.60000111C86 L87 F92 V93 C94C86-S90 WeakPolarHBondContact O-CB 3.5Å; C86-S90 PolarHBondContact O-N 3.49Å; C86-S90 PolarHBondContact O-OG 3.28Å; L87-S90 WeakPolarHBondContact O-CB 3.3Å; L87-S90 PolarHBondContact O-N 3.3Å; S90-F92 PolarHBondContact O-N 2.89Å; S90-V93 PolarHBondContact O-N 2.92Å; S90-C94 WeakPolarHBondContact O-CB 3.45Å; S90-C94 PolarHBondContact O-N 3.3Å; S90-C94 PolarHBondContact O-SG 3.48Å
91F95.4Very high93.8Very high4 Ų454.9 Ų54.92%0.01831%0.307CS..Hα-helixtrans-57-46.2173.3174.3-110.1000112.2N19 V72 F75 L87 L88 A89 C94 L95N19-F91 WeakPolarHBondContact OD1-CE2 3.35Å; N19-F91 VanDerWaalsContact OD1-CZ 3.28Å; N19-F91 WeakPolarHBondContact OD1-CZ 3.5Å; V72-F91 HydrophobicContact CG1-CD2 3.87Å; V72-F91 HydrophobicContact CG1-CE2 3.68Å; V72-F91 WeakPolarHBondContact O-CD2 3.29Å; F75-F91 HydrophobicContact CB-CB 3.97Å; L87-F91 PolarHBondContact O-N 3.5Å; L88-F91 HydrophobicContact CD1-CD1 4.44Å; L88-F91 PolarHBondContact O-N 2.82Å; A89-F91 PolarHBondContact O-N 3.3Å; F91-C94 PolarHBondContact O-N 3.42Å; F91-L95 HydrophobicContact CD1-CD1 4.25Å; F91-L95 HydrophobicContact CD2-CG 4.45Å; F91-L95 HydrophobicContact CE1-CD1 3.57Å; F91-L95 HydrophobicContact CE1-CG 4.38Å; F91-L95 HydrophobicContact CE2-CD1 3.98Å; F91-L95 HydrophobicContact CE2-CD2 4.29Å; F91-L95 HydrophobicContact CE2-CG 4.06Å; F91-L95 HydrophobicContact CZ-CD1 3.42Å; F91-L95 VanDerWaalsContact CZ-CD1 3.42Å; F91-L95 HydrophobicContact CZ-CD2 4.44Å; F91-L95 HydrophobicContact CZ-CG 4.03Å; F91-L95 WeakPolarHBondContact O-CG 3.33Å; F91-L95 PolarHBondContact O-N 2.86Å
92F95.8Very high94Very high64 Ų6452.8 Ų52.828%0.28130%0.296SS..Hα-helixtrans-60.4-47.1176.5177.3-89.9000112.4L88 A89 S90 C94 L95 L96 M200L88-F92 PolarHBondContact O-N 3.3Å; A89-F92 WeakPolarHBondContact O-CB 3.13Å; A89-F92 PolarHBondContact O-N 3.25Å; S90-F92 PolarHBondContact O-N 2.89Å; F92-C94 PolarHBondContact O-N 2.9Å; F92-L95 PolarHBondContact O-N 3.46Å; F92-L96 HydrophobicContact CE1-CD1 3.91Å; F92-L96 HydrophobicContact CZ-CD1 4.24Å; F92-L96 WeakPolarHBondContact O-CB 3.4Å; F92-L96 PolarHBondContact O-N 3.22Å; F92-M200 HydrophobicContact CD2-CB 3.92Å; F92-M200 HydrophobicContact CD2-CG 4.03Å; F92-M200 HydrophobicContact CE2-CB 3.81Å; F92-M200 HydrophobicContact CE2-CG 4.09Å; F92-M200 HydrophobicContact CE2-SD 4.32Å
93V96.3Very high94.4Very high79 Ų7948.8 Ų48.848%0.47929%0.287SS..Hα-helixtrans-63.4-42.4179.1171.90000111A89 S90 L96 I97A89-V93 WeakPolarHBondContact O-CG2 3.05Å; A89-V93 PolarHBondContact O-N 2.84Å; S90-V93 PolarHBondContact O-N 2.92Å; V93-L96 PolarHBondContact O-N 3.19Å; V93-I97 HydrophobicContact CG1-CD1 3.91Å; V93-I97 WeakPolarHBondContact O-CG1 3.39Å; V93-I97 PolarHBondContact O-N 3.43Å
94C96.1Very high94.7Very high32 Ų3252.4 Ų52.422%0.21631%0.31CS..Hα-helixtrans-59.5-47.3174.8-68.90000111.7V72 S90 F91 F92 L96 I97 I98V72-C94 HydrophobicContact CG2-CB 4.04Å; S90-C94 WeakPolarHBondContact O-CB 3.45Å; S90-C94 PolarHBondContact O-N 3.3Å; S90-C94 PolarHBondContact O-SG 3.48Å; F91-C94 PolarHBondContact O-N 3.42Å; F92-C94 PolarHBondContact O-N 2.9Å; C94-L96 VanDerWaalsContact C-N 3.31Å; C94-L96 PolarHBondContact O-N 2.92Å; C94-I97 PolarHBondContact O-N 3.49Å; C94-I98 VanDerWaalsContact O-CG1 3.24Å; C94-I98 WeakPolarHBondContact O-CG1 3.46Å; C94-I98 PolarHBondContact O-N 2.9Å
95L95.6Very high94.8Very high14 Ų1453.7 Ų53.77%0.07332%0.323CS..Hα-helixtrans-61.4-39.5177-73-174.4000112.3V72 F91 F92 I98 F99 M196 M200V72-L95 HydrophobicContact CG1-CD2 4.07Å; F91-L95 HydrophobicContact CD1-CD1 4.25Å; F91-L95 HydrophobicContact CD2-CG 4.45Å; F91-L95 HydrophobicContact CE1-CD1 3.57Å; F91-L95 HydrophobicContact CE1-CG 4.38Å; F91-L95 HydrophobicContact CE2-CD1 3.98Å; F91-L95 HydrophobicContact CE2-CD2 4.29Å; F91-L95 HydrophobicContact CE2-CG 4.06Å; F91-L95 HydrophobicContact CZ-CD1 3.42Å; F91-L95 VanDerWaalsContact CZ-CD1 3.42Å; F91-L95 HydrophobicContact CZ-CD2 4.44Å; F91-L95 HydrophobicContact CZ-CG 4.03Å; F91-L95 WeakPolarHBondContact O-CG 3.33Å; F91-L95 PolarHBondContact O-N 2.86Å; F92-L95 PolarHBondContact O-N 3.46Å; L95-I98 PolarHBondContact O-N 2.99Å; L95-F99 VanDerWaalsContact O-CB 3.22Å; L95-F99 WeakPolarHBondContact O-CB 3.34Å; L95-F99 PolarHBondContact O-N 3.48Å; L95-M196 HydrophobicContact CD2-CG 4.49Å; L95-M200 HydrophobicContact CB-CG 3.72Å; L95-M200 HydrophobicContact CB-SD 4.28Å; L95-M200 HydrophobicContact CD1-CG 3.9Å
96L96.5Very high95Very high93 Ų9354 Ų5449%0.48734%0.337SS..Hα-helixtrans-63.6-42.6177.9-172.4151.4000111.7F92 V93 C94 G100 M200F92-L96 HydrophobicContact CE1-CD1 3.91Å; F92-L96 HydrophobicContact CZ-CD1 4.24Å; F92-L96 WeakPolarHBondContact O-CB 3.4Å; F92-L96 PolarHBondContact O-N 3.22Å; V93-L96 PolarHBondContact O-N 3.19Å; C94-L96 VanDerWaalsContact C-N 3.31Å; C94-L96 PolarHBondContact O-N 2.92Å; L96-G100 PolarHBondContact O-N 3.34Å; L96-G100 VanDerWaalsContact O-N 3.08Å; L96-M200 HydrophobicContact CB-SD 4.29Å
97I96.9Very high95.1Very high110 Ų11053.8 Ų53.856%0.56433%0.333SS*.Hα-helixtrans-64.2-46.3176.2-67.4167.1000110.4V93 C94 F99 G100 A101V93-I97 HydrophobicContact CG1-CD1 3.91Å; V93-I97 WeakPolarHBondContact O-CG1 3.39Å; V93-I97 PolarHBondContact O-N 3.43Å; C94-I97 PolarHBondContact O-N 3.49Å; I97-F99 VanDerWaalsContact C-N 3.34Å; I97-F99 PolarHBondContact O-N 3.32Å; I97-G100 PolarHBondContact O-N 3.28Å; I97-A101 PolarHBondContact O-N 3.01Å
98I96.1Very high95.1Very high39 Ų3957.7 Ų57.720%0.235%0.348CS..Hα-helixtrans-63.2-42.8179.9-65.9167.7000110.5L68 V72 C94 L95 G100 A101 E102 M196L68-I98 HydrophobicContact CD1-CD1 4.23Å; L68-I98 HydrophobicContact CD2-CD1 4Å; L68-I98 HydrophobicContact CD2-CG1 4.17Å; L68-I98 HydrophobicContact CG-CD1 4.12Å; V72-I98 HydrophobicContact CG2-CD1 3.76Å; C94-I98 VanDerWaalsContact O-CG1 3.24Å; C94-I98 WeakPolarHBondContact O-CG1 3.46Å; C94-I98 PolarHBondContact O-N 2.9Å; L95-I98 PolarHBondContact O-N 2.99Å; I98-G100 VanDerWaalsContact C-N 3.34Å; I98-G100 PolarHBondContact O-N 2.91Å; I98-A101 CarbonylContact O-C 3.58Å; I98-A101 WeakPolarHBondContact O-CB 3.2Å; I98-A101 PolarHBondContact O-N 3.33Å; I98-A101 VanDerWaalsContact O-N 3.16Å; I98-E102 WeakPolarHBondContact O-CB 3.11Å; I98-E102 PolarHBondContact O-N 3.26Å; I98-M196 HydrophobicContact CB-SD 4.25Å; I98-M196 HydrophobicContact CG2-CE 3.58Å; I98-M196 HydrophobicContact CG2-SD 3.7Å
99F96.8Very high95Very high54 Ų5458.7 Ų58.724%0.23736%0.359CS..Hα-helixtrans-60.4-43177.1-178-102.2000112.1L95 I97 E102 I103 A193 M196 I197 M200L95-F99 VanDerWaalsContact O-CB 3.22Å; L95-F99 WeakPolarHBondContact O-CB 3.34Å; L95-F99 PolarHBondContact O-N 3.48Å; I97-F99 VanDerWaalsContact C-N 3.34Å; I97-F99 PolarHBondContact O-N 3.32Å; F99-E102 PolarHBondContact O-N 3.48Å; F99-I103 HydrophobicContact CD1-CD1 3.94Å; F99-I103 HydrophobicContact CE1-CD1 3.46Å; F99-I103 VanDerWaalsContact CE1-CD1 3.46Å; F99-I103 HydrophobicContact CZ-CD1 3.82Å; F99-I103 WeakPolarHBondContact O-CG1 3.37Å; F99-I103 PolarHBondContact O-N 3.34Å; F99-I103 VanDerWaalsContact O-N 3.08Å; F99-A193 HydrophobicContact CD2-CB 4.44Å; F99-A193 HydrophobicContact CE2-CB 3.93Å; F99-M196 HydrophobicContact CB-SD 4.28Å; F99-I197 HydrophobicContact CE2-CD1 3.98Å; F99-I197 HydrophobicContact CE2-CG1 4.03Å; F99-I197 HydrophobicContact CZ-CD1 4.13Å; F99-I197 HydrophobicContact CZ-CG1 4.37Å; F99-M200 HydrophobicContact CG-CE 4.4Å
100G97.1Very high94.9Very high31 Ų3163 Ų6332%0.3237%0.369SS..Hα-helixtrans-64.2-39.5173.800000113L96 I97 I98 T104L96-G100 PolarHBondContact O-N 3.34Å; L96-G100 VanDerWaalsContact O-N 3.08Å; I97-G100 PolarHBondContact O-N 3.28Å; I98-G100 VanDerWaalsContact C-N 3.34Å; I98-G100 PolarHBondContact O-N 2.91Å; G100-T104 WeakPolarHBondContact O-CB 3.42Å; G100-T104 PolarHBondContact O-N 2.88Å; G100-T104 PolarHBondContact O-OG1 3.28Å
101A96Very high94.7Very high56 Ų5667 Ų6746%0.46339%0.387SS..Hα-helixtrans-65.8-38.9175.400000112I97 I98 T104 A105I97-A101 PolarHBondContact O-N 3.01Å; I98-A101 CarbonylContact O-C 3.58Å; I98-A101 WeakPolarHBondContact O-CB 3.2Å; I98-A101 PolarHBondContact O-N 3.33Å; I98-A101 VanDerWaalsContact O-N 3.16Å; A101-T104 PolarHBondContact O-N 3.33Å; A101-A105 VanDerWaalsContact O-CB 3.25Å; A101-A105 WeakPolarHBondContact O-CB 3.31Å; A101-A105 PolarHBondContact O-N 3Å
102E93.9Very high94.6Very high45 Ų4568.6 Ų68.621%0.2140%0.396CS..Hα-helixtrans-64.5-44177.1-174.2177.8-159.200111.6I98 F99 T104 A105 G106 I192 M196I98-E102 WeakPolarHBondContact O-CB 3.11Å; I98-E102 PolarHBondContact O-N 3.26Å; F99-E102 PolarHBondContact O-N 3.48Å; E102-T104 VanDerWaalsContact C-N 3.33Å; E102-T104 PolarHBondContact O-N 2.98Å; E102-A105 PolarHBondContact O-N 3.41Å; E102-G106 PolarHBondContact O-N 3.12Å; E102-I192 WeakPolarHBondContact OE1-CB 3.48Å; E102-M196 WeakPolarHBondContact OE2-CE 3.45Å
103I95.6Very high94.2Very high91 Ų9169 Ų6947%0.46740%0.397SS..Hα-helixtrans-60.8-46.1173.8-67170.5000110.2F99 G106 V107F99-I103 HydrophobicContact CD1-CD1 3.94Å; F99-I103 HydrophobicContact CE1-CD1 3.46Å; F99-I103 VanDerWaalsContact CE1-CD1 3.46Å; F99-I103 HydrophobicContact CZ-CD1 3.82Å; F99-I103 WeakPolarHBondContact O-CG1 3.37Å; F99-I103 PolarHBondContact O-N 3.34Å; F99-I103 VanDerWaalsContact O-N 3.08Å; I103-G106 PolarHBondContact O-N 3.49Å; I103-V107 WeakPolarHBondContact O-CG2 3.39Å; I103-V107 PolarHBondContact O-N 2.88Å
104T95.8Very high93.8Very high97 Ų9772.5 Ų72.560%0.59541%0.408SS*.Hα-helixtrans-63.3-46.7-179.1-54.20000111.2G100 A101 E102 V107 F108G100-T104 WeakPolarHBondContact O-CB 3.42Å; G100-T104 PolarHBondContact O-N 2.88Å; G100-T104 PolarHBondContact O-OG1 3.28Å; A101-T104 PolarHBondContact O-N 3.33Å; E102-T104 VanDerWaalsContact C-N 3.33Å; E102-T104 PolarHBondContact O-N 2.98Å; T104-V107 PolarHBondContact O-N 3.24Å; T104-F108 VanDerWaalsContact O-CB 3.29Å; T104-F108 WeakPolarHBondContact O-CB 3.36Å; T104-F108 PolarHBondContact O-N 3.38Å
105A92.7Very high93.5Very high62 Ų6276.6 Ų76.651%0.51243%0.425SS..Hα-helixtrans-65.8-39.3177.800000112A101 E102 F108 G109A101-A105 VanDerWaalsContact O-CB 3.25Å; A101-A105 WeakPolarHBondContact O-CB 3.31Å; A101-A105 PolarHBondContact O-N 3Å; E102-A105 PolarHBondContact O-N 3.41Å; A105-F108 PolarHBondContact O-N 2.95Å; A105-G109 PolarHBondContact O-N 3.07Å
106G92.9Very high93.1Very high47 Ų4778.2 Ų78.249%0.48543%0.433SS..Hα-helixtrans-63.9-44.6176.500000112.5E102 I103 F110E102-G106 PolarHBondContact O-N 3.12Å; I103-G106 PolarHBondContact O-N 3.49Å; G106-F110 WeakPolarHBondContact O-CB 3.46Å; G106-F110 PolarHBondContact O-N 3.48Å
107V93.6Very high92.7Very high86 Ų8673.9 Ų73.952%0.52141%0.41SS..Hα-helixtrans-65.4-46.7174.9174.60000110.7I103 T104 G109 F110 L111I103-V107 WeakPolarHBondContact O-CG2 3.39Å; I103-V107 PolarHBondContact O-N 2.88Å; T104-V107 PolarHBondContact O-N 3.24Å; V107-G109 VanDerWaalsContact C-N 3.31Å; V107-G109 PolarHBondContact O-N 3.47Å; V107-F110 PolarHBondContact O-N 3.45Å; V107-L111 HydrophobicContact CG1-CD1 4.08Å; V107-L111 WeakPolarHBondContact O-CG 3.49Å; V107-L111 PolarHBondContact O-N 3.5Å; V107-L111 VanDerWaalsContact O-N 3.07Å
108F93.4Very high92.2Very high121 Ų12175 Ų7553%0.53141%0.413SS..Hα-helixtrans-60.1-42.9178.3-178.6-94.7000111.9T104 A105 L111 N112T104-F108 VanDerWaalsContact O-CB 3.29Å; T104-F108 WeakPolarHBondContact O-CB 3.36Å; T104-F108 PolarHBondContact O-N 3.38Å; A105-F108 PolarHBondContact O-N 2.95Å; F108-L111 PolarHBondContact O-N 2.9Å; F108-N112 WeakPolarHBondContact CE2-ND2 3.47Å; F108-N112 PolarHBondContact O-N 3.5Å; F108-N112 PolarHBondContact O-ND2 3.25Å
109G91.2Very high91.7Very high21 Ų2178.2 Ų78.222%0.21643%0.427CS..Hα-helixtrans-67.9-34.3179.300000113.3A105 V107 K113 I116A105-G109 PolarHBondContact O-N 3.07Å; V107-G109 VanDerWaalsContact C-N 3.31Å; V107-G109 PolarHBondContact O-N 3.47Å; G109-K113 WeakPolarHBondContact O-CA 3.25Å; G109-K113 PolarHBondContact O-N 2.89Å; G109-I116 VanDerWaalsContact CA-CD1 3.47Å
110F89.6Confident91.2Very high134 Ų13477.9 Ų77.959%0.58843%0.427SS*.Hα-helixtrans-67.4-41.8173.2-174.9-99.2000112.2G106 V107 L182G106-F110 WeakPolarHBondContact O-CB 3.46Å; G106-F110 PolarHBondContact O-N 3.48Å; V107-F110 PolarHBondContact O-N 3.45Å; F110-L182 HydrophobicContact CD2-CD2 4.18Å; F110-L182 HydrophobicContact CE2-CD2 4.5Å
111L92.8Very high90.6Very high126 Ų12677.8 Ų77.866%0.6642%0.419SS*.Hα-helixtrans-71.3-33.4-179.3-67.4175.8000113.1V107 F108V107-L111 HydrophobicContact CG1-CD1 4.08Å; V107-L111 WeakPolarHBondContact O-CG 3.49Å; V107-L111 PolarHBondContact O-N 3.5Å; V107-L111 VanDerWaalsContact O-N 3.07Å; F108-L111 PolarHBondContact O-N 2.9Å
112N91.9Very high89.9Confident39 Ų3980.9 Ų80.921%0.20942%0.422CS..THydrogen-bonded Turntrans-114.634.2-175.8-59.9-80.2000112.5F108 E114 Q115 I116F108-N112 WeakPolarHBondContact CE2-ND2 3.47Å; F108-N112 PolarHBondContact O-N 3.5Å; F108-N112 PolarHBondContact O-ND2 3.25Å; N112-E114 PolarHBondContact O-N 2.92Å; N112-Q115 HydrophobicContact CB-CB 4.38Å; N112-Q115 PolarHBondContact O-N 3Å; N112-Q115 VanDerWaalsContact O-N 3.16Å; N112-Q115 PolarHBondContact OD1-NE2 3.21Å; N112-I116 PolarHBondContact O-N 3.42Å; N112-I116 VanDerWaalsContact O-N 3.12Å
113K87.8Confident89.2Confident71 Ų7180 Ų8031%0.30942%0.417SS..Hα-helixtrans-55.4-36.5-176.564170.1-170.6155.60113.7G109 A117 D179 L182G109-K113 WeakPolarHBondContact O-CA 3.25Å; G109-K113 PolarHBondContact O-N 2.89Å; K113-A117 WeakPolarHBondContact O-CB 3.43Å; K113-A117 PolarHBondContact O-N 3.08Å; K113-D179 IonicContact NZ-OD1 2.74Å; K113-D179 PolarHBondContact NZ-OD1 3.16Å; K113-L182 HydrophobicContact CD-CD1 4.18Å
114E88.1Confident88.4Confident153 Ų15375.7 Ų75.772%0.71540%0.395SS*.Hα-helixtrans-67.6-44.4-179.9-65.1178.6-177.200111.4N112 I116 A117 E118N112-E114 PolarHBondContact O-N 2.92Å; E114-I116 VanDerWaalsContact C-N 3.35Å; E114-I116 PolarHBondContact O-N 2.88Å; E114-A117 PolarHBondContact O-N 2.79Å; E114-E118 PolarHBondContact O-N 3.46Å
115Q89.7Confident87.5Confident119 Ų11972.8 Ų72.856%0.55638%0.379SS*.Hα-helixtrans-64.2-40.4178-64.9173.521.200111.5N112 E118 E119N112-Q115 HydrophobicContact CB-CB 4.38Å; N112-Q115 PolarHBondContact O-N 3Å; N112-Q115 VanDerWaalsContact O-N 3.16Å; N112-Q115 PolarHBondContact OD1-NE2 3.21Å; Q115-E118 PolarHBondContact O-N 2.93Å; Q115-E119 PolarHBondContact O-N 3.04Å
116I87.9Confident86.6Confident48 Ų4871.8 Ų71.825%0.24637%0.365CS..Hα-helixtrans-65.6-40.7177.7-67.5172.4000110.9G109 N112 E114 E119 I120 F178G109-I116 VanDerWaalsContact CA-CD1 3.47Å; N112-I116 PolarHBondContact O-N 3.42Å; N112-I116 VanDerWaalsContact O-N 3.12Å; E114-I116 VanDerWaalsContact C-N 3.35Å; E114-I116 PolarHBondContact O-N 2.88Å; I116-E119 PolarHBondContact O-N 2.8Å; I116-I120 HydrophobicContact CG2-CD1 3.84Å; I116-I120 VanDerWaalsContact O-CG1 3.32Å; I116-I120 WeakPolarHBondContact O-CG1 3.28Å; I116-I120 PolarHBondContact O-N 2.8Å; I116-F178 HydrophobicContact CG2-CE1 4.31Å; I116-F178 HydrophobicContact CG2-CZ 4.27Å
117A87.3Confident85.5Confident2 Ų269.8 Ų69.82%0.01734%0.343CS..Hα-helixtrans-64.1-41.5177.600000111.6K113 E114 I120 Q121 L175 F178K113-A117 WeakPolarHBondContact O-CB 3.43Å; K113-A117 PolarHBondContact O-N 3.08Å; E114-A117 PolarHBondContact O-N 2.79Å; A117-I120 PolarHBondContact O-N 3.36Å; A117-Q121 WeakPolarHBondContact O-CB 3.1Å; A117-Q121 WeakPolarHBondContact O-CG 3.46Å; A117-Q121 PolarHBondContact O-N 3.45Å; A117-L175 HydrophobicContact CB-CD2 3.65Å; A117-F178 HydrophobicContact CB-CD2 3.93Å; A117-F178 HydrophobicContact CB-CG 4.37Å
118E87.1Confident84.3Confident132 Ų13267.1 Ų67.162%0.61733%0.326SS*.Hα-helixtrans-63.4-40.6175.9-170.7178.5-178.900112.1E114 Q115 I120 Q121 K122E114-E118 PolarHBondContact O-N 3.46Å; Q115-E118 PolarHBondContact O-N 2.93Å; E118-I120 VanDerWaalsContact C-N 3.34Å; E118-I120 PolarHBondContact O-N 2.79Å; E118-Q121 WeakPolarHBondContact O-CB 3.07Å; E118-Q121 PolarHBondContact O-N 3.47Å; E118-K122 WeakPolarHBondContact O-CB 3.47Å; E118-K122 PolarHBondContact O-N 3.3Å
119E85.3Confident83Confident108 Ų10864.6 Ų64.651%0.50533%0.327SS..Hα-helixtrans-64.9-38.6176.6-168.5170.9-168.200112Q115 I116 K122 F123Q115-E119 PolarHBondContact O-N 3.04Å; I116-E119 PolarHBondContact O-N 2.8Å; E119-K122 WeakPolarHBondContact O-CB 3.32Å; E119-K122 PolarHBondContact O-N 3.36Å; E119-F123 PolarHBondContact O-N 3.4Å
120I85.6Confident81.6Confident46 Ų4666 Ų6624%0.23633%0.329CS..Hα-helixtrans-69.7-38.7175.8-68.6167.4000111.4I116 A117 E118 K122 F123 Y124 Y142 I174 F178I116-I120 HydrophobicContact CG2-CD1 3.84Å; I116-I120 VanDerWaalsContact O-CG1 3.32Å; I116-I120 WeakPolarHBondContact O-CG1 3.28Å; I116-I120 PolarHBondContact O-N 2.8Å; A117-I120 PolarHBondContact O-N 3.36Å; E118-I120 VanDerWaalsContact C-N 3.34Å; E118-I120 PolarHBondContact O-N 2.79Å; I120-K122 VanDerWaalsContact C-N 3.31Å; I120-K122 PolarHBondContact O-N 3.3Å; I120-F123 PolarHBondContact O-N 3.46Å; I120-Y124 WeakPolarHBondContact O-CB 3.38Å; I120-Y124 PolarHBondContact O-N 3.08Å; I120-Y142 HydrophobicContact CG2-CE1 4.34Å; I120-I174 HydrophobicContact CB-CG2 4.32Å; I120-I174 HydrophobicContact CG2-CD1 4.27Å; I120-I174 HydrophobicContact CG2-CG1 4.5Å; I120-I174 HydrophobicContact CG2-CG2 3.89Å; I120-F178 HydrophobicContact CD1-CE1 4.4Å; I120-F178 HydrophobicContact CD1-CE2 3.44Å; I120-F178 VanDerWaalsContact CD1-CE2 3.44Å; I120-F178 HydrophobicContact CD1-CZ 3.23Å
121Q83.9Confident80Confident29 Ų2966 Ų6614%0.13634%0.336CS..Hα-helixtrans-59.9-42.3172.5-82.2-179.5-21.800112A117 E118 Y124 S125 H171 I174 L175A117-Q121 WeakPolarHBondContact O-CB 3.1Å; A117-Q121 WeakPolarHBondContact O-CG 3.46Å; A117-Q121 PolarHBondContact O-N 3.45Å; E118-Q121 WeakPolarHBondContact O-CB 3.07Å; E118-Q121 PolarHBondContact O-N 3.47Å; Q121-Y124 PolarHBondContact O-N 3.04Å; Q121-S125 PolarHBondContact O-N 3.46Å; Q121-S125 PolarHBondContact O-OG 3.29Å; Q121-H171 WeakPolarHBondContact CB-ND1 3.36Å; Q121-H171 HydrophobicContact CG-CB 4.27Å; Q121-H171 WeakPolarHBondContact CG-ND1 3.46Å; Q121-H171 PolarHBondContact NE2-O 2.99Å; Q121-I174 HydrophobicContact CG-CB 4.18Å; Q121-I174 HydrophobicContact CG-CD1 4.12Å; Q121-I174 HydrophobicContact CG-CG2 4.01Å; Q121-L175 VanDerWaalsContact NE2-CD1 3.29Å; Q121-L175 VanDerWaalsContact NE2-CG 3.28Å
122K82.3Confident78.4Confident121 Ų12162.3 Ų62.353%0.52632%0.317SS..Hα-helixtrans-63-47.8174.7-171.1-179.7179.3-174.90110.9E118 E119 I120 Y124 S125 D126E118-K122 WeakPolarHBondContact O-CB 3.47Å; E118-K122 PolarHBondContact O-N 3.3Å; E119-K122 WeakPolarHBondContact O-CB 3.32Å; E119-K122 PolarHBondContact O-N 3.36Å; I120-K122 VanDerWaalsContact C-N 3.31Å; I120-K122 PolarHBondContact O-N 3.3Å; K122-Y124 VanDerWaalsContact C-N 3.3Å; K122-Y124 PolarHBondContact O-N 3.34Å; K122-S125 PolarHBondContact O-N 3.34Å; K122-S125 VanDerWaalsContact O-N 3.15Å; K122-D126 WeakPolarHBondContact O-CB 3.39Å; K122-D126 PolarHBondContact O-N 3.35Å
123F78.8Confident76.8Confident28 Ų2866.3 Ų66.312%0.12334%0.343CS..Hα-helixtrans-57.7-41176-178.7-90.3000112.7T54 F55 A58 E119 I120 S127 Y142T54-F123 HydrophobicContact CG2-CB 4.35Å; T54-F123 HydrophobicContact CG2-CD2 4.32Å; F55-F123 HydrophobicContact CB-CE2 4.48Å; F55-F123 AromaticContact CD2-CE2 3.92Å; F55-F123 HydrophobicContact CD2-CE2 3.92Å; F55-F123 AromaticContact CD2-CZ 3.93Å; F55-F123 HydrophobicContact CD2-CZ 3.93Å; F55-F123 HydrophobicContact CE2-CZ 4.32Å; A58-F123 HydrophobicContact CB-CD2 4.13Å; A58-F123 HydrophobicContact CB-CE2 3.28Å; A58-F123 HydrophobicContact CB-CZ 3.72Å; E119-F123 PolarHBondContact O-N 3.4Å; I120-F123 PolarHBondContact O-N 3.46Å; F123-S127 WeakPolarHBondContact O-CB 3.48Å; F123-S127 PolarHBondContact O-N 3.5Å; F123-S127 PolarHBondContact O-OG 3.19Å; F123-Y142 HydrophobicContact CE1-CE2 4.48Å
124Y78.4Confident75.4Confident0 Ų065.2 Ų65.20%034%0.34CS..Hα-helixtrans-66.1-43.6176170.3-102.4000112I120 Q121 K122 D126 S127 I128 Y142 H143 G150 C170 I174I120-Y124 WeakPolarHBondContact O-CB 3.38Å; I120-Y124 PolarHBondContact O-N 3.08Å; Q121-Y124 PolarHBondContact O-N 3.04Å; K122-Y124 VanDerWaalsContact C-N 3.3Å; K122-Y124 PolarHBondContact O-N 3.34Å; Y124-D126 VanDerWaalsContact C-N 3.31Å; Y124-D126 PolarHBondContact O-N 2.88Å; Y124-S127 WeakPolarHBondContact O-CB 3.3Å; Y124-S127 PolarHBondContact O-N 3.03Å; Y124-S127 VanDerWaalsContact O-N 3.09Å; Y124-I128 PolarHBondContact O-N 2.91Å; Y124-Y142 AromaticContact CD2-CD1 3.99Å; Y124-Y142 HydrophobicContact CD2-CD1 3.99Å; Y124-Y142 AromaticContact CD2-CG 3.91Å; Y124-Y142 HydrophobicContact CD2-CG 3.91Å; Y124-Y142 HydrophobicContact CE2-CG 4.41Å; Y124-H143 AromaticContact CE2-NE2 3.99Å; Y124-H143 AromaticContact CZ-NE2 3.82Å; Y124-H143 PolarHBondContact OH-CD2 2.83Å; Y124-H143 PolarHBondContact OH-NE2 2.97Å; Y124-G150 VanDerWaalsContact CE1-O 3.27Å; Y124-G150 WeakPolarHBondContact CE1-O 3.32Å; Y124-G150 VanDerWaalsContact OH-C 3.28Å; Y124-G150 PolarHBondContact OH-O 3.32Å; Y124-C170 HydrophobicContact CD1-CB 4.09Å; Y124-C170 HydrophobicContact CE1-CB 3.39Å; Y124-C170 HydrophobicContact CE2-CB 4.15Å; Y124-C170 VanDerWaalsContact CZ-CB 3.42Å; Y124-C170 WeakPolarHBondContact OH-CB 3.41Å; Y124-C170 PolarHBondContact OH-SG 3.21Å; Y124-I174 HydrophobicContact CD1-CD1 4.34Å; Y124-I174 HydrophobicContact CG-CD1 4.15Å
125S77.4Confident74Confident36 Ų3658 Ų5825%0.25231%0.307SS..Hα-helixtrans-62.6-41.4177-56.10000111.9Q121 K122 S127 I128 A129 H171Q121-S125 PolarHBondContact O-N 3.46Å; Q121-S125 PolarHBondContact O-OG 3.29Å; K122-S125 PolarHBondContact O-N 3.34Å; K122-S125 VanDerWaalsContact O-N 3.15Å; S125-S127 VanDerWaalsContact C-N 3.26Å; S125-S127 PolarHBondContact O-N 3.45Å; S125-I128 WeakPolarHBondContact O-CG2 3.01Å; S125-I128 PolarHBondContact O-N 2.93Å; S125-A129 WeakPolarHBondContact O-CB 3.47Å; S125-A129 PolarHBondContact O-N 3.13Å; S125-H171 PolarHBondContact OG-CE1 3.32Å; S125-H171 PolarHBondContact OG-NE2 3.05Å
126D73.3Confident72.9Confident41 Ų4154.2 Ų54.222%0.21929%0.292CS..Hα-helixtrans-61.4-38.2173.9-70.9-16.6000110.7P52 T54 K122 Y124P52-D126 HydrophobicContact CB-CB 4.13Å; P52-D126 WeakPolarHBondContact CB-OD2 3.39Å; P52-D126 HydrophobicContact CG-CB 3.5Å; P52-D126 VanDerWaalsContact CG-CB 3.5Å; T54-D126 PolarHBondContact OG1-OD2 3.26Å; T54-D126 VanDerWaalsContact OG1-OD2 3.07Å; K122-D126 WeakPolarHBondContact O-CB 3.39Å; K122-D126 PolarHBondContact O-N 3.35Å; Y124-D126 VanDerWaalsContact C-N 3.31Å; Y124-D126 PolarHBondContact O-N 2.88Å
127S69.8Low71.9Confident4 Ų454.1 Ų54.13%0.02830%0.298CS..Hα-helixtrans-74-31.5-179.5-580000114.1F123 Y124 S125 D130F123-S127 WeakPolarHBondContact O-CB 3.48Å; F123-S127 PolarHBondContact O-N 3.5Å; F123-S127 PolarHBondContact O-OG 3.19Å; Y124-S127 WeakPolarHBondContact O-CB 3.3Å; Y124-S127 PolarHBondContact O-N 3.03Å; Y124-S127 VanDerWaalsContact O-N 3.09Å; S125-S127 VanDerWaalsContact C-N 3.26Å; S125-S127 PolarHBondContact O-N 3.45Å; S127-D130 WeakPolarHBondContact O-CB 3.34Å
128I69.9Low70.9Confident31 Ų3155.6 Ų55.616%0.15931%0.305CS..Hα-helixtrans-86.2-27.3178.6-161.5172000112.9Y124 S125 D130 L160Y124-I128 PolarHBondContact O-N 2.91Å; S125-I128 WeakPolarHBondContact O-CG2 3.01Å; S125-I128 PolarHBondContact O-N 2.93Å; I128-D130 PolarHBondContact O-N 3.29Å; I128-L160 HydrophobicContact CD1-CD2 4.13Å; I128-L160 HydrophobicContact CG1-CD2 3.95Å
129A66Low70.1Confident67 Ų6749.3 Ų49.355%0.55428%0.276SS*.Hα-helixtrans-64.9-19.4169.100000111.7S125 N131S125-A129 WeakPolarHBondContact O-CB 3.47Å; S125-A129 PolarHBondContact O-N 3.13Å; A129-N131 PolarHBondContact O-N 3.32Å
130D60.6Low69.6Low50 Ų5048 Ų4827%0.26727%0.273SS..  trans-81.896.9175.1-170.522000111.8S127 I128 N132S127-D130 WeakPolarHBondContact O-CB 3.34Å; I128-D130 PolarHBondContact O-N 3.29Å; D130-N132 PolarHBondContact O-N 3Å; D130-N132 PolarHBondContact OD1-ND2 2.89Å
131N56.5Low69.2Low134 Ų13450.8 Ų50.872%0.71729%0.287SS*.  trans-7117.7179.8-70.2-69.5000114.5A129A129-N131 PolarHBondContact O-N 3.32Å
132N58.6Low68.9Low49 Ų4952.2 Ų52.226%0.26229%0.291SS..SBendtrans-93.1160.7-177.9-70.8-71.1000112.3L45 D130 N134 G135 T136L45-N132 HydrophobicContact CD1-CB 3.62Å; L45-N132 WeakPolarHBondContact CD1-ND2 3.43Å; L45-N132 WeakPolarHBondContact CD1-OD1 3.46Å; L45-N132 WeakPolarHBondContact CD2-ND2 3.4Å; L45-N132 WeakPolarHBondContact CD2-OD1 3.2Å; L45-N132 WeakPolarHBondContact CG-ND2 3.27Å; D130-N132 PolarHBondContact O-N 3Å; D130-N132 PolarHBondContact OD1-ND2 2.89Å; N132-N134 PolarHBondContact O-N 3.18Å; N132-G135 PolarHBondContact O-N 2.91Å; N132-T136 VanDerWaalsContact O-CB 3.29Å; N132-T136 WeakPolarHBondContact O-CB 3.07Å; N132-T136 PolarHBondContact O-N 3.3Å; N132-T136 PolarHBondContact O-OG1 2.92Å
133V59.4Low68.7Low124 Ų12447.2 Ų47.275%0.75227%0.27SS*.Hα-helixtrans-58.8-34.6-177-172.80000111.7A137V133-A137 VanDerWaalsContact O-CB 3.3Å; V133-A137 WeakPolarHBondContact O-CB 3.38Å; V133-A137 PolarHBondContact O-N 3.29Å
134N56.9Low68.8Low47 Ų4754.7 Ų54.725%0.25130%0.302SS..Hα-helixtrans-75.3-45178.9-65.3-24.4000112.4T42 N132 T136 A137 I138T42-N134 PolarHBondContact OG1-ND2 3.33Å; N132-N134 PolarHBondContact O-N 3.18Å; N134-T136 VanDerWaalsContact C-N 3.32Å; N134-T136 PolarHBondContact O-N 3.01Å; N134-A137 PolarHBondContact O-N 3.42Å; N134-I138 VanDerWaalsContact O-CG1 3.29Å; N134-I138 WeakPolarHBondContact O-CG1 3.48Å; N134-I138 PolarHBondContact O-N 3.48Å
135G60.4Low69Low2 Ų259.4 Ų59.42%0.02133%0.331CS..Hα-helixtrans-61-41.5172.900000111.9N132 A137 I138 A139N132-G135 PolarHBondContact O-N 2.91Å; G135-A137 PolarHBondContact O-N 3.44Å; G135-I138 PolarHBondContact O-N 3.07Å; G135-A139 WeakPolarHBondContact O-CB 3.34Å; G135-A139 PolarHBondContact O-N 3.39Å
136T65.1Low69.2Low39 Ų3959.2 Ų59.224%0.23933%0.327CS..Hα-helixtrans-62.7-42.7173.6-57.40000111.9N132 N134 I138 A139 L140 L160N132-T136 VanDerWaalsContact O-CB 3.29Å; N132-T136 WeakPolarHBondContact O-CB 3.07Å; N132-T136 PolarHBondContact O-N 3.3Å; N132-T136 PolarHBondContact O-OG1 2.92Å; N134-T136 VanDerWaalsContact C-N 3.32Å; N134-T136 PolarHBondContact O-N 3.01Å; T136-I138 PolarHBondContact O-N 2.79Å; T136-A139 PolarHBondContact O-N 3.07Å; T136-L140 HydrophobicContact CG2-CD1 4.02Å; T136-L140 HydrophobicContact CG2-CG 4.45Å; T136-L140 VanDerWaalsContact O-CB 3.31Å; T136-L140 WeakPolarHBondContact O-CB 3.41Å; T136-L140 VanDerWaalsContact O-CG 3.27Å; T136-L140 WeakPolarHBondContact O-CG 3.29Å; T136-L140 PolarHBondContact O-N 3.37Å; T136-L160 HydrophobicContact CG2-CD1 3.72Å; T136-L160 HydrophobicContact CG2-CG 4.37Å
137A67.2Low69.6Low47 Ų4762 Ų6239%0.38834%0.342SS..Hα-helixtrans-64.1-40.3176.300000112.1V133 N134 G135 I141V133-A137 VanDerWaalsContact O-CB 3.3Å; V133-A137 WeakPolarHBondContact O-CB 3.38Å; V133-A137 PolarHBondContact O-N 3.29Å; N134-A137 PolarHBondContact O-N 3.42Å; G135-A137 PolarHBondContact O-N 3.44Å; A137-I141 WeakPolarHBondContact O-CD1 3.32Å; A137-I141 VanDerWaalsContact O-CG1 3.25Å; A137-I141 WeakPolarHBondContact O-CG1 3.38Å; A137-I141 PolarHBondContact O-N 3.12Å; A137-I141 VanDerWaalsContact O-N 3.11Å
138I67.5Low70.2Confident32 Ų3261.9 Ų61.916%0.16434%0.341CS..Hα-helixtrans-67.4-49.2176.5-64.9167.5000110F55 N134 G135 T136 L140 I141 Y142F55-I138 HydrophobicContact CE2-CD1 3.69Å; F55-I138 HydrophobicContact CZ-CD1 4.12Å; N134-I138 VanDerWaalsContact O-CG1 3.29Å; N134-I138 WeakPolarHBondContact O-CG1 3.48Å; N134-I138 PolarHBondContact O-N 3.48Å; G135-I138 PolarHBondContact O-N 3.07Å; T136-I138 PolarHBondContact O-N 2.79Å; I138-L140 VanDerWaalsContact C-N 3.3Å; I138-L140 PolarHBondContact O-N 2.97Å; I138-I141 WeakPolarHBondContact O-CA 3.22Å; I138-I141 WeakPolarHBondContact O-CB 3.14Å; I138-I141 PolarHBondContact O-N 3Å; I138-Y142 HydrophobicContact CG2-CD2 4.02Å; I138-Y142 HydrophobicContact CG2-CE2 3.86Å; I138-Y142 WeakPolarHBondContact O-CD2 3.13Å; I138-Y142 PolarHBondContact O-N 2.94Å
139A70Confident70.7Confident0 Ų061.2 Ų61.20%034%0.339CS..Hα-helixtrans-56.7-42.617700000111.9G135 T136 I141 Y142 H143 L160G135-A139 WeakPolarHBondContact O-CB 3.34Å; G135-A139 PolarHBondContact O-N 3.39Å; T136-A139 PolarHBondContact O-N 3.07Å; A139-I141 VanDerWaalsContact C-N 3.32Å; A139-I141 PolarHBondContact O-N 2.73Å; A139-Y142 WeakPolarHBondContact O-CB 3.45Å; A139-Y142 PolarHBondContact O-N 3.27Å; A139-Y142 VanDerWaalsContact O-N 3.15Å; A139-H143 PolarHBondContact O-CD2 2.92Å; A139-H143 PolarHBondContact O-N 3.29Å; A139-L160 HydrophobicContact CB-CD2 4.16Å
140L73.7Confident71.1Confident82 Ų8258.5 Ų58.543%0.42932%0.318SS..Hα-helixtrans-63-35.1174.9-79.2170000113.1T136 I138 K144T136-L140 HydrophobicContact CG2-CD1 4.02Å; T136-L140 HydrophobicContact CG2-CG 4.45Å; T136-L140 VanDerWaalsContact O-CB 3.31Å; T136-L140 WeakPolarHBondContact O-CB 3.41Å; T136-L140 VanDerWaalsContact O-CG 3.27Å; T136-L140 WeakPolarHBondContact O-CG 3.29Å; T136-L140 PolarHBondContact O-N 3.37Å; I138-L140 VanDerWaalsContact C-N 3.3Å; I138-L140 PolarHBondContact O-N 2.97Å; L140-K144 VanDerWaalsContact O-CB 3.31Å; L140-K144 WeakPolarHBondContact O-CB 3.41Å; L140-K144 PolarHBondContact O-N 3.25Å
141I76.9Confident71.4Confident104 Ų10456.7 Ų56.753%0.53331%0.31SS..Hα-helixtrans-63.9-46.2172.9-67.6162000109.6A137 I138 A139 H143 K144 T145A137-I141 WeakPolarHBondContact O-CD1 3.32Å; A137-I141 VanDerWaalsContact O-CG1 3.25Å; A137-I141 WeakPolarHBondContact O-CG1 3.38Å; A137-I141 PolarHBondContact O-N 3.12Å; A137-I141 VanDerWaalsContact O-N 3.11Å; I138-I141 WeakPolarHBondContact O-CA 3.22Å; I138-I141 WeakPolarHBondContact O-CB 3.14Å; I138-I141 PolarHBondContact O-N 3Å; A139-I141 VanDerWaalsContact C-N 3.32Å; A139-I141 PolarHBondContact O-N 2.73Å; I141-H143 PolarHBondContact O-N 3.2Å; I141-K144 PolarHBondContact O-N 2.96Å; I141-T145 WeakPolarHBondContact O-CB 3.49Å; I141-T145 PolarHBondContact O-N 3.44Å; I141-T145 PolarHBondContact O-OG1 3.44Å; I141-T145 VanDerWaalsContact O-OG1 3.04Å
142Y78Confident71.5Confident58 Ų5854 Ų5423%0.22731%0.307CS..Hα-helixtrans-60.2-46.7176.1-84.6-102000111.7I120 F123 Y124 I138 A139 K144 T145 L146I120-Y142 HydrophobicContact CG2-CE1 4.34Å; F123-Y142 HydrophobicContact CE1-CE2 4.48Å; Y124-Y142 AromaticContact CD2-CD1 3.99Å; Y124-Y142 HydrophobicContact CD2-CD1 3.99Å; Y124-Y142 AromaticContact CD2-CG 3.91Å; Y124-Y142 HydrophobicContact CD2-CG 3.91Å; Y124-Y142 HydrophobicContact CE2-CG 4.41Å; I138-Y142 HydrophobicContact CG2-CD2 4.02Å; I138-Y142 HydrophobicContact CG2-CE2 3.86Å; I138-Y142 WeakPolarHBondContact O-CD2 3.13Å; I138-Y142 PolarHBondContact O-N 2.94Å; A139-Y142 WeakPolarHBondContact O-CB 3.45Å; A139-Y142 PolarHBondContact O-N 3.27Å; A139-Y142 VanDerWaalsContact O-N 3.15Å; Y142-K144 VanDerWaalsContact C-N 3.32Å; Y142-K144 PolarHBondContact O-N 2.99Å; Y142-T145 PolarHBondContact O-N 2.65Å; Y142-L146 HydrophobicContact CD1-CD1 3.93Å; Y142-L146 WeakPolarHBondContact O-CB 3.38Å; Y142-L146 PolarHBondContact O-N 3.25Å
143H79.4Confident71.1Confident17 Ų1756.9 Ų56.98%0.07933%0.331CS..Hα-helixtrans-57.4-45.8178.9-66.6177.1000111.8Y124 A139 I141 N147 C148 G150 C170Y124-H143 AromaticContact CE2-NE2 3.99Å; Y124-H143 AromaticContact CZ-NE2 3.82Å; Y124-H143 PolarHBondContact OH-CD2 2.83Å; Y124-H143 PolarHBondContact OH-NE2 2.97Å; A139-H143 PolarHBondContact O-CD2 2.92Å; A139-H143 PolarHBondContact O-N 3.29Å; I141-H143 PolarHBondContact O-N 3.2Å; H143-N147 VanDerWaalsContact O-CA 3.22Å; H143-N147 WeakPolarHBondContact O-CA 3.29Å; H143-N147 PolarHBondContact O-N 2.92Å; H143-C148 WeakPolarHBondContact CA-O 3.29Å; H143-C148 WeakPolarHBondContact CB-O 3.3Å; H143-C148 PolarHBondContact O-N 3.16Å; H143-C148 VanDerWaalsContact O-N 3.16Å; H143-G150 PolarHBondContact NE2-N 3.5Å; H143-C170 PolarHBondContact CD2-SG 2.83Å
144K80.1Confident70.7Confident184 Ų18457 Ų5780%0.833%0.325SS*.Hα-helixtrans-75.2-33.6-179-168.3172.3-175.6175.70113.4L140 I141 Y142L140-K144 VanDerWaalsContact O-CB 3.31Å; L140-K144 WeakPolarHBondContact O-CB 3.41Å; L140-K144 PolarHBondContact O-N 3.25Å; I141-K144 PolarHBondContact O-N 2.96Å; Y142-K144 VanDerWaalsContact C-N 3.32Å; Y142-K144 PolarHBondContact O-N 2.99Å
145T82.6Confident70.3Confident100 Ų10063.8 Ų63.861%0.61336%0.355SS*.Hα-helixtrans-79.1-38.2-179-67.70000112.2I141 Y142I141-T145 WeakPolarHBondContact O-CB 3.49Å; I141-T145 PolarHBondContact O-N 3.44Å; I141-T145 PolarHBondContact O-OG1 3.44Å; I141-T145 VanDerWaalsContact O-OG1 3.04Å; Y142-T145 PolarHBondContact O-N 2.65Å
146L81.4Confident69.8Low32 Ų3270.1 Ų70.117%0.16838%0.382CS..Hα-helixtrans-97.6-5.8-177.8-64.2176.4000113.4Y142 C148 A173 I174 F177Y142-L146 HydrophobicContact CD1-CD1 3.93Å; Y142-L146 WeakPolarHBondContact O-CB 3.38Å; Y142-L146 PolarHBondContact O-N 3.25Å; L146-C148 HydrophobicContact CB-CB 4.48Å; L146-A173 HydrophobicContact CB-CB 4.35Å; L146-I174 HydrophobicContact CD1-CG1 3.57Å; L146-F177 HydrophobicContact CD2-CB 3.9Å; L146-F177 HydrophobicContact CD2-CD1 4.5Å; L146-F177 HydrophobicContact CD2-CD2 3.53Å; L146-F177 HydrophobicContact CD2-CE2 4.16Å; L146-F177 HydrophobicContact CD2-CG 3.73Å
147N81.1Confident69.3Low98 Ų9871.6 Ų71.652%0.52439%0.388SS..THydrogen-bonded Turntrans52.363.2-175.8-147.772.4000109.8H143 E166H143-N147 VanDerWaalsContact O-CA 3.22Å; H143-N147 WeakPolarHBondContact O-CA 3.29Å; H143-N147 PolarHBondContact O-N 2.92Å; N147-E166 VanDerWaalsContact CG-OE2 3.25Å; N147-E166 PolarHBondContact ND2-OE1 3.49Å; N147-E166 PolarHBondContact ND2-OE2 3.31Å; N147-E166 PolarHBondContact OD1-OE1 3.33Å
148C83.4Confident68.6Low2 Ų274.1 Ų74.11%0.01440%0.401CS..  trans-149.3165.3-176.8690000110.1H143 L146 E166 T168 C170 A173H143-C148 WeakPolarHBondContact CA-O 3.29Å; H143-C148 WeakPolarHBondContact CB-O 3.3Å; H143-C148 PolarHBondContact O-N 3.16Å; H143-C148 VanDerWaalsContact O-N 3.16Å; L146-C148 HydrophobicContact CB-CB 4.48Å; C148-E166 PolarHBondContact N-OE2 3.03Å; C148-T168 WeakPolarHBondContact CA-O 3.49Å; C148-T168 WeakPolarHBondContact CB-O 3.44Å; C148-C170 HydrophobicContact CB-CB 3.92Å; C148-C170 WeakPolarHBondContact CB-SG 3.41Å; C148-C170 WeakPolarHBondContact SG-CA 3.35Å; C148-C170 WeakPolarHBondContact SG-CB 3.43Å; C148-C170 CovalentContact SG-SG 2.03Å; C148-C170 PolarHBondContact SG-SG 2.83Å; C148-A173 HydrophobicContact CB-CB 3.62Å
149C80.6Confident68Low18 Ų1880.8 Ų80.812%0.12243%0.431CS..  trans-143.3140.8176.5161.20000111.3C161 E166 T168 C170C149-C161 HydrophobicContact CB-CB 4.02Å; C149-C161 WeakPolarHBondContact CB-SG 3.47Å; C149-C161 WeakPolarHBondContact SG-CB 3.41Å; C149-C161 CovalentContact SG-SG 2Å; C149-C161 PolarHBondContact SG-SG 3.38Å; C149-E166 HydrophobicContact CB-CB 4.26Å; C149-T168 PolarHBondContact N-O 3.15Å; C149-C170 PolarHBondContact N-SG 2.94Å
150G73.1Confident67.6Low10 Ų1082.1 Ų82.110%0.10344%0.438CS..SBendtrans73.9-174170.700000114.2Y124 H143 C170Y124-G150 VanDerWaalsContact CE1-O 3.27Å; Y124-G150 WeakPolarHBondContact CE1-O 3.32Å; Y124-G150 VanDerWaalsContact OH-C 3.28Å; Y124-G150 PolarHBondContact OH-O 3.32Å; H143-G150 PolarHBondContact NE2-N 3.5Å; G150-C170 WeakPolarHBondContact O-CB 3.45Å
151G67.3Low67.2Low11 Ų1179.3 Ų79.311%0.11343%0.425CS..  trans-128.5167.8173.500000111.1S153 M154 D169G151-S153 PolarHBondContact O-N 3.46Å; G151-M154 PolarHBondContact O-N 2.92Å; G151-D169 WeakPolarHBondContact CA-OD2 3.32Å
152A57.9Low66.3Low78 Ų7879.8 Ų79.865%0.64544%0.435SS*.THydrogen-bonded Turntrans-56.7-15.4-162.600000116.5D169A152-D169 WeakPolarHBondContact CA-OD2 3.48Å; A152-D169 PolarHBondContact N-OD2 2.87Å
153S51.8Low65.3Low110 Ų11082.4 Ų82.477%0.76945%0.453SS*.THydrogen-bonded Turntrans-147.79.8-176.6380000115.5G151G151-S153 PolarHBondContact O-N 3.46Å
154M49.8Very low64Low127 Ų12790.1 Ų90.163%0.62649%0.489SS*.SBendtrans-91121170.8-70.7-82.799.500108G151 K156G151-M154 PolarHBondContact O-N 2.92Å; M154-K156 PolarHBondContact O-N 3.38Å
155E48.2Very low62.7Low189 Ų18986.5 Ų86.588%0.88348%0.483SS*.  trans-40126.5165.5-85-179.1114.600108.2N157E155-N157 VanDerWaalsContact C-N 3.28Å; E155-N157 PolarHBondContact O-N 3.29Å
156K51.3Low61.4Low135 Ų13584.1 Ų84.159%0.58747%0.465SS*.  trans-45.496175.1-79.5-178174.6-175.30108M154 P158M154-K156 PolarHBondContact O-N 3.38Å; K156-P158 WeakPolarHBondContact O-CD 3.4Å
157N54.1Low60.4Low69 Ų6992 Ų9237%0.36950%0.501SS..  trans-65109.6177.8-17413.4000105.2E155 E159 L160E155-N157 VanDerWaalsContact C-N 3.28Å; E155-N157 PolarHBondContact O-N 3.29Å; N157-E159 PolarHBondContact O-N 3.05Å; N157-L160 PolarHBondContact O-N 3.12Å
158P53.4Low60Low101 Ų10190.3 Ų90.366%0.65649%0.494SS*.THydrogen-bonded Turntrans-66.1-12.9-166.924-31.2000112.7K156K156-P158 WeakPolarHBondContact O-CD 3.4Å
159E54.4Low60Low171 Ų17191.9 Ų91.980%0.79950%0.502SS*.THydrogen-bonded Turntrans-77.9-29.1173.3-67.8-170.1140.100114N157N157-E159 PolarHBondContact O-N 3.05Å
160L60.9Low60.1Low28 Ų2891 Ų9115%0.14750%0.496CS..THydrogen-bonded Turntrans-86.7-28.8-179.2-117.975.7000112.8I128 T136 A139 N157I128-L160 HydrophobicContact CD1-CD2 4.13Å; I128-L160 HydrophobicContact CG1-CD2 3.95Å; T136-L160 HydrophobicContact CG2-CD1 3.72Å; T136-L160 HydrophobicContact CG2-CG 4.37Å; A139-L160 HydrophobicContact CB-CD2 4.16Å; N157-L160 PolarHBondContact O-N 3.12Å
161C65.9Low60.6Low23 Ų2392.3 Ų92.316%0.15550%0.5CS..  trans-128.682.1-179-59.40000111.3C149 D163C149-C161 HydrophobicContact CB-CB 4.02Å; C149-C161 WeakPolarHBondContact CB-SG 3.47Å; C149-C161 WeakPolarHBondContact SG-CB 3.41Å; C149-C161 CovalentContact SG-SG 2Å; C149-C161 PolarHBondContact SG-SG 3.38Å; C161-D163 VanDerWaalsContact C-N 3.26Å; C161-D163 PolarHBondContact O-N 3.46Å
162P57.1Low61.4Low115 Ų11595 Ų9575%0.74751%0.514SS*.  trans-71.8-20-178.227.3-33.4000113.2
163D56.5Low62.7Low113 Ų11391.8 Ų91.860%0.60449%0.488SS*.  trans-103.4109.3-178.8-137-42.1000110.1C161 T165C161-D163 VanDerWaalsContact C-N 3.26Å; C161-D163 PolarHBondContact O-N 3.46Å; D163-T165 VanDerWaalsContact CG-OG1 3.28Å; D163-T165 PolarHBondContact O-N 3.17Å; D163-T165 PolarHBondContact OD1-OG1 3.19Å
164Q53.2Low64.4Low178 Ų17886.7 Ų86.783%0.83245%0.452SS*.THydrogen-bonded Turntrans-72.116.5-177.9-68-176.2-14.400113.8
165T53.2Low66.1Low108 Ų10884 Ų8466%0.66344%0.44SS*.THydrogen-bonded Turntrans-90.4-13-17329.40000114.5D163 E167D163-T165 VanDerWaalsContact CG-OG1 3.28Å; D163-T165 PolarHBondContact O-N 3.17Å; D163-T165 PolarHBondContact OD1-OG1 3.19Å; T165-E167 PolarHBondContact O-N 2.93Å
166E55.8Low67.9Low50 Ų5078.9 Ų78.923%0.23442%0.418CS..  trans-92.2101.2179.4-64.5-72.7142.600110.3N147 C148 C149 T168N147-E166 VanDerWaalsContact CG-OE2 3.25Å; N147-E166 PolarHBondContact ND2-OE1 3.49Å; N147-E166 PolarHBondContact ND2-OE2 3.31Å; N147-E166 PolarHBondContact OD1-OE1 3.33Å; C148-E166 PolarHBondContact N-OE2 3.03Å; C149-E166 HydrophobicContact CB-CB 4.26Å; E166-T168 VanDerWaalsContact C-N 3.32Å
167E58.9Low69.4Low198 Ų19876 Ų7693%0.92541%0.406SS*.  trans-81.5-11.6-177-145.6177-167.100113T165T165-E167 PolarHBondContact O-N 2.93Å
168T73.9Confident70.9Confident62 Ų6274.6 Ų74.638%0.3840%0.396SS..SBendtrans-97.6124.4-170.6-410000112.2C148 C149 E166 A173C148-T168 WeakPolarHBondContact CA-O 3.49Å; C148-T168 WeakPolarHBondContact CB-O 3.44Å; C149-T168 PolarHBondContact N-O 3.15Å; E166-T168 VanDerWaalsContact C-N 3.32Å; T168-A173 HydrophobicContact CG2-CB 4.28Å
169D81.9Confident72.3Confident35 Ų3574.4 Ų74.419%0.18739%0.39CS..  trans-66137.9171.8178.2-96.3000111.6G151 A152 H171 T172 A173G151-D169 WeakPolarHBondContact CA-OD2 3.32Å; A152-D169 WeakPolarHBondContact CA-OD2 3.48Å; A152-D169 PolarHBondContact N-OD2 2.87Å; D169-H171 VanDerWaalsContact C-N 3.29Å; D169-H171 PolarHBondContact O-N 3.4Å; D169-H171 WeakPolarHBondContact OD1-CA 3.42Å; D169-H171 WeakPolarHBondContact OD1-CB 3.33Å; D169-H171 IonicContact OD1-CD2 2.71Å; D169-H171 IonicContact OD1-CG 3.74Å; D169-H171 PolarHBondContact OD1-N 3.33Å; D169-T172 PolarHBondContact O-N 2.83Å; D169-T172 VanDerWaalsContact O-N 3.11Å; D169-A173 PolarHBondContact O-N 3.28Å
170C82.9Confident73.8Confident0 Ų072.5 Ų72.50%038%0.381CS..Hα-helixtrans-65.6-25.6-176.8-73.60000114.2Y124 H143 C148 C149 G150 A173 I174Y124-C170 HydrophobicContact CD1-CB 4.09Å; Y124-C170 HydrophobicContact CE1-CB 3.39Å; Y124-C170 HydrophobicContact CE2-CB 4.15Å; Y124-C170 VanDerWaalsContact CZ-CB 3.42Å; Y124-C170 WeakPolarHBondContact OH-CB 3.41Å; Y124-C170 PolarHBondContact OH-SG 3.21Å; H143-C170 PolarHBondContact CD2-SG 2.83Å; C148-C170 HydrophobicContact CB-CB 3.92Å; C148-C170 WeakPolarHBondContact CB-SG 3.41Å; C148-C170 WeakPolarHBondContact SG-CA 3.35Å; C148-C170 WeakPolarHBondContact SG-CB 3.43Å; C148-C170 CovalentContact SG-SG 2.03Å; C148-C170 PolarHBondContact SG-SG 2.83Å; C149-C170 PolarHBondContact N-SG 2.94Å; G150-C170 WeakPolarHBondContact O-CB 3.45Å; C170-A173 PolarHBondContact O-N 3.49Å; C170-I174 WeakPolarHBondContact O-CB 3.49Å; C170-I174 WeakPolarHBondContact O-CD1 3.25Å; C170-I174 WeakPolarHBondContact O-CG1 3.31Å; C170-I174 PolarHBondContact O-N 3.37Å
171H83.9Confident74.9Confident37 Ų3774.6 Ų74.617%0.17139%0.389CS..Hα-helixtrans-63.4-46.1171.7-76.6-101.9000110.8Q121 S125 D169 I174 L175Q121-H171 WeakPolarHBondContact CB-ND1 3.36Å; Q121-H171 HydrophobicContact CG-CB 4.27Å; Q121-H171 WeakPolarHBondContact CG-ND1 3.46Å; Q121-H171 PolarHBondContact NE2-O 2.99Å; S125-H171 PolarHBondContact OG-CE1 3.32Å; S125-H171 PolarHBondContact OG-NE2 3.05Å; D169-H171 VanDerWaalsContact C-N 3.29Å; D169-H171 PolarHBondContact O-N 3.4Å; D169-H171 WeakPolarHBondContact OD1-CA 3.42Å; D169-H171 WeakPolarHBondContact OD1-CB 3.33Å; D169-H171 IonicContact OD1-CD2 2.71Å; D169-H171 IonicContact OD1-CG 3.74Å; D169-H171 PolarHBondContact OD1-N 3.33Å; H171-I174 PolarHBondContact O-N 2.9Å; H171-L175 PolarHBondContact O-N 2.87Å
172T84.6Confident75.8Confident69 Ų6976 Ų7642%0.42340%0.395SS..Hα-helixtrans-65.4-41.1177.3-51.80000110.9D169 I174 L175 N176D169-T172 PolarHBondContact O-N 2.83Å; D169-T172 VanDerWaalsContact O-N 3.11Å; T172-I174 VanDerWaalsContact C-N 3.34Å; T172-I174 PolarHBondContact O-N 3.35Å; T172-L175 PolarHBondContact O-N 3.43Å; T172-N176 WeakPolarHBondContact O-CB 3.38Å; T172-N176 VanDerWaalsContact O-CG 3.3Å; T172-N176 PolarHBondContact O-N 3.43Å
173A85.4Confident77.2Confident10 Ų1076.6 Ų76.68%0.08339%0.391CS..Hα-helixtrans-63.2-37.8177.600000112.6L146 C148 T168 D169 C170 N176 F177L146-A173 HydrophobicContact CB-CB 4.35Å; C148-A173 HydrophobicContact CB-CB 3.62Å; T168-A173 HydrophobicContact CG2-CB 4.28Å; D169-A173 PolarHBondContact O-N 3.28Å; C170-A173 PolarHBondContact O-N 3.49Å; A173-N176 PolarHBondContact O-N 3.09Å; A173-F177 VanDerWaalsContact O-CB 3.29Å; A173-F177 WeakPolarHBondContact O-CB 3.45Å; A173-F177 PolarHBondContact O-N 2.98Å
174I86.4Confident78.8Confident3 Ų375.7 Ų75.72%0.01539%0.385CS..Hα-helixtrans-61.2-47.4174.8-70.8161000110.5I120 Q121 Y124 L146 C170 H171 T172 F177 F178I120-I174 HydrophobicContact CB-CG2 4.32Å; I120-I174 HydrophobicContact CG2-CD1 4.27Å; I120-I174 HydrophobicContact CG2-CG1 4.5Å; I120-I174 HydrophobicContact CG2-CG2 3.89Å; Q121-I174 HydrophobicContact CG-CB 4.18Å; Q121-I174 HydrophobicContact CG-CD1 4.12Å; Q121-I174 HydrophobicContact CG-CG2 4.01Å; Y124-I174 HydrophobicContact CD1-CD1 4.34Å; Y124-I174 HydrophobicContact CG-CD1 4.15Å; L146-I174 HydrophobicContact CD1-CG1 3.57Å; C170-I174 WeakPolarHBondContact O-CB 3.49Å; C170-I174 WeakPolarHBondContact O-CD1 3.25Å; C170-I174 WeakPolarHBondContact O-CG1 3.31Å; C170-I174 PolarHBondContact O-N 3.37Å; H171-I174 PolarHBondContact O-N 2.9Å; T172-I174 VanDerWaalsContact C-N 3.34Å; T172-I174 PolarHBondContact O-N 3.35Å; I174-F177 WeakPolarHBondContact O-CB 3.27Å; I174-F177 PolarHBondContact O-N 3.32Å; I174-F178 HydrophobicContact CG2-CD2 4.11Å; I174-F178 HydrophobicContact CG2-CE2 4.1Å; I174-F178 VanDerWaalsContact O-CD2 3.29Å; I174-F178 WeakPolarHBondContact O-CD2 3.33Å; I174-F178 PolarHBondContact O-N 3.07Å; I174-F178 VanDerWaalsContact O-N 3.14Å
175L85.8Confident80.4Confident71 Ų7170.5 Ų70.537%0.37236%0.362SS..Hα-helixtrans-62.4-47.7177.8-70.8167.1000111.7A117 Q121 H171 T172 F177 F178 D179A117-L175 HydrophobicContact CB-CD2 3.65Å; Q121-L175 VanDerWaalsContact NE2-CD1 3.29Å; Q121-L175 VanDerWaalsContact NE2-CG 3.28Å; H171-L175 PolarHBondContact O-N 2.87Å; T172-L175 PolarHBondContact O-N 3.43Å; L175-F177 PolarHBondContact O-N 2.98Å; L175-F178 PolarHBondContact O-N 3.03Å; L175-F178 VanDerWaalsContact O-N 3.09Å; L175-D179 PolarHBondContact O-N 3.46Å
176N85.4Confident82.2Confident81 Ų8166.9 Ų66.943%0.43335%0.346SS..Hα-helixtrans-60.4-35.2177.6-71.2-13.2000111.8T172 A173 D179 E180T172-N176 WeakPolarHBondContact O-CB 3.38Å; T172-N176 VanDerWaalsContact O-CG 3.3Å; T172-N176 PolarHBondContact O-N 3.43Å; A173-N176 PolarHBondContact O-N 3.09Å; N176-D179 PolarHBondContact O-N 3.02Å; N176-E180 WeakPolarHBondContact O-CB 3.49Å; N176-E180 PolarHBondContact O-N 3.45Å
177F84.6Confident83.9Confident74 Ų7472.3 Ų72.333%0.32537%0.366SS..Hα-helixtrans-63.2-44.8175-176.5-91.4000111.6L146 A173 I174 L175 K181 I185L146-F177 HydrophobicContact CD2-CB 3.9Å; L146-F177 HydrophobicContact CD2-CD1 4.5Å; L146-F177 HydrophobicContact CD2-CD2 3.53Å; L146-F177 HydrophobicContact CD2-CE2 4.16Å; L146-F177 HydrophobicContact CD2-CG 3.73Å; A173-F177 VanDerWaalsContact O-CB 3.29Å; A173-F177 WeakPolarHBondContact O-CB 3.45Å; A173-F177 PolarHBondContact O-N 2.98Å; I174-F177 WeakPolarHBondContact O-CB 3.27Å; I174-F177 PolarHBondContact O-N 3.32Å; L175-F177 PolarHBondContact O-N 2.98Å; F177-K181 HydrophobicContact CD2-CB 4.08Å; F177-K181 HydrophobicContact CD2-CG 3.7Å; F177-K181 HydrophobicContact CE2-CB 4Å; F177-K181 HydrophobicContact CE2-CG 3.89Å; F177-K181 HydrophobicContact CG-CB 4.36Å; F177-K181 HydrophobicContact CG-CG 4.26Å; F177-K181 HydrophobicContact CZ-CB 4.22Å; F177-K181 WeakPolarHBondContact O-CA 3.47Å; F177-K181 WeakPolarHBondContact O-CB 3.45Å; F177-K181 PolarHBondContact O-N 3.3Å; F177-I185 HydrophobicContact CD1-CD1 4.49Å; F177-I185 HydrophobicContact CE1-CD1 3.87Å; F177-I185 HydrophobicContact CE1-CG1 4.41Å
178F83.8Confident85.5Confident40 Ų4067.8 Ų67.818%0.17535%0.347CS..Hα-helixtrans-67.8-33.4178.2-83.8-76000113.2I116 A117 I120 I174 L175 L182 I185I116-F178 HydrophobicContact CG2-CE1 4.31Å; I116-F178 HydrophobicContact CG2-CZ 4.27Å; A117-F178 HydrophobicContact CB-CD2 3.93Å; A117-F178 HydrophobicContact CB-CG 4.37Å; I120-F178 HydrophobicContact CD1-CE1 4.4Å; I120-F178 HydrophobicContact CD1-CE2 3.44Å; I120-F178 VanDerWaalsContact CD1-CE2 3.44Å; I120-F178 HydrophobicContact CD1-CZ 3.23Å; I174-F178 HydrophobicContact CG2-CD2 4.11Å; I174-F178 HydrophobicContact CG2-CE2 4.1Å; I174-F178 VanDerWaalsContact O-CD2 3.29Å; I174-F178 WeakPolarHBondContact O-CD2 3.33Å; I174-F178 PolarHBondContact O-N 3.07Å; I174-F178 VanDerWaalsContact O-N 3.14Å; L175-F178 PolarHBondContact O-N 3.03Å; L175-F178 VanDerWaalsContact O-N 3.09Å; F178-L182 VanDerWaalsContact O-CB 3.27Å; F178-L182 WeakPolarHBondContact O-CB 3.42Å; F178-L182 WeakPolarHBondContact O-CD1 3.29Å; F178-I185 HydrophobicContact CD1-CD1 4.39Å; F178-I185 HydrophobicContact CE1-CD1 4.29Å
179D84.8Confident86.5Confident97 Ų9766 Ų6652%0.51934%0.341SS..Hα-helixtrans-80.8-42.5178.5-77.8-37.7000113.1K113 L175 N176K113-D179 IonicContact NZ-OD1 2.74Å; K113-D179 PolarHBondContact NZ-OD1 3.16Å; L175-D179 PolarHBondContact O-N 3.46Å; N176-D179 PolarHBondContact O-N 3.02Å
180E84.4Confident87Confident130 Ų13070 Ų7061%0.60736%0.361SS*.Hα-helixtrans-84.4-37.5-178.3-70.4-159.4167.400113.8N176N176-E180 WeakPolarHBondContact O-CB 3.49Å; N176-E180 PolarHBondContact O-N 3.45Å
181K84.3Confident87.6Confident73 Ų7372 Ų7232%0.31738%0.381SS..SBendtrans-100.26.5-170.8-46.9-52.9-177.4-1430112.7F177 L183 I184 I185F177-K181 HydrophobicContact CD2-CB 4.08Å; F177-K181 HydrophobicContact CD2-CG 3.7Å; F177-K181 HydrophobicContact CE2-CB 4Å; F177-K181 HydrophobicContact CE2-CG 3.89Å; F177-K181 HydrophobicContact CG-CB 4.36Å; F177-K181 HydrophobicContact CG-CG 4.26Å; F177-K181 HydrophobicContact CZ-CB 4.22Å; F177-K181 WeakPolarHBondContact O-CA 3.47Å; F177-K181 WeakPolarHBondContact O-CB 3.45Å; F177-K181 PolarHBondContact O-N 3.3Å; K181-L183 PolarHBondContact O-N 3.29Å; K181-L183 VanDerWaalsContact O-N 3.14Å; K181-I184 HydrophobicContact CB-CB 4.49Å; K181-I184 HydrophobicContact CB-CD1 4.34Å; K181-I184 HydrophobicContact CD-CD1 3.91Å; K181-I184 WeakPolarHBondContact O-CA 3.41Å; K181-I184 WeakPolarHBondContact O-CB 3.27Å; K181-I184 PolarHBondContact O-N 2.81Å; K181-I185 PolarHBondContact O-N 3.5Å
182L84.8Confident88.1Confident52 Ų5274 Ų7427%0.27239%0.392SS..Hα-helixtrans-51.4-37.8172.3-141.4159000111.6F110 K113 F178 I184 I185 G186F110-L182 HydrophobicContact CD2-CD2 4.18Å; F110-L182 HydrophobicContact CE2-CD2 4.5Å; K113-L182 HydrophobicContact CD-CD1 4.18Å; F178-L182 VanDerWaalsContact O-CB 3.27Å; F178-L182 WeakPolarHBondContact O-CB 3.42Å; F178-L182 WeakPolarHBondContact O-CD1 3.29Å; L182-I184 PolarHBondContact O-N 2.94Å; L182-I185 PolarHBondContact O-N 2.91Å; L182-G186 PolarHBondContact O-N 3.04Å
183L87.2Confident88.6Confident127 Ų12771.6 Ų71.667%0.66538%0.38SS*.Hα-helixtrans-61.1-42.1174.6-69.2177.6000112.7K181 G186 Y187K181-L183 PolarHBondContact O-N 3.29Å; K181-L183 VanDerWaalsContact O-N 3.14Å; L183-G186 PolarHBondContact O-N 2.86Å; L183-Y187 HydrophobicContact CB-CE2 4.42Å; L183-Y187 WeakPolarHBondContact O-CD2 3.34Å; L183-Y187 PolarHBondContact O-N 3.2Å
184I89.1Confident89.2Confident94 Ų9472.5 Ų72.548%0.48239%0.39SS..Hα-helixtrans-66.1-46.1178.2-57.6-176.7000110.2K181 L182 G186 Y187 I188K181-I184 HydrophobicContact CB-CB 4.49Å; K181-I184 HydrophobicContact CB-CD1 4.34Å; K181-I184 HydrophobicContact CD-CD1 3.91Å; K181-I184 WeakPolarHBondContact O-CA 3.41Å; K181-I184 WeakPolarHBondContact O-CB 3.27Å; K181-I184 PolarHBondContact O-N 2.81Å; L182-I184 PolarHBondContact O-N 2.94Å; I184-G186 PolarHBondContact O-N 3.41Å; I184-Y187 PolarHBondContact O-N 3.47Å; I184-Y187 VanDerWaalsContact O-N 3.16Å; I184-I188 HydrophobicContact CG2-CD1 4.27Å; I184-I188 WeakPolarHBondContact O-CG1 3.27Å; I184-I188 PolarHBondContact O-N 3.28Å
185I87.6Confident89.5Confident69 Ų6975.2 Ų75.235%0.35441%0.407SS..Hα-helixtrans-58.2-41.2175.4-58.5170.3000109.8F177 F178 K181 L182 I188 G189F177-I185 HydrophobicContact CD1-CD1 4.49Å; F177-I185 HydrophobicContact CE1-CD1 3.87Å; F177-I185 HydrophobicContact CE1-CG1 4.41Å; F178-I185 HydrophobicContact CD1-CD1 4.39Å; F178-I185 HydrophobicContact CE1-CD1 4.29Å; K181-I185 PolarHBondContact O-N 3.5Å; L182-I185 PolarHBondContact O-N 2.91Å; I185-I188 PolarHBondContact O-N 3.15Å; I185-G189 PolarHBondContact O-N 3.33Å
186G90.8Very high90Very high32 Ų3273 Ų7333%0.3340%0.395SS..Hα-helixtrans-60-46174.500000113.4L182 L183 I184 I188 G189 I190L182-G186 PolarHBondContact O-N 3.04Å; L183-G186 PolarHBondContact O-N 2.86Å; I184-G186 PolarHBondContact O-N 3.41Å; G186-I188 VanDerWaalsContact C-N 3.33Å; G186-I188 PolarHBondContact O-N 3.01Å; G186-G189 PolarHBondContact O-N 2.9Å; G186-I190 WeakPolarHBondContact O-CG1 3.13Å; G186-I190 PolarHBondContact O-N 3.37Å
187Y91.7Very high90.5Very high165 Ų16572.5 Ų72.565%0.64739%0.392SS*.Hα-helixtrans-62.7-38.9175.9-70.8-58.7000112.7L183 I184 I190 G191L183-Y187 HydrophobicContact CB-CE2 4.42Å; L183-Y187 WeakPolarHBondContact O-CD2 3.34Å; L183-Y187 PolarHBondContact O-N 3.2Å; I184-Y187 PolarHBondContact O-N 3.47Å; I184-Y187 VanDerWaalsContact O-N 3.16Å; Y187-I190 PolarHBondContact O-N 2.84Å; Y187-G191 PolarHBondContact O-N 3.11Å
188I92.9Very high90.9Very high102 Ų10273.2 Ų73.252%0.52340%0.398SS..Hα-helixtrans-61.2-48.9174.8-65.8167.8000109.6I184 I185 G186 I190 G191 I192I184-I188 HydrophobicContact CG2-CD1 4.27Å; I184-I188 WeakPolarHBondContact O-CG1 3.27Å; I184-I188 PolarHBondContact O-N 3.28Å; I185-I188 PolarHBondContact O-N 3.15Å; G186-I188 VanDerWaalsContact C-N 3.33Å; G186-I188 PolarHBondContact O-N 3.01Å; I188-I190 PolarHBondContact O-N 3.04Å; I188-G191 PolarHBondContact O-N 3.06Å; I188-G191 VanDerWaalsContact O-N 3.12Å; I188-I192 HydrophobicContact CG2-CD1 3.82Å; I188-I192 HydrophobicContact CG2-CG1 4.33Å; I188-I192 VanDerWaalsContact O-CG1 3.3Å; I188-I192 WeakPolarHBondContact O-CG1 3.35Å; I188-I192 PolarHBondContact O-N 2.96Å
189G93.3Very high91.4Very high25 Ų2572 Ų7226%0.25840%0.396SS..Hα-helixtrans-58.7-44.8177.300000113.1I185 G186 G191 I192 A193I185-G189 PolarHBondContact O-N 3.33Å; G186-G189 PolarHBondContact O-N 2.9Å; G189-G191 VanDerWaalsContact C-N 3.29Å; G189-G191 PolarHBondContact O-N 2.82Å; G189-I192 PolarHBondContact O-N 2.81Å; G189-A193 WeakPolarHBondContact O-CB 3.46Å; G189-A193 PolarHBondContact O-N 3.14Å
190I94.1Very high91.9Very high120 Ų12068.5 Ų68.562%0.61538%0.377SS*.Hα-helixtrans-61.8-39.2175.8-66.8166.8000111.2G186 Y187 I188 G194G186-I190 WeakPolarHBondContact O-CG1 3.13Å; G186-I190 PolarHBondContact O-N 3.37Å; Y187-I190 PolarHBondContact O-N 2.84Å; I188-I190 PolarHBondContact O-N 3.04Å; I190-G194 PolarHBondContact O-N 3.47Å
191G95.5Very high92.4Very high41 Ų4166.7 Ų66.742%0.42337%0.371SS..Hα-helixtrans-63.1-46.6176.300000112.5Y187 I188 G189 G194 V195Y187-G191 PolarHBondContact O-N 3.11Å; I188-G191 PolarHBondContact O-N 3.06Å; I188-G191 VanDerWaalsContact O-N 3.12Å; G189-G191 VanDerWaalsContact C-N 3.29Å; G189-G191 PolarHBondContact O-N 2.82Å; G191-G194 PolarHBondContact O-N 3.39Å; G191-V195 WeakPolarHBondContact O-CG2 3.46Å; G191-V195 PolarHBondContact O-N 3.42Å
192I94.3Very high92.9Very high78 Ų7866.6 Ų66.640%0.437%0.371SS..Hα-helixtrans-62.3-48.9177.4-61169.2000109.7E102 I188 G189 G194 V195 M196E102-I192 WeakPolarHBondContact OE1-CB 3.48Å; I188-I192 HydrophobicContact CG2-CD1 3.82Å; I188-I192 HydrophobicContact CG2-CG1 4.33Å; I188-I192 VanDerWaalsContact O-CG1 3.3Å; I188-I192 WeakPolarHBondContact O-CG1 3.35Å; I188-I192 PolarHBondContact O-N 2.96Å; G189-I192 PolarHBondContact O-N 2.81Å; I192-G194 VanDerWaalsContact C-N 3.31Å; I192-G194 PolarHBondContact O-N 3.26Å; I192-V195 WeakPolarHBondContact O-CB 3.05Å; I192-V195 PolarHBondContact O-N 3.14Å; I192-V195 VanDerWaalsContact O-N 3.13Å; I192-M196 HydrophobicContact CG2-CE 3.39Å; I192-M196 WeakPolarHBondContact O-CG 3.19Å; I192-M196 PolarHBondContact O-N 3.09Å
193A95.6Very high93.3Very high20 Ų2064.2 Ų64.217%0.16536%0.358CS..Hα-helixtrans-54.1-44.9174.900000112.4F99 G189 M196 I197F99-A193 HydrophobicContact CD2-CB 4.44Å; F99-A193 HydrophobicContact CE2-CB 3.93Å; G189-A193 WeakPolarHBondContact O-CB 3.46Å; G189-A193 PolarHBondContact O-N 3.14Å; A193-M196 PolarHBondContact O-N 2.86Å; A193-I197 VanDerWaalsContact O-CG1 3.32Å; A193-I197 WeakPolarHBondContact O-CG1 3.34Å; A193-I197 PolarHBondContact O-N 2.8Å
194G96.3Very high93.5Very high29 Ų2963.8 Ų63.830%0.29935%0.354SS..Hα-helixtrans-61.6-43.6176.700000113I190 G191 I192 I197 I198I190-G194 PolarHBondContact O-N 3.47Å; G191-G194 PolarHBondContact O-N 3.39Å; I192-G194 VanDerWaalsContact C-N 3.31Å; I192-G194 PolarHBondContact O-N 3.26Å; G194-I197 PolarHBondContact O-N 3.44Å; G194-I198 WeakPolarHBondContact O-CG1 3.29Å; G194-I198 PolarHBondContact O-N 3.46Å
195V93.9Very high93.6Very high60 Ų6062.2 Ų62.236%0.36435%0.349SS..Hα-helixtrans-62.1-42.5175165.90000111.5F18 G191 I192 I197 I198 G199F18-V195 HydrophobicContact CE1-CG1 3.76Å; F18-V195 HydrophobicContact CE2-CG1 4.44Å; F18-V195 HydrophobicContact CZ-CG1 3.36Å; G191-V195 WeakPolarHBondContact O-CG2 3.46Å; G191-V195 PolarHBondContact O-N 3.42Å; I192-V195 WeakPolarHBondContact O-CB 3.05Å; I192-V195 PolarHBondContact O-N 3.14Å; I192-V195 VanDerWaalsContact O-N 3.13Å; V195-I197 PolarHBondContact O-N 3.4Å; V195-I198 PolarHBondContact O-N 2.92Å; V195-G199 PolarHBondContact O-N 3.27Å
196M95.1Very high93.7Very high24 Ų2458.9 Ų58.912%0.11833%0.332CS..Hα-helixtrans-61.9-43.3176.3-66-162.3-149.800111.6L95 I98 F99 E102 I192 A193 I198 G199 M200L95-M196 HydrophobicContact CD2-CG 4.49Å; I98-M196 HydrophobicContact CB-SD 4.25Å; I98-M196 HydrophobicContact CG2-CE 3.58Å; I98-M196 HydrophobicContact CG2-SD 3.7Å; F99-M196 HydrophobicContact CB-SD 4.28Å; E102-M196 WeakPolarHBondContact OE2-CE 3.45Å; I192-M196 HydrophobicContact CG2-CE 3.39Å; I192-M196 WeakPolarHBondContact O-CG 3.19Å; I192-M196 PolarHBondContact O-N 3.09Å; A193-M196 PolarHBondContact O-N 2.86Å; M196-I198 PolarHBondContact O-N 2.87Å; M196-G199 PolarHBondContact O-N 2.03Å; M196-M200 WeakPolarHBondContact O-CG 3.01Å; M196-M200 PolarHBondContact O-N 3.37Å
197I95.9Very high93.7Very high71 Ų7158.7 Ų58.736%0.36433%0.325SS..Hα-helixtrans-60.9-45.4177.2-68.7166.3000110.9F99 A193 G194 V195 G199 M200 I201F99-I197 HydrophobicContact CE2-CD1 3.98Å; F99-I197 HydrophobicContact CE2-CG1 4.03Å; F99-I197 HydrophobicContact CZ-CD1 4.13Å; F99-I197 HydrophobicContact CZ-CG1 4.37Å; A193-I197 VanDerWaalsContact O-CG1 3.32Å; A193-I197 WeakPolarHBondContact O-CG1 3.34Å; A193-I197 PolarHBondContact O-N 2.8Å; G194-I197 PolarHBondContact O-N 3.44Å; V195-I197 PolarHBondContact O-N 3.4Å; I197-G199 VanDerWaalsContact C-N 3.31Å; I197-G199 PolarHBondContact O-N 3.48Å; I197-M200 HydrophobicContact CB-CE 4.39Å; I197-M200 HydrophobicContact CG1-CE 3.91Å; I197-M200 WeakPolarHBondContact O-CB 3.45Å; I197-M200 PolarHBondContact O-N 3.31Å; I197-I201 HydrophobicContact CG2-CD1 3.82Å; I197-I201 HydrophobicContact CG2-CG1 4.43Å; I197-I201 VanDerWaalsContact O-CG1 3.3Å; I197-I201 WeakPolarHBondContact O-CG1 3.21Å; I197-I201 PolarHBondContact O-N 3Å
198I94.5Very high93.6Very high88 Ų8853.3 Ų53.345%0.45131%0.311SS..Hα-helixtrans-60.2-43.8175.8-68.3167000110.6G194 V195 M196 M200 I201 F202G194-I198 WeakPolarHBondContact O-CG1 3.29Å; G194-I198 PolarHBondContact O-N 3.46Å; V195-I198 PolarHBondContact O-N 2.92Å; M196-I198 PolarHBondContact O-N 2.87Å; I198-M200 PolarHBondContact O-N 2.86Å; I198-I201 PolarHBondContact O-N 3.01Å; I198-F202 HydrophobicContact CG2-CD2 3.77Å; I198-F202 HydrophobicContact CG2-CE1 4.41Å; I198-F202 HydrophobicContact CG2-CE2 3.41Å; I198-F202 VanDerWaalsContact CG2-CE2 3.41Å; I198-F202 HydrophobicContact CG2-CG 4.41Å; I198-F202 HydrophobicContact CG2-CZ 3.77Å; I198-F202 WeakPolarHBondContact O-CG 3.41Å; I198-F202 PolarHBondContact O-N 3.11Å
199G94.1Very high93.3Very high14 Ų1449.4 Ų49.414%0.14429%0.294CS..Hα-helixtrans-58.5-44175.100000112.8V195 M196 I197 S203V195-G199 PolarHBondContact O-N 3.27Å; M196-G199 PolarHBondContact O-N 2.03Å; I197-G199 VanDerWaalsContact C-N 3.31Å; I197-G199 PolarHBondContact O-N 3.48Å; G199-S203 WeakPolarHBondContact O-CB 3.31Å; G199-S203 PolarHBondContact O-N 3.49Å
200M95.8Very high93Very high24 Ų2448.3 Ų48.312%0.11828%0.282CS..Hα-helixtrans-62.8-44.6175.5-74.2-170.9-71.300112F92 L95 L96 F99 M196 I197 I198 S203 M204F92-M200 HydrophobicContact CD2-CB 3.92Å; F92-M200 HydrophobicContact CD2-CG 4.03Å; F92-M200 HydrophobicContact CE2-CB 3.81Å; F92-M200 HydrophobicContact CE2-CG 4.09Å; F92-M200 HydrophobicContact CE2-SD 4.32Å; L95-M200 HydrophobicContact CB-CG 3.72Å; L95-M200 HydrophobicContact CB-SD 4.28Å; L95-M200 HydrophobicContact CD1-CG 3.9Å; L96-M200 HydrophobicContact CB-SD 4.29Å; F99-M200 HydrophobicContact CG-CE 4.4Å; M196-M200 WeakPolarHBondContact O-CG 3.01Å; M196-M200 PolarHBondContact O-N 3.37Å; I197-M200 HydrophobicContact CB-CE 4.39Å; I197-M200 HydrophobicContact CG1-CE 3.91Å; I197-M200 WeakPolarHBondContact O-CB 3.45Å; I197-M200 PolarHBondContact O-N 3.31Å; I198-M200 PolarHBondContact O-N 2.86Å; M200-S203 PolarHBondContact O-N 3.38Å; M200-M204 WeakPolarHBondContact O-CB 3.46Å; M200-M204 PolarHBondContact O-N 3.28Å
201I94.9Very high92.7Very high92 Ų9249.6 Ų49.647%0.47228%0.279SS..Hα-helixtrans-61.6-51.7177.8-68.2165.6000110.3I197 I198 S203 M204 V205I197-I201 HydrophobicContact CG2-CD1 3.82Å; I197-I201 HydrophobicContact CG2-CG1 4.43Å; I197-I201 VanDerWaalsContact O-CG1 3.3Å; I197-I201 WeakPolarHBondContact O-CG1 3.21Å; I197-I201 PolarHBondContact O-N 3Å; I198-I201 PolarHBondContact O-N 3.01Å; I201-S203 VanDerWaalsContact C-N 3.3Å; I201-S203 PolarHBondContact O-N 3.26Å; I201-M204 PolarHBondContact O-N 3.04Å; I201-V205 HydrophobicContact CG2-CG2 4.23Å; I201-V205 WeakPolarHBondContact O-CB 3.04Å; I201-V205 VanDerWaalsContact O-CG2 3.25Å; I201-V205 WeakPolarHBondContact O-CG2 3.34Å; I201-V205 PolarHBondContact O-N 2.74Å
202F93Very high92.3Very high72 Ų7252.8 Ų52.832%0.31629%0.286SS..Hα-helixtrans-63.9-37-179.7-68.8-17000112.2V11 L15 I198 L206V11-F202 HydrophobicContact CG1-CB 3.95Å; V11-F202 HydrophobicContact CG1-CD1 4Å; V11-F202 HydrophobicContact CG1-CG 3.94Å; L15-F202 HydrophobicContact CD1-CB 3.69Å; I198-F202 HydrophobicContact CG2-CD2 3.77Å; I198-F202 HydrophobicContact CG2-CE1 4.41Å; I198-F202 HydrophobicContact CG2-CE2 3.41Å; I198-F202 VanDerWaalsContact CG2-CE2 3.41Å; I198-F202 HydrophobicContact CG2-CG 4.41Å; I198-F202 HydrophobicContact CG2-CZ 3.77Å; I198-F202 WeakPolarHBondContact O-CG 3.41Å; I198-F202 PolarHBondContact O-N 3.11Å; F202-L206 WeakPolarHBondContact O-CB 3.17Å; F202-L206 PolarHBondContact O-N 3.44Å
203S92.9Very high91.6Very high2 Ų250.5 Ų50.51%0.01428%0.278CS..Hα-helixtrans-60.3-50.3173.1-177.90000111.8L88 G199 M200 I201 L206 C207L88-S203 VanDerWaalsContact CD1-OG 3.31Å; L88-S203 WeakPolarHBondContact CD1-OG 3.4Å; L88-S203 VanDerWaalsContact CD2-O 3.32Å; L88-S203 WeakPolarHBondContact CD2-O 3.35Å; L88-S203 VanDerWaalsContact CG-OG 3.31Å; L88-S203 WeakPolarHBondContact CG-OG 3.12Å; L88-S203 PolarHBondContact O-OG 3.47Å; G199-S203 WeakPolarHBondContact O-CB 3.31Å; G199-S203 PolarHBondContact O-N 3.49Å; M200-S203 PolarHBondContact O-N 3.38Å; I201-S203 VanDerWaalsContact C-N 3.3Å; I201-S203 PolarHBondContact O-N 3.26Å; S203-L206 PolarHBondContact O-N 2.96Å; S203-C207 VanDerWaalsContact O-CB 3.24Å; S203-C207 WeakPolarHBondContact O-CB 3.41Å; S203-C207 PolarHBondContact O-N 2.88Å
204M92.4Very high90.8Very high117 Ų11755.9 Ų55.958%0.57629%0.294SS*.Hα-helixtrans-64.4-45.2-179.5-172.5178.3-176.200111.8M200 I201 L206 C207 C208M200-M204 WeakPolarHBondContact O-CB 3.46Å; M200-M204 PolarHBondContact O-N 3.28Å; I201-M204 PolarHBondContact O-N 3.04Å; M204-L206 PolarHBondContact O-N 3.29Å; M204-C207 PolarHBondContact O-N 3.45Å; M204-C208 WeakPolarHBondContact O-CB 2.86Å; M204-C208 PolarHBondContact O-N 3.32Å; M204-C208 PolarHBondContact O-SG 2.96Å; M204-C208 VanDerWaalsContact O-SG 3.33Å
205V91.8Very high89.8Confident61 Ų6161.3 Ų61.337%0.3731%0.311SS..Hα-helixtrans-60.8-46.3178.5168.20000111M8 I201 C208 A209M8-V205 HydrophobicContact CE-CG1 3.38Å; M8-V205 HydrophobicContact SD-CG1 3.82Å; I201-V205 HydrophobicContact CG2-CG2 4.23Å; I201-V205 WeakPolarHBondContact O-CB 3.04Å; I201-V205 VanDerWaalsContact O-CG2 3.25Å; I201-V205 WeakPolarHBondContact O-CG2 3.34Å; I201-V205 PolarHBondContact O-N 2.74Å; V205-C208 PolarHBondContact O-N 2.81Å; V205-A209 WeakPolarHBondContact O-CB 3.34Å; V205-A209 PolarHBondContact O-N 2.81Å
206L90.1Very high88.6Confident0 Ų064 Ų640%033%0.327CS..Hα-helixtrans-67.8-37.3178.2-176.466.2000111.4V4 M8 K12 A80 L88 F202 S203 M204 A209 I210V4-L206 HydrophobicContact CG2-CD1 4.47Å; M8-L206 HydrophobicContact CG-CD1 4.03Å; M8-L206 HydrophobicContact SD-CD1 4.13Å; K12-L206 HydrophobicContact CB-CD1 4.26Å; A80-L206 HydrophobicContact CB-CD2 4.36Å; L88-L206 HydrophobicContact CD2-CB 3.86Å; L88-L206 HydrophobicContact CD2-CD2 4.01Å; L88-L206 HydrophobicContact CD2-CG 3.87Å; F202-L206 WeakPolarHBondContact O-CB 3.17Å; F202-L206 PolarHBondContact O-N 3.44Å; S203-L206 PolarHBondContact O-N 2.96Å; M204-L206 PolarHBondContact O-N 3.29Å; L206-A209 PolarHBondContact O-N 2.62Å; L206-I210 HydrophobicContact CD1-CD1 4.38Å; L206-I210 HydrophobicContact CG-CD1 3.98Å; L206-I210 WeakPolarHBondContact O-CB 3.45Å; L206-I210 WeakPolarHBondContact O-CD1 3.17Å; L206-I210 WeakPolarHBondContact O-CG1 3.48Å; L206-I210 PolarHBondContact O-N 3.29Å
207C90Very high86.6Confident28 Ų2871.7 Ų71.719%0.18937%0.367CS..Hα-helixtrans-63.8-45.3175.6-168.70000111.9L88 S203 M204 I210 R211L88-C207 HydrophobicContact CD2-CB 3.73Å; L88-C207 VanDerWaalsContact CD2-N 3.33Å; L88-C207 HydrophobicContact CG-CB 4.24Å; S203-C207 VanDerWaalsContact O-CB 3.24Å; S203-C207 WeakPolarHBondContact O-CB 3.41Å; S203-C207 PolarHBondContact O-N 2.88Å; M204-C207 PolarHBondContact O-N 3.45Å; C207-I210 PolarHBondContact O-N 3.17Å; C207-R211 PolarHBondContact O-N 2.68Å
208C89.2Confident86.2Confident52 Ų5271.8 Ų71.835%0.35137%0.367SS..Hα-helixtrans-62.7-42.4175.2-74.60000111.8M204 V205 R211 N212M204-C208 WeakPolarHBondContact O-CB 2.86Å; M204-C208 PolarHBondContact O-N 3.32Å; M204-C208 PolarHBondContact O-SG 2.96Å; M204-C208 VanDerWaalsContact O-SG 3.33Å; V205-C208 PolarHBondContact O-N 2.81Å; C208-R211 PolarHBondContact O-N 2Å; C208-N212 WeakPolarHBondContact O-CB 3.05Å; C208-N212 PolarHBondContact O-N 3.4Å
209A87.8Confident85.7Confident20 Ų2070.9 Ų70.917%0.16536%0.363CS..Hα-helixtrans-62.2-45.5176.700000111.7V4 M8 V205 L206 R211 N212 S213V4-A209 HydrophobicContact CG1-CB 3.87Å; M8-A209 HydrophobicContact CE-CB 3.99Å; M8-A209 HydrophobicContact CG-CB 3.93Å; M8-A209 HydrophobicContact SD-CB 4.11Å; V205-A209 WeakPolarHBondContact O-CB 3.34Å; V205-A209 PolarHBondContact O-N 2.81Å; L206-A209 PolarHBondContact O-N 2.62Å; A209-R211 VanDerWaalsContact C-N 3.33Å; A209-R211 PolarHBondContact O-N 3.32Å; A209-N212 PolarHBondContact O-N 3.01Å; A209-S213 PolarHBondContact O-N 2.88Å; A209-S213 PolarHBondContact O-OG 2.9Å; A209-S213 VanDerWaalsContact O-OG 3.12Å
210I86.6Confident85.3Confident2 Ų274.1 Ų74.11%0.0138%0.375CS..Hα-helixtrans-62.3-41.1176.3-67.5161.1000111.1E83 Q85 L88 L206 C207 S213 R214E83-I210 HydrophobicContact CB-CD1 3.86Å; E83-I210 HydrophobicContact CB-CG1 4.12Å; E83-I210 HydrophobicContact CG-CD1 4.35Å; E83-I210 WeakPolarHBondContact O-CG2 3.25Å; Q85-I210 HydrophobicContact CG-CB 4.26Å; Q85-I210 HydrophobicContact CG-CG2 3.68Å; L88-I210 HydrophobicContact CD2-CD1 4.24Å; L206-I210 HydrophobicContact CD1-CD1 4.38Å; L206-I210 HydrophobicContact CG-CD1 3.98Å; L206-I210 WeakPolarHBondContact O-CB 3.45Å; L206-I210 WeakPolarHBondContact O-CD1 3.17Å; L206-I210 WeakPolarHBondContact O-CG1 3.48Å; L206-I210 PolarHBondContact O-N 3.29Å; C207-I210 PolarHBondContact O-N 3.17Å; I210-S213 PolarHBondContact O-N 2.85Å; I210-R214 PolarHBondContact O-N 3.15Å
211R87.1Confident84.6Confident146 Ų14677 Ų7755%0.55139%0.39SS*.Hα-helixtrans-59.7-52.2176.2-169.4170.363.5179.60.5110.6Q85 C207 C208 A209 S213 R214 E215Q85-R211 VanDerWaalsContact NE2-CB 3.27Å; C207-R211 PolarHBondContact O-N 2.68Å; C208-R211 PolarHBondContact O-N 2Å; A209-R211 VanDerWaalsContact C-N 3.33Å; A209-R211 PolarHBondContact O-N 3.32Å; R211-S213 VanDerWaalsContact C-N 3.28Å; R211-S213 PolarHBondContact O-N 3.39Å; R211-R214 WeakPolarHBondContact O-CB 3.22Å; R211-R214 PolarHBondContact O-N 3.16Å; R211-E215 PolarHBondContact O-N 2.96Å
212N86.4Confident84Confident108 Ų10876.1 Ų76.158%0.57839%0.385SS*.Hα-helixtrans-59.8-39.7-179.4-168.267.1000111.9C208 A209 R214 E215 V216C208-N212 WeakPolarHBondContact O-CB 3.05Å; C208-N212 PolarHBondContact O-N 3.4Å; A209-N212 PolarHBondContact O-N 3.01Å; N212-R214 PolarHBondContact O-N 2.73Å; N212-E215 PolarHBondContact O-N 2.78Å; N212-V216 VanDerWaalsContact O-CG2 3.3Å; N212-V216 WeakPolarHBondContact O-CG2 3.14Å
213S81.1Confident83.4Confident31 Ų3176.3 Ų76.322%0.21739%0.39CS..Hα-helixtrans-66-21.1174.6-63.40000114.2A209 I210 R211 I217A209-S213 PolarHBondContact O-N 2.88Å; A209-S213 PolarHBondContact O-OG 2.9Å; A209-S213 VanDerWaalsContact O-OG 3.12Å; I210-S213 PolarHBondContact O-N 2.85Å; R211-S213 VanDerWaalsContact C-N 3.28Å; R211-S213 PolarHBondContact O-N 3.39Å; S213-I217 WeakPolarHBondContact O-CD1 3.08Å
214R78.4Confident82.7Confident132 Ų13281.6 Ų81.650%0.49842%0.417SS..Hα-helixtrans-82.2-38.8176.2-171.4-169.4-66.1-115.55.3111.9I210 R211 N212 V216 I217I210-R214 PolarHBondContact O-N 3.15Å; R211-R214 WeakPolarHBondContact O-CB 3.22Å; R211-R214 PolarHBondContact O-N 3.16Å; N212-R214 PolarHBondContact O-N 2.73Å; R214-V216 PolarHBondContact O-N 3.49Å; R214-I217 PolarHBondContact O-N 2.97Å
215E75.4Confident82Confident144 Ų14478.9 Ų78.967%0.67340%0.404SS*.Hα-helixtrans-70.1-17.3-179-58.2-62.3156.100113.5R211 N212R211-E215 PolarHBondContact O-N 2.96Å; N212-E215 PolarHBondContact O-N 2.78Å
216V67.3Low81.1Confident115 Ų11580.4 Ų80.470%0.69741%0.407SS*.THydrogen-bonded Turntrans-90.9-5.9-177.9179.10000112.6N212 R214N212-V216 VanDerWaalsContact O-CG2 3.3Å; N212-V216 WeakPolarHBondContact O-CG2 3.14Å; R214-V216 PolarHBondContact O-N 3.49Å
217I54.3Low80.3Confident187 Ų18787.7 Ų87.796%0.95944%0.444SS*.  trans-110.70-180-58.5171.7000109.2S213 R214S213-I217 WeakPolarHBondContact O-CD1 3.08Å; R214-I217 PolarHBondContact O-N 2.97Å

Retrieved 217 of 217 residues in 44.8 ms (Link to these results)

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