A0A096MV86_PAPAN Loading...

Chromosome 6 open reading frame 58

AlphaFold DB , UniProt , Accession A0A096MV86, Species PAPAN (Papio anubis, Olive baboon), Gene C6orf58, Length 330 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
1M31Very low50.6Low235 Ų23590.3 Ų90.3100%1.15851%0.51SS*.  098.50-72.9-172-8100107.7
2A34.5Very low51.4Low100 Ų10085.6 Ų85.683%0.82649%0.485SS*.  trans-78.3119.9172.100000107.2L4A2-L4 PolarHBondContact O-N 2.87Å; A2-L4 VanDerWaalsContact O-N 3.16Å
3F36.9Very low51.9Low197 Ų19781.8 Ų81.886%0.86448%0.476SS*.  trans-62.2115.4171-80.5-91.2000107.8P5F3-P5 WeakPolarHBondContact O-CD 3.24Å
4L47.5Very low52.4Low86 Ų8682.2 Ų82.245%0.4547%0.467SS..  trans-61.5119.2167.3-74.8165000106.8A2 V8 A249 V250A2-L4 PolarHBondContact O-N 2.87Å; A2-L4 VanDerWaalsContact O-N 3.16Å; L4-V8 HydrophobicContact CD2-CG1 4.41Å; L4-A249 HydrophobicContact CD2-CB 4.36Å; L4-V250 HydrophobicContact CD1-CG1 3.92Å; L4-V250 HydrophobicContact CD2-CG1 4.14Å
5P56.1Low52.8Low47 Ų4777.7 Ų77.731%0.30544%0.44SS..  trans-69145-173.828.5-35.1000110.6F3 W7 V8 Y246F3-P5 WeakPolarHBondContact O-CD 3.24Å; P5-W7 HydrophobicContact CB-CZ2 4.44Å; P5-W7 HydrophobicContact CG-CD2 4.37Å; P5-W7 HydrophobicContact CG-CH2 4.48Å; P5-W7 HydrophobicContact CG-CZ2 3.46Å; P5-W7 VanDerWaalsContact CG-CZ2 3.46Å; P5-W7 PolarHBondContact O-N 3.46Å; P5-V8 HydrophobicContact CG-CG2 4.02Å; P5-V8 WeakPolarHBondContact O-CB 3.49Å; P5-V8 WeakPolarHBondContact O-CG2 3.36Å; P5-V8 PolarHBondContact O-N 3.03Å; P5-Y246 HydrophobicContact CG-CE1 4.27Å
6S58.1Low52.8Low99 Ų9976.1 Ų76.169%0.69244%0.435SS*.Hα-helixtrans-44.4-32.9-169.51790000115.3V8 C9 V10S6-V8 VanDerWaalsContact C-N 3.32Å; S6-V8 PolarHBondContact O-N 3.12Å; S6-C9 WeakPolarHBondContact O-CB 3.33Å; S6-C9 PolarHBondContact O-N 3.3Å; S6-V10 PolarHBondContact O-N 2.75Å
7W54.8Low52.6Low52 Ų5276.6 Ų76.620%0.19745%0.451CS..Hα-helixtrans-70.7-21.1-179.755.9-89.8000114.2P5 V10 L11 Y246 L297P5-W7 HydrophobicContact CB-CZ2 4.44Å; P5-W7 HydrophobicContact CG-CD2 4.37Å; P5-W7 HydrophobicContact CG-CH2 4.48Å; P5-W7 HydrophobicContact CG-CZ2 3.46Å; P5-W7 VanDerWaalsContact CG-CZ2 3.46Å; P5-W7 PolarHBondContact O-N 3.46Å; W7-V10 WeakPolarHBondContact O-CB 3.49Å; W7-V10 PolarHBondContact O-N 3.25Å; W7-L11 HydrophobicContact CE3-CD1 4.11Å; W7-L11 HydrophobicContact CZ3-CD1 4.1Å; W7-L11 PolarHBondContact O-N 3.32Å; W7-Y246 AromaticContact CH2-CD1 3.56Å; W7-Y246 HydrophobicContact CH2-CD1 3.56Å; W7-Y246 AromaticContact CH2-CD2 3.73Å; W7-Y246 HydrophobicContact CH2-CD2 3.73Å; W7-Y246 AromaticContact CH2-CE1 3.22Å; W7-Y246 HydrophobicContact CH2-CE1 3.22Å; W7-Y246 AromaticContact CH2-CE2 3.49Å; W7-Y246 HydrophobicContact CH2-CE2 3.49Å; W7-Y246 VanDerWaalsContact CH2-CE2 3.49Å; W7-Y246 AromaticContact CH2-CG 3.78Å; W7-Y246 HydrophobicContact CH2-CG 3.78Å; W7-Y246 AromaticContact CH2-CZ 3.19Å; W7-Y246 HydrophobicContact CZ2-CD1 4.24Å; W7-Y246 AromaticContact CZ2-CE1 3.52Å; W7-Y246 HydrophobicContact CZ2-CE1 3.52Å; W7-Y246 HydrophobicContact CZ2-CE2 4.22Å; W7-Y246 AromaticContact CZ2-CZ 3.52Å; W7-Y246 WeakPolarHBondContact CZ2-OH 3.34Å; W7-Y246 HydrophobicContact CZ3-CD1 4.21Å; W7-Y246 HydrophobicContact CZ3-CD2 4.31Å; W7-Y246 HydrophobicContact CZ3-CE1 4.27Å; W7-Y246 HydrophobicContact CZ3-CE2 4.45Å; W7-Y246 HydrophobicContact CZ3-CG 4.21Å; W7-L297 HydrophobicContact CE3-CB 4.43Å; W7-L297 HydrophobicContact CE3-CD1 4.35Å; W7-L297 HydrophobicContact CH2-CB 4.47Å; W7-L297 HydrophobicContact CH2-CD1 3.03Å; W7-L297 HydrophobicContact CH2-CD2 4.22Å; W7-L297 HydrophobicContact CH2-CG 4.06Å; W7-L297 HydrophobicContact CZ2-CD1 3.81Å; W7-L297 HydrophobicContact CZ3-CB 3.97Å; W7-L297 HydrophobicContact CZ3-CD1 3.33Å; W7-L297 HydrophobicContact CZ3-CD2 3.8Å; W7-L297 HydrophobicContact CZ3-CG 3.87Å
8V57.3Low52.4Low4 Ų475.4 Ų75.42%0.02445%0.447CS..Hα-helixtrans-67.5-42.4170.9-179.40000110.6L4 P5 S6 V10 L11 V12 Y246 V250L4-V8 HydrophobicContact CD2-CG1 4.41Å; P5-V8 HydrophobicContact CG-CG2 4.02Å; P5-V8 WeakPolarHBondContact O-CB 3.49Å; P5-V8 WeakPolarHBondContact O-CG2 3.36Å; P5-V8 PolarHBondContact O-N 3.03Å; S6-V8 VanDerWaalsContact C-N 3.32Å; S6-V8 PolarHBondContact O-N 3.12Å; V8-V10 PolarHBondContact O-N 3.15Å; V8-L11 PolarHBondContact O-N 2.76Å; V8-V12 WeakPolarHBondContact O-CB 3.45Å; V8-V12 WeakPolarHBondContact O-CG2 3.45Å; V8-V12 PolarHBondContact O-N 2.75Å; V8-Y246 HydrophobicContact CG2-CD1 3.37Å; V8-Y246 HydrophobicContact CG2-CE1 3.84Å; V8-Y246 HydrophobicContact CG2-CG 4.28Å; V8-V250 HydrophobicContact CG1-CG1 3.61Å
9C58.2Low52.4Low86 Ų8675.2 Ų75.258%0.58144%0.443SS*.Hα-helixtrans-65.8-29.9173.3-63.40000111.5S6 G13S6-C9 WeakPolarHBondContact O-CB 3.33Å; S6-C9 PolarHBondContact O-N 3.3Å; C9-G13 VanDerWaalsContact O-CA 3.29Å; C9-G13 WeakPolarHBondContact O-CA 3.49Å; C9-G13 PolarHBondContact O-N 3.04Å
10V60.7Low51.8Low74 Ų7476.6 Ų76.645%0.44846%0.463SS..Hα-helixtrans-70.7-45.3173.2176.80000111.3S6 W7 V8 G13 Y14 I293S6-V10 PolarHBondContact O-N 2.75Å; W7-V10 WeakPolarHBondContact O-CB 3.49Å; W7-V10 PolarHBondContact O-N 3.25Å; V8-V10 PolarHBondContact O-N 3.15Å; V10-G13 PolarHBondContact O-N 3Å; V10-Y14 WeakPolarHBondContact O-CB 3.25Å; V10-Y14 PolarHBondContact O-N 3.33Å; V10-I293 HydrophobicContact CG1-CD1 4.28Å
11L61.5Low51.7Low13 Ų1375.5 Ų75.57%0.06847%0.468CS..Hα-helixtrans-56.3-59173-79.5170000110.2W7 V8 G13 Y14 F15 I293W7-L11 HydrophobicContact CE3-CD1 4.11Å; W7-L11 HydrophobicContact CZ3-CD1 4.1Å; W7-L11 PolarHBondContact O-N 3.32Å; V8-L11 PolarHBondContact O-N 2.76Å; L11-G13 VanDerWaalsContact C-N 3.3Å; L11-G13 PolarHBondContact O-N 3.32Å; L11-Y14 PolarHBondContact O-N 3.41Å; L11-F15 VanDerWaalsContact C-CD2 3.45Å; L11-F15 HydrophobicContact CB-CD2 4.39Å; L11-F15 HydrophobicContact CB-CE2 4.1Å; L11-F15 HydrophobicContact CD2-CE2 3.91Å; L11-F15 HydrophobicContact CD2-CZ 4.41Å; L11-F15 WeakPolarHBondContact O-CD2 3.47Å; L11-F15 WeakPolarHBondContact O-CG 3.48Å; L11-F15 PolarHBondContact O-N 3.35Å; L11-I293 HydrophobicContact CD1-CG2 3.98Å; L11-I293 HydrophobicContact CD2-CB 3.68Å; L11-I293 HydrophobicContact CD2-CD1 4.02Å; L11-I293 HydrophobicContact CD2-CG1 4.46Å; L11-I293 HydrophobicContact CD2-CG2 3.28Å; L11-I293 HydrophobicContact CG-CB 4.39Å; L11-I293 HydrophobicContact CG-CG2 3.45Å; L11-I293 VanDerWaalsContact CG-CG2 3.45Å
12V59.8Low52.2Low34 Ų3471.6 Ų71.621%0.20646%0.458CS..Hα-helixtrans-61.3-38.9-178.2177.20000111.6V8 S16 V250V8-V12 WeakPolarHBondContact O-CB 3.45Å; V8-V12 WeakPolarHBondContact O-CG2 3.45Å; V8-V12 PolarHBondContact O-N 2.75Å; V12-S16 WeakPolarHBondContact O-CB 3.16Å; V12-S16 PolarHBondContact O-N 2.79Å; V12-S16 PolarHBondContact O-OG 2.76Å; V12-V250 HydrophobicContact CG2-CG2 4.05Å
13G57.8Low53.1Low36 Ų3668.9 Ų68.937%0.37143%0.432SS..Hα-helixtrans-67.7-40.2177.500000113.3C9 V10 L11 S16 A17C9-G13 VanDerWaalsContact O-CA 3.29Å; C9-G13 WeakPolarHBondContact O-CA 3.49Å; C9-G13 PolarHBondContact O-N 3.04Å; V10-G13 PolarHBondContact O-N 3Å; L11-G13 VanDerWaalsContact C-N 3.3Å; L11-G13 PolarHBondContact O-N 3.32Å; G13-S16 CarbonylContact O-C 3.56Å; G13-S16 PolarHBondContact O-N 3.11Å; G13-S16 VanDerWaalsContact O-N 3.1Å; G13-A17 WeakPolarHBondContact O-CB 3.1Å; G13-A17 PolarHBondContact O-N 3.48Å
14Y59.7Low54.1Low88 Ų8864.8 Ų64.835%0.34542%0.42SS..Hα-helixtrans-72.2-35.1177.7-155.3-108000111.8V10 L11 S16 S18 F286 V289 V290V10-Y14 WeakPolarHBondContact O-CB 3.25Å; V10-Y14 PolarHBondContact O-N 3.33Å; L11-Y14 PolarHBondContact O-N 3.41Å; Y14-S16 PolarHBondContact O-N 3.34Å; Y14-S18 PolarHBondContact O-N 2.9Å; Y14-S18 PolarHBondContact O-OG 3.37Å; Y14-F286 AromaticContact CD1-CD2 3.8Å; Y14-F286 HydrophobicContact CD1-CD2 3.8Å; Y14-F286 AromaticContact CD1-CE2 3.55Å; Y14-F286 HydrophobicContact CD1-CE2 3.55Å; Y14-F286 AromaticContact CE1-CD2 3.39Å; Y14-F286 HydrophobicContact CE1-CD2 3.39Å; Y14-F286 AromaticContact CE1-CE2 3.68Å; Y14-F286 HydrophobicContact CE1-CE2 3.68Å; Y14-V289 HydrophobicContact CD1-CG1 3.88Å; Y14-V289 HydrophobicContact CE1-CB 3.71Å; Y14-V289 HydrophobicContact CE1-CG1 3.37Å; Y14-V289 HydrophobicContact CE1-CG2 4.43Å; Y14-V289 HydrophobicContact CE2-CG1 4.24Å; Y14-V289 HydrophobicContact CG-CG1 4.49Å; Y14-V290 HydrophobicContact CD1-CG2 4.44Å
15F58.1Low54.6Low15 Ų1563.6 Ų63.67%0.06641%0.413CS..Hα-helixtrans-66.4-24.3167.7-67.5-56.8000113L11 L19 F262 F286 V290L11-F15 VanDerWaalsContact C-CD2 3.45Å; L11-F15 HydrophobicContact CB-CD2 4.39Å; L11-F15 HydrophobicContact CB-CE2 4.1Å; L11-F15 HydrophobicContact CD2-CE2 3.91Å; L11-F15 HydrophobicContact CD2-CZ 4.41Å; L11-F15 WeakPolarHBondContact O-CD2 3.47Å; L11-F15 WeakPolarHBondContact O-CG 3.48Å; L11-F15 PolarHBondContact O-N 3.35Å; F15-L19 WeakPolarHBondContact O-CD2 3.3Å; F15-L19 WeakPolarHBondContact O-CG 3.42Å; F15-F262 HydrophobicContact CB-CD2 4.42Å; F15-F262 HydrophobicContact CD1-CB 4.41Å; F15-F262 AromaticContact CD1-CD2 3.42Å; F15-F262 HydrophobicContact CD1-CD2 3.42Å; F15-F262 VanDerWaalsContact CD1-CD2 3.42Å; F15-F262 AromaticContact CD1-CE2 3.95Å; F15-F262 HydrophobicContact CD1-CE2 3.95Å; F15-F262 HydrophobicContact CD1-CG 4.14Å; F15-F262 AromaticContact CD2-CD2 3.66Å; F15-F262 HydrophobicContact CD2-CD2 3.66Å; F15-F262 AromaticContact CD2-CE2 3.64Å; F15-F262 HydrophobicContact CD2-CE2 3.64Å; F15-F262 AromaticContact CE1-CD2 3.44Å; F15-F262 HydrophobicContact CE1-CD2 3.44Å; F15-F262 VanDerWaalsContact CE1-CD2 3.44Å; F15-F262 AromaticContact CE1-CE2 3.54Å; F15-F262 HydrophobicContact CE1-CE2 3.54Å; F15-F262 HydrophobicContact CE1-CG 4.13Å; F15-F262 HydrophobicContact CE1-CZ 4.25Å; F15-F262 AromaticContact CE2-CD2 3.72Å; F15-F262 HydrophobicContact CE2-CD2 3.72Å; F15-F262 AromaticContact CE2-CE2 3.24Å; F15-F262 HydrophobicContact CE2-CE2 3.24Å; F15-F262 HydrophobicContact CE2-CZ 4.21Å; F15-F262 AromaticContact CG-CD2 3.57Å; F15-F262 HydrophobicContact CG-CD2 3.57Å; F15-F262 HydrophobicContact CG-CE2 4.02Å; F15-F262 AromaticContact CZ-CD2 3.62Å; F15-F262 HydrophobicContact CZ-CD2 3.62Å; F15-F262 AromaticContact CZ-CE2 3.19Å; F15-F262 HydrophobicContact CZ-CE2 3.19Å; F15-F262 AromaticContact CZ-CZ 3.85Å; F15-F262 HydrophobicContact CZ-CZ 3.85Å; F15-F286 AromaticContact CD1-CZ 3.95Å; F15-F286 HydrophobicContact CD1-CZ 3.95Å; F15-F286 HydrophobicContact CE1-CZ 4.2Å; F15-V290 HydrophobicContact CE1-CG1 4.2Å; F15-V290 HydrophobicContact CE1-CG2 3.73Å; F15-V290 HydrophobicContact CZ-CG1 3.9Å; F15-V290 HydrophobicContact CZ-CG2 3.95Å
16S53.4Low54.7Low51 Ų5165 Ų6536%0.35742%0.424SS..Hα-helixtrans-89.9-28.4178.7-56.90000113.6V12 G13 Y14 L19V12-S16 WeakPolarHBondContact O-CB 3.16Å; V12-S16 PolarHBondContact O-N 2.79Å; V12-S16 PolarHBondContact O-OG 2.76Å; G13-S16 CarbonylContact O-C 3.56Å; G13-S16 PolarHBondContact O-N 3.11Å; G13-S16 VanDerWaalsContact O-N 3.1Å; Y14-S16 PolarHBondContact O-N 3.34Å; S16-L19 WeakPolarHBondContact O-CB 3.24Å; S16-L19 WeakPolarHBondContact O-CD1 3.46Å; S16-L19 WeakPolarHBondContact O-CG 3.27Å
17A49Very low55Low85 Ų8565.6 Ų65.670%0.70242%0.42SS*.Hα-helixtrans-80.7-25.1-179.400000113.4G13 L19G13-A17 WeakPolarHBondContact O-CB 3.1Å; G13-A17 PolarHBondContact O-N 3.48Å; A17-L19 PolarHBondContact O-N 2.94Å
18S49.3Very low56.5Low55 Ų5563.5 Ų63.539%0.38541%0.413SS..THydrogen-bonded Turntrans-79.38.8177.152.10000114Y14 A20 F286Y14-S18 PolarHBondContact O-N 2.9Å; Y14-S18 PolarHBondContact O-OG 3.37Å; S18-A20 VanDerWaalsContact C-N 3.31Å; S18-A20 PolarHBondContact O-N 2.85Å; S18-F286 WeakPolarHBondContact OG-CZ 3.08Å
19L51.4Low58.1Low71 Ų7165.7 Ų65.737%0.37242%0.422SS..  trans-78.41.4-169-67.6178.2000115.9F15 S16 A17 G21 K261F15-L19 WeakPolarHBondContact O-CD2 3.3Å; F15-L19 WeakPolarHBondContact O-CG 3.42Å; S16-L19 WeakPolarHBondContact O-CB 3.24Å; S16-L19 WeakPolarHBondContact O-CD1 3.46Å; S16-L19 WeakPolarHBondContact O-CG 3.27Å; A17-L19 PolarHBondContact O-N 2.94Å; L19-G21 PolarHBondContact O-N 3.36Å; L19-K261 HydrophobicContact CD2-CB 4.1Å; L19-K261 HydrophobicContact CD2-CD 3.34Å; L19-K261 HydrophobicContact CD2-CG 4.36Å; L19-K261 PolarHBondContact O-NZ 2.95Å
20A40.5Very low59.8Low103 Ų10362 Ų6285%0.85140%0.397SS*.  trans-85104.5-178.400000112.1S18S18-A20 VanDerWaalsContact C-N 3.31Å; S18-A20 PolarHBondContact O-N 2.85Å
21G50.2Low61.4Low54 Ų5460.5 Ų60.556%0.55739%0.388SS*.  trans168.4135.4172.100000111.8L19L19-G21 PolarHBondContact O-N 3.36Å
22T42.4Very low63.1Low154 Ų15462.5 Ų62.595%0.94540%0.399SS*.  trans-79.3127168.546.80000108.3
23S53.1Low64.8Low42 Ų4262.5 Ų62.529%0.29440%0.395SS..  trans-125.6136.8173.717.50000107.7
24N57.1Low66.6Low111 Ų11169.1 Ų69.159%0.59441%0.414SS*.  trans-66.2144.3176-66-43.9000109.2S26 D27 I28N24-S26 PolarHBondContact O-N 3.12Å; N24-S26 VanDerWaalsContact O-N 3.12Å; N24-D27 WeakPolarHBondContact CB-OD2 3.45Å; N24-D27 WeakPolarHBondContact O-CB 3.32Å; N24-D27 PolarHBondContact O-N 3.26Å; N24-I28 WeakPolarHBondContact O-CG1 3.35Å
25L59.2Low68.4Low61 Ų6170.6 Ų70.632%0.31942%0.424SS..G310 helixtrans-59.6-27.3-177.6-151.479.3000112.8D27 I28 E83 L256L25-D27 VanDerWaalsContact C-N 3.34Å; L25-I28 PolarHBondContact O-N 2.92Å; L25-E83 WeakPolarHBondContact CD1-OE1 3.49Å; L25-L256 HydrophobicContact CD1-CD2 4.11Å; L25-L256 HydrophobicContact CG-CD2 4.43Å
26S56.9Low70.3Confident77 Ų7770 Ų7054%0.53842%0.422SS..G310 helixtrans-63.8-36172.954.10000113.2N24 I28N24-S26 PolarHBondContact O-N 3.12Å; N24-S26 VanDerWaalsContact O-N 3.12Å; S26-I28 PolarHBondContact O-N 3.4Å
27D64.9Low72.4Confident111 Ų11168.6 Ų68.659%0.59441%0.411SS*.G310 helixtrans-80.1-7.6-173.8-52.9-16.5000111.7N24 L25N24-D27 WeakPolarHBondContact CB-OD2 3.45Å; N24-D27 WeakPolarHBondContact O-CB 3.32Å; N24-D27 PolarHBondContact O-N 3.26Å; L25-D27 VanDerWaalsContact C-N 3.34Å
28I85.1Confident74.7Confident9 Ų965.3 Ų65.35%0.04639%0.385CS..G310 helixtrans-100.7-17.7-174.8-62175000110.8N24 L25 S26 L92 L256 S260N24-I28 WeakPolarHBondContact O-CG1 3.35Å; L25-I28 PolarHBondContact O-N 2.92Å; S26-I28 PolarHBondContact O-N 3.4Å; I28-L92 WeakPolarHBondContact O-CD2 3.39Å; I28-L256 HydrophobicContact CG2-CD1 3.68Å; I28-L256 HydrophobicContact CG2-CD2 4.39Å; I28-L256 HydrophobicContact CG2-CG 3.67Å; I28-S260 WeakPolarHBondContact CG2-OG 3.4Å
29K91.3Very high76.9Confident49 Ų4967.7 Ų67.721%0.21339%0.39CS..SBendtrans-76.2155.8179.1-62.4-61.9-179.8-168.80111.7W33 W88 L256K29-W33 HydrophobicContact CB-CB 3.93Å; K29-W33 HydrophobicContact CB-CG 3.96Å; K29-W33 HydrophobicContact CD-CG 4.44Å; K29-W33 HydrophobicContact CG-CG 4.29Å; K29-W88 HydrophobicContact CD-CH2 3.73Å; K29-W88 HydrophobicContact CD-CZ3 3.87Å; K29-L256 HydrophobicContact CD-CD1 4.05Å
30P94.7Very high79.1Confident9 Ų965.1 Ų65.16%0.05838%0.377CS..PPolyproline II helixtrans-57.9157.7172.5-2029.7000112.7W33 M61 P91 L92P30-W33 HydrophobicContact CB-CE3 4.38Å; P30-W33 HydrophobicContact CG-CE3 3.84Å; P30-W33 HydrophobicContact CG-CZ3 4.22Å; P30-W33 VanDerWaalsContact O-CB 3.3Å; P30-W33 WeakPolarHBondContact O-CB 3.47Å; P30-W33 PolarHBondContact O-N 3.08Å; P30-M61 HydrophobicContact CB-CE 3.44Å; P30-M61 VanDerWaalsContact CB-CE 3.44Å; P30-M61 HydrophobicContact CB-SD 3.96Å; P30-M61 HydrophobicContact CG-CE 4.12Å; P30-M61 HydrophobicContact CG-SD 4.07Å; P30-P91 HydrophobicContact CG-CB 3.94Å; P30-P91 WeakPolarHBondContact CG-O 3.18Å; P30-L92 HydrophobicContact CG-CD2 4.09Å
31P95.1Very high81.7Confident42 Ų4263.6 Ų63.627%0.27336%0.36SS..THydrogen-bonded Turntrans-52.4141.1170.3-23.834.4000111.9W33 Y57 Y98 K99P31-W33 PolarHBondContact O-N 3.24Å; P31-W33 VanDerWaalsContact O-N 3.11Å; P31-Y57 PolarHBondContact O-OH 3.32Å; P31-Y98 HydrophobicContact CB-CD1 3.8Å; P31-Y98 HydrophobicContact CB-CE1 3.97Å; P31-Y98 HydrophobicContact CG-CD1 4.06Å; P31-K99 HydrophobicContact CG-CB 4.3Å
32L95.8Very high84Confident55 Ų5565.1 Ų65.129%0.28836%0.355SS..THydrogen-bonded Turntrans55.428.1177.5-50.8170.1000114.8K34 E35 S36 Y57 L58 Y98 M120L32-K34 VanDerWaalsContact C-N 3.28Å; L32-K34 PolarHBondContact O-N 2.9Å; L32-E35 WeakPolarHBondContact CA-OE2 3.44Å; L32-E35 HydrophobicContact CB-CB 4.36Å; L32-E35 HydrophobicContact CD2-CG 4.48Å; L32-E35 PolarHBondContact O-N 3.48Å; L32-S36 PolarHBondContact O-N 3.12Å; L32-S36 PolarHBondContact O-OG 3.35Å; L32-Y57 HydrophobicContact CB-CE1 4.15Å; L32-Y57 HydrophobicContact CD1-CD1 4.11Å; L32-Y57 HydrophobicContact CD1-CE1 4Å; L32-Y57 HydrophobicContact CG-CE1 4.42Å; L32-L58 HydrophobicContact CB-CD2 3.57Å; L32-L58 HydrophobicContact CD1-CD2 3.96Å; L32-L58 HydrophobicContact CG-CD2 4.38Å; L32-Y98 HydrophobicContact CD1-CE1 4.28Å; L32-M120 HydrophobicContact CD1-CE 3.6Å; L32-M120 HydrophobicContact CD1-SD 3.86Å
33W96.4Very high86.6Confident35 Ų3558.4 Ų58.413%0.13331%0.313CS..THydrogen-bonded Turntrans-60.9-34.9-177.9-179.9-104.8000113.4K29 P30 P31 M61 K65 L68 W88 P91K29-W33 HydrophobicContact CB-CB 3.93Å; K29-W33 HydrophobicContact CB-CG 3.96Å; K29-W33 HydrophobicContact CD-CG 4.44Å; K29-W33 HydrophobicContact CG-CG 4.29Å; P30-W33 HydrophobicContact CB-CE3 4.38Å; P30-W33 HydrophobicContact CG-CE3 3.84Å; P30-W33 HydrophobicContact CG-CZ3 4.22Å; P30-W33 VanDerWaalsContact O-CB 3.3Å; P30-W33 WeakPolarHBondContact O-CB 3.47Å; P30-W33 PolarHBondContact O-N 3.08Å; P31-W33 PolarHBondContact O-N 3.24Å; P31-W33 VanDerWaalsContact O-N 3.11Å; W33-M61 HydrophobicContact CE3-CG 4.11Å; W33-M61 HydrophobicContact CE3-SD 3.89Å; W33-M61 HydrophobicContact CZ3-CG 4.3Å; W33-M61 HydrophobicContact CZ3-SD 3.81Å; W33-K65 HydrophobicContact CD2-CD 4.19Å; W33-K65 HydrophobicContact CE3-CD 4.42Å; W33-K65 VanDerWaalsContact CH2-CA 3.42Å; W33-K65 HydrophobicContact CH2-CB 3.42Å; W33-K65 VanDerWaalsContact CH2-CB 3.42Å; W33-K65 HydrophobicContact CH2-CD 4.19Å; W33-K65 HydrophobicContact CH2-CG 3.65Å; W33-K65 HydrophobicContact CZ2-CB 3.87Å; W33-K65 HydrophobicContact CZ2-CD 3.89Å; W33-K65 HydrophobicContact CZ2-CG 3.5Å; W33-K65 VanDerWaalsContact CZ2-CG 3.5Å; W33-K65 HydrophobicContact CZ3-CB 3.77Å; W33-K65 HydrophobicContact CZ3-CD 4.42Å; W33-K65 HydrophobicContact CZ3-CG 4.24Å; W33-K65 PolarHBondContact O-NZ 3.38Å; W33-L68 HydrophobicContact CH2-CD1 3.74Å; W33-L68 HydrophobicContact CZ2-CD1 4.34Å; W33-W88 AromaticContact CE2-CH2 3.95Å; W33-W88 AromaticContact CH2-CH2 3.87Å; W33-W88 HydrophobicContact CH2-CH2 3.87Å; W33-W88 AromaticContact CH2-CZ3 3.72Å; W33-W88 HydrophobicContact CH2-CZ3 3.72Å; W33-W88 AromaticContact CZ2-CH2 3.4Å; W33-W88 HydrophobicContact CZ2-CH2 3.4Å; W33-W88 VanDerWaalsContact CZ2-CH2 3.4Å; W33-W88 AromaticContact CZ2-CZ3 3.7Å; W33-W88 HydrophobicContact CZ2-CZ3 3.7Å; W33-W88 HydrophobicContact CZ3-CZ3 4.28Å; W33-P91 HydrophobicContact CZ3-CB 3.96Å; W33-P91 HydrophobicContact CZ3-CG 4.47Å
34K95.2Very high88.7Confident175 Ų17562 Ų6276%0.76132%0.32SS*.THydrogen-bonded Turntrans-73-39.6-178-70.8-177.5178.4178.10110.7L32 K65L32-K34 VanDerWaalsContact C-N 3.28Å; L32-K34 PolarHBondContact O-N 2.9Å; K34-K65 PolarHBondContact O-NZ 3.05Å
35E96.6Very high90.6Very high119 Ų11960.5 Ų60.556%0.55632%0.315SS*.THydrogen-bonded Turntrans-73.6-26.9-178.3-59.578-178.300112.2L32 L58L32-E35 WeakPolarHBondContact CA-OE2 3.44Å; L32-E35 HydrophobicContact CB-CB 4.36Å; L32-E35 HydrophobicContact CD2-CG 4.48Å; L32-E35 PolarHBondContact O-N 3.48Å; E35-L58 HydrophobicContact CB-CD2 4.32Å
36S97.9Very high92.4Very high3 Ų361.4 Ų61.42%0.02132%0.317CS..SBendtrans-67.1142.6177.8-590000112L32 G38 M61 K65L32-S36 PolarHBondContact O-N 3.12Å; L32-S36 PolarHBondContact O-OG 3.35Å; S36-G38 PolarHBondContact O-N 3.47Å; S36-M61 WeakPolarHBondContact OG-CB 3.1Å; S36-M61 WeakPolarHBondContact OG-CG 3.28Å; S36-K65 PolarHBondContact O-NZ 3.11Å
37P98.2Very high94.1Very high20 Ų2065.3 Ų65.313%0.1333%0.332CS..  trans-47.4131.8175.1-32.338.6000113.4D42 Y43 L58 G62 K65P37-D42 HydrophobicContact CB-CB 3.87Å; P37-Y43 HydrophobicContact CB-CE1 4.08Å; P37-Y43 HydrophobicContact CB-CE2 3.98Å; P37-Y43 HydrophobicContact CG-CD1 4.41Å; P37-Y43 HydrophobicContact CG-CE1 3.77Å; P37-L58 VanDerWaalsContact CD-O 3.28Å; P37-L58 WeakPolarHBondContact CD-O 3.36Å; P37-G62 VanDerWaalsContact O-CA 3.24Å; P37-G62 WeakPolarHBondContact O-CA 3.22Å; P37-K65 WeakPolarHBondContact O-CD 3.26Å
38G97Very high95.5Very high16 Ų1664.7 Ų64.717%0.16534%0.336CS..  trans-102-17.9-179.400000114.5S36 D42 I66 N69S36-G38 PolarHBondContact O-N 3.47Å; G38-D42 PolarHBondContact N-OD2 2.77Å; G38-I66 WeakPolarHBondContact O-CG1 3.36Å; G38-N69 PolarHBondContact O-ND2 2.9Å
39Q97Very high96.1Very high105 Ų10565.8 Ų65.849%0.49134%0.344SS..SBendtrans-148.2160.9-177.954.8-173.243.600110.6S41 D42 I66Q39-S41 VanDerWaalsContact C-N 3.27Å; Q39-S41 WeakPolarHBondContact CG-OG 3.45Å; Q39-S41 PolarHBondContact NE2-OG 3.23Å; Q39-S41 PolarHBondContact O-N 3.41Å; Q39-D42 VanDerWaalsContact CG-CG 3.44Å; Q39-D42 VanDerWaalsContact CG-OD1 3.24Å; Q39-D42 WeakPolarHBondContact CG-OD1 3.45Å; Q39-D42 WeakPolarHBondContact CG-OD2 3.47Å; Q39-D42 PolarHBondContact N-OD2 3.06Å; Q39-D42 WeakPolarHBondContact O-CB 3.38Å; Q39-D42 PolarHBondContact O-N 3Å; Q39-D42 VanDerWaalsContact O-N 3.12Å; Q39-I66 VanDerWaalsContact C-CD1 3.44Å
40L96.6Very high96.4Very high17 Ų1766.2 Ų66.29%0.08934%0.344CS..G310 helixtrans-61.1-34.8-176.4-73.6170.7000113.2D42 Y43 Y50 I66 F140 I151L40-D42 PolarHBondContact O-N 2.97Å; L40-D42 VanDerWaalsContact O-N 3.15Å; L40-Y43 WeakPolarHBondContact O-CB 3.49Å; L40-Y43 WeakPolarHBondContact O-CD2 3.49Å; L40-Y43 PolarHBondContact O-N 3.18Å; L40-Y50 HydrophobicContact CB-CD1 4.11Å; L40-Y50 HydrophobicContact CB-CD2 4.16Å; L40-Y50 HydrophobicContact CB-CE1 4.09Å; L40-Y50 HydrophobicContact CB-CE2 4.14Å; L40-Y50 HydrophobicContact CB-CG 4.17Å; L40-Y50 HydrophobicContact CD1-CD2 4.33Å; L40-Y50 HydrophobicContact CD1-CE2 4.37Å; L40-Y50 WeakPolarHBondContact O-CD1 3.18Å; L40-Y50 WeakPolarHBondContact O-CE1 3.25Å; L40-I66 HydrophobicContact CD2-CD1 4.31Å; L40-F140 HydrophobicContact CD2-CZ 3.93Å; L40-I151 HydrophobicContact CD1-CD1 3.69Å; L40-I151 HydrophobicContact CD1-CG1 4.08Å; L40-I151 HydrophobicContact CD1-CG2 3.81Å
41S96.1Very high96.6Very high72 Ų7265.9 Ų65.950%0.50334%0.342SS..G310 helixtrans-68.2-7.8178.449.80000114.6Q39 Y43Q39-S41 VanDerWaalsContact C-N 3.27Å; Q39-S41 WeakPolarHBondContact CG-OG 3.45Å; Q39-S41 PolarHBondContact NE2-OG 3.23Å; Q39-S41 PolarHBondContact O-N 3.41Å; S41-Y43 VanDerWaalsContact C-N 3.27Å
42D97.5Very high96.8Very high85 Ų8563.9 Ų63.946%0.45533%0.329SS..G310 helixtrans-78.4-14.6171-58.4-21.5000111.8P37 G38 Q39 L40P37-D42 HydrophobicContact CB-CB 3.87Å; G38-D42 PolarHBondContact N-OD2 2.77Å; Q39-D42 VanDerWaalsContact CG-CG 3.44Å; Q39-D42 VanDerWaalsContact CG-OD1 3.24Å; Q39-D42 WeakPolarHBondContact CG-OD1 3.45Å; Q39-D42 WeakPolarHBondContact CG-OD2 3.47Å; Q39-D42 PolarHBondContact N-OD2 3.06Å; Q39-D42 WeakPolarHBondContact O-CB 3.38Å; Q39-D42 PolarHBondContact O-N 3Å; Q39-D42 VanDerWaalsContact O-N 3.12Å; L40-D42 PolarHBondContact O-N 2.97Å; L40-D42 VanDerWaalsContact O-N 3.15Å
43Y97.9Very high96.9Very high13 Ų1363 Ų635%0.05133%0.325CS..SBendtrans-88.2160.5174.2-64.2-76.7000112.4P37 L40 S41 I52 E59 G62 M63 I66P37-Y43 HydrophobicContact CB-CE1 4.08Å; P37-Y43 HydrophobicContact CB-CE2 3.98Å; P37-Y43 HydrophobicContact CG-CD1 4.41Å; P37-Y43 HydrophobicContact CG-CE1 3.77Å; L40-Y43 WeakPolarHBondContact O-CB 3.49Å; L40-Y43 WeakPolarHBondContact O-CD2 3.49Å; L40-Y43 PolarHBondContact O-N 3.18Å; S41-Y43 VanDerWaalsContact C-N 3.27Å; Y43-I52 HydrophobicContact CD1-CB 4.38Å; Y43-I52 HydrophobicContact CD1-CG1 3.9Å; Y43-I52 HydrophobicContact CD1-CG2 4.29Å; Y43-I52 HydrophobicContact CD2-CD1 4.1Å; Y43-I52 HydrophobicContact CD2-CG1 3.92Å; Y43-I52 HydrophobicContact CE1-CB 4.3Å; Y43-I52 HydrophobicContact CE1-CD1 4.47Å; Y43-I52 HydrophobicContact CE1-CG1 3.99Å; Y43-I52 HydrophobicContact CE1-CG2 3.75Å; Y43-I52 HydrophobicContact CE2-CD1 3.77Å; Y43-I52 HydrophobicContact CE2-CG1 3.96Å; Y43-I52 HydrophobicContact CG-CG1 3.89Å; Y43-E59 HydrophobicContact CD1-CG 4.36Å; Y43-E59 HydrophobicContact CE1-CB 3.9Å; Y43-E59 HydrophobicContact CE1-CG 3.98Å; Y43-E59 PolarHBondContact OH-O 2.54Å; Y43-G62 VanDerWaalsContact OH-CA 3.25Å; Y43-G62 WeakPolarHBondContact OH-CA 3.45Å; Y43-M63 PolarHBondContact OH-N 3.02Å; Y43-M63 VanDerWaalsContact OH-N 3.12Å; Y43-I66 HydrophobicContact CD2-CD1 4.32Å; Y43-I66 HydrophobicContact CE2-CD1 3.44Å; Y43-I66 VanDerWaalsContact CE2-CD1 3.44Å
44R97.3Very high97Very high118 Ų11861.4 Ų61.445%0.44532%0.319SS..EExtended strand (participates in β ladder)trans-64.1145.1170.772.6-172.1-173.1152.115.6110.8E46 I51R44-E46 IonicContact CZ-OE1 3.21Å; R44-E46 VanDerWaalsContact CZ-OE1 3.29Å; R44-E46 IonicContact NE-OE1 3.49Å; R44-E46 IonicContact NH1-OE1 2.85Å; R44-E46 PolarHBondContact NH1-OE1 3.05Å; R44-E46 IonicContact NH2-OE1 3.77Å; R44-E46 PolarHBondContact NH2-OE1 3.47Å; R44-I51 HydrophobicContact CG-CB 3.83Å; R44-I51 PolarHBondContact O-N 3.32Å
45V96.9Very high97.1Very high80 Ų8053.7 Ų53.749%0.48529%0.285SS..EExtended strand (participates in β ladder)trans-117.4129.6177.5-179.10000109.2V49 Y50V45-V49 WeakPolarHBondContact CA-O 3.27Å; V45-Y50 HydrophobicContact CG2-CD1 3.55Å; V45-Y50 HydrophobicContact CG2-CE1 3.61Å; V45-Y50 HydrophobicContact CG2-CG 4.5Å
46E95.6Very high97.2Very high79 Ų7949.7 Ų49.737%0.36927%0.268SS..EExtended strand (participates in β ladder)trans-127.3121.5175.2-67.1175.1-163.100108.7R44 S48 V49 I51R44-E46 IonicContact CZ-OE1 3.21Å; R44-E46 VanDerWaalsContact CZ-OE1 3.29Å; R44-E46 IonicContact NE-OE1 3.49Å; R44-E46 IonicContact NH1-OE1 2.85Å; R44-E46 PolarHBondContact NH1-OE1 3.05Å; R44-E46 IonicContact NH2-OE1 3.77Å; R44-E46 PolarHBondContact NH2-OE1 3.47Å; E46-S48 VanDerWaalsContact C-N 3.27Å; E46-S48 PolarHBondContact O-N 2.88Å; E46-V49 PolarHBondContact N-O 3.02Å; E46-V49 WeakPolarHBondContact O-CB 3.4Å; E46-V49 PolarHBondContact O-N 3.19Å; E46-I51 HydrophobicContact CB-CD1 4.37Å; E46-I51 HydrophobicContact CB-CG1 3.89Å; E46-I51 HydrophobicContact CG-CG1 3.95Å
47N93.6Very high97.3Very high160 Ų16049.5 Ų49.586%0.85627%0.267SS*.THydrogen-bonded Turntrans50.444.5-178.7-56.9-43.7000113.6V49N47-V49 PolarHBondContact O-N 3.04Å
48S94Very high97.3Very high97 Ų9750.7 Ų50.768%0.67827%0.272SS*.THydrogen-bonded Turntrans6611.7-176.1-50.90000115.7E46E46-S48 VanDerWaalsContact C-N 3.27Å; E46-S48 PolarHBondContact O-N 2.88Å
49V97.4Very high97.4Very high33 Ų3352.1 Ų52.120%0.228%0.275CS..EExtended strand (participates in β ladder)trans-106128.1175.6-174.10000109.6V45 E46 N47 I51 D154 R157V45-V49 WeakPolarHBondContact CA-O 3.27Å; E46-V49 PolarHBondContact N-O 3.02Å; E46-V49 WeakPolarHBondContact O-CB 3.4Å; E46-V49 PolarHBondContact O-N 3.19Å; N47-V49 PolarHBondContact O-N 3.04Å; V49-I51 HydrophobicContact CB-CD1 4.08Å; V49-I51 HydrophobicContact CG1-CD1 3.8Å; V49-I51 PolarHBondContact O-N 3.47Å; V49-D154 WeakPolarHBondContact CG2-O 3.5Å; V49-R157 HydrophobicContact CG1-CB 3.99Å
50Y98.3Very high97.4Very high58 Ų5847.1 Ų47.123%0.22725%0.251CS..EExtended strand (participates in β ladder)trans-69.3123.2169.4-63.2-74.1000109.6L40 V45 E155 V156 R157L40-Y50 HydrophobicContact CB-CD1 4.11Å; L40-Y50 HydrophobicContact CB-CD2 4.16Å; L40-Y50 HydrophobicContact CB-CE1 4.09Å; L40-Y50 HydrophobicContact CB-CE2 4.14Å; L40-Y50 HydrophobicContact CB-CG 4.17Å; L40-Y50 HydrophobicContact CD1-CD2 4.33Å; L40-Y50 HydrophobicContact CD1-CE2 4.37Å; L40-Y50 WeakPolarHBondContact O-CD1 3.18Å; L40-Y50 WeakPolarHBondContact O-CE1 3.25Å; V45-Y50 HydrophobicContact CG2-CD1 3.55Å; V45-Y50 HydrophobicContact CG2-CE1 3.61Å; V45-Y50 HydrophobicContact CG2-CG 4.5Å; Y50-E155 VanDerWaalsContact CD2-O 3.25Å; Y50-E155 WeakPolarHBondContact CD2-O 3.42Å; Y50-E155 PolarHBondContact N-O 2.74Å; Y50-V156 WeakPolarHBondContact O-CA 3.14Å; Y50-R157 PolarHBondContact O-N 2.84Å
51I98.4Very high97.6Very high1 Ų146.3 Ų46.31%0.00525%0.247CC..EExtended strand (participates in β ladder)trans-107.9120.1-178.6-48.3-59000109.7R44 E46 V49 R157 L159R44-I51 HydrophobicContact CG-CB 3.83Å; R44-I51 PolarHBondContact O-N 3.32Å; E46-I51 HydrophobicContact CB-CD1 4.37Å; E46-I51 HydrophobicContact CB-CG1 3.89Å; E46-I51 HydrophobicContact CG-CG1 3.95Å; V49-I51 HydrophobicContact CB-CD1 4.08Å; V49-I51 HydrophobicContact CG1-CD1 3.8Å; V49-I51 PolarHBondContact O-N 3.47Å; I51-R157 HydrophobicContact CD1-CB 4.31Å; I51-L159 HydrophobicContact CG2-CD1 4.13Å; I51-L159 HydrophobicContact CG2-CD2 3.49Å; I51-L159 VanDerWaalsContact CG2-CD2 3.49Å; I51-L159 HydrophobicContact CG2-CG 3.65Å
52I98.6Very high97.7Very high0 Ų042.9 Ų42.90%022%0.223CC..EExtended strand (participates in β ladder)trans-113.6130179.4-53.1177.9000108.6Y43 P54 E59 M63 F140 V156 R157 L158 L159Y43-I52 HydrophobicContact CD1-CB 4.38Å; Y43-I52 HydrophobicContact CD1-CG1 3.9Å; Y43-I52 HydrophobicContact CD1-CG2 4.29Å; Y43-I52 HydrophobicContact CD2-CD1 4.1Å; Y43-I52 HydrophobicContact CD2-CG1 3.92Å; Y43-I52 HydrophobicContact CE1-CB 4.3Å; Y43-I52 HydrophobicContact CE1-CD1 4.47Å; Y43-I52 HydrophobicContact CE1-CG1 3.99Å; Y43-I52 HydrophobicContact CE1-CG2 3.75Å; Y43-I52 HydrophobicContact CE2-CD1 3.77Å; Y43-I52 HydrophobicContact CE2-CG1 3.96Å; Y43-I52 HydrophobicContact CG-CG1 3.89Å; I52-P54 WeakPolarHBondContact O-CD 3.3Å; I52-E59 HydrophobicContact CG2-CB 4.22Å; I52-M63 HydrophobicContact CD1-CG 4.06Å; I52-M63 HydrophobicContact CG2-CG 3.84Å; I52-M63 HydrophobicContact CG2-SD 3.84Å; I52-F140 HydrophobicContact CD1-CE1 3.92Å; I52-F140 HydrophobicContact CD1-CZ 3.73Å; I52-V156 HydrophobicContact CD1-CG2 4.01Å; I52-V156 HydrophobicContact CG1-CG2 4.44Å; I52-R157 PolarHBondContact N-O 3.42Å; I52-L158 HydrophobicContact CB-CD2 3.88Å; I52-L158 HydrophobicContact CD1-CD2 4.41Å; I52-L158 HydrophobicContact CG2-CD2 4.34Å; I52-L158 CarbonylContact O-C 3.5Å; I52-L158 VanDerWaalsContact O-CA 3.31Å; I52-L158 WeakPolarHBondContact O-CA 3.28Å; I52-L159 PolarHBondContact O-N 2.87Å
53N98.5Very high97.7Very high38 Ų3838.9 Ų38.920%0.20320%0.202CC..  trans-97.594.3171.2-170.4-5.5000110.6W55 V56 E59 L159N53-W55 PolarHBondContact O-N 3.49Å; N53-W55 WeakPolarHBondContact OD1-CB 3.46Å; N53-W55 PolarHBondContact OD1-N 2.93Å; N53-V56 HydrophobicContact CB-CG2 4.22Å; N53-V56 PolarHBondContact O-N 3.43Å; N53-E59 PolarHBondContact N-OE2 3.42Å; N53-E59 VanDerWaalsContact O-CB 3.28Å; N53-E59 WeakPolarHBondContact O-CB 3.45Å; N53-L159 HydrophobicContact CB-CB 4.37Å; N53-L159 HydrophobicContact CB-CD1 3.73Å; N53-L159 HydrophobicContact CB-CG 4.36Å
54P98.4Very high97.8Very high1 Ų138.4 Ų38.41%0.00620%0.2CC..THydrogen-bonded Turntrans-67.2-7.2179.429.6-35.8000112.7I52 V56 R60 M63 Y133 L158I52-P54 WeakPolarHBondContact O-CD 3.3Å; P54-V56 PolarHBondContact O-N 2.91Å; P54-R60 HydrophobicContact CB-CG 4.36Å; P54-R60 PolarHBondContact O-NE 3.27Å; P54-R60 PolarHBondContact O-NH2 2.92Å; P54-M63 HydrophobicContact CB-SD 4.35Å; P54-Y133 HydrophobicContact CB-CD2 4.07Å; P54-Y133 HydrophobicContact CB-CE2 3.98Å; P54-Y133 HydrophobicContact CG-CD2 3.99Å; P54-Y133 HydrophobicContact CG-CE2 3.43Å; P54-Y133 VanDerWaalsContact CG-CE2 3.43Å; P54-L158 HydrophobicContact CG-CB 4.28Å
55W98.3Very high97.8Very high12 Ų1234.1 Ų34.15%0.04518%0.184CC..THydrogen-bonded Turntrans-87.56174.9-51.898.8000112.8N53 V122 V124 Y133 L159 P161 F168N53-W55 PolarHBondContact O-N 3.49Å; N53-W55 WeakPolarHBondContact OD1-CB 3.46Å; N53-W55 PolarHBondContact OD1-N 2.93Å; W55-V122 HydrophobicContact CE3-CG1 4.33Å; W55-V122 WeakPolarHBondContact O-CB 3.13Å; W55-V122 PolarHBondContact O-N 3.39Å; W55-V124 HydrophobicContact CE3-CB 4.29Å; W55-V124 HydrophobicContact CH2-CB 4.19Å; W55-V124 HydrophobicContact CH2-CG2 3.87Å; W55-V124 HydrophobicContact CZ2-CG2 4.46Å; W55-V124 HydrophobicContact CZ3-CB 3.86Å; W55-V124 HydrophobicContact CZ3-CG2 4.07Å; W55-Y133 AromaticContact CE2-CD2 3.99Å; W55-Y133 HydrophobicContact CH2-CD2 4.01Å; W55-Y133 HydrophobicContact CH2-CG 4.43Å; W55-Y133 AromaticContact CZ2-CD2 3.52Å; W55-Y133 HydrophobicContact CZ2-CD2 3.52Å; W55-Y133 AromaticContact CZ2-CE2 3.82Å; W55-Y133 HydrophobicContact CZ2-CE2 3.82Å; W55-Y133 HydrophobicContact CZ2-CG 4.26Å; W55-L159 PolarHBondContact NE1-O 3.42Å; W55-P161 HydrophobicContact CD2-CB 3.79Å; W55-P161 VanDerWaalsContact CE2-CB 3.41Å; W55-P161 HydrophobicContact CE3-CB 4.38Å; W55-P161 HydrophobicContact CG-CB 4.18Å; W55-P161 HydrophobicContact CH2-CB 4.25Å; W55-P161 HydrophobicContact CH2-CG 4.25Å; W55-P161 HydrophobicContact CZ2-CB 3.67Å; W55-P161 HydrophobicContact CZ2-CG 3.5Å; W55-P161 VanDerWaalsContact CZ2-CG 3.5Å; W55-P161 VanDerWaalsContact NE1-CD 3.28Å; W55-F168 HydrophobicContact CH2-CD1 4.36Å; W55-F168 AromaticContact CH2-CE1 3.67Å; W55-F168 HydrophobicContact CH2-CE1 3.67Å; W55-F168 HydrophobicContact CH2-CE2 4.07Å; W55-F168 AromaticContact CH2-CZ 3.52Å; W55-F168 HydrophobicContact CH2-CZ 3.52Å; W55-F168 HydrophobicContact CZ2-CD1 4.15Å; W55-F168 HydrophobicContact CZ2-CD2 4.22Å; W55-F168 AromaticContact CZ2-CE1 3.91Å; W55-F168 HydrophobicContact CZ2-CE1 3.91Å; W55-F168 HydrophobicContact CZ2-CE2 4Å; W55-F168 HydrophobicContact CZ2-CG 4.3Å; W55-F168 AromaticContact CZ2-CZ 3.84Å; W55-F168 HydrophobicContact CZ2-CZ 3.84Å
56V98.4Very high97.9Very high35 Ų3530.3 Ų30.321%0.21216%0.162CC..BIsolated β-bridgetrans-111.5128.2168.4176.20000108.7N53 P54 L58 E59 R60 M120N53-V56 HydrophobicContact CB-CG2 4.22Å; N53-V56 PolarHBondContact O-N 3.43Å; P54-V56 PolarHBondContact O-N 2.91Å; V56-L58 PolarHBondContact O-N 2.72Å; V56-E59 HydrophobicContact CB-CB 4.2Å; V56-E59 HydrophobicContact CB-CG 4.19Å; V56-E59 HydrophobicContact CG1-CB 4.47Å; V56-E59 HydrophobicContact CG1-CG 4.15Å; V56-E59 PolarHBondContact O-N 3.45Å; V56-R60 PolarHBondContact O-N 2.82Å; V56-M120 HydrophobicContact CG1-CB 4.38Å
57Y98.6Very high98Very high0 Ų026.7 Ų26.70%015%0.145CC..Hα-helixtrans-54.4-51.3-173.1174.4-106.6000113.2P31 L32 E59 R60 M61 Y94 Y98 L103 M120P31-Y57 PolarHBondContact O-OH 3.32Å; L32-Y57 HydrophobicContact CB-CE1 4.15Å; L32-Y57 HydrophobicContact CD1-CD1 4.11Å; L32-Y57 HydrophobicContact CD1-CE1 4Å; L32-Y57 HydrophobicContact CG-CE1 4.42Å; Y57-E59 VanDerWaalsContact C-N 3.32Å; Y57-E59 PolarHBondContact O-N 3.07Å; Y57-R60 PolarHBondContact O-N 3.2Å; Y57-M61 HydrophobicContact CE2-CE 3.91Å; Y57-M61 VanDerWaalsContact O-CB 3.3Å; Y57-M61 WeakPolarHBondContact O-CB 3.34Å; Y57-M61 PolarHBondContact O-N 3.42Å; Y57-M61 WeakPolarHBondContact OH-CE 3.29Å; Y57-Y94 WeakPolarHBondContact CA-OH 3.48Å; Y57-Y94 HydrophobicContact CD2-CD1 4.22Å; Y57-Y94 AromaticContact CD2-CE1 3.39Å; Y57-Y94 HydrophobicContact CD2-CE1 3.39Å; Y57-Y94 HydrophobicContact CD2-CE2 4.46Å; Y57-Y94 AromaticContact CD2-CZ 3.54Å; Y57-Y94 AromaticContact CE2-CD1 3.82Å; Y57-Y94 HydrophobicContact CE2-CD1 3.82Å; Y57-Y94 AromaticContact CE2-CE1 3.46Å; Y57-Y94 HydrophobicContact CE2-CE1 3.46Å; Y57-Y94 VanDerWaalsContact CE2-CE1 3.46Å; Y57-Y94 AromaticContact CE2-CZ 3.95Å; Y57-Y94 HydrophobicContact CG-CE1 4.41Å; Y57-Y98 HydrophobicContact CD1-CD1 4.49Å; Y57-Y98 AromaticContact CD1-CD2 3.99Å; Y57-Y98 HydrophobicContact CD1-CD2 3.99Å; Y57-Y98 HydrophobicContact CD1-CE1 4.34Å; Y57-Y98 AromaticContact CD1-CE2 3.84Å; Y57-Y98 HydrophobicContact CD1-CE2 3.84Å; Y57-Y98 HydrophobicContact CD1-CG 4.3Å; Y57-Y98 AromaticContact CD1-CZ 3.99Å; Y57-Y98 AromaticContact CD2-CD2 3.45Å; Y57-Y98 HydrophobicContact CD2-CD2 3.45Å; Y57-Y98 VanDerWaalsContact CD2-CD2 3.45Å; Y57-Y98 HydrophobicContact CD2-CE2 4.1Å; Y57-Y98 AromaticContact CD2-CG 3.71Å; Y57-Y98 HydrophobicContact CD2-CG 3.71Å; Y57-Y98 AromaticContact CE1-CD1 3.91Å; Y57-Y98 HydrophobicContact CE1-CD1 3.91Å; Y57-Y98 HydrophobicContact CE1-CD2 4.17Å; Y57-Y98 AromaticContact CE1-CE1 3.94Å; Y57-Y98 HydrophobicContact CE1-CE1 3.94Å; Y57-Y98 HydrophobicContact CE1-CE2 4.22Å; Y57-Y98 HydrophobicContact CE1-CG 4Å; Y57-Y98 HydrophobicContact CE2-CD1 4.03Å; Y57-Y98 AromaticContact CE2-CD2 3.7Å; Y57-Y98 HydrophobicContact CE2-CD2 3.7Å; Y57-Y98 HydrophobicContact CE2-CE2 4.49Å; Y57-Y98 AromaticContact CE2-CG 3.4Å; Y57-Y98 HydrophobicContact CE2-CG 3.4Å; Y57-Y98 AromaticContact CG-CD2 3.61Å; Y57-Y98 HydrophobicContact CG-CD2 3.61Å; Y57-Y98 AromaticContact CG-CE2 3.75Å; Y57-Y98 HydrophobicContact CG-CE2 3.75Å; Y57-Y98 HydrophobicContact CG-CG 4.15Å; Y57-Y98 AromaticContact CZ-CD1 3.63Å; Y57-Y98 AromaticContact CZ-CG 3.52Å; Y57-L103 HydrophobicContact CD2-CD1 3.93Å; Y57-L103 HydrophobicContact CE2-CD1 4.29Å; Y57-M120 WeakPolarHBondContact CB-O 3.49Å; Y57-M120 HydrophobicContact CD1-SD 4.15Å; Y57-M120 PolarHBondContact N-O 3.39Å
58L98.5Very high98.3Very high45 Ų4519.1 Ų19.124%0.23610%0.104CC..Hα-helixtrans-62.7-40.7-178.4-66.1177.6000111.8L32 E35 P37 V56 M61 G62 M120L32-L58 HydrophobicContact CB-CD2 3.57Å; L32-L58 HydrophobicContact CD1-CD2 3.96Å; L32-L58 HydrophobicContact CG-CD2 4.38Å; E35-L58 HydrophobicContact CB-CD2 4.32Å; P37-L58 VanDerWaalsContact CD-O 3.28Å; P37-L58 WeakPolarHBondContact CD-O 3.36Å; V56-L58 PolarHBondContact O-N 2.72Å; L58-M61 PolarHBondContact O-N 2.99Å; L58-G62 PolarHBondContact O-N 3.12Å; L58-M120 HydrophobicContact CD1-SD 4.49Å; L58-M120 HydrophobicContact CG-SD 4.17Å
59E98.7Very high98.4Very high45 Ų4518.4 Ų18.421%0.219%0.093CC..Hα-helixtrans-68.1-43.4179.8-68-165.5-130.800111.6Y43 I52 N53 V56 Y57 M61 G62 M63Y43-E59 HydrophobicContact CD1-CG 4.36Å; Y43-E59 HydrophobicContact CE1-CB 3.9Å; Y43-E59 HydrophobicContact CE1-CG 3.98Å; Y43-E59 PolarHBondContact OH-O 2.54Å; I52-E59 HydrophobicContact CG2-CB 4.22Å; N53-E59 PolarHBondContact N-OE2 3.42Å; N53-E59 VanDerWaalsContact O-CB 3.28Å; N53-E59 WeakPolarHBondContact O-CB 3.45Å; V56-E59 HydrophobicContact CB-CB 4.2Å; V56-E59 HydrophobicContact CB-CG 4.19Å; V56-E59 HydrophobicContact CG1-CB 4.47Å; V56-E59 HydrophobicContact CG1-CG 4.15Å; V56-E59 PolarHBondContact O-N 3.45Å; Y57-E59 VanDerWaalsContact C-N 3.32Å; Y57-E59 PolarHBondContact O-N 3.07Å; E59-M61 PolarHBondContact O-N 3.24Å; E59-G62 PolarHBondContact O-N 3.25Å; E59-M63 PolarHBondContact O-N 2.84Å
60R98.8Very high98.4Very high0 Ų020.1 Ų20.10%010%0.098CC..Hα-helixtrans-65.4-39.3173.5-163.5-172.5-57.5-164.6-8.8112.1P54 V56 Y57 G62 M63 Y94 A129 N132 S136P54-R60 HydrophobicContact CB-CG 4.36Å; P54-R60 PolarHBondContact O-NE 3.27Å; P54-R60 PolarHBondContact O-NH2 2.92Å; V56-R60 PolarHBondContact O-N 2.82Å; Y57-R60 PolarHBondContact O-N 3.2Å; R60-G62 VanDerWaalsContact C-N 3.27Å; R60-G62 PolarHBondContact O-N 3.4Å; R60-M63 HydrophobicContact CG-SD 4.43Å; R60-M63 WeakPolarHBondContact O-CB 3.47Å; R60-M63 PolarHBondContact O-N 3.06Å; R60-Y94 HydrophobicContact CB-CE1 3.82Å; R60-Y94 VanDerWaalsContact CD-CZ 3.5Å; R60-Y94 HydrophobicContact CG-CE1 4.12Å; R60-A129 PolarHBondContact NH1-O 3.48Å; R60-N132 VanDerWaalsContact CD-OD1 3.27Å; R60-N132 WeakPolarHBondContact CD-OD1 3.15Å; R60-N132 PolarHBondContact NH1-OD1 3.23Å; R60-S136 WeakPolarHBondContact CG-OG 3.46Å
61M98.8Very high98.4Very high0 Ų017.3 Ų17.30%09%0.088CC..Hα-helixtrans-62.1-38175-174.859.275.300111.5P30 W33 S36 Y57 L58 E59 M63 Y64 K65 P91 Y94P30-M61 HydrophobicContact CB-CE 3.44Å; P30-M61 VanDerWaalsContact CB-CE 3.44Å; P30-M61 HydrophobicContact CB-SD 3.96Å; P30-M61 HydrophobicContact CG-CE 4.12Å; P30-M61 HydrophobicContact CG-SD 4.07Å; W33-M61 HydrophobicContact CE3-CG 4.11Å; W33-M61 HydrophobicContact CE3-SD 3.89Å; W33-M61 HydrophobicContact CZ3-CG 4.3Å; W33-M61 HydrophobicContact CZ3-SD 3.81Å; S36-M61 WeakPolarHBondContact OG-CB 3.1Å; S36-M61 WeakPolarHBondContact OG-CG 3.28Å; Y57-M61 HydrophobicContact CE2-CE 3.91Å; Y57-M61 VanDerWaalsContact O-CB 3.3Å; Y57-M61 WeakPolarHBondContact O-CB 3.34Å; Y57-M61 PolarHBondContact O-N 3.42Å; Y57-M61 WeakPolarHBondContact OH-CE 3.29Å; L58-M61 PolarHBondContact O-N 2.99Å; E59-M61 PolarHBondContact O-N 3.24Å; M61-M63 VanDerWaalsContact C-N 3.3Å; M61-M63 PolarHBondContact O-N 3.17Å; M61-Y64 WeakPolarHBondContact O-CB 3.39Å; M61-Y64 PolarHBondContact O-N 2.86Å; M61-Y64 HydrophobicContact SD-CD2 4.35Å; M61-K65 PolarHBondContact O-N 3.38Å; M61-P91 HydrophobicContact SD-CB 3.72Å; M61-Y94 HydrophobicContact CB-CD1 4.38Å; M61-Y94 HydrophobicContact CB-CE1 4.25Å; M61-Y94 HydrophobicContact CE-CD1 3.57Å; M61-Y94 HydrophobicContact CE-CE1 4.31Å; M61-Y94 HydrophobicContact CE-CG 4.41Å; M61-Y94 HydrophobicContact SD-CD1 4.3Å
62G98.7Very high98.3Very high0 Ų018.6 Ų18.60%010%0.098CC..Hα-helixtrans-61.4-35.7176.300000113.2P37 Y43 L58 E59 R60 Y64 K65 I66P37-G62 VanDerWaalsContact O-CA 3.24Å; P37-G62 WeakPolarHBondContact O-CA 3.22Å; Y43-G62 VanDerWaalsContact OH-CA 3.25Å; Y43-G62 WeakPolarHBondContact OH-CA 3.45Å; L58-G62 PolarHBondContact O-N 3.12Å; E59-G62 PolarHBondContact O-N 3.25Å; R60-G62 VanDerWaalsContact C-N 3.27Å; R60-G62 PolarHBondContact O-N 3.4Å; G62-Y64 VanDerWaalsContact C-N 3.3Å; G62-Y64 PolarHBondContact O-N 2.88Å; G62-K65 PolarHBondContact O-N 3.19Å; G62-I66 WeakPolarHBondContact O-CB 3.21Å; G62-I66 VanDerWaalsContact O-CG1 3.27Å; G62-I66 WeakPolarHBondContact O-CG1 3.37Å; G62-I66 PolarHBondContact O-N 3.36Å
63M98.8Very high98.2Very high1 Ų126.3 Ų26.31%0.00513%0.127CC..Hα-helixtrans-56.2-45.3173.6-63.6171.464.500111.4Y43 I52 P54 E59 R60 M61 L67 F140 L158Y43-M63 PolarHBondContact OH-N 3.02Å; Y43-M63 VanDerWaalsContact OH-N 3.12Å; I52-M63 HydrophobicContact CD1-CG 4.06Å; I52-M63 HydrophobicContact CG2-CG 3.84Å; I52-M63 HydrophobicContact CG2-SD 3.84Å; P54-M63 HydrophobicContact CB-SD 4.35Å; E59-M63 PolarHBondContact O-N 2.84Å; R60-M63 HydrophobicContact CG-SD 4.43Å; R60-M63 WeakPolarHBondContact O-CB 3.47Å; R60-M63 PolarHBondContact O-N 3.06Å; M61-M63 VanDerWaalsContact C-N 3.3Å; M61-M63 PolarHBondContact O-N 3.17Å; M63-L67 WeakPolarHBondContact O-CB 3.34Å; M63-L67 PolarHBondContact O-N 3.46Å; M63-F140 HydrophobicContact CB-CD2 3.79Å; M63-F140 HydrophobicContact CB-CE2 4.17Å; M63-F140 HydrophobicContact CB-CG 4.22Å; M63-F140 HydrophobicContact CE-CB 3.69Å; M63-F140 HydrophobicContact CE-CD1 3.81Å; M63-F140 HydrophobicContact CE-CD2 4.4Å; M63-F140 HydrophobicContact CE-CG 3.71Å; M63-F140 HydrophobicContact CG-CD2 4.31Å; M63-F140 HydrophobicContact CG-CE2 4.4Å; M63-F140 WeakPolarHBondContact O-CD2 3.31Å; M63-L158 HydrophobicContact CE-CD1 4.16Å; M63-L158 HydrophobicContact CE-CD2 3.85Å; M63-L158 HydrophobicContact SD-CD2 4.16Å
64Y98.8Very high98Very high3 Ų326.3 Ų26.31%0.01213%0.125CC..Hα-helixtrans-67.5-40.2176.8-62.7-55.3000112.9M61 G62 L67 L68 L90 P91 Y94 N132 L135 S136M61-Y64 WeakPolarHBondContact O-CB 3.39Å; M61-Y64 PolarHBondContact O-N 2.86Å; M61-Y64 HydrophobicContact SD-CD2 4.35Å; G62-Y64 VanDerWaalsContact C-N 3.3Å; G62-Y64 PolarHBondContact O-N 2.88Å; Y64-L67 PolarHBondContact O-N 2.91Å; Y64-L68 WeakPolarHBondContact O-CB 3.49Å; Y64-L68 WeakPolarHBondContact O-CG 3.46Å; Y64-L68 PolarHBondContact O-N 3.34Å; Y64-L90 HydrophobicContact CD1-CB 3.65Å; Y64-L90 HydrophobicContact CD1-CD1 4.29Å; Y64-L90 HydrophobicContact CE1-CB 3.42Å; Y64-L90 VanDerWaalsContact CE1-CB 3.42Å; Y64-L90 HydrophobicContact CE1-CD1 4.11Å; Y64-L90 HydrophobicContact CE1-CG 4.3Å; Y64-L90 HydrophobicContact CG-CB 4.49Å; Y64-P91 HydrophobicContact CD2-CB 4.03Å; Y64-P91 HydrophobicContact CG-CB 3.96Å; Y64-P91 HydrophobicContact CG-CG 4.49Å; Y64-Y94 HydrophobicContact CD2-CD1 4.19Å; Y64-Y94 AromaticContact CE2-CD1 3.81Å; Y64-Y94 HydrophobicContact CE2-CD1 3.81Å; Y64-Y94 AromaticContact CE2-CG 3.85Å; Y64-Y94 HydrophobicContact CE2-CG 3.85Å; Y64-N132 PolarHBondContact OH-ND2 2.86Å; Y64-N132 VanDerWaalsContact OH-ND2 3.12Å; Y64-N132 PolarHBondContact OH-OD1 3.37Å; Y64-L135 WeakPolarHBondContact CE1-O 3.31Å; Y64-L135 PolarHBondContact OH-O 3.03Å; Y64-S136 WeakPolarHBondContact OH-CA 3.34Å; Y64-S136 VanDerWaalsContact OH-CB 3.25Å; Y64-S136 WeakPolarHBondContact OH-CB 3.4Å; Y64-S136 PolarHBondContact OH-N 2.92Å
65K98.6Very high97.9Very high28 Ų2826.3 Ų26.312%0.12213%0.125CC..Hα-helixtrans-63.5-44178.8-175.5167.8169.7-168.90112W33 K34 S36 P37 M61 G62 L68 N69W33-K65 HydrophobicContact CD2-CD 4.19Å; W33-K65 HydrophobicContact CE3-CD 4.42Å; W33-K65 VanDerWaalsContact CH2-CA 3.42Å; W33-K65 HydrophobicContact CH2-CB 3.42Å; W33-K65 VanDerWaalsContact CH2-CB 3.42Å; W33-K65 HydrophobicContact CH2-CD 4.19Å; W33-K65 HydrophobicContact CH2-CG 3.65Å; W33-K65 HydrophobicContact CZ2-CB 3.87Å; W33-K65 HydrophobicContact CZ2-CD 3.89Å; W33-K65 HydrophobicContact CZ2-CG 3.5Å; W33-K65 VanDerWaalsContact CZ2-CG 3.5Å; W33-K65 HydrophobicContact CZ3-CB 3.77Å; W33-K65 HydrophobicContact CZ3-CD 4.42Å; W33-K65 HydrophobicContact CZ3-CG 4.24Å; W33-K65 PolarHBondContact O-NZ 3.38Å; K34-K65 PolarHBondContact O-NZ 3.05Å; S36-K65 PolarHBondContact O-NZ 3.11Å; P37-K65 WeakPolarHBondContact O-CD 3.26Å; M61-K65 PolarHBondContact O-N 3.38Å; G62-K65 PolarHBondContact O-N 3.19Å; K65-L68 PolarHBondContact O-N 3.22Å; K65-N69 WeakPolarHBondContact O-CB 3.37Å; K65-N69 PolarHBondContact O-N 3.39Å; K65-N69 PolarHBondContact O-ND2 3.07Å
66I98.5Very high97.8Very high1 Ų128.9 Ų28.91%0.00515%0.149CC..Hα-helixtrans-62.8-46.6174.4-68.4166.9000110.4G38 Q39 L40 Y43 G62 L68 N69 Q70 F140 M149G38-I66 WeakPolarHBondContact O-CG1 3.36Å; Q39-I66 VanDerWaalsContact C-CD1 3.44Å; L40-I66 HydrophobicContact CD2-CD1 4.31Å; Y43-I66 HydrophobicContact CD2-CD1 4.32Å; Y43-I66 HydrophobicContact CE2-CD1 3.44Å; Y43-I66 VanDerWaalsContact CE2-CD1 3.44Å; G62-I66 WeakPolarHBondContact O-CB 3.21Å; G62-I66 VanDerWaalsContact O-CG1 3.27Å; G62-I66 WeakPolarHBondContact O-CG1 3.37Å; G62-I66 PolarHBondContact O-N 3.36Å; I66-L68 VanDerWaalsContact C-N 3.31Å; I66-L68 PolarHBondContact O-N 2.98Å; I66-N69 PolarHBondContact O-N 3.4Å; I66-N69 VanDerWaalsContact O-N 3.12Å; I66-Q70 HydrophobicContact CG2-CG 4.12Å; I66-Q70 WeakPolarHBondContact O-CG 3.44Å; I66-Q70 PolarHBondContact O-N 3.19Å; I66-F140 HydrophobicContact CB-CE2 4.43Å; I66-F140 HydrophobicContact CG2-CE2 4.26Å; I66-M149 HydrophobicContact CG2-CE 4.38Å; I66-M149 HydrophobicContact CG2-SD 3.97Å
67L98.2Very high97.5Very high3 Ų332.1 Ų32.12%0.01616%0.16CC..Hα-helixtrans-57.4-44.8178178.863.1000111.8M63 Y64 T71 L87 L90 P139 A143 M149 Y190M63-L67 WeakPolarHBondContact O-CB 3.34Å; M63-L67 PolarHBondContact O-N 3.46Å; Y64-L67 PolarHBondContact O-N 2.91Å; L67-T71 HydrophobicContact CD1-CG2 4.15Å; L67-T71 WeakPolarHBondContact O-CB 3.48Å; L67-T71 WeakPolarHBondContact O-CG2 3.41Å; L67-T71 PolarHBondContact O-N 3.1Å; L67-T71 PolarHBondContact O-OG1 3.05Å; L67-L87 HydrophobicContact CD1-CD1 4.19Å; L67-L87 HydrophobicContact CD2-CD1 3.98Å; L67-L87 HydrophobicContact CD2-CD2 4.35Å; L67-L87 HydrophobicContact CG-CD1 3.82Å; L67-L90 HydrophobicContact CD2-CD1 4.49Å; L67-P139 HydrophobicContact CD2-CB 4.27Å; L67-A143 HydrophobicContact CD1-CB 3.61Å; L67-M149 HydrophobicContact CB-CE 4.01Å; L67-M149 HydrophobicContact CD1-CE 3.68Å; L67-M149 HydrophobicContact CG-CE 4.46Å; L67-Y190 HydrophobicContact CD1-CE1 4.01Å; L67-Y190 VanDerWaalsContact CD1-OH 3.29Å; L67-Y190 WeakPolarHBondContact CD1-OH 3.46Å
68L98.3Very high97.2Very high1 Ų135.2 Ų35.21%0.00517%0.173CC..Hα-helixtrans-63.4-40.9175.3-79.4168.3000112.6W33 Y64 K65 I66 T71 A72 N82 N85 L87 W88 P91W33-L68 HydrophobicContact CH2-CD1 3.74Å; W33-L68 HydrophobicContact CZ2-CD1 4.34Å; Y64-L68 WeakPolarHBondContact O-CB 3.49Å; Y64-L68 WeakPolarHBondContact O-CG 3.46Å; Y64-L68 PolarHBondContact O-N 3.34Å; K65-L68 PolarHBondContact O-N 3.22Å; I66-L68 VanDerWaalsContact C-N 3.31Å; I66-L68 PolarHBondContact O-N 2.98Å; L68-T71 PolarHBondContact O-OG1 3.3Å; L68-A72 WeakPolarHBondContact O-CB 3.2Å; L68-A72 PolarHBondContact O-N 2.68Å; L68-A72 VanDerWaalsContact O-N 3.08Å; L68-N82 PolarHBondContact O-ND2 3.14Å; L68-N85 HydrophobicContact CD2-CB 3.81Å; L68-L87 HydrophobicContact CD2-CB 3.88Å; L68-W88 HydrophobicContact CD1-CD2 3.62Å; L68-W88 HydrophobicContact CD1-CE3 3.47Å; L68-W88 VanDerWaalsContact CD1-CE3 3.47Å; L68-W88 HydrophobicContact CD1-CG 4.37Å; L68-W88 HydrophobicContact CD1-CH2 3.68Å; L68-W88 HydrophobicContact CD1-CZ2 3.85Å; L68-W88 HydrophobicContact CD1-CZ3 3.51Å; L68-W88 HydrophobicContact CD2-CD2 4.07Å; L68-W88 HydrophobicContact CD2-CG 4.09Å; L68-P91 HydrophobicContact CD1-CG 3.74Å
69N97.5Very high96.8Very high81 Ų8134 Ų3443%0.43317%0.169SC..Hα-helixtrans-64.6-47.7177.8-72.9-12.3000111.4G38 K65 I66 T71 A72G38-N69 PolarHBondContact O-ND2 2.9Å; K65-N69 WeakPolarHBondContact O-CB 3.37Å; K65-N69 PolarHBondContact O-N 3.39Å; K65-N69 PolarHBondContact O-ND2 3.07Å; I66-N69 PolarHBondContact O-N 3.4Å; I66-N69 VanDerWaalsContact O-N 3.12Å; N69-T71 VanDerWaalsContact C-N 3.29Å; N69-T71 PolarHBondContact O-N 3.1Å; N69-A72 VanDerWaalsContact O-CB 3.32Å; N69-A72 WeakPolarHBondContact O-CB 3.49Å; N69-A72 PolarHBondContact O-N 3.14Å
70Q97.4Very high96.2Very high69 Ų6936.7 Ų36.732%0.32219%0.191SC..Hα-helixtrans-67.9-29.8-178.5-67-62-9.900112.8I66 I148 M149I66-Q70 HydrophobicContact CG2-CG 4.12Å; I66-Q70 WeakPolarHBondContact O-CG 3.44Å; I66-Q70 PolarHBondContact O-N 3.19Å; Q70-I148 HydrophobicContact CB-CG2 4.11Å; Q70-M149 HydrophobicContact CB-SD 4.13Å; Q70-M149 HydrophobicContact CG-SD 3.74Å
71T97.5Very high95.7Very high0 Ų043.5 Ų43.50%022%0.223CC..Hα-helixtrans-88.2-10.417855.80000113.7L67 L68 N69 R73 Y74 F75 N85 L87 I148 Y190 L193L67-T71 HydrophobicContact CD1-CG2 4.15Å; L67-T71 WeakPolarHBondContact O-CB 3.48Å; L67-T71 WeakPolarHBondContact O-CG2 3.41Å; L67-T71 PolarHBondContact O-N 3.1Å; L67-T71 PolarHBondContact O-OG1 3.05Å; L68-T71 PolarHBondContact O-OG1 3.3Å; N69-T71 VanDerWaalsContact C-N 3.29Å; N69-T71 PolarHBondContact O-N 3.1Å; T71-R73 VanDerWaalsContact C-N 3.29Å; T71-R73 PolarHBondContact O-N 3.01Å; T71-Y74 WeakPolarHBondContact O-CD2 3.4Å; T71-Y74 PolarHBondContact O-N 3.33Å; T71-F75 WeakPolarHBondContact O-CD2 3.16Å; T71-N85 PolarHBondContact OG1-ND2 3.13Å; T71-L87 HydrophobicContact CG2-CD1 3.93Å; T71-I148 HydrophobicContact CG2-CD1 4.38Å; T71-I148 HydrophobicContact CG2-CG2 4.01Å; T71-Y190 HydrophobicContact CG2-CE1 4.38Å; T71-L193 HydrophobicContact CG2-CD2 3.81Å
72A97.1Very high95.5Very high28 Ų2844.5 Ų44.523%0.23123%0.228CC..Hα-helixtrans-56.2-40.4-172.500000113.9L68 N69 Y74 F75 A76 N82L68-A72 WeakPolarHBondContact O-CB 3.2Å; L68-A72 PolarHBondContact O-N 2.68Å; L68-A72 VanDerWaalsContact O-N 3.08Å; N69-A72 VanDerWaalsContact O-CB 3.32Å; N69-A72 WeakPolarHBondContact O-CB 3.49Å; N69-A72 PolarHBondContact O-N 3.14Å; A72-Y74 PolarHBondContact O-N 3.39Å; A72-F75 PolarHBondContact O-N 3.35Å; A72-A76 PolarHBondContact O-N 3.39Å; A72-N82 VanDerWaalsContact CA-OD1 3.26Å; A72-N82 WeakPolarHBondContact CA-OD1 3.13Å; A72-N82 HydrophobicContact CB-CB 4.19Å
73R95.4Very high95.2Very high161 Ų16146.5 Ų46.561%0.60824%0.237SC*.Hα-helixtrans-57.9-31.5178.964179.3175.3-175.9-5.1113.5T71T71-R73 VanDerWaalsContact C-N 3.29Å; T71-R73 PolarHBondContact O-N 3.01Å
74Y95.9Very high95Very high39 Ų3949.5 Ų49.515%0.15325%0.252CS..Hα-helixtrans-80.8-23.9-179.5-53.3-69.6000112.4T71 A72 I148 L193 Q194T71-Y74 WeakPolarHBondContact O-CD2 3.4Å; T71-Y74 PolarHBondContact O-N 3.33Å; A72-Y74 PolarHBondContact O-N 3.39Å; Y74-I148 HydrophobicContact CE2-CD1 4.3Å; Y74-I148 HydrophobicContact CE2-CG1 4.42Å; Y74-L193 HydrophobicContact CD2-CD2 4.01Å; Y74-L193 HydrophobicContact CD2-CG 4.03Å; Y74-L193 HydrophobicContact CG-CD1 4.39Å; Y74-L193 HydrophobicContact CG-CD2 4.38Å; Y74-L193 HydrophobicContact CG-CG 3.91Å; Y74-Q194 HydrophobicContact CE1-CB 4.22Å; Y74-Q194 HydrophobicContact CE1-CG 3.83Å; Y74-Q194 HydrophobicContact CE2-CG 4.38Å
75F96.3Very high95Very high1 Ų149.4 Ų49.40%0.00425%0.251CS..Hα-helixtrans-91.9-11.4176.9-73.8-84.4000114T71 A72 K77 F78 A79 Q84 N85 I86 F189 L193 L203T71-F75 WeakPolarHBondContact O-CD2 3.16Å; A72-F75 PolarHBondContact O-N 3.35Å; F75-K77 PolarHBondContact O-N 3.47Å; F75-F78 HydrophobicContact CB-CD2 4.44Å; F75-F78 AromaticContact CD1-CD2 3.72Å; F75-F78 HydrophobicContact CD1-CD2 3.72Å; F75-F78 HydrophobicContact CD1-CE2 4.07Å; F75-F78 HydrophobicContact CE1-CD2 4.44Å; F75-F78 HydrophobicContact CE1-CE2 4.43Å; F75-F78 HydrophobicContact CG-CD2 4.44Å; F75-F78 PolarHBondContact O-N 3.2Å; F75-A79 PolarHBondContact O-N 3.34Å; F75-Q84 WeakPolarHBondContact CD1-O 3.34Å; F75-N85 HydrophobicContact CB-CB 4.34Å; F75-N85 HydrophobicContact CD1-CB 4.37Å; F75-N85 HydrophobicContact CD2-CB 3.99Å; F75-N85 VanDerWaalsContact CD2-CG 3.4Å; F75-N85 VanDerWaalsContact CD2-ND2 3.34Å; F75-N85 WeakPolarHBondContact CD2-ND2 3.39Å; F75-N85 HydrophobicContact CE2-CB 4.4Å; F75-N85 VanDerWaalsContact CE2-OD1 3.31Å; F75-N85 WeakPolarHBondContact CE2-OD1 3.48Å; F75-N85 HydrophobicContact CG-CB 3.98Å; F75-I86 HydrophobicContact CE1-CG1 3.86Å; F75-I86 HydrophobicContact CE1-CG2 4.42Å; F75-I86 HydrophobicContact CZ-CD1 4.5Å; F75-I86 HydrophobicContact CZ-CG1 3.73Å; F75-F189 HydrophobicContact CZ-CZ 4.48Å; F75-L193 HydrophobicContact CD2-CD1 4.03Å; F75-L193 HydrophobicContact CE1-CD1 4.34Å; F75-L193 HydrophobicContact CE2-CD1 3.46Å; F75-L193 VanDerWaalsContact CE2-CD1 3.46Å; F75-L193 HydrophobicContact CE2-CD2 3.8Å; F75-L193 HydrophobicContact CE2-CG 4.29Å; F75-L193 HydrophobicContact CZ-CD1 3.62Å; F75-L193 HydrophobicContact CZ-CD2 4.45Å; F75-L203 HydrophobicContact CE1-CD1 4.23Å
76A94.8Very high94.9Very high66 Ų6648.1 Ų48.155%0.54525%0.246SC..THydrogen-bonded Turntrans-56.4-24.6179.300000113.7A72 F78A72-A76 PolarHBondContact O-N 3.39Å; A76-F78 VanDerWaalsContact C-N 3.29Å; A76-F78 PolarHBondContact O-N 2.86Å
77K92.8Very high94.9Very high102 Ų10248.1 Ų48.144%0.44325%0.246SC..THydrogen-bonded Turntrans-73.1-15.5174.968.8-177.8-179.9179.20114.6F75 P196 S198F75-K77 PolarHBondContact O-N 3.47Å; K77-P196 PolarHBondContact NZ-O 3.39Å; K77-S198 WeakPolarHBondContact CE-O 3.45Å; K77-S198 WeakPolarHBondContact CE-OG 3.46Å; K77-S198 PolarHBondContact NZ-O 3.3Å; K77-S198 PolarHBondContact NZ-OG 3.04Å
78F92.4Very high94.9Very high65 Ų6548.2 Ų48.229%0.28525%0.246SC..THydrogen-bonded Turntrans-99.6-34.1-179.1-57.5-62.3000112.8F75 A76 Q84 F200 L203F75-F78 HydrophobicContact CB-CD2 4.44Å; F75-F78 AromaticContact CD1-CD2 3.72Å; F75-F78 HydrophobicContact CD1-CD2 3.72Å; F75-F78 HydrophobicContact CD1-CE2 4.07Å; F75-F78 HydrophobicContact CE1-CD2 4.44Å; F75-F78 HydrophobicContact CE1-CE2 4.43Å; F75-F78 HydrophobicContact CG-CD2 4.44Å; F75-F78 PolarHBondContact O-N 3.2Å; A76-F78 VanDerWaalsContact C-N 3.29Å; A76-F78 PolarHBondContact O-N 2.86Å; F78-Q84 HydrophobicContact CB-CB 3.93Å; F78-Q84 HydrophobicContact CB-CG 4.34Å; F78-F200 HydrophobicContact CD1-CB 4.2Å; F78-F200 HydrophobicContact CD1-CD2 4.17Å; F78-F200 HydrophobicContact CD2-CD2 4.15Å; F78-F200 HydrophobicContact CE1-CB 3.83Å; F78-F200 HydrophobicContact CE1-CD2 4.37Å; F78-F200 HydrophobicContact CE2-CD2 4.35Å; F78-F200 HydrophobicContact CG-CD2 4.05Å; F78-F200 HydrophobicContact CZ-CB 4.18Å; F78-F200 HydrophobicContact CZ-CD2 4.44Å; F78-L203 HydrophobicContact CE2-CD1 3.72Å; F78-L203 HydrophobicContact CZ-CD1 3.89Å
79A89.1Confident94.9Very high19 Ų1948.9 Ų48.916%0.15725%0.253CS..  trans-166.4159.8173.900000111.5F75 Q84F75-A79 PolarHBondContact O-N 3.34Å; A79-Q84 HydrophobicContact CB-CB 3.98Å; A79-Q84 HydrophobicContact CB-CG 3.25Å
80P86.6Confident95Very high102 Ų10245.3 Ų45.366%0.66223%0.234SC*.G310 helixtrans-66.3169.4167.331.6-37.1000112.1N82 E83P80-N82 PolarHBondContact O-N 3.04Å; P80-E83 PolarHBondContact O-N 3.25Å
81E87.6Confident95Very high143 Ų14342.1 Ų42.167%0.66822%0.219SC*.G310 helixtrans58.319.3169.1-59.6-174.8-159.300116.2E83E81-E83 HydrophobicContact CB-CG 4.18Å; E81-E83 PolarHBondContact O-N 2.9Å; E81-E83 VanDerWaalsContact O-N 3.11Å
82N94.5Very high95Very high22 Ų2242.3 Ų42.312%0.11822%0.22CC..G310 helixtrans6117176.6-157.528.4000113.8L68 A72 P80 Q84 N85 W88L68-N82 PolarHBondContact O-ND2 3.14Å; A72-N82 VanDerWaalsContact CA-OD1 3.26Å; A72-N82 WeakPolarHBondContact CA-OD1 3.13Å; A72-N82 HydrophobicContact CB-CB 4.19Å; P80-N82 PolarHBondContact O-N 3.04Å; N82-Q84 VanDerWaalsContact C-N 3.34Å; N82-Q84 PolarHBondContact O-N 3.01Å; N82-N85 VanDerWaalsContact O-CB 3.28Å; N82-N85 WeakPolarHBondContact O-CB 3.28Å; N82-N85 PolarHBondContact O-N 3.35Å; N82-N85 WeakPolarHBondContact OD1-CB 3.31Å; N82-N85 PolarHBondContact OD1-ND2 3.4Å; N82-W88 PolarHBondContact O-NE1 3.17Å
83E92.4Very high95.1Very high41 Ų4142.2 Ų42.219%0.19221%0.214CC..THydrogen-bonded Turntrans-68.7-32.5-173.4-61.6-173.1160.800113.2L25 P80 E81 N85 T255 L256L25-E83 WeakPolarHBondContact CD1-OE1 3.49Å; P80-E83 PolarHBondContact O-N 3.25Å; E81-E83 HydrophobicContact CB-CG 4.18Å; E81-E83 PolarHBondContact O-N 2.9Å; E81-E83 VanDerWaalsContact O-N 3.11Å; E83-N85 PolarHBondContact O-N 3.35Å; E83-T255 WeakPolarHBondContact O-CB 3.5Å; E83-L256 HydrophobicContact CG-CD2 4.25Å; E83-L256 PolarHBondContact O-N 2.97Å; E83-L256 VanDerWaalsContact O-N 3.1Å
84Q95.4Very high95.2Very high65 Ų6534.5 Ų34.530%0.30419%0.185SC..THydrogen-bonded Turntrans-82.24.9178.2-66.6-65.3-30.600113.1F75 F78 A79 N82 I86 F200F75-Q84 WeakPolarHBondContact CD1-O 3.34Å; F78-Q84 HydrophobicContact CB-CB 3.93Å; F78-Q84 HydrophobicContact CB-CG 4.34Å; A79-Q84 HydrophobicContact CB-CB 3.98Å; A79-Q84 HydrophobicContact CB-CG 3.25Å; N82-Q84 VanDerWaalsContact C-N 3.34Å; N82-Q84 PolarHBondContact O-N 3.01Å; Q84-I86 PolarHBondContact O-N 2.91Å; Q84-I86 VanDerWaalsContact O-N 3.1Å; Q84-F200 HydrophobicContact CB-CE2 4.32Å; Q84-F200 WeakPolarHBondContact O-CE2 3.44Å
85N97.9Very high95.3Very high0 Ų032.8 Ų32.80%018%0.179CC..  trans-66.3114.2174.8-164.7-37.1000110.4L68 T71 F75 N82 E83 L87 W88L68-N85 HydrophobicContact CD2-CB 3.81Å; T71-N85 PolarHBondContact OG1-ND2 3.13Å; F75-N85 HydrophobicContact CB-CB 4.34Å; F75-N85 HydrophobicContact CD1-CB 4.37Å; F75-N85 HydrophobicContact CD2-CB 3.99Å; F75-N85 VanDerWaalsContact CD2-CG 3.4Å; F75-N85 VanDerWaalsContact CD2-ND2 3.34Å; F75-N85 WeakPolarHBondContact CD2-ND2 3.39Å; F75-N85 HydrophobicContact CE2-CB 4.4Å; F75-N85 VanDerWaalsContact CE2-OD1 3.31Å; F75-N85 WeakPolarHBondContact CE2-OD1 3.48Å; F75-N85 HydrophobicContact CG-CB 3.98Å; N82-N85 VanDerWaalsContact O-CB 3.28Å; N82-N85 WeakPolarHBondContact O-CB 3.28Å; N82-N85 PolarHBondContact O-N 3.35Å; N82-N85 WeakPolarHBondContact OD1-CB 3.31Å; N82-N85 PolarHBondContact OD1-ND2 3.4Å; E83-N85 PolarHBondContact O-N 3.35Å; N85-L87 PolarHBondContact O-N 3.08Å; N85-L87 VanDerWaalsContact O-N 3.13Å; N85-L87 WeakPolarHBondContact OD1-CB 3.41Å; N85-L87 PolarHBondContact OD1-N 3.33Å; N85-W88 WeakPolarHBondContact O-CB 3.43Å; N85-W88 PolarHBondContact O-N 3.26Å; N85-W88 VanDerWaalsContact O-N 3.14Å
86I98.3Very high95.4Very high1 Ų133.7 Ų33.71%0.00518%0.183CC..G310 helixtrans-72.7-5.4-174.959.9172.5000112.5F75 Q84 W88 F189 F200 L203 L204 L207 T254 T255F75-I86 HydrophobicContact CE1-CG1 3.86Å; F75-I86 HydrophobicContact CE1-CG2 4.42Å; F75-I86 HydrophobicContact CZ-CD1 4.5Å; F75-I86 HydrophobicContact CZ-CG1 3.73Å; Q84-I86 PolarHBondContact O-N 2.91Å; Q84-I86 VanDerWaalsContact O-N 3.1Å; I86-W88 PolarHBondContact O-N 2.87Å; I86-F189 HydrophobicContact CD1-CE2 3.94Å; I86-F189 HydrophobicContact CD1-CZ 4.4Å; I86-F189 HydrophobicContact CG1-CE2 4.43Å; I86-F189 HydrophobicContact CG1-CZ 4.4Å; I86-F200 HydrophobicContact CG2-CE1 4.41Å; I86-F200 HydrophobicContact CG2-CE2 3.61Å; I86-F200 HydrophobicContact CG2-CZ 3.52Å; I86-L203 HydrophobicContact CD1-CB 3.77Å; I86-L204 HydrophobicContact CB-CD2 4.14Å; I86-L204 HydrophobicContact CD1-CD2 3.96Å; I86-L204 HydrophobicContact CD1-CG 4.3Å; I86-L204 HydrophobicContact CG2-CD2 3.75Å; I86-L204 HydrophobicContact CG2-CG 4.45Å; I86-L207 HydrophobicContact CB-CD2 3.84Å; I86-L207 HydrophobicContact CD1-CB 3.89Å; I86-L207 HydrophobicContact CD1-CD2 3.71Å; I86-L207 HydrophobicContact CD1-CG 4.39Å; I86-L207 HydrophobicContact CG1-CD2 3.77Å; I86-L207 WeakPolarHBondContact O-CD2 3.22Å; I86-T254 WeakPolarHBondContact O-CB 3.43Å; I86-T254 PolarHBondContact O-OG1 3.02Å; I86-T255 HydrophobicContact CG2-CG2 4.06Å
87L98.5Very high95.6Very high1 Ų131 Ų311%0.00516%0.159CC..G310 helixtrans-76.7-8.4171.2-62.4167.9000113L67 L68 T71 N85 G89 L90 P91 W186 F189 Y190 L207L67-L87 HydrophobicContact CD1-CD1 4.19Å; L67-L87 HydrophobicContact CD2-CD1 3.98Å; L67-L87 HydrophobicContact CD2-CD2 4.35Å; L67-L87 HydrophobicContact CG-CD1 3.82Å; L68-L87 HydrophobicContact CD2-CB 3.88Å; T71-L87 HydrophobicContact CG2-CD1 3.93Å; N85-L87 PolarHBondContact O-N 3.08Å; N85-L87 VanDerWaalsContact O-N 3.13Å; N85-L87 WeakPolarHBondContact OD1-CB 3.41Å; N85-L87 PolarHBondContact OD1-N 3.33Å; L87-G89 PolarHBondContact O-N 3.25Å; L87-G89 VanDerWaalsContact O-N 3.13Å; L87-L90 HydrophobicContact CD2-CD1 4.15Å; L87-L90 PolarHBondContact O-N 3.12Å; L87-L90 VanDerWaalsContact O-N 3.14Å; L87-P91 WeakPolarHBondContact O-CD 3.34Å; L87-W186 HydrophobicContact CD2-CZ3 4.14Å; L87-F189 HydrophobicContact CD1-CE1 4.16Å; L87-F189 HydrophobicContact CD1-CZ 4.48Å; L87-F189 HydrophobicContact CD2-CE1 3.89Å; L87-F189 HydrophobicContact CD2-CZ 4.19Å; L87-F189 HydrophobicContact CG-CE1 4.26Å; L87-F189 HydrophobicContact CG-CZ 4.3Å; L87-Y190 HydrophobicContact CD1-CE1 4.34Å; L87-L207 HydrophobicContact CD2-CD1 3.82Å
88W98.2Very high95.9Very high6 Ų627.4 Ų27.42%0.02314%0.143CC..G310 helixtrans-58.2-24.3175.8-83.7116000113.6K29 W33 L68 N82 N85 I86 L90 P91 L92 T254 L256K29-W88 HydrophobicContact CD-CH2 3.73Å; K29-W88 HydrophobicContact CD-CZ3 3.87Å; W33-W88 AromaticContact CE2-CH2 3.95Å; W33-W88 AromaticContact CH2-CH2 3.87Å; W33-W88 HydrophobicContact CH2-CH2 3.87Å; W33-W88 AromaticContact CH2-CZ3 3.72Å; W33-W88 HydrophobicContact CH2-CZ3 3.72Å; W33-W88 AromaticContact CZ2-CH2 3.4Å; W33-W88 HydrophobicContact CZ2-CH2 3.4Å; W33-W88 VanDerWaalsContact CZ2-CH2 3.4Å; W33-W88 AromaticContact CZ2-CZ3 3.7Å; W33-W88 HydrophobicContact CZ2-CZ3 3.7Å; W33-W88 HydrophobicContact CZ3-CZ3 4.28Å; L68-W88 HydrophobicContact CD1-CD2 3.62Å; L68-W88 HydrophobicContact CD1-CE3 3.47Å; L68-W88 VanDerWaalsContact CD1-CE3 3.47Å; L68-W88 HydrophobicContact CD1-CG 4.37Å; L68-W88 HydrophobicContact CD1-CH2 3.68Å; L68-W88 HydrophobicContact CD1-CZ2 3.85Å; L68-W88 HydrophobicContact CD1-CZ3 3.51Å; L68-W88 HydrophobicContact CD2-CD2 4.07Å; L68-W88 HydrophobicContact CD2-CG 4.09Å; N82-W88 PolarHBondContact O-NE1 3.17Å; N85-W88 WeakPolarHBondContact O-CB 3.43Å; N85-W88 PolarHBondContact O-N 3.26Å; N85-W88 VanDerWaalsContact O-N 3.14Å; I86-W88 PolarHBondContact O-N 2.87Å; W88-L90 PolarHBondContact O-N 3.08Å; W88-P91 HydrophobicContact CE3-CG 4Å; W88-P91 HydrophobicContact CZ3-CG 4.41Å; W88-P91 WeakPolarHBondContact O-CD 3.34Å; W88-L92 HydrophobicContact CB-CD1 4.26Å; W88-L92 WeakPolarHBondContact O-CB 3.3Å; W88-L92 WeakPolarHBondContact O-CD1 3.49Å; W88-L92 VanDerWaalsContact O-CG 3.26Å; W88-L92 WeakPolarHBondContact O-CG 3.47Å; W88-L92 PolarHBondContact O-N 3.36Å; W88-T254 WeakPolarHBondContact CB-O 3.17Å; W88-L256 HydrophobicContact CB-CB 4.31Å; W88-L256 HydrophobicContact CD2-CB 3.99Å; W88-L256 HydrophobicContact CD2-CD1 3.75Å; W88-L256 HydrophobicContact CD2-CG 4.37Å; W88-L256 HydrophobicContact CE3-CD1 3.67Å; W88-L256 HydrophobicContact CG-CB 3.73Å; W88-L256 HydrophobicContact CG-CD1 4.28Å; W88-L256 HydrophobicContact CH2-CD1 4.44Å; W88-L256 HydrophobicContact CZ2-CD1 4.47Å; W88-L256 HydrophobicContact CZ3-CD1 4.03Å
89G97.9Very high96Very high14 Ų1432.5 Ų32.514%0.14417%0.165CC..Hα-helixtrans-50.2-43.6172.800000113.5L87 Q93 T254L87-G89 PolarHBondContact O-N 3.25Å; L87-G89 VanDerWaalsContact O-N 3.13Å; G89-Q93 WeakPolarHBondContact O-CB 3.45Å; G89-Q93 PolarHBondContact O-N 3.5Å; G89-T254 PolarHBondContact N-O 3.44Å
90L98.6Very high96.4Very high7 Ų732.2 Ų32.24%0.03716%0.161CC..Hα-helixtrans-67-58.1-173.4-54.6171.3000113Y64 L67 L87 W88 L92 Q93 Y94 L135 P139 W186Y64-L90 HydrophobicContact CD1-CB 3.65Å; Y64-L90 HydrophobicContact CD1-CD1 4.29Å; Y64-L90 HydrophobicContact CE1-CB 3.42Å; Y64-L90 VanDerWaalsContact CE1-CB 3.42Å; Y64-L90 HydrophobicContact CE1-CD1 4.11Å; Y64-L90 HydrophobicContact CE1-CG 4.3Å; Y64-L90 HydrophobicContact CG-CB 4.49Å; L67-L90 HydrophobicContact CD2-CD1 4.49Å; L87-L90 HydrophobicContact CD2-CD1 4.15Å; L87-L90 PolarHBondContact O-N 3.12Å; L87-L90 VanDerWaalsContact O-N 3.14Å; W88-L90 PolarHBondContact O-N 3.08Å; L90-L92 VanDerWaalsContact C-N 3.33Å; L90-L92 PolarHBondContact O-N 2.98Å; L90-Q93 PolarHBondContact O-N 3.02Å; L90-Y94 PolarHBondContact O-N 3.07Å; L90-L135 HydrophobicContact CD2-CB 4.37Å; L90-P139 HydrophobicContact CD1-CB 4.29Å; L90-P139 HydrophobicContact CD1-CG 4.05Å; L90-W186 HydrophobicContact CD1-CH2 4.43Å
91P98.4Very high97Very high1 Ų128.9 Ų28.91%0.00615%0.145CC..Hα-helixtrans-67.8-31.4-179.525-33.4000113.2P30 W33 M61 Y64 L68 L87 W88 Y94 G95P30-P91 HydrophobicContact CG-CB 3.94Å; P30-P91 WeakPolarHBondContact CG-O 3.18Å; W33-P91 HydrophobicContact CZ3-CB 3.96Å; W33-P91 HydrophobicContact CZ3-CG 4.47Å; M61-P91 HydrophobicContact SD-CB 3.72Å; Y64-P91 HydrophobicContact CD2-CB 4.03Å; Y64-P91 HydrophobicContact CG-CB 3.96Å; Y64-P91 HydrophobicContact CG-CG 4.49Å; L68-P91 HydrophobicContact CD1-CG 3.74Å; L87-P91 WeakPolarHBondContact O-CD 3.34Å; W88-P91 HydrophobicContact CE3-CG 4Å; W88-P91 HydrophobicContact CZ3-CG 4.41Å; W88-P91 WeakPolarHBondContact O-CD 3.34Å; P91-Y94 PolarHBondContact O-N 2.81Å; P91-G95 PolarHBondContact O-N 3.18Å
92L98.1Very high97.5Very high5 Ų522 Ų223%0.02611%0.113CC..Hα-helixtrans-66.2-43.3176-72.1172.1000110.6I28 P30 W88 L90 Y94 G95 W96 L256 T259 Q263I28-L92 WeakPolarHBondContact O-CD2 3.39Å; P30-L92 HydrophobicContact CG-CD2 4.09Å; W88-L92 HydrophobicContact CB-CD1 4.26Å; W88-L92 WeakPolarHBondContact O-CB 3.3Å; W88-L92 WeakPolarHBondContact O-CD1 3.49Å; W88-L92 VanDerWaalsContact O-CG 3.26Å; W88-L92 WeakPolarHBondContact O-CG 3.47Å; W88-L92 PolarHBondContact O-N 3.36Å; L90-L92 VanDerWaalsContact C-N 3.33Å; L90-L92 PolarHBondContact O-N 2.98Å; L92-Y94 VanDerWaalsContact C-N 3.34Å; L92-Y94 PolarHBondContact O-N 2.8Å; L92-G95 PolarHBondContact O-N 2.86Å; L92-W96 PolarHBondContact O-N 3.38Å; L92-L256 HydrophobicContact CD1-CD1 4.3Å; L92-T259 HydrophobicContact CB-CG2 3.65Å; L92-T259 VanDerWaalsContact CD1-CB 3.46Å; L92-T259 HydrophobicContact CD1-CG2 3.55Å; L92-T259 HydrophobicContact CG-CG2 4.26Å; L92-Q263 PolarHBondContact O-NE2 3.05Å; L92-Q263 PolarHBondContact O-OE1 3.27Å
93Q97.8Very high97.7Very high25 Ų2521.2 Ų21.212%0.11711%0.108CC..Hα-helixtrans-62.8-42.8175.7-169.563.99.600111.9G89 L90 G95 W96 Q97 W240G89-Q93 WeakPolarHBondContact O-CB 3.45Å; G89-Q93 PolarHBondContact O-N 3.5Å; L90-Q93 PolarHBondContact O-N 3.02Å; Q93-G95 VanDerWaalsContact C-N 3.34Å; Q93-G95 PolarHBondContact O-N 3.39Å; Q93-W96 VanDerWaalsContact NE2-CE3 3.27Å; Q93-W96 VanDerWaalsContact NE2-CZ3 3.27Å; Q93-W96 PolarHBondContact O-N 3.5Å; Q93-Q97 WeakPolarHBondContact O-CG 3.35Å; Q93-Q97 PolarHBondContact O-N 3.45Å; Q93-W240 VanDerWaalsContact NE2-CZ2 3.32Å
94Y98.6Very high98Very high0 Ų019.5 Ų19.50%010%0.102CC..Hα-helixtrans-63-40.5175.9-172.5-128000112.8Y57 R60 M61 Y64 L90 P91 L92 W96 Q97 Y98 L103 V122 N132Y57-Y94 WeakPolarHBondContact CA-OH 3.48Å; Y57-Y94 HydrophobicContact CD2-CD1 4.22Å; Y57-Y94 AromaticContact CD2-CE1 3.39Å; Y57-Y94 HydrophobicContact CD2-CE1 3.39Å; Y57-Y94 HydrophobicContact CD2-CE2 4.46Å; Y57-Y94 AromaticContact CD2-CZ 3.54Å; Y57-Y94 AromaticContact CE2-CD1 3.82Å; Y57-Y94 HydrophobicContact CE2-CD1 3.82Å; Y57-Y94 AromaticContact CE2-CE1 3.46Å; Y57-Y94 HydrophobicContact CE2-CE1 3.46Å; Y57-Y94 VanDerWaalsContact CE2-CE1 3.46Å; Y57-Y94 AromaticContact CE2-CZ 3.95Å; Y57-Y94 HydrophobicContact CG-CE1 4.41Å; R60-Y94 HydrophobicContact CB-CE1 3.82Å; R60-Y94 VanDerWaalsContact CD-CZ 3.5Å; R60-Y94 HydrophobicContact CG-CE1 4.12Å; M61-Y94 HydrophobicContact CB-CD1 4.38Å; M61-Y94 HydrophobicContact CB-CE1 4.25Å; M61-Y94 HydrophobicContact CE-CD1 3.57Å; M61-Y94 HydrophobicContact CE-CE1 4.31Å; M61-Y94 HydrophobicContact CE-CG 4.41Å; M61-Y94 HydrophobicContact SD-CD1 4.3Å; Y64-Y94 HydrophobicContact CD2-CD1 4.19Å; Y64-Y94 AromaticContact CE2-CD1 3.81Å; Y64-Y94 HydrophobicContact CE2-CD1 3.81Å; Y64-Y94 AromaticContact CE2-CG 3.85Å; Y64-Y94 HydrophobicContact CE2-CG 3.85Å; L90-Y94 PolarHBondContact O-N 3.07Å; P91-Y94 PolarHBondContact O-N 2.81Å; L92-Y94 VanDerWaalsContact C-N 3.34Å; L92-Y94 PolarHBondContact O-N 2.8Å; Y94-W96 PolarHBondContact O-N 3.3Å; Y94-Q97 PolarHBondContact O-N 2.86Å; Y94-Y98 PolarHBondContact O-N 3.31Å; Y94-L103 HydrophobicContact CD2-CD1 3.85Å; Y94-L103 HydrophobicContact CD2-CD2 4.15Å; Y94-L103 HydrophobicContact CE2-CD1 3.22Å; Y94-L103 HydrophobicContact CE2-CD2 3.75Å; Y94-L103 HydrophobicContact CE2-CG 4.13Å; Y94-V122 WeakPolarHBondContact OH-CG2 3.5Å; Y94-N132 HydrophobicContact CD2-CB 4.42Å; Y94-N132 WeakPolarHBondContact CD2-OD1 3.3Å; Y94-N132 WeakPolarHBondContact CE2-OD1 3.26Å
95G98.1Very high98.1Very high2 Ų216.4 Ų16.42%0.0219%0.087CC..Hα-helixtrans-62.6-40.1174.500000113.8P91 L92 Q93 Y98 K99P91-G95 PolarHBondContact O-N 3.18Å; L92-G95 PolarHBondContact O-N 2.86Å; Q93-G95 VanDerWaalsContact C-N 3.34Å; Q93-G95 PolarHBondContact O-N 3.39Å; G95-Y98 PolarHBondContact O-N 3.02Å; G95-K99 PolarHBondContact O-N 3.11Å
96W98Very high98.1Very high21 Ų2117.5 Ų17.58%0.089%0.094CC..Hα-helixtrans-64.5-42.8172.7166.981.3000111.6L92 Q93 Y94 Y98 K99 T100 R102 W128 F236 L266 P267L92-W96 PolarHBondContact O-N 3.38Å; Q93-W96 VanDerWaalsContact NE2-CE3 3.27Å; Q93-W96 VanDerWaalsContact NE2-CZ3 3.27Å; Q93-W96 PolarHBondContact O-N 3.5Å; Y94-W96 PolarHBondContact O-N 3.3Å; W96-Y98 VanDerWaalsContact C-N 3.3Å; W96-Y98 PolarHBondContact O-N 3.45Å; W96-K99 PolarHBondContact O-N 3.08Å; W96-T100 HydrophobicContact CG-CG2 4.38Å; W96-T100 WeakPolarHBondContact O-CB 3.33Å; W96-T100 VanDerWaalsContact O-CG2 3.27Å; W96-T100 WeakPolarHBondContact O-CG2 3.15Å; W96-T100 PolarHBondContact O-N 3.47Å; W96-T100 VanDerWaalsContact O-N 3.08Å; W96-T100 PolarHBondContact O-OG1 3.39Å; W96-R102 VanDerWaalsContact CZ2-CZ 3.5Å; W96-W128 AromaticContact CH2-CH2 3.65Å; W96-W128 HydrophobicContact CH2-CH2 3.65Å; W96-W128 AromaticContact CH2-CZ2 3.99Å; W96-W128 HydrophobicContact CH2-CZ2 3.99Å; W96-W128 HydrophobicContact CH2-CZ3 4.01Å; W96-W128 HydrophobicContact CZ3-CE3 4.1Å; W96-W128 AromaticContact CZ3-CH2 3.81Å; W96-W128 HydrophobicContact CZ3-CH2 3.81Å; W96-W128 HydrophobicContact CZ3-CZ2 4.39Å; W96-W128 AromaticContact CZ3-CZ3 3.64Å; W96-W128 HydrophobicContact CZ3-CZ3 3.64Å; W96-F236 AromaticContact CH2-CE1 3.86Å; W96-F236 HydrophobicContact CH2-CE1 3.86Å; W96-F236 HydrophobicContact CH2-CZ 4Å; W96-F236 HydrophobicContact CZ2-CE1 4.18Å; W96-F236 HydrophobicContact CZ2-CZ 4.15Å; W96-L266 HydrophobicContact CD2-CB 4.46Å; W96-L266 HydrophobicContact CD2-CD1 3.84Å; W96-L266 HydrophobicContact CE3-CD1 4.25Å; W96-L266 HydrophobicContact CG-CD1 4.15Å; W96-L266 HydrophobicContact CZ2-CB 3.96Å; W96-L266 HydrophobicContact CZ2-CD1 4.25Å; W96-P267 PolarHBondContact NE1-O 2.99Å
97Q98.5Very high97.9Very high8 Ų819 Ų194%0.03710%0.103CC..Hα-helixtrans-59-43.6176.5-69.5165.2-16.700111.4Q93 Y94 T100 G101 R102 L103 W128 N132Q93-Q97 WeakPolarHBondContact O-CG 3.35Å; Q93-Q97 PolarHBondContact O-N 3.45Å; Y94-Q97 PolarHBondContact O-N 2.86Å; Q97-T100 PolarHBondContact O-OG1 2.68Å; Q97-G101 PolarHBondContact O-N 3.44Å; Q97-R102 HydrophobicContact CB-CB 4.18Å; Q97-R102 WeakPolarHBondContact O-CB 3.26Å; Q97-R102 PolarHBondContact O-N 3.31Å; Q97-L103 HydrophobicContact CB-CD1 4.4Å; Q97-L103 HydrophobicContact CB-CD2 3.69Å; Q97-L103 HydrophobicContact CB-CG 3.82Å; Q97-W128 HydrophobicContact CG-CE3 4.13Å; Q97-N132 PolarHBondContact OE1-ND2 3.47Å
98Y98.1Very high97.6Very high28 Ų2828.5 Ų28.511%0.1114%0.139CC..Hα-helixtrans-60.7-55.5175.9176-105.6000112.4P31 L32 Y57 Y94 G95 W96 T100 G101 L103 H119 M120P31-Y98 HydrophobicContact CB-CD1 3.8Å; P31-Y98 HydrophobicContact CB-CE1 3.97Å; P31-Y98 HydrophobicContact CG-CD1 4.06Å; L32-Y98 HydrophobicContact CD1-CE1 4.28Å; Y57-Y98 HydrophobicContact CD1-CD1 4.49Å; Y57-Y98 AromaticContact CD1-CD2 3.99Å; Y57-Y98 HydrophobicContact CD1-CD2 3.99Å; Y57-Y98 HydrophobicContact CD1-CE1 4.34Å; Y57-Y98 AromaticContact CD1-CE2 3.84Å; Y57-Y98 HydrophobicContact CD1-CE2 3.84Å; Y57-Y98 HydrophobicContact CD1-CG 4.3Å; Y57-Y98 AromaticContact CD1-CZ 3.99Å; Y57-Y98 AromaticContact CD2-CD2 3.45Å; Y57-Y98 HydrophobicContact CD2-CD2 3.45Å; Y57-Y98 VanDerWaalsContact CD2-CD2 3.45Å; Y57-Y98 HydrophobicContact CD2-CE2 4.1Å; Y57-Y98 AromaticContact CD2-CG 3.71Å; Y57-Y98 HydrophobicContact CD2-CG 3.71Å; Y57-Y98 AromaticContact CE1-CD1 3.91Å; Y57-Y98 HydrophobicContact CE1-CD1 3.91Å; Y57-Y98 HydrophobicContact CE1-CD2 4.17Å; Y57-Y98 AromaticContact CE1-CE1 3.94Å; Y57-Y98 HydrophobicContact CE1-CE1 3.94Å; Y57-Y98 HydrophobicContact CE1-CE2 4.22Å; Y57-Y98 HydrophobicContact CE1-CG 4Å; Y57-Y98 HydrophobicContact CE2-CD1 4.03Å; Y57-Y98 AromaticContact CE2-CD2 3.7Å; Y57-Y98 HydrophobicContact CE2-CD2 3.7Å; Y57-Y98 HydrophobicContact CE2-CE2 4.49Å; Y57-Y98 AromaticContact CE2-CG 3.4Å; Y57-Y98 HydrophobicContact CE2-CG 3.4Å; Y57-Y98 AromaticContact CG-CD2 3.61Å; Y57-Y98 HydrophobicContact CG-CD2 3.61Å; Y57-Y98 AromaticContact CG-CE2 3.75Å; Y57-Y98 HydrophobicContact CG-CE2 3.75Å; Y57-Y98 HydrophobicContact CG-CG 4.15Å; Y57-Y98 AromaticContact CZ-CD1 3.63Å; Y57-Y98 AromaticContact CZ-CG 3.52Å; Y94-Y98 PolarHBondContact O-N 3.31Å; G95-Y98 PolarHBondContact O-N 3.02Å; W96-Y98 VanDerWaalsContact C-N 3.3Å; W96-Y98 PolarHBondContact O-N 3.45Å; Y98-T100 PolarHBondContact O-N 3.18Å; Y98-T100 VanDerWaalsContact O-N 3.11Å; Y98-G101 PolarHBondContact O-N 2.93Å; Y98-G101 VanDerWaalsContact O-N 3.1Å; Y98-L103 HydrophobicContact CD2-CD1 4.31Å; Y98-H119 AromaticContact CE2-NE2 3.98Å; Y98-H119 AromaticContact CZ-CD2 3.97Å; Y98-H119 AromaticContact CZ-CE1 3.91Å; Y98-H119 AromaticContact CZ-NE2 3.41Å; Y98-H119 PolarHBondContact OH-CD2 3.06Å; Y98-H119 PolarHBondContact OH-NE2 3.4Å; Y98-M120 VanDerWaalsContact OH-CE 3.27Å; Y98-M120 WeakPolarHBondContact OH-CE 3.37Å
99K96.3Very high97.4Very high172 Ų17236 Ų3675%0.74817%0.174SC*.Hα-helixtrans-60.3-27.8-176.7-176.2177.5177.9-178.10113.1P31 G95 W96P31-K99 HydrophobicContact CG-CB 4.3Å; G95-K99 PolarHBondContact O-N 3.11Å; W96-K99 PolarHBondContact O-N 3.08Å
100T97.6Very high97.3Very high13 Ų1338.3 Ų38.38%0.0819%0.186CC..THydrogen-bonded Turntrans-95.83.9-176.461.30000114W96 Q97 Y98 R102 P268W96-T100 HydrophobicContact CG-CG2 4.38Å; W96-T100 WeakPolarHBondContact O-CB 3.33Å; W96-T100 VanDerWaalsContact O-CG2 3.27Å; W96-T100 WeakPolarHBondContact O-CG2 3.15Å; W96-T100 PolarHBondContact O-N 3.47Å; W96-T100 VanDerWaalsContact O-N 3.08Å; W96-T100 PolarHBondContact O-OG1 3.39Å; Q97-T100 PolarHBondContact O-OG1 2.68Å; Y98-T100 PolarHBondContact O-N 3.18Å; Y98-T100 VanDerWaalsContact O-N 3.11Å; T100-R102 VanDerWaalsContact C-N 3.27Å; T100-R102 PolarHBondContact O-N 2.81Å; T100-R102 PolarHBondContact OG1-NH1 3.06Å; T100-P268 VanDerWaalsContact CG2-C 3.49Å; T100-P268 VanDerWaalsContact CG2-O 3.32Å; T100-P268 WeakPolarHBondContact CG2-O 3.48Å
101G97.7Very high97.1Very high31 Ų3142.7 Ų42.732%0.3221%0.209SC..THydrogen-bonded Turntrans795.6179.300000114.3Q97 Y98 L103 A104Q97-G101 PolarHBondContact O-N 3.44Å; Y98-G101 PolarHBondContact O-N 2.93Å; Y98-G101 VanDerWaalsContact O-N 3.1Å; G101-L103 PolarHBondContact O-N 2.85Å; G101-A104 WeakPolarHBondContact O-CB 3.39Å; G101-A104 PolarHBondContact O-N 3.25Å; G101-A104 VanDerWaalsContact O-N 3.16Å
102R98.5Very high97.1Very high0 Ų043.2 Ų43.20%021%0.213CC..THydrogen-bonded Turntrans-70.3-16.6-177.1-75.3176169.286.48.5113.6W96 Q97 T100 S126 W128 E233 P267 R269 I270W96-R102 VanDerWaalsContact CZ2-CZ 3.5Å; Q97-R102 HydrophobicContact CB-CB 4.18Å; Q97-R102 WeakPolarHBondContact O-CB 3.26Å; Q97-R102 PolarHBondContact O-N 3.31Å; T100-R102 VanDerWaalsContact C-N 3.27Å; T100-R102 PolarHBondContact O-N 2.81Å; T100-R102 PolarHBondContact OG1-NH1 3.06Å; R102-S126 WeakPolarHBondContact O-CB 3.34Å; R102-S126 PolarHBondContact O-OG 2.98Å; R102-W128 HydrophobicContact CB-CB 4.02Å; R102-W128 HydrophobicContact CB-CD2 4.32Å; R102-W128 HydrophobicContact CB-CG 3.72Å; R102-W128 VanDerWaalsContact CD-CE2 3.44Å; R102-W128 HydrophobicContact CG-CD2 4.41Å; R102-W128 HydrophobicContact CG-CG 4.13Å; R102-E233 IonicContact CZ-OE1 3.25Å; R102-E233 VanDerWaalsContact CZ-OE1 3.26Å; R102-E233 IonicContact NE-OE1 3.37Å; R102-E233 PolarHBondContact NE-OE1 2.88Å; R102-E233 IonicContact NH2-OE1 3.82Å; R102-E233 PolarHBondContact NH2-OE1 2.94Å; R102-E233 IonicContact NH2-OE2 2.93Å; R102-E233 PolarHBondContact NH2-OE2 3.19Å; R102-P267 PolarHBondContact NH1-O 2.89Å; R102-R269 PolarHBondContact NH1-O 3.2Å; R102-R269 PolarHBondContact NH2-O 3.26Å; R102-I270 HydrophobicContact CG-CG1 4.01Å
103L98.4Very high97Very high4 Ų443.6 Ų43.62%0.02122%0.218CC..THydrogen-bonded Turntrans-88.4-10.3174.6-58.5-178.1000113.7Y57 Y94 Q97 Y98 G101 V122 S123 A129Y57-L103 HydrophobicContact CD2-CD1 3.93Å; Y57-L103 HydrophobicContact CE2-CD1 4.29Å; Y94-L103 HydrophobicContact CD2-CD1 3.85Å; Y94-L103 HydrophobicContact CD2-CD2 4.15Å; Y94-L103 HydrophobicContact CE2-CD1 3.22Å; Y94-L103 HydrophobicContact CE2-CD2 3.75Å; Y94-L103 HydrophobicContact CE2-CG 4.13Å; Q97-L103 HydrophobicContact CB-CD1 4.4Å; Q97-L103 HydrophobicContact CB-CD2 3.69Å; Q97-L103 HydrophobicContact CB-CG 3.82Å; Y98-L103 HydrophobicContact CD2-CD1 4.31Å; G101-L103 PolarHBondContact O-N 2.85Å; L103-V122 HydrophobicContact CB-CG1 4.33Å; L103-V122 HydrophobicContact CD1-CG2 4.48Å; L103-V122 HydrophobicContact CD2-CG1 4.42Å; L103-S123 PolarHBondContact O-N 3.25Å; L103-A129 HydrophobicContact CD2-CB 4.07Å
104A98.2Very high96.9Very high6 Ų645.4 Ų45.45%0.0522%0.224CC..SBendtrans-75.5168-179.600000111.6G101 P106 C112 Y114G101-A104 WeakPolarHBondContact O-CB 3.39Å; G101-A104 PolarHBondContact O-N 3.25Å; G101-A104 VanDerWaalsContact O-N 3.16Å; A104-P106 WeakPolarHBondContact O-CD 3.33Å; A104-C112 WeakPolarHBondContact CA-O 3.29Å; A104-C112 WeakPolarHBondContact CB-O 3.35Å; A104-Y114 HydrophobicContact CB-CD2 4.38Å; A104-Y114 HydrophobicContact CB-CE1 4.32Å; A104-Y114 HydrophobicContact CB-CE2 4.1Å
105D97.9Very high96.5Very high0 Ų054 Ų540%027%0.265CS..  trans-68.1110175.1174.79000111.5T107 R108 Q109 T110 C112 Y114D105-T107 VanDerWaalsContact C-N 3.25Å; D105-T107 VanDerWaalsContact CG-OG1 3.29Å; D105-T107 PolarHBondContact O-N 3.37Å; D105-T107 WeakPolarHBondContact OD1-CB 3.45Å; D105-T107 PolarHBondContact OD1-N 3.3Å; D105-T107 PolarHBondContact OD1-OG1 2.96Å; D105-T107 PolarHBondContact OD2-OG1 3.41Å; D105-R108 PolarHBondContact O-N 3.24Å; D105-Q109 PolarHBondContact OD2-N 3.28Å; D105-T110 VanDerWaalsContact CB-OG1 3.3Å; D105-T110 WeakPolarHBondContact CB-OG1 3.42Å; D105-T110 WeakPolarHBondContact OD2-CA 3.4Å; D105-T110 WeakPolarHBondContact OD2-CB 3.35Å; D105-T110 PolarHBondContact OD2-N 3.13Å; D105-T110 PolarHBondContact OD2-OG1 2.85Å; D105-C112 HydrophobicContact CB-CB 4.27Å; D105-C112 PolarHBondContact N-O 3.23Å; D105-Y114 HydrophobicContact CB-CE2 4.31Å; D105-Y114 VanDerWaalsContact O-CE2 3.31Å; D105-Y114 WeakPolarHBondContact O-CE2 3.37Å; D105-Y114 PolarHBondContact O-OH 3.33Å
106P97.4Very high96Very high22 Ų2258.6 Ų58.614%0.14330%0.296CS..THydrogen-bonded Turntrans-71.7-20.8-177.931.7-35.6000112.7A104 R108 D125 Y228 Y229A104-P106 WeakPolarHBondContact O-CD 3.33Å; P106-R108 VanDerWaalsContact C-N 3.27Å; P106-R108 PolarHBondContact O-N 3.27Å; P106-D125 HydrophobicContact CG-CB 4.34Å; P106-D125 VanDerWaalsContact CG-O 3.3Å; P106-D125 WeakPolarHBondContact CG-O 3.1Å; P106-Y228 HydrophobicContact CG-CD2 4.25Å; P106-Y228 HydrophobicContact CG-CG 4.32Å; P106-Y229 HydrophobicContact CB-CD1 4.21Å; P106-Y229 HydrophobicContact CB-CE1 3.7Å; P106-Y229 HydrophobicContact CB-CE2 4.14Å; P106-Y229 HydrophobicContact CG-CE1 4.42Å; P106-Y229 HydrophobicContact CG-CE2 4.1Å
107T95.4Very high95.7Very high33 Ų3359.4 Ų59.420%0.20231%0.311CS..THydrogen-bonded Turntrans-76.4-17.4-178.275.70000112.9D105 Q109 D125 Y228D105-T107 VanDerWaalsContact C-N 3.25Å; D105-T107 VanDerWaalsContact CG-OG1 3.29Å; D105-T107 PolarHBondContact O-N 3.37Å; D105-T107 WeakPolarHBondContact OD1-CB 3.45Å; D105-T107 PolarHBondContact OD1-N 3.3Å; D105-T107 PolarHBondContact OD1-OG1 2.96Å; D105-T107 PolarHBondContact OD2-OG1 3.41Å; T107-Q109 PolarHBondContact O-N 3.06Å; T107-Q109 WeakPolarHBondContact OG1-CB 3.3Å; T107-Q109 WeakPolarHBondContact OG1-CG 3.44Å; T107-Q109 PolarHBondContact OG1-N 3.14Å; T107-D125 HydrophobicContact CG2-CB 4.11Å; T107-Y228 HydrophobicContact CG2-CD1 3.72Å; T107-Y228 HydrophobicContact CG2-CD2 4.05Å; T107-Y228 HydrophobicContact CG2-CE1 3.99Å; T107-Y228 HydrophobicContact CG2-CE2 4.3Å; T107-Y228 HydrophobicContact CG2-CG 3.75Å
108R92.6Very high95.5Very high200 Ų20063.2 Ų63.276%0.75533%0.332SS*.SBendtrans56.720.7-171.6-56-174.1173.5-134-1.6114.1D105 P106 T110D105-R108 PolarHBondContact O-N 3.24Å; P106-R108 VanDerWaalsContact C-N 3.27Å; P106-R108 PolarHBondContact O-N 3.27Å; R108-T110 VanDerWaalsContact C-N 3.32Å
109Q94.1Very high95.3Very high163 Ų16365.1 Ų65.176%0.76234%0.341SS*.SBendtrans-78.5-23.3174-65.5179.823.600111.5D105 T107D105-Q109 PolarHBondContact OD2-N 3.28Å; T107-Q109 PolarHBondContact O-N 3.06Å; T107-Q109 WeakPolarHBondContact OG1-CB 3.3Å; T107-Q109 WeakPolarHBondContact OG1-CG 3.44Å; T107-Q109 PolarHBondContact OG1-N 3.14Å
110T94.5Very high95.3Very high64 Ų6459.4 Ų59.439%0.39332%0.318SS..SBendtrans-125.2163.7175.576.20000111.1D105 R108 C112D105-T110 VanDerWaalsContact CB-OG1 3.3Å; D105-T110 WeakPolarHBondContact CB-OG1 3.42Å; D105-T110 WeakPolarHBondContact OD2-CA 3.4Å; D105-T110 WeakPolarHBondContact OD2-CB 3.35Å; D105-T110 PolarHBondContact OD2-N 3.13Å; D105-T110 PolarHBondContact OD2-OG1 2.85Å; R108-T110 VanDerWaalsContact C-N 3.32Å; T110-C112 VanDerWaalsContact C-N 3.29Å; T110-C112 WeakPolarHBondContact OG1-CB 3.34Å; T110-C112 PolarHBondContact OG1-N 3.19Å
111N95.2Very high95.3Very high98 Ų9860.4 Ų60.452%0.52433%0.325SS..  trans-91.818.2173.1-63.3-28.2000112.7G113 Y114N111-G113 PolarHBondContact O-N 3.46Å; N111-Y114 PolarHBondContact O-N 3.2Å
112C97.7Very high95.4Very high12 Ų1259.2 Ų59.28%0.08131%0.311CS..THydrogen-bonded Turntrans-64.4125.2-179.9177.80000111.4A104 D105 T110 Y114 C121 V122 S123A104-C112 WeakPolarHBondContact CA-O 3.29Å; A104-C112 WeakPolarHBondContact CB-O 3.35Å; D105-C112 HydrophobicContact CB-CB 4.27Å; D105-C112 PolarHBondContact N-O 3.23Å; T110-C112 VanDerWaalsContact C-N 3.29Å; T110-C112 WeakPolarHBondContact OG1-CB 3.34Å; T110-C112 PolarHBondContact OG1-N 3.19Å; C112-Y114 WeakPolarHBondContact O-CD2 3.37Å; C112-Y114 PolarHBondContact O-N 3.15Å; C112-C121 HydrophobicContact CB-CB 3.89Å; C112-C121 WeakPolarHBondContact CB-SG 3.48Å; C112-C121 WeakPolarHBondContact SG-CB 3.41Å; C112-C121 CovalentContact SG-SG 2.03Å; C112-C121 PolarHBondContact SG-SG 3.01Å; C112-V122 VanDerWaalsContact SG-C 3.59Å; C112-S123 PolarHBondContact SG-N 3.49Å; C112-S123 VanDerWaalsContact SG-N 3.45Å
113G96.3Very high95.3Very high13 Ų1359.5 Ų59.513%0.13431%0.313CS..THydrogen-bonded Turntrans80.3-5.3179.900000114.7N111 D118 H119 C121N111-G113 PolarHBondContact O-N 3.46Å; G113-D118 WeakPolarHBondContact CA-O 3.45Å; G113-D118 PolarHBondContact N-O 2.59Å; G113-H119 PolarHBondContact O-ND1 3.17Å; G113-H119 VanDerWaalsContact O-ND1 3.12Å; G113-C121 WeakPolarHBondContact CA-O 3.25Å; G113-C121 PolarHBondContact N-O 2.91Å
114Y95.1Very high95.3Very high64 Ų6459.7 Ų59.725%0.25132%0.315SS..SBendtrans-92149.6177.1-64.6-77.3000111.7A104 D105 N111 C112 S116 G117A104-Y114 HydrophobicContact CB-CD2 4.38Å; A104-Y114 HydrophobicContact CB-CE1 4.32Å; A104-Y114 HydrophobicContact CB-CE2 4.1Å; D105-Y114 HydrophobicContact CB-CE2 4.31Å; D105-Y114 VanDerWaalsContact O-CE2 3.31Å; D105-Y114 WeakPolarHBondContact O-CE2 3.37Å; D105-Y114 PolarHBondContact O-OH 3.33Å; N111-Y114 PolarHBondContact O-N 3.2Å; C112-Y114 WeakPolarHBondContact O-CD2 3.37Å; C112-Y114 PolarHBondContact O-N 3.15Å; Y114-S116 PolarHBondContact O-N 3.13Å; Y114-G117 CarbonylContact O-C 3.39Å; Y114-G117 PolarHBondContact O-N 3.01Å
115E90.3Very high95.2Very high181 Ų18160 Ų6085%0.84632%0.316SS*.THydrogen-bonded Turntrans-59.1-30177.3-66.1-179.1173.800113.2G117E115-G117 PolarHBondContact O-N 3.41Å
116S88.6Confident95.2Very high97 Ų9760 Ų6068%0.67832%0.316SS*.THydrogen-bonded Turntrans-75.6-3.6177.6580000114.2Y114Y114-S116 PolarHBondContact O-N 3.13Å
117G91.6Very high95.2Very high38 Ų3859.1 Ų59.139%0.39231%0.309SS..SBendtrans-137.5-138.7179.300000112Y114 E115 H119Y114-G117 CarbonylContact O-C 3.39Å; Y114-G117 PolarHBondContact O-N 3.01Å; E115-G117 PolarHBondContact O-N 3.41Å; G117-H119 PolarHBondContact O-N 3.44Å
118D93.3Very high95.4Very high89 Ų8957.7 Ų57.748%0.47630%0.3SS..  trans-83.796.3173.1-1780.1000109.6G113 M120 C121G113-D118 WeakPolarHBondContact CA-O 3.45Å; G113-D118 PolarHBondContact N-O 2.59Å; D118-M120 PolarHBondContact O-N 3.4Å; D118-M120 WeakPolarHBondContact OD1-CA 3.3Å; D118-M120 PolarHBondContact OD1-N 3.01Å; D118-C121 HydrophobicContact CB-CB 3.83Å; D118-C121 VanDerWaalsContact O-CB 3.24Å; D118-C121 WeakPolarHBondContact O-CB 3.31Å; D118-C121 PolarHBondContact O-N 2.98Å; D118-C121 VanDerWaalsContact O-N 3.11Å; D118-C121 PolarHBondContact OD1-N 2.9Å
119H94.3Very high95.6Very high68 Ų6848.2 Ų48.232%0.31526%0.264SS..THydrogen-bonded Turntrans-65.7-17.1178.7-175.149.8000113.6Y98 G113 G117Y98-H119 AromaticContact CE2-NE2 3.98Å; Y98-H119 AromaticContact CZ-CD2 3.97Å; Y98-H119 AromaticContact CZ-CE1 3.91Å; Y98-H119 AromaticContact CZ-NE2 3.41Å; Y98-H119 PolarHBondContact OH-CD2 3.06Å; Y98-H119 PolarHBondContact OH-NE2 3.4Å; G113-H119 PolarHBondContact O-ND1 3.17Å; G113-H119 VanDerWaalsContact O-ND1 3.12Å; G117-H119 PolarHBondContact O-N 3.44Å
120M96.8Very high95.8Very high52 Ų5240.8 Ų40.826%0.25623%0.23SC..THydrogen-bonded Turntrans-90-11.5175.4-60.3-58.8145.200112.7L32 V56 Y57 L58 Y98 D118L32-M120 HydrophobicContact CD1-CE 3.6Å; L32-M120 HydrophobicContact CD1-SD 3.86Å; V56-M120 HydrophobicContact CG1-CB 4.38Å; Y57-M120 WeakPolarHBondContact CB-O 3.49Å; Y57-M120 HydrophobicContact CD1-SD 4.15Å; Y57-M120 PolarHBondContact N-O 3.39Å; L58-M120 HydrophobicContact CD1-SD 4.49Å; L58-M120 HydrophobicContact CG-SD 4.17Å; Y98-M120 VanDerWaalsContact OH-CE 3.27Å; Y98-M120 WeakPolarHBondContact OH-CE 3.37Å; D118-M120 PolarHBondContact O-N 3.4Å; D118-M120 WeakPolarHBondContact OD1-CA 3.3Å; D118-M120 PolarHBondContact OD1-N 3.01Å
121C98Very high95.9Very high34 Ų3438.1 Ų38.123%0.2321%0.213CC..BIsolated β-bridgetrans-64.6134.6176.6178.70000111C112 G113 D118C112-C121 HydrophobicContact CB-CB 3.89Å; C112-C121 WeakPolarHBondContact CB-SG 3.48Å; C112-C121 WeakPolarHBondContact SG-CB 3.41Å; C112-C121 CovalentContact SG-SG 2.03Å; C112-C121 PolarHBondContact SG-SG 3.01Å; G113-C121 WeakPolarHBondContact CA-O 3.25Å; G113-C121 PolarHBondContact N-O 2.91Å; D118-C121 HydrophobicContact CB-CB 3.83Å; D118-C121 VanDerWaalsContact O-CB 3.24Å; D118-C121 WeakPolarHBondContact O-CB 3.31Å; D118-C121 PolarHBondContact O-N 2.98Å; D118-C121 VanDerWaalsContact O-N 3.11Å; D118-C121 PolarHBondContact OD1-N 2.9Å
122V98.4Very high96.1Very high5 Ų533.6 Ų33.63%0.0319%0.189CC..  trans-108.2118.2174.6179.80000107.8W55 Y94 L103 C112 A129W55-V122 HydrophobicContact CE3-CG1 4.33Å; W55-V122 WeakPolarHBondContact O-CB 3.13Å; W55-V122 PolarHBondContact O-N 3.39Å; Y94-V122 WeakPolarHBondContact OH-CG2 3.5Å; L103-V122 HydrophobicContact CB-CG1 4.33Å; L103-V122 HydrophobicContact CD1-CG2 4.48Å; L103-V122 HydrophobicContact CD2-CG1 4.42Å; C112-V122 VanDerWaalsContact SG-C 3.59Å; V122-A129 HydrophobicContact CG1-CB 3.48Å; V122-A129 VanDerWaalsContact CG1-CB 3.48Å
123S97.9Very high96.1Very high6 Ų633 Ų334%0.04219%0.185CC..  trans-78.6132.5-172.6-1760000112.3L103 C112 D125 S126 A129L103-S123 PolarHBondContact O-N 3.25Å; C112-S123 PolarHBondContact SG-N 3.49Å; C112-S123 VanDerWaalsContact SG-N 3.45Å; S123-D125 PolarHBondContact O-N 2.94Å; S123-D125 PolarHBondContact OG-N 3.25Å; S123-D125 VanDerWaalsContact OG-N 3.08Å; S123-S126 WeakPolarHBondContact O-CB 3.08Å; S123-S126 PolarHBondContact O-N 3.45Å; S123-S126 VanDerWaalsContact O-N 3.15Å; S123-A129 WeakPolarHBondContact O-CB 3.41Å
124V96.9Very high96.2Very high9 Ų932.5 Ų32.56%0.05518%0.179CC..THydrogen-bonded Turntrans-76.7-0.5169.670.20000113.1W55 P161 K163 N164 F168W55-V124 HydrophobicContact CE3-CB 4.29Å; W55-V124 HydrophobicContact CH2-CB 4.19Å; W55-V124 HydrophobicContact CH2-CG2 3.87Å; W55-V124 HydrophobicContact CZ2-CG2 4.46Å; W55-V124 HydrophobicContact CZ3-CB 3.86Å; W55-V124 HydrophobicContact CZ3-CG2 4.07Å; V124-P161 HydrophobicContact CB-CB 3.88Å; V124-P161 HydrophobicContact CG1-CB 4.26Å; V124-P161 HydrophobicContact CG2-CB 3.71Å; V124-P161 HydrophobicContact CG2-CG 3.86Å; V124-K163 HydrophobicContact CG1-CD 4.06Å; V124-K163 VanDerWaalsContact CG1-CE 3.49Å; V124-K163 HydrophobicContact CG1-CG 3.37Å; V124-N164 HydrophobicContact CG2-CB 4.39Å; V124-F168 HydrophobicContact CG2-CE2 3.82Å; V124-F168 HydrophobicContact CG2-CZ 3.86Å
125D96.8Very high96.4Very high12 Ų1230.2 Ų30.26%0.06417%0.172CC..THydrogen-bonded Turntrans-92.1-8.6166-65.5-49.9000112.1P106 T107 S123 W127 K163 Y228P106-D125 HydrophobicContact CG-CB 4.34Å; P106-D125 VanDerWaalsContact CG-O 3.3Å; P106-D125 WeakPolarHBondContact CG-O 3.1Å; T107-D125 HydrophobicContact CG2-CB 4.11Å; S123-D125 PolarHBondContact O-N 2.94Å; S123-D125 PolarHBondContact OG-N 3.25Å; S123-D125 VanDerWaalsContact OG-N 3.08Å; D125-W127 PolarHBondContact O-N 3.41Å; D125-K163 WeakPolarHBondContact OD1-CE 3.45Å; D125-K163 IonicContact OD1-NZ 3.86Å; D125-K163 PolarHBondContact OD1-NZ 3.41Å; D125-K163 VanDerWaalsContact OD2-CE 3.26Å; D125-K163 WeakPolarHBondContact OD2-CE 3.31Å; D125-K163 IonicContact OD2-NZ 2.71Å; D125-K163 PolarHBondContact OD2-NZ 3.32Å; D125-Y228 HydrophobicContact CB-CD2 4.33Å; D125-Y228 HydrophobicContact CB-CE2 4.23Å; D125-Y228 WeakPolarHBondContact O-CD2 3.19Å
126S98.1Very high96.8Very high0 Ų021.7 Ų21.70%013%0.132CC..  trans-82.9116.3176.5165.10000110.8R102 S123 W128 A129 D130 Y229R102-S126 WeakPolarHBondContact O-CB 3.34Å; R102-S126 PolarHBondContact O-OG 2.98Å; S123-S126 WeakPolarHBondContact O-CB 3.08Å; S123-S126 PolarHBondContact O-N 3.45Å; S123-S126 VanDerWaalsContact O-N 3.15Å; S126-W128 PolarHBondContact O-N 3.02Å; S126-W128 PolarHBondContact OG-N 3.21Å; S126-A129 WeakPolarHBondContact O-CB 3.44Å; S126-A129 PolarHBondContact O-N 2.84Å; S126-A129 PolarHBondContact OG-N 3.24Å; S126-D130 PolarHBondContact O-N 3.25Å; S126-Y229 WeakPolarHBondContact CA-OH 3.48Å; S126-Y229 PolarHBondContact OG-OH 3.4Å
127W97.9Very high97.3Very high3 Ų317.1 Ų17.11%0.01110%0.1CC..Hα-helixtrans-50.2-43.1168.7-179.187.5000112.9D125 A129 D130 L131 F222 Y226 Y229 E237 V241D125-W127 PolarHBondContact O-N 3.41Å; W127-A129 PolarHBondContact O-N 3.11Å; W127-D130 PolarHBondContact O-N 3.38Å; W127-L131 HydrophobicContact CD2-CD1 4.1Å; W127-L131 HydrophobicContact CD2-CG 4.45Å; W127-L131 VanDerWaalsContact CE2-CD1 3.42Å; W127-L131 HydrophobicContact CE3-CD1 4.4Å; W127-L131 HydrophobicContact CH2-CD1 3.49Å; W127-L131 VanDerWaalsContact CH2-CD1 3.49Å; W127-L131 HydrophobicContact CZ2-CD1 3.11Å; W127-L131 HydrophobicContact CZ2-CG 4.23Å; W127-L131 HydrophobicContact CZ3-CD1 4.12Å; W127-L131 PolarHBondContact O-N 2.03Å; W127-L131 VanDerWaalsContact O-N 3.1Å; W127-F222 VanDerWaalsContact CD1-O 3.23Å; W127-Y226 AromaticContact CD1-CE1 3.88Å; W127-Y226 AromaticContact CD2-CE1 4Å; W127-Y226 HydrophobicContact CD2-CE1 4Å; W127-Y226 AromaticContact CE2-CE1 3.44Å; W127-Y226 VanDerWaalsContact CE2-CE1 3.44Å; W127-Y226 AromaticContact CE2-CZ 3.71Å; W127-Y226 HydrophobicContact CG-CD1 4.44Å; W127-Y226 HydrophobicContact CG-CE1 4.23Å; W127-Y226 AromaticContact CZ2-CE1 3.77Å; W127-Y226 HydrophobicContact CZ2-CE1 3.77Å; W127-Y226 AromaticContact CZ2-CZ 3.89Å; W127-Y226 VanDerWaalsContact CZ2-OH 3.29Å; W127-Y226 WeakPolarHBondContact CZ2-OH 3.26Å; W127-Y226 AromaticContact NE1-CE1 3.39Å; W127-Y226 AromaticContact NE1-CZ 3.38Å; W127-Y226 PolarHBondContact NE1-OH 3.12Å; W127-Y229 HydrophobicContact CB-CE2 3.84Å; W127-E237 HydrophobicContact CD2-CB 4.35Å; W127-E237 HydrophobicContact CD2-CG 4.36Å; W127-E237 HydrophobicContact CE3-CB 3.87Å; W127-E237 HydrophobicContact CE3-CG 3.63Å; W127-E237 HydrophobicContact CH2-CB 3.77Å; W127-E237 HydrophobicContact CH2-CG 4.36Å; W127-E237 HydrophobicContact CZ2-CB 4.23Å; W127-E237 HydrophobicContact CZ3-CB 3.59Å; W127-E237 HydrophobicContact CZ3-CG 3.66Å; W127-V241 HydrophobicContact CH2-CG2 3.71Å; W127-V241 HydrophobicContact CZ2-CG2 3.84Å
128W98.4Very high97.6Very high4 Ų415.3 Ų15.32%0.0158%0.081CC..Hα-helixtrans-63.1-42.2177.3-70.798.4000112.3W96 Q97 R102 S126 N132 E233 F236 E237 W240W96-W128 AromaticContact CH2-CH2 3.65Å; W96-W128 HydrophobicContact CH2-CH2 3.65Å; W96-W128 AromaticContact CH2-CZ2 3.99Å; W96-W128 HydrophobicContact CH2-CZ2 3.99Å; W96-W128 HydrophobicContact CH2-CZ3 4.01Å; W96-W128 HydrophobicContact CZ3-CE3 4.1Å; W96-W128 AromaticContact CZ3-CH2 3.81Å; W96-W128 HydrophobicContact CZ3-CH2 3.81Å; W96-W128 HydrophobicContact CZ3-CZ2 4.39Å; W96-W128 AromaticContact CZ3-CZ3 3.64Å; W96-W128 HydrophobicContact CZ3-CZ3 3.64Å; Q97-W128 HydrophobicContact CG-CE3 4.13Å; R102-W128 HydrophobicContact CB-CB 4.02Å; R102-W128 HydrophobicContact CB-CD2 4.32Å; R102-W128 HydrophobicContact CB-CG 3.72Å; R102-W128 VanDerWaalsContact CD-CE2 3.44Å; R102-W128 HydrophobicContact CG-CD2 4.41Å; R102-W128 HydrophobicContact CG-CG 4.13Å; S126-W128 PolarHBondContact O-N 3.02Å; S126-W128 PolarHBondContact OG-N 3.21Å; W128-N132 WeakPolarHBondContact O-CB 3.33Å; W128-N132 PolarHBondContact O-N 3.45Å; W128-E233 PolarHBondContact NE1-OE1 3.41Å; W128-F236 HydrophobicContact CH2-CD1 4.41Å; W128-F236 AromaticContact CH2-CE1 3.78Å; W128-F236 HydrophobicContact CH2-CE1 3.78Å; W128-F236 HydrophobicContact CH2-CZ 4.3Å; W128-F236 AromaticContact CZ2-CD1 3.86Å; W128-F236 HydrophobicContact CZ2-CD1 3.86Å; W128-F236 AromaticContact CZ2-CE1 3.53Å; W128-F236 HydrophobicContact CZ2-CE1 3.53Å; W128-F236 HydrophobicContact CZ2-CZ 4.47Å; W128-E237 VanDerWaalsContact CD1-OE1 3.26Å; W128-E237 HydrophobicContact CZ2-CB 4.47Å; W128-E237 HydrophobicContact CZ2-CG 3.59Å; W128-E237 PolarHBondContact NE1-OE1 2.91Å; W128-W240 HydrophobicContact CH2-CB 4.14Å; W128-W240 AromaticContact CH2-CD1 3.62Å; W128-W240 AromaticContact CH2-CG 3.83Å; W128-W240 HydrophobicContact CH2-CG 3.83Å; W128-W240 AromaticContact CZ3-CD1 3.47Å; W128-W240 VanDerWaalsContact CZ3-CD1 3.47Å; W128-W240 HydrophobicContact CZ3-CG 4.14Å; W128-W240 AromaticContact CZ3-NE1 3.82Å
129A98.1Very high97.9Very high0 Ų011.1 Ų11.10%06%0.059CC..Hα-helixtrans-67.3-39.1178.800000112R60 L103 V122 S123 S126 W127 Y133R60-A129 PolarHBondContact NH1-O 3.48Å; L103-A129 HydrophobicContact CD2-CB 4.07Å; V122-A129 HydrophobicContact CG1-CB 3.48Å; V122-A129 VanDerWaalsContact CG1-CB 3.48Å; S123-A129 WeakPolarHBondContact O-CB 3.41Å; S126-A129 WeakPolarHBondContact O-CB 3.44Å; S126-A129 PolarHBondContact O-N 2.84Å; S126-A129 PolarHBondContact OG-N 3.24Å; W127-A129 PolarHBondContact O-N 3.11Å; A129-Y133 PolarHBondContact O-N 3.36Å
130D97.5Very high98.1Very high8 Ų88 Ų84%0.0434%0.044CC..Hα-helixtrans-67.9-47.2-179.7-73.9-20.7000111.9S126 W127 N132 Y133 F134 F168 F222S126-D130 PolarHBondContact O-N 3.25Å; W127-D130 PolarHBondContact O-N 3.38Å; D130-N132 VanDerWaalsContact C-N 3.35Å; D130-N132 PolarHBondContact O-N 3.3Å; D130-Y133 VanDerWaalsContact O-CB 3.26Å; D130-Y133 WeakPolarHBondContact O-CB 3.24Å; D130-Y133 PolarHBondContact O-N 2.87Å; D130-F134 VanDerWaalsContact O-CD2 3.27Å; D130-F134 WeakPolarHBondContact O-CD2 3.06Å; D130-F168 WeakPolarHBondContact OD1-CZ 3.04Å; D130-F222 HydrophobicContact CB-CD1 3.5Å; D130-F222 HydrophobicContact CB-CD2 4.36Å; D130-F222 HydrophobicContact CB-CE1 3.66Å; D130-F222 HydrophobicContact CB-CG 3.89Å; D130-F222 HydrophobicContact CB-CZ 4.19Å; D130-F222 WeakPolarHBondContact OD2-CD1 3.47Å; D130-F222 WeakPolarHBondContact OD2-CE1 3.4Å
131L97.6Very high98.2Very high7 Ų75.5 Ų5.54%0.0373%0.032CC..Hα-helixtrans-68.1-37.9175.5-63.9-167.9000112.2W127 Y133 F134 L135 L215 I219 F222W127-L131 HydrophobicContact CD2-CD1 4.1Å; W127-L131 HydrophobicContact CD2-CG 4.45Å; W127-L131 VanDerWaalsContact CE2-CD1 3.42Å; W127-L131 HydrophobicContact CE3-CD1 4.4Å; W127-L131 HydrophobicContact CH2-CD1 3.49Å; W127-L131 VanDerWaalsContact CH2-CD1 3.49Å; W127-L131 HydrophobicContact CZ2-CD1 3.11Å; W127-L131 HydrophobicContact CZ2-CG 4.23Å; W127-L131 HydrophobicContact CZ3-CD1 4.12Å; W127-L131 PolarHBondContact O-N 2.03Å; W127-L131 VanDerWaalsContact O-N 3.1Å; L131-Y133 PolarHBondContact O-N 2.79Å; L131-F134 PolarHBondContact O-N 2.69Å; L131-L135 PolarHBondContact O-N 3.06Å; L131-L215 HydrophobicContact CD1-CD2 4.38Å; L131-I219 HydrophobicContact CD1-CG1 3.73Å; L131-I219 HydrophobicContact CD2-CG1 4Å; L131-F222 HydrophobicContact CD2-CD2 4.1Å
132N98.3Very high98.2Very high3 Ų33.9 Ų3.92%0.0162%0.021CC..Hα-helixtrans-65-30.7175.2-179.1-89.7000112R60 Y64 Y94 Q97 W128 D130 F134 L135 S136R60-N132 VanDerWaalsContact CD-OD1 3.27Å; R60-N132 WeakPolarHBondContact CD-OD1 3.15Å; R60-N132 PolarHBondContact NH1-OD1 3.23Å; Y64-N132 PolarHBondContact OH-ND2 2.86Å; Y64-N132 VanDerWaalsContact OH-ND2 3.12Å; Y64-N132 PolarHBondContact OH-OD1 3.37Å; Y94-N132 HydrophobicContact CD2-CB 4.42Å; Y94-N132 WeakPolarHBondContact CD2-OD1 3.3Å; Y94-N132 WeakPolarHBondContact CE2-OD1 3.26Å; Q97-N132 PolarHBondContact OE1-ND2 3.47Å; W128-N132 WeakPolarHBondContact O-CB 3.33Å; W128-N132 PolarHBondContact O-N 3.45Å; D130-N132 VanDerWaalsContact C-N 3.35Å; D130-N132 PolarHBondContact O-N 3.3Å; N132-F134 VanDerWaalsContact C-N 3.28Å; N132-F134 PolarHBondContact O-N 2.74Å; N132-L135 CarbonylContact O-C 3.55Å; N132-L135 PolarHBondContact O-N 3.03Å; N132-S136 WeakPolarHBondContact O-CB 3.21Å; N132-S136 PolarHBondContact O-N 3.36Å
133Y98.7Very high98.2Very high0 Ų03.6 Ų3.60%02%0.02CC..Hα-helixtrans-53-49.8174.3175.2-83.6000110.2P54 W55 A129 D130 L131 S136 S137 F168 C169 Y170P54-Y133 HydrophobicContact CB-CD2 4.07Å; P54-Y133 HydrophobicContact CB-CE2 3.98Å; P54-Y133 HydrophobicContact CG-CD2 3.99Å; P54-Y133 HydrophobicContact CG-CE2 3.43Å; P54-Y133 VanDerWaalsContact CG-CE2 3.43Å; W55-Y133 AromaticContact CE2-CD2 3.99Å; W55-Y133 HydrophobicContact CH2-CD2 4.01Å; W55-Y133 HydrophobicContact CH2-CG 4.43Å; W55-Y133 AromaticContact CZ2-CD2 3.52Å; W55-Y133 HydrophobicContact CZ2-CD2 3.52Å; W55-Y133 AromaticContact CZ2-CE2 3.82Å; W55-Y133 HydrophobicContact CZ2-CE2 3.82Å; W55-Y133 HydrophobicContact CZ2-CG 4.26Å; A129-Y133 PolarHBondContact O-N 3.36Å; D130-Y133 VanDerWaalsContact O-CB 3.26Å; D130-Y133 WeakPolarHBondContact O-CB 3.24Å; D130-Y133 PolarHBondContact O-N 2.87Å; L131-Y133 PolarHBondContact O-N 2.79Å; Y133-S136 CarbonylContact O-C 3.51Å; Y133-S136 WeakPolarHBondContact O-CB 3.47Å; Y133-S136 PolarHBondContact O-N 2.69Å; Y133-S137 WeakPolarHBondContact CD1-OG 3.29Å; Y133-S137 VanDerWaalsContact CE1-OG 3.26Å; Y133-S137 WeakPolarHBondContact CE1-OG 3.26Å; Y133-S137 WeakPolarHBondContact O-CB 3.49Å; Y133-S137 PolarHBondContact O-N 3.11Å; Y133-S137 PolarHBondContact O-OG 2.58Å; Y133-F168 AromaticContact CD1-CD1 3.5Å; Y133-F168 HydrophobicContact CD1-CD1 3.5Å; Y133-F168 HydrophobicContact CD1-CE1 4.19Å; Y133-F168 HydrophobicContact CD1-CG 4.4Å; Y133-F168 HydrophobicContact CD2-CD1 4.33Å; Y133-F168 HydrophobicContact CE1-CB 3.85Å; Y133-F168 AromaticContact CE1-CD1 3.72Å; Y133-F168 HydrophobicContact CE1-CD1 3.72Å; Y133-F168 HydrophobicContact CE1-CG 4.2Å; Y133-F168 HydrophobicContact CE2-CD1 4.46Å; Y133-F168 AromaticContact CG-CD1 3.86Å; Y133-F168 HydrophobicContact CG-CD1 3.86Å; Y133-F168 HydrophobicContact CG-CE1 4.18Å; Y133-C169 PolarHBondContact OH-O 3.02Å; Y133-Y170 VanDerWaalsContact OH-CD1 3.3Å; Y133-Y170 WeakPolarHBondContact OH-CD1 3.3Å; Y133-Y170 WeakPolarHBondContact OH-CE1 3.49Å
134F98.7Very high98.2Very high2 Ų23.5 Ų3.51%0.0092%0.018CC..Hα-helixtrans-70.8-34.6-179.8-66.3-79.8000112.9D130 L131 N132 S136 L138 P139 F168 F179 T214 T218 F222D130-F134 VanDerWaalsContact O-CD2 3.27Å; D130-F134 WeakPolarHBondContact O-CD2 3.06Å; L131-F134 PolarHBondContact O-N 2.69Å; N132-F134 VanDerWaalsContact C-N 3.28Å; N132-F134 PolarHBondContact O-N 2.74Å; F134-S136 PolarHBondContact O-N 3.38Å; F134-L138 HydrophobicContact CB-CD1 4.23Å; F134-L138 HydrophobicContact CB-CG 4.38Å; F134-L138 HydrophobicContact CD1-CD1 4.23Å; F134-L138 HydrophobicContact CD1-CG 4.26Å; F134-L138 WeakPolarHBondContact O-CB 3.44Å; F134-L138 WeakPolarHBondContact O-CG 3.29Å; F134-L138 PolarHBondContact O-N 3.21Å; F134-L138 VanDerWaalsContact O-N 3.14Å; F134-P139 VanDerWaalsContact O-CD 3.31Å; F134-P139 WeakPolarHBondContact O-CD 3.32Å; F134-F168 AromaticContact CE2-CD1 3.72Å; F134-F168 HydrophobicContact CE2-CD1 3.72Å; F134-F168 AromaticContact CE2-CE1 3.9Å; F134-F168 HydrophobicContact CE2-CE1 3.9Å; F134-F168 AromaticContact CZ-CD1 3.61Å; F134-F168 HydrophobicContact CZ-CD1 3.61Å; F134-F168 HydrophobicContact CZ-CE1 4.23Å; F134-F168 HydrophobicContact CZ-CG 4.41Å; F134-F179 HydrophobicContact CD1-CE2 4.09Å; F134-F179 HydrophobicContact CD1-CZ 4.14Å; F134-F179 AromaticContact CE1-CE2 3.53Å; F134-F179 HydrophobicContact CE1-CE2 3.53Å; F134-F179 AromaticContact CE1-CZ 3.55Å; F134-F179 HydrophobicContact CE1-CZ 3.55Å; F134-F179 HydrophobicContact CZ-CE2 4.49Å; F134-F179 HydrophobicContact CZ-CZ 4.19Å; F134-T214 HydrophobicContact CB-CG2 3.74Å; F134-T218 HydrophobicContact CB-CG2 3.82Å; F134-T218 HydrophobicContact CD1-CG2 3.75Å; F134-T218 HydrophobicContact CD2-CG2 3.6Å; F134-T218 HydrophobicContact CE1-CG2 4.21Å; F134-T218 HydrophobicContact CE2-CG2 4.1Å; F134-T218 HydrophobicContact CG-CG2 3.42Å; F134-T218 VanDerWaalsContact CG-CG2 3.42Å; F134-T218 HydrophobicContact CZ-CG2 4.37Å; F134-F222 HydrophobicContact CD2-CE2 4.23Å; F134-F222 AromaticContact CE2-CE2 3.41Å; F134-F222 HydrophobicContact CE2-CE2 3.41Å; F134-F222 VanDerWaalsContact CE2-CE2 3.41Å; F134-F222 AromaticContact CE2-CZ 3.64Å; F134-F222 HydrophobicContact CE2-CZ 3.64Å; F134-F222 HydrophobicContact CZ-CE2 4.16Å; F134-F222 HydrophobicContact CZ-CZ 4.23Å
135L98.4Very high98.2Very high17 Ų174.4 Ų4.49%0.0892%0.023CC..Hα-helixtrans-70.8-3.6170.7-68172.6000113.4Y64 L90 L131 N132 P139 T214 L215Y64-L135 WeakPolarHBondContact CE1-O 3.31Å; Y64-L135 PolarHBondContact OH-O 3.03Å; L90-L135 HydrophobicContact CD2-CB 4.37Å; L131-L135 PolarHBondContact O-N 3.06Å; N132-L135 CarbonylContact O-C 3.55Å; N132-L135 PolarHBondContact O-N 3.03Å; L135-P139 WeakPolarHBondContact O-CG 3.27Å; L135-T214 HydrophobicContact CD2-CG2 3.72Å; L135-T214 HydrophobicContact CG-CG2 4.13Å; L135-L215 HydrophobicContact CD1-CD2 4.01Å; L135-L215 HydrophobicContact CG-CD2 4.47Å
136S98.6Very high98.2Very high2 Ų25 Ų51%0.0143%0.028CC..Hα-helixtrans-105.3-55.7171-170.20000111.3R60 Y64 N132 Y133 F134 P139 F140R60-S136 WeakPolarHBondContact CG-OG 3.46Å; Y64-S136 WeakPolarHBondContact OH-CA 3.34Å; Y64-S136 VanDerWaalsContact OH-CB 3.25Å; Y64-S136 WeakPolarHBondContact OH-CB 3.4Å; Y64-S136 PolarHBondContact OH-N 2.92Å; N132-S136 WeakPolarHBondContact O-CB 3.21Å; N132-S136 PolarHBondContact O-N 3.36Å; Y133-S136 CarbonylContact O-C 3.51Å; Y133-S136 WeakPolarHBondContact O-CB 3.47Å; Y133-S136 PolarHBondContact O-N 2.69Å; F134-S136 PolarHBondContact O-N 3.38Å; S136-P139 WeakPolarHBondContact O-CD 3.39Å; S136-P139 WeakPolarHBondContact O-CG 3.4Å; S136-F140 WeakPolarHBondContact O-CB 3.41Å; S136-F140 PolarHBondContact O-N 3.1Å
137S98.6Very high98Very high1 Ų17 Ų71%0.0075%0.048CC..Hα-helixtrans-68.6-48-172.359.70000112.7Y133 F140 L141 L158Y133-S137 WeakPolarHBondContact CD1-OG 3.29Å; Y133-S137 VanDerWaalsContact CE1-OG 3.26Å; Y133-S137 WeakPolarHBondContact CE1-OG 3.26Å; Y133-S137 WeakPolarHBondContact O-CB 3.49Å; Y133-S137 PolarHBondContact O-N 3.11Å; Y133-S137 PolarHBondContact O-OG 2.58Å; S137-F140 PolarHBondContact O-N 2.83Å; S137-L141 VanDerWaalsContact O-CB 3.28Å; S137-L141 WeakPolarHBondContact O-CB 3.01Å; S137-L141 VanDerWaalsContact O-CG 3.29Å; S137-L141 WeakPolarHBondContact O-CG 3.32Å; S137-L141 PolarHBondContact O-N 3.2Å; S137-L158 VanDerWaalsContact CB-CD1 3.44Å
138L98.8Very high97.9Very high0 Ų06.9 Ų6.90%05%0.048CC..Hα-helixtrans-63.7-50.6-178.5-58-175.5000112.8F134 F140 A142 C175 F179 T182 M183 T214F134-L138 HydrophobicContact CB-CD1 4.23Å; F134-L138 HydrophobicContact CB-CG 4.38Å; F134-L138 HydrophobicContact CD1-CD1 4.23Å; F134-L138 HydrophobicContact CD1-CG 4.26Å; F134-L138 WeakPolarHBondContact O-CB 3.44Å; F134-L138 WeakPolarHBondContact O-CG 3.29Å; F134-L138 PolarHBondContact O-N 3.21Å; F134-L138 VanDerWaalsContact O-N 3.14Å; L138-F140 VanDerWaalsContact C-N 3.31Å; L138-F140 PolarHBondContact O-N 2.89Å; L138-A142 WeakPolarHBondContact O-CB 3.46Å; L138-A142 PolarHBondContact O-N 3.37Å; L138-C175 HydrophobicContact CD2-CB 3.93Å; L138-F179 HydrophobicContact CD1-CB 4.41Å; L138-F179 HydrophobicContact CD1-CG 4.37Å; L138-F179 HydrophobicContact CD2-CB 4.44Å; L138-F179 HydrophobicContact CD2-CD2 4.08Å; L138-F179 HydrophobicContact CD2-CG 4.47Å; L138-T182 HydrophobicContact CD1-CG2 3.62Å; L138-M183 HydrophobicContact CB-SD 4.35Å; L138-M183 HydrophobicContact CD2-SD 3.96Å; L138-T214 HydrophobicContact CD1-CG2 3.87Å
139P98.7Very high97.7Very high0 Ų07.1 Ų7.10%05%0.05CC..Hα-helixtrans-63-37.1176.219.4-28.3000112.6L67 L90 F134 L135 S136 A143 W186 Y190L67-P139 HydrophobicContact CD2-CB 4.27Å; L90-P139 HydrophobicContact CD1-CB 4.29Å; L90-P139 HydrophobicContact CD1-CG 4.05Å; F134-P139 VanDerWaalsContact O-CD 3.31Å; F134-P139 WeakPolarHBondContact O-CD 3.32Å; L135-P139 WeakPolarHBondContact O-CG 3.27Å; S136-P139 WeakPolarHBondContact O-CD 3.39Å; S136-P139 WeakPolarHBondContact O-CG 3.4Å; P139-A143 WeakPolarHBondContact O-CB 3.28Å; P139-A143 PolarHBondContact O-N 2.77Å; P139-W186 HydrophobicContact CB-CD2 3.83Å; P139-W186 HydrophobicContact CB-CE3 3.81Å; P139-W186 HydrophobicContact CB-CH2 3.79Å; P139-W186 HydrophobicContact CB-CZ2 3.8Å; P139-W186 HydrophobicContact CB-CZ3 3.79Å; P139-W186 HydrophobicContact CG-CH2 4.3Å; P139-W186 HydrophobicContact CG-CZ2 4.02Å; P139-Y190 VanDerWaalsContact O-CE2 3.3Å; P139-Y190 WeakPolarHBondContact O-CE2 3.34Å; P139-Y190 PolarHBondContact O-OH 3.07Å
140F98.8Very high97.6Very high2 Ų210.4 Ų10.41%0.0098%0.084CC..Hα-helixtrans-67.6-50179.1-179-91.2000112.1L40 I52 M63 I66 S136 S137 L138 A142 A143 V144 M149 V156L40-F140 HydrophobicContact CD2-CZ 3.93Å; I52-F140 HydrophobicContact CD1-CE1 3.92Å; I52-F140 HydrophobicContact CD1-CZ 3.73Å; M63-F140 HydrophobicContact CB-CD2 3.79Å; M63-F140 HydrophobicContact CB-CE2 4.17Å; M63-F140 HydrophobicContact CB-CG 4.22Å; M63-F140 HydrophobicContact CE-CB 3.69Å; M63-F140 HydrophobicContact CE-CD1 3.81Å; M63-F140 HydrophobicContact CE-CD2 4.4Å; M63-F140 HydrophobicContact CE-CG 3.71Å; M63-F140 HydrophobicContact CG-CD2 4.31Å; M63-F140 HydrophobicContact CG-CE2 4.4Å; M63-F140 WeakPolarHBondContact O-CD2 3.31Å; I66-F140 HydrophobicContact CB-CE2 4.43Å; I66-F140 HydrophobicContact CG2-CE2 4.26Å; S136-F140 WeakPolarHBondContact O-CB 3.41Å; S136-F140 PolarHBondContact O-N 3.1Å; S137-F140 PolarHBondContact O-N 2.83Å; L138-F140 VanDerWaalsContact C-N 3.31Å; L138-F140 PolarHBondContact O-N 2.89Å; F140-A142 VanDerWaalsContact C-N 3.34Å; F140-A142 PolarHBondContact O-N 2.04Å; F140-A143 WeakPolarHBondContact O-CB 3.41Å; F140-A143 PolarHBondContact O-N 3.39Å; F140-A143 VanDerWaalsContact O-N 3.08Å; F140-V144 HydrophobicContact CE1-CG2 4.27Å; F140-V144 PolarHBondContact O-N 2.83Å; F140-V144 VanDerWaalsContact O-N 3.11Å; F140-M149 HydrophobicContact CD2-CE 3.57Å; F140-M149 HydrophobicContact CE2-CE 3.7Å; F140-M149 HydrophobicContact CG-CE 4.31Å; F140-V156 HydrophobicContact CE1-CG2 4Å
141L98.7Very high97.5Very high0 Ų011.5 Ų11.50%09%0.089CC..Hα-helixtrans-69.6-31.3-179.9-67.3171.4000111.9S137 A143 V144 D145 V156 L158 V172 C175 M183S137-L141 VanDerWaalsContact O-CB 3.28Å; S137-L141 WeakPolarHBondContact O-CB 3.01Å; S137-L141 VanDerWaalsContact O-CG 3.29Å; S137-L141 WeakPolarHBondContact O-CG 3.32Å; S137-L141 PolarHBondContact O-N 3.2Å; L141-A143 VanDerWaalsContact C-N 3.31Å; L141-V144 WeakPolarHBondContact O-CB 3.47Å; L141-V144 PolarHBondContact O-N 2.8Å; L141-D145 VanDerWaalsContact O-CB 3.26Å; L141-D145 WeakPolarHBondContact O-CB 3.41Å; L141-D145 PolarHBondContact O-N 3.38Å; L141-V156 HydrophobicContact CD2-CG1 4.26Å; L141-L158 HydrophobicContact CD1-CD1 3.98Å; L141-L158 HydrophobicContact CD1-CG 4.48Å; L141-V172 HydrophobicContact CB-CG2 4.29Å; L141-V172 HydrophobicContact CD2-CG2 4.2Å; L141-C175 HydrophobicContact CD1-CB 4.32Å; L141-C175 WeakPolarHBondContact CD1-SG 3.06Å; L141-M183 HydrophobicContact CB-CE 4.35Å
142A98.5Very high97.4Very high0 Ų014 Ų140%011%0.108CC..Hα-helixtrans-68.2-30.4169.800000112.4L138 F140 V144 D145 S146 M183 W186 N187 Y190L138-A142 WeakPolarHBondContact O-CB 3.46Å; L138-A142 PolarHBondContact O-N 3.37Å; F140-A142 VanDerWaalsContact C-N 3.34Å; F140-A142 PolarHBondContact O-N 2.04Å; A142-V144 VanDerWaalsContact C-N 3.34Å; A142-D145 PolarHBondContact O-N 3Å; A142-S146 VanDerWaalsContact O-CB 3.3Å; A142-S146 WeakPolarHBondContact O-CB 3.27Å; A142-S146 PolarHBondContact O-N 2.97Å; A142-S146 PolarHBondContact O-OG 3.27Å; A142-M183 HydrophobicContact CB-CE 3.92Å; A142-M183 HydrophobicContact CB-SD 4.16Å; A142-W186 HydrophobicContact CB-CB 3.36Å; A142-W186 HydrophobicContact CB-CG 4.23Å; A142-N187 PolarHBondContact O-OD1 2.95Å; A142-Y190 HydrophobicContact CB-CD2 4.27Å; A142-Y190 HydrophobicContact CB-CE2 3.9Å
143A98.3Very high97.2Very high0 Ų016 Ų160%012%0.122CC..Hα-helixtrans-69.5-33.2172.700000112.2L67 P139 F140 L141 S146 G147 I148 M149 Y190L67-A143 HydrophobicContact CD1-CB 3.61Å; P139-A143 WeakPolarHBondContact O-CB 3.28Å; P139-A143 PolarHBondContact O-N 2.77Å; F140-A143 WeakPolarHBondContact O-CB 3.41Å; F140-A143 PolarHBondContact O-N 3.39Å; F140-A143 VanDerWaalsContact O-N 3.08Å; L141-A143 VanDerWaalsContact C-N 3.31Å; A143-S146 WeakPolarHBondContact CA-OG 3.44Å; A143-S146 PolarHBondContact O-OG 3.08Å; A143-G147 PolarHBondContact O-N 3.39Å; A143-I148 HydrophobicContact CB-CB 4.42Å; A143-I148 HydrophobicContact CB-CG2 4.4Å; A143-I148 PolarHBondContact O-N 3.38Å; A143-M149 HydrophobicContact CB-CE 3.52Å; A143-M149 HydrophobicContact CB-CG 3.89Å; A143-M149 HydrophobicContact CB-SD 4.36Å; A143-M149 PolarHBondContact O-N 3.18Å; A143-Y190 HydrophobicContact CB-CD2 4.29Å; A143-Y190 HydrophobicContact CB-CE1 4.23Å; A143-Y190 HydrophobicContact CB-CE2 3.73Å; A143-Y190 VanDerWaalsContact N-CE2 3.31Å
144V98Very high97.1Very high3 Ų321.6 Ų21.62%0.01815%0.152CC..Hα-helixtrans-63.8-53169.9175.80000109.7F140 L141 A142 S146 G147 M149 I151 V156 V172F140-V144 HydrophobicContact CE1-CG2 4.27Å; F140-V144 PolarHBondContact O-N 2.83Å; F140-V144 VanDerWaalsContact O-N 3.11Å; L141-V144 WeakPolarHBondContact O-CB 3.47Å; L141-V144 PolarHBondContact O-N 2.8Å; A142-V144 VanDerWaalsContact C-N 3.34Å; V144-S146 VanDerWaalsContact C-N 3.3Å; V144-S146 PolarHBondContact O-N 2.95Å; V144-G147 WeakPolarHBondContact O-CA 3.34Å; V144-G147 PolarHBondContact O-N 3.04Å; V144-M149 HydrophobicContact CB-CG 4.42Å; V144-M149 HydrophobicContact CG2-CB 4.07Å; V144-M149 HydrophobicContact CG2-CG 3.73Å; V144-I151 HydrophobicContact CG1-CD1 4.23Å; V144-I151 HydrophobicContact CG1-CG1 4.18Å; V144-I151 HydrophobicContact CG2-CD1 4.19Å; V144-I151 HydrophobicContact CG2-CG1 4.47Å; V144-V156 HydrophobicContact CG1-CG1 4.15Å; V144-V156 HydrophobicContact CG2-CG1 3.87Å; V144-V172 HydrophobicContact CB-CG2 4.2Å; V144-V172 HydrophobicContact CG1-CG2 3.99Å
145D96.4Very high97Very high29 Ų2925 Ų2516%0.15517%0.168CC..Hα-helixtrans-63.8-30.1-176.4-17346.8000114.2L141 A142 G147 V172 R176 N187L141-D145 VanDerWaalsContact O-CB 3.26Å; L141-D145 WeakPolarHBondContact O-CB 3.41Å; L141-D145 PolarHBondContact O-N 3.38Å; A142-D145 PolarHBondContact O-N 3Å; D145-G147 VanDerWaalsContact C-N 3.29Å; D145-V172 HydrophobicContact CB-CG1 3.71Å; D145-V172 HydrophobicContact CB-CG2 4.4Å; D145-V172 WeakPolarHBondContact OD1-CG1 3.49Å; D145-R176 VanDerWaalsContact CG-NE 3.3Å; D145-R176 IonicContact OD1-CZ 3.72Å; D145-R176 IonicContact OD1-NE 2.88Å; D145-R176 PolarHBondContact OD1-NE 3Å; D145-R176 IonicContact OD1-NH1 2.61Å; D145-R176 PolarHBondContact OD1-NH1 3.26Å; D145-R176 IonicContact OD1-NH2 3.41Å; D145-R176 PolarHBondContact OD1-NH2 3.34Å; D145-R176 IonicContact OD2-CZ 3.29Å; D145-R176 IonicContact OD2-NE 3.49Å; D145-R176 PolarHBondContact OD2-NE 3.14Å; D145-R176 IonicContact OD2-NH2 3.42Å; D145-R176 PolarHBondContact OD2-NH2 3.14Å; D145-N187 PolarHBondContact OD2-ND2 3.5Å
146S96.2Very high96.9Very high23 Ų2324.3 Ų24.316%0.16116%0.164CC..THydrogen-bonded Turntrans-82.2-3.3172.458.80000114A142 A143 V144 I148 Y190A142-S146 VanDerWaalsContact O-CB 3.3Å; A142-S146 WeakPolarHBondContact O-CB 3.27Å; A142-S146 PolarHBondContact O-N 2.97Å; A142-S146 PolarHBondContact O-OG 3.27Å; A143-S146 WeakPolarHBondContact CA-OG 3.44Å; A143-S146 PolarHBondContact O-OG 3.08Å; V144-S146 VanDerWaalsContact C-N 3.3Å; V144-S146 PolarHBondContact O-N 2.95Å; S146-I148 VanDerWaalsContact C-N 3.27Å; S146-I148 PolarHBondContact O-N 3.12Å; S146-Y190 WeakPolarHBondContact OG-CB 3.46Å
147G95.5Very high96.9Very high42 Ų4228.4 Ų28.443%0.43318%0.179SC..THydrogen-bonded Turntrans76.75.6-17900000114.8A143 V144 D145 M149 G150A143-G147 PolarHBondContact O-N 3.39Å; V144-G147 WeakPolarHBondContact O-CA 3.34Å; V144-G147 PolarHBondContact O-N 3.04Å; D145-G147 VanDerWaalsContact C-N 3.29Å; G147-M149 VanDerWaalsContact C-N 3.25Å; G147-M149 PolarHBondContact O-N 2.89Å; G147-G150 PolarHBondContact O-N 3.45Å
148I95Very high96.9Very high2 Ų228.4 Ų28.41%0.0118%0.179CC..THydrogen-bonded Turntrans-61.8-36.5175.6-80-172.5000111.4Q70 T71 Y74 A143 S146 G150 Y190 L193 Q194Q70-I148 HydrophobicContact CB-CG2 4.11Å; T71-I148 HydrophobicContact CG2-CD1 4.38Å; T71-I148 HydrophobicContact CG2-CG2 4.01Å; Y74-I148 HydrophobicContact CE2-CD1 4.3Å; Y74-I148 HydrophobicContact CE2-CG1 4.42Å; A143-I148 HydrophobicContact CB-CB 4.42Å; A143-I148 HydrophobicContact CB-CG2 4.4Å; A143-I148 PolarHBondContact O-N 3.38Å; S146-I148 VanDerWaalsContact C-N 3.27Å; S146-I148 PolarHBondContact O-N 3.12Å; I148-G150 VanDerWaalsContact C-N 3.26Å; I148-G150 PolarHBondContact O-N 3.27Å; I148-Y190 HydrophobicContact CD1-CD1 3.36Å; I148-Y190 HydrophobicContact CD1-CE1 4.29Å; I148-Y190 HydrophobicContact CD1-CG 3.66Å; I148-L193 HydrophobicContact CD1-CD2 4.34Å; I148-Q194 HydrophobicContact CD1-CG 4.28Å; I148-Q194 HydrophobicContact CG1-CG 4.19Å
149M95.3Very high96.9Very high8 Ų829.8 Ų29.84%0.03919%0.186CC..THydrogen-bonded Turntrans-74.8-14.1-178.4-63.5-66.9-17200113.7I66 L67 Q70 F140 A143 V144 G147 I151I66-M149 HydrophobicContact CG2-CE 4.38Å; I66-M149 HydrophobicContact CG2-SD 3.97Å; L67-M149 HydrophobicContact CB-CE 4.01Å; L67-M149 HydrophobicContact CD1-CE 3.68Å; L67-M149 HydrophobicContact CG-CE 4.46Å; Q70-M149 HydrophobicContact CB-SD 4.13Å; Q70-M149 HydrophobicContact CG-SD 3.74Å; F140-M149 HydrophobicContact CD2-CE 3.57Å; F140-M149 HydrophobicContact CE2-CE 3.7Å; F140-M149 HydrophobicContact CG-CE 4.31Å; A143-M149 HydrophobicContact CB-CE 3.52Å; A143-M149 HydrophobicContact CB-CG 3.89Å; A143-M149 HydrophobicContact CB-SD 4.36Å; A143-M149 PolarHBondContact O-N 3.18Å; V144-M149 HydrophobicContact CB-CG 4.42Å; V144-M149 HydrophobicContact CG2-CB 4.07Å; V144-M149 HydrophobicContact CG2-CG 3.73Å; G147-M149 VanDerWaalsContact C-N 3.25Å; G147-M149 PolarHBondContact O-N 2.89Å; M149-I151 HydrophobicContact CB-CG1 3.91Å; M149-I151 PolarHBondContact O-N 3.22Å
150G94.3Very high96.8Very high70 Ų7032 Ų3272%0.72220%0.2SC*.SBendtrans68.320.2179.200000114.9G147 I148G147-G150 PolarHBondContact O-N 3.45Å; I148-G150 VanDerWaalsContact C-N 3.26Å; I148-G150 PolarHBondContact O-N 3.27Å
151I95.8Very high96.7Very high31 Ų3132 Ų3216%0.15920%0.201CC..SBendtrans-125.1160.2175.157.3154.7000109.9L40 V144 M149 E155 V156L40-I151 HydrophobicContact CD1-CD1 3.69Å; L40-I151 HydrophobicContact CD1-CG1 4.08Å; L40-I151 HydrophobicContact CD1-CG2 3.81Å; V144-I151 HydrophobicContact CG1-CD1 4.23Å; V144-I151 HydrophobicContact CG1-CG1 4.18Å; V144-I151 HydrophobicContact CG2-CD1 4.19Å; V144-I151 HydrophobicContact CG2-CG1 4.47Å; M149-I151 HydrophobicContact CB-CG1 3.91Å; M149-I151 PolarHBondContact O-N 3.22Å; I151-E155 WeakPolarHBondContact CA-OE2 3.1Å; I151-E155 HydrophobicContact CB-CB 4.36Å; I151-E155 WeakPolarHBondContact CB-OE2 3.25Å; I151-E155 HydrophobicContact CD1-CB 4.41Å; I151-V156 HydrophobicContact CD1-CB 3.93Å; I151-V156 HydrophobicContact CD1-CG1 3.8Å
152S96Very high96.3Very high60 Ų6037.8 Ų37.842%0.4224%0.239SC..  trans-75.4154.8173.1-172.60000111.8D154 E155S152-D154 WeakPolarHBondContact CB-OD1 2.99Å; S152-D154 PolarHBondContact O-N 3.14Å; S152-D154 PolarHBondContact OG-OD1 2.64Å; S152-E155 PolarHBondContact N-OE2 2.76Å; S152-E155 WeakPolarHBondContact O-CB 3.43Å; S152-E155 PolarHBondContact O-N 2.74Å
153S95.1Very high96Very high45 Ų4541.8 Ų41.832%0.31526%0.256SS..THydrogen-bonded Turntrans-63.5-20.2-177-64.20000114.5
154D94.9Very high95.7Very high117 Ų11745.1 Ų45.163%0.62627%0.274SS*.THydrogen-bonded Turntrans-92.8-7.7177.160.1-42.2000113.6V49 S152 V156V49-D154 WeakPolarHBondContact CG2-O 3.5Å; S152-D154 WeakPolarHBondContact CB-OD1 2.99Å; S152-D154 PolarHBondContact O-N 3.14Å; S152-D154 PolarHBondContact OG-OD1 2.64Å; D154-V156 VanDerWaalsContact C-N 3.3Å; D154-V156 PolarHBondContact O-N 3.06Å
155E96.6Very high95.5Very high74 Ų7449.9 Ų49.935%0.34630%0.296SS..SBendtrans-85.41.5-179.4-68.3-177.5118.400113.4Y50 I151 S152Y50-E155 VanDerWaalsContact CD2-O 3.25Å; Y50-E155 WeakPolarHBondContact CD2-O 3.42Å; Y50-E155 PolarHBondContact N-O 2.74Å; I151-E155 WeakPolarHBondContact CA-OE2 3.1Å; I151-E155 HydrophobicContact CB-CB 4.36Å; I151-E155 WeakPolarHBondContact CB-OE2 3.25Å; I151-E155 HydrophobicContact CD1-CB 4.41Å; S152-E155 PolarHBondContact N-OE2 2.76Å; S152-E155 WeakPolarHBondContact O-CB 3.43Å; S152-E155 PolarHBondContact O-N 2.74Å
156V97.9Very high95.4Very high2 Ų260.6 Ų60.61%0.01233%0.334CS..EExtended strand (participates in β ladder)trans-142.8140.3176.365.20000112.3Y50 I52 F140 L141 V144 I151 D154Y50-V156 WeakPolarHBondContact O-CA 3.14Å; I52-V156 HydrophobicContact CD1-CG2 4.01Å; I52-V156 HydrophobicContact CG1-CG2 4.44Å; F140-V156 HydrophobicContact CE1-CG2 4Å; L141-V156 HydrophobicContact CD2-CG1 4.26Å; V144-V156 HydrophobicContact CG1-CG1 4.15Å; V144-V156 HydrophobicContact CG2-CG1 3.87Å; I151-V156 HydrophobicContact CD1-CB 3.93Å; I151-V156 HydrophobicContact CD1-CG1 3.8Å; D154-V156 VanDerWaalsContact C-N 3.3Å; D154-V156 PolarHBondContact O-N 3.06Å
157R97.7Very high95.4Very high88 Ų8862.8 Ų62.833%0.33234%0.34SS..EExtended strand (participates in β ladder)trans-145.1141.3177.3-175.917661.285.5-1.9111.4V49 Y50 I51 I52V49-R157 HydrophobicContact CG1-CB 3.99Å; Y50-R157 PolarHBondContact O-N 2.84Å; I51-R157 HydrophobicContact CD1-CB 4.31Å; I52-R157 PolarHBondContact N-O 3.42Å
158L98.6Very high95.5Very high0 Ų061.4 Ų61.40%032%0.323CS..EExtended strand (participates in β ladder)trans-90.7145.7174.6-50.4-176.9000110.6I52 P54 M63 S137 L141 Y170I52-L158 HydrophobicContact CB-CD2 3.88Å; I52-L158 HydrophobicContact CD1-CD2 4.41Å; I52-L158 HydrophobicContact CG2-CD2 4.34Å; I52-L158 CarbonylContact O-C 3.5Å; I52-L158 VanDerWaalsContact O-CA 3.31Å; I52-L158 WeakPolarHBondContact O-CA 3.28Å; P54-L158 HydrophobicContact CG-CB 4.28Å; M63-L158 HydrophobicContact CE-CD1 4.16Å; M63-L158 HydrophobicContact CE-CD2 3.85Å; M63-L158 HydrophobicContact SD-CD2 4.16Å; S137-L158 VanDerWaalsContact CB-CD1 3.44Å; L141-L158 HydrophobicContact CD1-CD1 3.98Å; L141-L158 HydrophobicContact CD1-CG 4.48Å; L158-Y170 HydrophobicContact CB-CD1 4.29Å; L158-Y170 WeakPolarHBondContact CB-O 3.26Å; L158-Y170 WeakPolarHBondContact CG-O 3.28Å; L158-Y170 PolarHBondContact N-O 3.05Å
159L98.3Very high95.6Very high29 Ų2961.4 Ų61.415%0.15232%0.323CS..PPolyproline II helixtrans-82.6145.1173.5-65.3-178.3000112.5I51 I52 N53 W55I51-L159 HydrophobicContact CG2-CD1 4.13Å; I51-L159 HydrophobicContact CG2-CD2 3.49Å; I51-L159 VanDerWaalsContact CG2-CD2 3.49Å; I51-L159 HydrophobicContact CG2-CG 3.65Å; I52-L159 PolarHBondContact O-N 2.87Å; N53-L159 HydrophobicContact CB-CB 4.37Å; N53-L159 HydrophobicContact CB-CD1 3.73Å; N53-L159 HydrophobicContact CB-CG 4.36Å; W55-L159 PolarHBondContact NE1-O 3.42Å
160P97.8Very high95.7Very high46 Ų4662.8 Ų62.830%0.29933%0.328SS..PPolyproline II helixtrans-69.6154.5172.332.1-35.7000112.1E165 Y170P160-E165 HydrophobicContact CB-CB 4.15Å; P160-E165 HydrophobicContact CB-CG 3.89Å; P160-Y170 VanDerWaalsContact CA-CE1 3.4Å; P160-Y170 HydrophobicContact CB-CE1 3.89Å; P160-Y170 HydrophobicContact CB-CE2 4.22Å
161P96.3Very high95.9Very high2 Ų261.8 Ų61.81%0.01331%0.306CS..PPolyproline II helixtrans-67163.5166.622.3-23.1000110.9W55 V124 K163 E165 F168 Y170W55-P161 HydrophobicContact CD2-CB 3.79Å; W55-P161 VanDerWaalsContact CE2-CB 3.41Å; W55-P161 HydrophobicContact CE3-CB 4.38Å; W55-P161 HydrophobicContact CG-CB 4.18Å; W55-P161 HydrophobicContact CH2-CB 4.25Å; W55-P161 HydrophobicContact CH2-CG 4.25Å; W55-P161 HydrophobicContact CZ2-CB 3.67Å; W55-P161 HydrophobicContact CZ2-CG 3.5Å; W55-P161 VanDerWaalsContact CZ2-CG 3.5Å; W55-P161 VanDerWaalsContact NE1-CD 3.28Å; V124-P161 HydrophobicContact CB-CB 3.88Å; V124-P161 HydrophobicContact CG1-CB 4.26Å; V124-P161 HydrophobicContact CG2-CB 3.71Å; V124-P161 HydrophobicContact CG2-CG 3.86Å; P161-K163 WeakPolarHBondContact CB-O 3.42Å; P161-K163 WeakPolarHBondContact CG-O 3.18Å; P161-K163 PolarHBondContact O-N 3.21Å; P161-K163 VanDerWaalsContact O-N 3.11Å; P161-E165 WeakPolarHBondContact O-CG 3.35Å; P161-F168 HydrophobicContact CG-CD2 3.67Å; P161-F168 HydrophobicContact CG-CE2 3.59Å; P161-Y170 VanDerWaalsContact CD-OH 3.28Å; P161-Y170 WeakPolarHBondContact CD-OH 3.37Å
162P90.3Very high96.1Very high123 Ų12360.5 Ų60.580%0.79930%0.3SS*.SBendtrans-62.8-16.8176.2-23.234000115.3
163K92.5Very high96.1Very high84 Ų8462.1 Ų62.137%0.36531%0.311SS..SBendtrans-148.8165177.161.9174.2170.8-1790110.3V124 D125 P161 E165V124-K163 HydrophobicContact CG1-CD 4.06Å; V124-K163 VanDerWaalsContact CG1-CE 3.49Å; V124-K163 HydrophobicContact CG1-CG 3.37Å; D125-K163 WeakPolarHBondContact OD1-CE 3.45Å; D125-K163 IonicContact OD1-NZ 3.86Å; D125-K163 PolarHBondContact OD1-NZ 3.41Å; D125-K163 VanDerWaalsContact OD2-CE 3.26Å; D125-K163 WeakPolarHBondContact OD2-CE 3.31Å; D125-K163 IonicContact OD2-NZ 2.71Å; D125-K163 PolarHBondContact OD2-NZ 3.32Å; P161-K163 WeakPolarHBondContact CB-O 3.42Å; P161-K163 WeakPolarHBondContact CG-O 3.18Å; P161-K163 PolarHBondContact O-N 3.21Å; P161-K163 VanDerWaalsContact O-N 3.11Å; K163-E165 PolarHBondContact O-N 3.04Å
164N91.2Very high96.3Very high69 Ų6961.6 Ų61.637%0.36931%0.307SS..  trans60.827.2-178.7-60-27.7000114V124 R166 K167 F168V124-N164 HydrophobicContact CG2-CB 4.39Å; N164-R166 PolarHBondContact O-N 3.05Å; N164-K167 HydrophobicContact CB-CD 4.2Å; N164-K167 HydrophobicContact CB-CG 4.23Å; N164-K167 WeakPolarHBondContact O-CB 3.33Å; N164-K167 PolarHBondContact O-N 3.46Å; N164-F168 HydrophobicContact CB-CE2 4.4Å; N164-F168 WeakPolarHBondContact O-CD2 3.14Å
165E93.5Very high96.4Very high104 Ų10456 Ų5649%0.48628%0.278SS..G310 helixtrans-53.7-33.1-174.4-54.8-175.4-165.700113.7P160 P161 K163 K167 F168 Y170P160-E165 HydrophobicContact CB-CB 4.15Å; P160-E165 HydrophobicContact CB-CG 3.89Å; P161-E165 WeakPolarHBondContact O-CG 3.35Å; K163-E165 PolarHBondContact O-N 3.04Å; E165-K167 PolarHBondContact O-N 3.46Å; E165-F168 PolarHBondContact O-N 2.75Å; E165-Y170 VanDerWaalsContact C-OH 3.28Å; E165-Y170 VanDerWaalsContact CA-OH 3.28Å; E165-Y170 WeakPolarHBondContact CA-OH 3.32Å; E165-Y170 WeakPolarHBondContact O-CE2 3.47Å; E165-Y170 PolarHBondContact O-OH 3.32Å
166R94.5Very high96.5Very high253 Ų25357.4 Ų57.496%0.95528%0.28SS*.G310 helixtrans-73.7-11-179.1-61.9-177.1-177.7177.30.5114N164 F168N164-R166 PolarHBondContact O-N 3.05Å; R166-F168 VanDerWaalsContact C-N 3.29Å
167K95.4Very high96.5Very high69 Ų6962.3 Ų62.330%0.331%0.314SS..G310 helixtrans-78.2-12.9177.4-68.3-163.7178.3-169.80112.6N164 E165 S221 F222 D224N164-K167 HydrophobicContact CB-CD 4.2Å; N164-K167 HydrophobicContact CB-CG 4.23Å; N164-K167 WeakPolarHBondContact O-CB 3.33Å; N164-K167 PolarHBondContact O-N 3.46Å; E165-K167 PolarHBondContact O-N 3.46Å; K167-S221 PolarHBondContact NZ-O 2.86Å; K167-F222 HydrophobicContact CB-CE1 4.32Å; K167-F222 HydrophobicContact CB-CZ 4.12Å; K167-F222 HydrophobicContact CD-CD1 4.39Å; K167-F222 HydrophobicContact CD-CE1 3.76Å; K167-F222 HydrophobicContact CD-CZ 4.25Å; K167-D224 IonicContact NZ-OD1 3.38Å; K167-D224 PolarHBondContact NZ-OD1 2.93Å; K167-D224 IonicContact NZ-OD2 3.48Å; K167-D224 PolarHBondContact NZ-OD2 3.21Å
168F97.8Very high96.5Very high14 Ų1461.9 Ų61.96%0.06132%0.324CS..SBendtrans-121.7163.3-172.9-50.2-87.8000112.6W55 V124 D130 Y133 F134 P161 N164 E165 R166 Y170 F222W55-F168 HydrophobicContact CH2-CD1 4.36Å; W55-F168 AromaticContact CH2-CE1 3.67Å; W55-F168 HydrophobicContact CH2-CE1 3.67Å; W55-F168 HydrophobicContact CH2-CE2 4.07Å; W55-F168 AromaticContact CH2-CZ 3.52Å; W55-F168 HydrophobicContact CH2-CZ 3.52Å; W55-F168 HydrophobicContact CZ2-CD1 4.15Å; W55-F168 HydrophobicContact CZ2-CD2 4.22Å; W55-F168 AromaticContact CZ2-CE1 3.91Å; W55-F168 HydrophobicContact CZ2-CE1 3.91Å; W55-F168 HydrophobicContact CZ2-CE2 4Å; W55-F168 HydrophobicContact CZ2-CG 4.3Å; W55-F168 AromaticContact CZ2-CZ 3.84Å; W55-F168 HydrophobicContact CZ2-CZ 3.84Å; V124-F168 HydrophobicContact CG2-CE2 3.82Å; V124-F168 HydrophobicContact CG2-CZ 3.86Å; D130-F168 WeakPolarHBondContact OD1-CZ 3.04Å; Y133-F168 AromaticContact CD1-CD1 3.5Å; Y133-F168 HydrophobicContact CD1-CD1 3.5Å; Y133-F168 HydrophobicContact CD1-CE1 4.19Å; Y133-F168 HydrophobicContact CD1-CG 4.4Å; Y133-F168 HydrophobicContact CD2-CD1 4.33Å; Y133-F168 HydrophobicContact CE1-CB 3.85Å; Y133-F168 AromaticContact CE1-CD1 3.72Å; Y133-F168 HydrophobicContact CE1-CD1 3.72Å; Y133-F168 HydrophobicContact CE1-CG 4.2Å; Y133-F168 HydrophobicContact CE2-CD1 4.46Å; Y133-F168 AromaticContact CG-CD1 3.86Å; Y133-F168 HydrophobicContact CG-CD1 3.86Å; Y133-F168 HydrophobicContact CG-CE1 4.18Å; F134-F168 AromaticContact CE2-CD1 3.72Å; F134-F168 HydrophobicContact CE2-CD1 3.72Å; F134-F168 AromaticContact CE2-CE1 3.9Å; F134-F168 HydrophobicContact CE2-CE1 3.9Å; F134-F168 AromaticContact CZ-CD1 3.61Å; F134-F168 HydrophobicContact CZ-CD1 3.61Å; F134-F168 HydrophobicContact CZ-CE1 4.23Å; F134-F168 HydrophobicContact CZ-CG 4.41Å; P161-F168 HydrophobicContact CG-CD2 3.67Å; P161-F168 HydrophobicContact CG-CE2 3.59Å; N164-F168 HydrophobicContact CB-CE2 4.4Å; N164-F168 WeakPolarHBondContact O-CD2 3.14Å; E165-F168 PolarHBondContact O-N 2.75Å; R166-F168 VanDerWaalsContact C-N 3.29Å; F168-Y170 HydrophobicContact CB-CE1 3.8Å; F168-F222 HydrophobicContact CD1-CZ 4.36Å; F168-F222 AromaticContact CE1-CE1 3.98Å; F168-F222 HydrophobicContact CE1-CE1 3.98Å; F168-F222 AromaticContact CE1-CZ 3.67Å; F168-F222 HydrophobicContact CE1-CZ 3.67Å; F168-F222 AromaticContact CZ-CE1 3.74Å; F168-F222 HydrophobicContact CZ-CE1 3.74Å; F168-F222 AromaticContact CZ-CZ 3.87Å; F168-F222 HydrophobicContact CZ-CZ 3.87Å
169C98.1Very high96.4Very high1 Ų163.2 Ų63.21%0.00733%0.33CS..  trans-114.8151.1171.5680000109.8Y133 C175 F179Y133-C169 PolarHBondContact OH-O 3.02Å; C169-C175 VanDerWaalsContact C-SG 3.58Å; C169-C175 HydrophobicContact CB-CB 3.86Å; C169-C175 WeakPolarHBondContact CB-SG 2.84Å; C169-C175 WeakPolarHBondContact SG-CA 3.44Å; C169-C175 WeakPolarHBondContact SG-CB 3.42Å; C169-C175 CovalentContact SG-SG 2.04Å; C169-C175 PolarHBondContact SG-SG 3.21Å; C169-F179 HydrophobicContact CB-CE2 4.45Å
170Y98.2Very high96.4Very high37 Ų3766.6 Ų66.615%0.14535%0.348CS..  trans-129.4-11.1-161.7-59.8-62.4000115.5Y133 L158 P160 P161 E165 F168 S174Y133-Y170 VanDerWaalsContact OH-CD1 3.3Å; Y133-Y170 WeakPolarHBondContact OH-CD1 3.3Å; Y133-Y170 WeakPolarHBondContact OH-CE1 3.49Å; L158-Y170 HydrophobicContact CB-CD1 4.29Å; L158-Y170 WeakPolarHBondContact CB-O 3.26Å; L158-Y170 WeakPolarHBondContact CG-O 3.28Å; L158-Y170 PolarHBondContact N-O 3.05Å; P160-Y170 VanDerWaalsContact CA-CE1 3.4Å; P160-Y170 HydrophobicContact CB-CE1 3.89Å; P160-Y170 HydrophobicContact CB-CE2 4.22Å; P161-Y170 VanDerWaalsContact CD-OH 3.28Å; P161-Y170 WeakPolarHBondContact CD-OH 3.37Å; E165-Y170 VanDerWaalsContact C-OH 3.28Å; E165-Y170 VanDerWaalsContact CA-OH 3.28Å; E165-Y170 WeakPolarHBondContact CA-OH 3.32Å; E165-Y170 WeakPolarHBondContact O-CE2 3.47Å; E165-Y170 PolarHBondContact O-OH 3.32Å; F168-Y170 HydrophobicContact CB-CE1 3.8Å; Y170-S174 PolarHBondContact N-OG 3.21Å
171D98.2Very high96.4Very high49 Ų4970.9 Ų70.926%0.26236%0.364SS..SBendtrans-149.2172.6-179.554.145.9000108.9S173 S174 C175D171-S173 PolarHBondContact O-N 3.13Å; D171-S173 PolarHBondContact OD1-N 3.36Å; D171-S174 VanDerWaalsContact CG-OG 3.31Å; D171-S174 PolarHBondContact N-OG 3.11Å; D171-S174 PolarHBondContact O-OG 3.05Å; D171-S174 VanDerWaalsContact O-OG 3.14Å; D171-S174 VanDerWaalsContact OD1-CB 3.29Å; D171-S174 WeakPolarHBondContact OD1-CB 3.44Å; D171-S174 PolarHBondContact OD1-N 2.9Å; D171-S174 PolarHBondContact OD1-OG 2.87Å; D171-C175 WeakPolarHBondContact O-CB 3.49Å; D171-C175 PolarHBondContact O-N 3Å; D171-C175 PolarHBondContact O-SG 3.14Å; D171-C175 VanDerWaalsContact O-SG 3.39Å
172V98.2Very high96.5Very high5 Ų570.8 Ų70.83%0.0336%0.363CS..Hα-helixtrans-57.7-39.7-177.7175.70000111.4L141 V144 D145 R176L141-V172 HydrophobicContact CB-CG2 4.29Å; L141-V172 HydrophobicContact CD2-CG2 4.2Å; V144-V172 HydrophobicContact CB-CG2 4.2Å; V144-V172 HydrophobicContact CG1-CG2 3.99Å; D145-V172 HydrophobicContact CB-CG1 3.71Å; D145-V172 HydrophobicContact CB-CG2 4.4Å; D145-V172 WeakPolarHBondContact OD1-CG1 3.49Å; V172-R176 VanDerWaalsContact O-CB 3.31Å; V172-R176 WeakPolarHBondContact O-CB 3.45Å; V172-R176 WeakPolarHBondContact O-CG 3.46Å; V172-R176 PolarHBondContact O-N 3.2Å
173S98Very high96.9Very high94 Ų9464.9 Ų64.966%0.65733%0.325SS*.Hα-helixtrans-67.7-53.4-176.5-173.70000111.9D171 C175 R176 S177D171-S173 PolarHBondContact O-N 3.13Å; D171-S173 PolarHBondContact OD1-N 3.36Å; S173-C175 PolarHBondContact O-N 3.47Å; S173-R176 PolarHBondContact O-N 2.87Å; S173-S177 WeakPolarHBondContact O-CB 3.43Å; S173-S177 PolarHBondContact O-N 3.03Å
174S98.1Very high97.2Very high34 Ų3464.3 Ų64.324%0.23833%0.326CS..Hα-helixtrans-61.5-42.817855.90000111.4Y170 D171 S177 S178Y170-S174 PolarHBondContact N-OG 3.21Å; D171-S174 VanDerWaalsContact CG-OG 3.31Å; D171-S174 PolarHBondContact N-OG 3.11Å; D171-S174 PolarHBondContact O-OG 3.05Å; D171-S174 VanDerWaalsContact O-OG 3.14Å; D171-S174 VanDerWaalsContact OD1-CB 3.29Å; D171-S174 WeakPolarHBondContact OD1-CB 3.44Å; D171-S174 PolarHBondContact OD1-N 2.9Å; D171-S174 PolarHBondContact OD1-OG 2.87Å; S174-S177 PolarHBondContact O-N 3.44Å; S174-S178 PolarHBondContact O-N 3.46Å; S174-S178 PolarHBondContact O-OG 2.88Å
175C98.3Very high97.6Very high0 Ų064.2 Ų64.20%032%0.322CS..Hα-helixtrans-68.7-37.5178.7-68.20000112.9L138 L141 C169 D171 S173 S177 S178 F179 M183L138-C175 HydrophobicContact CD2-CB 3.93Å; L141-C175 HydrophobicContact CD1-CB 4.32Å; L141-C175 WeakPolarHBondContact CD1-SG 3.06Å; C169-C175 VanDerWaalsContact C-SG 3.58Å; C169-C175 HydrophobicContact CB-CB 3.86Å; C169-C175 WeakPolarHBondContact CB-SG 2.84Å; C169-C175 WeakPolarHBondContact SG-CA 3.44Å; C169-C175 WeakPolarHBondContact SG-CB 3.42Å; C169-C175 CovalentContact SG-SG 2.04Å; C169-C175 PolarHBondContact SG-SG 3.21Å; D171-C175 WeakPolarHBondContact O-CB 3.49Å; D171-C175 PolarHBondContact O-N 3Å; D171-C175 PolarHBondContact O-SG 3.14Å; D171-C175 VanDerWaalsContact O-SG 3.39Å; S173-C175 PolarHBondContact O-N 3.47Å; C175-S177 VanDerWaalsContact C-N 3.34Å; C175-S178 PolarHBondContact O-N 3.03Å; C175-F179 WeakPolarHBondContact O-CA 3.33Å; C175-F179 WeakPolarHBondContact O-CB 3.42Å; C175-F179 PolarHBondContact O-N 3.29Å; C175-M183 HydrophobicContact CB-CG 4.49Å; C175-M183 HydrophobicContact CB-SD 4.13Å
176R97.5Very high97.8Very high103 Ų10359.2 Ų59.239%0.38930%0.299SS..Hα-helixtrans-63.7-40170.9-85.1-177.7161.7-174.2-3.8112.1D145 V172 S173 S178 L180 M183D145-R176 VanDerWaalsContact CG-NE 3.3Å; D145-R176 IonicContact OD1-CZ 3.72Å; D145-R176 IonicContact OD1-NE 2.88Å; D145-R176 PolarHBondContact OD1-NE 3Å; D145-R176 IonicContact OD1-NH1 2.61Å; D145-R176 PolarHBondContact OD1-NH1 3.26Å; D145-R176 IonicContact OD1-NH2 3.41Å; D145-R176 PolarHBondContact OD1-NH2 3.34Å; D145-R176 IonicContact OD2-CZ 3.29Å; D145-R176 IonicContact OD2-NE 3.49Å; D145-R176 PolarHBondContact OD2-NE 3.14Å; D145-R176 IonicContact OD2-NH2 3.42Å; D145-R176 PolarHBondContact OD2-NH2 3.14Å; V172-R176 VanDerWaalsContact O-CB 3.31Å; V172-R176 WeakPolarHBondContact O-CB 3.45Å; V172-R176 WeakPolarHBondContact O-CG 3.46Å; V172-R176 PolarHBondContact O-N 3.2Å; S173-R176 PolarHBondContact O-N 2.87Å; R176-S178 VanDerWaalsContact C-N 3.34Å; R176-L180 WeakPolarHBondContact O-CA 3.37Å; R176-L180 WeakPolarHBondContact O-CB 3.34Å; R176-L180 PolarHBondContact O-N 3.06Å; R176-L180 VanDerWaalsContact O-N 3.14Å; R176-M183 HydrophobicContact CG-CB 4.25Å; R176-M183 HydrophobicContact CG-CE 4.21Å; R176-M183 HydrophobicContact CG-CG 4.31Å
177S97.9Very high98Very high105 Ų10547.7 Ų47.773%0.73426%0.256SS*.Hα-helixtrans-65.3-38.1178.8-1720000112.2S173 S174 C175S173-S177 WeakPolarHBondContact O-CB 3.43Å; S173-S177 PolarHBondContact O-N 3.03Å; S174-S177 PolarHBondContact O-N 3.44Å; C175-S177 VanDerWaalsContact C-N 3.34Å
178S97.5Very high98.1Very high78 Ų7847 Ų4755%0.54526%0.258SS..Hα-helixtrans-87.5-31.5-177.5-61.80000113.7S174 C175 R176S174-S178 PolarHBondContact O-N 3.46Å; S174-S178 PolarHBondContact O-OG 2.88Å; C175-S178 PolarHBondContact O-N 3.03Å; R176-S178 VanDerWaalsContact C-N 3.34Å
179F97.8Very high98.2Very high29 Ų2946.4 Ų46.413%0.12726%0.255CS..  trans-135.645.7-170-56-76.7000111.9F134 L138 C169 C175 E181 T182 M183 D217 T218F134-F179 HydrophobicContact CD1-CE2 4.09Å; F134-F179 HydrophobicContact CD1-CZ 4.14Å; F134-F179 AromaticContact CE1-CE2 3.53Å; F134-F179 HydrophobicContact CE1-CE2 3.53Å; F134-F179 AromaticContact CE1-CZ 3.55Å; F134-F179 HydrophobicContact CE1-CZ 3.55Å; F134-F179 HydrophobicContact CZ-CE2 4.49Å; F134-F179 HydrophobicContact CZ-CZ 4.19Å; L138-F179 HydrophobicContact CD1-CB 4.41Å; L138-F179 HydrophobicContact CD1-CG 4.37Å; L138-F179 HydrophobicContact CD2-CB 4.44Å; L138-F179 HydrophobicContact CD2-CD2 4.08Å; L138-F179 HydrophobicContact CD2-CG 4.47Å; C169-F179 HydrophobicContact CB-CE2 4.45Å; C175-F179 WeakPolarHBondContact O-CA 3.33Å; C175-F179 WeakPolarHBondContact O-CB 3.42Å; C175-F179 PolarHBondContact O-N 3.29Å; F179-E181 VanDerWaalsContact C-N 3.34Å; F179-E181 PolarHBondContact O-N 3.41Å; F179-T182 PolarHBondContact O-N 3.1Å; F179-T182 VanDerWaalsContact O-N 3.14Å; F179-M183 WeakPolarHBondContact O-CB 3.42Å; F179-M183 WeakPolarHBondContact O-CG 3.35Å; F179-M183 PolarHBondContact O-N 2.75Å; F179-D217 HydrophobicContact CD1-CB 3.89Å; F179-D217 HydrophobicContact CE1-CB 4.13Å; F179-T218 HydrophobicContact CE1-CG2 3.98Å; F179-T218 HydrophobicContact CZ-CG2 4.33Å
180L97.8Very high98.2Very high100 Ų10046.3 Ų46.352%0.52426%0.255SS..Hα-helixtrans-49.7-50.7-173.4-179.960.5000113R176 N184R176-L180 WeakPolarHBondContact O-CA 3.37Å; R176-L180 WeakPolarHBondContact O-CB 3.34Å; R176-L180 PolarHBondContact O-N 3.06Å; R176-L180 VanDerWaalsContact O-N 3.14Å; L180-N184 WeakPolarHBondContact O-CB 3.46Å; L180-N184 PolarHBondContact O-N 3Å; L180-N184 PolarHBondContact O-ND2 2.96Å
181E98.2Very high98.1Very high135 Ų13550.3 Ų50.363%0.63128%0.275SS*.Hα-helixtrans-65.8-41.9-178.2-67.6-166.6-177.200112.6F179 N184 K185F179-E181 VanDerWaalsContact C-N 3.34Å; F179-E181 PolarHBondContact O-N 3.41Å; E181-N184 PolarHBondContact O-N 2.68Å; E181-K185 WeakPolarHBondContact O-CG 3.29Å; E181-K185 PolarHBondContact O-N 3.02Å; E181-K185 IonicContact OE2-NZ 3Å
182T98.5Very high98.1Very high0 Ų050 Ų500%027%0.27CS..Hα-helixtrans-67.6-42.8179-730000111.4L138 F179 N184 K185 W186 S213 T214 D217L138-T182 HydrophobicContact CD1-CG2 3.62Å; F179-T182 PolarHBondContact O-N 3.1Å; F179-T182 VanDerWaalsContact O-N 3.14Å; T182-N184 VanDerWaalsContact C-N 3.3Å; T182-N184 PolarHBondContact O-N 3.11Å; T182-K185 PolarHBondContact O-N 3.35Å; T182-W186 PolarHBondContact O-N 3.08Å; T182-S213 WeakPolarHBondContact OG1-CB 3.28Å; T182-S213 PolarHBondContact OG1-O 2.68Å; T182-S213 PolarHBondContact OG1-OG 3.32Å; T182-T214 VanDerWaalsContact CG2-OG1 3.28Å; T182-T214 WeakPolarHBondContact CG2-OG1 3.19Å; T182-D217 WeakPolarHBondContact CB-OD2 3.36Å; T182-D217 PolarHBondContact OG1-OD2 3.49Å
183M98.4Very high98Very high0 Ų049.8 Ų49.80%027%0.269CS..Hα-helixtrans-58.6-41.9172.6-73.1-66.6-68.400111.4L138 L141 A142 C175 R176 F179 K185 W186 N187L138-M183 HydrophobicContact CB-SD 4.35Å; L138-M183 HydrophobicContact CD2-SD 3.96Å; L141-M183 HydrophobicContact CB-CE 4.35Å; A142-M183 HydrophobicContact CB-CE 3.92Å; A142-M183 HydrophobicContact CB-SD 4.16Å; C175-M183 HydrophobicContact CB-CG 4.49Å; C175-M183 HydrophobicContact CB-SD 4.13Å; R176-M183 HydrophobicContact CG-CB 4.25Å; R176-M183 HydrophobicContact CG-CE 4.21Å; R176-M183 HydrophobicContact CG-CG 4.31Å; F179-M183 WeakPolarHBondContact O-CB 3.42Å; F179-M183 WeakPolarHBondContact O-CG 3.35Å; F179-M183 PolarHBondContact O-N 2.75Å; M183-K185 PolarHBondContact O-N 2.85Å; M183-W186 PolarHBondContact O-N 3.15Å; M183-N187 WeakPolarHBondContact O-CB 3.3Å; M183-N187 PolarHBondContact O-N 3.27Å; M183-N187 PolarHBondContact O-ND2 3.37Å
184N98.5Very high97.9Very high72 Ų7248.8 Ų48.839%0.38525%0.254SS..Hα-helixtrans-63.9-37.3176.2-73.3-21.1000113L180 E181 T182 N187 T188L180-N184 WeakPolarHBondContact O-CB 3.46Å; L180-N184 PolarHBondContact O-N 3Å; L180-N184 PolarHBondContact O-ND2 2.96Å; E181-N184 PolarHBondContact O-N 2.68Å; T182-N184 VanDerWaalsContact C-N 3.3Å; T182-N184 PolarHBondContact O-N 3.11Å; N184-N187 PolarHBondContact O-N 2.56Å; N184-T188 WeakPolarHBondContact O-CB 3.45Å; N184-T188 PolarHBondContact O-N 2.57Å; N184-T188 PolarHBondContact O-OG1 2.65Å
185K98.8Very high97.8Very high66 Ų6648.8 Ų48.829%0.28725%0.254SS..Hα-helixtrans-66-42.8174.8-68.9-179.4-169.991.40111.6E181 T182 M183 T188 F189 A209 A210 S213E181-K185 WeakPolarHBondContact O-CG 3.29Å; E181-K185 PolarHBondContact O-N 3.02Å; E181-K185 IonicContact OE2-NZ 3Å; T182-K185 PolarHBondContact O-N 3.35Å; M183-K185 PolarHBondContact O-N 2.85Å; K185-T188 WeakPolarHBondContact O-CB 3.45Å; K185-T188 PolarHBondContact O-N 3.43Å; K185-F189 PolarHBondContact O-N 3.49Å; K185-A209 WeakPolarHBondContact CD-O 3.49Å; K185-A210 HydrophobicContact CB-CB 3.9Å; K185-S213 PolarHBondContact NZ-OG 3.02Å
186W98.8Very high97.4Very high0 Ų053.8 Ų53.80%029%0.286CS..Hα-helixtrans-62.5-43.5172.9-78.9113.5000112.2L87 L90 P139 A142 T182 M183 T188 F189 Y190 L207 A210 T214L87-W186 HydrophobicContact CD2-CZ3 4.14Å; L90-W186 HydrophobicContact CD1-CH2 4.43Å; P139-W186 HydrophobicContact CB-CD2 3.83Å; P139-W186 HydrophobicContact CB-CE3 3.81Å; P139-W186 HydrophobicContact CB-CH2 3.79Å; P139-W186 HydrophobicContact CB-CZ2 3.8Å; P139-W186 HydrophobicContact CB-CZ3 3.79Å; P139-W186 HydrophobicContact CG-CH2 4.3Å; P139-W186 HydrophobicContact CG-CZ2 4.02Å; A142-W186 HydrophobicContact CB-CB 3.36Å; A142-W186 HydrophobicContact CB-CG 4.23Å; T182-W186 PolarHBondContact O-N 3.08Å; M183-W186 PolarHBondContact O-N 3.15Å; W186-T188 VanDerWaalsContact C-N 3.31Å; W186-T188 PolarHBondContact O-N 3.38Å; W186-F189 HydrophobicContact CE3-CD1 4.18Å; W186-F189 HydrophobicContact CZ3-CD1 4.33Å; W186-F189 WeakPolarHBondContact O-CB 3.28Å; W186-F189 PolarHBondContact O-N 2.88Å; W186-Y190 HydrophobicContact CB-CE2 4.33Å; W186-Y190 HydrophobicContact CE3-CE2 4.4Å; W186-Y190 WeakPolarHBondContact O-CD2 3.4Å; W186-Y190 PolarHBondContact O-N 3.14Å; W186-L207 HydrophobicContact CH2-CD1 3.71Å; W186-L207 HydrophobicContact CZ3-CD1 3.62Å; W186-A210 HydrophobicContact CB-CB 4.44Å; W186-A210 HydrophobicContact CD2-CB 3.5Å; W186-A210 VanDerWaalsContact CD2-CB 3.5Å; W186-A210 HydrophobicContact CE3-CB 3.86Å; W186-A210 HydrophobicContact CG-CB 3.78Å; W186-A210 HydrophobicContact CH2-CB 4.44Å; W186-A210 HydrophobicContact CZ2-CB 4.14Å; W186-A210 HydrophobicContact CZ3-CB 4.31Å; W186-T214 PolarHBondContact NE1-OG1 3.16Å
187N97.7Very high97.1Very high10 Ų1056.9 Ų56.95%0.05330%0.303CS..Hα-helixtrans-60.1-41174.3-78.9-25.1000112.3A142 D145 M183 N184 F189 Y190 Q191A142-N187 PolarHBondContact O-OD1 2.95Å; D145-N187 PolarHBondContact OD2-ND2 3.5Å; M183-N187 WeakPolarHBondContact O-CB 3.3Å; M183-N187 PolarHBondContact O-N 3.27Å; M183-N187 PolarHBondContact O-ND2 3.37Å; N184-N187 PolarHBondContact O-N 2.56Å; N187-F189 VanDerWaalsContact C-N 3.32Å; N187-F189 PolarHBondContact O-N 2.92Å; N187-Y190 PolarHBondContact O-N 3.46Å; N187-Q191 WeakPolarHBondContact O-CB 3.28Å; N187-Q191 VanDerWaalsContact O-CG 3.3Å; N187-Q191 WeakPolarHBondContact O-CG 3.4Å; N187-Q191 PolarHBondContact O-N 3.04Å
188T98.3Very high97Very high56 Ų5652.2 Ų52.234%0.34427%0.27SS..Hα-helixtrans-62-42.2176.9-58.50000111N184 K185 W186 Y192 Y206N184-T188 WeakPolarHBondContact O-CB 3.45Å; N184-T188 PolarHBondContact O-N 2.57Å; N184-T188 PolarHBondContact O-OG1 2.65Å; K185-T188 WeakPolarHBondContact O-CB 3.45Å; K185-T188 PolarHBondContact O-N 3.43Å; W186-T188 VanDerWaalsContact C-N 3.31Å; W186-T188 PolarHBondContact O-N 3.38Å; T188-Y192 WeakPolarHBondContact O-CB 3.21Å; T188-Y192 PolarHBondContact O-N 3.03Å; T188-Y206 HydrophobicContact CG2-CD1 3.76Å; T188-Y206 HydrophobicContact CG2-CE1 3.68Å
189F98.6Very high96.9Very high0 Ų055 Ų550%027%0.272CS..Hα-helixtrans-56.9-48.5172.6166.5-104.6000111.8F75 I86 L87 K185 W186 N187 Y192 L193 L203 L207F75-F189 HydrophobicContact CZ-CZ 4.48Å; I86-F189 HydrophobicContact CD1-CE2 3.94Å; I86-F189 HydrophobicContact CD1-CZ 4.4Å; I86-F189 HydrophobicContact CG1-CE2 4.43Å; I86-F189 HydrophobicContact CG1-CZ 4.4Å; L87-F189 HydrophobicContact CD1-CE1 4.16Å; L87-F189 HydrophobicContact CD1-CZ 4.48Å; L87-F189 HydrophobicContact CD2-CE1 3.89Å; L87-F189 HydrophobicContact CD2-CZ 4.19Å; L87-F189 HydrophobicContact CG-CE1 4.26Å; L87-F189 HydrophobicContact CG-CZ 4.3Å; K185-F189 PolarHBondContact O-N 3.49Å; W186-F189 HydrophobicContact CE3-CD1 4.18Å; W186-F189 HydrophobicContact CZ3-CD1 4.33Å; W186-F189 WeakPolarHBondContact O-CB 3.28Å; W186-F189 PolarHBondContact O-N 2.88Å; N187-F189 VanDerWaalsContact C-N 3.32Å; N187-F189 PolarHBondContact O-N 2.92Å; F189-Y192 PolarHBondContact O-N 3.23Å; F189-L193 HydrophobicContact CE1-CD2 4.45Å; F189-L193 HydrophobicContact CZ-CD2 4.38Å; F189-L193 WeakPolarHBondContact O-CB 3.39Å; F189-L193 PolarHBondContact O-N 3.23Å; F189-L203 HydrophobicContact CD2-CD2 4.26Å; F189-L203 HydrophobicContact CE2-CB 4.35Å; F189-L203 HydrophobicContact CE2-CD2 3.85Å; F189-L207 HydrophobicContact CD2-CB 4.14Å; F189-L207 HydrophobicContact CE2-CB 4.08Å
190Y98.5Very high96.9Very high0 Ų055.4 Ų55.40%027%0.274CS..Hα-helixtrans-68.6-41.3-178.8-69.1-47.9000113.9L67 T71 L87 P139 A142 A143 S146 I148 W186 N187 Y192 L193 Q194L67-Y190 HydrophobicContact CD1-CE1 4.01Å; L67-Y190 VanDerWaalsContact CD1-OH 3.29Å; L67-Y190 WeakPolarHBondContact CD1-OH 3.46Å; T71-Y190 HydrophobicContact CG2-CE1 4.38Å; L87-Y190 HydrophobicContact CD1-CE1 4.34Å; P139-Y190 VanDerWaalsContact O-CE2 3.3Å; P139-Y190 WeakPolarHBondContact O-CE2 3.34Å; P139-Y190 PolarHBondContact O-OH 3.07Å; A142-Y190 HydrophobicContact CB-CD2 4.27Å; A142-Y190 HydrophobicContact CB-CE2 3.9Å; A143-Y190 HydrophobicContact CB-CD2 4.29Å; A143-Y190 HydrophobicContact CB-CE1 4.23Å; A143-Y190 HydrophobicContact CB-CE2 3.73Å; A143-Y190 VanDerWaalsContact N-CE2 3.31Å; S146-Y190 WeakPolarHBondContact OG-CB 3.46Å; I148-Y190 HydrophobicContact CD1-CD1 3.36Å; I148-Y190 HydrophobicContact CD1-CE1 4.29Å; I148-Y190 HydrophobicContact CD1-CG 3.66Å; W186-Y190 HydrophobicContact CB-CE2 4.33Å; W186-Y190 HydrophobicContact CE3-CE2 4.4Å; W186-Y190 WeakPolarHBondContact O-CD2 3.4Å; W186-Y190 PolarHBondContact O-N 3.14Å; N187-Y190 PolarHBondContact O-N 3.46Å; Y190-Y192 VanDerWaalsContact C-N 3.32Å; Y190-Y192 PolarHBondContact O-N 3.25Å; Y190-L193 HydrophobicContact CD1-CD2 4.42Å; Y190-L193 WeakPolarHBondContact O-CB 3.18Å; Y190-L193 PolarHBondContact O-N 2.84Å; Y190-Q194 WeakPolarHBondContact O-CG 3.31Å; Y190-Q194 PolarHBondContact O-N 3.5Å
191Q96.9Very high96.8Very high120 Ų12055.7 Ų55.756%0.56128%0.276SS*.Hα-helixtrans-61-43.3173.8-72.9173.3-6.400111.2N187 Q194 S195N187-Q191 WeakPolarHBondContact O-CB 3.28Å; N187-Q191 VanDerWaalsContact O-CG 3.3Å; N187-Q191 WeakPolarHBondContact O-CG 3.4Å; N187-Q191 PolarHBondContact O-N 3.04Å; Q191-Q194 PolarHBondContact O-N 3.39Å; Q191-S195 PolarHBondContact O-N 3.17Å
192Y97.8Very high96.8Very high42 Ų4251.2 Ų51.217%0.16526%0.257CS..Hα-helixtrans-66-40.1175.3-172.1-103.6000111.3T188 F189 Y190 Q194 S195 S198 K199 D202 L203 Y206T188-Y192 WeakPolarHBondContact O-CB 3.21Å; T188-Y192 PolarHBondContact O-N 3.03Å; F189-Y192 PolarHBondContact O-N 3.23Å; Y190-Y192 VanDerWaalsContact C-N 3.32Å; Y190-Y192 PolarHBondContact O-N 3.25Å; Y192-Q194 VanDerWaalsContact C-N 3.28Å; Y192-Q194 PolarHBondContact O-N 3.29Å; Y192-S195 WeakPolarHBondContact O-CB 3.46Å; Y192-S195 PolarHBondContact O-N 2.93Å; Y192-S198 WeakPolarHBondContact O-CB 3.37Å; Y192-K199 PolarHBondContact OH-N 3.26Å; Y192-K199 VanDerWaalsContact OH-N 3.08Å; Y192-D202 HydrophobicContact CE1-CB 3.51Å; Y192-D202 VanDerWaalsContact OH-CB 3.26Å; Y192-D202 WeakPolarHBondContact OH-CB 3.39Å; Y192-D202 PolarHBondContact OH-OD2 2.71Å; Y192-D202 VanDerWaalsContact OH-OD2 3.12Å; Y192-L203 HydrophobicContact CD1-CD2 3.62Å; Y192-L203 HydrophobicContact CD1-CG 3.96Å; Y192-L203 HydrophobicContact CE1-CD2 4.19Å; Y192-L203 HydrophobicContact CE1-CG 4.01Å; Y192-Y206 AromaticContact CD1-CD2 3.59Å; Y192-Y206 HydrophobicContact CD1-CD2 3.59Å; Y192-Y206 AromaticContact CD1-CE2 3.63Å; Y192-Y206 HydrophobicContact CD1-CE2 3.63Å; Y192-Y206 HydrophobicContact CD2-CD2 4.47Å; Y192-Y206 AromaticContact CD2-CE2 3.76Å; Y192-Y206 HydrophobicContact CD2-CE2 3.76Å; Y192-Y206 HydrophobicContact CE1-CD2 4.23Å; Y192-Y206 HydrophobicContact CE1-CE2 4.06Å; Y192-Y206 HydrophobicContact CE2-CE2 4.15Å; Y192-Y206 AromaticContact CG-CD2 3.74Å; Y192-Y206 HydrophobicContact CG-CD2 3.74Å; Y192-Y206 AromaticContact CG-CE2 3.48Å; Y192-Y206 HydrophobicContact CG-CE2 3.48Å; Y192-Y206 VanDerWaalsContact CG-CE2 3.48Å
193L97.3Very high96.8Very high2 Ų251.2 Ų51.21%0.0126%0.257CS..Hα-helixtrans-56.9-40.5175.7-179.663.4000112.8T71 Y74 F75 I148 F189 Y190 S195 L203T71-L193 HydrophobicContact CG2-CD2 3.81Å; Y74-L193 HydrophobicContact CD2-CD2 4.01Å; Y74-L193 HydrophobicContact CD2-CG 4.03Å; Y74-L193 HydrophobicContact CG-CD1 4.39Å; Y74-L193 HydrophobicContact CG-CD2 4.38Å; Y74-L193 HydrophobicContact CG-CG 3.91Å; F75-L193 HydrophobicContact CD2-CD1 4.03Å; F75-L193 HydrophobicContact CE1-CD1 4.34Å; F75-L193 HydrophobicContact CE2-CD1 3.46Å; F75-L193 VanDerWaalsContact CE2-CD1 3.46Å; F75-L193 HydrophobicContact CE2-CD2 3.8Å; F75-L193 HydrophobicContact CE2-CG 4.29Å; F75-L193 HydrophobicContact CZ-CD1 3.62Å; F75-L193 HydrophobicContact CZ-CD2 4.45Å; I148-L193 HydrophobicContact CD1-CD2 4.34Å; F189-L193 HydrophobicContact CE1-CD2 4.45Å; F189-L193 HydrophobicContact CZ-CD2 4.38Å; F189-L193 WeakPolarHBondContact O-CB 3.39Å; F189-L193 PolarHBondContact O-N 3.23Å; Y190-L193 HydrophobicContact CD1-CD2 4.42Å; Y190-L193 WeakPolarHBondContact O-CB 3.18Å; Y190-L193 PolarHBondContact O-N 2.84Å; L193-S195 PolarHBondContact O-N 3.39Å; L193-L203 HydrophobicContact CB-CD2 3.87Å; L193-L203 HydrophobicContact CD1-CD1 3.99Å; L193-L203 HydrophobicContact CD1-CD2 3.82Å; L193-L203 HydrophobicContact CG-CD2 4.47Å
194Q95.2Very high96.8Very high72 Ų7251.3 Ų51.334%0.33626%0.257SS..Hα-helixtrans-68.8-18.5176.9-70.1173-39.800113.6Y74 I148 Y190 Q191 Y192Y74-Q194 HydrophobicContact CE1-CB 4.22Å; Y74-Q194 HydrophobicContact CE1-CG 3.83Å; Y74-Q194 HydrophobicContact CE2-CG 4.38Å; I148-Q194 HydrophobicContact CD1-CG 4.28Å; I148-Q194 HydrophobicContact CG1-CG 4.19Å; Y190-Q194 WeakPolarHBondContact O-CG 3.31Å; Y190-Q194 PolarHBondContact O-N 3.5Å; Q191-Q194 PolarHBondContact O-N 3.39Å; Y192-Q194 VanDerWaalsContact C-N 3.28Å; Y192-Q194 PolarHBondContact O-N 3.29Å
195S94.8Very high96.8Very high35 Ų3552.8 Ų52.825%0.24526%0.26CS..SBendtrans-68.3134179.1-179.50000111.7Q191 Y192 L193 F197 S198Q191-S195 PolarHBondContact O-N 3.17Å; Y192-S195 WeakPolarHBondContact O-CB 3.46Å; Y192-S195 PolarHBondContact O-N 2.93Å; L193-S195 PolarHBondContact O-N 3.39Å; S195-F197 PolarHBondContact O-N 3.35Å; S195-F197 PolarHBondContact OG-N 3.45Å; S195-S198 WeakPolarHBondContact O-CB 3.19Å; S195-S198 PolarHBondContact O-N 3.34Å; S195-S198 VanDerWaalsContact O-N 3.14Å; S195-S198 PolarHBondContact O-OG 3.47Å
196P90.8Very high96.8Very high104 Ų10453.9 Ų53.968%0.67526%0.263SS*.THydrogen-bonded Turntrans-61.9-26.1175.325.9-33.6000112K77 S198K77-P196 PolarHBondContact NZ-O 3.39Å; P196-S198 VanDerWaalsContact C-N 3.32Å; P196-S198 PolarHBondContact O-N 2.84Å
197F92.3Very high96.8Very high169 Ų16954.2 Ų54.274%0.74127%0.265SS*.THydrogen-bonded Turntrans-886.3-179-54.9-69.3000114.1S195 K199S195-F197 PolarHBondContact O-N 3.35Å; S195-F197 PolarHBondContact OG-N 3.45Å; F197-K199 PolarHBondContact O-N 2.98Å
198S94.6Very high96.8Very high6 Ų654.4 Ų54.44%0.04227%0.265CS..  trans-62.9130.1-177.6630000112.2K77 Y192 S195 P196K77-S198 WeakPolarHBondContact CE-O 3.45Å; K77-S198 WeakPolarHBondContact CE-OG 3.46Å; K77-S198 PolarHBondContact NZ-O 3.3Å; K77-S198 PolarHBondContact NZ-OG 3.04Å; Y192-S198 WeakPolarHBondContact O-CB 3.37Å; S195-S198 WeakPolarHBondContact O-CB 3.19Å; S195-S198 PolarHBondContact O-N 3.34Å; S195-S198 VanDerWaalsContact O-N 3.14Å; S195-S198 PolarHBondContact O-OG 3.47Å; P196-S198 VanDerWaalsContact C-N 3.32Å; P196-S198 PolarHBondContact O-N 2.84Å
199K96.6Very high96.8Very high136 Ų13653.9 Ų53.959%0.59127%0.266SS*.  trans-103.4146.8177.3-62.2179.7-176.2175.30109.9Y192 F197 D201 D202 L203Y192-K199 PolarHBondContact OH-N 3.26Å; Y192-K199 VanDerWaalsContact OH-N 3.08Å; F197-K199 PolarHBondContact O-N 2.98Å; K199-D201 PolarHBondContact O-N 3.25Å; K199-D202 HydrophobicContact CB-CB 4.36Å; K199-D202 PolarHBondContact O-N 2.92Å; K199-L203 WeakPolarHBondContact O-CG 3.26Å; K199-L203 PolarHBondContact O-N 2.89Å
200F96.3Very high96.8Very high39 Ų3953.9 Ų53.917%0.17127%0.266CS..Hα-helixtrans-57.7-46.7-178.1-168.4-97.5000112.6F78 Q84 I86 D202 L203 L204 P253 T255F78-F200 HydrophobicContact CD1-CB 4.2Å; F78-F200 HydrophobicContact CD1-CD2 4.17Å; F78-F200 HydrophobicContact CD2-CD2 4.15Å; F78-F200 HydrophobicContact CE1-CB 3.83Å; F78-F200 HydrophobicContact CE1-CD2 4.37Å; F78-F200 HydrophobicContact CE2-CD2 4.35Å; F78-F200 HydrophobicContact CG-CD2 4.05Å; F78-F200 HydrophobicContact CZ-CB 4.18Å; F78-F200 HydrophobicContact CZ-CD2 4.44Å; Q84-F200 HydrophobicContact CB-CE2 4.32Å; Q84-F200 WeakPolarHBondContact O-CE2 3.44Å; I86-F200 HydrophobicContact CG2-CE1 4.41Å; I86-F200 HydrophobicContact CG2-CE2 3.61Å; I86-F200 HydrophobicContact CG2-CZ 3.52Å; F200-D202 VanDerWaalsContact C-N 3.34Å; F200-D202 PolarHBondContact O-N 3.14Å; F200-L203 WeakPolarHBondContact O-CB 3.27Å; F200-L203 PolarHBondContact O-N 3.28Å; F200-L204 HydrophobicContact CD1-CD1 3.79Å; F200-L204 HydrophobicContact CD1-CG 4.4Å; F200-L204 HydrophobicContact CE1-CD1 3.61Å; F200-L204 HydrophobicContact CE1-CG 4.23Å; F200-L204 WeakPolarHBondContact O-CG 3.45Å; F200-L204 PolarHBondContact O-N 2.78Å; F200-P253 HydrophobicContact CE1-CB 4.07Å; F200-P253 HydrophobicContact CE1-CG 4.37Å; F200-P253 HydrophobicContact CZ-CB 4.3Å; F200-T255 HydrophobicContact CE2-CG2 4.42Å; F200-T255 HydrophobicContact CZ-CG2 3.81Å
201D96.3Very high96.9Very high106 Ų10655.1 Ų55.157%0.56727%0.272SS*.Hα-helixtrans-65.8-35.3-179.9-64.3-14000113K199 L204 K205K199-D201 PolarHBondContact O-N 3.25Å; D201-L204 WeakPolarHBondContact O-CB 3.07Å; D201-L204 PolarHBondContact O-N 3.02Å; D201-K205 WeakPolarHBondContact O-CG 3.47Å; D201-K205 PolarHBondContact O-N 3.18Å; D201-K205 VanDerWaalsContact O-N 3.14Å
202D97.7Very high96.9Very high40 Ų4051 Ų5121%0.21426%0.255CS..Hα-helixtrans-72.6-37176.7-68.1-30.3000110.9Y192 K199 F200 L204 K205 Y206Y192-D202 HydrophobicContact CE1-CB 3.51Å; Y192-D202 VanDerWaalsContact OH-CB 3.26Å; Y192-D202 WeakPolarHBondContact OH-CB 3.39Å; Y192-D202 PolarHBondContact OH-OD2 2.71Å; Y192-D202 VanDerWaalsContact OH-OD2 3.12Å; K199-D202 HydrophobicContact CB-CB 4.36Å; K199-D202 PolarHBondContact O-N 2.92Å; F200-D202 VanDerWaalsContact C-N 3.34Å; F200-D202 PolarHBondContact O-N 3.14Å; D202-L204 VanDerWaalsContact C-N 3.28Å; D202-L204 PolarHBondContact O-N 3.1Å; D202-K205 WeakPolarHBondContact O-CB 3.47Å; D202-K205 PolarHBondContact O-N 2.87Å; D202-K205 VanDerWaalsContact O-N 3.14Å; D202-K205 IonicContact OD1-NZ 3.68Å; D202-K205 PolarHBondContact OD1-NZ 3.14Å; D202-Y206 HydrophobicContact CB-CE2 4.46Å; D202-Y206 WeakPolarHBondContact O-CD2 3.43Å; D202-Y206 PolarHBondContact O-N 3.26Å
203L98.4Very high96.9Very high0 Ų049.6 Ų49.60%025%0.251CS..Hα-helixtrans-59.1-40.5171-73.8167.5000111.7F75 F78 I86 F189 Y192 L193 K199 F200 Y206 L207F75-L203 HydrophobicContact CE1-CD1 4.23Å; F78-L203 HydrophobicContact CE2-CD1 3.72Å; F78-L203 HydrophobicContact CZ-CD1 3.89Å; I86-L203 HydrophobicContact CD1-CB 3.77Å; F189-L203 HydrophobicContact CD2-CD2 4.26Å; F189-L203 HydrophobicContact CE2-CB 4.35Å; F189-L203 HydrophobicContact CE2-CD2 3.85Å; Y192-L203 HydrophobicContact CD1-CD2 3.62Å; Y192-L203 HydrophobicContact CD1-CG 3.96Å; Y192-L203 HydrophobicContact CE1-CD2 4.19Å; Y192-L203 HydrophobicContact CE1-CG 4.01Å; L193-L203 HydrophobicContact CB-CD2 3.87Å; L193-L203 HydrophobicContact CD1-CD1 3.99Å; L193-L203 HydrophobicContact CD1-CD2 3.82Å; L193-L203 HydrophobicContact CG-CD2 4.47Å; K199-L203 WeakPolarHBondContact O-CG 3.26Å; K199-L203 PolarHBondContact O-N 2.89Å; F200-L203 WeakPolarHBondContact O-CB 3.27Å; F200-L203 PolarHBondContact O-N 3.28Å; L203-Y206 PolarHBondContact O-N 3.31Å; L203-L207 VanDerWaalsContact O-CB 3.32Å; L203-L207 WeakPolarHBondContact O-CB 3.48Å; L203-L207 PolarHBondContact O-N 3.21Å
204L98.4Very high97Very high2 Ų249.5 Ų49.51%0.0125%0.251CS..Hα-helixtrans-62.3-41.2174.4-71.5168.4000112I86 F200 D201 D202 L207 W208 L251 P253I86-L204 HydrophobicContact CB-CD2 4.14Å; I86-L204 HydrophobicContact CD1-CD2 3.96Å; I86-L204 HydrophobicContact CD1-CG 4.3Å; I86-L204 HydrophobicContact CG2-CD2 3.75Å; I86-L204 HydrophobicContact CG2-CG 4.45Å; F200-L204 HydrophobicContact CD1-CD1 3.79Å; F200-L204 HydrophobicContact CD1-CG 4.4Å; F200-L204 HydrophobicContact CE1-CD1 3.61Å; F200-L204 HydrophobicContact CE1-CG 4.23Å; F200-L204 WeakPolarHBondContact O-CG 3.45Å; F200-L204 PolarHBondContact O-N 2.78Å; D201-L204 WeakPolarHBondContact O-CB 3.07Å; D201-L204 PolarHBondContact O-N 3.02Å; D202-L204 VanDerWaalsContact C-N 3.28Å; D202-L204 PolarHBondContact O-N 3.1Å; L204-L207 PolarHBondContact O-N 2.85Å; L204-W208 WeakPolarHBondContact O-CB 3.36Å; L204-W208 PolarHBondContact O-N 3.35Å; L204-L251 HydrophobicContact CB-CB 4.2Å; L204-P253 HydrophobicContact CD1-CB 4.25Å; L204-P253 HydrophobicContact CD1-CG 3.93Å; L204-P253 HydrophobicContact CD2-CB 4.31Å
205K98.4Very high97.1Very high104 Ų10446.6 Ų46.645%0.45224%0.237SC..Hα-helixtrans-59.8-48176.2-67169.1-164.9161.50111.5D201 D202 A209 L251D201-K205 WeakPolarHBondContact O-CG 3.47Å; D201-K205 PolarHBondContact O-N 3.18Å; D201-K205 VanDerWaalsContact O-N 3.14Å; D202-K205 WeakPolarHBondContact O-CB 3.47Å; D202-K205 PolarHBondContact O-N 2.87Å; D202-K205 VanDerWaalsContact O-N 3.14Å; D202-K205 IonicContact OD1-NZ 3.68Å; D202-K205 PolarHBondContact OD1-NZ 3.14Å; K205-A209 VanDerWaalsContact O-CB 3.28Å; K205-A209 WeakPolarHBondContact O-CB 3.43Å; K205-A209 PolarHBondContact O-N 3.19Å; K205-L251 HydrophobicContact CB-CD2 4.28Å; K205-L251 HydrophobicContact CD-CD1 4.44Å; K205-L251 HydrophobicContact CG-CD1 3.61Å; K205-L251 HydrophobicContact CG-CD2 3.74Å; K205-L251 HydrophobicContact CG-CG 4.35Å
206Y98.7Very high97.2Very high89 Ų8948.5 Ų48.535%0.34926%0.255SS..Hα-helixtrans-68.2-41-179.5-67.7-60.9000112.3T188 Y192 D202 L203 A209 A210T188-Y206 HydrophobicContact CG2-CD1 3.76Å; T188-Y206 HydrophobicContact CG2-CE1 3.68Å; Y192-Y206 AromaticContact CD1-CD2 3.59Å; Y192-Y206 HydrophobicContact CD1-CD2 3.59Å; Y192-Y206 AromaticContact CD1-CE2 3.63Å; Y192-Y206 HydrophobicContact CD1-CE2 3.63Å; Y192-Y206 HydrophobicContact CD2-CD2 4.47Å; Y192-Y206 AromaticContact CD2-CE2 3.76Å; Y192-Y206 HydrophobicContact CD2-CE2 3.76Å; Y192-Y206 HydrophobicContact CE1-CD2 4.23Å; Y192-Y206 HydrophobicContact CE1-CE2 4.06Å; Y192-Y206 HydrophobicContact CE2-CE2 4.15Å; Y192-Y206 AromaticContact CG-CD2 3.74Å; Y192-Y206 HydrophobicContact CG-CD2 3.74Å; Y192-Y206 AromaticContact CG-CE2 3.48Å; Y192-Y206 HydrophobicContact CG-CE2 3.48Å; Y192-Y206 VanDerWaalsContact CG-CE2 3.48Å; D202-Y206 HydrophobicContact CB-CE2 4.46Å; D202-Y206 WeakPolarHBondContact O-CD2 3.43Å; D202-Y206 PolarHBondContact O-N 3.26Å; L203-Y206 PolarHBondContact O-N 3.31Å; Y206-A209 PolarHBondContact O-N 3.26Å; Y206-A210 PolarHBondContact O-N 2.98Å
207L98.8Very high97.4Very high6 Ų646.6 Ų46.63%0.03124%0.239CC..Hα-helixtrans-58-53.1174.2174.667.9000110.7I86 L87 W186 F189 L203 L204 A209 A210 H211 T254I86-L207 HydrophobicContact CB-CD2 3.84Å; I86-L207 HydrophobicContact CD1-CB 3.89Å; I86-L207 HydrophobicContact CD1-CD2 3.71Å; I86-L207 HydrophobicContact CD1-CG 4.39Å; I86-L207 HydrophobicContact CG1-CD2 3.77Å; I86-L207 WeakPolarHBondContact O-CD2 3.22Å; L87-L207 HydrophobicContact CD2-CD1 3.82Å; W186-L207 HydrophobicContact CH2-CD1 3.71Å; W186-L207 HydrophobicContact CZ3-CD1 3.62Å; F189-L207 HydrophobicContact CD2-CB 4.14Å; F189-L207 HydrophobicContact CE2-CB 4.08Å; L203-L207 VanDerWaalsContact O-CB 3.32Å; L203-L207 WeakPolarHBondContact O-CB 3.48Å; L203-L207 PolarHBondContact O-N 3.21Å; L204-L207 PolarHBondContact O-N 2.85Å; L207-A209 VanDerWaalsContact C-N 3.33Å; L207-A209 PolarHBondContact O-N 3.3Å; L207-A210 PolarHBondContact O-N 3.41Å; L207-H211 WeakPolarHBondContact O-CB 3.34Å; L207-H211 PolarHBondContact O-N 2.88Å; L207-T254 VanDerWaalsContact CD2-OG1 3.25Å; L207-T254 WeakPolarHBondContact CD2-OG1 3.4Å
208W98.6Very high97.6Very high15 Ų1538.6 Ų38.66%0.05720%0.204CC..Hα-helixtrans-65.4-37.2-176.8-81.9119.5000112.2L204 A210 H211 T212 V244 L247 A248 F252 T254L204-W208 WeakPolarHBondContact O-CB 3.36Å; L204-W208 PolarHBondContact O-N 3.35Å; W208-A210 PolarHBondContact O-N 3.5Å; W208-H211 HydrophobicContact CE3-CB 4.24Å; W208-H211 PolarHBondContact O-N 3.22Å; W208-T212 WeakPolarHBondContact O-CG2 3.34Å; W208-T212 PolarHBondContact O-N 2.71Å; W208-T212 PolarHBondContact O-OG1 3.38Å; W208-V244 HydrophobicContact CZ3-CG1 3.8Å; W208-L247 HydrophobicContact CH2-CB 3.85Å; W208-L247 HydrophobicContact CZ2-CB 4.02Å; W208-A248 HydrophobicContact CB-CB 3.92Å; W208-A248 VanDerWaalsContact CD2-CA 3.44Å; W208-A248 HydrophobicContact CD2-CB 3.71Å; W208-A248 HydrophobicContact CE3-CB 3.48Å; W208-A248 VanDerWaalsContact CE3-CB 3.48Å; W208-A248 HydrophobicContact CG-CB 3.94Å; W208-A248 HydrophobicContact CZ3-CB 4.22Å; W208-F252 HydrophobicContact CZ2-CB 4.01Å; W208-F252 WeakPolarHBondContact CZ2-O 3.37Å; W208-F252 PolarHBondContact NE1-O 3.33Å; W208-T254 HydrophobicContact CH2-CG2 4.06Å; W208-T254 HydrophobicContact CZ2-CG2 3.6Å
209A98.8Very high97.6Very high44 Ų4439.6 Ų39.636%0.36421%0.209SC..Hα-helixtrans-61.7-41.1173.500000112.6K185 K205 Y206 L207 S213K185-A209 WeakPolarHBondContact CD-O 3.49Å; K205-A209 VanDerWaalsContact O-CB 3.28Å; K205-A209 WeakPolarHBondContact O-CB 3.43Å; K205-A209 PolarHBondContact O-N 3.19Å; Y206-A209 PolarHBondContact O-N 3.26Å; L207-A209 VanDerWaalsContact C-N 3.33Å; L207-A209 PolarHBondContact O-N 3.3Å; A209-S213 WeakPolarHBondContact O-CB 3.44Å; A209-S213 PolarHBondContact O-N 3.18Å
210A98.8Very high97.4Very high0 Ų041 Ų410%022%0.215CC..Hα-helixtrans-71.6-40.7177.300000112.1K185 W186 Y206 L207 W208 T214K185-A210 HydrophobicContact CB-CB 3.9Å; W186-A210 HydrophobicContact CB-CB 4.44Å; W186-A210 HydrophobicContact CD2-CB 3.5Å; W186-A210 VanDerWaalsContact CD2-CB 3.5Å; W186-A210 HydrophobicContact CE3-CB 3.86Å; W186-A210 HydrophobicContact CG-CB 3.78Å; W186-A210 HydrophobicContact CH2-CB 4.44Å; W186-A210 HydrophobicContact CZ2-CB 4.14Å; W186-A210 HydrophobicContact CZ3-CB 4.31Å; Y206-A210 PolarHBondContact O-N 2.98Å; L207-A210 PolarHBondContact O-N 3.41Å; W208-A210 PolarHBondContact O-N 3.5Å; A210-T214 PolarHBondContact O-N 3.4Å; A210-T214 PolarHBondContact O-OG1 3.37Å
211H98.6Very high97.2Very high27 Ų2742.4 Ų42.413%0.12523%0.23CC..Hα-helixtrans-64.4-50178.9-173.7-62.1000112.3L207 W208 S213 T214 L215L207-H211 WeakPolarHBondContact O-CB 3.34Å; L207-H211 PolarHBondContact O-N 2.88Å; W208-H211 HydrophobicContact CE3-CB 4.24Å; W208-H211 PolarHBondContact O-N 3.22Å; H211-S213 VanDerWaalsContact C-N 3.33Å; H211-S213 PolarHBondContact O-N 2.84Å; H211-T214 WeakPolarHBondContact O-CB 3.42Å; H211-T214 PolarHBondContact O-N 2.99Å; H211-L215 PolarHBondContact O-N 3.45Å
212T98.2Very high97.2Very high34 Ų3437.5 Ų37.521%0.20920%0.203CC..Hα-helixtrans-69.1-33.6179.856.10000111.8W208 T214 L215 A216 A248W208-T212 WeakPolarHBondContact O-CG2 3.34Å; W208-T212 PolarHBondContact O-N 2.71Å; W208-T212 PolarHBondContact O-OG1 3.38Å; T212-T214 VanDerWaalsContact C-N 3.31Å; T212-T214 PolarHBondContact O-N 3.34Å; T212-L215 PolarHBondContact O-N 3.14Å; T212-A216 WeakPolarHBondContact O-CB 3.15Å; T212-A216 PolarHBondContact O-N 3.49Å; T212-A248 HydrophobicContact CG2-CB 3.48Å; T212-A248 VanDerWaalsContact CG2-CB 3.48Å
213S98.5Very high97Very high12 Ų1240.6 Ų40.68%0.08422%0.216CC..Hα-helixtrans-61-40.3171-166.30000112T182 K185 A209 H211 L215 A216 D217T182-S213 WeakPolarHBondContact OG1-CB 3.28Å; T182-S213 PolarHBondContact OG1-O 2.68Å; T182-S213 PolarHBondContact OG1-OG 3.32Å; K185-S213 PolarHBondContact NZ-OG 3.02Å; A209-S213 WeakPolarHBondContact O-CB 3.44Å; A209-S213 PolarHBondContact O-N 3.18Å; H211-S213 VanDerWaalsContact C-N 3.33Å; H211-S213 PolarHBondContact O-N 2.84Å; S213-L215 VanDerWaalsContact C-N 3.34Å; S213-L215 PolarHBondContact O-N 3.27Å; S213-A216 PolarHBondContact O-N 2.93Å; S213-D217 WeakPolarHBondContact O-CB 3.39Å; S213-D217 PolarHBondContact O-N 3.42Å
214T98.6Very high96.7Very high0 Ų044.3 Ų44.30%024%0.236CC..Hα-helixtrans-59.1-45.5175.2-58.30000111.4F134 L135 L138 T182 W186 A210 H211 T212 T218F134-T214 HydrophobicContact CB-CG2 3.74Å; L135-T214 HydrophobicContact CD2-CG2 3.72Å; L135-T214 HydrophobicContact CG-CG2 4.13Å; L138-T214 HydrophobicContact CD1-CG2 3.87Å; T182-T214 VanDerWaalsContact CG2-OG1 3.28Å; T182-T214 WeakPolarHBondContact CG2-OG1 3.19Å; W186-T214 PolarHBondContact NE1-OG1 3.16Å; A210-T214 PolarHBondContact O-N 3.4Å; A210-T214 PolarHBondContact O-OG1 3.37Å; H211-T214 WeakPolarHBondContact O-CB 3.42Å; H211-T214 PolarHBondContact O-N 2.99Å; T212-T214 VanDerWaalsContact C-N 3.31Å; T212-T214 PolarHBondContact O-N 3.34Å; T214-T218 WeakPolarHBondContact O-CB 3.38Å; T214-T218 VanDerWaalsContact O-CG2 3.24Å; T214-T218 WeakPolarHBondContact O-CG2 3.4Å; T214-T218 PolarHBondContact O-N 2.93Å; T214-T218 PolarHBondContact O-OG1 3.41Å
215L97.5Very high96.4Very high11 Ų1144.4 Ų44.46%0.05824%0.238CC..Hα-helixtrans-66.7-45.5177.5-71.2-178.1000112L131 L135 H211 T212 S213 D217 T218 I219 V244L131-L215 HydrophobicContact CD1-CD2 4.38Å; L135-L215 HydrophobicContact CD1-CD2 4.01Å; L135-L215 HydrophobicContact CG-CD2 4.47Å; H211-L215 PolarHBondContact O-N 3.45Å; T212-L215 PolarHBondContact O-N 3.14Å; S213-L215 VanDerWaalsContact C-N 3.34Å; S213-L215 PolarHBondContact O-N 3.27Å; L215-D217 VanDerWaalsContact C-N 3.29Å; L215-D217 PolarHBondContact O-N 2.89Å; L215-T218 PolarHBondContact O-N 3.22Å; L215-T218 PolarHBondContact O-OG1 3.48Å; L215-I219 HydrophobicContact CB-CD1 3.82Å; L215-I219 HydrophobicContact CD2-CD1 4.37Å; L215-I219 WeakPolarHBondContact O-CB 3.3Å; L215-I219 WeakPolarHBondContact O-CD1 3.39Å; L215-I219 WeakPolarHBondContact O-CG1 3.31Å; L215-I219 PolarHBondContact O-N 2.95Å; L215-V244 HydrophobicContact CD1-CB 4.2Å; L215-V244 HydrophobicContact CD1-CG1 3.72Å
216A96.4Very high96.2Very high75 Ų7539.9 Ų39.962%0.6222%0.218SC*.Hα-helixtrans-58.8-39.5-179.600000112.6T212 S213T212-A216 WeakPolarHBondContact O-CB 3.15Å; T212-A216 PolarHBondContact O-N 3.49Å; S213-A216 PolarHBondContact O-N 2.93Å
217D96.1Very high96.1Very high64 Ų6442.2 Ų42.234%0.34224%0.236SC..Hα-helixtrans-74.7-23.9-179.7-73.3-8.4000113.4F179 T182 S213 L215F179-D217 HydrophobicContact CD1-CB 3.89Å; F179-D217 HydrophobicContact CE1-CB 4.13Å; T182-D217 WeakPolarHBondContact CB-OD2 3.36Å; T182-D217 PolarHBondContact OG1-OD2 3.49Å; S213-D217 WeakPolarHBondContact O-CB 3.39Å; S213-D217 PolarHBondContact O-N 3.42Å; L215-D217 VanDerWaalsContact C-N 3.29Å; L215-D217 PolarHBondContact O-N 2.89Å
218T95.4Very high96Very high1 Ų146.8 Ų46.81%0.00625%0.254CS..Hα-helixtrans-110.4-35.4-165.557.10000113.8F134 F179 T214 L215 K220 S221 F222F134-T218 HydrophobicContact CB-CG2 3.82Å; F134-T218 HydrophobicContact CD1-CG2 3.75Å; F134-T218 HydrophobicContact CD2-CG2 3.6Å; F134-T218 HydrophobicContact CE1-CG2 4.21Å; F134-T218 HydrophobicContact CE2-CG2 4.1Å; F134-T218 HydrophobicContact CG-CG2 3.42Å; F134-T218 VanDerWaalsContact CG-CG2 3.42Å; F134-T218 HydrophobicContact CZ-CG2 4.37Å; F179-T218 HydrophobicContact CE1-CG2 3.98Å; F179-T218 HydrophobicContact CZ-CG2 4.33Å; T214-T218 WeakPolarHBondContact O-CB 3.38Å; T214-T218 VanDerWaalsContact O-CG2 3.24Å; T214-T218 WeakPolarHBondContact O-CG2 3.4Å; T214-T218 PolarHBondContact O-N 2.93Å; T214-T218 PolarHBondContact O-OG1 3.41Å; L215-T218 PolarHBondContact O-N 3.22Å; L215-T218 PolarHBondContact O-OG1 3.48Å; T218-K220 VanDerWaalsContact C-N 3.29Å; T218-K220 PolarHBondContact O-N 2.94Å; T218-K220 VanDerWaalsContact O-N 3.14Å; T218-S221 WeakPolarHBondContact O-CB 3.31Å; T218-S221 PolarHBondContact O-N 3.43Å; T218-F222 VanDerWaalsContact O-CD2 3.31Å; T218-F222 WeakPolarHBondContact O-CD2 3.45Å
219I94.1Very high95.9Very high26 Ų2647.2 Ų47.213%0.13326%0.256CS..G310 helixtrans-52.3-44.8-171.8-77.7165.2000113.4L131 L215 S221 F222 E223 V241L131-I219 HydrophobicContact CD1-CG1 3.73Å; L131-I219 HydrophobicContact CD2-CG1 4Å; L215-I219 HydrophobicContact CB-CD1 3.82Å; L215-I219 HydrophobicContact CD2-CD1 4.37Å; L215-I219 WeakPolarHBondContact O-CB 3.3Å; L215-I219 WeakPolarHBondContact O-CD1 3.39Å; L215-I219 WeakPolarHBondContact O-CG1 3.31Å; L215-I219 PolarHBondContact O-N 2.95Å; I219-S221 PolarHBondContact O-N 2.99Å; I219-F222 PolarHBondContact O-N 3Å; I219-F222 VanDerWaalsContact O-N 3.1Å; I219-E223 PolarHBondContact O-N 3.41Å; I219-V241 HydrophobicContact CD1-CB 4.1Å; I219-V241 HydrophobicContact CD1-CG1 3.28Å; I219-V241 HydrophobicContact CD1-CG2 3.63Å; I219-V241 HydrophobicContact CG1-CG2 4.39Å
220K92.9Very high95.9Very high167 Ų16746.3 Ų46.373%0.72625%0.247SC*.G310 helixtrans-60.9-29.8-176.3-171.2175.9177.9-1780112.7T218 F222T218-K220 VanDerWaalsContact C-N 3.29Å; T218-K220 PolarHBondContact O-N 2.94Å; T218-K220 VanDerWaalsContact O-N 3.14Å; K220-F222 PolarHBondContact O-N 2.99Å
221S93.1Very high95.7Very high68 Ų6855 Ų5548%0.47628%0.284SS..G310 helixtrans-76.1-10.1-177.9-58.90000113.8K167 T218 I219K167-S221 PolarHBondContact NZ-O 2.86Å; T218-S221 WeakPolarHBondContact O-CB 3.31Å; T218-S221 PolarHBondContact O-N 3.43Å; I219-S221 PolarHBondContact O-N 2.99Å
222F94.9Very high95.6Very high2 Ų255.1 Ų55.11%0.00929%0.287CS..G310 helixtrans-126.616.1-175.5-60.7-78.8000113W127 D130 L131 F134 K167 F168 T218 I219 K220 D224 G225W127-F222 VanDerWaalsContact CD1-O 3.23Å; D130-F222 HydrophobicContact CB-CD1 3.5Å; D130-F222 HydrophobicContact CB-CD2 4.36Å; D130-F222 HydrophobicContact CB-CE1 3.66Å; D130-F222 HydrophobicContact CB-CG 3.89Å; D130-F222 HydrophobicContact CB-CZ 4.19Å; D130-F222 WeakPolarHBondContact OD2-CD1 3.47Å; D130-F222 WeakPolarHBondContact OD2-CE1 3.4Å; L131-F222 HydrophobicContact CD2-CD2 4.1Å; F134-F222 HydrophobicContact CD2-CE2 4.23Å; F134-F222 AromaticContact CE2-CE2 3.41Å; F134-F222 HydrophobicContact CE2-CE2 3.41Å; F134-F222 VanDerWaalsContact CE2-CE2 3.41Å; F134-F222 AromaticContact CE2-CZ 3.64Å; F134-F222 HydrophobicContact CE2-CZ 3.64Å; F134-F222 HydrophobicContact CZ-CE2 4.16Å; F134-F222 HydrophobicContact CZ-CZ 4.23Å; K167-F222 HydrophobicContact CB-CE1 4.32Å; K167-F222 HydrophobicContact CB-CZ 4.12Å; K167-F222 HydrophobicContact CD-CD1 4.39Å; K167-F222 HydrophobicContact CD-CE1 3.76Å; K167-F222 HydrophobicContact CD-CZ 4.25Å; F168-F222 HydrophobicContact CD1-CZ 4.36Å; F168-F222 AromaticContact CE1-CE1 3.98Å; F168-F222 HydrophobicContact CE1-CE1 3.98Å; F168-F222 AromaticContact CE1-CZ 3.67Å; F168-F222 HydrophobicContact CE1-CZ 3.67Å; F168-F222 AromaticContact CZ-CE1 3.74Å; F168-F222 HydrophobicContact CZ-CE1 3.74Å; F168-F222 AromaticContact CZ-CZ 3.87Å; F168-F222 HydrophobicContact CZ-CZ 3.87Å; T218-F222 VanDerWaalsContact O-CD2 3.31Å; T218-F222 WeakPolarHBondContact O-CD2 3.45Å; I219-F222 PolarHBondContact O-N 3Å; I219-F222 VanDerWaalsContact O-N 3.1Å; K220-F222 PolarHBondContact O-N 2.99Å; F222-D224 VanDerWaalsContact C-OD1 3.23Å; F222-D224 VanDerWaalsContact CA-OD1 3.28Å; F222-D224 WeakPolarHBondContact CA-OD1 3.35Å; F222-D224 PolarHBondContact O-N 2.91Å; F222-G225 PolarHBondContact O-N 3.47Å
223E93.1Very high95.6Very high106 Ų10653.5 Ų53.550%0.49528%0.277SS..G310 helixtrans-62.1-25.5177.4-64.7-171.6144.800113I219 G225 Y226I219-E223 PolarHBondContact O-N 3.41Å; E223-G225 PolarHBondContact O-N 3.22Å; E223-Y226 HydrophobicContact CB-CD2 4.07Å; E223-Y226 HydrophobicContact CB-CE2 4.11Å; E223-Y226 HydrophobicContact CG-CE2 4.06Å; E223-Y226 WeakPolarHBondContact O-CB 3.28Å; E223-Y226 WeakPolarHBondContact O-CD2 3.38Å; E223-Y226 PolarHBondContact O-N 2.89Å
224D92.4Very high95.5Very high77 Ų7753.2 Ų53.241%0.41228%0.275SS..G310 helixtrans-59.2-30.2171.753.4-28.2000112.4K167 F222 Y226 D227K167-D224 IonicContact NZ-OD1 3.38Å; K167-D224 PolarHBondContact NZ-OD1 2.93Å; K167-D224 IonicContact NZ-OD2 3.48Å; K167-D224 PolarHBondContact NZ-OD2 3.21Å; F222-D224 VanDerWaalsContact C-OD1 3.23Å; F222-D224 VanDerWaalsContact CA-OD1 3.28Å; F222-D224 WeakPolarHBondContact CA-OD1 3.35Å; F222-D224 PolarHBondContact O-N 2.91Å; D224-Y226 PolarHBondContact O-N 3.37Å; D224-D227 PolarHBondContact O-N 2.86Å
225G92.8Very high95.4Very high4 Ų455.9 Ų55.94%0.04129%0.288CS..G310 helixtrans-61.6-25.4177.100000113.8F222 E223 D227 Y228 Y229F222-G225 PolarHBondContact O-N 3.47Å; E223-G225 PolarHBondContact O-N 3.22Å; G225-D227 PolarHBondContact O-N 3.16Å; G225-Y228 PolarHBondContact O-N 2.93Å; G225-Y229 VanDerWaalsContact O-CD2 3.22Å; G225-Y229 WeakPolarHBondContact O-CD2 3.36Å; G225-Y229 WeakPolarHBondContact O-CE2 3.36Å
226Y94.4Very high95.4Very high10 Ų1055.4 Ų55.44%0.03929%0.285CS..G310 helixtrans-62.1-28.5177.8-66.8-51.1000112.9W127 E223 D224 Y228 Y229 A234 E237 R238W127-Y226 AromaticContact CD1-CE1 3.88Å; W127-Y226 AromaticContact CD2-CE1 4Å; W127-Y226 HydrophobicContact CD2-CE1 4Å; W127-Y226 AromaticContact CE2-CE1 3.44Å; W127-Y226 VanDerWaalsContact CE2-CE1 3.44Å; W127-Y226 AromaticContact CE2-CZ 3.71Å; W127-Y226 HydrophobicContact CG-CD1 4.44Å; W127-Y226 HydrophobicContact CG-CE1 4.23Å; W127-Y226 AromaticContact CZ2-CE1 3.77Å; W127-Y226 HydrophobicContact CZ2-CE1 3.77Å; W127-Y226 AromaticContact CZ2-CZ 3.89Å; W127-Y226 VanDerWaalsContact CZ2-OH 3.29Å; W127-Y226 WeakPolarHBondContact CZ2-OH 3.26Å; W127-Y226 AromaticContact NE1-CE1 3.39Å; W127-Y226 AromaticContact NE1-CZ 3.38Å; W127-Y226 PolarHBondContact NE1-OH 3.12Å; E223-Y226 HydrophobicContact CB-CD2 4.07Å; E223-Y226 HydrophobicContact CB-CE2 4.11Å; E223-Y226 HydrophobicContact CG-CE2 4.06Å; E223-Y226 WeakPolarHBondContact O-CB 3.28Å; E223-Y226 WeakPolarHBondContact O-CD2 3.38Å; E223-Y226 PolarHBondContact O-N 2.89Å; D224-Y226 PolarHBondContact O-N 3.37Å; Y226-Y228 PolarHBondContact O-N 3.3Å; Y226-Y229 PolarHBondContact O-N 2.98Å; Y226-A234 HydrophobicContact CD1-CB 4.37Å; Y226-E237 HydrophobicContact CD1-CB 4.27Å; Y226-E237 WeakPolarHBondContact CD1-OE2 3.45Å; Y226-E237 HydrophobicContact CE1-CB 3.77Å; Y226-R238 HydrophobicContact CE1-CG 3.9Å; Y226-R238 HydrophobicContact CE2-CG 4.2Å; Y226-R238 VanDerWaalsContact CG-NH2 3.35Å
227D95.8Very high95.3Very high138 Ų13851.8 Ų51.874%0.73826%0.256SS*.G310 helixtrans-72.5-14.9-174.9-69.1-20.6000112.7D224 G225 Y229D224-D227 PolarHBondContact O-N 2.86Å; G225-D227 PolarHBondContact O-N 3.16Å; D227-Y229 VanDerWaalsContact C-N 3.31Å
228Y96.8Very high95.3Very high101 Ų10154.4 Ų54.440%0.39626%0.261SS..G310 helixtrans-84.4-5.9176.2-54.9-39.7000113.7P106 T107 D125 G225 Y226P106-Y228 HydrophobicContact CG-CD2 4.25Å; P106-Y228 HydrophobicContact CG-CG 4.32Å; T107-Y228 HydrophobicContact CG2-CD1 3.72Å; T107-Y228 HydrophobicContact CG2-CD2 4.05Å; T107-Y228 HydrophobicContact CG2-CE1 3.99Å; T107-Y228 HydrophobicContact CG2-CE2 4.3Å; T107-Y228 HydrophobicContact CG2-CG 3.75Å; D125-Y228 HydrophobicContact CB-CD2 4.33Å; D125-Y228 HydrophobicContact CB-CE2 4.23Å; D125-Y228 WeakPolarHBondContact O-CD2 3.19Å; G225-Y228 PolarHBondContact O-N 2.93Å; Y226-Y228 PolarHBondContact O-N 3.3Å
229Y97.7Very high95.2Very high24 Ų2454.4 Ų54.49%0.09426%0.261CS..SBendtrans-110.4162.7-176.4-66.7-83.1000112.5P106 S126 W127 G225 Y226 D227 E233 E237P106-Y229 HydrophobicContact CB-CD1 4.21Å; P106-Y229 HydrophobicContact CB-CE1 3.7Å; P106-Y229 HydrophobicContact CB-CE2 4.14Å; P106-Y229 HydrophobicContact CG-CE1 4.42Å; P106-Y229 HydrophobicContact CG-CE2 4.1Å; S126-Y229 WeakPolarHBondContact CA-OH 3.48Å; S126-Y229 PolarHBondContact OG-OH 3.4Å; W127-Y229 HydrophobicContact CB-CE2 3.84Å; G225-Y229 VanDerWaalsContact O-CD2 3.22Å; G225-Y229 WeakPolarHBondContact O-CD2 3.36Å; G225-Y229 WeakPolarHBondContact O-CE2 3.36Å; Y226-Y229 PolarHBondContact O-N 2.98Å; D227-Y229 VanDerWaalsContact C-N 3.31Å; Y229-E233 HydrophobicContact CD1-CB 4.44Å; Y229-E233 HydrophobicContact CD1-CG 3.75Å; Y229-E233 HydrophobicContact CE1-CG 4.47Å; Y229-E233 HydrophobicContact CG-CG 4.17Å; Y229-E237 WeakPolarHBondContact CD2-OE1 3.36Å; Y229-E237 WeakPolarHBondContact CE2-OE1 3.4Å
230S97.1Very high95.3Very high25 Ų2554.2 Ų54.218%0.17526%0.259CS..  trans-60.2154.216985.60000109.7T232 E233 A234 L271 N273S230-T232 PolarHBondContact O-N 3.43Å; S230-T232 VanDerWaalsContact O-N 3.17Å; S230-T232 PolarHBondContact OG-N 3.46Å; S230-E233 PolarHBondContact O-N 2.89Å; S230-E233 VanDerWaalsContact O-N 3.16Å; S230-E233 PolarHBondContact OG-N 3.33Å; S230-A234 WeakPolarHBondContact O-CB 3.17Å; S230-A234 PolarHBondContact O-N 3.26Å; S230-L271 PolarHBondContact OG-O 3.31Å; S230-N273 WeakPolarHBondContact CB-OD1 3.25Å
231K95.6Very high95.3Very high182 Ų18247.3 Ų47.379%0.79123%0.23SC*.Hα-helixtrans-59.4-32.7178-69.1-176.2-179.9177.80111.4H235 N273K231-H235 VanDerWaalsContact O-CB 3.31Å; K231-H235 WeakPolarHBondContact O-CB 3.47Å; K231-H235 PolarHBondContact O-N 3.21Å; K231-N273 PolarHBondContact N-OD1 3.39Å
232T96.7Very high95.3Very high30 Ų3045 Ų4518%0.18421%0.213CC..Hα-helixtrans-68.5-46.4177.6-52.20000111.7S230 H235 F236 L271 L272 N273 D275S230-T232 PolarHBondContact O-N 3.43Å; S230-T232 VanDerWaalsContact O-N 3.17Å; S230-T232 PolarHBondContact OG-N 3.46Å; T232-H235 PolarHBondContact O-N 3.24Å; T232-F236 PolarHBondContact O-N 3.33Å; T232-L271 HydrophobicContact CG2-CB 3.85Å; T232-L271 HydrophobicContact CG2-CD1 4.1Å; T232-L272 VanDerWaalsContact CB-O 3.28Å; T232-L272 WeakPolarHBondContact CB-O 3.31Å; T232-L272 PolarHBondContact OG1-O 3.27Å; T232-L272 VanDerWaalsContact OG1-O 3.12Å; T232-N273 WeakPolarHBondContact OG1-CA 3.43Å; T232-D275 HydrophobicContact CG2-CB 4.4Å
233E98.1Very high95.2Very high0 Ų045.2 Ų45.20%022%0.215CC..Hα-helixtrans-67.5-44.2177.1-177.869.8-169.300110.9R102 W128 Y229 S230 H235 F236 E237 I270 L271R102-E233 IonicContact CZ-OE1 3.25Å; R102-E233 VanDerWaalsContact CZ-OE1 3.26Å; R102-E233 IonicContact NE-OE1 3.37Å; R102-E233 PolarHBondContact NE-OE1 2.88Å; R102-E233 IonicContact NH2-OE1 3.82Å; R102-E233 PolarHBondContact NH2-OE1 2.94Å; R102-E233 IonicContact NH2-OE2 2.93Å; R102-E233 PolarHBondContact NH2-OE2 3.19Å; W128-E233 PolarHBondContact NE1-OE1 3.41Å; Y229-E233 HydrophobicContact CD1-CB 4.44Å; Y229-E233 HydrophobicContact CD1-CG 3.75Å; Y229-E233 HydrophobicContact CE1-CG 4.47Å; Y229-E233 HydrophobicContact CG-CG 4.17Å; S230-E233 PolarHBondContact O-N 2.89Å; S230-E233 VanDerWaalsContact O-N 3.16Å; S230-E233 PolarHBondContact OG-N 3.33Å; E233-H235 PolarHBondContact O-N 2.82Å; E233-F236 CarbonylContact O-C 3.56Å; E233-F236 WeakPolarHBondContact O-CA 3.38Å; E233-F236 WeakPolarHBondContact O-CB 3.26Å; E233-F236 PolarHBondContact O-N 3.45Å; E233-E237 HydrophobicContact CG-CG 4.44Å; E233-E237 WeakPolarHBondContact O-CG 3.38Å; E233-E237 PolarHBondContact O-N 2.61Å; E233-I270 HydrophobicContact CB-CG2 4.27Å; E233-I270 HydrophobicContact CG-CG2 4.02Å; E233-L271 HydrophobicContact CB-CB 4.17Å; E233-L271 VanDerWaalsContact OE2-CB 3.3Å; E233-L271 WeakPolarHBondContact OE2-CB 3.34Å; E233-L271 VanDerWaalsContact OE2-CG 3.32Å; E233-L271 WeakPolarHBondContact OE2-CG 3.49Å; E233-L271 PolarHBondContact OE2-N 2.93Å
234A96.6Very high95.2Very high6 Ų640.5 Ų40.55%0.0519%0.193CC..Hα-helixtrans-63.1-29178.200000112.8Y226 S230 E237 R238Y226-A234 HydrophobicContact CD1-CB 4.37Å; S230-A234 WeakPolarHBondContact O-CB 3.17Å; S230-A234 PolarHBondContact O-N 3.26Å; A234-E237 WeakPolarHBondContact CA-OE2 3.34Å; A234-R238 WeakPolarHBondContact O-CG 3.45Å; A234-R238 PolarHBondContact O-N 2.78Å; A234-R238 PolarHBondContact O-NH1 3.02Å
235H95.7Very high95.3Very high57 Ų5740.3 Ų40.326%0.26419%0.192SC..Hα-helixtrans-72.5-40.8171.2177.8-97.7000111.8K231 T232 E233 R238 S239 N299K231-H235 VanDerWaalsContact O-CB 3.31Å; K231-H235 WeakPolarHBondContact O-CB 3.47Å; K231-H235 PolarHBondContact O-N 3.21Å; T232-H235 PolarHBondContact O-N 3.24Å; E233-H235 PolarHBondContact O-N 2.82Å; H235-R238 PolarHBondContact O-N 3.24Å; H235-S239 PolarHBondContact CE1-OG 3.43Å; H235-S239 WeakPolarHBondContact O-CB 3.34Å; H235-S239 PolarHBondContact O-N 3.19Å; H235-S239 PolarHBondContact O-OG 2.79Å; H235-N299 PolarHBondContact NE2-OD1 3.17Å
236F96.9Very high95.2Very high0 Ų043 Ų430%020%0.201CC..Hα-helixtrans-62.3-42.2174.4167.9-113.1000112W96 W128 T232 E233 R238 S239 W240 P267 L271 L291 L294W96-F236 AromaticContact CH2-CE1 3.86Å; W96-F236 HydrophobicContact CH2-CE1 3.86Å; W96-F236 HydrophobicContact CH2-CZ 4Å; W96-F236 HydrophobicContact CZ2-CE1 4.18Å; W96-F236 HydrophobicContact CZ2-CZ 4.15Å; W128-F236 HydrophobicContact CH2-CD1 4.41Å; W128-F236 AromaticContact CH2-CE1 3.78Å; W128-F236 HydrophobicContact CH2-CE1 3.78Å; W128-F236 HydrophobicContact CH2-CZ 4.3Å; W128-F236 AromaticContact CZ2-CD1 3.86Å; W128-F236 HydrophobicContact CZ2-CD1 3.86Å; W128-F236 AromaticContact CZ2-CE1 3.53Å; W128-F236 HydrophobicContact CZ2-CE1 3.53Å; W128-F236 HydrophobicContact CZ2-CZ 4.47Å; T232-F236 PolarHBondContact O-N 3.33Å; E233-F236 CarbonylContact O-C 3.56Å; E233-F236 WeakPolarHBondContact O-CA 3.38Å; E233-F236 WeakPolarHBondContact O-CB 3.26Å; E233-F236 PolarHBondContact O-N 3.45Å; F236-R238 PolarHBondContact O-N 3.35Å; F236-S239 CarbonylContact O-C 3.59Å; F236-S239 PolarHBondContact O-N 3.21Å; F236-W240 VanDerWaalsContact O-CB 3.22Å; F236-W240 WeakPolarHBondContact O-CB 3.13Å; F236-W240 PolarHBondContact O-N 2.64Å; F236-P267 HydrophobicContact CD2-CG 4.36Å; F236-P267 HydrophobicContact CE1-CG 4.11Å; F236-P267 HydrophobicContact CE2-CG 3.86Å; F236-P267 HydrophobicContact CZ-CG 3.74Å; F236-L271 HydrophobicContact CB-CD1 3.6Å; F236-L271 HydrophobicContact CD1-CD1 4.2Å; F236-L271 HydrophobicContact CG-CD1 3.87Å; F236-L291 HydrophobicContact CB-CD1 4.49Å; F236-L291 HydrophobicContact CD2-CD1 3.66Å; F236-L291 HydrophobicContact CE2-CD1 4.27Å; F236-L291 HydrophobicContact CG-CD1 4.3Å; F236-L294 HydrophobicContact CD2-CD1 4.25Å; F236-L294 HydrophobicContact CE2-CD1 3.69Å
237E95.9Very high95.2Very high0 Ų043.3 Ų43.30%020%0.204CC..Hα-helixtrans-56.8-48.9176.2-72.8170161.800112.1W127 W128 Y226 Y229 E233 A234 W240 V241W127-E237 HydrophobicContact CD2-CB 4.35Å; W127-E237 HydrophobicContact CD2-CG 4.36Å; W127-E237 HydrophobicContact CE3-CB 3.87Å; W127-E237 HydrophobicContact CE3-CG 3.63Å; W127-E237 HydrophobicContact CH2-CB 3.77Å; W127-E237 HydrophobicContact CH2-CG 4.36Å; W127-E237 HydrophobicContact CZ2-CB 4.23Å; W127-E237 HydrophobicContact CZ3-CB 3.59Å; W127-E237 HydrophobicContact CZ3-CG 3.66Å; W128-E237 VanDerWaalsContact CD1-OE1 3.26Å; W128-E237 HydrophobicContact CZ2-CB 4.47Å; W128-E237 HydrophobicContact CZ2-CG 3.59Å; W128-E237 PolarHBondContact NE1-OE1 2.91Å; Y226-E237 HydrophobicContact CD1-CB 4.27Å; Y226-E237 WeakPolarHBondContact CD1-OE2 3.45Å; Y226-E237 HydrophobicContact CE1-CB 3.77Å; Y229-E237 WeakPolarHBondContact CD2-OE1 3.36Å; Y229-E237 WeakPolarHBondContact CE2-OE1 3.4Å; E233-E237 HydrophobicContact CG-CG 4.44Å; E233-E237 WeakPolarHBondContact O-CG 3.38Å; E233-E237 PolarHBondContact O-N 2.61Å; A234-E237 WeakPolarHBondContact CA-OE2 3.34Å; E237-W240 WeakPolarHBondContact O-CB 3.39Å; E237-W240 PolarHBondContact O-N 2.63Å; E237-V241 PolarHBondContact O-N 3.32Å; E237-V241 VanDerWaalsContact O-N 3.13Å
238R94.9Very high95.1Very high118 Ų11837.3 Ų37.345%0.44517%0.173SC..Hα-helixtrans-63.7-44.1175.7-68178-177.191.9-5.8112.1Y226 A234 H235 F236 W240 V241 L242Y226-R238 HydrophobicContact CE1-CG 3.9Å; Y226-R238 HydrophobicContact CE2-CG 4.2Å; Y226-R238 VanDerWaalsContact CG-NH2 3.35Å; A234-R238 WeakPolarHBondContact O-CG 3.45Å; A234-R238 PolarHBondContact O-N 2.78Å; A234-R238 PolarHBondContact O-NH1 3.02Å; H235-R238 PolarHBondContact O-N 3.24Å; F236-R238 PolarHBondContact O-N 3.35Å; R238-W240 PolarHBondContact O-N 3.29Å; R238-V241 PolarHBondContact O-N 3.44Å; R238-L242 PolarHBondContact O-N 2.76Å
239S94.6Very high95Very high1 Ų135.6 Ų35.61%0.00718%0.18CC..Hα-helixtrans-65.2-30.9178.1-58.50000112H235 F236 A243 L294H235-S239 PolarHBondContact CE1-OG 3.43Å; H235-S239 WeakPolarHBondContact O-CB 3.34Å; H235-S239 PolarHBondContact O-N 3.19Å; H235-S239 PolarHBondContact O-OG 2.79Å; F236-S239 CarbonylContact O-C 3.59Å; F236-S239 PolarHBondContact O-N 3.21Å; S239-A243 WeakPolarHBondContact O-CB 3.44Å; S239-A243 PolarHBondContact O-N 2.7Å; S239-L294 WeakPolarHBondContact CB-O 3.3Å
240W94.9Very high94.8Very high23 Ų2336.6 Ų36.69%0.08719%0.188CC..Hα-helixtrans-69.3-47.6177175.9-106.3000111.7Q93 W128 F236 E237 R238 L242 A243 V244 F262 L266 L294Q93-W240 VanDerWaalsContact NE2-CZ2 3.32Å; W128-W240 HydrophobicContact CH2-CB 4.14Å; W128-W240 AromaticContact CH2-CD1 3.62Å; W128-W240 AromaticContact CH2-CG 3.83Å; W128-W240 HydrophobicContact CH2-CG 3.83Å; W128-W240 AromaticContact CZ3-CD1 3.47Å; W128-W240 VanDerWaalsContact CZ3-CD1 3.47Å; W128-W240 HydrophobicContact CZ3-CG 4.14Å; W128-W240 AromaticContact CZ3-NE1 3.82Å; F236-W240 VanDerWaalsContact O-CB 3.22Å; F236-W240 WeakPolarHBondContact O-CB 3.13Å; F236-W240 PolarHBondContact O-N 2.64Å; E237-W240 WeakPolarHBondContact O-CB 3.39Å; E237-W240 PolarHBondContact O-N 2.63Å; R238-W240 PolarHBondContact O-N 3.29Å; W240-L242 PolarHBondContact O-N 3.43Å; W240-A243 WeakPolarHBondContact O-CB 3.46Å; W240-A243 PolarHBondContact O-N 2.68Å; W240-A243 VanDerWaalsContact O-N 3.14Å; W240-V244 HydrophobicContact CD2-CG2 4.5Å; W240-V244 HydrophobicContact CZ2-CG2 4.03Å; W240-V244 WeakPolarHBondContact O-CG2 3.12Å; W240-V244 PolarHBondContact O-N 2.88Å; W240-F262 AromaticContact CH2-CE1 3.55Å; W240-F262 HydrophobicContact CH2-CE1 3.55Å; W240-F262 AromaticContact CH2-CZ 3.77Å; W240-F262 HydrophobicContact CH2-CZ 3.77Å; W240-F262 AromaticContact CZ3-CE1 3.92Å; W240-F262 HydrophobicContact CZ3-CE1 3.92Å; W240-F262 AromaticContact CZ3-CZ 3.81Å; W240-F262 HydrophobicContact CZ3-CZ 3.81Å; W240-L266 HydrophobicContact CE3-CD2 4.1Å; W240-L266 HydrophobicContact CH2-CD1 4.35Å; W240-L266 HydrophobicContact CH2-CD2 4.13Å; W240-L266 HydrophobicContact CZ3-CD2 3.56Å; W240-L294 HydrophobicContact CE3-CD1 4.38Å
241V93.7Very high94.7Very high21 Ų2137.8 Ų37.813%0.12719%0.192CC..Hα-helixtrans-52.2-49.3172168.90000110.3W127 I219 E237 R238 A243 V244 D245W127-V241 HydrophobicContact CH2-CG2 3.71Å; W127-V241 HydrophobicContact CZ2-CG2 3.84Å; I219-V241 HydrophobicContact CD1-CB 4.1Å; I219-V241 HydrophobicContact CD1-CG1 3.28Å; I219-V241 HydrophobicContact CD1-CG2 3.63Å; I219-V241 HydrophobicContact CG1-CG2 4.39Å; E237-V241 PolarHBondContact O-N 3.32Å; E237-V241 VanDerWaalsContact O-N 3.13Å; R238-V241 PolarHBondContact O-N 3.44Å; V241-A243 VanDerWaalsContact C-N 3.33Å; V241-A243 PolarHBondContact O-N 2.8Å; V241-V244 VanDerWaalsContact O-CB 3.31Å; V241-V244 WeakPolarHBondContact O-CB 3.47Å; V241-V244 PolarHBondContact O-N 2.85Å; V241-V244 VanDerWaalsContact O-N 3.11Å; V241-D245 PolarHBondContact O-N 3Å
242L92.6Very high94.7Very high21 Ų2129.4 Ų29.411%0.1116%0.156CC..Hα-helixtrans-62.3-43.7-179.5-177.161.9000111.4R238 W240 V244 D245 Y246 L297 D301R238-L242 PolarHBondContact O-N 2.76Å; W240-L242 PolarHBondContact O-N 3.43Å; L242-V244 PolarHBondContact O-N 3.28Å; L242-D245 WeakPolarHBondContact O-CB 3.47Å; L242-D245 PolarHBondContact O-N 2.68Å; L242-Y246 HydrophobicContact CD1-CD2 4.36Å; L242-Y246 HydrophobicContact CD1-CE2 3.79Å; L242-Y246 HydrophobicContact CG-CD2 4.28Å; L242-Y246 HydrophobicContact CG-CE2 3.96Å; L242-Y246 VanDerWaalsContact O-CD2 3.25Å; L242-Y246 WeakPolarHBondContact O-CD2 3.31Å; L242-Y246 PolarHBondContact O-N 3.14Å; L242-L297 HydrophobicContact CD2-CD1 3.45Å; L242-L297 VanDerWaalsContact CD2-CD1 3.45Å; L242-L297 HydrophobicContact CD2-CD2 4.41Å; L242-L297 HydrophobicContact CD2-CG 3.68Å; L242-L297 HydrophobicContact CG-CD1 3.81Å; L242-L297 HydrophobicContact CG-CD2 4.18Å; L242-L297 HydrophobicContact CG-CG 3.98Å; L242-D301 HydrophobicContact CD2-CB 3.26Å
243A92.8Very high94.7Very high6 Ų629 Ų295%0.0515%0.154CC..Hα-helixtrans-58.2-35.9175.600000112.5S239 W240 V241 D245 Y246 L247 L294 L297S239-A243 WeakPolarHBondContact O-CB 3.44Å; S239-A243 PolarHBondContact O-N 2.7Å; W240-A243 WeakPolarHBondContact O-CB 3.46Å; W240-A243 PolarHBondContact O-N 2.68Å; W240-A243 VanDerWaalsContact O-N 3.14Å; V241-A243 VanDerWaalsContact C-N 3.33Å; V241-A243 PolarHBondContact O-N 2.8Å; A243-D245 VanDerWaalsContact C-N 3.33Å; A243-D245 PolarHBondContact O-N 3.45Å; A243-Y246 PolarHBondContact O-N 3.01Å; A243-Y246 VanDerWaalsContact O-N 3.16Å; A243-L247 WeakPolarHBondContact O-CG 3.32Å; A243-L247 PolarHBondContact O-N 3.17Å; A243-L294 HydrophobicContact CB-CD2 3.35Å; A243-L297 HydrophobicContact CB-CD2 3.81Å
244V94Very high94.6Very high7 Ų729.7 Ų29.74%0.04216%0.158CC..Hα-helixtrans-61.1-40.2174.4172.60000111.6W208 L215 W240 V241 L242 Y246 L247 A248W208-V244 HydrophobicContact CZ3-CG1 3.8Å; L215-V244 HydrophobicContact CD1-CB 4.2Å; L215-V244 HydrophobicContact CD1-CG1 3.72Å; W240-V244 HydrophobicContact CD2-CG2 4.5Å; W240-V244 HydrophobicContact CZ2-CG2 4.03Å; W240-V244 WeakPolarHBondContact O-CG2 3.12Å; W240-V244 PolarHBondContact O-N 2.88Å; V241-V244 VanDerWaalsContact O-CB 3.31Å; V241-V244 WeakPolarHBondContact O-CB 3.47Å; V241-V244 PolarHBondContact O-N 2.85Å; V241-V244 VanDerWaalsContact O-N 3.11Å; L242-V244 PolarHBondContact O-N 3.28Å; V244-Y246 VanDerWaalsContact C-N 3.28Å; V244-Y246 PolarHBondContact O-N 2.93Å; V244-L247 PolarHBondContact O-N 2.54Å; V244-A248 WeakPolarHBondContact O-CB 3.22Å; V244-A248 PolarHBondContact O-N 3.43Å
245D93.1Very high94.6Very high72 Ų7229.9 Ų29.939%0.38516%0.158SC..Hα-helixtrans-62.1-36.6174.8-71-28.3000112.2V241 L242 A243 A248 A249V241-D245 PolarHBondContact O-N 3Å; L242-D245 WeakPolarHBondContact O-CB 3.47Å; L242-D245 PolarHBondContact O-N 2.68Å; A243-D245 VanDerWaalsContact C-N 3.33Å; A243-D245 PolarHBondContact O-N 3.45Å; D245-A248 WeakPolarHBondContact O-CB 3.3Å; D245-A248 PolarHBondContact O-N 2.74Å; D245-A249 WeakPolarHBondContact O-CB 3.43Å; D245-A249 PolarHBondContact O-N 3.28Å
246Y91.2Very high94.6Very high60 Ų6027.1 Ų27.124%0.23515%0.146CC..Hα-helixtrans-71.1-39.3174.8-76.4-85.2000112.6P5 W7 V8 L242 A243 V244 A248 A249 V250 L297P5-Y246 HydrophobicContact CG-CE1 4.27Å; W7-Y246 AromaticContact CH2-CD1 3.56Å; W7-Y246 HydrophobicContact CH2-CD1 3.56Å; W7-Y246 AromaticContact CH2-CD2 3.73Å; W7-Y246 HydrophobicContact CH2-CD2 3.73Å; W7-Y246 AromaticContact CH2-CE1 3.22Å; W7-Y246 HydrophobicContact CH2-CE1 3.22Å; W7-Y246 AromaticContact CH2-CE2 3.49Å; W7-Y246 HydrophobicContact CH2-CE2 3.49Å; W7-Y246 VanDerWaalsContact CH2-CE2 3.49Å; W7-Y246 AromaticContact CH2-CG 3.78Å; W7-Y246 HydrophobicContact CH2-CG 3.78Å; W7-Y246 AromaticContact CH2-CZ 3.19Å; W7-Y246 HydrophobicContact CZ2-CD1 4.24Å; W7-Y246 AromaticContact CZ2-CE1 3.52Å; W7-Y246 HydrophobicContact CZ2-CE1 3.52Å; W7-Y246 HydrophobicContact CZ2-CE2 4.22Å; W7-Y246 AromaticContact CZ2-CZ 3.52Å; W7-Y246 WeakPolarHBondContact CZ2-OH 3.34Å; W7-Y246 HydrophobicContact CZ3-CD1 4.21Å; W7-Y246 HydrophobicContact CZ3-CD2 4.31Å; W7-Y246 HydrophobicContact CZ3-CE1 4.27Å; W7-Y246 HydrophobicContact CZ3-CE2 4.45Å; W7-Y246 HydrophobicContact CZ3-CG 4.21Å; V8-Y246 HydrophobicContact CG2-CD1 3.37Å; V8-Y246 HydrophobicContact CG2-CE1 3.84Å; V8-Y246 HydrophobicContact CG2-CG 4.28Å; L242-Y246 HydrophobicContact CD1-CD2 4.36Å; L242-Y246 HydrophobicContact CD1-CE2 3.79Å; L242-Y246 HydrophobicContact CG-CD2 4.28Å; L242-Y246 HydrophobicContact CG-CE2 3.96Å; L242-Y246 VanDerWaalsContact O-CD2 3.25Å; L242-Y246 WeakPolarHBondContact O-CD2 3.31Å; L242-Y246 PolarHBondContact O-N 3.14Å; A243-Y246 PolarHBondContact O-N 3.01Å; A243-Y246 VanDerWaalsContact O-N 3.16Å; V244-Y246 VanDerWaalsContact C-N 3.28Å; V244-Y246 PolarHBondContact O-N 2.93Å; Y246-A248 VanDerWaalsContact C-N 3.28Å; Y246-A248 PolarHBondContact O-N 3Å; Y246-A249 PolarHBondContact O-N 2.87Å; Y246-V250 WeakPolarHBondContact O-CG2 3.21Å; Y246-V250 PolarHBondContact O-N 3.38Å; Y246-L297 HydrophobicContact CD2-CD1 4.05Å; Y246-L297 HydrophobicContact CD2-CD2 4.13Å; Y246-L297 HydrophobicContact CE2-CD1 3.68Å
247L94.1Very high94.3Very high18 Ų1830 Ų309%0.09416%0.161CC..Hα-helixtrans-60.9-39.8172.5-68.1174.9000111.2W208 A243 V244 V250 L251 F252 F262W208-L247 HydrophobicContact CH2-CB 3.85Å; W208-L247 HydrophobicContact CZ2-CB 4.02Å; A243-L247 WeakPolarHBondContact O-CG 3.32Å; A243-L247 PolarHBondContact O-N 3.17Å; V244-L247 PolarHBondContact O-N 2.54Å; L247-V250 WeakPolarHBondContact O-CG2 3.39Å; L247-V250 PolarHBondContact O-N 2.84Å; L247-L251 PolarHBondContact O-N 3.45Å; L247-F252 HydrophobicContact CB-CB 4.04Å; L247-F252 HydrophobicContact CD2-CB 3.99Å; L247-F252 HydrophobicContact CD2-CD2 3.94Å; L247-F252 HydrophobicContact CD2-CG 3.92Å; L247-F252 WeakPolarHBondContact O-CB 3.41Å; L247-F252 PolarHBondContact O-N 3.24Å; L247-F262 HydrophobicContact CD1-CE2 4.17Å; L247-F262 HydrophobicContact CD1-CZ 3.96Å; L247-F262 HydrophobicContact CD2-CE2 4.15Å
248A94.8Very high94.1Very high12 Ų1234.2 Ų34.210%0.09918%0.176CC..Hα-helixtrans-64-45.3174.500000112.3W208 T212 V244 D245 Y246 V250 L251W208-A248 HydrophobicContact CB-CB 3.92Å; W208-A248 VanDerWaalsContact CD2-CA 3.44Å; W208-A248 HydrophobicContact CD2-CB 3.71Å; W208-A248 HydrophobicContact CE3-CB 3.48Å; W208-A248 VanDerWaalsContact CE3-CB 3.48Å; W208-A248 HydrophobicContact CG-CB 3.94Å; W208-A248 HydrophobicContact CZ3-CB 4.22Å; T212-A248 HydrophobicContact CG2-CB 3.48Å; T212-A248 VanDerWaalsContact CG2-CB 3.48Å; V244-A248 WeakPolarHBondContact O-CB 3.22Å; V244-A248 PolarHBondContact O-N 3.43Å; D245-A248 WeakPolarHBondContact O-CB 3.3Å; D245-A248 PolarHBondContact O-N 2.74Å; Y246-A248 VanDerWaalsContact C-N 3.28Å; Y246-A248 PolarHBondContact O-N 3Å; A248-V250 PolarHBondContact O-N 3.23Å; A248-L251 PolarHBondContact O-N 3.13Å
249A93.9Very high94.1Very high65 Ų6529 Ų2954%0.53716%0.158SC..Hα-helixtrans-61.3-31.6179.700000113.2L4 D245 Y246L4-A249 HydrophobicContact CD2-CB 4.36Å; D245-A249 WeakPolarHBondContact O-CB 3.43Å; D245-A249 PolarHBondContact O-N 3.28Å; Y246-A249 PolarHBondContact O-N 2.87Å
250V93.5Very high94Very high44 Ų4429.7 Ų29.727%0.26716%0.162SC..THydrogen-bonded Turntrans-93.97175.7-55.30000113.7L4 V8 V12 Y246 L247 A248 F252L4-V250 HydrophobicContact CD1-CG1 3.92Å; L4-V250 HydrophobicContact CD2-CG1 4.14Å; V8-V250 HydrophobicContact CG1-CG1 3.61Å; V12-V250 HydrophobicContact CG2-CG2 4.05Å; Y246-V250 WeakPolarHBondContact O-CG2 3.21Å; Y246-V250 PolarHBondContact O-N 3.38Å; L247-V250 WeakPolarHBondContact O-CG2 3.39Å; L247-V250 PolarHBondContact O-N 2.84Å; A248-V250 PolarHBondContact O-N 3.23Å; V250-F252 VanDerWaalsContact C-N 3.29Å; V250-F252 HydrophobicContact CG2-CB 4.28Å; V250-F252 PolarHBondContact O-N 3.35Å
251L95.8Very high93.7Very high50 Ų5030.6 Ų30.626%0.26217%0.167SC..THydrogen-bonded Turntrans50.846.9-177.6-57.6177.3000112.3L204 K205 L247 A248 P253L204-L251 HydrophobicContact CB-CB 4.2Å; K205-L251 HydrophobicContact CB-CD2 4.28Å; K205-L251 HydrophobicContact CD-CD1 4.44Å; K205-L251 HydrophobicContact CG-CD1 3.61Å; K205-L251 HydrophobicContact CG-CD2 3.74Å; K205-L251 HydrophobicContact CG-CG 4.35Å; L247-L251 PolarHBondContact O-N 3.45Å; A248-L251 PolarHBondContact O-N 3.13Å; L251-P253 WeakPolarHBondContact O-CD 3.24Å; L251-P253 VanDerWaalsContact O-N 3.15Å
252F95.6Very high93.6Very high7 Ų730.3 Ų30.33%0.03116%0.164CC..  trans-55.4121.6-177.6-178-89.8000110.8W208 L247 V250 T254 R258 F262W208-F252 HydrophobicContact CZ2-CB 4.01Å; W208-F252 WeakPolarHBondContact CZ2-O 3.37Å; W208-F252 PolarHBondContact NE1-O 3.33Å; L247-F252 HydrophobicContact CB-CB 4.04Å; L247-F252 HydrophobicContact CD2-CB 3.99Å; L247-F252 HydrophobicContact CD2-CD2 3.94Å; L247-F252 HydrophobicContact CD2-CG 3.92Å; L247-F252 WeakPolarHBondContact O-CB 3.41Å; L247-F252 PolarHBondContact O-N 3.24Å; V250-F252 VanDerWaalsContact C-N 3.29Å; V250-F252 HydrophobicContact CG2-CB 4.28Å; V250-F252 PolarHBondContact O-N 3.35Å; F252-T254 HydrophobicContact CD1-CG2 4.24Å; F252-T254 PolarHBondContact O-N 3.26Å; F252-R258 HydrophobicContact CE1-CG 3.98Å; F252-R258 HydrophobicContact CE2-CG 4.19Å; F252-R258 HydrophobicContact CZ-CG 3.56Å; F252-F262 HydrophobicContact CE2-CD2 4.28Å; F252-F262 HydrophobicContact CZ-CB 4.02Å; F252-F262 AromaticContact CZ-CD2 3.91Å; F252-F262 HydrophobicContact CZ-CD2 3.91Å; F252-F262 HydrophobicContact CZ-CG 4.16Å
253P96.1Very high93.6Very high22 Ų2230.4 Ų30.414%0.14316%0.164CC..  trans-69.4111.4178.7-20.232.3000112.4F200 L204 L251 T255 R258F200-P253 HydrophobicContact CE1-CB 4.07Å; F200-P253 HydrophobicContact CE1-CG 4.37Å; F200-P253 HydrophobicContact CZ-CB 4.3Å; L204-P253 HydrophobicContact CD1-CB 4.25Å; L204-P253 HydrophobicContact CD1-CG 3.93Å; L204-P253 HydrophobicContact CD2-CB 4.31Å; L251-P253 WeakPolarHBondContact O-CD 3.24Å; L251-P253 VanDerWaalsContact O-N 3.15Å; P253-T255 HydrophobicContact CB-CG2 4.27Å; P253-T255 PolarHBondContact O-N 2.84Å; P253-R258 VanDerWaalsContact CD-CZ 3.42Å; P253-R258 VanDerWaalsContact CG-NH1 3.31Å; P253-R258 VanDerWaalsContact O-CD 3.3Å; P253-R258 WeakPolarHBondContact O-CD 3.29Å; P253-R258 WeakPolarHBondContact O-CG 3.44Å
254T96.8Very high93.5Very high14 Ų1435.7 Ų35.79%0.08619%0.186CC..  trans-84.941.5-178.243.30000112.8I86 W88 G89 L207 W208 F252 T259I86-T254 WeakPolarHBondContact O-CB 3.43Å; I86-T254 PolarHBondContact O-OG1 3.02Å; W88-T254 WeakPolarHBondContact CB-O 3.17Å; G89-T254 PolarHBondContact N-O 3.44Å; L207-T254 VanDerWaalsContact CD2-OG1 3.25Å; L207-T254 WeakPolarHBondContact CD2-OG1 3.4Å; W208-T254 HydrophobicContact CH2-CG2 4.06Å; W208-T254 HydrophobicContact CZ2-CG2 3.6Å; F252-T254 HydrophobicContact CD1-CG2 4.24Å; F252-T254 PolarHBondContact O-N 3.26Å; T254-T259 VanDerWaalsContact CA-OG1 3.29Å; T254-T259 WeakPolarHBondContact CA-OG1 3.37Å; T254-T259 PolarHBondContact O-OG1 2.89Å
255T96.7Very high93.4Very high9 Ų935.3 Ų35.36%0.05518%0.184CC..  trans-77164.7179.665.70000111.5E83 I86 F200 P253 I257 R258 T259E83-T255 WeakPolarHBondContact O-CB 3.5Å; I86-T255 HydrophobicContact CG2-CG2 4.06Å; F200-T255 HydrophobicContact CE2-CG2 4.42Å; F200-T255 HydrophobicContact CZ-CG2 3.81Å; P253-T255 HydrophobicContact CB-CG2 4.27Å; P253-T255 PolarHBondContact O-N 2.84Å; T255-I257 PolarHBondContact O-N 3.19Å; T255-R258 PolarHBondContact O-N 3.42Å; T255-R258 WeakPolarHBondContact OG1-CB 3.44Å; T255-T259 WeakPolarHBondContact O-CB 3.44Å; T255-T259 PolarHBondContact O-N 3.46Å; T255-T259 PolarHBondContact O-OG1 3.43Å; T255-T259 VanDerWaalsContact O-OG1 3.13Å
256L94.3Very high93.6Very high0 Ų032 Ų320%017%0.166CC..Hα-helixtrans-51.3-56.3-174.7176.962.8000112.4L25 I28 K29 E83 W88 L92 S260L25-L256 HydrophobicContact CD1-CD2 4.11Å; L25-L256 HydrophobicContact CG-CD2 4.43Å; I28-L256 HydrophobicContact CG2-CD1 3.68Å; I28-L256 HydrophobicContact CG2-CD2 4.39Å; I28-L256 HydrophobicContact CG2-CG 3.67Å; K29-L256 HydrophobicContact CD-CD1 4.05Å; E83-L256 HydrophobicContact CG-CD2 4.25Å; E83-L256 PolarHBondContact O-N 2.97Å; E83-L256 VanDerWaalsContact O-N 3.1Å; W88-L256 HydrophobicContact CB-CB 4.31Å; W88-L256 HydrophobicContact CD2-CB 3.99Å; W88-L256 HydrophobicContact CD2-CD1 3.75Å; W88-L256 HydrophobicContact CD2-CG 4.37Å; W88-L256 HydrophobicContact CE3-CD1 3.67Å; W88-L256 HydrophobicContact CG-CB 3.73Å; W88-L256 HydrophobicContact CG-CD1 4.28Å; W88-L256 HydrophobicContact CH2-CD1 4.44Å; W88-L256 HydrophobicContact CZ2-CD1 4.47Å; W88-L256 HydrophobicContact CZ3-CD1 4.03Å; L92-L256 HydrophobicContact CD1-CD1 4.3Å; L256-S260 WeakPolarHBondContact O-CB 3.43Å; L256-S260 PolarHBondContact O-N 3.39Å; L256-S260 VanDerWaalsContact O-N 3.07Å
257I91.5Very high93.9Very high61 Ų6129.1 Ų29.131%0.31316%0.155SC..Hα-helixtrans-68.8-43.5-175.4-61.6173.3000110.4T255 K261T255-I257 PolarHBondContact O-N 3.19Å; I257-K261 HydrophobicContact CG2-CD 4.13Å; I257-K261 WeakPolarHBondContact O-CB 3.22Å; I257-K261 WeakPolarHBondContact O-CG 3.47Å; I257-K261 PolarHBondContact O-N 2.86Å
258R92.3Very high94Very high87 Ų8730.8 Ų30.833%0.32817%0.167SC..Hα-helixtrans-68.9-44.8-174-171.3162.9-178168.60.6111.5F252 P253 T255 F262F252-R258 HydrophobicContact CE1-CG 3.98Å; F252-R258 HydrophobicContact CE2-CG 4.19Å; F252-R258 HydrophobicContact CZ-CG 3.56Å; P253-R258 VanDerWaalsContact CD-CZ 3.42Å; P253-R258 VanDerWaalsContact CG-NH1 3.31Å; P253-R258 VanDerWaalsContact O-CD 3.3Å; P253-R258 WeakPolarHBondContact O-CD 3.29Å; P253-R258 WeakPolarHBondContact O-CG 3.44Å; T255-R258 PolarHBondContact O-N 3.42Å; T255-R258 WeakPolarHBondContact OG1-CB 3.44Å; R258-F262 VanDerWaalsContact O-CB 3.31Å; R258-F262 WeakPolarHBondContact O-CB 3.38Å; R258-F262 PolarHBondContact O-N 3.34Å
259T94.3Very high94.1Very high8 Ų833 Ų335%0.04917%0.172CC..Hα-helixtrans-65.8-46175.9-58.60000111.2L92 T254 T255 K261 F262 Q263L92-T259 HydrophobicContact CB-CG2 3.65Å; L92-T259 VanDerWaalsContact CD1-CB 3.46Å; L92-T259 HydrophobicContact CD1-CG2 3.55Å; L92-T259 HydrophobicContact CG-CG2 4.26Å; T254-T259 VanDerWaalsContact CA-OG1 3.29Å; T254-T259 WeakPolarHBondContact CA-OG1 3.37Å; T254-T259 PolarHBondContact O-OG1 2.89Å; T255-T259 WeakPolarHBondContact O-CB 3.44Å; T255-T259 PolarHBondContact O-N 3.46Å; T255-T259 PolarHBondContact O-OG1 3.43Å; T255-T259 VanDerWaalsContact O-OG1 3.13Å; T259-K261 VanDerWaalsContact C-N 3.31Å; T259-K261 PolarHBondContact O-N 2.91Å; T259-F262 WeakPolarHBondContact O-CB 3.37Å; T259-F262 PolarHBondContact O-N 3.33Å; T259-F262 VanDerWaalsContact O-N 3.15Å; T259-Q263 HydrophobicContact CG2-CG 4.24Å; T259-Q263 WeakPolarHBondContact O-CG 3.21Å; T259-Q263 PolarHBondContact O-N 3.14Å
260S92.2Very high94.3Very high16 Ų1632.2 Ų32.211%0.11216%0.159CC..Hα-helixtrans-59.7-41.2179.9177.60000112.5I28 L256 Q263I28-S260 WeakPolarHBondContact CG2-OG 3.4Å; L256-S260 WeakPolarHBondContact O-CB 3.43Å; L256-S260 PolarHBondContact O-N 3.39Å; L256-S260 VanDerWaalsContact O-N 3.07Å; S260-Q263 PolarHBondContact O-N 3.42Å
261K89.6Confident94.6Very high43 Ų4330.2 Ų30.219%0.18715%0.146CC..Hα-helixtrans-65.9-44.9174.4-72.3-175.8-178.8-1730111.8L19 I257 T259 Q263 K264L19-K261 HydrophobicContact CD2-CB 4.1Å; L19-K261 HydrophobicContact CD2-CD 3.34Å; L19-K261 HydrophobicContact CD2-CG 4.36Å; L19-K261 PolarHBondContact O-NZ 2.95Å; I257-K261 HydrophobicContact CG2-CD 4.13Å; I257-K261 WeakPolarHBondContact O-CB 3.22Å; I257-K261 WeakPolarHBondContact O-CG 3.47Å; I257-K261 PolarHBondContact O-N 2.86Å; T259-K261 VanDerWaalsContact C-N 3.31Å; T259-K261 PolarHBondContact O-N 2.91Å; K261-Q263 VanDerWaalsContact C-N 3.28Å; K261-Q263 PolarHBondContact O-N 3.38Å; K261-K264 WeakPolarHBondContact O-CB 3.5Å; K261-K264 PolarHBondContact O-N 3.04Å
262F89.7Confident94.6Very high14 Ų1432.1 Ų32.16%0.06116%0.157CC..Hα-helixtrans-55.4-44.1176.7169.4-82.1000111.8F15 W240 L247 F252 R258 T259 K264 G265 L266F15-F262 HydrophobicContact CB-CD2 4.42Å; F15-F262 HydrophobicContact CD1-CB 4.41Å; F15-F262 AromaticContact CD1-CD2 3.42Å; F15-F262 HydrophobicContact CD1-CD2 3.42Å; F15-F262 VanDerWaalsContact CD1-CD2 3.42Å; F15-F262 AromaticContact CD1-CE2 3.95Å; F15-F262 HydrophobicContact CD1-CE2 3.95Å; F15-F262 HydrophobicContact CD1-CG 4.14Å; F15-F262 AromaticContact CD2-CD2 3.66Å; F15-F262 HydrophobicContact CD2-CD2 3.66Å; F15-F262 AromaticContact CD2-CE2 3.64Å; F15-F262 HydrophobicContact CD2-CE2 3.64Å; F15-F262 AromaticContact CE1-CD2 3.44Å; F15-F262 HydrophobicContact CE1-CD2 3.44Å; F15-F262 VanDerWaalsContact CE1-CD2 3.44Å; F15-F262 AromaticContact CE1-CE2 3.54Å; F15-F262 HydrophobicContact CE1-CE2 3.54Å; F15-F262 HydrophobicContact CE1-CG 4.13Å; F15-F262 HydrophobicContact CE1-CZ 4.25Å; F15-F262 AromaticContact CE2-CD2 3.72Å; F15-F262 HydrophobicContact CE2-CD2 3.72Å; F15-F262 AromaticContact CE2-CE2 3.24Å; F15-F262 HydrophobicContact CE2-CE2 3.24Å; F15-F262 HydrophobicContact CE2-CZ 4.21Å; F15-F262 AromaticContact CG-CD2 3.57Å; F15-F262 HydrophobicContact CG-CD2 3.57Å; F15-F262 HydrophobicContact CG-CE2 4.02Å; F15-F262 AromaticContact CZ-CD2 3.62Å; F15-F262 HydrophobicContact CZ-CD2 3.62Å; F15-F262 AromaticContact CZ-CE2 3.19Å; F15-F262 HydrophobicContact CZ-CE2 3.19Å; F15-F262 AromaticContact CZ-CZ 3.85Å; F15-F262 HydrophobicContact CZ-CZ 3.85Å; W240-F262 AromaticContact CH2-CE1 3.55Å; W240-F262 HydrophobicContact CH2-CE1 3.55Å; W240-F262 AromaticContact CH2-CZ 3.77Å; W240-F262 HydrophobicContact CH2-CZ 3.77Å; W240-F262 AromaticContact CZ3-CE1 3.92Å; W240-F262 HydrophobicContact CZ3-CE1 3.92Å; W240-F262 AromaticContact CZ3-CZ 3.81Å; W240-F262 HydrophobicContact CZ3-CZ 3.81Å; L247-F262 HydrophobicContact CD1-CE2 4.17Å; L247-F262 HydrophobicContact CD1-CZ 3.96Å; L247-F262 HydrophobicContact CD2-CE2 4.15Å; F252-F262 HydrophobicContact CE2-CD2 4.28Å; F252-F262 HydrophobicContact CZ-CB 4.02Å; F252-F262 AromaticContact CZ-CD2 3.91Å; F252-F262 HydrophobicContact CZ-CD2 3.91Å; F252-F262 HydrophobicContact CZ-CG 4.16Å; R258-F262 VanDerWaalsContact O-CB 3.31Å; R258-F262 WeakPolarHBondContact O-CB 3.38Å; R258-F262 PolarHBondContact O-N 3.34Å; T259-F262 WeakPolarHBondContact O-CB 3.37Å; T259-F262 PolarHBondContact O-N 3.33Å; T259-F262 VanDerWaalsContact O-N 3.15Å; F262-K264 PolarHBondContact O-N 3.47Å; F262-G265 PolarHBondContact O-N 3.11Å; F262-G265 VanDerWaalsContact O-N 3.11Å; F262-L266 HydrophobicContact CE1-CD1 4.36Å; F262-L266 HydrophobicContact CE1-CD2 4.12Å; F262-L266 HydrophobicContact CE1-CG 4.36Å
263Q92.8Very high94.7Very high24 Ų2437 Ų3711%0.11218%0.183CC..Hα-helixtrans-67.9-17.6-176.6-72.7-175.6-29.400114.9L92 T259 S260 K261 G265 L266L92-Q263 PolarHBondContact O-NE2 3.05Å; L92-Q263 PolarHBondContact O-OE1 3.27Å; T259-Q263 HydrophobicContact CG2-CG 4.24Å; T259-Q263 WeakPolarHBondContact O-CG 3.21Å; T259-Q263 PolarHBondContact O-N 3.14Å; S260-Q263 PolarHBondContact O-N 3.42Å; K261-Q263 VanDerWaalsContact C-N 3.28Å; K261-Q263 PolarHBondContact O-N 3.38Å; Q263-G265 PolarHBondContact O-N 3.27Å; Q263-G265 VanDerWaalsContact O-N 3.13Å; Q263-L266 HydrophobicContact CB-CD1 4.25Å; Q263-L266 HydrophobicContact CG-CD1 3.9Å; Q263-L266 WeakPolarHBondContact O-CB 3.38Å; Q263-L266 PolarHBondContact O-N 3.19Å
264K91.4Very high94.7Very high116 Ų11641.4 Ų41.450%0.50421%0.21SC..THydrogen-bonded Turntrans-60.2-21.5172.3-64.9-178.8-178.1-176.70112.4K261 F262 F286 Q287K261-K264 WeakPolarHBondContact O-CB 3.5Å; K261-K264 PolarHBondContact O-N 3.04Å; F262-K264 PolarHBondContact O-N 3.47Å; K264-F286 HydrophobicContact CB-CD1 4.34Å; K264-F286 HydrophobicContact CB-CE1 4.15Å; K264-Q287 VanDerWaalsContact O-CG 3.28Å; K264-Q287 WeakPolarHBondContact O-CG 3.41Å
265G92.3Very high94.7Very high0 Ų041.7 Ų41.70%021%0.21CC..THydrogen-bonded Turntrans-87.7-8.8176.900000114F262 Q263 Q287 V290F262-G265 PolarHBondContact O-N 3.11Å; F262-G265 VanDerWaalsContact O-N 3.11Å; Q263-G265 PolarHBondContact O-N 3.27Å; Q263-G265 VanDerWaalsContact O-N 3.13Å; G265-Q287 WeakPolarHBondContact O-CA 3.38Å; G265-V290 VanDerWaalsContact O-CB 3.3Å; G265-V290 WeakPolarHBondContact O-CB 3.35Å; G265-V290 VanDerWaalsContact O-CG1 3.31Å; G265-V290 WeakPolarHBondContact O-CG1 3.44Å
266L95.9Very high94.7Very high2 Ų245.7 Ų45.71%0.0124%0.235CC..SBendtrans-77.7152.5-179.6-62.4-179.8000111.4W96 W240 F262 Q263 Q287W96-L266 HydrophobicContact CD2-CB 4.46Å; W96-L266 HydrophobicContact CD2-CD1 3.84Å; W96-L266 HydrophobicContact CE3-CD1 4.25Å; W96-L266 HydrophobicContact CG-CD1 4.15Å; W96-L266 HydrophobicContact CZ2-CB 3.96Å; W96-L266 HydrophobicContact CZ2-CD1 4.25Å; W240-L266 HydrophobicContact CE3-CD2 4.1Å; W240-L266 HydrophobicContact CH2-CD1 4.35Å; W240-L266 HydrophobicContact CH2-CD2 4.13Å; W240-L266 HydrophobicContact CZ3-CD2 3.56Å; F262-L266 HydrophobicContact CE1-CD1 4.36Å; F262-L266 HydrophobicContact CE1-CD2 4.12Å; F262-L266 HydrophobicContact CE1-CG 4.36Å; Q263-L266 HydrophobicContact CB-CD1 4.25Å; Q263-L266 HydrophobicContact CG-CD1 3.9Å; Q263-L266 WeakPolarHBondContact O-CB 3.38Å; Q263-L266 PolarHBondContact O-N 3.19Å; L266-Q287 PolarHBondContact O-NE2 3.36Å
267P97.6Very high94.7Very high0 Ų046.3 Ų46.30%024%0.24CC..  trans-52.4126.9174.9-28.936.8000112W96 R102 F236 R269 L271 F283 L291W96-P267 PolarHBondContact NE1-O 2.99Å; R102-P267 PolarHBondContact NH1-O 2.89Å; F236-P267 HydrophobicContact CD2-CG 4.36Å; F236-P267 HydrophobicContact CE1-CG 4.11Å; F236-P267 HydrophobicContact CE2-CG 3.86Å; F236-P267 HydrophobicContact CZ-CG 3.74Å; P267-R269 PolarHBondContact O-N 2.97Å; P267-L271 HydrophobicContact CB-CD2 4.16Å; P267-L271 HydrophobicContact CB-CG 4.47Å; P267-L271 HydrophobicContact CG-CD1 4.49Å; P267-L271 HydrophobicContact CG-CD2 4.45Å; P267-F283 HydrophobicContact CB-CE2 3.86Å; P267-F283 HydrophobicContact CB-CZ 3.93Å; P267-F283 HydrophobicContact CG-CE2 4.3Å; P267-L291 HydrophobicContact CG-CD1 4.18Å; P267-L291 HydrophobicContact CG-CD2 4.39Å
268P97.2Very high94.9Very high53 Ų5345.6 Ų45.634%0.34424%0.239SC..SBendtrans-79.4-3-176.932.6-35.6000113.9T100 F283T100-P268 VanDerWaalsContact CG2-C 3.49Å; T100-P268 VanDerWaalsContact CG2-O 3.32Å; T100-P268 WeakPolarHBondContact CG2-O 3.48Å; P268-F283 HydrophobicContact CG-CD1 3.89Å; P268-F283 HydrophobicContact CG-CE1 3.82Å; P268-F283 HydrophobicContact CG-CZ 4.37Å
269R97.7Very high95.1Very high58 Ų5849.4 Ų49.422%0.21926%0.258CS..SBendtrans-150.7170.1176.457169.7177.275.41.3110.2R102 P267 D275 D282 F283R102-R269 PolarHBondContact NH1-O 3.2Å; R102-R269 PolarHBondContact NH2-O 3.26Å; P267-R269 PolarHBondContact O-N 2.97Å; R269-D275 IonicContact CZ-OD1 2.64Å; R269-D275 IonicContact CZ-OD2 2.94Å; R269-D275 IonicContact NH1-OD1 2.78Å; R269-D275 IonicContact NH1-OD2 3.26Å; R269-D275 PolarHBondContact NH1-OD2 3.4Å; R269-D275 IonicContact NH2-OD1 2.75Å; R269-D275 PolarHBondContact NH2-OD1 2.99Å; R269-D275 IonicContact NH2-OD2 2.74Å; R269-D275 PolarHBondContact NH2-OD2 3.48Å; R269-D282 IonicContact CZ-OD1 3.63Å; R269-D282 IonicContact CZ-OD2 2.63Å; R269-D282 IonicContact NE-OD1 2.85Å; R269-D282 IonicContact NE-OD2 2.89Å; R269-D282 PolarHBondContact NE-OD2 2.96Å; R269-D282 IonicContact NH2-OD1 3.01Å; R269-D282 PolarHBondContact NH2-OD1 3.29Å; R269-D282 IonicContact NH2-OD2 2.7Å; R269-D282 PolarHBondContact NH2-OD2 3.32Å; R269-F283 HydrophobicContact CG-CE1 4.04Å; R269-F283 HydrophobicContact CG-CZ 4.48Å
270I97.9Very high95.3Very high49 Ų4949.3 Ų49.325%0.25126%0.258SS..PPolyproline II helixtrans-58.9135.4166.5-65.4174.4000109.3R102 E233R102-I270 HydrophobicContact CG-CG1 4.01Å; E233-I270 HydrophobicContact CB-CG2 4.27Å; E233-I270 HydrophobicContact CG-CG2 4.02Å
271L98.3Very high95.5Very high1 Ų154.5 Ų54.51%0.00529%0.294CS..PPolyproline II helixtrans-77.4139.8179.3-61.6173.4000111.4S230 T232 E233 F236 P267 D275 I280 F283 L291S230-L271 PolarHBondContact OG-O 3.31Å; T232-L271 HydrophobicContact CG2-CB 3.85Å; T232-L271 HydrophobicContact CG2-CD1 4.1Å; E233-L271 HydrophobicContact CB-CB 4.17Å; E233-L271 VanDerWaalsContact OE2-CB 3.3Å; E233-L271 WeakPolarHBondContact OE2-CB 3.34Å; E233-L271 VanDerWaalsContact OE2-CG 3.32Å; E233-L271 WeakPolarHBondContact OE2-CG 3.49Å; E233-L271 PolarHBondContact OE2-N 2.93Å; F236-L271 HydrophobicContact CB-CD1 3.6Å; F236-L271 HydrophobicContact CD1-CD1 4.2Å; F236-L271 HydrophobicContact CG-CD1 3.87Å; P267-L271 HydrophobicContact CB-CD2 4.16Å; P267-L271 HydrophobicContact CB-CG 4.47Å; P267-L271 HydrophobicContact CG-CD1 4.49Å; P267-L271 HydrophobicContact CG-CD2 4.45Å; L271-D275 WeakPolarHBondContact CA-OD2 3.31Å; L271-D275 HydrophobicContact CD2-CB 4.31Å; L271-I280 HydrophobicContact CD2-CD1 4.31Å; L271-F283 HydrophobicContact CD2-CE2 3.84Å; L271-F283 HydrophobicContact CD2-CZ 3.55Å; L271-L291 HydrophobicContact CD1-CD1 3.87Å; L271-L291 HydrophobicContact CD1-CD2 3.89Å; L271-L291 HydrophobicContact CD2-CD2 3.75Å
272L97.1Very high95.9Very high91 Ų9156.7 Ų56.748%0.47631%0.307SS..PPolyproline II helixtrans-97.5160.1177-56.3178.2000110.1T232 T274 D275T232-L272 VanDerWaalsContact CB-O 3.28Å; T232-L272 WeakPolarHBondContact CB-O 3.31Å; T232-L272 PolarHBondContact OG1-O 3.27Å; T232-L272 VanDerWaalsContact OG1-O 3.12Å; L272-T274 PolarHBondContact O-N 2.86Å; L272-T274 VanDerWaalsContact O-N 3.09Å; L272-D275 PolarHBondContact N-OD2 3.45Å; L272-D275 WeakPolarHBondContact O-CB 3.41Å; L272-D275 PolarHBondContact O-N 2.89Å
273N96.6Very high96.2Very high109 Ų10956.6 Ų56.658%0.58331%0.307SS*.THydrogen-bonded Turntrans-60.5-20.8175.5-72.9-37.2000113.3S230 K231 T232S230-N273 WeakPolarHBondContact CB-OD1 3.25Å; K231-N273 PolarHBondContact N-OD1 3.39Å; T232-N273 WeakPolarHBondContact OG1-CA 3.43Å
274T96.5Very high96.4Very high115 Ų11558.6 Ų58.671%0.70632%0.321SS*.THydrogen-bonded Turntrans-88-10.4178.451.60000113.6L272 V276L272-T274 PolarHBondContact O-N 2.86Å; L272-T274 VanDerWaalsContact O-N 3.09Å; T274-V276 PolarHBondContact O-N 3.26Å
275D97.8Very high96.5Very high19 Ų1958 Ų5810%0.10233%0.329CS..  trans-74.7123.1-179.4-72.1-33.4000110.5T232 R269 L271 L272 I280T232-D275 HydrophobicContact CG2-CB 4.4Å; R269-D275 IonicContact CZ-OD1 2.64Å; R269-D275 IonicContact CZ-OD2 2.94Å; R269-D275 IonicContact NH1-OD1 2.78Å; R269-D275 IonicContact NH1-OD2 3.26Å; R269-D275 PolarHBondContact NH1-OD2 3.4Å; R269-D275 IonicContact NH2-OD1 2.75Å; R269-D275 PolarHBondContact NH2-OD1 2.99Å; R269-D275 IonicContact NH2-OD2 2.74Å; R269-D275 PolarHBondContact NH2-OD2 3.48Å; L271-D275 WeakPolarHBondContact CA-OD2 3.31Å; L271-D275 HydrophobicContact CD2-CB 4.31Å; L272-D275 PolarHBondContact N-OD2 3.45Å; L272-D275 WeakPolarHBondContact O-CB 3.41Å; L272-D275 PolarHBondContact O-N 2.89Å; D275-I280 HydrophobicContact CB-CD1 3.76Å; D275-I280 HydrophobicContact CB-CG1 3.96Å
276V95.8Very high96.5Very high94 Ų9459.7 Ų59.757%0.5734%0.336SS*.  trans-130.2100.7179.1-1760000109.1T274 F279T274-V276 PolarHBondContact O-N 3.26Å; V276-F279 CarbonylContact O-C 3.54Å; V276-F279 WeakPolarHBondContact O-CA 3.44Å; V276-F279 PolarHBondContact O-N 3.16Å
277A94.7Very high96.4Very high13 Ų1360.7 Ų60.711%0.10734%0.341CS..THydrogen-bonded Turntrans-65.7143.2172.500000110.7I280 L291 F292A277-I280 HydrophobicContact CB-CD1 4.43Å; A277-L291 HydrophobicContact CB-CB 4.09Å; A277-L291 HydrophobicContact CB-CD2 3.96Å; A277-L291 HydrophobicContact CB-CG 3.82Å; A277-F292 HydrophobicContact CB-CB 4.12Å
278P95.5Very high96.4Very high45 Ų4561.2 Ų61.229%0.29234%0.344SS..THydrogen-bonded Turncis-93.928.55.338.8-38.1000114.3N288 F292P278-N288 VanDerWaalsContact C-CG 3.41Å; P278-N288 WeakPolarHBondContact CA-OD1 3.39Å; P278-N288 HydrophobicContact CB-CB 4.03Å; P278-N288 WeakPolarHBondContact O-CB 3.46Å; P278-N288 PolarHBondContact O-OD1 3.02Å; P278-F292 HydrophobicContact CB-CB 4.29Å
279F96.5Very high96.2Very high168 Ų16860.8 Ų60.874%0.73734%0.34SS*.  trans-113.225.3-170.8-51.2-65.9000114.1V276 S281 N288V276-F279 CarbonylContact O-C 3.54Å; V276-F279 WeakPolarHBondContact O-CA 3.44Å; V276-F279 PolarHBondContact O-N 3.16Å; F279-S281 PolarHBondContact O-N 3.19Å; F279-N288 PolarHBondContact N-OD1 3.16Å
280I97.9Very high96Very high6 Ų658.1 Ų58.13%0.03133%0.33CS..  trans-76.7112.3177.2-57.3167.4000108.3L271 D275 A277 D282 F283 N288 L291L271-I280 HydrophobicContact CD2-CD1 4.31Å; D275-I280 HydrophobicContact CB-CD1 3.76Å; D275-I280 HydrophobicContact CB-CG1 3.96Å; A277-I280 HydrophobicContact CB-CD1 4.43Å; I280-D282 VanDerWaalsContact C-N 3.32Å; I280-D282 WeakPolarHBondContact CG2-OD1 3.38Å; I280-D282 PolarHBondContact O-N 3.24Å; I280-F283 HydrophobicContact CB-CB 4.08Å; I280-F283 HydrophobicContact CB-CD1 4.25Å; I280-F283 HydrophobicContact CB-CD2 4.12Å; I280-F283 HydrophobicContact CB-CG 3.92Å; I280-F283 HydrophobicContact CD1-CD2 3.77Å; I280-F283 HydrophobicContact CD1-CE2 3.63Å; I280-F283 HydrophobicContact CD1-CG 4.39Å; I280-F283 HydrophobicContact CD1-CZ 4.13Å; I280-F283 HydrophobicContact CG2-CB 4.12Å; I280-F283 HydrophobicContact CG2-CD1 3.46Å; I280-F283 VanDerWaalsContact CG2-CD1 3.46Å; I280-F283 HydrophobicContact CG2-CD2 4.13Å; I280-F283 HydrophobicContact CG2-CE1 3.76Å; I280-F283 HydrophobicContact CG2-CE2 4.4Å; I280-F283 HydrophobicContact CG2-CG 3.65Å; I280-F283 HydrophobicContact CG2-CZ 4.22Å; I280-F283 PolarHBondContact O-N 3.26Å; I280-F283 VanDerWaalsContact O-N 3.14Å; I280-N288 WeakPolarHBondContact CB-OD1 3.45Å; I280-N288 PolarHBondContact N-OD1 3Å; I280-N288 PolarHBondContact O-ND2 3.48Å; I280-L291 HydrophobicContact CD1-CD2 3.55Å
281S96.8Very high95.8Very high124 Ų12455.9 Ų55.987%0.86732%0.319SS*.THydrogen-bonded Turntrans-65.1-29.5-167.460.90000115F279F279-S281 PolarHBondContact O-N 3.19Å
282D97Very high95.6Very high89 Ų8960.5 Ų60.548%0.47634%0.339SS..THydrogen-bonded Turntrans-93.35.7179.765.7-45.7000113R269 I280R269-D282 IonicContact CZ-OD1 3.63Å; R269-D282 IonicContact CZ-OD2 2.63Å; R269-D282 IonicContact NE-OD1 2.85Å; R269-D282 IonicContact NE-OD2 2.89Å; R269-D282 PolarHBondContact NE-OD2 2.96Å; R269-D282 IonicContact NH2-OD1 3.01Å; R269-D282 PolarHBondContact NH2-OD1 3.29Å; R269-D282 IonicContact NH2-OD2 2.7Å; R269-D282 PolarHBondContact NH2-OD2 3.32Å; I280-D282 VanDerWaalsContact C-N 3.32Å; I280-D282 WeakPolarHBondContact CG2-OD1 3.38Å; I280-D282 PolarHBondContact O-N 3.24Å
283F97.4Very high95.3Very high12 Ų1257 Ų575%0.05332%0.321CS..SBendtrans-99.6146.1174.4-77.926000110.2P267 P268 R269 L271 I280 Q287 N288 L291P267-F283 HydrophobicContact CB-CE2 3.86Å; P267-F283 HydrophobicContact CB-CZ 3.93Å; P267-F283 HydrophobicContact CG-CE2 4.3Å; P268-F283 HydrophobicContact CG-CD1 3.89Å; P268-F283 HydrophobicContact CG-CE1 3.82Å; P268-F283 HydrophobicContact CG-CZ 4.37Å; R269-F283 HydrophobicContact CG-CE1 4.04Å; R269-F283 HydrophobicContact CG-CZ 4.48Å; L271-F283 HydrophobicContact CD2-CE2 3.84Å; L271-F283 HydrophobicContact CD2-CZ 3.55Å; I280-F283 HydrophobicContact CB-CB 4.08Å; I280-F283 HydrophobicContact CB-CD1 4.25Å; I280-F283 HydrophobicContact CB-CD2 4.12Å; I280-F283 HydrophobicContact CB-CG 3.92Å; I280-F283 HydrophobicContact CD1-CD2 3.77Å; I280-F283 HydrophobicContact CD1-CE2 3.63Å; I280-F283 HydrophobicContact CD1-CG 4.39Å; I280-F283 HydrophobicContact CD1-CZ 4.13Å; I280-F283 HydrophobicContact CG2-CB 4.12Å; I280-F283 HydrophobicContact CG2-CD1 3.46Å; I280-F283 VanDerWaalsContact CG2-CD1 3.46Å; I280-F283 HydrophobicContact CG2-CD2 4.13Å; I280-F283 HydrophobicContact CG2-CE1 3.76Å; I280-F283 HydrophobicContact CG2-CE2 4.4Å; I280-F283 HydrophobicContact CG2-CG 3.65Å; I280-F283 HydrophobicContact CG2-CZ 4.22Å; I280-F283 PolarHBondContact O-N 3.26Å; I280-F283 VanDerWaalsContact O-N 3.14Å; F283-Q287 HydrophobicContact CB-CB 4.08Å; F283-Q287 HydrophobicContact CD2-CB 3.99Å; F283-Q287 HydrophobicContact CG-CB 4.28Å; F283-N288 WeakPolarHBondContact CB-ND2 3.34Å; F283-N288 PolarHBondContact O-ND2 3.19Å; F283-L291 HydrophobicContact CE2-CD2 3.94Å
284T95.8Very high95.1Very high66 Ų6652 Ų5241%0.40529%0.294SS..  trans-64.4158.6169.464.50000110.8F286 Q287 N288T284-F286 PolarHBondContact O-N 3.31Å; T284-Q287 PolarHBondContact O-N 2.97Å; T284-Q287 VanDerWaalsContact O-N 3.14Å; T284-Q287 VanDerWaalsContact OG1-CD 3.31Å; T284-Q287 VanDerWaalsContact OG1-CG 3.26Å; T284-Q287 WeakPolarHBondContact OG1-CG 3.47Å; T284-Q287 PolarHBondContact OG1-N 3.21Å; T284-Q287 PolarHBondContact OG1-OE1 3Å; T284-N288 PolarHBondContact O-N 3.18Å; T284-N288 PolarHBondContact O-ND2 2.97Å
285P94.3Very high94.8Very high104 Ų10448 Ų4868%0.67527%0.268SS*.Hα-helixtrans-54.5-38.7173.7-27.135.2000112.6N288 V289P285-N288 PolarHBondContact O-N 3.09Å; P285-V289 WeakPolarHBondContact O-CG2 3.43Å; P285-V289 PolarHBondContact O-N 3.19Å
286F91.4Very high94.4Very high35 Ų3549.8 Ų49.815%0.15428%0.28CS..Hα-helixtrans-63.1-46178.3-175.6-127.1000112Y14 F15 S18 K264 T284 V289 V290Y14-F286 AromaticContact CD1-CD2 3.8Å; Y14-F286 HydrophobicContact CD1-CD2 3.8Å; Y14-F286 AromaticContact CD1-CE2 3.55Å; Y14-F286 HydrophobicContact CD1-CE2 3.55Å; Y14-F286 AromaticContact CE1-CD2 3.39Å; Y14-F286 HydrophobicContact CE1-CD2 3.39Å; Y14-F286 AromaticContact CE1-CE2 3.68Å; Y14-F286 HydrophobicContact CE1-CE2 3.68Å; F15-F286 AromaticContact CD1-CZ 3.95Å; F15-F286 HydrophobicContact CD1-CZ 3.95Å; F15-F286 HydrophobicContact CE1-CZ 4.2Å; S18-F286 WeakPolarHBondContact OG-CZ 3.08Å; K264-F286 HydrophobicContact CB-CD1 4.34Å; K264-F286 HydrophobicContact CB-CE1 4.15Å; T284-F286 PolarHBondContact O-N 3.31Å; F286-V289 PolarHBondContact O-N 3.48Å; F286-V290 HydrophobicContact CD2-CG2 4.3Å; F286-V290 HydrophobicContact CE2-CG2 3.94Å; F286-V290 HydrophobicContact CZ-CG2 4.14Å; F286-V290 WeakPolarHBondContact O-CG2 3.32Å; F286-V290 PolarHBondContact O-N 3.17Å
287Q95.4Very high94Very high24 Ų2445.4 Ų45.411%0.11225%0.253CS..Hα-helixtrans-64.2-42.6177.2-71.8164-3900112.4K264 G265 L266 F283 T284 V289 V290 L291K264-Q287 VanDerWaalsContact O-CG 3.28Å; K264-Q287 WeakPolarHBondContact O-CG 3.41Å; G265-Q287 WeakPolarHBondContact O-CA 3.38Å; L266-Q287 PolarHBondContact O-NE2 3.36Å; F283-Q287 HydrophobicContact CB-CB 4.08Å; F283-Q287 HydrophobicContact CD2-CB 3.99Å; F283-Q287 HydrophobicContact CG-CB 4.28Å; T284-Q287 PolarHBondContact O-N 2.97Å; T284-Q287 VanDerWaalsContact O-N 3.14Å; T284-Q287 VanDerWaalsContact OG1-CD 3.31Å; T284-Q287 VanDerWaalsContact OG1-CG 3.26Å; T284-Q287 WeakPolarHBondContact OG1-CG 3.47Å; T284-Q287 PolarHBondContact OG1-N 3.21Å; T284-Q287 PolarHBondContact OG1-OE1 3Å; Q287-V289 PolarHBondContact O-N 3.22Å; Q287-V290 PolarHBondContact O-N 3.43Å; Q287-L291 WeakPolarHBondContact O-CB 3.28Å; Q287-L291 PolarHBondContact O-N 3.1Å
288N96Very high93.6Very high11 Ų1145.4 Ų45.46%0.05925%0.254CS..Hα-helixtrans-60.2-44.9176.5-94-56.8000112.2P278 F279 I280 F283 T284 P285 F292P278-N288 VanDerWaalsContact C-CG 3.41Å; P278-N288 WeakPolarHBondContact CA-OD1 3.39Å; P278-N288 HydrophobicContact CB-CB 4.03Å; P278-N288 WeakPolarHBondContact O-CB 3.46Å; P278-N288 PolarHBondContact O-OD1 3.02Å; F279-N288 PolarHBondContact N-OD1 3.16Å; I280-N288 WeakPolarHBondContact CB-OD1 3.45Å; I280-N288 PolarHBondContact N-OD1 3Å; I280-N288 PolarHBondContact O-ND2 3.48Å; F283-N288 WeakPolarHBondContact CB-ND2 3.34Å; F283-N288 PolarHBondContact O-ND2 3.19Å; T284-N288 PolarHBondContact O-N 3.18Å; T284-N288 PolarHBondContact O-ND2 2.97Å; P285-N288 PolarHBondContact O-N 3.09Å; N288-F292 VanDerWaalsContact O-CB 3.31Å; N288-F292 WeakPolarHBondContact O-CB 3.43Å; N288-F292 PolarHBondContact O-N 3.04Å
289V94.1Very high93.1Very high43 Ų4347.2 Ų47.226%0.26126%0.261SS..Hα-helixtrans-66.6-45.2178.4170.90000111.3Y14 P285 F286 Q287 F292 I293Y14-V289 HydrophobicContact CD1-CG1 3.88Å; Y14-V289 HydrophobicContact CE1-CB 3.71Å; Y14-V289 HydrophobicContact CE1-CG1 3.37Å; Y14-V289 HydrophobicContact CE1-CG2 4.43Å; Y14-V289 HydrophobicContact CE2-CG1 4.24Å; Y14-V289 HydrophobicContact CG-CG1 4.49Å; P285-V289 WeakPolarHBondContact O-CG2 3.43Å; P285-V289 PolarHBondContact O-N 3.19Å; F286-V289 PolarHBondContact O-N 3.48Å; Q287-V289 PolarHBondContact O-N 3.22Å; V289-F292 WeakPolarHBondContact O-CB 3.4Å; V289-F292 PolarHBondContact O-N 3.4Å; V289-I293 HydrophobicContact CG1-CD1 3.84Å; V289-I293 HydrophobicContact CG1-CG1 4.4Å; V289-I293 VanDerWaalsContact O-CG1 3.31Å; V289-I293 WeakPolarHBondContact O-CG1 3.28Å; V289-I293 PolarHBondContact O-N 3.03Å
290V92.5Very high92.5Very high2 Ų242.1 Ų42.11%0.01224%0.244CC..Hα-helixtrans-61.3-47.8178.8167.80000110.8Y14 F15 G265 F286 Q287 F292 I293 L294Y14-V290 HydrophobicContact CD1-CG2 4.44Å; F15-V290 HydrophobicContact CE1-CG1 4.2Å; F15-V290 HydrophobicContact CE1-CG2 3.73Å; F15-V290 HydrophobicContact CZ-CG1 3.9Å; F15-V290 HydrophobicContact CZ-CG2 3.95Å; G265-V290 VanDerWaalsContact O-CB 3.3Å; G265-V290 WeakPolarHBondContact O-CB 3.35Å; G265-V290 VanDerWaalsContact O-CG1 3.31Å; G265-V290 WeakPolarHBondContact O-CG1 3.44Å; F286-V290 HydrophobicContact CD2-CG2 4.3Å; F286-V290 HydrophobicContact CE2-CG2 3.94Å; F286-V290 HydrophobicContact CZ-CG2 4.14Å; F286-V290 WeakPolarHBondContact O-CG2 3.32Å; F286-V290 PolarHBondContact O-N 3.17Å; Q287-V290 PolarHBondContact O-N 3.43Å; V290-F292 VanDerWaalsContact C-N 3.31Å; V290-F292 PolarHBondContact O-N 2.79Å; V290-I293 PolarHBondContact O-N 3.42Å; V290-L294 HydrophobicContact CG1-CD1 4.09Å; V290-L294 HydrophobicContact CG1-CG 4.48Å; V290-L294 WeakPolarHBondContact O-CG 3.47Å; V290-L294 PolarHBondContact O-N 3.22Å
291L95.4Very high91.6Very high2 Ų245.4 Ų45.41%0.0126%0.261CS..Hα-helixtrans-61.1-40.3176.7-179.958.3000111.9F236 P267 L271 A277 I280 F283 Q287 I293 L294 N295F236-L291 HydrophobicContact CB-CD1 4.49Å; F236-L291 HydrophobicContact CD2-CD1 3.66Å; F236-L291 HydrophobicContact CE2-CD1 4.27Å; F236-L291 HydrophobicContact CG-CD1 4.3Å; P267-L291 HydrophobicContact CG-CD1 4.18Å; P267-L291 HydrophobicContact CG-CD2 4.39Å; L271-L291 HydrophobicContact CD1-CD1 3.87Å; L271-L291 HydrophobicContact CD1-CD2 3.89Å; L271-L291 HydrophobicContact CD2-CD2 3.75Å; A277-L291 HydrophobicContact CB-CB 4.09Å; A277-L291 HydrophobicContact CB-CD2 3.96Å; A277-L291 HydrophobicContact CB-CG 3.82Å; I280-L291 HydrophobicContact CD1-CD2 3.55Å; F283-L291 HydrophobicContact CE2-CD2 3.94Å; Q287-L291 WeakPolarHBondContact O-CB 3.28Å; Q287-L291 PolarHBondContact O-N 3.1Å; L291-I293 PolarHBondContact O-N 2.89Å; L291-L294 PolarHBondContact O-N 3.43Å; L291-N295 WeakPolarHBondContact O-CB 3.31Å; L291-N295 VanDerWaalsContact O-CG 3.23Å; L291-N295 PolarHBondContact O-N 3.03Å; L291-N295 PolarHBondContact O-OD1 3.12Å
292F93.9Very high90.7Very high99 Ų9947.2 Ų47.243%0.43425%0.253SS..Hα-helixtrans-58.9-46.1174.9174.4-99.8000112A277 P278 N288 V289 V290 L294 N295 V296A277-F292 HydrophobicContact CB-CB 4.12Å; P278-F292 HydrophobicContact CB-CB 4.29Å; N288-F292 VanDerWaalsContact O-CB 3.31Å; N288-F292 WeakPolarHBondContact O-CB 3.43Å; N288-F292 PolarHBondContact O-N 3.04Å; V289-F292 WeakPolarHBondContact O-CB 3.4Å; V289-F292 PolarHBondContact O-N 3.4Å; V290-F292 VanDerWaalsContact C-N 3.31Å; V290-F292 PolarHBondContact O-N 2.79Å; F292-L294 PolarHBondContact O-N 3.47Å; F292-N295 PolarHBondContact O-N 2.92Å; F292-V296 HydrophobicContact CD1-CG2 4.34Å; F292-V296 HydrophobicContact CE1-CG2 3.87Å; F292-V296 HydrophobicContact CE2-CG2 4.13Å; F292-V296 HydrophobicContact CZ-CG2 3.76Å; F292-V296 WeakPolarHBondContact O-CG2 3.34Å; F292-V296 PolarHBondContact O-N 3.44Å
293I90.8Very high89.4Confident18 Ų1846.4 Ų46.49%0.09226%0.255CS..Hα-helixtrans-65.8-40179.7-58161.2000111.1V10 L11 V289 V290 L291 N295 V296 L297V10-I293 HydrophobicContact CG1-CD1 4.28Å; L11-I293 HydrophobicContact CD1-CG2 3.98Å; L11-I293 HydrophobicContact CD2-CB 3.68Å; L11-I293 HydrophobicContact CD2-CD1 4.02Å; L11-I293 HydrophobicContact CD2-CG1 4.46Å; L11-I293 HydrophobicContact CD2-CG2 3.28Å; L11-I293 HydrophobicContact CG-CB 4.39Å; L11-I293 HydrophobicContact CG-CG2 3.45Å; L11-I293 VanDerWaalsContact CG-CG2 3.45Å; V289-I293 HydrophobicContact CG1-CD1 3.84Å; V289-I293 HydrophobicContact CG1-CG1 4.4Å; V289-I293 VanDerWaalsContact O-CG1 3.31Å; V289-I293 WeakPolarHBondContact O-CG1 3.28Å; V289-I293 PolarHBondContact O-N 3.03Å; V290-I293 PolarHBondContact O-N 3.42Å; L291-I293 PolarHBondContact O-N 2.89Å; I293-N295 VanDerWaalsContact C-N 3.3Å; I293-N295 PolarHBondContact O-N 3.45Å; I293-V296 PolarHBondContact O-N 3.24Å; I293-L297 WeakPolarHBondContact O-CB 3.4Å; I293-L297 PolarHBondContact O-N 2.96Å
294L92.1Very high88Confident4 Ų449 Ų492%0.02127%0.272CS..Hα-helixtrans-60.9-40.3174.2-67.3174.9000111.7F236 S239 W240 A243 V290 L291 F292 L297 G298F236-L294 HydrophobicContact CD2-CD1 4.25Å; F236-L294 HydrophobicContact CE2-CD1 3.69Å; S239-L294 WeakPolarHBondContact CB-O 3.3Å; W240-L294 HydrophobicContact CE3-CD1 4.38Å; A243-L294 HydrophobicContact CB-CD2 3.35Å; V290-L294 HydrophobicContact CG1-CD1 4.09Å; V290-L294 HydrophobicContact CG1-CG 4.48Å; V290-L294 WeakPolarHBondContact O-CG 3.47Å; V290-L294 PolarHBondContact O-N 3.22Å; L291-L294 PolarHBondContact O-N 3.43Å; F292-L294 PolarHBondContact O-N 3.47Å; L294-L297 WeakPolarHBondContact O-CB 3.33Å; L294-L297 PolarHBondContact O-N 3Å; L294-G298 PolarHBondContact O-N 3.3Å
295N90.8Very high86.3Confident31 Ų3147.4 Ų47.417%0.16627%0.269CS..Hα-helixtrans-66-42.3177-70.9-7.9000112.2L291 F292 I293 L297 G298 N299L291-N295 WeakPolarHBondContact O-CB 3.31Å; L291-N295 VanDerWaalsContact O-CG 3.23Å; L291-N295 PolarHBondContact O-N 3.03Å; L291-N295 PolarHBondContact O-OD1 3.12Å; F292-N295 PolarHBondContact O-N 2.92Å; I293-N295 VanDerWaalsContact C-N 3.3Å; I293-N295 PolarHBondContact O-N 3.45Å; N295-L297 VanDerWaalsContact C-N 3.29Å; N295-L297 PolarHBondContact O-N 3.06Å; N295-G298 PolarHBondContact O-N 3.29Å; N295-N299 WeakPolarHBondContact O-CB 3.36Å; N295-N299 PolarHBondContact O-N 2.94Å; N295-N299 PolarHBondContact O-ND2 3.25Å
296V89Confident84Confident56 Ų5649.3 Ų49.334%0.33926%0.263SS..Hα-helixtrans-59.4-44.7174.6170.10000110.2F292 I293 N299 V300F292-V296 HydrophobicContact CD1-CG2 4.34Å; F292-V296 HydrophobicContact CE1-CG2 3.87Å; F292-V296 HydrophobicContact CE2-CG2 4.13Å; F292-V296 HydrophobicContact CZ-CG2 3.76Å; F292-V296 WeakPolarHBondContact O-CG2 3.34Å; F292-V296 PolarHBondContact O-N 3.44Å; I293-V296 PolarHBondContact O-N 3.24Å; V296-N299 PolarHBondContact O-N 3.03Å; V296-V300 HydrophobicContact CG1-CG2 4.31Å; V296-V300 WeakPolarHBondContact O-CG2 3.48Å; V296-V300 PolarHBondContact O-N 3.39Å
297L86.9Confident81.4Confident2 Ų252 Ų521%0.0128%0.279CS..Hα-helixtrans-55.9-54.9176165.752.3000111.7W7 L242 A243 Y246 I293 L294 N295 N299 V300 D301W7-L297 HydrophobicContact CE3-CB 4.43Å; W7-L297 HydrophobicContact CE3-CD1 4.35Å; W7-L297 HydrophobicContact CH2-CB 4.47Å; W7-L297 HydrophobicContact CH2-CD1 3.03Å; W7-L297 HydrophobicContact CH2-CD2 4.22Å; W7-L297 HydrophobicContact CH2-CG 4.06Å; W7-L297 HydrophobicContact CZ2-CD1 3.81Å; W7-L297 HydrophobicContact CZ3-CB 3.97Å; W7-L297 HydrophobicContact CZ3-CD1 3.33Å; W7-L297 HydrophobicContact CZ3-CD2 3.8Å; W7-L297 HydrophobicContact CZ3-CG 3.87Å; L242-L297 HydrophobicContact CD2-CD1 3.45Å; L242-L297 VanDerWaalsContact CD2-CD1 3.45Å; L242-L297 HydrophobicContact CD2-CD2 4.41Å; L242-L297 HydrophobicContact CD2-CG 3.68Å; L242-L297 HydrophobicContact CG-CD1 3.81Å; L242-L297 HydrophobicContact CG-CD2 4.18Å; L242-L297 HydrophobicContact CG-CG 3.98Å; A243-L297 HydrophobicContact CB-CD2 3.81Å; Y246-L297 HydrophobicContact CD2-CD1 4.05Å; Y246-L297 HydrophobicContact CD2-CD2 4.13Å; Y246-L297 HydrophobicContact CE2-CD1 3.68Å; I293-L297 WeakPolarHBondContact O-CB 3.4Å; I293-L297 PolarHBondContact O-N 2.96Å; L294-L297 WeakPolarHBondContact O-CB 3.33Å; L294-L297 PolarHBondContact O-N 3Å; N295-L297 VanDerWaalsContact C-N 3.29Å; N295-L297 PolarHBondContact O-N 3.06Å; L297-N299 VanDerWaalsContact C-N 3.25Å; L297-N299 PolarHBondContact O-N 3.22Å; L297-V300 PolarHBondContact O-N 3.27Å; L297-D301 PolarHBondContact O-N 2.85Å
298G85.3Confident78.6Confident12 Ų1260.6 Ų60.612%0.12431%0.311CS..Hα-helixtrans-59.1-35.8179.400000113.3L294 N295 K302L294-G298 PolarHBondContact O-N 3.3Å; N295-G298 PolarHBondContact O-N 3.29Å; G298-K302 PolarHBondContact O-N 3.13Å; G298-K302 VanDerWaalsContact O-N 3.13Å
299N86.2Confident76Confident84 Ų8463.7 Ų63.745%0.44933%0.33SS..Hα-helixtrans-69.9-43.2177.5-70.6-21.8000112.6H235 N295 V296 L297 D301 K302 S303H235-N299 PolarHBondContact NE2-OD1 3.17Å; N295-N299 WeakPolarHBondContact O-CB 3.36Å; N295-N299 PolarHBondContact O-N 2.94Å; N295-N299 PolarHBondContact O-ND2 3.25Å; V296-N299 PolarHBondContact O-N 3.03Å; L297-N299 VanDerWaalsContact C-N 3.25Å; L297-N299 PolarHBondContact O-N 3.22Å; N299-D301 VanDerWaalsContact C-N 3.33Å; N299-D301 PolarHBondContact O-N 3.19Å; N299-K302 PolarHBondContact O-N 3.16Å; N299-S303 PolarHBondContact O-N 3.39Å; N299-S303 PolarHBondContact O-OG 3.48Å
300V83.1Confident73.4Confident61 Ų6165.6 Ų65.637%0.3734%0.336SS..Hα-helixtrans-61.9-43177.2169.80000110.7V296 L297 S303 T304V296-V300 HydrophobicContact CG1-CG2 4.31Å; V296-V300 WeakPolarHBondContact O-CG2 3.48Å; V296-V300 PolarHBondContact O-N 3.39Å; L297-V300 PolarHBondContact O-N 3.27Å; V300-S303 PolarHBondContact O-N 2.85Å; V300-T304 HydrophobicContact CG1-CG2 4.17Å; V300-T304 WeakPolarHBondContact O-CB 3.49Å; V300-T304 VanDerWaalsContact O-CG2 3.31Å; V300-T304 WeakPolarHBondContact O-CG2 3.31Å; V300-T304 PolarHBondContact O-N 3.3Å; V300-T304 PolarHBondContact O-OG1 3.02Å
301D79.4Confident70.9Confident74 Ų7472.9 Ų72.940%0.39637%0.368SS..Hα-helixtrans-63.5-45.8177.9-176.676.4000112.1L242 L297 N299 S303 T304 G305L242-D301 HydrophobicContact CD2-CB 3.26Å; L297-D301 PolarHBondContact O-N 2.85Å; N299-D301 VanDerWaalsContact C-N 3.33Å; N299-D301 PolarHBondContact O-N 3.19Å; D301-S303 VanDerWaalsContact C-N 3.29Å; D301-S303 PolarHBondContact O-N 3.02Å; D301-T304 WeakPolarHBondContact CA-OG1 3.48Å; D301-T304 PolarHBondContact O-N 3.16Å; D301-T304 VanDerWaalsContact O-N 3.16Å; D301-T304 PolarHBondContact O-OG1 3.25Å; D301-G305 PolarHBondContact O-N 2.75Å
302K77.9Confident68.3Low162 Ų16275.7 Ų75.770%0.70439%0.387SS*.Hα-helixtrans-56.1-43.7174-171.4178.3-178.3179.50112.4G298 N299 Y306G298-K302 PolarHBondContact O-N 3.13Å; G298-K302 VanDerWaalsContact O-N 3.13Å; N299-K302 PolarHBondContact O-N 3.16Å; K302-Y306 WeakPolarHBondContact O-CB 3.32Å; K302-Y306 PolarHBondContact O-N 3.28Å; K302-Y306 VanDerWaalsContact O-N 3.13Å
303S69.4Low65.6Low72 Ų7275.9 Ų75.950%0.50339%0.393SS..Hα-helixtrans-68.2-39.7177.9-64.70000113N299 V300 D301 L307N299-S303 PolarHBondContact O-N 3.39Å; N299-S303 PolarHBondContact O-OG 3.48Å; V300-S303 PolarHBondContact O-N 2.85Å; D301-S303 VanDerWaalsContact C-N 3.29Å; D301-S303 PolarHBondContact O-N 3.02Å; S303-L307 WeakPolarHBondContact O-CG 3.4Å; S303-L307 PolarHBondContact O-N 3.06Å
304T68.1Low63.4Low66 Ų6679.6 Ų79.641%0.40542%0.416SS..Hα-helixtrans-78.1-31.418058.80000113V300 D301 L307 R308V300-T304 HydrophobicContact CG1-CG2 4.17Å; V300-T304 WeakPolarHBondContact O-CB 3.49Å; V300-T304 VanDerWaalsContact O-CG2 3.31Å; V300-T304 WeakPolarHBondContact O-CG2 3.31Å; V300-T304 PolarHBondContact O-N 3.3Å; V300-T304 PolarHBondContact O-OG1 3.02Å; D301-T304 WeakPolarHBondContact CA-OG1 3.48Å; D301-T304 PolarHBondContact O-N 3.16Å; D301-T304 VanDerWaalsContact O-N 3.16Å; D301-T304 PolarHBondContact O-OG1 3.25Å; T304-L307 PolarHBondContact O-N 3.13Å; T304-R308 WeakPolarHBondContact O-CB 3.39Å; T304-R308 PolarHBondContact O-N 3Å
305G59.9Low60.8Low34 Ų3483.6 Ų83.635%0.35144%0.444SS..Hα-helixtrans-61.9-43.8169.500000111.5D301 R308 T309D301-G305 PolarHBondContact O-N 2.75Å; G305-R308 PolarHBondContact O-N 3.36Å; G305-T309 PolarHBondContact O-N 2.88Å; G305-T309 PolarHBondContact O-OG1 2.9Å
306Y45.6Very low58.3Low143 Ų14390.6 Ų90.656%0.56147%0.468SS*.Hα-helixtrans-61-45.6172.3-175.8-92.9000112.1K302 R308 T309 E310K302-Y306 WeakPolarHBondContact O-CB 3.32Å; K302-Y306 PolarHBondContact O-N 3.28Å; K302-Y306 VanDerWaalsContact O-N 3.13Å; Y306-R308 VanDerWaalsContact C-N 3.3Å; Y306-R308 PolarHBondContact O-N 3.16Å; Y306-T309 WeakPolarHBondContact CA-OG1 3.41Å; Y306-T309 PolarHBondContact O-N 3.36Å; Y306-T309 PolarHBondContact O-OG1 3.21Å; Y306-E310 HydrophobicContact CD1-CG 4.34Å; Y306-E310 HydrophobicContact CE1-CG 3.87Å; Y306-E310 WeakPolarHBondContact CE1-OE1 3.42Å; Y306-E310 PolarHBondContact O-N 2.75Å; Y306-E310 PolarHBondContact OH-OE1 3.26Å
307L38Very low55.7Low93 Ų9390 Ų9049%0.48747%0.473SS..Hα-helixtrans-64.1-32.2175.1-72.6167.1000113.2S303 T304 K311S303-L307 WeakPolarHBondContact O-CG 3.4Å; S303-L307 PolarHBondContact O-N 3.06Å; T304-L307 PolarHBondContact O-N 3.13Å; L307-K311 WeakPolarHBondContact O-CB 3.01Å; L307-K311 WeakPolarHBondContact O-CG 3.31Å; L307-K311 PolarHBondContact O-N 3.33Å
308R36.1Very low53.3Low204 Ų20497.2 Ų97.277%0.7751%0.507SS*.Hα-helixtrans-72.5-34.9176.3-161.6-177.2-86.1-173.4-2.7111T304 G305 Y306 S312T304-R308 WeakPolarHBondContact O-CB 3.39Å; T304-R308 PolarHBondContact O-N 3Å; G305-R308 PolarHBondContact O-N 3.36Å; Y306-R308 VanDerWaalsContact C-N 3.3Å; Y306-R308 PolarHBondContact O-N 3.16Å; R308-S312 PolarHBondContact O-N 3.04Å; R308-S312 VanDerWaalsContact O-N 3.14Å; R308-S312 PolarHBondContact O-OG 2.78Å
309T41.2Very low50.8Low76 Ų76100.1 Ų100.147%0.46653%0.526SS..Hα-helixtrans-72.6-39.6173.810.70000112.5G305 Y306 S312 N313G305-T309 PolarHBondContact O-N 2.88Å; G305-T309 PolarHBondContact O-OG1 2.9Å; Y306-T309 WeakPolarHBondContact CA-OG1 3.41Å; Y306-T309 PolarHBondContact O-N 3.36Å; Y306-T309 PolarHBondContact O-OG1 3.21Å; T309-S312 VanDerWaalsContact CA-OG 3.31Å; T309-S312 WeakPolarHBondContact CA-OG 3.31Å; T309-S312 PolarHBondContact O-N 2.98Å; T309-S312 PolarHBondContact O-OG 2.86Å; T309-N313 WeakPolarHBondContact O-CB 3.5Å; T309-N313 PolarHBondContact O-N 2.7Å; T309-N313 PolarHBondContact O-ND2 3.47Å
310E39.6Very low48.4Very low82 Ų82103.8 Ų103.838%0.38354%0.54SS..Hα-helixtrans-63.2-44.3173.1-79.5-170.6158.200111.9Y306 S312 N313 V314Y306-E310 HydrophobicContact CD1-CG 4.34Å; Y306-E310 HydrophobicContact CE1-CG 3.87Å; Y306-E310 WeakPolarHBondContact CE1-OE1 3.42Å; Y306-E310 PolarHBondContact O-N 2.75Å; Y306-E310 PolarHBondContact OH-OE1 3.26Å; E310-S312 VanDerWaalsContact C-N 3.33Å; E310-S312 PolarHBondContact O-N 3.49Å; E310-N313 PolarHBondContact O-N 3.44Å; E310-N313 VanDerWaalsContact O-N 3.15Å; E310-V314 VanDerWaalsContact O-CG2 3.31Å; E310-V314 WeakPolarHBondContact O-CG2 3.47Å; E310-V314 PolarHBondContact O-N 3.18Å
311K39.4Very low46.1Very low156 Ų156105.7 Ų105.768%0.67856%0.556SS**Hα-helixtrans-60.8-40.6174.7-77.9-175.7179.1-177.40112.2L307 N313 V314 S315L307-K311 WeakPolarHBondContact O-CB 3.01Å; L307-K311 WeakPolarHBondContact O-CG 3.31Å; L307-K311 PolarHBondContact O-N 3.33Å; K311-N313 VanDerWaalsContact C-N 3.33Å; K311-N313 PolarHBondContact O-N 3Å; K311-V314 PolarHBondContact O-N 3.4Å; K311-S315 PolarHBondContact O-N 3.14Å; K311-S315 PolarHBondContact O-OG 3.41Å
312S41.1Very low44Very low61 Ų61107.4 Ų107.443%0.42757%0.574SS.*Hα-helixtrans-65.9-33.617555.20000113.4R308 T309 E310 R316R308-S312 PolarHBondContact O-N 3.04Å; R308-S312 VanDerWaalsContact O-N 3.14Å; R308-S312 PolarHBondContact O-OG 2.78Å; T309-S312 VanDerWaalsContact CA-OG 3.31Å; T309-S312 WeakPolarHBondContact CA-OG 3.31Å; T309-S312 PolarHBondContact O-N 2.98Å; T309-S312 PolarHBondContact O-OG 2.86Å; E310-S312 VanDerWaalsContact C-N 3.33Å; E310-S312 PolarHBondContact O-N 3.49Å; S312-R316 PolarHBondContact O-N 2.98Å
313N38.8Very low42Very low103 Ų103104.3 Ų104.355%0.55157%0.572SS**Hα-helixtrans-76-34.6177.3-72.3-16.5000112.3T309 E310 K311 R316 G317T309-N313 WeakPolarHBondContact O-CB 3.5Å; T309-N313 PolarHBondContact O-N 2.7Å; T309-N313 PolarHBondContact O-ND2 3.47Å; E310-N313 PolarHBondContact O-N 3.44Å; E310-N313 VanDerWaalsContact O-N 3.15Å; K311-N313 VanDerWaalsContact C-N 3.33Å; K311-N313 PolarHBondContact O-N 3Å; N313-R316 PolarHBondContact O-N 3.31Å; N313-G317 PolarHBondContact O-N 3.15Å
314V42.8Very low40.6Very low96 Ų96112 Ų11258%0.58259%0.59SS**Hα-helixtrans-67.7-39.4172.71720000111.3E310 K311 R316 G317 H318E310-V314 VanDerWaalsContact O-CG2 3.31Å; E310-V314 WeakPolarHBondContact O-CG2 3.47Å; E310-V314 PolarHBondContact O-N 3.18Å; K311-V314 PolarHBondContact O-N 3.4Å; V314-R316 VanDerWaalsContact C-N 3.28Å; V314-R316 PolarHBondContact O-N 2.99Å; V314-G317 PolarHBondContact O-N 3.48Å; V314-H318 PolarHBondContact O-N 2.89Å
315S39.4Very low39.3Very low87 Ų87116.2 Ų116.261%0.60861%0.609SS**Hα-helixtrans-64.8-30.8173.3-57.90000113K311K311-S315 PolarHBondContact O-N 3.14Å; K311-S315 PolarHBondContact O-OG 3.41Å
316R36.3Very low38Very low178 Ų178125.6 Ų125.667%0.67264%0.635SS**Hα-helixtrans-76.9-33.1176.4-146.3172.7-178.1162.90.2112.6S312 N313 V314 H318 S319S312-R316 PolarHBondContact O-N 2.98Å; N313-R316 PolarHBondContact O-N 3.31Å; V314-R316 VanDerWaalsContact C-N 3.28Å; V314-R316 PolarHBondContact O-N 2.99Å; R316-H318 VanDerWaalsContact C-N 3.33Å; R316-H318 PolarHBondContact O-N 3.4Å; R316-S319 PolarHBondContact O-N 3.26Å; R316-S319 PolarHBondContact O-OG 3.34Å
317G35.1Very low37.3Very low43 Ų43122.4 Ų122.444%0.44365%0.646SS.*Hα-helixtrans-70.3-22.9174.100000114.6N313 V314N313-G317 PolarHBondContact O-N 3.15Å; V314-G317 PolarHBondContact O-N 3.48Å
318H35.8Very low37.1Very low154 Ų154125.9 Ų125.971%0.71367%0.665SS**Hα-helixtrans-85.8-17.4173.8-87.6-6.6000114.4V314 R316V314-H318 PolarHBondContact O-N 2.89Å; R316-H318 VanDerWaalsContact C-N 3.33Å; R316-H318 PolarHBondContact O-N 3.4Å
319S34.5Very low37.1Very low74 Ų74123.1 Ų123.152%0.51767%0.666SS.*Hα-helixtrans-81.1-22.2172.852.50000114.1R316R316-S319 PolarHBondContact O-N 3.26Å; R316-S319 PolarHBondContact O-OG 3.34Å
320E35.5Very low36.9Very low160 Ų160129 Ų12975%0.74871%0.71SS**THydrogen-bonded Turntrans-88.5-5.6-179.6-73.7-176168.300114.1
321S34.8Very low36.7Very low102 Ų102131.3 Ų131.371%0.71373%0.726SS**THydrogen-bonded Turntrans-93.3-3.8178.9-177.40000114.5
322S35.8Very low36.6Very low109 Ų109130 Ų13076%0.76273%0.729SS**SBendtrans-116.110.8-171.9-163.10000115.6
323S35.4Very low36.3Very low97 Ų97133.8 Ų133.868%0.67875%0.745SS**  trans-127.944.9-177.539.20000113.4
324R38.5Very low36.2Very low234 Ų234135.6 Ų135.688%0.88376%0.757SS**  trans-133.5102.7156.2-72.4-174.2-168.3179.64.5108.4
325I41.2Very low35.8Very low154 Ų154138.1 Ų138.179%0.7977%0.768SS**  trans171.2140146.4-84.9151.6000107.3
326Y32.9Very low35.5Very low231 Ų231141.5 Ų141.591%0.90678%0.778SS**  trans85.6103.2-168.5-61.3-76.3000112.9
327G30.4Very low35.5Very low77 Ų77138.9 Ų138.979%0.79479%0.786SS**  cis112.9139.546.200000106.2
328N33.7Very low35.5Very low165 Ų165146.3 Ų146.388%0.88281%0.812SS**  cis-164.9158.816.9-1425.4000109.3
329N36.3Very low35.5Very low146 Ų146145.7 Ų145.778%0.78182%0.821SS**  trans-62.5156.3162.7-83.3-29.7000112.3
330S36.8Very low35.6Very low199 Ų199152.2 Ų152.2100%1.39285%0.848SS**  trans89.80164.2-54.40000117

Retrieved 330 of 330 residues in 335.5 ms (Link to these results)

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