A0A087X620_POEFO Loading...

Solute carrier family 48 member 1b

AlphaFold DB , UniProt , Accession A0A087X620, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 144 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
1M42.4Very low62.8Low222 Ų22299 Ų99100%1.09452%0.519SS*.  082.30-75174.3170.400111.1I3M1-I3 VanDerWaalsContact C-N 3.35Å
2P52.4Low63.6Low87 Ų8799.6 Ų99.657%0.56551%0.51SS*.  trans-72.9-21.2-178.926.9-32000114.5N4 K5 T6P2-N4 PolarHBondContact O-N 3.03Å; P2-K5 PolarHBondContact O-N 3.15Å; P2-T6 PolarHBondContact O-N 2.95Å; P2-T6 PolarHBondContact O-OG1 3.46Å
3I52.9Low64.1Low98 Ų9892.2 Ų92.250%0.50347%0.473SS..Hα-helixtrans-63.3-33.3-174.6-67.9152.6000113.7M1 K5 T6 R7M1-I3 VanDerWaalsContact C-N 3.35Å; I3-K5 VanDerWaalsContact C-N 3.33Å; I3-K5 PolarHBondContact O-N 3.23Å; I3-T6 WeakPolarHBondContact CA-OG1 3.34Å; I3-T6 PolarHBondContact O-OG1 3.4Å; I3-T6 VanDerWaalsContact O-OG1 3.13Å; I3-R7 PolarHBondContact O-N 3.34Å; I3-R7 VanDerWaalsContact O-N 3.15Å
4N61.8Low64.9Low119 Ų11988.6 Ų88.664%0.63646%0.46SS*.Hα-helixtrans-67.9-34.9179-111.214000112P2 V8P2-N4 PolarHBondContact O-N 3.03Å; N4-V8 WeakPolarHBondContact O-CG2 3.45Å; N4-V8 PolarHBondContact O-N 3.22Å
5K64.4Low65.5Low164 Ų16489.4 Ų89.471%0.71346%0.464SS*.Hα-helixtrans-74.7-36.1-176.5-146.7170.1-175171.90111.6P2 I3 S9P2-K5 PolarHBondContact O-N 3.15Å; I3-K5 VanDerWaalsContact C-N 3.33Å; I3-K5 PolarHBondContact O-N 3.23Å; K5-S9 PolarHBondContact O-N 3.45Å; K5-S9 VanDerWaalsContact O-N 3.16Å
6T64.5Low65.8Low16 Ų1684.2 Ų84.210%0.09844%0.439CS..Hα-helixtrans-68.5-40.7172.823.60000112.2P2 I3 V8 S9 V10 Y57 Y131P2-T6 PolarHBondContact O-N 2.95Å; P2-T6 PolarHBondContact O-OG1 3.46Å; I3-T6 WeakPolarHBondContact CA-OG1 3.34Å; I3-T6 PolarHBondContact O-OG1 3.4Å; I3-T6 VanDerWaalsContact O-OG1 3.13Å; T6-V8 VanDerWaalsContact C-N 3.35Å; T6-V8 PolarHBondContact O-N 3.35Å; T6-S9 WeakPolarHBondContact O-CB 3.49Å; T6-S9 PolarHBondContact O-N 3.13Å; T6-S9 VanDerWaalsContact O-N 3.13Å; T6-V10 WeakPolarHBondContact O-CG2 3.33Å; T6-V10 PolarHBondContact O-N 3.28Å; T6-Y57 HydrophobicContact CG2-CD1 3.98Å; T6-Y57 HydrophobicContact CG2-CE1 4.03Å; T6-Y131 WeakPolarHBondContact CG2-OH 3.35Å
7R66.8Low66.3Low162 Ų16280.7 Ų80.761%0.61142%0.422SS*.Hα-helixtrans-63.9-38.5178.7-156.9-178-71-178-3112.6I3 V10 A11I3-R7 PolarHBondContact O-N 3.34Å; I3-R7 VanDerWaalsContact O-N 3.15Å; R7-V10 PolarHBondContact O-N 3.13Å; R7-A11 PolarHBondContact O-N 3.25Å; R7-A11 VanDerWaalsContact O-N 3.09Å
8V69.5Low67Low103 Ų10382.3 Ų82.362%0.62443%0.43SS*.Hα-helixtrans-65.3-39.3172.1173.10000111.5N4 T6 V10 A11 Y12N4-V8 WeakPolarHBondContact O-CG2 3.45Å; N4-V8 PolarHBondContact O-N 3.22Å; T6-V8 VanDerWaalsContact C-N 3.35Å; T6-V8 PolarHBondContact O-N 3.35Å; V8-V10 VanDerWaalsContact C-N 3.35Å; V8-A11 PolarHBondContact O-N 3.25Å; V8-Y12 WeakPolarHBondContact O-CB 3.4Å; V8-Y12 PolarHBondContact O-N 3.46Å
9S68.1Low67.4Low37 Ų3783.7 Ų83.726%0.25944%0.437SS..Hα-helixtrans-64-39175.4-155.40000112.2K5 T6 Y12 S13 H54K5-S9 PolarHBondContact O-N 3.45Å; K5-S9 VanDerWaalsContact O-N 3.16Å; T6-S9 WeakPolarHBondContact O-CB 3.49Å; T6-S9 PolarHBondContact O-N 3.13Å; T6-S9 VanDerWaalsContact O-N 3.13Å; S9-Y12 PolarHBondContact O-N 3.4Å; S9-S13 PolarHBondContact O-N 3.36Å; S9-S13 PolarHBondContact O-OG 2.92Å; S9-H54 PolarHBondContact OG-CE1 2.83Å; S9-H54 VanDerWaalsContact OG-CE1 3.31Å; S9-H54 PolarHBondContact OG-NE2 2.92Å
10V73.7Confident67.7Low31 Ų3179.6 Ų79.619%0.18842%0.416CS..Hα-helixtrans-62.5-46.7174.7172.80000111.1T6 R7 V8 Y12 S13 S14 L51 H54 L58T6-V10 WeakPolarHBondContact O-CG2 3.33Å; T6-V10 PolarHBondContact O-N 3.28Å; R7-V10 PolarHBondContact O-N 3.13Å; V8-V10 VanDerWaalsContact C-N 3.35Å; V10-Y12 VanDerWaalsContact C-N 3.28Å; V10-Y12 PolarHBondContact O-N 3.03Å; V10-S13 PolarHBondContact O-N 3.31Å; V10-S14 PolarHBondContact O-N 3.44Å; V10-S14 PolarHBondContact O-OG 3.11Å; V10-L51 HydrophobicContact CG1-CD1 4.46Å; V10-H54 HydrophobicContact CG2-CB 3.59Å; V10-L58 HydrophobicContact CG2-CD1 4.05Å
11A74.7Confident68.1Low50 Ų5079.3 Ų79.341%0.41342%0.418SS..Hα-helixtrans-63.1-36176.400000112.1R7 V8 S14 L15R7-A11 PolarHBondContact O-N 3.25Å; R7-A11 VanDerWaalsContact O-N 3.09Å; V8-A11 PolarHBondContact O-N 3.25Å; A11-S14 WeakPolarHBondContact CA-OG 3.4Å; A11-S14 PolarHBondContact O-OG 3.05Å; A11-L15 WeakPolarHBondContact O-CG 3.46Å; A11-L15 PolarHBondContact O-N 2.87Å
12Y72.1Confident69.7Low106 Ų10671.6 Ų71.642%0.41639%0.386SS..Hα-helixtrans-68.1-43.2176-167.1-104.1000112V8 S9 V10 L15 G16 K119 W120V8-Y12 WeakPolarHBondContact O-CB 3.4Å; V8-Y12 PolarHBondContact O-N 3.46Å; S9-Y12 PolarHBondContact O-N 3.4Å; V10-Y12 VanDerWaalsContact C-N 3.28Å; V10-Y12 PolarHBondContact O-N 3.03Å; Y12-L15 PolarHBondContact O-N 3.32Å; Y12-G16 PolarHBondContact O-N 3.36Å; Y12-K119 PolarHBondContact OH-NZ 3.23Å; Y12-W120 AromaticContact CD1-CH2 3.41Å; Y12-W120 HydrophobicContact CD1-CH2 3.41Å; Y12-W120 VanDerWaalsContact CD1-CH2 3.41Å; Y12-W120 AromaticContact CD1-CZ3 3.65Å; Y12-W120 HydrophobicContact CD1-CZ3 3.65Å; Y12-W120 AromaticContact CE1-CH2 3.32Å; Y12-W120 HydrophobicContact CE1-CH2 3.32Å; Y12-W120 HydrophobicContact CE1-CZ2 4.1Å; Y12-W120 AromaticContact CE1-CZ3 3.77Å; Y12-W120 HydrophobicContact CE1-CZ3 3.77Å; Y12-W120 HydrophobicContact CG-CH2 4.36Å; Y12-W120 WeakPolarHBondContact O-CH2 3.34Å
13S70.5Confident70.5Confident4 Ų467.7 Ų67.73%0.02836%0.361CS..Hα-helixtrans-66.8-35.6176.1-690000112.6S9 V10 G16 V17 T50S9-S13 PolarHBondContact O-N 3.36Å; S9-S13 PolarHBondContact O-OG 2.92Å; V10-S13 PolarHBondContact O-N 3.31Å; S13-G16 WeakPolarHBondContact O-CA 3.45Å; S13-G16 PolarHBondContact O-N 3.15Å; S13-G16 VanDerWaalsContact O-N 3.16Å; S13-V17 WeakPolarHBondContact O-CG2 3.49Å; S13-V17 PolarHBondContact O-N 3.09Å; S13-T50 WeakPolarHBondContact CB-OG1 3.37Å; S13-T50 PolarHBondContact OG-OG1 3.32Å
14S74.3Confident71.5Confident42 Ų4267 Ų6729%0.29435%0.354SS..Hα-helixtrans-66.5-40.4177.661.60000111.6V10 A11 G16 V17 I18V10-S14 PolarHBondContact O-N 3.44Å; V10-S14 PolarHBondContact O-OG 3.11Å; A11-S14 WeakPolarHBondContact CA-OG 3.4Å; A11-S14 PolarHBondContact O-OG 3.05Å; S14-G16 VanDerWaalsContact C-N 3.29Å; S14-G16 PolarHBondContact O-N 3.16Å; S14-V17 PolarHBondContact O-N 3.42Å; S14-I18 WeakPolarHBondContact O-CG1 3.37Å; S14-I18 PolarHBondContact O-N 3.17Å
15L74.3Confident72.1Confident100 Ų10065.3 Ų65.352%0.52435%0.345SS..Hα-helixtrans-60.5-40.7170.6-68.6172.5000111.4A11 Y12 V17 I18 L19A11-L15 WeakPolarHBondContact O-CG 3.46Å; A11-L15 PolarHBondContact O-N 2.87Å; Y12-L15 PolarHBondContact O-N 3.32Å; L15-V17 PolarHBondContact O-N 2.88Å; L15-I18 PolarHBondContact O-N 2.92Å; L15-L19 WeakPolarHBondContact O-CB 3.42Å; L15-L19 VanDerWaalsContact O-CG 3.22Å; L15-L19 WeakPolarHBondContact O-CG 3.39Å; L15-L19 PolarHBondContact O-N 3.38Å
16G71.1Confident72.6Confident6 Ų660 Ų606%0.06233%0.326CS..Hα-helixtrans-58.6-42.4174.200000113.6Y12 S13 S14 G20Y12-G16 PolarHBondContact O-N 3.36Å; S13-G16 WeakPolarHBondContact O-CA 3.45Å; S13-G16 PolarHBondContact O-N 3.15Å; S13-G16 VanDerWaalsContact O-N 3.16Å; S14-G16 VanDerWaalsContact C-N 3.29Å; S14-G16 PolarHBondContact O-N 3.16Å; G16-G20 PolarHBondContact O-N 3.16Å
17V74.5Confident72.8Confident25 Ų2561 Ų6115%0.15233%0.328CS..Hα-helixtrans-63.7-47.8175.7174.50000111.1S13 S14 L15 L19 G20 V21 A47 L48S13-V17 WeakPolarHBondContact O-CG2 3.49Å; S13-V17 PolarHBondContact O-N 3.09Å; S14-V17 PolarHBondContact O-N 3.42Å; L15-V17 PolarHBondContact O-N 2.88Å; V17-L19 VanDerWaalsContact C-N 3.31Å; V17-L19 PolarHBondContact O-N 2.9Å; V17-G20 PolarHBondContact O-N 3.44Å; V17-V21 HydrophobicContact CG1-CG2 4.3Å; V17-V21 WeakPolarHBondContact O-CG2 3.36Å; V17-V21 PolarHBondContact O-N 3.2Å; V17-A47 HydrophobicContact CG2-CB 3.84Å; V17-L48 HydrophobicContact CG1-CD1 4.1Å; V17-L48 VanDerWaalsContact CG2-CA 3.5Å; V17-L48 HydrophobicContact CG2-CB 3.85Å; V17-L48 HydrophobicContact CG2-CD1 4.49Å; V17-L48 VanDerWaalsContact CG2-N 3.33Å
18I77.6Confident72.9Confident109 Ų10957.1 Ų57.156%0.55932%0.319SS*.Hα-helixtrans-60.3-44.8-179.7-66164.1000110.3S14 L15 S22S14-I18 WeakPolarHBondContact O-CG1 3.37Å; S14-I18 PolarHBondContact O-N 3.17Å; L15-I18 PolarHBondContact O-N 2.92Å; I18-S22 WeakPolarHBondContact O-CB 3.33Å; I18-S22 PolarHBondContact O-N 3.34Å
19L74.8Confident73Confident109 Ų10958 Ų5857%0.57132%0.32SS*.Hα-helixtrans-66.4-40178.7-68.7171.5000112.3L15 V17 A23L15-L19 WeakPolarHBondContact O-CB 3.42Å; L15-L19 VanDerWaalsContact O-CG 3.22Å; L15-L19 WeakPolarHBondContact O-CG 3.39Å; L15-L19 PolarHBondContact O-N 3.38Å; V17-L19 VanDerWaalsContact C-N 3.31Å; V17-L19 PolarHBondContact O-N 2.9Å; L19-A23 WeakPolarHBondContact O-CB 3.38Å; L19-A23 PolarHBondContact O-N 3.13Å
20G74.5Confident73.1Confident1 Ų160.9 Ų60.91%0.0134%0.335CS..Hα-helixtrans-66.8-42.4176.700000113.3G16 V17 A23 F24G16-G20 PolarHBondContact O-N 3.16Å; V17-G20 PolarHBondContact O-N 3.44Å; G20-A23 PolarHBondContact O-N 3.48Å; G20-F24 PolarHBondContact O-N 3.27Å
21V75.9Confident72.7Confident75 Ų7563.2 Ų63.246%0.45534%0.341SS..Hα-helixtrans-67.3-41.4175.9173.50000111V17 A23 F24 L25V17-V21 HydrophobicContact CG1-CG2 4.3Å; V17-V21 WeakPolarHBondContact O-CG2 3.36Å; V17-V21 PolarHBondContact O-N 3.2Å; V21-A23 VanDerWaalsContact C-N 3.34Å; V21-A23 PolarHBondContact O-N 3.22Å; V21-F24 WeakPolarHBondContact O-CB 3.24Å; V21-F24 PolarHBondContact O-N 2.72Å; V21-L25 HydrophobicContact CG1-CD1 4.17Å; V21-L25 WeakPolarHBondContact O-CG 3.46Å; V21-L25 PolarHBondContact O-N 3Å
22S75.8Confident72Confident60 Ų6068.9 Ų68.942%0.4236%0.356SS..Hα-helixtrans-58.9-46174.8179.40000111.4I18 F24 L25 V26I18-S22 WeakPolarHBondContact O-CB 3.33Å; I18-S22 PolarHBondContact O-N 3.34Å; S22-F24 PolarHBondContact O-N 2.93Å; S22-L25 PolarHBondContact O-N 3.2Å; S22-V26 WeakPolarHBondContact O-CB 3.31Å; S22-V26 VanDerWaalsContact O-CG2 3.32Å; S22-V26 WeakPolarHBondContact O-CG2 3.47Å; S22-V26 PolarHBondContact O-N 3.5Å
23A69.2Low71.5Confident5 Ų566.1 Ų66.14%0.04135%0.347CS..Hα-helixtrans-64.5-39176.800000113L19 G20 V21 L25 W27 W113L19-A23 WeakPolarHBondContact O-CB 3.38Å; L19-A23 PolarHBondContact O-N 3.13Å; G20-A23 PolarHBondContact O-N 3.48Å; V21-A23 VanDerWaalsContact C-N 3.34Å; V21-A23 PolarHBondContact O-N 3.22Å; A23-L25 VanDerWaalsContact C-N 3.34Å; A23-L25 PolarHBondContact O-N 3.34Å; A23-W27 HydrophobicContact CB-CE3 4.15Å; A23-W27 HydrophobicContact CB-CZ3 4.21Å; A23-W27 PolarHBondContact O-N 3.39Å; A23-W113 HydrophobicContact CB-CD2 4.39Å; A23-W113 HydrophobicContact CB-CH2 3.27Å; A23-W113 HydrophobicContact CB-CZ2 3.1Å; A23-W113 HydrophobicContact CB-CZ3 3.99Å
24F74.5Confident71.2Confident82 Ų8273.3 Ų73.336%0.3638%0.38SS..Hα-helixtrans-58.2-46.9173.2179.8-98000111.6G20 V21 S22 N28 G37G20-F24 PolarHBondContact O-N 3.27Å; V21-F24 WeakPolarHBondContact O-CB 3.24Å; V21-F24 PolarHBondContact O-N 2.72Å; S22-F24 PolarHBondContact O-N 2.93Å; F24-N28 WeakPolarHBondContact O-CB 3.46Å; F24-N28 PolarHBondContact O-N 3.38Å; F24-N28 VanDerWaalsContact O-N 3.1Å; F24-G37 VanDerWaalsContact CD2-O 3.32Å; F24-G37 WeakPolarHBondContact CD2-O 3.44Å
25L73.8Confident70.8Confident85 Ų8579.4 Ų79.445%0.44540%0.397SS..Hα-helixtrans-66.5-47-179.6-70.2169.9000112.2V21 S22 A23 N28 I29V21-L25 HydrophobicContact CG1-CD1 4.17Å; V21-L25 WeakPolarHBondContact O-CG 3.46Å; V21-L25 PolarHBondContact O-N 3Å; S22-L25 PolarHBondContact O-N 3.2Å; A23-L25 VanDerWaalsContact C-N 3.34Å; A23-L25 PolarHBondContact O-N 3.34Å; L25-N28 PolarHBondContact O-N 3.45Å; L25-I29 HydrophobicContact CB-CD1 4.41Å; L25-I29 HydrophobicContact CD2-CD1 4.11Å; L25-I29 VanDerWaalsContact O-CB 3.29Å; L25-I29 WeakPolarHBondContact O-CB 3.46Å; L25-I29 VanDerWaalsContact O-CG1 3.3Å; L25-I29 WeakPolarHBondContact O-CG1 3.37Å; L25-I29 PolarHBondContact O-N 3.13Å
26V75.3Confident70.4Confident52 Ų5274.7 Ų74.732%0.31537%0.373SS..Hα-helixtrans-62.4-47.1-178.5170.30000111.2S22 V30 Y31S22-V26 WeakPolarHBondContact O-CB 3.31Å; S22-V26 VanDerWaalsContact O-CG2 3.32Å; S22-V26 WeakPolarHBondContact O-CG2 3.47Å; S22-V26 PolarHBondContact O-N 3.5Å; V26-V30 WeakPolarHBondContact O-CA 3.41Å; V26-V30 WeakPolarHBondContact O-CB 3.22Å; V26-V30 PolarHBondContact O-N 3.15Å; V26-Y31 HydrophobicContact CG1-CD2 3.99Å; V26-Y31 HydrophobicContact CG1-CE2 3.69Å
27W67.8Low70.3Confident36 Ų3674.5 Ų74.514%0.13637%0.371CS..Hα-helixtrans-75.9-27-177.3-90.9-88.3000114.1A23 Y31 K32 Q33 T36 L109A23-W27 HydrophobicContact CB-CE3 4.15Å; A23-W27 HydrophobicContact CB-CZ3 4.21Å; A23-W27 PolarHBondContact O-N 3.39Å; W27-Y31 HydrophobicContact CD2-CD2 4.36Å; W27-Y31 HydrophobicContact CG-CD2 4.25Å; W27-K32 PolarHBondContact O-N 3.04Å; W27-Q33 PolarHBondContact O-N 3.36Å; W27-T36 HydrophobicContact CD2-CG2 4.04Å; W27-T36 HydrophobicContact CG-CG2 3.85Å; W27-L109 HydrophobicContact CH2-CD2 3.92Å; W27-L109 HydrophobicContact CZ2-CD1 4.18Å; W27-L109 HydrophobicContact CZ2-CD2 3.64Å; W27-L109 HydrophobicContact CZ2-CG 4.33Å
28N69.2Low70.2Confident81 Ų8176.1 Ų76.143%0.43339%0.386SS..Hα-helixtrans-78.2-42.7176.4-160.3-7.5000111.8F24 L25F24-N28 WeakPolarHBondContact O-CB 3.46Å; F24-N28 PolarHBondContact O-N 3.38Å; F24-N28 VanDerWaalsContact O-N 3.1Å; L25-N28 PolarHBondContact O-N 3.45Å
29I71.6Confident69.8Low123 Ų12371.9 Ų71.963%0.63137%0.365SS*.Hα-helixtrans-86.1-45.7-174.9-59.2169.8000112L25L25-I29 HydrophobicContact CB-CD1 4.41Å; L25-I29 HydrophobicContact CD2-CD1 4.11Å; L25-I29 VanDerWaalsContact O-CB 3.29Å; L25-I29 WeakPolarHBondContact O-CB 3.46Å; L25-I29 VanDerWaalsContact O-CG1 3.3Å; L25-I29 WeakPolarHBondContact O-CG1 3.37Å; L25-I29 PolarHBondContact O-N 3.13Å
30V71.1Confident69.6Low97 Ų9766.7 Ų66.759%0.58834%0.337SS*.THydrogen-bonded Turntrans-88.1-50.8-171.6-1760000111.5V26V26-V30 WeakPolarHBondContact O-CA 3.41Å; V26-V30 WeakPolarHBondContact O-CB 3.22Å; V26-V30 PolarHBondContact O-N 3.15Å
31Y63.3Low69.6Low79 Ų7967.4 Ų67.431%0.3135%0.345SS..SBendtrans-94.1-12.9-168.6-64.9-72.8000114.4V26 W27 Q33 P104V26-Y31 HydrophobicContact CG1-CD2 3.99Å; V26-Y31 HydrophobicContact CG1-CE2 3.69Å; W27-Y31 HydrophobicContact CD2-CD2 4.36Å; W27-Y31 HydrophobicContact CG-CD2 4.25Å; Y31-Q33 PolarHBondContact O-N 3.32Å; Y31-Q33 VanDerWaalsContact O-N 3.09Å; Y31-P104 HydrophobicContact CD1-CB 4.3Å; Y31-P104 HydrophobicContact CE1-CB 3.7Å; Y31-P104 HydrophobicContact CE1-CG 4.28Å
32K61.8Low69.5Low169 Ų16966.6 Ų66.674%0.73534%0.338SS*.  trans50.825.1-175.4-65.1-174.2176.5-178.70113.8W27 Q34W27-K32 PolarHBondContact O-N 3.04Å; K32-Q34 PolarHBondContact O-N 3.19Å
33Q60.6Low69.5Low49 Ų4963.9 Ų63.923%0.22932%0.318CS..  trans-98.292.4-178-167.482.2-35.200108.5W27 Y31 W35 T36 G37 R105W27-Q33 PolarHBondContact O-N 3.36Å; Y31-Q33 PolarHBondContact O-N 3.32Å; Y31-Q33 VanDerWaalsContact O-N 3.09Å; Q33-W35 VanDerWaalsContact C-N 3.27Å; Q33-W35 PolarHBondContact O-N 2.91Å; Q33-T36 PolarHBondContact O-N 3.48Å; Q33-G37 PolarHBondContact O-N 3.44Å; Q33-R105 PolarHBondContact NE2-O 2.93Å
34Q65.2Low69.6Low154 Ų15463.9 Ų63.972%0.7232%0.319SS*.Hα-helixtrans-59.8-34-170.6-65.2178.8-30.400113.4K32 A38K32-Q34 PolarHBondContact O-N 3.19Å; Q34-A38 VanDerWaalsContact O-CB 3.31Å; Q34-A38 WeakPolarHBondContact O-CB 3.08Å; Q34-A38 PolarHBondContact O-N 3.29Å
35W65.2Low69.7Low170 Ų17063.9 Ų63.964%0.64433%0.326SS*.Hα-helixtrans-67.3-44.7-178.3-61.297.4000113.1Q33 M39 F90Q33-W35 VanDerWaalsContact C-N 3.27Å; Q33-W35 PolarHBondContact O-N 2.91Å; W35-M39 WeakPolarHBondContact O-CG 3.03Å; W35-M39 PolarHBondContact O-N 3.33Å; W35-F90 HydrophobicContact CB-CE1 4.46Å; W35-F90 HydrophobicContact CB-CZ 4.46Å; W35-F90 HydrophobicContact CE3-CZ 4.39Å
36T66.6Low69.6Low2 Ų260 Ų601%0.01231%0.305CS..Hα-helixtrans-71.5-39.5179.7-44.80000111.2W27 Q33 M39 G40 L109 S110W27-T36 HydrophobicContact CD2-CG2 4.04Å; W27-T36 HydrophobicContact CG-CG2 3.85Å; Q33-T36 PolarHBondContact O-N 3.48Å; T36-M39 PolarHBondContact O-N 3.45Å; T36-G40 PolarHBondContact O-N 3.16Å; T36-L109 HydrophobicContact CG2-CB 4.43Å; T36-S110 WeakPolarHBondContact CB-OG 3.4Å; T36-S110 PolarHBondContact OG1-OG 2.87Å
37G68.6Low69.4Low2 Ų257.5 Ų57.52%0.02129%0.29CS..Hα-helixtrans-59.2-49.6173.300000111.5F24 Q33 M39 G40 G41F24-G37 VanDerWaalsContact CD2-O 3.32Å; F24-G37 WeakPolarHBondContact CD2-O 3.44Å; Q33-G37 PolarHBondContact O-N 3.44Å; G37-M39 VanDerWaalsContact C-N 3.3Å; G37-M39 PolarHBondContact O-N 3.39Å; G37-G40 PolarHBondContact O-N 3.27Å; G37-G41 PolarHBondContact O-N 3.24Å
38A72.8Confident69.5Low58 Ų5859.8 Ų59.848%0.47931%0.305SS..Hα-helixtrans-58-40.5179.100000112.8Q34 L42Q34-A38 VanDerWaalsContact O-CB 3.31Å; Q34-A38 WeakPolarHBondContact O-CB 3.08Å; Q34-A38 PolarHBondContact O-N 3.29Å; A38-L42 WeakPolarHBondContact O-CB 3.47Å; A38-L42 PolarHBondContact O-N 3.47Å
39M69.3Low69.7Low21 Ų2158.2 Ų58.210%0.10329%0.293CS..Hα-helixtrans-73.5-37.8178.3-70.7164.985.400113.6W35 T36 G37 G41 L42 S43 A86 F90 S110 W113W35-M39 WeakPolarHBondContact O-CG 3.03Å; W35-M39 PolarHBondContact O-N 3.33Å; T36-M39 PolarHBondContact O-N 3.45Å; G37-M39 VanDerWaalsContact C-N 3.3Å; G37-M39 PolarHBondContact O-N 3.39Å; M39-G41 VanDerWaalsContact C-N 3.33Å; M39-L42 PolarHBondContact O-N 3.24Å; M39-S43 PolarHBondContact O-N 2.89Å; M39-A86 HydrophobicContact CE-CB 4.13Å; M39-F90 HydrophobicContact CE-CD2 3.17Å; M39-F90 HydrophobicContact CE-CE2 3.25Å; M39-F90 HydrophobicContact CE-CG 4.21Å; M39-F90 HydrophobicContact CE-CZ 4.26Å; M39-F90 HydrophobicContact CG-CE2 4.36Å; M39-F90 HydrophobicContact SD-CD2 3.5Å; M39-F90 VanDerWaalsContact SD-CD2 3.5Å; M39-F90 HydrophobicContact SD-CE1 4.3Å; M39-F90 HydrophobicContact SD-CE2 3Å; M39-F90 WeakPolarHBondContact SD-CE2 3.45Å; M39-F90 HydrophobicContact SD-CG 4.39Å; M39-F90 HydrophobicContact SD-CZ 3.45Å; M39-F90 WeakPolarHBondContact SD-CZ 3.46Å; M39-S110 WeakPolarHBondContact CE-O 3.43Å; M39-W113 HydrophobicContact CB-CB 4.39Å
40G70.7Confident69.8Low0 Ų052.5 Ų52.50%026%0.263CS..Hα-helixtrans-62-42.2171.800000111.7T36 G37 S43 G44T36-G40 PolarHBondContact O-N 3.16Å; G37-G40 PolarHBondContact O-N 3.27Å; G40-S43 VanDerWaalsContact O-CB 3.28Å; G40-S43 WeakPolarHBondContact O-CB 3.33Å; G40-S43 PolarHBondContact O-N 3.07Å; G40-G44 PolarHBondContact O-N 3.45Å
41G73.5Confident69.8Low16 Ų1649.7 Ų49.717%0.16525%0.245CC..Hα-helixtrans-62.3-44.8173.200000112.7G37 M39 S43 G44 V45G37-G41 PolarHBondContact O-N 3.24Å; M39-G41 VanDerWaalsContact C-N 3.33Å; G41-S43 VanDerWaalsContact C-N 3.27Å; G41-S43 PolarHBondContact O-N 3.17Å; G41-G44 WeakPolarHBondContact O-CA 3.2Å; G41-G44 PolarHBondContact O-N 3.13Å; G41-V45 WeakPolarHBondContact O-CG2 3.41Å; G41-V45 PolarHBondContact O-N 3.31Å
42L74.4Confident70.3Confident58 Ų5848.7 Ų48.730%0.30424%0.244SC..Hα-helixtrans-60.8-37.2176.2-163.2125.7000111.7A38 M39 V45 L46 F79A38-L42 WeakPolarHBondContact O-CB 3.47Å; A38-L42 PolarHBondContact O-N 3.47Å; M39-L42 PolarHBondContact O-N 3.24Å; L42-V45 PolarHBondContact O-N 3.09Å; L42-L46 HydrophobicContact CD2-CD1 3.82Å; L42-L46 WeakPolarHBondContact O-CD1 3.43Å; L42-L46 WeakPolarHBondContact O-CG 3.32Å; L42-L46 PolarHBondContact O-N 2.97Å; L42-L46 VanDerWaalsContact O-N 3.08Å; L42-F79 HydrophobicContact CD1-CD1 4.36Å; L42-F79 HydrophobicContact CD1-CE1 4.2Å; L42-F79 HydrophobicContact CD2-CD1 4.43Å
43S75.3Confident70.9Confident2 Ų240.7 Ų40.71%0.01421%0.21CC..Hα-helixtrans-61.5-44.3171.6-146.30000112.4M39 G40 G41 L46 A47 S117M39-S43 PolarHBondContact O-N 2.89Å; G40-S43 VanDerWaalsContact O-CB 3.28Å; G40-S43 WeakPolarHBondContact O-CB 3.33Å; G40-S43 PolarHBondContact O-N 3.07Å; G41-S43 VanDerWaalsContact C-N 3.27Å; G41-S43 PolarHBondContact O-N 3.17Å; S43-L46 PolarHBondContact O-N 3.28Å; S43-A47 WeakPolarHBondContact O-CB 3.47Å; S43-A47 PolarHBondContact O-N 2.88Å; S43-S117 WeakPolarHBondContact CA-OG 3.33Å; S43-S117 WeakPolarHBondContact CB-OG 3.47Å; S43-S117 PolarHBondContact N-OG 3.32Å; S43-S117 WeakPolarHBondContact OG-CA 3Å; S43-S117 PolarHBondContact OG-N 2.95Å; S43-S117 PolarHBondContact OG-OG 3.24Å
44G71.6Confident71.4Confident6 Ų639 Ų396%0.06220%0.202CC..Hα-helixtrans-62.6-43177.300000112.9G40 G41 L46 A47 L48G40-G44 PolarHBondContact O-N 3.45Å; G41-G44 WeakPolarHBondContact O-CA 3.2Å; G41-G44 PolarHBondContact O-N 3.13Å; G44-L46 PolarHBondContact O-N 3.3Å; G44-A47 PolarHBondContact O-N 2.9Å; G44-L48 WeakPolarHBondContact O-CB 3.4Å; G44-L48 PolarHBondContact O-N 3.28Å
45V76.4Confident71.7Confident82 Ų8234 Ų3450%0.49718%0.181SC..Hα-helixtrans-63.6-41.7176.5176.30000111G41 L42 L48 W49G41-V45 WeakPolarHBondContact O-CG2 3.41Å; G41-V45 PolarHBondContact O-N 3.31Å; L42-V45 PolarHBondContact O-N 3.09Å; V45-L48 WeakPolarHBondContact O-CB 3.39Å; V45-L48 PolarHBondContact O-N 3.31Å; V45-W49 WeakPolarHBondContact O-CB 3.46Å; V45-W49 PolarHBondContact O-N 3.41Å
46L70.6Confident72.1Confident3 Ų327.9 Ų27.92%0.01616%0.16CC..Hα-helixtrans-64.6-42.5175.8-74.2163.8000112.1L42 S43 G44 L48 W49 T50 F79 W120L42-L46 HydrophobicContact CD2-CD1 3.82Å; L42-L46 WeakPolarHBondContact O-CD1 3.43Å; L42-L46 WeakPolarHBondContact O-CG 3.32Å; L42-L46 PolarHBondContact O-N 2.97Å; L42-L46 VanDerWaalsContact O-N 3.08Å; S43-L46 PolarHBondContact O-N 3.28Å; G44-L46 PolarHBondContact O-N 3.3Å; L46-L48 VanDerWaalsContact C-N 3.3Å; L46-L48 PolarHBondContact O-N 3.5Å; L46-W49 WeakPolarHBondContact O-CB 3.46Å; L46-W49 PolarHBondContact O-N 3.19Å; L46-T50 WeakPolarHBondContact O-CG2 3.15Å; L46-T50 PolarHBondContact O-N 3.48Å; L46-F79 HydrophobicContact CD1-CB 4.38Å; L46-F79 HydrophobicContact CD2-CB 3.65Å; L46-F79 HydrophobicContact CD2-CD2 4.21Å; L46-F79 HydrophobicContact CD2-CG 4.02Å; L46-W120 HydrophobicContact CB-CB 4.38Å
47A71.3Confident72.1Confident0 Ų029.8 Ų29.80%017%0.168CC..Hα-helixtrans-61.6-40174.400000111.4V17 S43 G44 W49 T50 L51 W120V17-A47 HydrophobicContact CG2-CB 3.84Å; S43-A47 WeakPolarHBondContact O-CB 3.47Å; S43-A47 PolarHBondContact O-N 2.88Å; G44-A47 PolarHBondContact O-N 2.9Å; A47-W49 VanDerWaalsContact C-N 3.33Å; A47-W49 PolarHBondContact O-N 3.02Å; A47-T50 PolarHBondContact O-N 3.12Å; A47-T50 PolarHBondContact O-OG1 3.24Å; A47-L51 PolarHBondContact O-N 3.3Å; A47-W120 HydrophobicContact CB-CD2 4.25Å; A47-W120 HydrophobicContact CB-CG 4.41Å
48L71.1Confident72.1Confident83 Ų8333.5 Ų33.544%0.43519%0.187SC..Hα-helixtrans-64.6-40.8177-170.2126.7000111.1V17 G44 V45 L46 T50 L51 I52V17-L48 HydrophobicContact CG1-CD1 4.1Å; V17-L48 VanDerWaalsContact CG2-CA 3.5Å; V17-L48 HydrophobicContact CG2-CB 3.85Å; V17-L48 HydrophobicContact CG2-CD1 4.49Å; V17-L48 VanDerWaalsContact CG2-N 3.33Å; G44-L48 WeakPolarHBondContact O-CB 3.4Å; G44-L48 PolarHBondContact O-N 3.28Å; V45-L48 WeakPolarHBondContact O-CB 3.39Å; V45-L48 PolarHBondContact O-N 3.31Å; L46-L48 VanDerWaalsContact C-N 3.3Å; L46-L48 PolarHBondContact O-N 3.5Å; L48-T50 VanDerWaalsContact C-N 3.33Å; L48-T50 PolarHBondContact O-N 2.91Å; L48-L51 WeakPolarHBondContact O-CB 3.48Å; L48-L51 PolarHBondContact O-N 2.94Å; L48-I52 HydrophobicContact CD2-CD1 3.6Å; L48-I52 HydrophobicContact CD2-CG1 4.48Å; L48-I52 HydrophobicContact CG-CD1 4.36Å; L48-I52 VanDerWaalsContact O-CG1 3.31Å; L48-I52 WeakPolarHBondContact O-CG1 3.44Å; L48-I52 PolarHBondContact O-N 3.11Å
49W73.8Confident72Confident49 Ų4936 Ų3619%0.18619%0.189CC..Hα-helixtrans-61.2-40.6173.8-151.6-61.7000111.5V45 L46 A47 I52 T53 F71 F72 M75 L124V45-W49 WeakPolarHBondContact O-CB 3.46Å; V45-W49 PolarHBondContact O-N 3.41Å; L46-W49 WeakPolarHBondContact O-CB 3.46Å; L46-W49 PolarHBondContact O-N 3.19Å; A47-W49 VanDerWaalsContact C-N 3.33Å; A47-W49 PolarHBondContact O-N 3.02Å; W49-I52 PolarHBondContact O-N 3.21Å; W49-T53 PolarHBondContact O-N 3.02Å; W49-T53 VanDerWaalsContact O-N 3.09Å; W49-T53 PolarHBondContact O-OG1 3.47Å; W49-F71 HydrophobicContact CZ2-CE1 4.49Å; W49-F72 AromaticContact CD1-CD1 3.17Å; W49-F72 AromaticContact CD1-CE1 3.03Å; W49-F72 AromaticContact CD1-CG 3.91Å; W49-F72 AromaticContact CD1-CZ 3.7Å; W49-F72 HydrophobicContact CD2-CE1 4.32Å; W49-F72 HydrophobicContact CD2-CZ 4.27Å; W49-F72 AromaticContact CE2-CD1 3.88Å; W49-F72 AromaticContact CE2-CD2 3.83Å; W49-F72 AromaticContact CE2-CE1 3.72Å; W49-F72 AromaticContact CE2-CE2 3.68Å; W49-F72 AromaticContact CE2-CG 3.89Å; W49-F72 AromaticContact CE2-CZ 3.59Å; W49-F72 HydrophobicContact CG-CD1 4.37Å; W49-F72 AromaticContact CG-CE1 3.93Å; W49-F72 HydrophobicContact CG-CE1 3.93Å; W49-F72 HydrophobicContact CG-CZ 4.3Å; W49-F72 AromaticContact CZ2-CD2 3.74Å; W49-F72 HydrophobicContact CZ2-CD2 3.74Å; W49-F72 AromaticContact CZ2-CE2 3.65Å; W49-F72 HydrophobicContact CZ2-CE2 3.65Å; W49-F72 HydrophobicContact CZ2-CG 4.19Å; W49-F72 HydrophobicContact CZ2-CZ 4.03Å; W49-F72 AromaticContact NE1-CD1 2.79Å; W49-F72 AromaticContact NE1-CD2 3.46Å; W49-F72 AromaticContact NE1-CE1 2.91Å; W49-F72 AromaticContact NE1-CE2 3.56Å; W49-F72 AromaticContact NE1-CG 3.05Å; W49-F72 AromaticContact NE1-CZ 3.27Å; W49-F72 VanDerWaalsContact NE1-CZ 3.27Å; W49-M75 HydrophobicContact CH2-CB 4.16Å; W49-M75 HydrophobicContact CH2-CE 4.16Å; W49-M75 HydrophobicContact CH2-CG 4.17Å; W49-M75 HydrophobicContact CZ2-CB 3.94Å; W49-M75 HydrophobicContact CZ2-CG 4.18Å; W49-L124 HydrophobicContact CB-CD2 4.29Å; W49-L124 HydrophobicContact CG-CD2 4.13Å
50T72.2Confident71.9Confident2 Ų239.8 Ų39.81%0.01221%0.209CC..Hα-helixtrans-63.3-40.9173.575.40000112.6S13 L46 A47 L48 T53 H54 W120 L124S13-T50 WeakPolarHBondContact CB-OG1 3.37Å; S13-T50 PolarHBondContact OG-OG1 3.32Å; L46-T50 WeakPolarHBondContact O-CG2 3.15Å; L46-T50 PolarHBondContact O-N 3.48Å; A47-T50 PolarHBondContact O-N 3.12Å; A47-T50 PolarHBondContact O-OG1 3.24Å; L48-T50 VanDerWaalsContact C-N 3.33Å; L48-T50 PolarHBondContact O-N 2.91Å; T50-T53 PolarHBondContact O-N 3.44Å; T50-H54 PolarHBondContact O-CD2 3.47Å; T50-H54 VanDerWaalsContact O-CD2 3.24Å; T50-H54 PolarHBondContact O-N 3.03Å; T50-H54 VanDerWaalsContact O-N 3.13Å; T50-W120 WeakPolarHBondContact CG2-O 3.44Å; T50-L124 HydrophobicContact CG2-CB 3.63Å; T50-L124 HydrophobicContact CG2-CD1 4.01Å; T50-L124 HydrophobicContact CG2-CD2 4.45Å; T50-L124 HydrophobicContact CG2-CG 4.23Å
51L70.9Confident71.8Confident39 Ų3946.4 Ų46.420%0.20424%0.235CC..Hα-helixtrans-65-46.6178.4-173.7132.3000111.2V10 A47 L48 T53 H54 V55V10-L51 HydrophobicContact CG1-CD1 4.46Å; A47-L51 PolarHBondContact O-N 3.3Å; L48-L51 WeakPolarHBondContact O-CB 3.48Å; L48-L51 PolarHBondContact O-N 2.94Å; L51-T53 PolarHBondContact O-N 3.28Å; L51-H54 PolarHBondContact O-N 2.76Å; L51-H54 VanDerWaalsContact O-N 3.17Å; L51-V55 HydrophobicContact CD2-CG2 4.09Å; L51-V55 HydrophobicContact CG-CG2 4.4Å; L51-V55 WeakPolarHBondContact O-CG2 3.13Å; L51-V55 PolarHBondContact O-N 3.27Å
52I75.4Confident71.4Confident58 Ų5845.7 Ų45.730%0.29723%0.228SC..Hα-helixtrans-56.7-43.2175.9-68.7165.3000110.3L48 W49 H54 V55 M56 F72L48-I52 HydrophobicContact CD2-CD1 3.6Å; L48-I52 HydrophobicContact CD2-CG1 4.48Å; L48-I52 HydrophobicContact CG-CD1 4.36Å; L48-I52 VanDerWaalsContact O-CG1 3.31Å; L48-I52 WeakPolarHBondContact O-CG1 3.44Å; L48-I52 PolarHBondContact O-N 3.11Å; W49-I52 PolarHBondContact O-N 3.21Å; I52-H54 VanDerWaalsContact C-N 3.32Å; I52-H54 PolarHBondContact O-N 3.13Å; I52-V55 PolarHBondContact O-N 3.13Å; I52-M56 HydrophobicContact CG2-CG 4.16Å; I52-M56 HydrophobicContact CG2-SD 3.83Å; I52-M56 WeakPolarHBondContact O-CB 3.42Å; I52-M56 WeakPolarHBondContact O-CG 3.45Å; I52-M56 PolarHBondContact O-N 2.99Å; I52-F72 HydrophobicContact CB-CE1 4.42Å; I52-F72 HydrophobicContact CG2-CE1 4.02Å; I52-F72 HydrophobicContact CG2-CZ 4Å
53T72.9Confident70.8Confident1 Ų150.3 Ų50.31%0.00624%0.241CC..Hα-helixtrans-62.4-40.3-179.3-440000111.8W49 T50 L51 Y57 W62 F72 L124W49-T53 PolarHBondContact O-N 3.02Å; W49-T53 VanDerWaalsContact O-N 3.09Å; W49-T53 PolarHBondContact O-OG1 3.47Å; T50-T53 PolarHBondContact O-N 3.44Å; L51-T53 PolarHBondContact O-N 3.28Å; T53-Y57 WeakPolarHBondContact O-CB 3.36Å; T53-Y57 PolarHBondContact O-N 3.41Å; T53-Y57 VanDerWaalsContact O-N 3.15Å; T53-W62 HydrophobicContact CG2-CZ2 4.07Å; T53-W62 PolarHBondContact O-NE1 3.26Å; T53-F72 WeakPolarHBondContact OG1-CD1 3.3Å; T53-L124 HydrophobicContact CG2-CD1 4.34Å; T53-L124 WeakPolarHBondContact OG1-CD1 3.39Å
54H71.6Confident70.4Confident14 Ų1456.1 Ų56.17%0.06528%0.276CS..Hα-helixtrans-71.2-40175.3-73.2-54000113.3S9 V10 T50 L51 I52 Y57 L58 Y131S9-H54 PolarHBondContact OG-CE1 2.83Å; S9-H54 VanDerWaalsContact OG-CE1 3.31Å; S9-H54 PolarHBondContact OG-NE2 2.92Å; V10-H54 HydrophobicContact CG2-CB 3.59Å; T50-H54 PolarHBondContact O-CD2 3.47Å; T50-H54 VanDerWaalsContact O-CD2 3.24Å; T50-H54 PolarHBondContact O-N 3.03Å; T50-H54 VanDerWaalsContact O-N 3.13Å; L51-H54 PolarHBondContact O-N 2.76Å; L51-H54 VanDerWaalsContact O-N 3.17Å; I52-H54 VanDerWaalsContact C-N 3.32Å; I52-H54 PolarHBondContact O-N 3.13Å; H54-Y57 PolarHBondContact O-N 2.9Å; H54-L58 WeakPolarHBondContact O-CG 3.49Å; H54-L58 PolarHBondContact O-N 3.5Å; H54-Y131 PolarHBondContact CE1-OH 2.96Å; H54-Y131 AromaticContact ND1-CZ 3.93Å; H54-Y131 PolarHBondContact ND1-OH 2.95Å
55V71.6Confident70.4Confident47 Ų4762.2 Ų62.229%0.28530%0.297SS..Hα-helixtrans-65.5-46.5177.5171.60000110.6L51 I52 Y57 L58 Q59L51-V55 HydrophobicContact CD2-CG2 4.09Å; L51-V55 HydrophobicContact CG-CG2 4.4Å; L51-V55 WeakPolarHBondContact O-CG2 3.13Å; L51-V55 PolarHBondContact O-N 3.27Å; I52-V55 PolarHBondContact O-N 3.13Å; V55-Y57 PolarHBondContact O-N 2.94Å; V55-L58 PolarHBondContact O-N 3.32Å; V55-L58 VanDerWaalsContact O-N 3.11Å; V55-Q59 WeakPolarHBondContact O-CG 3.33Å; V55-Q59 PolarHBondContact O-N 2.9Å
56M74.3Confident69.9Low42 Ų4262.8 Ų62.821%0.20730%0.297CS..Hα-helixtrans-64.2-29.1176.7-75.9-174135.300112.9I52 D60 Y61 W62 W65I52-M56 HydrophobicContact CG2-CG 4.16Å; I52-M56 HydrophobicContact CG2-SD 3.83Å; I52-M56 WeakPolarHBondContact O-CB 3.42Å; I52-M56 WeakPolarHBondContact O-CG 3.45Å; I52-M56 PolarHBondContact O-N 2.99Å; M56-D60 PolarHBondContact O-N 3.26Å; M56-Y61 PolarHBondContact O-N 3.45Å; M56-W62 HydrophobicContact SD-CZ2 4.22Å; M56-W65 HydrophobicContact CE-CE3 4.34Å; M56-W65 HydrophobicContact CE-CZ3 4.07Å
57Y66.6Low69.9Low42 Ų4271.3 Ų71.317%0.16533%0.334CS..Hα-helixtrans-69.5-42.4171.2178-95.9000111.9T6 T53 H54 V55 Q59 D60 Y131 E134 F135T6-Y57 HydrophobicContact CG2-CD1 3.98Å; T6-Y57 HydrophobicContact CG2-CE1 4.03Å; T53-Y57 WeakPolarHBondContact O-CB 3.36Å; T53-Y57 PolarHBondContact O-N 3.41Å; T53-Y57 VanDerWaalsContact O-N 3.15Å; H54-Y57 PolarHBondContact O-N 2.9Å; V55-Y57 PolarHBondContact O-N 2.94Å; Y57-Q59 PolarHBondContact O-N 2.94Å; Y57-D60 PolarHBondContact O-N 3.28Å; Y57-Y131 HydrophobicContact CD1-CD1 4.33Å; Y57-Y131 AromaticContact CD1-CE1 3.62Å; Y57-Y131 HydrophobicContact CD1-CE1 3.62Å; Y57-Y131 AromaticContact CD1-CZ 3.8Å; Y57-Y131 AromaticContact CD2-CD1 3.24Å; Y57-Y131 HydrophobicContact CD2-CD1 3.24Å; Y57-Y131 HydrophobicContact CD2-CD2 4.07Å; Y57-Y131 AromaticContact CD2-CE1 3.4Å; Y57-Y131 HydrophobicContact CD2-CE1 3.4Å; Y57-Y131 VanDerWaalsContact CD2-CE1 3.4Å; Y57-Y131 HydrophobicContact CD2-CE2 4.22Å; Y57-Y131 AromaticContact CD2-CG 3.59Å; Y57-Y131 HydrophobicContact CD2-CG 3.59Å; Y57-Y131 AromaticContact CD2-CZ 3.89Å; Y57-Y131 HydrophobicContact CE1-CD1 4.22Å; Y57-Y131 AromaticContact CE1-CE1 3.59Å; Y57-Y131 HydrophobicContact CE1-CE1 3.59Å; Y57-Y131 AromaticContact CE2-CD1 3.1Å; Y57-Y131 HydrophobicContact CE2-CD1 3.1Å; Y57-Y131 AromaticContact CE2-CE1 3.37Å; Y57-Y131 HydrophobicContact CE2-CE1 3.37Å; Y57-Y131 AromaticContact CE2-CG 3.86Å; Y57-Y131 HydrophobicContact CE2-CG 3.86Å; Y57-Y131 AromaticContact CG-CD1 3.86Å; Y57-Y131 HydrophobicContact CG-CD1 3.86Å; Y57-Y131 HydrophobicContact CG-CD2 4.34Å; Y57-Y131 AromaticContact CG-CE1 3.51Å; Y57-Y131 HydrophobicContact CG-CE1 3.51Å; Y57-Y131 HydrophobicContact CG-CE2 4.05Å; Y57-Y131 HydrophobicContact CG-CG 4.26Å; Y57-Y131 AromaticContact CG-CZ 3.6Å; Y57-Y131 AromaticContact CZ-CD1 3.62Å; Y57-Y131 AromaticContact CZ-CE1 3.44Å; Y57-Y131 VanDerWaalsContact CZ-CE1 3.44Å; Y57-E134 PolarHBondContact OH-OE2 2.94Å; Y57-F135 HydrophobicContact CD2-CE2 4.04Å; Y57-F135 HydrophobicContact CD2-CZ 4.15Å; Y57-F135 HydrophobicContact CE2-CE2 4.07Å; Y57-F135 HydrophobicContact CE2-CZ 4.11Å
58L67.6Low70Confident80 Ų8071.5 Ų71.542%0.41934%0.337SS..Hα-helixtrans-66.2-25.6176.4-73.3172.7000113.4V10 H54 V55V10-L58 HydrophobicContact CG2-CD1 4.05Å; H54-L58 WeakPolarHBondContact O-CG 3.49Å; H54-L58 PolarHBondContact O-N 3.5Å; V55-L58 PolarHBondContact O-N 3.32Å; V55-L58 VanDerWaalsContact O-N 3.11Å
59Q71.1Confident70.1Confident112 Ų11267.8 Ų67.852%0.52332%0.317SS..THydrogen-bonded Turntrans-92.26.2178.1-66.7-179.5-19.400113.5V55 Y57 Y61V55-Q59 WeakPolarHBondContact O-CG 3.33Å; V55-Q59 PolarHBondContact O-N 2.9Å; Y57-Q59 PolarHBondContact O-N 2.94Å; Q59-Y61 HydrophobicContact CB-CD2 3.69Å; Q59-Y61 HydrophobicContact CB-CE2 4.29Å; Q59-Y61 PolarHBondContact O-N 3.47Å
60D67.8Low69.9Low100 Ų10071.5 Ų71.554%0.53533%0.334SS..THydrogen-bonded Turntrans56.610.2-178.4-89.9-59.4000116.1M56 Y57 W62 R63M56-D60 PolarHBondContact O-N 3.26Å; Y57-D60 PolarHBondContact O-N 3.28Å; D60-W62 PolarHBondContact O-N 3.18Å; D60-R63 WeakPolarHBondContact O-CB 3.43Å; D60-R63 PolarHBondContact O-N 3.45Å; D60-R63 VanDerWaalsContact O-N 3.16Å
61Y66.9Low70Confident139 Ų13977.3 Ų77.355%0.54536%0.36SS..G310 helixtrans-61.9-26.2179.6-95.1-76.2000113.5M56 Q59 R63 T64 W65M56-Y61 PolarHBondContact O-N 3.45Å; Q59-Y61 HydrophobicContact CB-CD2 3.69Å; Q59-Y61 HydrophobicContact CB-CE2 4.29Å; Q59-Y61 PolarHBondContact O-N 3.47Å; Y61-R63 PolarHBondContact O-N 3.35Å; Y61-T64 PolarHBondContact O-N 2.93Å; Y61-T64 PolarHBondContact O-OG1 3.4Å; Y61-W65 PolarHBondContact O-N 3.32Å
62W65.2Low70.2Confident1 Ų176.8 Ų76.80%0.00436%0.356CS..G310 helixtrans-65.1-23.4178.9-76.7118.5000113.5T53 M56 D60 T64 W65 G68 L69 F72 F135T53-W62 HydrophobicContact CG2-CZ2 4.07Å; T53-W62 PolarHBondContact O-NE1 3.26Å; M56-W62 HydrophobicContact SD-CZ2 4.22Å; D60-W62 PolarHBondContact O-N 3.18Å; W62-T64 VanDerWaalsContact C-N 3.3Å; W62-T64 PolarHBondContact O-N 3.37Å; W62-W65 HydrophobicContact CZ3-CE3 4.48Å; W62-W65 PolarHBondContact O-N 2.64Å; W62-G68 VanDerWaalsContact CZ3-C 3.44Å; W62-L69 HydrophobicContact CD2-CB 4.28Å; W62-L69 HydrophobicContact CD2-CD1 3.77Å; W62-L69 HydrophobicContact CD2-CG 4.42Å; W62-L69 HydrophobicContact CE3-CB 3.48Å; W62-L69 VanDerWaalsContact CE3-CB 3.48Å; W62-L69 HydrophobicContact CE3-CD1 3.82Å; W62-L69 HydrophobicContact CE3-CD2 4.49Å; W62-L69 HydrophobicContact CE3-CG 4.1Å; W62-L69 VanDerWaalsContact CH2-CA 3.49Å; W62-L69 HydrophobicContact CH2-CB 3.97Å; W62-L69 HydrophobicContact CH2-CD1 3.67Å; W62-L69 HydrophobicContact CH2-CG 4.42Å; W62-L69 HydrophobicContact CZ2-CD1 3.58Å; W62-L69 HydrophobicContact CZ3-CB 3.37Å; W62-L69 HydrophobicContact CZ3-CD1 3.84Å; W62-L69 HydrophobicContact CZ3-CG 4.17Å; W62-F72 HydrophobicContact CH2-CB 4.26Å; W62-F72 HydrophobicContact CH2-CD1 4.22Å; W62-F72 HydrophobicContact CH2-CD2 4.38Å; W62-F72 HydrophobicContact CH2-CG 4.02Å; W62-F72 HydrophobicContact CZ2-CD1 4.17Å; W62-F72 HydrophobicContact CZ2-CG 4.42Å; W62-F135 HydrophobicContact CB-CE2 3.93Å; W62-F135 HydrophobicContact CB-CZ 4.13Å
63R62.3Low69.9Low155 Ų15575.1 Ų75.159%0.58535%0.348SS*.G310 helixtrans-65.4-35.1179.1-146.7179.4-159-120.33.9111.7D60 Y61 F135 I138D60-R63 WeakPolarHBondContact O-CB 3.43Å; D60-R63 PolarHBondContact O-N 3.45Å; D60-R63 VanDerWaalsContact O-N 3.16Å; Y61-R63 PolarHBondContact O-N 3.35Å; R63-F135 HydrophobicContact CB-CE1 4.23Å; R63-F135 HydrophobicContact CG-CD1 4.25Å; R63-F135 HydrophobicContact CG-CE1 4.14Å; R63-I138 VanDerWaalsContact NH2-CG2 3.3Å
64T67.4Low70.1Confident123 Ų12379 Ų7976%0.75537%0.374SS*.THydrogen-bonded Turntrans-90.3-18.7177.449.90000113.1Y61 W62Y61-T64 PolarHBondContact O-N 2.93Å; Y61-T64 PolarHBondContact O-OG1 3.4Å; W62-T64 VanDerWaalsContact C-N 3.3Å; W62-T64 PolarHBondContact O-N 3.37Å
65W70.6Confident70.3Confident134 Ų13480.9 Ų80.951%0.50838%0.383SS..  trans-126.655.4-173.2-16237.7000115.6M56 Y61 W62 K67 G68M56-W65 HydrophobicContact CE-CE3 4.34Å; M56-W65 HydrophobicContact CE-CZ3 4.07Å; Y61-W65 PolarHBondContact O-N 3.32Å; W62-W65 HydrophobicContact CZ3-CE3 4.48Å; W62-W65 PolarHBondContact O-N 2.64Å; W65-K67 VanDerWaalsContact C-N 3.3Å; W65-K67 PolarHBondContact O-N 3.18Å; W65-G68 PolarHBondContact O-N 2.97Å
66L67.3Low70.3Confident94 Ų9478.7 Ų78.749%0.49237%0.37SS..Hα-helixtrans-63-27.6178.4-75.4164.5000114.7L69L66-L69 PolarHBondContact O-N 2.95Å
67K69.3Low70.2Confident182 Ų18280.4 Ų80.479%0.79138%0.379SS*.Hα-helixtrans-66.8-38.8176.1-76.3-179.4-177.8173.30111.8W65 L69 K70 F71W65-K67 VanDerWaalsContact C-N 3.3Å; W65-K67 PolarHBondContact O-N 3.18Å; K67-L69 PolarHBondContact O-N 3.37Å; K67-K70 PolarHBondContact O-N 2.91Å; K67-F71 PolarHBondContact O-N 2.67Å
68G73.3Confident70.8Confident5 Ų584.1 Ų84.15%0.05240%0.397CS..Hα-helixtrans-61.8-32.7174.900000112.3W62 W65 K70 F71 F72W62-G68 VanDerWaalsContact CZ3-C 3.44Å; W65-G68 PolarHBondContact O-N 2.97Å; G68-K70 VanDerWaalsContact C-N 3.34Å; G68-K70 PolarHBondContact O-N 3.01Å; G68-F71 WeakPolarHBondContact O-CB 3.38Å; G68-F71 PolarHBondContact O-N 2.81Å; G68-F72 PolarHBondContact O-N 3.46Å
69L73.5Confident71.1Confident4 Ų482.3 Ų82.32%0.02139%0.385CS..Hα-helixtrans-68.6-39.2-176.1-170.460.2000110.7W62 L66 K67 F71 F72 L73 A128 R132W62-L69 HydrophobicContact CD2-CB 4.28Å; W62-L69 HydrophobicContact CD2-CD1 3.77Å; W62-L69 HydrophobicContact CD2-CG 4.42Å; W62-L69 HydrophobicContact CE3-CB 3.48Å; W62-L69 VanDerWaalsContact CE3-CB 3.48Å; W62-L69 HydrophobicContact CE3-CD1 3.82Å; W62-L69 HydrophobicContact CE3-CD2 4.49Å; W62-L69 HydrophobicContact CE3-CG 4.1Å; W62-L69 VanDerWaalsContact CH2-CA 3.49Å; W62-L69 HydrophobicContact CH2-CB 3.97Å; W62-L69 HydrophobicContact CH2-CD1 3.67Å; W62-L69 HydrophobicContact CH2-CG 4.42Å; W62-L69 HydrophobicContact CZ2-CD1 3.58Å; W62-L69 HydrophobicContact CZ3-CB 3.37Å; W62-L69 HydrophobicContact CZ3-CD1 3.84Å; W62-L69 HydrophobicContact CZ3-CG 4.17Å; L66-L69 PolarHBondContact O-N 2.95Å; K67-L69 PolarHBondContact O-N 3.37Å; L69-F71 VanDerWaalsContact C-N 3.34Å; L69-F72 PolarHBondContact O-N 2.95Å; L69-L73 WeakPolarHBondContact O-CB 3.41Å; L69-L73 PolarHBondContact O-N 3.03Å; L69-A128 HydrophobicContact CD1-CB 4.33Å; L69-R132 HydrophobicContact CD2-CB 4.26Å
70K70.7Confident71.2Confident127 Ų12778 Ų7855%0.55237%0.367SS*.Hα-helixtrans-63.5-40.3174.1-71.2-176.5177.1178.20111.7K67 G68 L73 C74K67-K70 PolarHBondContact O-N 2.91Å; G68-K70 VanDerWaalsContact C-N 3.34Å; G68-K70 PolarHBondContact O-N 3.01Å; K70-L73 PolarHBondContact O-N 3.43Å; K70-C74 WeakPolarHBondContact O-CB 3.29Å; K70-C74 PolarHBondContact O-N 2.97Å
71F74.8Confident71.5Confident124 Ų12477 Ų7754%0.54437%0.365SS..Hα-helixtrans-64.3-47.7176.6-178.8-98.7000111.7W49 K67 G68 L69 L73 C74 M75W49-F71 HydrophobicContact CZ2-CE1 4.49Å; K67-F71 PolarHBondContact O-N 2.67Å; G68-F71 WeakPolarHBondContact O-CB 3.38Å; G68-F71 PolarHBondContact O-N 2.81Å; L69-F71 VanDerWaalsContact C-N 3.34Å; F71-L73 VanDerWaalsContact C-N 3.27Å; F71-L73 PolarHBondContact O-N 2.93Å; F71-C74 PolarHBondContact O-N 3.34Å; F71-M75 HydrophobicContact CD1-CG 4.28Å; F71-M75 HydrophobicContact CE1-CG 3.86Å; F71-M75 HydrophobicContact CE2-CG 4.3Å; F71-M75 HydrophobicContact CZ-CG 3.87Å; F71-M75 HydrophobicContact CZ-SD 4.25Å; F71-M75 WeakPolarHBondContact O-CG 3.49Å; F71-M75 PolarHBondContact O-N 2.93Å
72F73.9Confident72Confident28 Ų2873.6 Ų73.612%0.12336%0.355CS..Hα-helixtrans-54.6-43.5174.4-103-126000112.1W49 I52 T53 W62 G68 L69 A76W49-F72 AromaticContact CD1-CD1 3.17Å; W49-F72 AromaticContact CD1-CE1 3.03Å; W49-F72 AromaticContact CD1-CG 3.91Å; W49-F72 AromaticContact CD1-CZ 3.7Å; W49-F72 HydrophobicContact CD2-CE1 4.32Å; W49-F72 HydrophobicContact CD2-CZ 4.27Å; W49-F72 AromaticContact CE2-CD1 3.88Å; W49-F72 AromaticContact CE2-CD2 3.83Å; W49-F72 AromaticContact CE2-CE1 3.72Å; W49-F72 AromaticContact CE2-CE2 3.68Å; W49-F72 AromaticContact CE2-CG 3.89Å; W49-F72 AromaticContact CE2-CZ 3.59Å; W49-F72 HydrophobicContact CG-CD1 4.37Å; W49-F72 AromaticContact CG-CE1 3.93Å; W49-F72 HydrophobicContact CG-CE1 3.93Å; W49-F72 HydrophobicContact CG-CZ 4.3Å; W49-F72 AromaticContact CZ2-CD2 3.74Å; W49-F72 HydrophobicContact CZ2-CD2 3.74Å; W49-F72 AromaticContact CZ2-CE2 3.65Å; W49-F72 HydrophobicContact CZ2-CE2 3.65Å; W49-F72 HydrophobicContact CZ2-CG 4.19Å; W49-F72 HydrophobicContact CZ2-CZ 4.03Å; W49-F72 AromaticContact NE1-CD1 2.79Å; W49-F72 AromaticContact NE1-CD2 3.46Å; W49-F72 AromaticContact NE1-CE1 2.91Å; W49-F72 AromaticContact NE1-CE2 3.56Å; W49-F72 AromaticContact NE1-CG 3.05Å; W49-F72 AromaticContact NE1-CZ 3.27Å; W49-F72 VanDerWaalsContact NE1-CZ 3.27Å; I52-F72 HydrophobicContact CB-CE1 4.42Å; I52-F72 HydrophobicContact CG2-CE1 4.02Å; I52-F72 HydrophobicContact CG2-CZ 4Å; T53-F72 WeakPolarHBondContact OG1-CD1 3.3Å; W62-F72 HydrophobicContact CH2-CB 4.26Å; W62-F72 HydrophobicContact CH2-CD1 4.22Å; W62-F72 HydrophobicContact CH2-CD2 4.38Å; W62-F72 HydrophobicContact CH2-CG 4.02Å; W62-F72 HydrophobicContact CZ2-CD1 4.17Å; W62-F72 HydrophobicContact CZ2-CG 4.42Å; G68-F72 PolarHBondContact O-N 3.46Å; L69-F72 PolarHBondContact O-N 2.95Å; F72-A76 WeakPolarHBondContact O-CB 3.32Å; F72-A76 PolarHBondContact O-N 2.91Å
73L69.9Low72.3Confident24 Ų2473.7 Ų73.713%0.12636%0.356CS..Hα-helixtrans-68.8-41.5179.8-158.1164.4000111.8L69 K70 F71 A76 I77 L125 A128 K129L69-L73 WeakPolarHBondContact O-CB 3.41Å; L69-L73 PolarHBondContact O-N 3.03Å; K70-L73 PolarHBondContact O-N 3.43Å; F71-L73 VanDerWaalsContact C-N 3.27Å; F71-L73 PolarHBondContact O-N 2.93Å; L73-A76 WeakPolarHBondContact O-CB 3.46Å; L73-A76 PolarHBondContact O-N 3.48Å; L73-I77 HydrophobicContact CD2-CD1 3.54Å; L73-I77 HydrophobicContact CD2-CG1 4.17Å; L73-I77 WeakPolarHBondContact O-CG1 3.2Å; L73-I77 PolarHBondContact O-N 2.97Å; L73-I77 VanDerWaalsContact O-N 3.11Å; L73-L125 HydrophobicContact CD2-CD1 3.32Å; L73-L125 HydrophobicContact CG-CD1 3.75Å; L73-A128 HydrophobicContact CB-CB 4.42Å; L73-A128 HydrophobicContact CD1-CB 3.98Å; L73-A128 HydrophobicContact CG-CB 4.11Å; L73-K129 HydrophobicContact CD1-CG 4.28Å
74C75.9Confident72.9Confident83 Ų8370.2 Ų70.256%0.56135%0.348SS*.Hα-helixtrans-61.2-46.6175.9-168.60000111.6K70 F71 A76 I77 F78K70-C74 WeakPolarHBondContact O-CB 3.29Å; K70-C74 PolarHBondContact O-N 2.97Å; F71-C74 PolarHBondContact O-N 3.34Å; C74-A76 VanDerWaalsContact C-N 3.33Å; C74-A76 PolarHBondContact O-N 3.46Å; C74-I77 PolarHBondContact O-N 3.24Å; C74-F78 PolarHBondContact O-N 2.99Å
75M76Confident73.4Confident53 Ų5368.4 Ų68.426%0.26134%0.337SS..Hα-helixtrans-61.7-40.6176.7-71.2-63.9-79.300111.8W49 F71 I77 F78 F79W49-M75 HydrophobicContact CH2-CB 4.16Å; W49-M75 HydrophobicContact CH2-CE 4.16Å; W49-M75 HydrophobicContact CH2-CG 4.17Å; W49-M75 HydrophobicContact CZ2-CB 3.94Å; W49-M75 HydrophobicContact CZ2-CG 4.18Å; F71-M75 HydrophobicContact CD1-CG 4.28Å; F71-M75 HydrophobicContact CE1-CG 3.86Å; F71-M75 HydrophobicContact CE2-CG 4.3Å; F71-M75 HydrophobicContact CZ-CG 3.87Å; F71-M75 HydrophobicContact CZ-SD 4.25Å; F71-M75 WeakPolarHBondContact O-CG 3.49Å; F71-M75 PolarHBondContact O-N 2.93Å; M75-I77 PolarHBondContact O-N 3.1Å; M75-F78 PolarHBondContact O-N 3.42Å; M75-F79 HydrophobicContact CE-CE2 3.72Å; M75-F79 HydrophobicContact CE-CZ 4.4Å; M75-F79 WeakPolarHBondContact O-CD2 3.49Å; M75-F79 PolarHBondContact O-N 3.29Å
76A71.5Confident73.4Confident1 Ų163 Ų631%0.00832%0.321CS..Hα-helixtrans-57.4-48.8175.200000112F72 L73 C74 F78 F79 S80 S121 L124F72-A76 WeakPolarHBondContact O-CB 3.32Å; F72-A76 PolarHBondContact O-N 2.91Å; L73-A76 WeakPolarHBondContact O-CB 3.46Å; L73-A76 PolarHBondContact O-N 3.48Å; C74-A76 VanDerWaalsContact C-N 3.33Å; C74-A76 PolarHBondContact O-N 3.46Å; A76-F78 PolarHBondContact O-N 3.03Å; A76-F79 PolarHBondContact O-N 3.46Å; A76-S80 WeakPolarHBondContact O-CB 3.32Å; A76-S80 PolarHBondContact O-N 2.98Å; A76-S121 PolarHBondContact O-OG 2.94Å; A76-L124 HydrophobicContact CB-CB 4.4Å; A76-L124 HydrophobicContact CB-CD2 3.44Å; A76-L124 VanDerWaalsContact CB-CD2 3.44Å; A76-L124 HydrophobicContact CB-CG 3.86Å
77I73.6Confident73.7Confident78 Ų7862 Ų6240%0.431%0.312SS..Hα-helixtrans-60.7-46.7178.4-66.8169.4000110.5L73 C74 M75 F79 S80 V81 L125L73-I77 HydrophobicContact CD2-CD1 3.54Å; L73-I77 HydrophobicContact CD2-CG1 4.17Å; L73-I77 WeakPolarHBondContact O-CG1 3.2Å; L73-I77 PolarHBondContact O-N 2.97Å; L73-I77 VanDerWaalsContact O-N 3.11Å; C74-I77 PolarHBondContact O-N 3.24Å; M75-I77 PolarHBondContact O-N 3.1Å; I77-F79 PolarHBondContact O-N 2.95Å; I77-S80 VanDerWaalsContact O-CB 3.26Å; I77-S80 WeakPolarHBondContact O-CB 3.5Å; I77-S80 PolarHBondContact O-N 3.42Å; I77-S80 VanDerWaalsContact O-N 3.1Å; I77-V81 WeakPolarHBondContact O-CG2 3.28Å; I77-V81 PolarHBondContact O-N 3.46Å; I77-L125 HydrophobicContact CD1-CD1 4.05Å; I77-L125 HydrophobicContact CG1-CD1 3.76Å; I77-L125 HydrophobicContact CG1-CD2 4.3Å
78F78.3Confident74Confident120 Ų12056.9 Ų56.953%0.52630%0.296SS..Hα-helixtrans-57.2-49.9179.5-179.2-102.8000111.8C74 M75 A76 S80 V81 I82C74-F78 PolarHBondContact O-N 2.99Å; M75-F78 PolarHBondContact O-N 3.42Å; A76-F78 PolarHBondContact O-N 3.03Å; F78-S80 VanDerWaalsContact C-N 3.3Å; F78-S80 PolarHBondContact O-N 3.08Å; F78-V81 PolarHBondContact O-N 3.34Å; F78-I82 HydrophobicContact CD1-CD1 3.76Å; F78-I82 HydrophobicContact CE1-CD1 3.27Å; F78-I82 HydrophobicContact CE1-CG1 4.45Å; F78-I82 HydrophobicContact CE2-CD1 4.38Å; F78-I82 HydrophobicContact CG-CD1 4.5Å; F78-I82 HydrophobicContact CZ-CD1 3.63Å; F78-I82 PolarHBondContact O-N 3.47Å; F78-I82 VanDerWaalsContact O-N 3.14Å
79F74.8Confident74Confident42 Ų4259.7 Ų59.718%0.18431%0.313CS..Hα-helixtrans-67.2-29.3176.3-78.3-66.9000113.3L42 L46 M75 A76 I77 I82 A83L42-F79 HydrophobicContact CD1-CD1 4.36Å; L42-F79 HydrophobicContact CD1-CE1 4.2Å; L42-F79 HydrophobicContact CD2-CD1 4.43Å; L46-F79 HydrophobicContact CD1-CB 4.38Å; L46-F79 HydrophobicContact CD2-CB 3.65Å; L46-F79 HydrophobicContact CD2-CD2 4.21Å; L46-F79 HydrophobicContact CD2-CG 4.02Å; M75-F79 HydrophobicContact CE-CE2 3.72Å; M75-F79 HydrophobicContact CE-CZ 4.4Å; M75-F79 WeakPolarHBondContact O-CD2 3.49Å; M75-F79 PolarHBondContact O-N 3.29Å; A76-F79 PolarHBondContact O-N 3.46Å; I77-F79 PolarHBondContact O-N 2.95Å; F79-I82 PolarHBondContact O-N 3.06Å; F79-A83 WeakPolarHBondContact O-CB 3.48Å; F79-A83 PolarHBondContact O-N 3.36Å
80S72.2Confident73.8Confident20 Ų2060.5 Ų60.514%0.1432%0.316CS..Hα-helixtrans-61.2-45.8172.3-166.80000111.3A76 I77 F78 A83 I84 S121A76-S80 WeakPolarHBondContact O-CB 3.32Å; A76-S80 PolarHBondContact O-N 2.98Å; I77-S80 VanDerWaalsContact O-CB 3.26Å; I77-S80 WeakPolarHBondContact O-CB 3.5Å; I77-S80 PolarHBondContact O-N 3.42Å; I77-S80 VanDerWaalsContact O-N 3.1Å; F78-S80 VanDerWaalsContact C-N 3.3Å; F78-S80 PolarHBondContact O-N 3.08Å; S80-A83 PolarHBondContact O-N 2.96Å; S80-I84 WeakPolarHBondContact O-CG1 3.48Å; S80-I84 PolarHBondContact O-N 2.96Å; S80-S121 VanDerWaalsContact CB-OG 3.29Å; S80-S121 WeakPolarHBondContact CB-OG 3.08Å
81V74.8Confident73.9Confident80 Ų8057.5 Ų57.549%0.48531%0.306SS..Hα-helixtrans-63.6-44.8179.6176.30000110.2I77 F78 A83 I84 V85I77-V81 WeakPolarHBondContact O-CG2 3.28Å; I77-V81 PolarHBondContact O-N 3.46Å; F78-V81 PolarHBondContact O-N 3.34Å; V81-A83 VanDerWaalsContact C-N 3.31Å; V81-A83 PolarHBondContact O-N 3.33Å; V81-I84 PolarHBondContact O-N 2.98Å; V81-V85 WeakPolarHBondContact O-CG2 3.17Å; V81-V85 PolarHBondContact O-N 3.5Å
82I77.2Confident73.8Confident68 Ų6854.4 Ų54.435%0.34930%0.3SS..Hα-helixtrans-59.5-42.5175.8-67172.6000111.2F78 F79 I84 V85 A86F78-I82 HydrophobicContact CD1-CD1 3.76Å; F78-I82 HydrophobicContact CE1-CD1 3.27Å; F78-I82 HydrophobicContact CE1-CG1 4.45Å; F78-I82 HydrophobicContact CE2-CD1 4.38Å; F78-I82 HydrophobicContact CG-CD1 4.5Å; F78-I82 HydrophobicContact CZ-CD1 3.63Å; F78-I82 PolarHBondContact O-N 3.47Å; F78-I82 VanDerWaalsContact O-N 3.14Å; F79-I82 PolarHBondContact O-N 3.06Å; I82-I84 VanDerWaalsContact C-N 3.34Å; I82-I84 PolarHBondContact O-N 3.21Å; I82-V85 PolarHBondContact O-N 2.81Å; I82-A86 VanDerWaalsContact O-CB 3.31Å; I82-A86 WeakPolarHBondContact O-CB 3.29Å; I82-A86 PolarHBondContact O-N 3.32Å
83A71.6Confident73.6Confident2 Ų256.3 Ų56.32%0.01731%0.31CS..Hα-helixtrans-65.1-35.1178.500000112.9F79 S80 V81 F87 S114 L118F79-A83 WeakPolarHBondContact O-CB 3.48Å; F79-A83 PolarHBondContact O-N 3.36Å; S80-A83 PolarHBondContact O-N 2.96Å; V81-A83 VanDerWaalsContact C-N 3.31Å; V81-A83 PolarHBondContact O-N 3.33Å; A83-F87 VanDerWaalsContact O-CB 3.27Å; A83-F87 WeakPolarHBondContact O-CB 3.35Å; A83-F87 PolarHBondContact O-N 2.97Å; A83-S114 PolarHBondContact O-OG 3.4Å; A83-L118 HydrophobicContact CB-CB 4.49Å
84I74.6Confident73.5Confident82 Ų8255.1 Ų55.142%0.42130%0.304SS..Hα-helixtrans-65.2-50.6173.5-65.9166.8000110.1S80 V81 I82 A86 F87 V88 L118S80-I84 WeakPolarHBondContact O-CG1 3.48Å; S80-I84 PolarHBondContact O-N 2.96Å; V81-I84 PolarHBondContact O-N 2.98Å; I82-I84 VanDerWaalsContact C-N 3.34Å; I82-I84 PolarHBondContact O-N 3.21Å; I84-A86 VanDerWaalsContact C-N 3.32Å; I84-A86 PolarHBondContact O-N 3.32Å; I84-F87 WeakPolarHBondContact O-CB 3.43Å; I84-F87 PolarHBondContact O-N 3.11Å; I84-F87 VanDerWaalsContact O-N 3.15Å; I84-V88 HydrophobicContact CG2-CG2 4.49Å; I84-V88 WeakPolarHBondContact O-CG2 3.44Å; I84-V88 PolarHBondContact O-N 3.34Å; I84-L118 HydrophobicContact CB-CD1 4.31Å; I84-L118 HydrophobicContact CD1-CD1 3.99Å; I84-L118 HydrophobicContact CG1-CD1 3.14Å
85V77.9Confident73.2Confident85 Ų8556.2 Ų56.252%0.51530%0.303SS..Hα-helixtrans-59.3-47.3-179.1173.70000110.1V81 I82 F87 V88 T89V81-V85 WeakPolarHBondContact O-CG2 3.17Å; V81-V85 PolarHBondContact O-N 3.5Å; I82-V85 PolarHBondContact O-N 2.81Å; V85-F87 PolarHBondContact O-N 3.4Å; V85-V88 PolarHBondContact O-N 3.43Å; V85-T89 HydrophobicContact CG1-CG2 4.44Å; V85-T89 WeakPolarHBondContact O-CG2 3.43Å; V85-T89 PolarHBondContact O-N 3.22Å; V85-T89 PolarHBondContact O-OG1 3.49Å
86A71.2Confident72.9Confident20 Ų2058.6 Ų58.617%0.16533%0.325CS..Hα-helixtrans-60.2-43.8175.900000111.8M39 I82 I84 V88 T89 F90M39-A86 HydrophobicContact CE-CB 4.13Å; I82-A86 VanDerWaalsContact O-CB 3.31Å; I82-A86 WeakPolarHBondContact O-CB 3.29Å; I82-A86 PolarHBondContact O-N 3.32Å; I84-A86 VanDerWaalsContact C-N 3.32Å; I84-A86 PolarHBondContact O-N 3.32Å; A86-V88 VanDerWaalsContact C-N 3.34Å; A86-V88 PolarHBondContact O-N 3Å; A86-T89 WeakPolarHBondContact CA-OG1 3.06Å; A86-T89 PolarHBondContact O-N 3.07Å; A86-T89 PolarHBondContact O-OG1 2.85Å; A86-F90 HydrophobicContact CB-CD2 4.3Å; A86-F90 HydrophobicContact CB-CE2 4.19Å; A86-F90 WeakPolarHBondContact O-CD2 3.37Å; A86-F90 PolarHBondContact O-N 3.49Å
87F73Confident72.6Confident73 Ų7366.7 Ų66.732%0.3236%0.356SS..Hα-helixtrans-57.7-47.2177.8179.5-106.5000111.9A83 I84 V85 L91 A111 S114 A115A83-F87 VanDerWaalsContact O-CB 3.27Å; A83-F87 WeakPolarHBondContact O-CB 3.35Å; A83-F87 PolarHBondContact O-N 2.97Å; I84-F87 WeakPolarHBondContact O-CB 3.43Å; I84-F87 PolarHBondContact O-N 3.11Å; I84-F87 VanDerWaalsContact O-N 3.15Å; V85-F87 PolarHBondContact O-N 3.4Å; F87-L91 HydrophobicContact CE1-CD2 4.31Å; F87-L91 VanDerWaalsContact O-CB 3.23Å; F87-L91 WeakPolarHBondContact O-CB 3.1Å; F87-L91 PolarHBondContact O-N 2.92Å; F87-A111 HydrophobicContact CD2-CB 4.29Å; F87-A111 VanDerWaalsContact CD2-O 3.27Å; F87-A111 WeakPolarHBondContact CD2-O 3.31Å; F87-A111 HydrophobicContact CE2-CB 4.24Å; F87-S114 PolarHBondContact N-OG 3.26Å; F87-S114 VanDerWaalsContact N-OG 3.16Å; F87-A115 HydrophobicContact CD2-CB 4.09Å; F87-A115 HydrophobicContact CE2-CB 3.94Å
88V75.4Confident72.2Confident75 Ų7572.2 Ų72.246%0.45538%0.377SS..Hα-helixtrans-67-38.9-179.4175.70000111.9I84 V85 A86 S92I84-V88 HydrophobicContact CG2-CG2 4.49Å; I84-V88 WeakPolarHBondContact O-CG2 3.44Å; I84-V88 PolarHBondContact O-N 3.34Å; V85-V88 PolarHBondContact O-N 3.43Å; A86-V88 VanDerWaalsContact C-N 3.34Å; A86-V88 PolarHBondContact O-N 3Å; V88-S92 VanDerWaalsContact O-CB 3.31Å; V88-S92 WeakPolarHBondContact O-CB 3.47Å; V88-S92 PolarHBondContact O-N 3.15Å; V88-S92 PolarHBondContact O-OG 3.48Å
89T73.3Confident71.3Confident64 Ų6470 Ų7039%0.39337%0.368SS..Hα-helixtrans-68.9-44.7178.854.70000111.7V85 A86 L91 S92 I93V85-T89 HydrophobicContact CG1-CG2 4.44Å; V85-T89 WeakPolarHBondContact O-CG2 3.43Å; V85-T89 PolarHBondContact O-N 3.22Å; V85-T89 PolarHBondContact O-OG1 3.49Å; A86-T89 WeakPolarHBondContact CA-OG1 3.06Å; A86-T89 PolarHBondContact O-N 3.07Å; A86-T89 PolarHBondContact O-OG1 2.85Å; T89-L91 PolarHBondContact O-N 3.42Å; T89-S92 PolarHBondContact O-N 3.36Å; T89-I93 WeakPolarHBondContact O-CB 3.44Å; T89-I93 WeakPolarHBondContact O-CD1 3.4Å; T89-I93 VanDerWaalsContact O-CG1 3.24Å; T89-I93 WeakPolarHBondContact O-CG1 3.48Å; T89-I93 PolarHBondContact O-N 3.02Å
90F69.9Low70.4Confident21 Ų2170.2 Ų70.29%0.09238%0.375CS..Hα-helixtrans-65.9-38.5176.9-73.9-64000112.3W35 M39 A86 A94 L107 A111W35-F90 HydrophobicContact CB-CE1 4.46Å; W35-F90 HydrophobicContact CB-CZ 4.46Å; W35-F90 HydrophobicContact CE3-CZ 4.39Å; M39-F90 HydrophobicContact CE-CD2 3.17Å; M39-F90 HydrophobicContact CE-CE2 3.25Å; M39-F90 HydrophobicContact CE-CG 4.21Å; M39-F90 HydrophobicContact CE-CZ 4.26Å; M39-F90 HydrophobicContact CG-CE2 4.36Å; M39-F90 HydrophobicContact SD-CD2 3.5Å; M39-F90 VanDerWaalsContact SD-CD2 3.5Å; M39-F90 HydrophobicContact SD-CE1 4.3Å; M39-F90 HydrophobicContact SD-CE2 3Å; M39-F90 WeakPolarHBondContact SD-CE2 3.45Å; M39-F90 HydrophobicContact SD-CG 4.39Å; M39-F90 HydrophobicContact SD-CZ 3.45Å; M39-F90 WeakPolarHBondContact SD-CZ 3.46Å; A86-F90 HydrophobicContact CB-CD2 4.3Å; A86-F90 HydrophobicContact CB-CE2 4.19Å; A86-F90 WeakPolarHBondContact O-CD2 3.37Å; A86-F90 PolarHBondContact O-N 3.49Å; F90-A94 VanDerWaalsContact O-CB 3.27Å; F90-A94 WeakPolarHBondContact O-CB 3.46Å; F90-A94 PolarHBondContact O-N 3.37Å; F90-L107 HydrophobicContact CD1-CB 4.49Å; F90-L107 HydrophobicContact CD1-CD2 3.83Å; F90-L107 HydrophobicContact CE1-CD2 3.93Å; F90-A111 HydrophobicContact CB-CB 4.21Å
91L71.9Confident69.6Low64 Ų6474.9 Ų74.934%0.33540%0.402SS..Hα-helixtrans-64.2-47175.5-170.968.8000111.5F87 T89 I93 A94 I95F87-L91 HydrophobicContact CE1-CD2 4.31Å; F87-L91 VanDerWaalsContact O-CB 3.23Å; F87-L91 WeakPolarHBondContact O-CB 3.1Å; F87-L91 PolarHBondContact O-N 2.92Å; T89-L91 PolarHBondContact O-N 3.42Å; L91-I93 PolarHBondContact O-N 2.99Å; L91-A94 PolarHBondContact O-N 3.05Å; L91-I95 HydrophobicContact CD1-CD1 4.47Å; L91-I95 HydrophobicContact CG-CD1 4.04Å; L91-I95 WeakPolarHBondContact O-CD1 3.22Å; L91-I95 VanDerWaalsContact O-CG1 3.27Å; L91-I95 WeakPolarHBondContact O-CG1 3.37Å; L91-I95 PolarHBondContact O-N 3.38Å
92S72.6Confident68.6Low60 Ų6077.3 Ų77.342%0.4242%0.417SS..Hα-helixtrans-60.2-45.3177.8-60.40000111.7V88 T89 I95 S96V88-S92 VanDerWaalsContact O-CB 3.31Å; V88-S92 WeakPolarHBondContact O-CB 3.47Å; V88-S92 PolarHBondContact O-N 3.15Å; V88-S92 PolarHBondContact O-OG 3.48Å; T89-S92 PolarHBondContact O-N 3.36Å; S92-I95 PolarHBondContact O-N 2.97Å; S92-S96 PolarHBondContact O-N 3.26Å; S92-S96 PolarHBondContact O-OG 3.39Å; S92-S96 VanDerWaalsContact O-OG 3.13Å
93I70.8Confident67.5Low67 Ų6778 Ų7834%0.34442%0.422SS..Hα-helixtrans-66-40.6179.3-67.9164.3000111.3T89 L91 I95 S96 R97 L107T89-I93 WeakPolarHBondContact O-CB 3.44Å; T89-I93 WeakPolarHBondContact O-CD1 3.4Å; T89-I93 VanDerWaalsContact O-CG1 3.24Å; T89-I93 WeakPolarHBondContact O-CG1 3.48Å; T89-I93 PolarHBondContact O-N 3.02Å; L91-I93 PolarHBondContact O-N 2.99Å; I93-I95 VanDerWaalsContact C-N 3.34Å; I93-I95 PolarHBondContact O-N 2.94Å; I93-S96 PolarHBondContact O-N 3.2Å; I93-R97 HydrophobicContact CG2-CG 4.47Å; I93-R97 PolarHBondContact O-N 3.34Å; I93-L107 HydrophobicContact CB-CD1 4.45Å; I93-L107 HydrophobicContact CG2-CD1 3.47Å; I93-L107 VanDerWaalsContact CG2-CD1 3.47Å
94A66.8Low66.7Low0 Ų081 Ų810%044%0.441CS..Hα-helixtrans-62.4-42.1178.200000111.8F90 L91 K98 L107 Y108F90-A94 VanDerWaalsContact O-CB 3.27Å; F90-A94 WeakPolarHBondContact O-CB 3.46Å; F90-A94 PolarHBondContact O-N 3.37Å; L91-A94 PolarHBondContact O-N 3.05Å; A94-K98 PolarHBondContact O-N 2.96Å; A94-L107 HydrophobicContact CB-CB 4.43Å; A94-Y108 HydrophobicContact CB-CD1 4.39Å; A94-Y108 HydrophobicContact CB-CD2 4.2Å; A94-Y108 HydrophobicContact CB-CE1 4.13Å; A94-Y108 HydrophobicContact CB-CE2 3.92Å; A94-Y108 HydrophobicContact CB-CG 4.42Å
95I70.2Confident65.8Low106 Ų10684.5 Ų84.554%0.54445%0.449SS..Hα-helixtrans-65.5-45.4176.5-65.6165.1000110.8L91 S92 I93 R97 K98L91-I95 HydrophobicContact CD1-CD1 4.47Å; L91-I95 HydrophobicContact CG-CD1 4.04Å; L91-I95 WeakPolarHBondContact O-CD1 3.22Å; L91-I95 VanDerWaalsContact O-CG1 3.27Å; L91-I95 WeakPolarHBondContact O-CG1 3.37Å; L91-I95 PolarHBondContact O-N 3.38Å; S92-I95 PolarHBondContact O-N 2.97Å; I93-I95 VanDerWaalsContact C-N 3.34Å; I93-I95 PolarHBondContact O-N 2.94Å; I95-R97 VanDerWaalsContact C-N 3.31Å; I95-R97 PolarHBondContact O-N 3.31Å; I95-K98 PolarHBondContact O-N 3.39Å
96S69.3Low64.8Low103 Ų10380.5 Ų80.572%0.7243%0.425SS*.Hα-helixtrans-65.2-31.1-179.5-63.90000113.6S92 I93S92-S96 PolarHBondContact O-N 3.26Å; S92-S96 PolarHBondContact O-OG 3.39Å; S92-S96 VanDerWaalsContact O-OG 3.13Å; I93-S96 PolarHBondContact O-N 3.2Å
97R65.9Low64.5Low171 Ų17180.8 Ų80.865%0.64542%0.424SS*.Hα-helixtrans-89.5-4.7-179.7-69.7-173.4-171.3-1150.1114.5I93 I95 E99I93-R97 HydrophobicContact CG2-CG 4.47Å; I93-R97 PolarHBondContact O-N 3.34Å; I95-R97 VanDerWaalsContact C-N 3.31Å; I95-R97 PolarHBondContact O-N 3.31Å; R97-E99 HydrophobicContact CB-CG 3.68Å; R97-E99 PolarHBondContact O-N 2.88Å
98K65.1Low64.1Low193 Ų19380.7 Ų80.784%0.83942%0.422SS*.THydrogen-bonded Turntrans47.639.5-175.1-62.1-175179.9-177.30112.7A94 I95A94-K98 PolarHBondContact O-N 2.96Å; I95-K98 PolarHBondContact O-N 3.39Å
99E59.5Low63.5Low73 Ų7379.7 Ų79.734%0.34141%0.413SS..  trans-66.3141.3-177.3-69.3-74.716500110.7R97 Y108R97-E99 HydrophobicContact CB-CG 3.68Å; R97-E99 PolarHBondContact O-N 2.88Å; E99-Y108 HydrophobicContact CB-CE2 4.42Å; E99-Y108 WeakPolarHBondContact O-CE2 3.48Å
100S55.7Low63.1Low48 Ų4876.7 Ų76.734%0.33640%0.395SS..  trans-73.9138.317899.10000110.4T102 D103 S106S100-T102 PolarHBondContact O-N 3.21Å; S100-T102 VanDerWaalsContact O-N 3.17Å; S100-T102 PolarHBondContact OG-N 3.36Å; S100-D103 PolarHBondContact O-N 2.9Å; S100-D103 PolarHBondContact OG-N 3.46Å; S100-D103 PolarHBondContact OG-OD2 3.28Å; S100-S106 WeakPolarHBondContact O-CB 3.46Å
101V55Low62.9Low118 Ų11875.9 Ų75.972%0.71539%0.392SS*.THydrogen-bonded Turntrans-65.6-16.2177.1-152.50000111.5
102T54.1Low62.9Low130 Ų13077.4 Ų77.480%0.79840%0.404SS*.THydrogen-bonded Turntrans-86.5-15.8-175-24.70000112.8S100S100-T102 PolarHBondContact O-N 3.21Å; S100-T102 VanDerWaalsContact O-N 3.17Å; S100-T102 PolarHBondContact OG-N 3.36Å
103D54.1Low62.6Low83 Ų8376.6 Ų76.644%0.44439%0.392SS..  trans-82.5125.5-179.2-81.2-60.6000112.1S100 R105 S106S100-D103 PolarHBondContact O-N 2.9Å; S100-D103 PolarHBondContact OG-N 3.46Å; S100-D103 PolarHBondContact OG-OD2 3.28Å; D103-R105 PolarHBondContact O-N 3Å; D103-S106 VanDerWaalsContact O-CB 3.31Å; D103-S106 WeakPolarHBondContact O-CB 3.35Å; D103-S106 PolarHBondContact O-N 3.2Å; D103-S106 PolarHBondContact O-OG 3.45Å
104P54.8Low62.3Low64 Ų6473.6 Ų73.642%0.41638%0.377SS..THydrogen-bonded Turntrans-67.8-6.6-177.626-33.5000114Y31Y31-P104 HydrophobicContact CD1-CB 4.3Å; Y31-P104 HydrophobicContact CE1-CB 3.7Å; Y31-P104 HydrophobicContact CE1-CG 4.28Å
105R55.3Low62.5Low156 Ų15675.6 Ų75.659%0.58939%0.393SS*.THydrogen-bonded Turntrans-100.8-0.4173.7-74.3-177.2162.6178.7-3.4113.6Q33 D103Q33-R105 PolarHBondContact NE2-O 2.93Å; D103-R105 PolarHBondContact O-N 3Å
106S57.7Low62.5Low2 Ų273.7 Ų73.71%0.01438%0.383CS..  trans-67.3142.9-175.182.40000111.6S100 D103 Y108 L109S100-S106 WeakPolarHBondContact O-CB 3.46Å; D103-S106 VanDerWaalsContact O-CB 3.31Å; D103-S106 WeakPolarHBondContact O-CB 3.35Å; D103-S106 PolarHBondContact O-N 3.2Å; D103-S106 PolarHBondContact O-OG 3.45Å; S106-Y108 PolarHBondContact O-N 3.06Å; S106-Y108 VanDerWaalsContact O-N 3.14Å; S106-L109 PolarHBondContact O-N 2.96Å
107L63.9Low62.5Low26 Ų2668.9 Ų68.914%0.13635%0.349CS..Hα-helixtrans-70.1-6.5-178.8-67.7159000112.9F90 I93 A94 L109 S110 A111F90-L107 HydrophobicContact CD1-CB 4.49Å; F90-L107 HydrophobicContact CD1-CD2 3.83Å; F90-L107 HydrophobicContact CE1-CD2 3.93Å; I93-L107 HydrophobicContact CB-CD1 4.45Å; I93-L107 HydrophobicContact CG2-CD1 3.47Å; I93-L107 VanDerWaalsContact CG2-CD1 3.47Å; A94-L107 HydrophobicContact CB-CB 4.43Å; L107-L109 VanDerWaalsContact C-N 3.31Å; L107-L109 PolarHBondContact O-N 3.3Å; L107-S110 WeakPolarHBondContact O-CB 3.47Å; L107-S110 PolarHBondContact O-N 3.47Å; L107-A111 PolarHBondContact O-N 3.36Å; L107-A111 VanDerWaalsContact O-N 3.07Å
108Y64.3Low62.5Low71 Ų7163.5 Ų63.528%0.27833%0.333SS..Hα-helixtrans-61-38.6171.2-77.2-76.2000112.1A94 E99 S106 S110 A111 V112A94-Y108 HydrophobicContact CB-CD1 4.39Å; A94-Y108 HydrophobicContact CB-CD2 4.2Å; A94-Y108 HydrophobicContact CB-CE1 4.13Å; A94-Y108 HydrophobicContact CB-CE2 3.92Å; A94-Y108 HydrophobicContact CB-CG 4.42Å; E99-Y108 HydrophobicContact CB-CE2 4.42Å; E99-Y108 WeakPolarHBondContact O-CE2 3.48Å; S106-Y108 PolarHBondContact O-N 3.06Å; S106-Y108 VanDerWaalsContact O-N 3.14Å; Y108-S110 VanDerWaalsContact C-N 3.34Å; Y108-S110 PolarHBondContact O-N 3.1Å; Y108-A111 WeakPolarHBondContact O-CB 3.26Å; Y108-A111 PolarHBondContact O-N 3.39Å; Y108-V112 WeakPolarHBondContact O-CG2 3.44Å; Y108-V112 PolarHBondContact O-N 3.44Å
109L64.3Low63Low54 Ų5458.2 Ų58.228%0.28331%0.31SS..Hα-helixtrans-62.5-41.4175.1-88.1143.3000111.4W27 T36 S106 L107 A111 V112 W113W27-L109 HydrophobicContact CH2-CD2 3.92Å; W27-L109 HydrophobicContact CZ2-CD1 4.18Å; W27-L109 HydrophobicContact CZ2-CD2 3.64Å; W27-L109 HydrophobicContact CZ2-CG 4.33Å; T36-L109 HydrophobicContact CG2-CB 4.43Å; S106-L109 PolarHBondContact O-N 2.96Å; L107-L109 VanDerWaalsContact C-N 3.31Å; L107-L109 PolarHBondContact O-N 3.3Å; L109-A111 VanDerWaalsContact C-N 3.33Å; L109-A111 PolarHBondContact O-N 3.44Å; L109-V112 PolarHBondContact O-N 3.24Å; L109-W113 PolarHBondContact O-N 2.92Å
110S64.6Low63.5Low0 Ų055.2 Ų55.20%030%0.296CS..Hα-helixtrans-61.2-40.6173.3-62.30000112.2T36 M39 L107 Y108 W113 S114T36-S110 WeakPolarHBondContact CB-OG 3.4Å; T36-S110 PolarHBondContact OG1-OG 2.87Å; M39-S110 WeakPolarHBondContact CE-O 3.43Å; L107-S110 WeakPolarHBondContact O-CB 3.47Å; L107-S110 PolarHBondContact O-N 3.47Å; Y108-S110 VanDerWaalsContact C-N 3.34Å; Y108-S110 PolarHBondContact O-N 3.1Å; S110-W113 PolarHBondContact O-N 2.98Å; S110-S114 PolarHBondContact O-N 3.46Å
111A64.5Low64Low5 Ų553 Ų534%0.04128%0.28CS..Hα-helixtrans-63-42.7175.600000111.9F87 F90 L107 Y108 L109 W113 S114 A115F87-A111 HydrophobicContact CD2-CB 4.29Å; F87-A111 VanDerWaalsContact CD2-O 3.27Å; F87-A111 WeakPolarHBondContact CD2-O 3.31Å; F87-A111 HydrophobicContact CE2-CB 4.24Å; F90-A111 HydrophobicContact CB-CB 4.21Å; L107-A111 PolarHBondContact O-N 3.36Å; L107-A111 VanDerWaalsContact O-N 3.07Å; Y108-A111 WeakPolarHBondContact O-CB 3.26Å; Y108-A111 PolarHBondContact O-N 3.39Å; L109-A111 VanDerWaalsContact C-N 3.33Å; L109-A111 PolarHBondContact O-N 3.44Å; A111-W113 VanDerWaalsContact C-N 3.33Å; A111-W113 PolarHBondContact O-N 3.47Å; A111-S114 WeakPolarHBondContact O-CB 3.45Å; A111-S114 PolarHBondContact O-N 3.26Å; A111-A115 PolarHBondContact O-N 2.97Å
112V73Confident64.5Low96 Ų9649.7 Ų49.758%0.58226%0.262SS*.Hα-helixtrans-60.2-43.7174.7173.70000111.1Y108 L109 S114 A115 M116Y108-V112 WeakPolarHBondContact O-CG2 3.44Å; Y108-V112 PolarHBondContact O-N 3.44Å; L109-V112 PolarHBondContact O-N 3.24Å; V112-S114 VanDerWaalsContact C-N 3.33Å; V112-S114 PolarHBondContact O-N 2.91Å; V112-A115 PolarHBondContact O-N 3.41Å; V112-M116 PolarHBondContact O-N 3.35Å
113W66.1Low65.4Low42 Ų4246.9 Ų46.916%0.15924%0.242CC..Hα-helixtrans-65.2-34.9176.6-80.6107.9000113A23 M39 L109 S110 A111 M116 S117A23-W113 HydrophobicContact CB-CD2 4.39Å; A23-W113 HydrophobicContact CB-CH2 3.27Å; A23-W113 HydrophobicContact CB-CZ2 3.1Å; A23-W113 HydrophobicContact CB-CZ3 3.99Å; M39-W113 HydrophobicContact CB-CB 4.39Å; L109-W113 PolarHBondContact O-N 2.92Å; S110-W113 PolarHBondContact O-N 2.98Å; A111-W113 VanDerWaalsContact C-N 3.33Å; A111-W113 PolarHBondContact O-N 3.47Å; W113-M116 PolarHBondContact O-N 3.31Å; W113-S117 PolarHBondContact O-N 3.01Å; W113-S117 PolarHBondContact O-OG 3.02Å; W113-S117 VanDerWaalsContact O-OG 3.06Å
114S64.6Low66.3Low4 Ų443.1 Ų43.13%0.02822%0.221CC..Hα-helixtrans-64.9-44.3172.1-145.30000112.2A83 F87 S110 A111 V112 M116 S117 L118A83-S114 PolarHBondContact O-OG 3.4Å; F87-S114 PolarHBondContact N-OG 3.26Å; F87-S114 VanDerWaalsContact N-OG 3.16Å; S110-S114 PolarHBondContact O-N 3.46Å; A111-S114 WeakPolarHBondContact O-CB 3.45Å; A111-S114 PolarHBondContact O-N 3.26Å; V112-S114 VanDerWaalsContact C-N 3.33Å; V112-S114 PolarHBondContact O-N 2.91Å; S114-M116 VanDerWaalsContact C-N 3.25Å; S114-M116 PolarHBondContact O-N 2.94Å; S114-S117 WeakPolarHBondContact O-CB 3.47Å; S114-S117 PolarHBondContact O-N 3.09Å; S114-L118 PolarHBondContact O-N 3.23Å
115A70.4Confident67Low42 Ų4241.8 Ų41.835%0.34721%0.211SC..Hα-helixtrans-62.3-36.617600000111.4F87 A111 V112 L118 K119F87-A115 HydrophobicContact CD2-CB 4.09Å; F87-A115 HydrophobicContact CE2-CB 3.94Å; A111-A115 PolarHBondContact O-N 2.97Å; V112-A115 PolarHBondContact O-N 3.41Å; A115-L118 WeakPolarHBondContact O-CB 3.31Å; A115-L118 PolarHBondContact O-N 3.24Å; A115-K119 PolarHBondContact O-N 3.02Å; A115-K119 VanDerWaalsContact O-N 3.07Å
116M71.1Confident67.8Low67 Ų6739.9 Ų39.933%0.3321%0.212SC..Hα-helixtrans-68.2-41.5176-149.458.2175.700111.8V112 W113 S114 L118 K119 W120V112-M116 PolarHBondContact O-N 3.35Å; W113-M116 PolarHBondContact O-N 3.31Å; S114-M116 VanDerWaalsContact C-N 3.25Å; S114-M116 PolarHBondContact O-N 2.94Å; M116-L118 VanDerWaalsContact C-N 3.31Å; M116-L118 PolarHBondContact O-N 2.96Å; M116-K119 HydrophobicContact CE-CD 4.27Å; M116-K119 WeakPolarHBondContact O-CB 3.41Å; M116-K119 PolarHBondContact O-N 2.75Å; M116-K119 HydrophobicContact SD-CD 4.06Å; M116-W120 PolarHBondContact O-N 3.33Å; M116-W120 VanDerWaalsContact O-N 3.15Å
117S67.7Low68.4Low2 Ų240.5 Ų40.51%0.01422%0.217CC..Hα-helixtrans-60.2-39.1172.1-62.90000112.8S43 W113 S114 K119 W120 S121S43-S117 WeakPolarHBondContact CA-OG 3.33Å; S43-S117 WeakPolarHBondContact CB-OG 3.47Å; S43-S117 PolarHBondContact N-OG 3.32Å; S43-S117 WeakPolarHBondContact OG-CA 3Å; S43-S117 PolarHBondContact OG-N 2.95Å; S43-S117 PolarHBondContact OG-OG 3.24Å; W113-S117 PolarHBondContact O-N 3.01Å; W113-S117 PolarHBondContact O-OG 3.02Å; W113-S117 VanDerWaalsContact O-OG 3.06Å; S114-S117 WeakPolarHBondContact O-CB 3.47Å; S114-S117 PolarHBondContact O-N 3.09Å; S117-K119 PolarHBondContact O-N 3.48Å; S117-W120 PolarHBondContact O-N 3.26Å; S117-S121 PolarHBondContact O-N 3.37Å
118L66.8Low68.5Low58 Ų5839.4 Ų39.430%0.30421%0.211SC..Hα-helixtrans-61.8-43175.5-170.8109.6000111.9A83 I84 S114 A115 M116 W120 S121 S122A83-L118 HydrophobicContact CB-CB 4.49Å; I84-L118 HydrophobicContact CB-CD1 4.31Å; I84-L118 HydrophobicContact CD1-CD1 3.99Å; I84-L118 HydrophobicContact CG1-CD1 3.14Å; S114-L118 PolarHBondContact O-N 3.23Å; A115-L118 WeakPolarHBondContact O-CB 3.31Å; A115-L118 PolarHBondContact O-N 3.24Å; M116-L118 VanDerWaalsContact C-N 3.31Å; M116-L118 PolarHBondContact O-N 2.96Å; L118-W120 PolarHBondContact O-N 3.37Å; L118-S121 PolarHBondContact O-N 3.28Å; L118-S122 WeakPolarHBondContact O-CB 3.4Å; L118-S122 PolarHBondContact O-N 3.24Å; L118-S122 PolarHBondContact O-OG 3.31Å
119K75.2Confident68.8Low81 Ų8141.8 Ų41.835%0.35222%0.223SC..Hα-helixtrans-58.8-47.4176.2178.3-176.8172.2-1790111.2Y12 A115 M116 S117 S122 L123Y12-K119 PolarHBondContact OH-NZ 3.23Å; A115-K119 PolarHBondContact O-N 3.02Å; A115-K119 VanDerWaalsContact O-N 3.07Å; M116-K119 HydrophobicContact CE-CD 4.27Å; M116-K119 WeakPolarHBondContact O-CB 3.41Å; M116-K119 PolarHBondContact O-N 2.75Å; M116-K119 HydrophobicContact SD-CD 4.06Å; S117-K119 PolarHBondContact O-N 3.48Å; K119-S122 PolarHBondContact O-N 3.47Å; K119-L123 HydrophobicContact CG-CD1 4.2Å; K119-L123 WeakPolarHBondContact O-CG 3.45Å; K119-L123 PolarHBondContact O-N 3.14Å
120W69.4Low69.2Low11 Ų1147.4 Ų47.44%0.04224%0.241CC..Hα-helixtrans-65.3-41.3179.6-66.3117.4000112.3Y12 L46 A47 T50 M116 S117 L118 S122 L123 L124Y12-W120 AromaticContact CD1-CH2 3.41Å; Y12-W120 HydrophobicContact CD1-CH2 3.41Å; Y12-W120 VanDerWaalsContact CD1-CH2 3.41Å; Y12-W120 AromaticContact CD1-CZ3 3.65Å; Y12-W120 HydrophobicContact CD1-CZ3 3.65Å; Y12-W120 AromaticContact CE1-CH2 3.32Å; Y12-W120 HydrophobicContact CE1-CH2 3.32Å; Y12-W120 HydrophobicContact CE1-CZ2 4.1Å; Y12-W120 AromaticContact CE1-CZ3 3.77Å; Y12-W120 HydrophobicContact CE1-CZ3 3.77Å; Y12-W120 HydrophobicContact CG-CH2 4.36Å; Y12-W120 WeakPolarHBondContact O-CH2 3.34Å; L46-W120 HydrophobicContact CB-CB 4.38Å; A47-W120 HydrophobicContact CB-CD2 4.25Å; A47-W120 HydrophobicContact CB-CG 4.41Å; T50-W120 WeakPolarHBondContact CG2-O 3.44Å; M116-W120 PolarHBondContact O-N 3.33Å; M116-W120 VanDerWaalsContact O-N 3.15Å; S117-W120 PolarHBondContact O-N 3.26Å; L118-W120 PolarHBondContact O-N 3.37Å; W120-S122 PolarHBondContact O-N 3.48Å; W120-L123 HydrophobicContact CE3-CD1 4.23Å; W120-L123 HydrophobicContact CZ3-CD1 4.44Å; W120-L123 PolarHBondContact O-N 3.07Å; W120-L124 WeakPolarHBondContact O-CB 3.31Å; W120-L124 PolarHBondContact O-N 2.8Å
121S67.2Low69.4Low1 Ų148 Ų481%0.00724%0.243CC..Hα-helixtrans-63.7-40.7175.9-175.10000112.7A76 S80 S117 L118 L123 L124 L125A76-S121 PolarHBondContact O-OG 2.94Å; S80-S121 VanDerWaalsContact CB-OG 3.29Å; S80-S121 WeakPolarHBondContact CB-OG 3.08Å; S117-S121 PolarHBondContact O-N 3.37Å; L118-S121 PolarHBondContact O-N 3.28Å; S121-L123 PolarHBondContact O-N 3.18Å; S121-L124 WeakPolarHBondContact O-CB 3.4Å; S121-L124 PolarHBondContact O-N 2.92Å; S121-L125 WeakPolarHBondContact O-CB 3.45Å; S121-L125 PolarHBondContact O-N 3.15Å
122S66.4Low69.6Low48 Ų4854 Ų5434%0.33626%0.264SS..Hα-helixtrans-64.6-41.1176.8-57.80000112.1L118 K119 W120 L125 L126L118-S122 WeakPolarHBondContact O-CB 3.4Å; L118-S122 PolarHBondContact O-N 3.24Å; L118-S122 PolarHBondContact O-OG 3.31Å; K119-S122 PolarHBondContact O-N 3.47Å; W120-S122 PolarHBondContact O-N 3.48Å; S122-L125 PolarHBondContact O-N 3.33Å; S122-L126 WeakPolarHBondContact O-CG 2.99Å; S122-L126 PolarHBondContact O-N 3.01Å
123L73.1Confident69.5Low72 Ų7256.5 Ų56.538%0.37727%0.268SS..Hα-helixtrans-64.2-43.4175.1-80166.6000111.9K119 W120 S121 L125 L126 A127K119-L123 HydrophobicContact CG-CD1 4.2Å; K119-L123 WeakPolarHBondContact O-CG 3.45Å; K119-L123 PolarHBondContact O-N 3.14Å; W120-L123 HydrophobicContact CE3-CD1 4.23Å; W120-L123 HydrophobicContact CZ3-CD1 4.44Å; W120-L123 PolarHBondContact O-N 3.07Å; S121-L123 PolarHBondContact O-N 3.18Å; L123-L125 VanDerWaalsContact C-N 3.31Å; L123-L125 PolarHBondContact O-N 3.16Å; L123-L126 PolarHBondContact O-N 3.39Å; L123-A127 WeakPolarHBondContact O-CB 3.4Å; L123-A127 PolarHBondContact O-N 3.27Å
124L71.6Confident69.7Low3 Ų358 Ų582%0.01628%0.276CS..Hα-helixtrans-56.9-46.4174.9-176.261000111.3W49 T50 T53 A76 W120 S121 A127 A128W49-L124 HydrophobicContact CB-CD2 4.29Å; W49-L124 HydrophobicContact CG-CD2 4.13Å; T50-L124 HydrophobicContact CG2-CB 3.63Å; T50-L124 HydrophobicContact CG2-CD1 4.01Å; T50-L124 HydrophobicContact CG2-CD2 4.45Å; T50-L124 HydrophobicContact CG2-CG 4.23Å; T53-L124 HydrophobicContact CG2-CD1 4.34Å; T53-L124 WeakPolarHBondContact OG1-CD1 3.39Å; A76-L124 HydrophobicContact CB-CB 4.4Å; A76-L124 HydrophobicContact CB-CD2 3.44Å; A76-L124 VanDerWaalsContact CB-CD2 3.44Å; A76-L124 HydrophobicContact CB-CG 3.86Å; W120-L124 WeakPolarHBondContact O-CB 3.31Å; W120-L124 PolarHBondContact O-N 2.8Å; S121-L124 WeakPolarHBondContact O-CB 3.4Å; S121-L124 PolarHBondContact O-N 2.92Å; L124-A127 PolarHBondContact O-N 3.45Å; L124-A128 WeakPolarHBondContact O-CB 3.27Å; L124-A128 PolarHBondContact O-N 3.45Å
125L69.9Low69.8Low37 Ų3758.7 Ų58.719%0.19428%0.279CS..Hα-helixtrans-64.3-44.2-179.2-176.762.5000112.2L73 I77 S121 S122 L123 K129L73-L125 HydrophobicContact CD2-CD1 3.32Å; L73-L125 HydrophobicContact CG-CD1 3.75Å; I77-L125 HydrophobicContact CD1-CD1 4.05Å; I77-L125 HydrophobicContact CG1-CD1 3.76Å; I77-L125 HydrophobicContact CG1-CD2 4.3Å; S121-L125 WeakPolarHBondContact O-CB 3.45Å; S121-L125 PolarHBondContact O-N 3.15Å; S122-L125 PolarHBondContact O-N 3.33Å; L123-L125 VanDerWaalsContact C-N 3.31Å; L123-L125 PolarHBondContact O-N 3.16Å; L125-K129 WeakPolarHBondContact O-CB 3.27Å; L125-K129 WeakPolarHBondContact O-CG 3.44Å; L125-K129 PolarHBondContact O-N 3.2Å
126L72.7Confident69.5Low116 Ų11658.7 Ų58.761%0.60728%0.279SS*.Hα-helixtrans-66.2-42.4178.2-72.6172.9000111.7S122 L123 R130S122-L126 WeakPolarHBondContact O-CG 2.99Å; S122-L126 PolarHBondContact O-N 3.01Å; L123-L126 PolarHBondContact O-N 3.39Å; L126-R130 WeakPolarHBondContact O-CB 3.27Å; L126-R130 PolarHBondContact O-N 3.23Å
127A68.7Low69.1Low15 Ų1559.7 Ų59.712%0.12429%0.286CS..Hα-helixtrans-61.3-50.1175.700000110.9L123 L124 K129 R130 Y131L123-A127 WeakPolarHBondContact O-CB 3.4Å; L123-A127 PolarHBondContact O-N 3.27Å; L124-A127 PolarHBondContact O-N 3.45Å; A127-K129 PolarHBondContact O-N 2.88Å; A127-R130 PolarHBondContact O-N 3.14Å; A127-Y131 HydrophobicContact CB-CD2 4.44Å; A127-Y131 HydrophobicContact CB-CE2 3.96Å; A127-Y131 WeakPolarHBondContact O-CD2 3.45Å; A127-Y131 PolarHBondContact O-N 2.99Å
128A67.3Low68.9Low2 Ų262.8 Ų62.82%0.01730%0.301CS..Hα-helixtrans-61.5-41.2179.400000112.9L69 L73 L124 R132L69-A128 HydrophobicContact CD1-CB 4.33Å; L73-A128 HydrophobicContact CB-CB 4.42Å; L73-A128 HydrophobicContact CD1-CB 3.98Å; L73-A128 HydrophobicContact CG-CB 4.11Å; L124-A128 WeakPolarHBondContact O-CB 3.27Å; L124-A128 PolarHBondContact O-N 3.45Å; A128-R132 WeakPolarHBondContact O-CB 3.34Å; A128-R132 PolarHBondContact O-N 2.96Å
129K71Confident68.6Low122 Ų12263.1 Ų63.153%0.5331%0.309SS..Hα-helixtrans-63.6-43.1174.7-79.5-174.8177.5-176.40112L73 L125 A127 R132 K133L73-K129 HydrophobicContact CD1-CG 4.28Å; L125-K129 WeakPolarHBondContact O-CB 3.27Å; L125-K129 WeakPolarHBondContact O-CG 3.44Å; L125-K129 PolarHBondContact O-N 3.2Å; A127-K129 PolarHBondContact O-N 2.88Å; K129-R132 PolarHBondContact O-N 3.4Å; K129-K133 PolarHBondContact O-N 3.18Å; K129-K133 VanDerWaalsContact O-N 3.13Å
130R72.9Confident68Low171 Ų17163.9 Ų63.965%0.64532%0.316SS*.Hα-helixtrans-63.8-46.9179.7-172.2176.6-177.91791.1111.3L126 A127 R132 K133 E134L126-R130 WeakPolarHBondContact O-CB 3.27Å; L126-R130 PolarHBondContact O-N 3.23Å; A127-R130 PolarHBondContact O-N 3.14Å; R130-R132 PolarHBondContact O-N 3.49Å; R130-K133 PolarHBondContact O-N 3.43Å; R130-E134 PolarHBondContact O-N 3.17Å; R130-E134 VanDerWaalsContact O-N 3.11Å
131Y67.9Low67.5Low13 Ų1369.7 Ų69.75%0.05135%0.346CS..Hα-helixtrans-61.8-43.5177.5-61.6-37000111.7T6 H54 Y57 A127 K133 E134 F135T6-Y131 WeakPolarHBondContact CG2-OH 3.35Å; H54-Y131 PolarHBondContact CE1-OH 2.96Å; H54-Y131 AromaticContact ND1-CZ 3.93Å; H54-Y131 PolarHBondContact ND1-OH 2.95Å; Y57-Y131 HydrophobicContact CD1-CD1 4.33Å; Y57-Y131 AromaticContact CD1-CE1 3.62Å; Y57-Y131 HydrophobicContact CD1-CE1 3.62Å; Y57-Y131 AromaticContact CD1-CZ 3.8Å; Y57-Y131 AromaticContact CD2-CD1 3.24Å; Y57-Y131 HydrophobicContact CD2-CD1 3.24Å; Y57-Y131 HydrophobicContact CD2-CD2 4.07Å; Y57-Y131 AromaticContact CD2-CE1 3.4Å; Y57-Y131 HydrophobicContact CD2-CE1 3.4Å; Y57-Y131 VanDerWaalsContact CD2-CE1 3.4Å; Y57-Y131 HydrophobicContact CD2-CE2 4.22Å; Y57-Y131 AromaticContact CD2-CG 3.59Å; Y57-Y131 HydrophobicContact CD2-CG 3.59Å; Y57-Y131 AromaticContact CD2-CZ 3.89Å; Y57-Y131 HydrophobicContact CE1-CD1 4.22Å; Y57-Y131 AromaticContact CE1-CE1 3.59Å; Y57-Y131 HydrophobicContact CE1-CE1 3.59Å; Y57-Y131 AromaticContact CE2-CD1 3.1Å; Y57-Y131 HydrophobicContact CE2-CD1 3.1Å; Y57-Y131 AromaticContact CE2-CE1 3.37Å; Y57-Y131 HydrophobicContact CE2-CE1 3.37Å; Y57-Y131 AromaticContact CE2-CG 3.86Å; Y57-Y131 HydrophobicContact CE2-CG 3.86Å; Y57-Y131 AromaticContact CG-CD1 3.86Å; Y57-Y131 HydrophobicContact CG-CD1 3.86Å; Y57-Y131 HydrophobicContact CG-CD2 4.34Å; Y57-Y131 AromaticContact CG-CE1 3.51Å; Y57-Y131 HydrophobicContact CG-CE1 3.51Å; Y57-Y131 HydrophobicContact CG-CE2 4.05Å; Y57-Y131 HydrophobicContact CG-CG 4.26Å; Y57-Y131 AromaticContact CG-CZ 3.6Å; Y57-Y131 AromaticContact CZ-CD1 3.62Å; Y57-Y131 AromaticContact CZ-CE1 3.44Å; Y57-Y131 VanDerWaalsContact CZ-CE1 3.44Å; A127-Y131 HydrophobicContact CB-CD2 4.44Å; A127-Y131 HydrophobicContact CB-CE2 3.96Å; A127-Y131 WeakPolarHBondContact O-CD2 3.45Å; A127-Y131 PolarHBondContact O-N 2.99Å; Y131-K133 VanDerWaalsContact C-N 3.29Å; Y131-K133 PolarHBondContact O-N 3.03Å; Y131-E134 PolarHBondContact O-N 2.73Å; Y131-F135 WeakPolarHBondContact O-CD2 3.35Å; Y131-F135 PolarHBondContact O-N 3.38Å
132R68.4Low67Low130 Ų13073.8 Ų73.849%0.49138%0.375SS..Hα-helixtrans-58.4-39.3176-175.7176.3175.1-171.3-5.2113L69 A128 K129 R130 A136L69-R132 HydrophobicContact CD2-CB 4.26Å; A128-R132 WeakPolarHBondContact O-CB 3.34Å; A128-R132 PolarHBondContact O-N 2.96Å; K129-R132 PolarHBondContact O-N 3.4Å; R130-R132 PolarHBondContact O-N 3.49Å; R132-A136 WeakPolarHBondContact O-CB 3.24Å; R132-A136 PolarHBondContact O-N 2.92Å; R132-A136 VanDerWaalsContact O-N 3.12Å
133K70.7Confident66.6Low149 Ų14978.6 Ų78.665%0.64840%0.397SS*.Hα-helixtrans-67.1-43.8178.9-166177.2-179.8-178.50111.3K129 R130 Y131 F135 A136 D137K129-K133 PolarHBondContact O-N 3.18Å; K129-K133 VanDerWaalsContact O-N 3.13Å; R130-K133 PolarHBondContact O-N 3.43Å; Y131-K133 VanDerWaalsContact C-N 3.29Å; Y131-K133 PolarHBondContact O-N 3.03Å; K133-F135 PolarHBondContact O-N 3.42Å; K133-A136 PolarHBondContact O-N 2.97Å; K133-D137 PolarHBondContact O-N 3.31Å; K133-D137 VanDerWaalsContact O-N 3.13Å
134E71.2Confident65.6Low73 Ų7386.2 Ų86.234%0.34143%0.428SS..Hα-helixtrans-63-41.4178.9-160.8167.2-149.400112Y57 R130 Y131 I138Y57-E134 PolarHBondContact OH-OE2 2.94Å; R130-E134 PolarHBondContact O-N 3.17Å; R130-E134 VanDerWaalsContact O-N 3.11Å; Y131-E134 PolarHBondContact O-N 2.73Å; E134-I138 HydrophobicContact CG-CD1 4.49Å; E134-I138 WeakPolarHBondContact O-CD1 3.27Å; E134-I138 VanDerWaalsContact O-CG1 3.24Å; E134-I138 WeakPolarHBondContact O-CG1 3.46Å; E134-I138 PolarHBondContact O-N 2.99Å
135F65.1Low65.3Low20 Ų2090.4 Ų90.49%0.08845%0.448CS..Hα-helixtrans-71-32.5175.9-71.5-66.8000113.7Y57 W62 R63 Y131 K133 I138 S139Y57-F135 HydrophobicContact CD2-CE2 4.04Å; Y57-F135 HydrophobicContact CD2-CZ 4.15Å; Y57-F135 HydrophobicContact CE2-CE2 4.07Å; Y57-F135 HydrophobicContact CE2-CZ 4.11Å; W62-F135 HydrophobicContact CB-CE2 3.93Å; W62-F135 HydrophobicContact CB-CZ 4.13Å; R63-F135 HydrophobicContact CB-CE1 4.23Å; R63-F135 HydrophobicContact CG-CD1 4.25Å; R63-F135 HydrophobicContact CG-CE1 4.14Å; Y131-F135 WeakPolarHBondContact O-CD2 3.35Å; Y131-F135 PolarHBondContact O-N 3.38Å; K133-F135 PolarHBondContact O-N 3.42Å; F135-I138 PolarHBondContact O-N 3.32Å; F135-S139 PolarHBondContact O-N 3.38Å; F135-S139 PolarHBondContact O-OG 3.05Å
136A64.3Low65Low42 Ų4293.2 Ų93.235%0.34746%0.462SS..Hα-helixtrans-65.8-4317600000111.6R132 K133 I138 S139 I140R132-A136 WeakPolarHBondContact O-CB 3.24Å; R132-A136 PolarHBondContact O-N 2.92Å; R132-A136 VanDerWaalsContact O-N 3.12Å; K133-A136 PolarHBondContact O-N 2.97Å; A136-I138 PolarHBondContact O-N 3.18Å; A136-S139 WeakPolarHBondContact CA-OG 3.23Å; A136-S139 PolarHBondContact O-N 3.5Å; A136-S139 PolarHBondContact O-OG 3.46Å; A136-I140 WeakPolarHBondContact O-CD1 3.5Å; A136-I140 VanDerWaalsContact O-CG1 3.32Å; A136-I140 WeakPolarHBondContact O-CG1 3.45Å; A136-I140 PolarHBondContact O-N 3.35Å; A136-I140 VanDerWaalsContact O-N 3.13Å
137D63Low64.6Low88 Ų8891.9 Ų91.947%0.47145%0.453SS..Hα-helixtrans-64.2-40.1176.6-73.1-22.2000111.6K133 I140 L141K133-D137 PolarHBondContact O-N 3.31Å; K133-D137 VanDerWaalsContact O-N 3.13Å; D137-I140 PolarHBondContact O-N 2.77Å; D137-L141 PolarHBondContact O-N 2.93Å; D137-L141 VanDerWaalsContact O-N 3.15Å
138I64.5Low64.4Low67 Ų6796.4 Ų96.434%0.34447%0.473SS..Hα-helixtrans-66-40.5176.6-64.1162.8000111.5R63 E134 F135 A136 I140 L141 S142R63-I138 VanDerWaalsContact NH2-CG2 3.3Å; E134-I138 HydrophobicContact CG-CD1 4.49Å; E134-I138 WeakPolarHBondContact O-CD1 3.27Å; E134-I138 VanDerWaalsContact O-CG1 3.24Å; E134-I138 WeakPolarHBondContact O-CG1 3.46Å; E134-I138 PolarHBondContact O-N 2.99Å; F135-I138 PolarHBondContact O-N 3.32Å; A136-I138 PolarHBondContact O-N 3.18Å; I138-I140 VanDerWaalsContact C-N 3.3Å; I138-I140 PolarHBondContact O-N 3.33Å; I138-L141 PolarHBondContact O-N 3.05Å; I138-S142 PolarHBondContact O-N 3.38Å; I138-S142 VanDerWaalsContact O-N 3.13Å; I138-S142 PolarHBondContact O-OG 3.39Å
139S59.2Low64.2Low65 Ų65102.3 Ų102.346%0.45550%0.501SS..Hα-helixtrans-65.5-33.317858.60000113.2F135 A136 S142F135-S139 PolarHBondContact O-N 3.38Å; F135-S139 PolarHBondContact O-OG 3.05Å; A136-S139 WeakPolarHBondContact CA-OG 3.23Å; A136-S139 PolarHBondContact O-N 3.5Å; A136-S139 PolarHBondContact O-OG 3.46Å; S139-S142 PolarHBondContact O-OG 3.13Å
140I63.3Low63.7Low97 Ų97101 Ų10150%0.49750%0.499SS..Hα-helixtrans-69.5-41.5176.4-69.4163.4000110.2A136 D137 I138 S142 D143 F144A136-I140 WeakPolarHBondContact O-CD1 3.5Å; A136-I140 VanDerWaalsContact O-CG1 3.32Å; A136-I140 WeakPolarHBondContact O-CG1 3.45Å; A136-I140 PolarHBondContact O-N 3.35Å; A136-I140 VanDerWaalsContact O-N 3.13Å; D137-I140 PolarHBondContact O-N 2.77Å; I138-I140 VanDerWaalsContact C-N 3.3Å; I138-I140 PolarHBondContact O-N 3.33Å; I140-S142 VanDerWaalsContact C-N 3.33Å; I140-S142 PolarHBondContact O-N 2.99Å; I140-D143 PolarHBondContact O-N 3.31Å; I140-F144 HydrophobicContact CG2-CE2 4.27Å; I140-F144 WeakPolarHBondContact O-CD2 3.31Å
141L58.8Low63.1Low132 Ų13296 Ų9669%0.69149%0.489SS*.Hα-helixtrans-68.2-27.4178.3-81.1161.9000113.9D137 I138 D143D137-L141 PolarHBondContact O-N 2.93Å; D137-L141 VanDerWaalsContact O-N 3.15Å; I138-L141 PolarHBondContact O-N 3.05Å; L141-D143 VanDerWaalsContact C-N 3.32Å
142S56.7Low62.7Low87 Ų87102.4 Ų102.461%0.60852%0.523SS*.THydrogen-bonded Turntrans-79.8-12.8177.256.70000114.5I138 S139 I140I138-S142 PolarHBondContact O-N 3.38Å; I138-S142 VanDerWaalsContact O-N 3.13Å; I138-S142 PolarHBondContact O-OG 3.39Å; S139-S142 PolarHBondContact O-OG 3.13Å; I140-S142 VanDerWaalsContact C-N 3.33Å; I140-S142 PolarHBondContact O-N 2.99Å
143D58.1Low62.2Low150 Ų150100.1 Ų100.180%0.80253%0.525SS*.THydrogen-bonded Turntrans-93.90.3-178.1-126.80.4000112.7I140 L141I140-D143 PolarHBondContact O-N 3.31Å; L141-D143 VanDerWaalsContact C-N 3.32Å
144F51.8Low61.4Low231 Ų23195.6 Ų95.6100%1.01351%0.514SS*.  trans-100.20171.8-82.1-80.8000110.8I140I140-F144 HydrophobicContact CG2-CE2 4.27Å; I140-F144 WeakPolarHBondContact O-CD2 3.31Å

Retrieved 144 of 144 residues in 218.2 ms (Link to these results)

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