A0A077Z2E2_TRITR Loading...

Transmembrane protein 170A

AlphaFold DB , UniProt , Accession A0A077Z2E2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 125 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
1M57.5Low69.9Low137 Ų13795.2 Ų95.268%0.67549%0.494SS*.  096.70-147168.2161.800107.8E5 Y6 Y9M1-E5 VanDerWaalsContact CA-OE2 3.28Å; M1-E5 WeakPolarHBondContact CA-OE2 3.44Å; M1-Y6 HydrophobicContact CB-CD2 4.28Å; M1-Y6 HydrophobicContact CB-CE2 3.52Å; M1-Y6 HydrophobicContact CE-CD1 3.32Å; M1-Y6 HydrophobicContact CE-CD2 4Å; M1-Y6 HydrophobicContact CE-CE1 3.03Å; M1-Y6 HydrophobicContact CE-CE2 3.77Å; M1-Y6 HydrophobicContact CE-CG 3.8Å; M1-Y6 HydrophobicContact CG-CD2 3.7Å; M1-Y6 HydrophobicContact CG-CE1 4.31Å; M1-Y6 HydrophobicContact CG-CE2 3.23Å; M1-Y6 HydrophobicContact CG-CG 4.42Å; M1-Y6 HydrophobicContact SD-CD1 4.37Å; M1-Y6 HydrophobicContact SD-CD2 4.31Å; M1-Y6 HydrophobicContact SD-CE1 3.65Å; M1-Y6 HydrophobicContact SD-CE2 3.58Å; M1-Y6 VanDerWaalsContact SD-CE2 3.58Å; M1-Y6 PolarHBondContact SD-OH 3.25Å; M1-Y9 HydrophobicContact CE-CD2 4.06Å; M1-Y9 HydrophobicContact CE-CE2 4.04Å
2N76.4Confident69.5Low109 Ų10988.3 Ų88.358%0.58346%0.459SS*.  trans-81.6153.2-178.3-151.613.2000108.5S4 E5 Y6N2-S4 PolarHBondContact O-N 3.35Å; N2-S4 VanDerWaalsContact O-N 3.12Å; N2-E5 VanDerWaalsContact O-CB 3.32Å; N2-E5 WeakPolarHBondContact O-CB 3.26Å; N2-E5 PolarHBondContact O-N 3.25Å; N2-Y6 WeakPolarHBondContact O-CD2 3.48Å; N2-Y6 PolarHBondContact O-N 2.64Å
3T77.6Confident69.2Low107 Ų10786.9 Ų86.966%0.65646%0.459SS*.Hα-helixtrans-55.7-32.4-179.542.90000112.9E5 Y6 I7T3-E5 VanDerWaalsContact C-N 3.33Å; T3-E5 PolarHBondContact O-N 2.88Å; T3-Y6 PolarHBondContact O-N 3.39Å; T3-I7 WeakPolarHBondContact O-CD1 3.46Å; T3-I7 VanDerWaalsContact O-CG1 3.26Å; T3-I7 WeakPolarHBondContact O-CG1 3.04Å; T3-I7 PolarHBondContact O-N 3.05Å; T3-I7 VanDerWaalsContact O-N 3.1Å
4S71.5Confident69Low73 Ų7382.7 Ų82.751%0.5144%0.44SS..Hα-helixtrans-61.1-38.4173.858.90000113.5N2 I7 S8N2-S4 PolarHBondContact O-N 3.35Å; N2-S4 VanDerWaalsContact O-N 3.12Å; S4-I7 PolarHBondContact O-N 2.91Å; S4-S8 PolarHBondContact O-N 3.39Å; S4-S8 VanDerWaalsContact O-N 3.12Å
5E69.2Low68.7Low76 Ų7682.1 Ų82.136%0.35544%0.437SS..Hα-helixtrans-69.2-41.8179.6-156-164.8149.700110.6M1 N2 T3 I7 S8 Y9M1-E5 VanDerWaalsContact CA-OE2 3.28Å; M1-E5 WeakPolarHBondContact CA-OE2 3.44Å; N2-E5 VanDerWaalsContact O-CB 3.32Å; N2-E5 WeakPolarHBondContact O-CB 3.26Å; N2-E5 PolarHBondContact O-N 3.25Å; T3-E5 VanDerWaalsContact C-N 3.33Å; T3-E5 PolarHBondContact O-N 2.88Å; E5-I7 VanDerWaalsContact C-N 3.32Å; E5-I7 PolarHBondContact O-N 2.83Å; E5-S8 PolarHBondContact O-N 3.06Å; E5-Y9 HydrophobicContact CB-CE2 4.47Å; E5-Y9 HydrophobicContact CG-CD2 4.47Å; E5-Y9 HydrophobicContact CG-CE2 3.64Å; E5-Y9 WeakPolarHBondContact O-CD2 3.27Å; E5-Y9 PolarHBondContact O-N 3.22Å; E5-Y9 VanDerWaalsContact O-N 3.15Å; E5-Y9 WeakPolarHBondContact OE1-CE2 3.38Å; E5-Y9 PolarHBondContact OE1-OH 3.15Å
6Y70.9Confident68.4Low121 Ų12180.3 Ų80.348%0.47543%0.43SS..Hα-helixtrans-60.5-41.1173.7-80.5-85000112.6M1 N2 T3 Y9 L10M1-Y6 HydrophobicContact CB-CD2 4.28Å; M1-Y6 HydrophobicContact CB-CE2 3.52Å; M1-Y6 HydrophobicContact CE-CD1 3.32Å; M1-Y6 HydrophobicContact CE-CD2 4Å; M1-Y6 HydrophobicContact CE-CE1 3.03Å; M1-Y6 HydrophobicContact CE-CE2 3.77Å; M1-Y6 HydrophobicContact CE-CG 3.8Å; M1-Y6 HydrophobicContact CG-CD2 3.7Å; M1-Y6 HydrophobicContact CG-CE1 4.31Å; M1-Y6 HydrophobicContact CG-CE2 3.23Å; M1-Y6 HydrophobicContact CG-CG 4.42Å; M1-Y6 HydrophobicContact SD-CD1 4.37Å; M1-Y6 HydrophobicContact SD-CD2 4.31Å; M1-Y6 HydrophobicContact SD-CE1 3.65Å; M1-Y6 HydrophobicContact SD-CE2 3.58Å; M1-Y6 VanDerWaalsContact SD-CE2 3.58Å; M1-Y6 PolarHBondContact SD-OH 3.25Å; N2-Y6 WeakPolarHBondContact O-CD2 3.48Å; N2-Y6 PolarHBondContact O-N 2.64Å; T3-Y6 PolarHBondContact O-N 3.39Å; Y6-Y9 PolarHBondContact O-N 3.09Å; Y6-L10 WeakPolarHBondContact O-CG 3.29Å; Y6-L10 PolarHBondContact O-N 3.29Å; Y6-L10 VanDerWaalsContact O-N 3.17Å
7I70.1Confident67.9Low114 Ų11482.7 Ų82.759%0.58545%0.451SS*.Hα-helixtrans-66.1-41.3-180-67163.6000110.5T3 S4 E5 Y9 L10 D11T3-I7 WeakPolarHBondContact O-CD1 3.46Å; T3-I7 VanDerWaalsContact O-CG1 3.26Å; T3-I7 WeakPolarHBondContact O-CG1 3.04Å; T3-I7 PolarHBondContact O-N 3.05Å; T3-I7 VanDerWaalsContact O-N 3.1Å; S4-I7 PolarHBondContact O-N 2.91Å; E5-I7 VanDerWaalsContact C-N 3.32Å; E5-I7 PolarHBondContact O-N 2.83Å; I7-Y9 PolarHBondContact O-N 3.32Å; I7-L10 PolarHBondContact O-N 2.92Å; I7-L10 VanDerWaalsContact O-N 3.16Å; I7-D11 PolarHBondContact O-N 2.88Å; I7-D11 VanDerWaalsContact O-N 3.09Å
8S69.4Low67.5Low32 Ų3287.3 Ų87.322%0.22447%0.469CS..Hα-helixtrans-59.8-43.2174.2161.90000112.1S4 E5 L10 D11 V12 E26S4-S8 PolarHBondContact O-N 3.39Å; S4-S8 VanDerWaalsContact O-N 3.12Å; E5-S8 PolarHBondContact O-N 3.06Å; S8-L10 VanDerWaalsContact C-N 3.28Å; S8-L10 PolarHBondContact O-N 3.12Å; S8-D11 PolarHBondContact O-N 2.89Å; S8-D11 VanDerWaalsContact O-N 3.09Å; S8-V12 PolarHBondContact O-N 3.33Å; S8-E26 VanDerWaalsContact OG-CD 3.29Å; S8-E26 PolarHBondContact OG-OE1 2.91Å
9Y67Low67.4Low68 Ų6886.8 Ų86.827%0.26747%0.466SS..Hα-helixtrans-65.4-29.1176-64.6-56.5000114M1 E5 Y6 I7 D11 V12 Y29M1-Y9 HydrophobicContact CE-CD2 4.06Å; M1-Y9 HydrophobicContact CE-CE2 4.04Å; E5-Y9 HydrophobicContact CB-CE2 4.47Å; E5-Y9 HydrophobicContact CG-CD2 4.47Å; E5-Y9 HydrophobicContact CG-CE2 3.64Å; E5-Y9 WeakPolarHBondContact O-CD2 3.27Å; E5-Y9 PolarHBondContact O-N 3.22Å; E5-Y9 VanDerWaalsContact O-N 3.15Å; E5-Y9 WeakPolarHBondContact OE1-CE2 3.38Å; E5-Y9 PolarHBondContact OE1-OH 3.15Å; Y6-Y9 PolarHBondContact O-N 3.09Å; I7-Y9 PolarHBondContact O-N 3.32Å; Y9-D11 VanDerWaalsContact C-N 3.32Å; Y9-V12 WeakPolarHBondContact O-CB 3.32Å; Y9-V12 WeakPolarHBondContact O-CG2 3.26Å; Y9-Y29 AromaticContact CD1-CD2 3.78Å; Y9-Y29 HydrophobicContact CD1-CD2 3.78Å; Y9-Y29 HydrophobicContact CD1-CE2 4.11Å; Y9-Y29 HydrophobicContact CD1-CG 4.46Å; Y9-Y29 AromaticContact CE1-CD2 3.42Å; Y9-Y29 HydrophobicContact CE1-CD2 3.42Å; Y9-Y29 VanDerWaalsContact CE1-CD2 3.42Å; Y9-Y29 AromaticContact CE1-CE2 3.46Å; Y9-Y29 HydrophobicContact CE1-CE2 3.46Å; Y9-Y29 VanDerWaalsContact CE1-CE2 3.46Å; Y9-Y29 HydrophobicContact CE1-CG 4.48Å
10L68.2Low67.4Low141 Ų14186.1 Ų86.174%0.73847%0.466SS*.Hα-helixtrans-76.4-23.6175.4-70.1176.3000112.2Y6 I7 S8 V12 P13Y6-L10 WeakPolarHBondContact O-CG 3.29Å; Y6-L10 PolarHBondContact O-N 3.29Å; Y6-L10 VanDerWaalsContact O-N 3.17Å; I7-L10 PolarHBondContact O-N 2.92Å; I7-L10 VanDerWaalsContact O-N 3.16Å; S8-L10 VanDerWaalsContact C-N 3.28Å; S8-L10 PolarHBondContact O-N 3.12Å; L10-V12 VanDerWaalsContact C-N 3.29Å; L10-P13 WeakPolarHBondContact O-CD 3.17Å
11D71.4Confident67.7Low69 Ų6982.4 Ų82.437%0.36945%0.446SS..SBendtrans-88.44.6178.6-153.243.4000113.5I7 S8 Y9 P13 S14I7-D11 PolarHBondContact O-N 2.88Å; I7-D11 VanDerWaalsContact O-N 3.09Å; S8-D11 PolarHBondContact O-N 2.89Å; S8-D11 VanDerWaalsContact O-N 3.09Å; Y9-D11 VanDerWaalsContact C-N 3.32Å; D11-P13 VanDerWaalsContact O-N 3.15Å; D11-S14 VanDerWaalsContact CG-CB 3.43Å; D11-S14 WeakPolarHBondContact O-CA 3.34Å; D11-S14 WeakPolarHBondContact O-CB 3.46Å; D11-S14 PolarHBondContact O-N 2.91Å; D11-S14 VanDerWaalsContact OD1-CB 3.23Å; D11-S14 WeakPolarHBondContact OD1-CB 3.44Å; D11-S14 WeakPolarHBondContact OD2-CB 3.36Å
12V64.6Low68.7Low12 Ų1280.4 Ų80.47%0.07344%0.438CS..THydrogen-bonded Turntrans-51.2-32.7171.3170.50000113.3S8 Y9 L10 S14 Q30 F33S8-V12 PolarHBondContact O-N 3.33Å; Y9-V12 WeakPolarHBondContact O-CB 3.32Å; Y9-V12 WeakPolarHBondContact O-CG2 3.26Å; L10-V12 VanDerWaalsContact C-N 3.29Å; V12-S14 PolarHBondContact O-N 2.99Å; V12-Q30 VanDerWaalsContact C-OE1 3.24Å; V12-Q30 VanDerWaalsContact CG1-OE1 3.24Å; V12-Q30 PolarHBondContact O-NE2 3.45Å; V12-Q30 PolarHBondContact O-OE1 3.3Å; V12-F33 HydrophobicContact CG1-CB 3.8Å; V12-F33 HydrophobicContact CG1-CD1 4.32Å; V12-F33 HydrophobicContact CG1-CG 3.99Å
13P66.1Low69Low71 Ų7178.3 Ų78.346%0.46143%0.43SS..THydrogen-bonded Turntrans-71.6-13.6173.2-20.535.3000114L10 D11 F33L10-P13 WeakPolarHBondContact O-CD 3.17Å; D11-P13 VanDerWaalsContact O-N 3.15Å; P13-F33 HydrophobicContact CG-CZ 4.35Å
14S65.8Low69.4Low28 Ų2875.8 Ų75.820%0.19641%0.412CS..  trans-70.8133.1-176.1-166.80000111.4D11 V12 T16 Q30D11-S14 VanDerWaalsContact CG-CB 3.43Å; D11-S14 WeakPolarHBondContact O-CA 3.34Å; D11-S14 WeakPolarHBondContact O-CB 3.46Å; D11-S14 PolarHBondContact O-N 2.91Å; D11-S14 VanDerWaalsContact OD1-CB 3.23Å; D11-S14 WeakPolarHBondContact OD1-CB 3.44Å; D11-S14 WeakPolarHBondContact OD2-CB 3.36Å; V12-S14 PolarHBondContact O-N 2.99Å; S14-T16 WeakPolarHBondContact OG-CG2 3.29Å; S14-T16 PolarHBondContact OG-N 2.87Å; S14-T16 PolarHBondContact OG-OG1 3.34Å; S14-Q30 PolarHBondContact O-NE2 3.41Å
15L65Low70.1Confident74 Ų7474.4 Ų74.439%0.38740%0.402SS..  trans-107.614.6173.3-62.3174.3000110.2W34 F103L15-W34 HydrophobicContact CD2-CZ2 4.12Å; L15-W34 HydrophobicContact CG-CZ2 4.37Å; L15-F103 HydrophobicContact CD2-CB 3.79Å; L15-F103 HydrophobicContact CD2-CG 4.27Å
16T64.4Low70.8Confident53 Ų5372.1 Ų72.133%0.32539%0.392SS..  trans-62136.7-179.148.50000109.6S14 E18 D19S14-T16 WeakPolarHBondContact OG-CG2 3.29Å; S14-T16 PolarHBondContact OG-N 2.87Å; S14-T16 PolarHBondContact OG-OG1 3.34Å; T16-E18 PolarHBondContact O-N 3.47Å; T16-D19 PolarHBondContact OG1-OD2 2.95Å; T16-D19 VanDerWaalsContact OG1-OD2 3.08Å
17P59Low71.4Confident121 Ų12166.4 Ų66.479%0.78637%0.369SS*.THydrogen-bonded Turntrans-68-12.1173.7-14.628.2000113.1D19P17-D19 VanDerWaalsContact C-N 3.34Å
18E61Low72.2Confident165 Ų16563.5 Ų63.577%0.77135%0.351SS*.THydrogen-bonded Turntrans-79.8-17.6-168.6-59.5-171163.600112.9T16 P20T16-E18 PolarHBondContact O-N 3.47Å; E18-P20 WeakPolarHBondContact O-CD 3.46Å
19D65.3Low73Confident79 Ų7966.5 Ų66.542%0.42236%0.358SS..SBendtrans-11681.9-177.5-57.9-63.8000109.9T16 P17 L21T16-D19 PolarHBondContact OG1-OD2 2.95Å; T16-D19 VanDerWaalsContact OG1-OD2 3.08Å; P17-D19 VanDerWaalsContact C-N 3.34Å; D19-L21 PolarHBondContact O-N 2.97Å
20P67.9Low73.8Confident72 Ų7263.4 Ų63.447%0.46835%0.346SS..  trans-65.6123.3177.727.3-33.1000109.6E18 D22 V96E18-P20 WeakPolarHBondContact O-CD 3.46Å; P20-D22 PolarHBondContact O-N 3.14Å; P20-D22 VanDerWaalsContact O-N 3.1Å; P20-V96 HydrophobicContact CB-CB 4.28Å; P20-V96 HydrophobicContact CB-CG1 4.39Å
21L73.4Confident74.7Confident8 Ų856.7 Ų56.74%0.04231%0.311CS..BIsolated β-bridgetrans-67.8110.4175.1-52.1161.5000108.2D19 E26 I27 Q30 V96 M97 A102D19-L21 PolarHBondContact O-N 2.97Å; L21-E26 HydrophobicContact CD2-CB 4.18Å; L21-E26 HydrophobicContact CD2-CG 3.48Å; L21-E26 VanDerWaalsContact CD2-CG 3.48Å; L21-I27 HydrophobicContact CB-CD1 4.42Å; L21-I27 HydrophobicContact CB-CG1 3.47Å; L21-I27 VanDerWaalsContact CB-CG1 3.47Å; L21-I27 HydrophobicContact CD1-CG1 4.36Å; L21-Q30 HydrophobicContact CD1-CB 4.1Å; L21-Q30 HydrophobicContact CD1-CG 3.93Å; L21-Q30 HydrophobicContact CD2-CB 4.47Å; L21-V96 WeakPolarHBondContact O-CA 3.3Å; L21-M97 VanDerWaalsContact CB-O 3.26Å; L21-M97 WeakPolarHBondContact CB-O 3.23Å; L21-M97 HydrophobicContact CD1-CE 4.36Å; L21-M97 WeakPolarHBondContact CD1-O 3.44Å; L21-M97 WeakPolarHBondContact CG-O 3.44Å; L21-M97 PolarHBondContact N-O 2.92Å; L21-M97 PolarHBondContact O-N 3.33Å; L21-A102 HydrophobicContact CD1-CB 4.05Å
22D78.9Confident75.6Confident95 Ų9554.6 Ų54.651%0.50830%0.299SS..  trans-115.2-10.1-173.372.2-11.4000113.4P20 L91 V96P20-D22 PolarHBondContact O-N 3.14Å; P20-D22 VanDerWaalsContact O-N 3.1Å; D22-L91 VanDerWaalsContact O-CD1 3.24Å; D22-L91 WeakPolarHBondContact O-CD1 3.24Å; D22-V96 HydrophobicContact CB-CG1 4.26Å
23T83.3Confident76.7Confident66 Ų6657.6 Ų57.641%0.40531%0.311SS..SBendtrans-108.7150.1175.268.80000112.7S25 E26 I27T23-S25 VanDerWaalsContact C-N 3.27Å; T23-S25 PolarHBondContact O-N 2.75Å; T23-E26 PolarHBondContact O-N 3.41Å; T23-E26 VanDerWaalsContact OG1-CB 3.25Å; T23-E26 WeakPolarHBondContact OG1-CB 3.37Å; T23-E26 PolarHBondContact OG1-N 3.45Å; T23-I27 WeakPolarHBondContact O-CG1 3.43Å; T23-I27 PolarHBondContact O-N 2.9Å; T23-I27 VanDerWaalsContact O-N 3.12Å
24L85.8Confident77.7Confident54 Ų5456.1 Ų56.128%0.28330%0.297SS..Hα-helixtrans-57-43.7176.9-174.8147.5000111.5W28 A87 W88 L91L24-W28 HydrophobicContact CD2-CE3 4.41Å; L24-W28 WeakPolarHBondContact O-CB 3.22Å; L24-W28 PolarHBondContact O-N 3.16Å; L24-A87 HydrophobicContact CG-CB 4.48Å; L24-W88 HydrophobicContact CD1-CB 4.14Å; L24-W88 HydrophobicContact CD1-CG 4.44Å; L24-L91 HydrophobicContact CB-CD2 3.88Å
25S85.7Confident78.8Confident44 Ų4455 Ų5531%0.30829%0.289SS..Hα-helixtrans-62-47.2-178.9-59.10000111.2T23 W28 Y29T23-S25 VanDerWaalsContact C-N 3.27Å; T23-S25 PolarHBondContact O-N 2.75Å; S25-W28 PolarHBondContact O-N 2.91Å; S25-Y29 WeakPolarHBondContact O-CB 3.49Å; S25-Y29 WeakPolarHBondContact O-CD2 3.02Å; S25-Y29 PolarHBondContact O-N 2.94Å
26E82.7Confident79.9Confident28 Ų2854 Ų5413%0.13128%0.284CS..Hα-helixtrans-64.7-47.2-177.8-154.9-178.3-162.800111.6S8 L21 T23 W28 Y29 Q30S8-E26 VanDerWaalsContact OG-CD 3.29Å; S8-E26 PolarHBondContact OG-OE1 2.91Å; L21-E26 HydrophobicContact CD2-CB 4.18Å; L21-E26 HydrophobicContact CD2-CG 3.48Å; L21-E26 VanDerWaalsContact CD2-CG 3.48Å; T23-E26 PolarHBondContact O-N 3.41Å; T23-E26 VanDerWaalsContact OG1-CB 3.25Å; T23-E26 WeakPolarHBondContact OG1-CB 3.37Å; T23-E26 PolarHBondContact OG1-N 3.45Å; E26-W28 VanDerWaalsContact C-N 3.32Å; E26-W28 PolarHBondContact O-N 3.25Å; E26-Y29 PolarHBondContact O-N 3.19Å; E26-Q30 VanDerWaalsContact O-CB 3.29Å; E26-Q30 WeakPolarHBondContact O-CB 3.41Å; E26-Q30 PolarHBondContact O-N 2.88Å
27I84.9Confident81.1Confident0 Ų054 Ų540%028%0.283CS..Hα-helixtrans-59-45.4174.6-63170.4000110.8L21 T23 Q30 I31 A87 L91 M97L21-I27 HydrophobicContact CB-CD1 4.42Å; L21-I27 HydrophobicContact CB-CG1 3.47Å; L21-I27 VanDerWaalsContact CB-CG1 3.47Å; L21-I27 HydrophobicContact CD1-CG1 4.36Å; T23-I27 WeakPolarHBondContact O-CG1 3.43Å; T23-I27 PolarHBondContact O-N 2.9Å; T23-I27 VanDerWaalsContact O-N 3.12Å; I27-Q30 WeakPolarHBondContact O-CB 3.23Å; I27-Q30 PolarHBondContact O-N 3.28Å; I27-I31 HydrophobicContact CG2-CD1 3.75Å; I27-I31 HydrophobicContact CG2-CG1 4.4Å; I27-I31 VanDerWaalsContact O-CG1 3.27Å; I27-I31 WeakPolarHBondContact O-CG1 3.4Å; I27-I31 PolarHBondContact O-N 3.2Å; I27-A87 HydrophobicContact CB-CB 3.93Å; I27-A87 HydrophobicContact CG2-CB 3.59Å; I27-L91 HydrophobicContact CD1-CB 4.38Å; I27-L91 HydrophobicContact CD1-CD1 4.38Å; I27-M97 HydrophobicContact CD1-CB 4.14Å; I27-M97 HydrophobicContact CG1-CB 4.32Å; I27-M97 HydrophobicContact CG2-CE 3.52Å; I27-M97 HydrophobicContact CG2-SD 4.24Å
28W86.5Confident82.5Confident53 Ų5349 Ų4920%0.20125%0.251CS..Hα-helixtrans-63.4-49.3-179.3167.130.6000111.8L24 S25 E26 Q30 I31 L32 N80 V84 A87L24-W28 HydrophobicContact CD2-CE3 4.41Å; L24-W28 WeakPolarHBondContact O-CB 3.22Å; L24-W28 PolarHBondContact O-N 3.16Å; S25-W28 PolarHBondContact O-N 2.91Å; E26-W28 VanDerWaalsContact C-N 3.32Å; E26-W28 PolarHBondContact O-N 3.25Å; W28-Q30 VanDerWaalsContact C-N 3.3Å; W28-Q30 PolarHBondContact O-N 3.49Å; W28-I31 PolarHBondContact O-N 3.44Å; W28-L32 VanDerWaalsContact O-CB 3.25Å; W28-L32 WeakPolarHBondContact O-CB 3.12Å; W28-L32 PolarHBondContact O-N 3.32Å; W28-N80 VanDerWaalsContact CE2-OD1 3.23Å; W28-N80 WeakPolarHBondContact CZ2-OD1 3.18Å; W28-N80 PolarHBondContact NE1-OD1 3.43Å; W28-V84 HydrophobicContact CD2-CG2 3.47Å; W28-V84 VanDerWaalsContact CD2-CG2 3.47Å; W28-V84 HydrophobicContact CE3-CG2 4.08Å; W28-V84 HydrophobicContact CG-CG2 3.76Å; W28-V84 HydrophobicContact CH2-CG2 4.26Å; W28-V84 HydrophobicContact CZ2-CG2 3.68Å; W28-V84 HydrophobicContact CZ3-CG2 4.44Å; W28-A87 HydrophobicContact CB-CB 3.85Å
29Y85.3Confident83.9Confident96 Ų9641.5 Ų41.538%0.37622%0.217SC..Hα-helixtrans-62.5-39178.5-77.4-62000111.6Y9 S25 E26 L32 F33Y9-Y29 AromaticContact CD1-CD2 3.78Å; Y9-Y29 HydrophobicContact CD1-CD2 3.78Å; Y9-Y29 HydrophobicContact CD1-CE2 4.11Å; Y9-Y29 HydrophobicContact CD1-CG 4.46Å; Y9-Y29 AromaticContact CE1-CD2 3.42Å; Y9-Y29 HydrophobicContact CE1-CD2 3.42Å; Y9-Y29 VanDerWaalsContact CE1-CD2 3.42Å; Y9-Y29 AromaticContact CE1-CE2 3.46Å; Y9-Y29 HydrophobicContact CE1-CE2 3.46Å; Y9-Y29 VanDerWaalsContact CE1-CE2 3.46Å; Y9-Y29 HydrophobicContact CE1-CG 4.48Å; S25-Y29 WeakPolarHBondContact O-CB 3.49Å; S25-Y29 WeakPolarHBondContact O-CD2 3.02Å; S25-Y29 PolarHBondContact O-N 2.94Å; E26-Y29 PolarHBondContact O-N 3.19Å; Y29-L32 PolarHBondContact O-N 2.94Å; Y29-F33 WeakPolarHBondContact O-CB 3.44Å; Y29-F33 PolarHBondContact O-N 3.37Å
30Q85.7Confident85Confident2 Ų239.6 Ų39.61%0.00921%0.208CC..Hα-helixtrans-57.4-54.2174-164723.900111.9V12 S14 L21 E26 I27 W28 F33 W34 A102V12-Q30 VanDerWaalsContact C-OE1 3.24Å; V12-Q30 VanDerWaalsContact CG1-OE1 3.24Å; V12-Q30 PolarHBondContact O-NE2 3.45Å; V12-Q30 PolarHBondContact O-OE1 3.3Å; S14-Q30 PolarHBondContact O-NE2 3.41Å; L21-Q30 HydrophobicContact CD1-CB 4.1Å; L21-Q30 HydrophobicContact CD1-CG 3.93Å; L21-Q30 HydrophobicContact CD2-CB 4.47Å; E26-Q30 VanDerWaalsContact O-CB 3.29Å; E26-Q30 WeakPolarHBondContact O-CB 3.41Å; E26-Q30 PolarHBondContact O-N 2.88Å; I27-Q30 WeakPolarHBondContact O-CB 3.23Å; I27-Q30 PolarHBondContact O-N 3.28Å; W28-Q30 VanDerWaalsContact C-N 3.3Å; W28-Q30 PolarHBondContact O-N 3.49Å; Q30-F33 PolarHBondContact O-N 3.07Å; Q30-W34 PolarHBondContact O-N 2.79Å; Q30-A102 HydrophobicContact CB-CB 3.77Å; Q30-A102 HydrophobicContact CG-CB 3.21Å
31I87Confident86.1Confident1 Ų141.4 Ų41.41%0.00521%0.213CC..Hα-helixtrans-62.9-48.1179.7-61.2166.6000109.4I27 W28 F33 W34 V35 S83 F86 M97 A102 A105I27-I31 HydrophobicContact CG2-CD1 3.75Å; I27-I31 HydrophobicContact CG2-CG1 4.4Å; I27-I31 VanDerWaalsContact O-CG1 3.27Å; I27-I31 WeakPolarHBondContact O-CG1 3.4Å; I27-I31 PolarHBondContact O-N 3.2Å; W28-I31 PolarHBondContact O-N 3.44Å; I31-F33 VanDerWaalsContact C-N 3.31Å; I31-F33 PolarHBondContact O-N 3.36Å; I31-W34 PolarHBondContact O-N 3.27Å; I31-V35 HydrophobicContact CG2-CG2 4.04Å; I31-V35 WeakPolarHBondContact O-CG2 3.39Å; I31-V35 PolarHBondContact O-N 3.45Å; I31-S83 WeakPolarHBondContact CG2-OG 3.24Å; I31-F86 HydrophobicContact CD1-CB 4.01Å; I31-M97 HydrophobicContact CD1-CE 4.17Å; I31-M97 HydrophobicContact CG1-CE 4.28Å; I31-A102 HydrophobicContact CG1-CB 3.9Å; I31-A105 HydrophobicContact CG1-CB 4.46Å
32L89Confident86.8Confident24 Ų2443.8 Ų43.813%0.12623%0.228CC..Hα-helixtrans-58.7-42.1-179-178.362000112.3W28 Y29 V35 L36 N80W28-L32 VanDerWaalsContact O-CB 3.25Å; W28-L32 WeakPolarHBondContact O-CB 3.12Å; W28-L32 PolarHBondContact O-N 3.32Å; Y29-L32 PolarHBondContact O-N 2.94Å; L32-V35 PolarHBondContact O-N 3.46Å; L32-L36 WeakPolarHBondContact O-CB 3.05Å; L32-L36 PolarHBondContact O-N 2.94Å; L32-N80 HydrophobicContact CD1-CB 4.27Å
33F87.7Confident87.2Confident75 Ų7541 Ų4133%0.32921%0.212SC..Hα-helixtrans-59-50.4176.2178.2-100.1000110.9V12 P13 Y29 Q30 I31 V35 L36 V37V12-F33 HydrophobicContact CG1-CB 3.8Å; V12-F33 HydrophobicContact CG1-CD1 4.32Å; V12-F33 HydrophobicContact CG1-CG 3.99Å; P13-F33 HydrophobicContact CG-CZ 4.35Å; Y29-F33 WeakPolarHBondContact O-CB 3.44Å; Y29-F33 PolarHBondContact O-N 3.37Å; Q30-F33 PolarHBondContact O-N 3.07Å; I31-F33 VanDerWaalsContact C-N 3.31Å; I31-F33 PolarHBondContact O-N 3.36Å; F33-V35 PolarHBondContact O-N 3.01Å; F33-L36 WeakPolarHBondContact O-CB 3.2Å; F33-L36 PolarHBondContact O-N 3.14Å; F33-V37 HydrophobicContact CD1-CG2 4.34Å; F33-V37 HydrophobicContact CE1-CG2 3.98Å; F33-V37 HydrophobicContact CE2-CG2 4.29Å; F33-V37 HydrophobicContact CZ-CG2 3.95Å; F33-V37 WeakPolarHBondContact O-CG2 3.32Å; F33-V37 PolarHBondContact O-N 3.18Å
34W87.1Confident87.5Confident41 Ų4139.6 Ų39.616%0.15521%0.205CC..Hα-helixtrans-70.3-30.7-179.9-68.7117.2000113.5L15 Q30 I31 V37 S38 F103L15-W34 HydrophobicContact CD2-CZ2 4.12Å; L15-W34 HydrophobicContact CG-CZ2 4.37Å; Q30-W34 PolarHBondContact O-N 2.79Å; I31-W34 PolarHBondContact O-N 3.27Å; W34-V37 HydrophobicContact CE3-CB 4.34Å; W34-V37 HydrophobicContact CE3-CG1 4.39Å; W34-V37 HydrophobicContact CZ3-CG1 4.43Å; W34-S38 VanDerWaalsContact O-CB 3.29Å; W34-S38 WeakPolarHBondContact O-CB 3.3Å; W34-S38 PolarHBondContact O-N 3.48Å; W34-S38 PolarHBondContact O-OG 3.26Å; W34-F103 HydrophobicContact CD2-CB 4.43Å; W34-F103 AromaticContact CD2-CD2 3.49Å; W34-F103 HydrophobicContact CD2-CD2 3.49Å; W34-F103 VanDerWaalsContact CD2-CD2 3.49Å; W34-F103 HydrophobicContact CD2-CE2 4.25Å; W34-F103 HydrophobicContact CD2-CG 4.45Å; W34-F103 AromaticContact CE2-CD2 3.76Å; W34-F103 AromaticContact CE3-CD2 3.57Å; W34-F103 HydrophobicContact CE3-CD2 3.57Å; W34-F103 AromaticContact CE3-CE2 3.85Å; W34-F103 HydrophobicContact CE3-CE2 3.85Å; W34-F103 HydrophobicContact CG-CB 4.22Å; W34-F103 AromaticContact CG-CD2 3.93Å; W34-F103 HydrophobicContact CG-CD2 3.93Å; W34-F103 HydrophobicContact CH2-CD2 4.16Å; W34-F103 HydrophobicContact CH2-CE2 4.33Å; W34-F103 HydrophobicContact CZ2-CD2 4.1Å; W34-F103 AromaticContact CZ3-CD2 3.91Å; W34-F103 HydrophobicContact CZ3-CD2 3.91Å; W34-F103 AromaticContact CZ3-CE2 3.89Å; W34-F103 HydrophobicContact CZ3-CE2 3.89Å
35V88.8Confident87.6Confident4 Ų441.6 Ų41.62%0.02422%0.219CC..Hα-helixtrans-63-44.4169.1176.10000110.4I31 L32 F33 S38 S39 P75 G106 Q109 T110I31-V35 HydrophobicContact CG2-CG2 4.04Å; I31-V35 WeakPolarHBondContact O-CG2 3.39Å; I31-V35 PolarHBondContact O-N 3.45Å; L32-V35 PolarHBondContact O-N 3.46Å; F33-V35 PolarHBondContact O-N 3.01Å; V35-S38 WeakPolarHBondContact CA-OG 3.29Å; V35-S38 PolarHBondContact O-OG 3.24Å; V35-S38 VanDerWaalsContact O-OG 3.07Å; V35-S39 WeakPolarHBondContact O-CB 3.29Å; V35-S39 PolarHBondContact O-N 3.44Å; V35-P75 HydrophobicContact CG1-CB 4Å; V35-P75 HydrophobicContact CG1-CG 4.39Å; V35-G106 VanDerWaalsContact CG2-CA 3.45Å; V35-Q109 HydrophobicContact CG2-CB 4.16Å; V35-Q109 HydrophobicContact CG2-CG 4.24Å; V35-T110 PolarHBondContact O-OG1 3.36Å
36L88.9Confident87.7Confident54 Ų5441.5 Ų41.528%0.28322%0.221SC..Hα-helixtrans-64.3-48.6178.9-175.766.1000111.1L32 F33 S39 V40 V72 P75L32-L36 WeakPolarHBondContact O-CB 3.05Å; L32-L36 PolarHBondContact O-N 2.94Å; F33-L36 WeakPolarHBondContact O-CB 3.2Å; F33-L36 PolarHBondContact O-N 3.14Å; L36-S39 PolarHBondContact O-N 3.08Å; L36-V40 HydrophobicContact CD1-CG2 4.36Å; L36-V40 WeakPolarHBondContact O-CB 3.17Å; L36-V40 VanDerWaalsContact O-CG2 3.23Å; L36-V40 WeakPolarHBondContact O-CG2 3.22Å; L36-V40 PolarHBondContact O-N 3.42Å; L36-V72 HydrophobicContact CD1-CG1 4.31Å; L36-P75 HydrophobicContact CD1-CB 4.12Å
37V88.8Confident87.9Confident51 Ų5140.8 Ų40.831%0.30922%0.22SC..Hα-helixtrans-59.4-50.8178.5171.70000110.8F33 W34 S39 V40 L41F33-V37 HydrophobicContact CD1-CG2 4.34Å; F33-V37 HydrophobicContact CE1-CG2 3.98Å; F33-V37 HydrophobicContact CE2-CG2 4.29Å; F33-V37 HydrophobicContact CZ-CG2 3.95Å; F33-V37 WeakPolarHBondContact O-CG2 3.32Å; F33-V37 PolarHBondContact O-N 3.18Å; W34-V37 HydrophobicContact CE3-CB 4.34Å; W34-V37 HydrophobicContact CE3-CG1 4.39Å; W34-V37 HydrophobicContact CZ3-CG1 4.43Å; V37-S39 PolarHBondContact O-N 3.14Å; V37-V40 PolarHBondContact O-N 3.18Å; V37-L41 HydrophobicContact CG1-CD1 4.24Å; V37-L41 WeakPolarHBondContact O-CG 3.09Å; V37-L41 PolarHBondContact O-N 2.87Å
38S89.9Confident87.9Confident16 Ų1643.7 Ų43.711%0.11224%0.24CC..Hα-helixtrans-63.4-41.3-179.954.80000112.3W34 V35 L41 V42 T110W34-S38 VanDerWaalsContact O-CB 3.29Å; W34-S38 WeakPolarHBondContact O-CB 3.3Å; W34-S38 PolarHBondContact O-N 3.48Å; W34-S38 PolarHBondContact O-OG 3.26Å; V35-S38 WeakPolarHBondContact CA-OG 3.29Å; V35-S38 PolarHBondContact O-OG 3.24Å; V35-S38 VanDerWaalsContact O-OG 3.07Å; S38-L41 PolarHBondContact O-N 3.12Å; S38-V42 WeakPolarHBondContact O-CG2 3.36Å; S38-V42 PolarHBondContact O-N 3.08Å; S38-T110 VanDerWaalsContact OG-CB 3.3Å; S38-T110 WeakPolarHBondContact OG-CB 3.26Å; S38-T110 PolarHBondContact OG-OG1 3.47Å
39S89.1Confident87.9Confident8 Ų844.9 Ų44.96%0.05625%0.253CS..Hα-helixtrans-65.4-43.4177.8-177.40000112.1V35 L36 V37 L41 V42 H43 G71 P75V35-S39 WeakPolarHBondContact O-CB 3.29Å; V35-S39 PolarHBondContact O-N 3.44Å; L36-S39 PolarHBondContact O-N 3.08Å; V37-S39 PolarHBondContact O-N 3.14Å; S39-L41 VanDerWaalsContact C-N 3.3Å; S39-L41 PolarHBondContact O-N 3.45Å; S39-V42 PolarHBondContact O-N 3.5Å; S39-H43 WeakPolarHBondContact O-CB 3.4Å; S39-H43 PolarHBondContact O-N 2.82Å; S39-H43 PolarHBondContact O-ND1 2.81Å; S39-H43 PolarHBondContact OG-CE1 2.75Å; S39-H43 PolarHBondContact OG-ND1 3.44Å; S39-G71 WeakPolarHBondContact CB-O 3.32Å; S39-G71 PolarHBondContact OG-O 3.32Å; S39-P75 VanDerWaalsContact OG-CG 3.23Å; S39-P75 WeakPolarHBondContact OG-CG 3.19Å
40V89.1Confident87.9Confident40 Ų4041 Ų4124%0.24224%0.241CC..Hα-helixtrans-60.1-41.7175.6167.80000110.7L36 V37 H43 S44 M68 V72L36-V40 HydrophobicContact CD1-CG2 4.36Å; L36-V40 WeakPolarHBondContact O-CB 3.17Å; L36-V40 VanDerWaalsContact O-CG2 3.23Å; L36-V40 WeakPolarHBondContact O-CG2 3.22Å; L36-V40 PolarHBondContact O-N 3.42Å; V37-V40 PolarHBondContact O-N 3.18Å; V40-H43 PolarHBondContact O-N 3.49Å; V40-S44 WeakPolarHBondContact O-CB 3.42Å; V40-S44 PolarHBondContact O-N 2.86Å; V40-S44 PolarHBondContact O-OG 3.01Å; V40-M68 HydrophobicContact CG1-CE 3.87Å; V40-V72 HydrophobicContact CG2-CG2 3.94Å
41L90.1Very high87.9Confident110 Ų11045.7 Ų45.758%0.57626%0.261SS*.Hα-helixtrans-62-48.7176.2-70.7174.3000111.8V37 S38 S39 H43 S44 V45V37-L41 HydrophobicContact CG1-CD1 4.24Å; V37-L41 WeakPolarHBondContact O-CG 3.09Å; V37-L41 PolarHBondContact O-N 2.87Å; S38-L41 PolarHBondContact O-N 3.12Å; S39-L41 VanDerWaalsContact C-N 3.3Å; S39-L41 PolarHBondContact O-N 3.45Å; L41-H43 PolarHBondContact O-N 3.34Å; L41-S44 PolarHBondContact O-N 3.41Å; L41-V45 WeakPolarHBondContact O-CG2 3.42Å; L41-V45 PolarHBondContact O-N 3.23Å; L41-V45 VanDerWaalsContact O-N 3.08Å
42V88.9Confident87.7Confident57 Ų5753.8 Ų53.835%0.34529%0.293SS..Hα-helixtrans-59.1-46.9178.3170.90000111.2S38 S39 V45 A46 T110 T114S38-V42 WeakPolarHBondContact O-CG2 3.36Å; S38-V42 PolarHBondContact O-N 3.08Å; S39-V42 PolarHBondContact O-N 3.5Å; V42-V45 PolarHBondContact O-N 3.13Å; V42-A46 PolarHBondContact O-N 3.26Å; V42-T110 HydrophobicContact CG2-CG2 4.16Å; V42-T114 HydrophobicContact CG1-CG2 4.15Å
43H87.9Confident87.3Confident36 Ų3659.6 Ų59.617%0.16732%0.321CS..Hα-helixtrans-73.4-27.6-179.1-69.781.2000112.6S39 V40 L41 A46 A47 I67 G71S39-H43 WeakPolarHBondContact O-CB 3.4Å; S39-H43 PolarHBondContact O-N 2.82Å; S39-H43 PolarHBondContact O-ND1 2.81Å; S39-H43 PolarHBondContact OG-CE1 2.75Å; S39-H43 PolarHBondContact OG-ND1 3.44Å; V40-H43 PolarHBondContact O-N 3.49Å; L41-H43 PolarHBondContact O-N 3.34Å; H43-A46 PolarHBondContact O-N 2.88Å; H43-A47 WeakPolarHBondContact O-CB 3.49Å; H43-A47 PolarHBondContact O-N 2.9Å; H43-I67 HydrophobicContact CB-CG2 4.28Å; H43-I67 PolarHBondContact CD2-O 3.39Å; H43-G71 WeakPolarHBondContact CD2-CA 3.47Å; H43-G71 PolarHBondContact CD2-N 3.22Å; H43-G71 VanDerWaalsContact CE1-CA 3.41Å; H43-G71 WeakPolarHBondContact CE1-CA 3.23Å; H43-G71 WeakPolarHBondContact ND1-CA 3.4Å
44S87.7Confident86.7Confident38 Ų3857.6 Ų57.627%0.26631%0.314SS..Hα-helixtrans-65.6-41.2172.1-63.30000111.4V40 L41 S48 M68V40-S44 WeakPolarHBondContact O-CB 3.42Å; V40-S44 PolarHBondContact O-N 2.86Å; V40-S44 PolarHBondContact O-OG 3.01Å; L41-S44 PolarHBondContact O-N 3.41Å; S44-S48 WeakPolarHBondContact O-CB 3.46Å; S44-S48 PolarHBondContact O-N 3.42Å; S44-S48 PolarHBondContact O-OG 3.41Å; S44-M68 WeakPolarHBondContact OG-CE 3.38Å
45V88.7Confident86Confident96 Ų9663.1 Ų63.158%0.58234%0.339SS*.Hα-helixtrans-64.2-48.1173.5175.20000110L41 V42 A47 S48 V49L41-V45 WeakPolarHBondContact O-CG2 3.42Å; L41-V45 PolarHBondContact O-N 3.23Å; L41-V45 VanDerWaalsContact O-N 3.08Å; V42-V45 PolarHBondContact O-N 3.13Å; V45-A47 PolarHBondContact O-N 3.34Å; V45-S48 WeakPolarHBondContact O-CB 3.21Å; V45-S48 PolarHBondContact O-N 2.99Å; V45-V49 WeakPolarHBondContact O-CG2 3.23Å; V45-V49 PolarHBondContact O-N 3.49Å
46A87.5Confident85.2Confident41 Ų4167.9 Ų67.934%0.33937%0.372SS..Hα-helixtrans-61.1-42.8177.900000112.5V42 H43 S48 V49 A50 I67V42-A46 PolarHBondContact O-N 3.26Å; H43-A46 PolarHBondContact O-N 2.88Å; A46-S48 VanDerWaalsContact C-N 3.35Å; A46-V49 PolarHBondContact O-N 3.45Å; A46-A50 VanDerWaalsContact O-CB 3.29Å; A46-A50 WeakPolarHBondContact O-CB 3.22Å; A46-A50 PolarHBondContact O-N 2.93Å; A46-I67 HydrophobicContact CB-CG2 3.89Å
47A86.4Confident84.3Confident14 Ų1470.9 Ų70.912%0.11639%0.385CS..Hα-helixtrans-65.6-37.6176.500000111.7H43 V45 A50 F51 A64 I67H43-A47 WeakPolarHBondContact O-CB 3.49Å; H43-A47 PolarHBondContact O-N 2.9Å; V45-A47 PolarHBondContact O-N 3.34Å; A47-A50 PolarHBondContact O-N 3.25Å; A47-F51 VanDerWaalsContact O-CB 3.22Å; A47-F51 WeakPolarHBondContact O-CB 3.17Å; A47-F51 PolarHBondContact O-N 3.13Å; A47-A64 HydrophobicContact CB-CB 4.31Å; A47-I67 HydrophobicContact CB-CG2 4.28Å
48S86.3Confident83.3Confident61 Ų6176.8 Ų76.843%0.42741%0.406SS..Hα-helixtrans-64.2-49.5174.6-60.20000110.9S44 V45 A46 A50 F51 Y52S44-S48 WeakPolarHBondContact O-CB 3.46Å; S44-S48 PolarHBondContact O-N 3.42Å; S44-S48 PolarHBondContact O-OG 3.41Å; V45-S48 WeakPolarHBondContact O-CB 3.21Å; V45-S48 PolarHBondContact O-N 2.99Å; A46-S48 VanDerWaalsContact C-N 3.35Å; S48-A50 VanDerWaalsContact C-N 3.35Å; S48-A50 PolarHBondContact O-N 2.74Å; S48-F51 WeakPolarHBondContact O-CB 3.37Å; S48-F51 PolarHBondContact O-N 2.89Å; S48-Y52 WeakPolarHBondContact O-CD2 3.46Å; S48-Y52 PolarHBondContact O-N 3.34Å
49V86.7Confident82.2Confident77 Ų7781.2 Ų81.247%0.46743%0.433SS..Hα-helixtrans-58.1-47.6175.9173.10000110.7V45 A46 F51 Y52 M53V45-V49 WeakPolarHBondContact O-CG2 3.23Å; V45-V49 PolarHBondContact O-N 3.49Å; A46-V49 PolarHBondContact O-N 3.45Å; V49-F51 VanDerWaalsContact C-N 3.34Å; V49-F51 PolarHBondContact O-N 2.9Å; V49-Y52 PolarHBondContact O-N 2.84Å; V49-M53 HydrophobicContact CG1-CG 4.45Å; V49-M53 HydrophobicContact CG1-SD 3.94Å; V49-M53 WeakPolarHBondContact O-CG 3.49Å; V49-M53 PolarHBondContact O-N 3.13Å
50A85.4Confident81Confident15 Ų1583.8 Ų83.812%0.12445%0.445CS..Hα-helixtrans-58.7-45.417600000111.2A46 A47 S48 Y52 M53 L54 I67A46-A50 VanDerWaalsContact O-CB 3.29Å; A46-A50 WeakPolarHBondContact O-CB 3.22Å; A46-A50 PolarHBondContact O-N 2.93Å; A47-A50 PolarHBondContact O-N 3.25Å; S48-A50 VanDerWaalsContact C-N 3.35Å; S48-A50 PolarHBondContact O-N 2.74Å; A50-Y52 PolarHBondContact O-N 3.28Å; A50-M53 PolarHBondContact O-N 2.92Å; A50-L54 WeakPolarHBondContact O-CB 3.33Å; A50-L54 PolarHBondContact O-N 3.25Å; A50-I67 HydrophobicContact CB-CD1 3.71Å
51F84.4Confident80.1Confident100 Ų10088.4 Ų88.444%0.43946%0.458SS..Hα-helixtrans-61.7-43.1177.8-173.3-94.3000112.3A47 S48 V49 L54 K55 R61 A64A47-F51 VanDerWaalsContact O-CB 3.22Å; A47-F51 WeakPolarHBondContact O-CB 3.17Å; A47-F51 PolarHBondContact O-N 3.13Å; S48-F51 WeakPolarHBondContact O-CB 3.37Å; S48-F51 PolarHBondContact O-N 2.89Å; V49-F51 VanDerWaalsContact C-N 3.34Å; V49-F51 PolarHBondContact O-N 2.9Å; F51-L54 PolarHBondContact O-N 3.27Å; F51-K55 PolarHBondContact O-N 2.66Å; F51-R61 HydrophobicContact CE2-CG 4.23Å; F51-A64 HydrophobicContact CB-CB 4.47Å
52Y83.2Confident79.7Confident172 Ų17291.9 Ų91.968%0.67546%0.463SS*.Hα-helixtrans-64.1-42.3176.5-78.2-65.5000112.4S48 V49 A50 K55S48-Y52 WeakPolarHBondContact O-CD2 3.46Å; S48-Y52 PolarHBondContact O-N 3.34Å; V49-Y52 PolarHBondContact O-N 2.84Å; A50-Y52 PolarHBondContact O-N 3.28Å; Y52-K55 WeakPolarHBondContact O-CG 3.26Å
53M81.4Confident79.3Confident145 Ų14595.8 Ų95.871%0.71447%0.473SS*.Hα-helixtrans-69.8-36178.2-68.4-178.583.400112.1V49 A50V49-M53 HydrophobicContact CG1-CG 4.45Å; V49-M53 HydrophobicContact CG1-SD 3.94Å; V49-M53 WeakPolarHBondContact O-CG 3.49Å; V49-M53 PolarHBondContact O-N 3.13Å; A50-M53 PolarHBondContact O-N 2.92Å
54L73.6Confident78.9Confident34 Ų3494.7 Ų94.718%0.17847%0.47CS..Hα-helixtrans-96.54.9-173.9-80.742.3000113.6A50 F51 S56 H57 M60A50-L54 WeakPolarHBondContact O-CB 3.33Å; A50-L54 PolarHBondContact O-N 3.25Å; F51-L54 PolarHBondContact O-N 3.27Å; L54-S56 PolarHBondContact O-N 3.49Å; L54-H57 PolarHBondContact O-N 3.27Å; L54-M60 HydrophobicContact CB-CB 3.63Å; L54-M60 HydrophobicContact CD1-CE 4.04Å; L54-M60 HydrophobicContact CD2-CB 3.6Å; L54-M60 HydrophobicContact CD2-CE 3.73Å; L54-M60 HydrophobicContact CD2-CG 4.36Å; L54-M60 HydrophobicContact CD2-SD 4.46Å; L54-M60 HydrophobicContact CG-CB 3.54Å; L54-M60 HydrophobicContact CG-CE 3.58Å; L54-M60 HydrophobicContact CG-CG 4.09Å
55K73Confident78.7Confident156 Ų15697.6 Ų97.668%0.67848%0.482SS*.THydrogen-bonded Turntrans-51.4-26.8-176.571-178.4-179.4-179.30114.2F51 Y52F51-K55 PolarHBondContact O-N 2.66Å; Y52-K55 WeakPolarHBondContact O-CG 3.26Å
56S72.5Confident78.6Confident104 Ų10495.2 Ų95.273%0.72747%0.472SS*.THydrogen-bonded Turntrans-75.9-21.6179.8-1590000113.9L54L54-S56 PolarHBondContact O-N 3.49Å
57H69.9Low78.5Confident117 Ų11795.7 Ų95.754%0.54247%0.469SS..  trans-111.9106.9-174.4-66.7-73.3000111.1L54 T59 M60L54-H57 PolarHBondContact O-N 3.27Å; H57-T59 PolarHBondContact O-N 3.1Å; H57-T59 VanDerWaalsContact O-N 3.12Å; H57-M60 HydrophobicContact CB-CB 3.86Å; H57-M60 HydrophobicContact CB-CG 3.42Å; H57-M60 VanDerWaalsContact CB-CG 3.42Å; H57-M60 PolarHBondContact O-N 3.39Å
58K67.9Low78.5Confident176 Ų17698.2 Ų98.277%0.76548%0.479SS*.G310 helixtrans-53.4-34.9-178.2-165176.5-178.6-178.40113.3
59T67Low78.6Confident109 Ų109100.7 Ų100.767%0.66949%0.487SS*.G310 helixtrans-74.7-24.8178.8-470000113H57 R61 W62H57-T59 PolarHBondContact O-N 3.1Å; H57-T59 VanDerWaalsContact O-N 3.12Å; T59-R61 VanDerWaalsContact C-N 3.27Å; T59-R61 PolarHBondContact O-N 2.86Å; T59-W62 VanDerWaalsContact O-CD1 3.26Å
60M63Low78.5Confident61 Ų61101.5 Ų101.530%0.349%0.491SS..G310 helixtrans-81.4-7.3-171.2-66.5-79.7-8600113.4L54 H57 W62 Y63L54-M60 HydrophobicContact CB-CB 3.63Å; L54-M60 HydrophobicContact CD1-CE 4.04Å; L54-M60 HydrophobicContact CD2-CB 3.6Å; L54-M60 HydrophobicContact CD2-CE 3.73Å; L54-M60 HydrophobicContact CD2-CG 4.36Å; L54-M60 HydrophobicContact CD2-SD 4.46Å; L54-M60 HydrophobicContact CG-CB 3.54Å; L54-M60 HydrophobicContact CG-CE 3.58Å; L54-M60 HydrophobicContact CG-CG 4.09Å; H57-M60 HydrophobicContact CB-CB 3.86Å; H57-M60 HydrophobicContact CB-CG 3.42Å; H57-M60 VanDerWaalsContact CB-CG 3.42Å; H57-M60 PolarHBondContact O-N 3.39Å; M60-W62 PolarHBondContact O-N 3.03Å; M60-Y63 HydrophobicContact CB-CD2 4.19Å; M60-Y63 HydrophobicContact CE-CD2 4.36Å; M60-Y63 HydrophobicContact CE-CE2 4.34Å; M60-Y63 HydrophobicContact CG-CD2 4.44Å; M60-Y63 HydrophobicContact CG-CE2 4.49Å; M60-Y63 WeakPolarHBondContact O-CB 3.2Å; M60-Y63 PolarHBondContact O-N 2.78Å; M60-Y63 HydrophobicContact SD-CD2 3.53Å; M60-Y63 VanDerWaalsContact SD-CD2 3.53Å; M60-Y63 HydrophobicContact SD-CE2 3.26Å; M60-Y63 WeakPolarHBondContact SD-CE2 3.29Å
61R71.4Confident78.4Confident137 Ų137100.8 Ų100.852%0.51749%0.486SS..Hα-helixtrans-59.3-28.5173-64.5-179.5179.4177.3-0.8112.7F51 T59 Y63 A64F51-R61 HydrophobicContact CE2-CG 4.23Å; T59-R61 VanDerWaalsContact C-N 3.27Å; T59-R61 PolarHBondContact O-N 2.86Å; R61-Y63 VanDerWaalsContact C-N 3.26Å; R61-Y63 PolarHBondContact O-N 2.8Å; R61-A64 PolarHBondContact O-N 3.45Å
62W79.8Confident78.5Confident183 Ų18398.2 Ų98.269%0.69348%0.478SS*.Hα-helixtrans-64.9-28.1176.1-64.8112.5000112.9T59 M60 L65 A66T59-W62 VanDerWaalsContact O-CD1 3.26Å; M60-W62 PolarHBondContact O-N 3.03Å; W62-L65 HydrophobicContact CE3-CD1 3.72Å; W62-L65 HydrophobicContact CZ3-CD1 3.88Å; W62-L65 PolarHBondContact O-N 3.1Å; W62-A66 PolarHBondContact O-N 3.43Å
63Y80.4Confident78.8Confident140 Ų14093.8 Ų93.855%0.54947%0.469SS..Hα-helixtrans-67.4-38.1176.4-72-84.4000112.2M60 R61 L65 A66 I67M60-Y63 HydrophobicContact CB-CD2 4.19Å; M60-Y63 HydrophobicContact CE-CD2 4.36Å; M60-Y63 HydrophobicContact CE-CE2 4.34Å; M60-Y63 HydrophobicContact CG-CD2 4.44Å; M60-Y63 HydrophobicContact CG-CE2 4.49Å; M60-Y63 WeakPolarHBondContact O-CB 3.2Å; M60-Y63 PolarHBondContact O-N 2.78Å; M60-Y63 HydrophobicContact SD-CD2 3.53Å; M60-Y63 VanDerWaalsContact SD-CD2 3.53Å; M60-Y63 HydrophobicContact SD-CE2 3.26Å; M60-Y63 WeakPolarHBondContact SD-CE2 3.29Å; R61-Y63 VanDerWaalsContact C-N 3.26Å; R61-Y63 PolarHBondContact O-N 2.8Å; Y63-L65 VanDerWaalsContact C-N 3.3Å; Y63-L65 PolarHBondContact O-N 3.39Å; Y63-A66 PolarHBondContact O-N 3.29Å; Y63-I67 VanDerWaalsContact O-CG1 3.27Å; Y63-I67 WeakPolarHBondContact O-CG1 3.3Å; Y63-I67 PolarHBondContact O-N 3.16Å
64A81.5Confident78.9Confident13 Ų1388.3 Ų88.311%0.10745%0.449CS..Hα-helixtrans-62.7-39.9175.600000111.5A47 F51 R61 I67 M68A47-A64 HydrophobicContact CB-CB 4.31Å; F51-A64 HydrophobicContact CB-CB 4.47Å; R61-A64 PolarHBondContact O-N 3.45Å; A64-I67 PolarHBondContact O-N 3.45Å; A64-M68 PolarHBondContact O-N 2.92Å; A64-M68 VanDerWaalsContact O-N 3.08Å
65L83.3Confident79.4Confident99 Ų9987.1 Ų87.152%0.51844%0.444SS..Hα-helixtrans-65.3-42.1173.3-68.9173.8000111.8W62 Y63 I67 M68 L69W62-L65 HydrophobicContact CE3-CD1 3.72Å; W62-L65 HydrophobicContact CZ3-CD1 3.88Å; W62-L65 PolarHBondContact O-N 3.1Å; Y63-L65 VanDerWaalsContact C-N 3.3Å; Y63-L65 PolarHBondContact O-N 3.39Å; L65-I67 PolarHBondContact O-N 2.91Å; L65-M68 PolarHBondContact O-N 3.42Å; L65-L69 WeakPolarHBondContact O-CG 3.39Å; L65-L69 PolarHBondContact O-N 2.92Å
66A85.8Confident80Confident45 Ų4584.1 Ų84.137%0.37244%0.435SS..Hα-helixtrans-61.2-43.3176.200000112W62 Y63 M68 L69 V70W62-A66 PolarHBondContact O-N 3.43Å; Y63-A66 PolarHBondContact O-N 3.29Å; A66-M68 VanDerWaalsContact C-N 3.32Å; A66-M68 PolarHBondContact O-N 2.66Å; A66-L69 PolarHBondContact O-N 3.27Å; A66-V70 WeakPolarHBondContact O-CG2 3.34Å; A66-V70 PolarHBondContact O-N 3.35Å
67I86.2Confident80.8Confident52 Ų5283 Ų8327%0.26742%0.423SS..Hα-helixtrans-58.7-45.9175.1-68.8164.3000110.2H43 A46 A47 A50 Y63 A64 L65 L69 V70 G71H43-I67 HydrophobicContact CB-CG2 4.28Å; H43-I67 PolarHBondContact CD2-O 3.39Å; A46-I67 HydrophobicContact CB-CG2 3.89Å; A47-I67 HydrophobicContact CB-CG2 4.28Å; A50-I67 HydrophobicContact CB-CD1 3.71Å; Y63-I67 VanDerWaalsContact O-CG1 3.27Å; Y63-I67 WeakPolarHBondContact O-CG1 3.3Å; Y63-I67 PolarHBondContact O-N 3.16Å; A64-I67 PolarHBondContact O-N 3.45Å; L65-I67 PolarHBondContact O-N 2.91Å; I67-L69 PolarHBondContact O-N 2.82Å; I67-V70 PolarHBondContact O-N 3.03Å; I67-G71 PolarHBondContact O-N 2.9Å
68M85.8Confident81.5Confident66 Ų6685 Ų8533%0.32543%0.426SS..Hα-helixtrans-64.2-41178.6-166.464.5163.800112.4V40 S44 A64 L65 A66 G71 V72V40-M68 HydrophobicContact CG1-CE 3.87Å; S44-M68 WeakPolarHBondContact OG-CE 3.38Å; A64-M68 PolarHBondContact O-N 2.92Å; A64-M68 VanDerWaalsContact O-N 3.08Å; L65-M68 PolarHBondContact O-N 3.42Å; A66-M68 VanDerWaalsContact C-N 3.32Å; A66-M68 PolarHBondContact O-N 2.66Å; M68-G71 PolarHBondContact O-N 2.74Å; M68-V72 PolarHBondContact O-N 2.88Å
69L88Confident82.4Confident113 Ų11376.8 Ų76.859%0.59239%0.392SS*.Hα-helixtrans-62.8-43.7176.2-73.9174.2000111.8L65 A66 I67 G71 V72 V73L65-L69 WeakPolarHBondContact O-CG 3.39Å; L65-L69 PolarHBondContact O-N 2.92Å; A66-L69 PolarHBondContact O-N 3.27Å; I67-L69 PolarHBondContact O-N 2.82Å; L69-G71 PolarHBondContact O-N 2.95Å; L69-V72 PolarHBondContact O-N 3.44Å; L69-V72 VanDerWaalsContact O-N 3.14Å; L69-V73 WeakPolarHBondContact O-CB 3.25Å; L69-V73 VanDerWaalsContact O-CG2 3.3Å; L69-V73 WeakPolarHBondContact O-CG2 3.15Å; L69-V73 PolarHBondContact O-N 3.49Å
70V85.2Confident83.4Confident94 Ų9473.8 Ų73.857%0.5737%0.372SS*.Hα-helixtrans-59.7-39174.7171.50000110.6A66 I67 V72 G74A66-V70 WeakPolarHBondContact O-CG2 3.34Å; A66-V70 PolarHBondContact O-N 3.35Å; I67-V70 PolarHBondContact O-N 3.03Å; V70-V72 PolarHBondContact O-N 3.08Å; V70-G74 PolarHBondContact O-N 3.13Å
71G83.8Confident84.7Confident0 Ų075.9 Ų75.90%038%0.383CS..Hα-helixtrans-64.5-20.2177.100000115.9S39 H43 I67 M68 L69 P75S39-G71 WeakPolarHBondContact CB-O 3.32Å; S39-G71 PolarHBondContact OG-O 3.32Å; H43-G71 WeakPolarHBondContact CD2-CA 3.47Å; H43-G71 PolarHBondContact CD2-N 3.22Å; H43-G71 VanDerWaalsContact CE1-CA 3.41Å; H43-G71 WeakPolarHBondContact CE1-CA 3.23Å; H43-G71 WeakPolarHBondContact ND1-CA 3.4Å; I67-G71 PolarHBondContact O-N 2.9Å; M68-G71 PolarHBondContact O-N 2.74Å; L69-G71 PolarHBondContact O-N 2.95Å; G71-P75 WeakPolarHBondContact O-CD 3.47Å; G71-P75 VanDerWaalsContact O-CG 3.22Å; G71-P75 WeakPolarHBondContact O-CG 3.41Å
72V86.4Confident85.6Confident47 Ų4770.6 Ų70.629%0.28537%0.366SS..Hα-helixtrans-99.6-46.3176.2176.10000111.1L36 V40 M68 L69 V70 G74 P75 L76L36-V72 HydrophobicContact CD1-CG1 4.31Å; V40-V72 HydrophobicContact CG2-CG2 3.94Å; M68-V72 PolarHBondContact O-N 2.88Å; L69-V72 PolarHBondContact O-N 3.44Å; L69-V72 VanDerWaalsContact O-N 3.14Å; V70-V72 PolarHBondContact O-N 3.08Å; V72-G74 VanDerWaalsContact C-N 3.35Å; V72-G74 PolarHBondContact O-N 3.46Å; V72-P75 WeakPolarHBondContact O-CD 3.36Å; V72-L76 HydrophobicContact CG1-CD1 3.83Å; V72-L76 VanDerWaalsContact O-CG 3.29Å; V72-L76 WeakPolarHBondContact O-CG 3.39Å; V72-L76 PolarHBondContact O-N 3.45Å
73V88.7Confident86Confident78 Ų7861.9 Ų61.947%0.47333%0.333SS..Hα-helixtrans-68-35.1-177176.50000111.6L69 L76 T77L69-V73 WeakPolarHBondContact O-CB 3.25Å; L69-V73 VanDerWaalsContact O-CG2 3.3Å; L69-V73 WeakPolarHBondContact O-CG2 3.15Å; L69-V73 PolarHBondContact O-N 3.49Å; V73-L76 PolarHBondContact O-N 3.31Å; V73-T77 HydrophobicContact CG1-CG2 4.27Å; V73-T77 WeakPolarHBondContact O-CG2 3.33Å; V73-T77 PolarHBondContact O-N 2.69Å; V73-T77 PolarHBondContact O-OG1 3.33Å
74G84.2Confident86.6Confident30 Ų3057.5 Ų57.531%0.30932%0.321SS..Hα-helixtrans-59.2-55.8177.600000112.9V70 V72 L76 T77 W78 G79V70-G74 PolarHBondContact O-N 3.13Å; V72-G74 VanDerWaalsContact C-N 3.35Å; V72-G74 PolarHBondContact O-N 3.46Å; G74-L76 VanDerWaalsContact C-N 3.33Å; G74-L76 PolarHBondContact O-N 3.18Å; G74-T77 PolarHBondContact O-N 3.3Å; G74-T77 PolarHBondContact O-OG1 2.89Å; G74-W78 PolarHBondContact O-N 3.42Å; G74-G79 PolarHBondContact O-N 2.92Å
75P83.6Confident87.1Confident10 Ų1061.4 Ų61.47%0.06534%0.339CS..Iπ-helixtrans-55.9-42172.5-31.737.9000114.4V35 L36 S39 G71 V72 T77 G79 N80V35-P75 HydrophobicContact CG1-CB 4Å; V35-P75 HydrophobicContact CG1-CG 4.39Å; L36-P75 HydrophobicContact CD1-CB 4.12Å; S39-P75 VanDerWaalsContact OG-CG 3.23Å; S39-P75 WeakPolarHBondContact OG-CG 3.19Å; G71-P75 WeakPolarHBondContact O-CD 3.47Å; G71-P75 VanDerWaalsContact O-CG 3.22Å; G71-P75 WeakPolarHBondContact O-CG 3.41Å; V72-P75 WeakPolarHBondContact O-CD 3.36Å; P75-T77 VanDerWaalsContact C-N 3.26Å; P75-T77 PolarHBondContact O-N 2.89Å; P75-G79 CarbonylContact O-C 3.26Å; P75-G79 VanDerWaalsContact O-C 3.26Å; P75-G79 WeakPolarHBondContact O-CA 3.33Å; P75-G79 PolarHBondContact O-N 3.39Å; P75-G79 VanDerWaalsContact O-N 3.13Å; P75-N80 PolarHBondContact O-N 2.91Å
76L86.4Confident87.3Confident92 Ų9261.2 Ų61.248%0.48234%0.335SS..Iπ-helixtrans-67.9-26.5-177.9-71.6174.2000113.3V72 V73 G74 N80V72-L76 HydrophobicContact CG1-CD1 3.83Å; V72-L76 VanDerWaalsContact O-CG 3.29Å; V72-L76 WeakPolarHBondContact O-CG 3.39Å; V72-L76 PolarHBondContact O-N 3.45Å; V73-L76 PolarHBondContact O-N 3.31Å; G74-L76 VanDerWaalsContact C-N 3.33Å; G74-L76 PolarHBondContact O-N 3.18Å; L76-N80 WeakPolarHBondContact O-CB 3.4Å
77T88.3Confident87.4Confident80 Ų8059.1 Ų59.149%0.49132%0.317SS..Iπ-helixtrans-97.1-69.6-179.651.90000111.1V73 G74 P75V73-T77 HydrophobicContact CG1-CG2 4.27Å; V73-T77 WeakPolarHBondContact O-CG2 3.33Å; V73-T77 PolarHBondContact O-N 2.69Å; V73-T77 PolarHBondContact O-OG1 3.33Å; G74-T77 PolarHBondContact O-N 3.3Å; G74-T77 PolarHBondContact O-OG1 2.89Å; P75-T77 VanDerWaalsContact C-N 3.26Å; P75-T77 PolarHBondContact O-N 2.89Å
78W85.9Confident87.6Confident159 Ų15963.3 Ų63.360%0.60233%0.33SS*.Iπ-helixtrans-76.9-45-176.6-170.6-100.3000111.8G74 N80 I81 T82G74-W78 PolarHBondContact O-N 3.42Å; W78-N80 PolarHBondContact O-N 3.32Å; W78-I81 PolarHBondContact O-N 3.43Å; W78-I81 VanDerWaalsContact O-N 3.13Å; W78-T82 PolarHBondContact O-N 2.83Å; W78-T82 VanDerWaalsContact O-N 3.08Å; W78-T82 PolarHBondContact O-OG1 3.47Å; W78-T82 VanDerWaalsContact O-OG1 3.12Å
79G85.5Confident87.8Confident4 Ų464 Ų644%0.04133%0.334CS..Iπ-helixtrans-58.9-35.4179.500000111.8G74 P75 T82 S83 Q109G74-G79 PolarHBondContact O-N 2.92Å; P75-G79 CarbonylContact O-C 3.26Å; P75-G79 VanDerWaalsContact O-C 3.26Å; P75-G79 WeakPolarHBondContact O-CA 3.33Å; P75-G79 PolarHBondContact O-N 3.39Å; P75-G79 VanDerWaalsContact O-N 3.13Å; G79-T82 WeakPolarHBondContact CA-OG1 3.28Å; G79-T82 PolarHBondContact O-OG1 2.85Å; G79-T82 VanDerWaalsContact O-OG1 3.1Å; G79-S83 WeakPolarHBondContact O-CB 3.27Å; G79-S83 PolarHBondContact O-N 3.07Å; G79-S83 PolarHBondContact O-OG 3.35Å; G79-Q109 VanDerWaalsContact CA-NE2 3.3Å; G79-Q109 PolarHBondContact O-NE2 3.44Å; G79-Q109 VanDerWaalsContact O-NE2 3.16Å
80N88.7Confident87.8Confident46 Ų4659.9 Ų59.925%0.24631%0.314CS..Hα-helixtrans-60.9-49.1175.6-168.449.6000112.9W28 L32 P75 L76 W78 S83 V84W28-N80 VanDerWaalsContact CE2-OD1 3.23Å; W28-N80 WeakPolarHBondContact CZ2-OD1 3.18Å; W28-N80 PolarHBondContact NE1-OD1 3.43Å; L32-N80 HydrophobicContact CD1-CB 4.27Å; P75-N80 PolarHBondContact O-N 2.91Å; L76-N80 WeakPolarHBondContact O-CB 3.4Å; W78-N80 PolarHBondContact O-N 3.32Å; N80-S83 PolarHBondContact O-N 3.35Å; N80-V84 WeakPolarHBondContact O-CG2 3.29Å; N80-V84 PolarHBondContact O-N 2.83Å
81I90.5Very high87.8Confident105 Ų10557.7 Ų57.754%0.53830%0.299SS..Hα-helixtrans-62.7-47.5179.7-63.2168.9000110.4W78 V84 L85W78-I81 PolarHBondContact O-N 3.43Å; W78-I81 VanDerWaalsContact O-N 3.13Å; I81-V84 PolarHBondContact O-N 3.2Å; I81-L85 PolarHBondContact O-N 3.33Å; I81-L85 VanDerWaalsContact O-N 3.1Å
82T89.9Confident88.1Confident26 Ų2662.9 Ų62.916%0.1633%0.326CS..Hα-helixtrans-66.8-37.8-179.548.40000111.7W78 G79 L85 F86 Q109W78-T82 PolarHBondContact O-N 2.83Å; W78-T82 VanDerWaalsContact O-N 3.08Å; W78-T82 PolarHBondContact O-OG1 3.47Å; W78-T82 VanDerWaalsContact O-OG1 3.12Å; G79-T82 WeakPolarHBondContact CA-OG1 3.28Å; G79-T82 PolarHBondContact O-OG1 2.85Å; G79-T82 VanDerWaalsContact O-OG1 3.1Å; T82-L85 PolarHBondContact O-N 2.78Å; T82-F86 WeakPolarHBondContact O-CD2 3.27Å; T82-F86 PolarHBondContact O-N 2.92Å; T82-Q109 PolarHBondContact OG1-NE2 3.18Å; T82-Q109 PolarHBondContact OG1-OE1 2.91Å
83S88.8Confident88.1Confident0 Ų065 Ų650%034%0.344CS..Hα-helixtrans-65.5-41.2177.2-640000112.5I31 G79 N80 L85 F86 A87 Q109I31-S83 WeakPolarHBondContact CG2-OG 3.24Å; G79-S83 WeakPolarHBondContact O-CB 3.27Å; G79-S83 PolarHBondContact O-N 3.07Å; G79-S83 PolarHBondContact O-OG 3.35Å; N80-S83 PolarHBondContact O-N 3.35Å; S83-L85 VanDerWaalsContact C-N 3.32Å; S83-L85 PolarHBondContact O-N 3.1Å; S83-F86 PolarHBondContact O-N 3.47Å; S83-A87 VanDerWaalsContact O-CB 3.32Å; S83-A87 WeakPolarHBondContact O-CB 3.48Å; S83-A87 PolarHBondContact O-N 3.4Å; S83-Q109 PolarHBondContact OG-NE2 2.91Å
84V91.4Very high87.6Confident48 Ų4868.7 Ų68.729%0.29135%0.349SS..Hα-helixtrans-60.2-45172.9173.30000110.6W28 N80 I81 A87 W88W28-V84 HydrophobicContact CD2-CG2 3.47Å; W28-V84 VanDerWaalsContact CD2-CG2 3.47Å; W28-V84 HydrophobicContact CE3-CG2 4.08Å; W28-V84 HydrophobicContact CG-CG2 3.76Å; W28-V84 HydrophobicContact CH2-CG2 4.26Å; W28-V84 HydrophobicContact CZ2-CG2 3.68Å; W28-V84 HydrophobicContact CZ3-CG2 4.44Å; N80-V84 WeakPolarHBondContact O-CG2 3.29Å; N80-V84 PolarHBondContact O-N 2.83Å; I81-V84 PolarHBondContact O-N 3.2Å; V84-A87 PolarHBondContact O-N 2.96Å; V84-W88 WeakPolarHBondContact O-CB 3.01Å; V84-W88 PolarHBondContact O-N 3.02Å
85L92.1Very high87.1Confident96 Ų9669 Ų6950%0.50335%0.353SS..Hα-helixtrans-63.4-45.7179.9178.965.6000111.4I81 T82 S83 W88 I89I81-L85 PolarHBondContact O-N 3.33Å; I81-L85 VanDerWaalsContact O-N 3.1Å; T82-L85 PolarHBondContact O-N 2.78Å; S83-L85 VanDerWaalsContact C-N 3.32Å; S83-L85 PolarHBondContact O-N 3.1Å; L85-W88 PolarHBondContact O-N 3.31Å; L85-I89 HydrophobicContact CD1-CD1 4.11Å; L85-I89 HydrophobicContact CD1-CG1 4.4Å; L85-I89 HydrophobicContact CG-CD1 3.93Å; L85-I89 VanDerWaalsContact O-CG1 3.26Å; L85-I89 WeakPolarHBondContact O-CG1 3.47Å; L85-I89 PolarHBondContact O-N 3.44Å
86F87.7Confident86.9Confident95 Ų9572.1 Ų72.142%0.41737%0.371SS..Hα-helixtrans-60.4-44.8174.8-86.7-67.3000111.8I31 T82 S83 W88 I89 C90I31-F86 HydrophobicContact CD1-CB 4.01Å; T82-F86 WeakPolarHBondContact O-CD2 3.27Å; T82-F86 PolarHBondContact O-N 2.92Å; S83-F86 PolarHBondContact O-N 3.47Å; F86-W88 VanDerWaalsContact C-N 3.33Å; F86-W88 PolarHBondContact O-N 3.25Å; F86-I89 PolarHBondContact O-N 3.31Å; F86-C90 WeakPolarHBondContact O-CB 3.41Å; F86-C90 PolarHBondContact O-N 3.41Å; F86-C90 PolarHBondContact O-SG 2.9Å; F86-C90 VanDerWaalsContact O-SG 3.39Å
87A89.2Confident86.3Confident0 Ų068 Ų680%035%0.349CS..Hα-helixtrans-58.6-45.8176.400000111.8L24 I27 W28 S83 V84 C90 L91L24-A87 HydrophobicContact CG-CB 4.48Å; I27-A87 HydrophobicContact CB-CB 3.93Å; I27-A87 HydrophobicContact CG2-CB 3.59Å; W28-A87 HydrophobicContact CB-CB 3.85Å; S83-A87 VanDerWaalsContact O-CB 3.32Å; S83-A87 WeakPolarHBondContact O-CB 3.48Å; S83-A87 PolarHBondContact O-N 3.4Å; V84-A87 PolarHBondContact O-N 2.96Å; A87-C90 PolarHBondContact O-N 3.39Å; A87-L91 VanDerWaalsContact O-CB 3.27Å; A87-L91 WeakPolarHBondContact O-CB 3.29Å; A87-L91 PolarHBondContact O-N 2.93Å
88W89.4Confident85.9Confident141 Ų14167 Ų6753%0.53434%0.344SS..Hα-helixtrans-62.3-44.8177.7-174.284.5000112.1L24 V84 L85 F86 N92L24-W88 HydrophobicContact CD1-CB 4.14Å; L24-W88 HydrophobicContact CD1-CG 4.44Å; V84-W88 WeakPolarHBondContact O-CB 3.01Å; V84-W88 PolarHBondContact O-N 3.02Å; L85-W88 PolarHBondContact O-N 3.31Å; F86-W88 VanDerWaalsContact C-N 3.33Å; F86-W88 PolarHBondContact O-N 3.25Å; W88-N92 PolarHBondContact NE1-ND2 3.08Å; W88-N92 PolarHBondContact O-N 3.41Å; W88-N92 VanDerWaalsContact O-N 3.1Å; W88-N92 PolarHBondContact O-ND2 3.29Å
89I90.8Very high85.5Confident80 Ų8059.6 Ų59.641%0.4132%0.317SS..Hα-helixtrans-62.5-47.9177.3-67.7165.6000110.7L85 F86 N92 S93L85-I89 HydrophobicContact CD1-CD1 4.11Å; L85-I89 HydrophobicContact CD1-CG1 4.4Å; L85-I89 HydrophobicContact CG-CD1 3.93Å; L85-I89 VanDerWaalsContact O-CG1 3.26Å; L85-I89 WeakPolarHBondContact O-CG1 3.47Å; L85-I89 PolarHBondContact O-N 3.44Å; F86-I89 PolarHBondContact O-N 3.31Å; I89-N92 PolarHBondContact O-N 3.45Å; I89-S93 WeakPolarHBondContact O-CB 3.4Å; I89-S93 PolarHBondContact O-N 2.89Å
90C86.7Confident85.2Confident26 Ų2663.7 Ų63.718%0.17634%0.338CS..Hα-helixtrans-64.3-42.2-178.4-73.90000112F86 A87 N92 S93 R94 M97F86-C90 WeakPolarHBondContact O-CB 3.41Å; F86-C90 PolarHBondContact O-N 3.41Å; F86-C90 PolarHBondContact O-SG 2.9Å; F86-C90 VanDerWaalsContact O-SG 3.39Å; A87-C90 PolarHBondContact O-N 3.39Å; C90-N92 PolarHBondContact O-N 2.68Å; C90-S93 PolarHBondContact O-N 3.43Å; C90-R94 PolarHBondContact O-N 2.87Å; C90-M97 HydrophobicContact CB-SD 3.73Å
91L87Confident84.9Confident48 Ų4867.4 Ų67.425%0.25135%0.349SS..Hα-helixtrans-60.9-45176.8-174.365.9000111.5D22 L24 I27 A87 G95D22-L91 VanDerWaalsContact O-CD1 3.24Å; D22-L91 WeakPolarHBondContact O-CD1 3.24Å; L24-L91 HydrophobicContact CB-CD2 3.88Å; I27-L91 HydrophobicContact CD1-CB 4.38Å; I27-L91 HydrophobicContact CD1-CD1 4.38Å; A87-L91 VanDerWaalsContact O-CB 3.27Å; A87-L91 WeakPolarHBondContact O-CB 3.29Å; A87-L91 PolarHBondContact O-N 2.93Å; L91-G95 VanDerWaalsContact O-CA 3.23Å; L91-G95 WeakPolarHBondContact O-CA 3.19Å; L91-G95 PolarHBondContact O-N 3.35Å
92N88.6Confident84.6Confident109 Ų10962.4 Ų62.458%0.58332%0.324SS*.Hα-helixtrans-74.4-24.4178.8-75.2-85000113.5W88 I89 C90W88-N92 PolarHBondContact NE1-ND2 3.08Å; W88-N92 PolarHBondContact O-N 3.41Å; W88-N92 VanDerWaalsContact O-N 3.1Å; W88-N92 PolarHBondContact O-ND2 3.29Å; I89-N92 PolarHBondContact O-N 3.45Å; C90-N92 PolarHBondContact O-N 2.68Å
93S87.8Confident84.3Confident92 Ų9263.6 Ų63.664%0.64333%0.327SS*.Hα-helixtrans-87.4-42.4-178.8177.30000113.2I89 C90I89-S93 WeakPolarHBondContact O-CB 3.4Å; I89-S93 PolarHBondContact O-N 2.89Å; C90-S93 PolarHBondContact O-N 3.43Å
94R77.3Confident84.3Confident156 Ų15667.8 Ų67.859%0.58935%0.348SS*.Hα-helixtrans-119.1-18.9-169.7-64.8178.7175.2-109.5-0.2113.5C90 V96C90-R94 PolarHBondContact O-N 2.87Å; R94-V96 WeakPolarHBondContact CB-O 3.48Å; R94-V96 PolarHBondContact O-N 2.89Å
95G74Confident84.1Confident37 Ų3766.8 Ų66.838%0.38135%0.346SS..SBendtrans73.1-34.1-173.800000114.2L91L91-G95 VanDerWaalsContact O-CA 3.23Å; L91-G95 WeakPolarHBondContact O-CA 3.19Å; L91-G95 PolarHBondContact O-N 3.35Å
96V78.5Confident83.8Confident74 Ų7462.2 Ų62.245%0.44832%0.322SS..  trans-136.9146.1178-65.20000110.8P20 L21 D22 R94P20-V96 HydrophobicContact CB-CB 4.28Å; P20-V96 HydrophobicContact CB-CG1 4.39Å; L21-V96 WeakPolarHBondContact O-CA 3.3Å; D22-V96 HydrophobicContact CB-CG1 4.26Å; R94-V96 WeakPolarHBondContact CB-O 3.48Å; R94-V96 PolarHBondContact O-N 2.89Å
97M74.7Confident83.9Confident6 Ų660.5 Ų60.53%0.0332%0.316CS..BIsolated β-bridgetrans-130.6124.4176.9-160174.379.800111.3L21 I27 I31 C90 A102L21-M97 VanDerWaalsContact CB-O 3.26Å; L21-M97 WeakPolarHBondContact CB-O 3.23Å; L21-M97 HydrophobicContact CD1-CE 4.36Å; L21-M97 WeakPolarHBondContact CD1-O 3.44Å; L21-M97 WeakPolarHBondContact CG-O 3.44Å; L21-M97 PolarHBondContact N-O 2.92Å; L21-M97 PolarHBondContact O-N 3.33Å; I27-M97 HydrophobicContact CD1-CB 4.14Å; I27-M97 HydrophobicContact CG1-CB 4.32Å; I27-M97 HydrophobicContact CG2-CE 3.52Å; I27-M97 HydrophobicContact CG2-SD 4.24Å; I31-M97 HydrophobicContact CD1-CE 4.17Å; I31-M97 HydrophobicContact CG1-CE 4.28Å; C90-M97 HydrophobicContact CB-SD 3.73Å; M97-A102 HydrophobicContact CE-CB 3.33Å
98P78.9Confident84Confident59 Ų5964.3 Ų64.338%0.38334%0.339SS..  trans-64.4143.7173.8-17.729.2000111.3L100 Y101 A102P98-L100 PolarHBondContact O-N 3.42Å; P98-L100 VanDerWaalsContact O-N 3.11Å; P98-Y101 HydrophobicContact CB-CD2 4.02Å; P98-Y101 HydrophobicContact CG-CD2 3.83Å; P98-Y101 HydrophobicContact CG-CE2 4.2Å; P98-Y101 WeakPolarHBondContact O-CB 3.45Å; P98-Y101 PolarHBondContact O-N 3.39Å; P98-A102 PolarHBondContact O-N 3.02Å
99G77.3Confident83.9Confident4 Ų458.1 Ų58.14%0.04132%0.316CS..Hα-helixtrans-53.7-33.7179.200000114.2Y101 A102 F103G99-Y101 VanDerWaalsContact C-N 3.32Å; G99-Y101 PolarHBondContact O-N 3.12Å; G99-A102 WeakPolarHBondContact O-CB 3.01Å; G99-A102 PolarHBondContact O-N 3.33Å; G99-A102 VanDerWaalsContact O-N 3.17Å; G99-F103 PolarHBondContact O-N 2.95Å
100L79.8Confident83.8Confident90 Ų9054.7 Ų54.747%0.47130%0.299SS..Hα-helixtrans-60.9-37.1175-175.365.1000113.1P98 A102 F103 L104P98-L100 PolarHBondContact O-N 3.42Å; P98-L100 VanDerWaalsContact O-N 3.11Å; L100-A102 VanDerWaalsContact C-N 3.35Å; L100-F103 HydrophobicContact CD1-CD1 4.05Å; L100-F103 WeakPolarHBondContact O-CB 3.1Å; L100-F103 PolarHBondContact O-N 3.33Å; L100-L104 HydrophobicContact CG-CD1 4.44Å; L100-L104 WeakPolarHBondContact O-CG 3.33Å; L100-L104 PolarHBondContact O-N 2.85Å
101Y83.8Confident83.9Confident124 Ų12456.9 Ų56.949%0.48631%0.311SS..Hα-helixtrans-69-36.9177.1-82.3-105000111P98 G99 L104 A105P98-Y101 HydrophobicContact CB-CD2 4.02Å; P98-Y101 HydrophobicContact CG-CD2 3.83Å; P98-Y101 HydrophobicContact CG-CE2 4.2Å; P98-Y101 WeakPolarHBondContact O-CB 3.45Å; P98-Y101 PolarHBondContact O-N 3.39Å; G99-Y101 VanDerWaalsContact C-N 3.32Å; G99-Y101 PolarHBondContact O-N 3.12Å; Y101-L104 PolarHBondContact O-N 3.3Å; Y101-A105 VanDerWaalsContact O-CB 3.28Å; Y101-A105 WeakPolarHBondContact O-CB 3.42Å; Y101-A105 PolarHBondContact O-N 3.49Å
102A84Confident84Confident0 Ų059.1 Ų59.10%032%0.323CS..Hα-helixtrans-65.2-43176.400000111.3L21 Q30 I31 M97 P98 G99 L100 A105 G106L21-A102 HydrophobicContact CD1-CB 4.05Å; Q30-A102 HydrophobicContact CB-CB 3.77Å; Q30-A102 HydrophobicContact CG-CB 3.21Å; I31-A102 HydrophobicContact CG1-CB 3.9Å; M97-A102 HydrophobicContact CE-CB 3.33Å; P98-A102 PolarHBondContact O-N 3.02Å; G99-A102 WeakPolarHBondContact O-CB 3.01Å; G99-A102 PolarHBondContact O-N 3.33Å; G99-A102 VanDerWaalsContact O-N 3.17Å; L100-A102 VanDerWaalsContact C-N 3.35Å; A102-A105 PolarHBondContact O-N 3.45Å; A102-G106 PolarHBondContact O-N 3Å
103F82.8Confident83.9Confident51 Ų5156.2 Ų56.222%0.22431%0.31CS..Hα-helixtrans-56.8-52.1174164.9-103.1000111.8L15 W34 G99 L100 A105 G106 I107L15-F103 HydrophobicContact CD2-CB 3.79Å; L15-F103 HydrophobicContact CD2-CG 4.27Å; W34-F103 HydrophobicContact CD2-CB 4.43Å; W34-F103 AromaticContact CD2-CD2 3.49Å; W34-F103 HydrophobicContact CD2-CD2 3.49Å; W34-F103 VanDerWaalsContact CD2-CD2 3.49Å; W34-F103 HydrophobicContact CD2-CE2 4.25Å; W34-F103 HydrophobicContact CD2-CG 4.45Å; W34-F103 AromaticContact CE2-CD2 3.76Å; W34-F103 AromaticContact CE3-CD2 3.57Å; W34-F103 HydrophobicContact CE3-CD2 3.57Å; W34-F103 AromaticContact CE3-CE2 3.85Å; W34-F103 HydrophobicContact CE3-CE2 3.85Å; W34-F103 HydrophobicContact CG-CB 4.22Å; W34-F103 AromaticContact CG-CD2 3.93Å; W34-F103 HydrophobicContact CG-CD2 3.93Å; W34-F103 HydrophobicContact CH2-CD2 4.16Å; W34-F103 HydrophobicContact CH2-CE2 4.33Å; W34-F103 HydrophobicContact CZ2-CD2 4.1Å; W34-F103 AromaticContact CZ3-CD2 3.91Å; W34-F103 HydrophobicContact CZ3-CD2 3.91Å; W34-F103 AromaticContact CZ3-CE2 3.89Å; W34-F103 HydrophobicContact CZ3-CE2 3.89Å; G99-F103 PolarHBondContact O-N 2.95Å; L100-F103 HydrophobicContact CD1-CD1 4.05Å; L100-F103 WeakPolarHBondContact O-CB 3.1Å; L100-F103 PolarHBondContact O-N 3.33Å; F103-A105 VanDerWaalsContact C-N 3.35Å; F103-A105 PolarHBondContact O-N 3.18Å; F103-G106 PolarHBondContact O-N 3.47Å; F103-I107 HydrophobicContact CD1-CD1 4.16Å; F103-I107 HydrophobicContact CD2-CD1 4.06Å; F103-I107 HydrophobicContact CE1-CD1 3.56Å; F103-I107 HydrophobicContact CE2-CD1 3.46Å; F103-I107 VanDerWaalsContact CE2-CD1 3.46Å; F103-I107 HydrophobicContact CE2-CG1 4.36Å; F103-I107 HydrophobicContact CG-CD1 4.4Å; F103-I107 HydrophobicContact CZ-CD1 3.18Å; F103-I107 HydrophobicContact CZ-CG1 4.47Å; F103-I107 PolarHBondContact O-N 2.99Å; F103-I107 VanDerWaalsContact O-N 3.08Å
104L88.6Confident83.8Confident87 Ų8753.2 Ų53.246%0.45529%0.288SS..Hα-helixtrans-63-41.7178.3-69.8175.6000111.5L100 Y101 G106 I107 V108L100-L104 HydrophobicContact CG-CD1 4.44Å; L100-L104 WeakPolarHBondContact O-CG 3.33Å; L100-L104 PolarHBondContact O-N 2.85Å; Y101-L104 PolarHBondContact O-N 3.3Å; L104-G106 VanDerWaalsContact C-N 3.3Å; L104-G106 PolarHBondContact O-N 3.35Å; L104-I107 PolarHBondContact O-N 2.85Å; L104-V108 WeakPolarHBondContact O-CB 3.44Å; L104-V108 VanDerWaalsContact O-CG2 3.24Å; L104-V108 WeakPolarHBondContact O-CG2 3.37Å; L104-V108 PolarHBondContact O-N 3.46Å
105A87.5Confident84.3Confident28 Ų2850.4 Ų50.423%0.23128%0.284CS..Hα-helixtrans-58.7-43.4176.300000111.3I31 Y101 A102 F103 V108 Q109I31-A105 HydrophobicContact CG1-CB 4.46Å; Y101-A105 VanDerWaalsContact O-CB 3.28Å; Y101-A105 WeakPolarHBondContact O-CB 3.42Å; Y101-A105 PolarHBondContact O-N 3.49Å; A102-A105 PolarHBondContact O-N 3.45Å; F103-A105 VanDerWaalsContact C-N 3.35Å; F103-A105 PolarHBondContact O-N 3.18Å; A105-V108 PolarHBondContact O-N 3.37Å; A105-Q109 VanDerWaalsContact O-CB 3.29Å; A105-Q109 WeakPolarHBondContact O-CB 3.34Å; A105-Q109 PolarHBondContact O-N 3.45Å
106G86.2Confident84.9Confident0 Ų051.8 Ų51.80%029%0.285CS..Hα-helixtrans-64.2-43.2177.700000113.5V35 A102 F103 L104 Q109 T110V35-G106 VanDerWaalsContact CG2-CA 3.45Å; A102-G106 PolarHBondContact O-N 3Å; F103-G106 PolarHBondContact O-N 3.47Å; L104-G106 VanDerWaalsContact C-N 3.3Å; L104-G106 PolarHBondContact O-N 3.35Å; G106-Q109 PolarHBondContact O-N 3.47Å; G106-T110 PolarHBondContact O-N 3.02Å; G106-T110 VanDerWaalsContact O-N 3.13Å; G106-T110 PolarHBondContact O-OG1 2.62Å
107I88.8Confident85.2Confident59 Ų5951.5 Ų51.530%0.30329%0.286SS..Hα-helixtrans-63-48.4175.3-69.3170.3000110.9F103 L104 Q109 T110 V111F103-I107 HydrophobicContact CD1-CD1 4.16Å; F103-I107 HydrophobicContact CD2-CD1 4.06Å; F103-I107 HydrophobicContact CE1-CD1 3.56Å; F103-I107 HydrophobicContact CE2-CD1 3.46Å; F103-I107 VanDerWaalsContact CE2-CD1 3.46Å; F103-I107 HydrophobicContact CE2-CG1 4.36Å; F103-I107 HydrophobicContact CG-CD1 4.4Å; F103-I107 HydrophobicContact CZ-CD1 3.18Å; F103-I107 HydrophobicContact CZ-CG1 4.47Å; F103-I107 PolarHBondContact O-N 2.99Å; F103-I107 VanDerWaalsContact O-N 3.08Å; L104-I107 PolarHBondContact O-N 2.85Å; I107-Q109 VanDerWaalsContact C-N 3.29Å; I107-Q109 PolarHBondContact O-N 2.91Å; I107-T110 PolarHBondContact O-N 3.15Å; I107-V111 HydrophobicContact CG2-CG2 4.23Å; I107-V111 WeakPolarHBondContact O-CG2 3.25Å; I107-V111 PolarHBondContact O-N 2.68Å
108V91.3Very high85.5Confident79 Ų7958.3 Ų58.348%0.47932%0.315SS..Hα-helixtrans-59.4-43-179.8168.80000110.5L104 A105 T110 V111 I112L104-V108 WeakPolarHBondContact O-CB 3.44Å; L104-V108 VanDerWaalsContact O-CG2 3.24Å; L104-V108 WeakPolarHBondContact O-CG2 3.37Å; L104-V108 PolarHBondContact O-N 3.46Å; A105-V108 PolarHBondContact O-N 3.37Å; V108-T110 PolarHBondContact O-N 2.88Å; V108-V111 PolarHBondContact O-N 3.29Å; V108-I112 HydrophobicContact CG1-CD1 3.64Å; V108-I112 HydrophobicContact CG1-CG1 4.31Å; V108-I112 VanDerWaalsContact O-CG1 3.3Å; V108-I112 WeakPolarHBondContact O-CG1 3.47Å; V108-I112 PolarHBondContact O-N 3.1Å
109Q87.1Confident86Confident12 Ų1259.3 Ų59.36%0.05632%0.323CS..Hα-helixtrans-59.1-45.3176.5-176.3174.9-51.500111.8V35 G79 T82 S83 A105 G106 I107 C113V35-Q109 HydrophobicContact CG2-CB 4.16Å; V35-Q109 HydrophobicContact CG2-CG 4.24Å; G79-Q109 VanDerWaalsContact CA-NE2 3.3Å; G79-Q109 PolarHBondContact O-NE2 3.44Å; G79-Q109 VanDerWaalsContact O-NE2 3.16Å; T82-Q109 PolarHBondContact OG1-NE2 3.18Å; T82-Q109 PolarHBondContact OG1-OE1 2.91Å; S83-Q109 PolarHBondContact OG-NE2 2.91Å; A105-Q109 VanDerWaalsContact O-CB 3.29Å; A105-Q109 WeakPolarHBondContact O-CB 3.34Å; A105-Q109 PolarHBondContact O-N 3.45Å; G106-Q109 PolarHBondContact O-N 3.47Å; I107-Q109 VanDerWaalsContact C-N 3.29Å; I107-Q109 PolarHBondContact O-N 2.91Å; Q109-C113 WeakPolarHBondContact O-CB 3.32Å; Q109-C113 PolarHBondContact O-N 3.21Å; Q109-C113 PolarHBondContact O-SG 3.37Å
110T88.7Confident86.3Confident7 Ų768.4 Ų68.44%0.04336%0.356CS..Hα-helixtrans-65.4-42.2176.7-63.90000112.3V35 S38 V42 G106 I107 V108 C113 T114V35-T110 PolarHBondContact O-OG1 3.36Å; S38-T110 VanDerWaalsContact OG-CB 3.3Å; S38-T110 WeakPolarHBondContact OG-CB 3.26Å; S38-T110 PolarHBondContact OG-OG1 3.47Å; V42-T110 HydrophobicContact CG2-CG2 4.16Å; G106-T110 PolarHBondContact O-N 3.02Å; G106-T110 VanDerWaalsContact O-N 3.13Å; G106-T110 PolarHBondContact O-OG1 2.62Å; I107-T110 PolarHBondContact O-N 3.15Å; V108-T110 PolarHBondContact O-N 2.88Å; T110-C113 PolarHBondContact O-N 3.27Å; T110-T114 VanDerWaalsContact O-CB 3.32Å; T110-T114 WeakPolarHBondContact O-CB 3.28Å; T110-T114 PolarHBondContact O-N 3.27Å; T110-T114 PolarHBondContact O-OG1 3.15Å
111V88.4Confident86.3Confident73 Ų7367.6 Ų67.644%0.44236%0.355SS..Hα-helixtrans-62.2-48.3178.3170.60000110.7I107 V108 C113 T114 I115I107-V111 HydrophobicContact CG2-CG2 4.23Å; I107-V111 WeakPolarHBondContact O-CG2 3.25Å; I107-V111 PolarHBondContact O-N 2.68Å; V108-V111 PolarHBondContact O-N 3.29Å; V111-C113 PolarHBondContact O-N 3.17Å; V111-T114 PolarHBondContact O-N 2.92Å; V111-I115 HydrophobicContact CG1-CD1 3.7Å; V111-I115 HydrophobicContact CG1-CG1 4.41Å; V111-I115 VanDerWaalsContact O-CG1 3.29Å; V111-I115 WeakPolarHBondContact O-CG1 3.13Å; V111-I115 PolarHBondContact O-N 3.3Å
112I90.5Very high85.8Confident95 Ų9569 Ų6949%0.48736%0.364SS..Hα-helixtrans-61.1-47.3177.9-67.5170.1000110.5V108 T114 I115 V116V108-I112 HydrophobicContact CG1-CD1 3.64Å; V108-I112 HydrophobicContact CG1-CG1 4.31Å; V108-I112 VanDerWaalsContact O-CG1 3.3Å; V108-I112 WeakPolarHBondContact O-CG1 3.47Å; V108-I112 PolarHBondContact O-N 3.1Å; I112-T114 VanDerWaalsContact C-N 3.27Å; I112-T114 PolarHBondContact O-N 3.11Å; I112-I115 PolarHBondContact O-N 3.03Å; I112-V116 HydrophobicContact CG2-CG2 4.26Å; I112-V116 WeakPolarHBondContact O-CB 3.4Å; I112-V116 VanDerWaalsContact O-CG2 3.29Å; I112-V116 WeakPolarHBondContact O-CG2 3.23Å; I112-V116 PolarHBondContact O-N 2.93Å
113C86.1Confident85.7Confident47 Ų4774.1 Ų74.132%0.31840%0.397SS..Hα-helixtrans-60.1-39.5178.4-700000111.9Q109 T110 V111 S117Q109-C113 WeakPolarHBondContact O-CB 3.32Å; Q109-C113 PolarHBondContact O-N 3.21Å; Q109-C113 PolarHBondContact O-SG 3.37Å; T110-C113 PolarHBondContact O-N 3.27Å; V111-C113 PolarHBondContact O-N 3.17Å; C113-S117 WeakPolarHBondContact O-CB 3.4Å; C113-S117 PolarHBondContact O-N 3.44Å; C113-S117 PolarHBondContact O-OG 3.46Å
114T84.9Confident85.4Confident30 Ų3076.2 Ų76.218%0.18442%0.418CS..Hα-helixtrans-65.2-49.3177-58.30000110.7V42 T110 V111 I112 V116 S117 F118V42-T114 HydrophobicContact CG1-CG2 4.15Å; T110-T114 VanDerWaalsContact O-CB 3.32Å; T110-T114 WeakPolarHBondContact O-CB 3.28Å; T110-T114 PolarHBondContact O-N 3.27Å; T110-T114 PolarHBondContact O-OG1 3.15Å; V111-T114 PolarHBondContact O-N 2.92Å; I112-T114 VanDerWaalsContact C-N 3.27Å; I112-T114 PolarHBondContact O-N 3.11Å; T114-V116 PolarHBondContact O-N 3.12Å; T114-S117 WeakPolarHBondContact O-CB 3.05Å; T114-S117 PolarHBondContact O-N 3.39Å; T114-S117 VanDerWaalsContact O-N 3.14Å; T114-F118 HydrophobicContact CG2-CD2 3.71Å; T114-F118 HydrophobicContact CG2-CE2 3.57Å; T114-F118 VanDerWaalsContact O-CD2 3.26Å; T114-F118 WeakPolarHBondContact O-CD2 3.44Å; T114-F118 PolarHBondContact O-N 3.17Å
115I87.7Confident84.3Confident97 Ų9781.1 Ų81.150%0.49744%0.444SS..Hα-helixtrans-58-48.8177.1-68.4166.8000110.7V111 I112 S117 F118 C119V111-I115 HydrophobicContact CG1-CD1 3.7Å; V111-I115 HydrophobicContact CG1-CG1 4.41Å; V111-I115 VanDerWaalsContact O-CG1 3.29Å; V111-I115 WeakPolarHBondContact O-CG1 3.13Å; V111-I115 PolarHBondContact O-N 3.3Å; I112-I115 PolarHBondContact O-N 3.03Å; I115-S117 VanDerWaalsContact C-N 3.26Å; I115-S117 PolarHBondContact O-N 3.39Å; I115-F118 PolarHBondContact O-N 3.38Å; I115-F118 VanDerWaalsContact O-N 3.16Å; I115-C119 WeakPolarHBondContact O-CB 3.17Å; I115-C119 PolarHBondContact O-N 2.76Å; I115-C119 PolarHBondContact O-SG 3.36Å
116V87.9Confident84.2Confident66 Ų6683.8 Ų83.840%0.445%0.454SS..Hα-helixtrans-59.2-39.8177.7170.40000111.1I112 T114 C119 R120I112-V116 HydrophobicContact CG2-CG2 4.26Å; I112-V116 WeakPolarHBondContact O-CB 3.4Å; I112-V116 VanDerWaalsContact O-CG2 3.29Å; I112-V116 WeakPolarHBondContact O-CG2 3.23Å; I112-V116 PolarHBondContact O-N 2.93Å; T114-V116 PolarHBondContact O-N 3.12Å; V116-C119 PolarHBondContact O-N 3.1Å; V116-R120 WeakPolarHBondContact O-CG 3.35Å; V116-R120 PolarHBondContact O-N 3.12Å
117S84Confident84.1Confident67 Ų6788.2 Ų88.247%0.46948%0.478SS..Hα-helixtrans-65.5-42.9176.7-59.30000111.8C113 T114 I115 R120 V121C113-S117 WeakPolarHBondContact O-CB 3.4Å; C113-S117 PolarHBondContact O-N 3.44Å; C113-S117 PolarHBondContact O-OG 3.46Å; T114-S117 WeakPolarHBondContact O-CB 3.05Å; T114-S117 PolarHBondContact O-N 3.39Å; T114-S117 VanDerWaalsContact O-N 3.14Å; I115-S117 VanDerWaalsContact C-N 3.26Å; I115-S117 PolarHBondContact O-N 3.39Å; S117-R120 PolarHBondContact O-N 3.09Å; S117-V121 PolarHBondContact O-N 3.31Å
118F81.9Confident83.8Confident149 Ų14989.8 Ų89.865%0.65449%0.488SS*.Hα-helixtrans-62.5-45173.1-85.8-74.3000112T114 I115 R120 V121 F122T114-F118 HydrophobicContact CG2-CD2 3.71Å; T114-F118 HydrophobicContact CG2-CE2 3.57Å; T114-F118 VanDerWaalsContact O-CD2 3.26Å; T114-F118 WeakPolarHBondContact O-CD2 3.44Å; T114-F118 PolarHBondContact O-N 3.17Å; I115-F118 PolarHBondContact O-N 3.38Å; I115-F118 VanDerWaalsContact O-N 3.16Å; F118-R120 PolarHBondContact O-N 3.09Å; F118-V121 PolarHBondContact O-N 3.16Å; F118-V121 VanDerWaalsContact O-N 3.09Å; F118-F122 PolarHBondContact O-N 3.4Å
119C88.1Confident83.4Confident80 Ų8090.5 Ų90.554%0.54149%0.489SS..Hα-helixtrans-62.9-25.1177.4-69.10000113.2I115 V116 P123I115-C119 WeakPolarHBondContact O-CB 3.17Å; I115-C119 PolarHBondContact O-N 2.76Å; I115-C119 PolarHBondContact O-SG 3.36Å; V116-C119 PolarHBondContact O-N 3.1Å; C119-P123 WeakPolarHBondContact O-CD 3.45Å
120R83.7Confident83.1Confident195 Ų19595.4 Ų95.474%0.73652%0.516SS*.Hα-helixtrans-74.2-33.1173.6-76.8175.3177.4179.6-0112.9V116 S117 F118V116-R120 WeakPolarHBondContact O-CG 3.35Å; V116-R120 PolarHBondContact O-N 3.12Å; S117-R120 PolarHBondContact O-N 3.09Å; F118-R120 PolarHBondContact O-N 3.09Å
121V79.9Confident82.8Confident74 Ų74101.3 Ų101.345%0.44855%0.547SS..Hα-helixtrans-85-28.1179.7-179.50000111.2S117 F118 S124 L125S117-V121 PolarHBondContact O-N 3.31Å; F118-V121 PolarHBondContact O-N 3.16Å; F118-V121 VanDerWaalsContact O-N 3.09Å; V121-S124 WeakPolarHBondContact O-CA 3.26Å; V121-S124 PolarHBondContact O-N 2.78Å; V121-S124 PolarHBondContact O-OG 2.77Å; V121-L125 HydrophobicContact CG1-CD1 4.27Å; V121-L125 HydrophobicContact CG1-CG 4.18Å; V121-L125 PolarHBondContact O-N 3.24Å
122F73.7Confident82.4Confident153 Ų153103.3 Ų103.367%0.67156%0.555SS**G310 helixtrans-55.5-41-177.5-168.9-93.5000114.5F118 S124 L125F118-F122 PolarHBondContact O-N 3.4Å; F122-S124 PolarHBondContact O-N 3.08Å; F122-S124 VanDerWaalsContact O-N 3.15Å; F122-L125 PolarHBondContact O-N 3.3Å
123P81.2Confident81.7Confident108 Ų108103.9 Ų103.970%0.70156%0.56SS**G310 helixtrans-64.8-14.1174.2-23.333.7000114.9C119C119-P123 WeakPolarHBondContact O-CD 3.45Å
124S78.3Confident81.4Confident95 Ų95108.7 Ų108.766%0.66458%0.58SS**G310 helixtrans-102.5-2.4179.364.90000114.3V121 F122V121-S124 WeakPolarHBondContact O-CA 3.26Å; V121-S124 PolarHBondContact O-N 2.78Å; V121-S124 PolarHBondContact O-OG 2.77Å; F122-S124 PolarHBondContact O-N 3.08Å; F122-S124 VanDerWaalsContact O-N 3.15Å
125L65.3Low81Confident190 Ų190115.8 Ų115.8100%0.99562%0.616SS**  trans-94.40173-69.2172.3000110.4V121 F122V121-L125 HydrophobicContact CG1-CD1 4.27Å; V121-L125 HydrophobicContact CG1-CG 4.18Å; V121-L125 PolarHBondContact O-N 3.24Å; F122-L125 PolarHBondContact O-N 3.3Å

Retrieved 125 of 125 residues in 184.1 ms (Link to these results)

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