A0A060VW99_ONCMY Loading...

TLC domain containing 5a

AlphaFold DB , UniProt , Accession A0A060VW99, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 242 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M51.7Low86.1Confident182 Ų18281.5 Ų81.590%0.89748%0.475SS*.  0-270-67.6-169.878.600113.4S3 L4M1-S3 PolarHBondContact O-N 3.35Å; M1-L4 PolarHBondContact O-N 3.3Å
2T55Low87.2Confident131 Ų13178.1 Ų78.180%0.80445%0.453SS*.THydrogen-bonded Turntrans-64.3-14.9176.945.70000115.1I6T2-I6 WeakPolarHBondContact O-CD1 3.44Å
3S79.6Confident88Confident82 Ų8277.8 Ų77.857%0.57345%0.453SS*.Hα-helixtrans-85.8-19.818053.60000115.3M1 G7M1-S3 PolarHBondContact O-N 3.35Å; S3-G7 PolarHBondContact O-N 3.21Å
4L90.3Very high88.8Confident45 Ų4575.1 Ų75.124%0.23645%0.45CS..Hα-helixtrans-70.6-49.9-175.6-74.3171.2000113M1 I6 G7 V8 I74 V78 L116M1-L4 PolarHBondContact O-N 3.3Å; L4-I6 VanDerWaalsContact C-N 3.25Å; L4-I6 PolarHBondContact O-N 3.41Å; L4-G7 PolarHBondContact O-N 2.92Å; L4-G7 VanDerWaalsContact O-N 3.14Å; L4-V8 WeakPolarHBondContact O-CG2 3.29Å; L4-V8 PolarHBondContact O-N 3.41Å; L4-I74 HydrophobicContact CD2-CG2 3.58Å; L4-V78 HydrophobicContact CD2-CG2 4.03Å; L4-L116 HydrophobicContact CD2-CD2 4.42Å
5P92.6Very high89.4Confident83 Ų8371.4 Ų71.454%0.53943%0.425SS..Hα-helixtrans-60.7-38.5177.9-22.334.5000111.8V8 V9P5-V8 PolarHBondContact O-N 3.38Å; P5-V9 WeakPolarHBondContact O-CG2 3.44Å; P5-V9 PolarHBondContact O-N 3.49Å
6I93.8Very high90Very high103 Ų10370.6 Ų70.653%0.52842%0.417SS..Hα-helixtrans-61-48.1175.5-60.8174.9000110.1T2 L4 V8 V9 L10T2-I6 WeakPolarHBondContact O-CD1 3.44Å; L4-I6 VanDerWaalsContact C-N 3.25Å; L4-I6 PolarHBondContact O-N 3.41Å; I6-V8 VanDerWaalsContact C-N 3.32Å; I6-V8 PolarHBondContact O-N 2.98Å; I6-V9 PolarHBondContact O-N 3.48Å; I6-L10 HydrophobicContact CG2-CD1 3.91Å; I6-L10 HydrophobicContact CG2-CG 4.29Å; I6-L10 WeakPolarHBondContact O-CB 3.46Å; I6-L10 VanDerWaalsContact O-CG 3.27Å; I6-L10 WeakPolarHBondContact O-CG 3.42Å; I6-L10 PolarHBondContact O-N 3.48Å
7G95.4Very high90.5Very high19 Ų1970.4 Ų70.420%0.19642%0.417CS..Hα-helixtrans-58.4-41.6177.100000113.1S3 L4 L10 C11 V78S3-G7 PolarHBondContact O-N 3.21Å; L4-G7 PolarHBondContact O-N 2.92Å; L4-G7 VanDerWaalsContact O-N 3.14Å; G7-L10 PolarHBondContact O-N 3.38Å; G7-C11 PolarHBondContact O-N 3.2Å; G7-C11 PolarHBondContact O-SG 2.77Å; G7-V78 VanDerWaalsContact C-CG1 3.48Å
8V96.6Very high90.9Very high21 Ų2169.1 Ų69.113%0.12741%0.408CS..Hα-helixtrans-66.1-45.3177.2175.80000111.2L4 P5 I6 L10 C11 L12 V78 L81 I85L4-V8 WeakPolarHBondContact O-CG2 3.29Å; L4-V8 PolarHBondContact O-N 3.41Å; P5-V8 PolarHBondContact O-N 3.38Å; I6-V8 VanDerWaalsContact C-N 3.32Å; I6-V8 PolarHBondContact O-N 2.98Å; V8-L10 VanDerWaalsContact C-N 3.34Å; V8-L10 PolarHBondContact O-N 2.98Å; V8-C11 PolarHBondContact O-N 3.46Å; V8-L12 WeakPolarHBondContact O-CB 3.42Å; V8-L12 PolarHBondContact O-N 2.95Å; V8-V78 HydrophobicContact CG2-CG1 4.01Å; V8-V78 HydrophobicContact CG2-CG2 4.28Å; V8-L81 HydrophobicContact CG1-CD2 4.1Å; V8-L81 HydrophobicContact CG1-CG 4.15Å; V8-L81 HydrophobicContact CG2-CD2 3.72Å; V8-L81 HydrophobicContact CG2-CG 4.44Å; V8-I85 HydrophobicContact CG1-CD1 4.08Å
9V97.1Very high91.3Very high85 Ų8567 Ų6752%0.51539%0.392SS..Hα-helixtrans-60.9-44.7176.6170.20000110.7P5 I6 C11 L12 T13P5-V9 WeakPolarHBondContact O-CG2 3.44Å; P5-V9 PolarHBondContact O-N 3.49Å; I6-V9 PolarHBondContact O-N 3.48Å; V9-C11 PolarHBondContact O-N 2.95Å; V9-L12 PolarHBondContact O-N 3.41Å; V9-T13 WeakPolarHBondContact O-CB 3.44Å; V9-T13 PolarHBondContact O-N 3.46Å; V9-T13 PolarHBondContact O-OG1 3Å
10L97.4Very high91.7Very high116 Ų11670.1 Ų70.161%0.60740%0.401SS*.Hα-helixtrans-61.1-45176.8-71.3173.4000111.9I6 G7 V8 T13 G14I6-L10 HydrophobicContact CG2-CD1 3.91Å; I6-L10 HydrophobicContact CG2-CG 4.29Å; I6-L10 WeakPolarHBondContact O-CB 3.46Å; I6-L10 VanDerWaalsContact O-CG 3.27Å; I6-L10 WeakPolarHBondContact O-CG 3.42Å; I6-L10 PolarHBondContact O-N 3.48Å; G7-L10 PolarHBondContact O-N 3.38Å; V8-L10 VanDerWaalsContact C-N 3.34Å; V8-L10 PolarHBondContact O-N 2.98Å; L10-T13 PolarHBondContact O-N 3.39Å; L10-G14 PolarHBondContact O-N 3.47Å
11C98.1Very high92Very high30 Ų3071.2 Ų71.220%0.20341%0.405CS..Hα-helixtrans-63.3-44.4176.5-68.10000111.4G7 V8 V9 T13 G14 W15G7-C11 PolarHBondContact O-N 3.2Å; G7-C11 PolarHBondContact O-SG 2.77Å; V8-C11 PolarHBondContact O-N 3.46Å; V9-C11 PolarHBondContact O-N 2.95Å; C11-T13 PolarHBondContact O-N 3.01Å; C11-G14 WeakPolarHBondContact O-CA 3.39Å; C11-G14 PolarHBondContact O-N 2.92Å; C11-G14 VanDerWaalsContact O-N 3.16Å; C11-W15 PolarHBondContact O-N 2.97Å
12L98.4Very high94.1Very high40 Ų4064.2 Ų64.221%0.20937%0.371CS..Hα-helixtrans-58.8-48.2176.4176.960.8000111.6V8 V9 G14 W15 I16 G82 I85 F86V8-L12 WeakPolarHBondContact O-CB 3.42Å; V8-L12 PolarHBondContact O-N 2.95Å; V9-L12 PolarHBondContact O-N 3.41Å; L12-G14 VanDerWaalsContact C-N 3.27Å; L12-G14 PolarHBondContact O-N 3.29Å; L12-W15 PolarHBondContact O-N 3.46Å; L12-I16 HydrophobicContact CD1-CD1 3.97Å; L12-I16 HydrophobicContact CD1-CG1 4.36Å; L12-I16 HydrophobicContact CG-CD1 3.92Å; L12-I16 WeakPolarHBondContact O-CG1 3.29Å; L12-I16 PolarHBondContact O-N 2.98Å; L12-G82 WeakPolarHBondContact CD1-O 3.13Å; L12-I85 HydrophobicContact CD1-CB 4.29Å; L12-I85 HydrophobicContact CD1-CG2 3.98Å; L12-I85 HydrophobicContact CD2-CG2 4Å; L12-F86 HydrophobicContact CD1-CB 3.76Å
13T98.4Very high96.1Very high74 Ų7458.7 Ų58.745%0.45434%0.338SS..Hα-helixtrans-61.5-37.3175.6-58.90000111.5V9 L10 C11 I16 T17V9-T13 WeakPolarHBondContact O-CB 3.44Å; V9-T13 PolarHBondContact O-N 3.46Å; V9-T13 PolarHBondContact O-OG1 3Å; L10-T13 PolarHBondContact O-N 3.39Å; C11-T13 PolarHBondContact O-N 3.01Å; T13-I16 PolarHBondContact O-N 3.39Å; T13-T17 VanDerWaalsContact O-CB 3.29Å; T13-T17 WeakPolarHBondContact O-CB 3.38Å; T13-T17 PolarHBondContact O-N 3.24Å; T13-T17 PolarHBondContact O-OG1 3.48Å
14G98.6Very high96.9Very high40 Ų4059.8 Ų59.841%0.41234%0.337SS..Hα-helixtrans-58.9-50.8173.400000112.3L10 C11 L12 T17 L18L10-G14 PolarHBondContact O-N 3.47Å; C11-G14 WeakPolarHBondContact O-CA 3.39Å; C11-G14 PolarHBondContact O-N 2.92Å; C11-G14 VanDerWaalsContact O-N 3.16Å; L12-G14 VanDerWaalsContact C-N 3.27Å; L12-G14 PolarHBondContact O-N 3.29Å; G14-T17 PolarHBondContact O-N 3.36Å; G14-L18 WeakPolarHBondContact O-CB 3.39Å; G14-L18 PolarHBondContact O-N 2.91Å
15W98.6Very high97.1Very high20 Ų2063.7 Ų63.78%0.07636%0.358CS..Hα-helixtrans-63-42.5177.9-67.7119.5000112.8C11 L12 T17 L18 Y19 V38 L41 H42 L45 I79 Y83 F86C11-W15 PolarHBondContact O-N 2.97Å; L12-W15 PolarHBondContact O-N 3.46Å; W15-T17 VanDerWaalsContact C-N 3.35Å; W15-T17 PolarHBondContact O-N 2.91Å; W15-L18 HydrophobicContact CE3-CD2 3.96Å; W15-L18 HydrophobicContact CZ3-CD2 3.92Å; W15-L18 PolarHBondContact O-N 2.87Å; W15-Y19 WeakPolarHBondContact O-CB 3.35Å; W15-Y19 PolarHBondContact O-N 3.49Å; W15-V38 HydrophobicContact CE3-CG1 3.62Å; W15-V38 HydrophobicContact CZ3-CG1 4.09Å; W15-L41 HydrophobicContact CZ3-CD2 4.34Å; W15-H42 HydrophobicContact CH2-CB 3.8Å; W15-H42 HydrophobicContact CZ2-CB 4.24Å; W15-H42 AromaticContact CZ2-ND1 3.67Å; W15-H42 HydrophobicContact CZ3-CB 4.18Å; W15-L45 HydrophobicContact CH2-CD2 4.14Å; W15-L45 HydrophobicContact CZ2-CD2 4.26Å; W15-I79 HydrophobicContact CZ2-CG2 3.86Å; W15-I79 PolarHBondContact NE1-O 3.49Å; W15-I79 VanDerWaalsContact NE1-O 3.09Å; W15-Y83 VanDerWaalsContact CD1-CA 3.5Å; W15-Y83 VanDerWaalsContact CD1-N 3.27Å; W15-Y83 HydrophobicContact CD2-CD2 4.28Å; W15-Y83 HydrophobicContact CE3-CD2 4.41Å; W15-F86 HydrophobicContact CB-CB 4.26Å; W15-F86 HydrophobicContact CB-CD1 4.43Å; W15-F86 HydrophobicContact CB-CG 4.22Å
16I98.5Very high97.2Very high58 Ų5862.2 Ų62.230%0.29735%0.345SS..Hα-helixtrans-62.6-43.1175.5-68.7165.9000111L12 T13 Y19 K20 F86L12-I16 HydrophobicContact CD1-CD1 3.97Å; L12-I16 HydrophobicContact CD1-CG1 4.36Å; L12-I16 HydrophobicContact CG-CD1 3.92Å; L12-I16 WeakPolarHBondContact O-CG1 3.29Å; L12-I16 PolarHBondContact O-N 2.98Å; T13-I16 PolarHBondContact O-N 3.39Å; I16-Y19 PolarHBondContact O-N 3.34Å; I16-K20 HydrophobicContact CG2-CD 4.32Å; I16-K20 WeakPolarHBondContact O-CG 3.29Å; I16-K20 PolarHBondContact O-N 3.39Å; I16-F86 HydrophobicContact CG1-CD2 3.78Å; I16-F86 HydrophobicContact CG1-CE2 4.41Å
17T98.4Very high97Very high68 Ų6864.6 Ų64.642%0.41736%0.355SS..Hα-helixtrans-64-46.1178.6-59.60000110.6T13 G14 W15 Y19 K20 L21T13-T17 VanDerWaalsContact O-CB 3.29Å; T13-T17 WeakPolarHBondContact O-CB 3.38Å; T13-T17 PolarHBondContact O-N 3.24Å; T13-T17 PolarHBondContact O-OG1 3.48Å; G14-T17 PolarHBondContact O-N 3.36Å; W15-T17 VanDerWaalsContact C-N 3.35Å; W15-T17 PolarHBondContact O-N 2.91Å; T17-Y19 VanDerWaalsContact C-N 3.34Å; T17-Y19 PolarHBondContact O-N 3.04Å; T17-K20 PolarHBondContact O-N 2.94Å; T17-L21 HydrophobicContact CG2-CD1 4.12Å; T17-L21 HydrophobicContact CG2-CG 4.42Å; T17-L21 WeakPolarHBondContact O-CG 3.4Å; T17-L21 PolarHBondContact O-N 3.24Å
18L98.5Very high96.8Very high47 Ų4769.2 Ų69.225%0.24638%0.384CS..Hα-helixtrans-57.3-47.3175.2174.764.9000111.6G14 W15 K20 L21 L22 V38 L41G14-L18 WeakPolarHBondContact O-CB 3.39Å; G14-L18 PolarHBondContact O-N 2.91Å; W15-L18 HydrophobicContact CE3-CD2 3.96Å; W15-L18 HydrophobicContact CZ3-CD2 3.92Å; W15-L18 PolarHBondContact O-N 2.87Å; L18-K20 VanDerWaalsContact C-N 3.34Å; L18-K20 PolarHBondContact O-N 3.45Å; L18-L21 PolarHBondContact O-N 3.17Å; L18-L22 HydrophobicContact CD1-CD1 4.19Å; L18-L22 HydrophobicContact CD1-CG 4.24Å; L18-L22 HydrophobicContact CG-CD1 4.1Å; L18-L22 WeakPolarHBondContact O-CG 3.39Å; L18-L22 PolarHBondContact O-N 2.96Å; L18-V38 HydrophobicContact CD2-CG1 4.39Å; L18-V38 HydrophobicContact CD2-CG2 4.29Å; L18-V38 HydrophobicContact CG-CG2 4.27Å; L18-L41 HydrophobicContact CD2-CD2 3.47Å; L18-L41 VanDerWaalsContact CD2-CD2 3.47Å
19Y98.4Very high96.4Very high29 Ų2974.2 Ų74.211%0.11440%0.4CS..Hα-helixtrans-56.5-47.2176.6171.5-110.3000111.9W15 I16 T17 L21 L22 C23 F31 N34 C35 V38 F86 W90W15-Y19 WeakPolarHBondContact O-CB 3.35Å; W15-Y19 PolarHBondContact O-N 3.49Å; I16-Y19 PolarHBondContact O-N 3.34Å; T17-Y19 VanDerWaalsContact C-N 3.34Å; T17-Y19 PolarHBondContact O-N 3.04Å; Y19-L21 PolarHBondContact O-N 3.47Å; Y19-L22 PolarHBondContact O-N 3.12Å; Y19-C23 VanDerWaalsContact CE2-SG 3.52Å; Y19-C23 PolarHBondContact O-N 2.9Å; Y19-C23 PolarHBondContact O-SG 2.68Å; Y19-C23 VanDerWaalsContact O-SG 3.32Å; Y19-F31 WeakPolarHBondContact OH-CB 3.48Å; Y19-F31 WeakPolarHBondContact OH-CD1 3.25Å; Y19-N34 HydrophobicContact CD2-CB 4.38Å; Y19-N34 HydrophobicContact CE2-CB 4.16Å; Y19-C35 HydrophobicContact CD2-CB 4.36Å; Y19-C35 HydrophobicContact CE2-CB 3.97Å; Y19-V38 HydrophobicContact CD2-CG2 4.39Å; Y19-F86 HydrophobicContact CD1-CE2 4.16Å; Y19-F86 HydrophobicContact CD1-CZ 4.31Å; Y19-F86 HydrophobicContact CD2-CZ 4.01Å; Y19-F86 AromaticContact CG-CE2 3.97Å; Y19-F86 HydrophobicContact CG-CE2 3.97Å; Y19-F86 AromaticContact CG-CZ 3.73Å; Y19-F86 HydrophobicContact CG-CZ 3.73Å; Y19-W90 AromaticContact CE2-NE1 3.75Å; Y19-W90 AromaticContact CZ-NE1 3.48Å; Y19-W90 PolarHBondContact OH-NE1 3.47Å; Y19-W90 VanDerWaalsContact OH-NE1 3.17Å
20K97.7Very high96.2Very high129 Ų12971.9 Ų71.956%0.56139%0.393SS*.Hα-helixtrans-61.7-43.2177.5-73.6177.8177.3-177.60112.2I16 T17 L18 L22 C23 N24I16-K20 HydrophobicContact CG2-CD 4.32Å; I16-K20 WeakPolarHBondContact O-CG 3.29Å; I16-K20 PolarHBondContact O-N 3.39Å; T17-K20 PolarHBondContact O-N 2.94Å; L18-K20 VanDerWaalsContact C-N 3.34Å; L18-K20 PolarHBondContact O-N 3.45Å; K20-L22 VanDerWaalsContact C-N 3.33Å; K20-L22 PolarHBondContact O-N 3.44Å; K20-C23 WeakPolarHBondContact O-CB 3.41Å; K20-C23 PolarHBondContact O-N 2.63Å; K20-N24 VanDerWaalsContact O-CG 3.28Å; K20-N24 PolarHBondContact O-N 3.28Å; K20-N24 PolarHBondContact O-OD1 3.46Å
21L98Very high96.1Very high93 Ų9372.4 Ų72.449%0.48739%0.391SS..Hα-helixtrans-62-41.5176.5-69.7173.1000111.7T17 L18 Y19 N24 N25T17-L21 HydrophobicContact CG2-CD1 4.12Å; T17-L21 HydrophobicContact CG2-CG 4.42Å; T17-L21 WeakPolarHBondContact O-CG 3.4Å; T17-L21 PolarHBondContact O-N 3.24Å; L18-L21 PolarHBondContact O-N 3.17Å; Y19-L21 PolarHBondContact O-N 3.47Å; L21-N24 PolarHBondContact O-N 2.93Å; L21-N25 WeakPolarHBondContact O-CB 3.43Å; L21-N25 VanDerWaalsContact O-CG 3.31Å; L21-N25 PolarHBondContact O-N 3.28Å; L21-N25 PolarHBondContact O-ND2 2.9Å
22L97.6Very high96Very high36 Ų3673.8 Ų73.819%0.18840%0.395CS..Hα-helixtrans-64.2-42.5174.9-72.2171.2000111.7L18 Y19 K20 N24 N25 N26 N34 L37 V38L18-L22 HydrophobicContact CD1-CD1 4.19Å; L18-L22 HydrophobicContact CD1-CG 4.24Å; L18-L22 HydrophobicContact CG-CD1 4.1Å; L18-L22 WeakPolarHBondContact O-CG 3.39Å; L18-L22 PolarHBondContact O-N 2.96Å; Y19-L22 PolarHBondContact O-N 3.12Å; K20-L22 VanDerWaalsContact C-N 3.33Å; K20-L22 PolarHBondContact O-N 3.44Å; L22-N24 VanDerWaalsContact C-N 3.33Å; L22-N24 PolarHBondContact O-N 3.49Å; L22-N25 PolarHBondContact O-N 2.81Å; L22-N26 WeakPolarHBondContact O-CB 3.25Å; L22-N26 PolarHBondContact O-N 3.34Å; L22-N34 HydrophobicContact CB-CB 4.07Å; L22-N34 PolarHBondContact O-OD1 3.32Å; L22-L37 HydrophobicContact CD1-CB 4.02Å; L22-L37 HydrophobicContact CD2-CD1 4.37Å; L22-V38 HydrophobicContact CD1-CG2 3.61Å
23C96.9Very high96Very high15 Ų1573.6 Ų73.610%0.10139%0.391CS..Hα-helixtrans-59.1-42.9174.9-72.50000112.5Y19 K20 N26 E27Y19-C23 VanDerWaalsContact CE2-SG 3.52Å; Y19-C23 PolarHBondContact O-N 2.9Å; Y19-C23 PolarHBondContact O-SG 2.68Å; Y19-C23 VanDerWaalsContact O-SG 3.32Å; K20-C23 WeakPolarHBondContact O-CB 3.41Å; K20-C23 PolarHBondContact O-N 2.63Å; C23-N26 CarbonylContact O-C 3.54Å; C23-E27 WeakPolarHBondContact O-CA 3.34Å; C23-E27 WeakPolarHBondContact O-CG 3.46Å; C23-E27 PolarHBondContact O-N 3.46Å
24N95.9Very high95.9Very high104 Ų10470.1 Ų70.156%0.55637%0.37SS*.Hα-helixtrans-70.4-33.9178.7-66.22.7000112.6K20 L21 L22 E27K20-N24 VanDerWaalsContact O-CG 3.28Å; K20-N24 PolarHBondContact O-N 3.28Å; K20-N24 PolarHBondContact O-OD1 3.46Å; L21-N24 PolarHBondContact O-N 2.93Å; L22-N24 VanDerWaalsContact C-N 3.33Å; L22-N24 PolarHBondContact O-N 3.49Å; N24-E27 WeakPolarHBondContact O-CG 3.41Å
25N95.4Very high95.9Very high128 Ų12868.4 Ų68.468%0.68435%0.351SS*.Hα-helixtrans-83.7-25.7-179.8-70.2-25.9000113L21 L22L21-N25 WeakPolarHBondContact O-CB 3.43Å; L21-N25 VanDerWaalsContact O-CG 3.31Å; L21-N25 PolarHBondContact O-N 3.28Å; L21-N25 PolarHBondContact O-ND2 2.9Å; L22-N25 PolarHBondContact O-N 2.81Å
26N93.8Very high95.8Very high51 Ų5168.9 Ų68.927%0.27335%0.353SS..  trans-120.946.4-178.3-60-43.4000111.3L22 C23 S28 R29 N34L22-N26 WeakPolarHBondContact O-CB 3.25Å; L22-N26 PolarHBondContact O-N 3.34Å; C23-N26 CarbonylContact O-C 3.54Å; N26-S28 PolarHBondContact O-N 2.86Å; N26-R29 HydrophobicContact CB-CB 4.25Å; N26-R29 HydrophobicContact CB-CG 4.29Å; N26-R29 PolarHBondContact O-N 3.31Å; N26-N34 VanDerWaalsContact CB-OD1 3.31Å; N26-N34 WeakPolarHBondContact CB-OD1 3.3Å; N26-N34 PolarHBondContact ND2-OD1 3.48Å; N26-N34 VanDerWaalsContact ND2-OD1 3.14Å; N26-N34 PolarHBondContact O-ND2 2.95Å
27E88.4Confident95.8Very high154 Ų15468.3 Ų68.372%0.7235%0.351SS*.G310 helixtrans-54.2-32-177.6-68.5-179.617500112.3C23 N24 R29C23-E27 WeakPolarHBondContact O-CA 3.34Å; C23-E27 WeakPolarHBondContact O-CG 3.46Å; C23-E27 PolarHBondContact O-N 3.46Å; N24-E27 WeakPolarHBondContact O-CG 3.41Å; E27-R29 VanDerWaalsContact C-N 3.3Å; E27-R29 PolarHBondContact O-N 3.04Å
28S91.3Very high95.8Very high116 Ų11665.1 Ų65.181%0.81133%0.331SS*.G310 helixtrans-71.5-15.5179.361.60000115.3N26N26-S28 PolarHBondContact O-N 2.86Å
29R88.5Confident95.8Very high125 Ų12563.1 Ų63.147%0.47232%0.32SS..G310 helixtrans-98.1-8.5-172.4-66.5-69.7-175.3176.7-2.8114.4N26 E27 W33N26-R29 HydrophobicContact CB-CB 4.25Å; N26-R29 HydrophobicContact CB-CG 4.29Å; N26-R29 PolarHBondContact O-N 3.31Å; E27-R29 VanDerWaalsContact C-N 3.3Å; E27-R29 PolarHBondContact O-N 3.04Å; R29-W33 HydrophobicContact CB-CB 3.91Å; R29-W33 HydrophobicContact CB-CD2 3.96Å; R29-W33 HydrophobicContact CB-CG 3.55Å; R29-W33 HydrophobicContact CG-CD2 4.27Å; R29-W33 HydrophobicContact CG-CG 4.27Å; R29-W33 WeakPolarHBondContact O-CB 3.45Å
30G92.9Very high95.8Very high36 Ų3663.6 Ų63.637%0.37133%0.325SS..  trans79168.7178.900000114.7N34G30-N34 PolarHBondContact O-N 3.02Å; G30-N34 PolarHBondContact O-ND2 2.87Å
31F95.7Very high95.8Very high128 Ų12861.5 Ų61.556%0.56132%0.319SS*.Hα-helixtrans-67.6-44.6-172.4-66-57.6000113.9Y19 W33 N34 C35 F94Y19-F31 WeakPolarHBondContact OH-CB 3.48Å; Y19-F31 WeakPolarHBondContact OH-CD1 3.25Å; F31-W33 VanDerWaalsContact C-N 3.33Å; F31-W33 PolarHBondContact O-N 3.04Å; F31-N34 PolarHBondContact O-N 3.49Å; F31-C35 PolarHBondContact O-N 3.03Å; F31-F94 HydrophobicContact CB-CZ 4.4Å
32E96.6Very high95.8Very high59 Ų5957.1 Ų57.128%0.27630%0.296SS..Hα-helixtrans-62.8-41-179.6-173.8174.1173.800111.6N34 C35 R36 W90 W143E32-N34 VanDerWaalsContact C-N 3.29Å; E32-N34 PolarHBondContact O-N 3.32Å; E32-C35 PolarHBondContact O-N 3.45Å; E32-C35 VanDerWaalsContact O-N 3.13Å; E32-R36 HydrophobicContact CG-CG 4.04Å; E32-R36 WeakPolarHBondContact O-CG 3.3Å; E32-R36 PolarHBondContact O-N 3.3Å; E32-R36 IonicContact OE1-CZ 2.81Å; E32-R36 IonicContact OE1-NE 3.63Å; E32-R36 PolarHBondContact OE1-NE 2.61Å; E32-R36 IonicContact OE1-NH2 3.75Å; E32-R36 PolarHBondContact OE1-NH2 3.25Å; E32-W90 HydrophobicContact CB-CH2 3.64Å; E32-W90 HydrophobicContact CB-CZ2 4.1Å; E32-W90 HydrophobicContact CG-CH2 3.63Å; E32-W90 HydrophobicContact CG-CZ2 4.48Å; E32-W90 HydrophobicContact CG-CZ3 4.28Å; E32-W143 HydrophobicContact CB-CH2 4.37Å; E32-W143 HydrophobicContact CB-CZ2 4.05Å; E32-W143 HydrophobicContact CG-CH2 4.08Å; E32-W143 HydrophobicContact CG-CZ2 3.47Å; E32-W143 VanDerWaalsContact CG-CZ2 3.47Å; E32-W143 PolarHBondContact OE1-NE1 2.96Å
33W97.3Very high95.9Very high35 Ų3555.4 Ų55.413%0.13329%0.287CS..Hα-helixtrans-56-46.4177.4-176.6-74.9000111.9R29 F31 R36 L37 W143 F144 Q147 L148R29-W33 HydrophobicContact CB-CB 3.91Å; R29-W33 HydrophobicContact CB-CD2 3.96Å; R29-W33 HydrophobicContact CB-CG 3.55Å; R29-W33 HydrophobicContact CG-CD2 4.27Å; R29-W33 HydrophobicContact CG-CG 4.27Å; R29-W33 WeakPolarHBondContact O-CB 3.45Å; F31-W33 VanDerWaalsContact C-N 3.33Å; F31-W33 PolarHBondContact O-N 3.04Å; W33-R36 PolarHBondContact O-N 3.45Å; W33-L37 PolarHBondContact O-N 3.48Å; W33-W143 HydrophobicContact CB-CH2 4.04Å; W33-W143 HydrophobicContact CB-CZ3 4.25Å; W33-W143 HydrophobicContact CD2-CZ3 4.19Å; W33-W143 HydrophobicContact CE3-CH2 4.18Å; W33-W143 AromaticContact CE3-CZ3 3.77Å; W33-W143 HydrophobicContact CE3-CZ3 3.77Å; W33-W143 HydrophobicContact CG-CZ3 4.43Å; W33-W143 HydrophobicContact CZ3-CZ3 4.47Å; W33-F144 AromaticContact CD2-CD1 3.89Å; W33-F144 HydrophobicContact CD2-CD1 3.89Å; W33-F144 AromaticContact CD2-CE1 3.67Å; W33-F144 HydrophobicContact CD2-CE1 3.67Å; W33-F144 AromaticContact CE2-CD1 3.79Å; W33-F144 AromaticContact CE2-CE1 3.59Å; W33-F144 AromaticContact CE3-CD1 3.89Å; W33-F144 HydrophobicContact CE3-CD1 3.89Å; W33-F144 HydrophobicContact CE3-CE1 4.12Å; W33-F144 HydrophobicContact CG-CE1 4.01Å; W33-F144 AromaticContact CH2-CD1 3.69Å; W33-F144 HydrophobicContact CH2-CD1 3.69Å; W33-F144 HydrophobicContact CH2-CE1 4.35Å; W33-F144 AromaticContact CZ2-CD1 3.7Å; W33-F144 HydrophobicContact CZ2-CD1 3.7Å; W33-F144 AromaticContact CZ2-CE1 3.95Å; W33-F144 HydrophobicContact CZ2-CE1 3.95Å; W33-F144 AromaticContact CZ3-CD1 3.8Å; W33-F144 HydrophobicContact CZ3-CD1 3.8Å; W33-F144 HydrophobicContact CZ3-CE1 4.44Å; W33-F144 AromaticContact NE1-CE1 3.89Å; W33-Q147 HydrophobicContact CE3-CB 4.15Å; W33-Q147 HydrophobicContact CE3-CG 4.48Å; W33-Q147 HydrophobicContact CZ3-CB 3.73Å; W33-Q147 HydrophobicContact CZ3-CG 4.49Å; W33-L148 HydrophobicContact CH2-CD1 4.28Å; W33-L148 HydrophobicContact CH2-CD2 3.86Å; W33-L148 HydrophobicContact CH2-CG 3.97Å; W33-L148 HydrophobicContact CZ3-CD2 4.3Å; W33-L148 HydrophobicContact CZ3-CG 4.35Å
34N97.6Very high95.9Very high2 Ų258.6 Ų58.61%0.01130%0.303CS..Hα-helixtrans-68.6-35.3179.6-70.9-52.5000112Y19 L22 N26 G30 F31 E32 L37 V38Y19-N34 HydrophobicContact CD2-CB 4.38Å; Y19-N34 HydrophobicContact CE2-CB 4.16Å; L22-N34 HydrophobicContact CB-CB 4.07Å; L22-N34 PolarHBondContact O-OD1 3.32Å; N26-N34 VanDerWaalsContact CB-OD1 3.31Å; N26-N34 WeakPolarHBondContact CB-OD1 3.3Å; N26-N34 PolarHBondContact ND2-OD1 3.48Å; N26-N34 VanDerWaalsContact ND2-OD1 3.14Å; N26-N34 PolarHBondContact O-ND2 2.95Å; G30-N34 PolarHBondContact O-N 3.02Å; G30-N34 PolarHBondContact O-ND2 2.87Å; F31-N34 PolarHBondContact O-N 3.49Å; E32-N34 VanDerWaalsContact C-N 3.29Å; E32-N34 PolarHBondContact O-N 3.32Å; N34-L37 PolarHBondContact O-N 3.1Å; N34-V38 WeakPolarHBondContact O-CG2 3.31Å; N34-V38 PolarHBondContact O-N 3.19Å
35C97.7Very high96Very high3 Ų356.8 Ų56.82%0.0229%0.293CS..Hα-helixtrans-63.3-44.8171.6-167.80000111.7Y19 F31 E32 L37 V38 T39 W90Y19-C35 HydrophobicContact CD2-CB 4.36Å; Y19-C35 HydrophobicContact CE2-CB 3.97Å; F31-C35 PolarHBondContact O-N 3.03Å; E32-C35 PolarHBondContact O-N 3.45Å; E32-C35 VanDerWaalsContact O-N 3.13Å; C35-L37 PolarHBondContact O-N 3.11Å; C35-V38 WeakPolarHBondContact O-CA 3.45Å; C35-V38 WeakPolarHBondContact O-CB 3.32Å; C35-V38 PolarHBondContact O-N 3.16Å; C35-T39 PolarHBondContact O-N 2.9Å; C35-T39 PolarHBondContact O-OG1 3.3Å; C35-W90 HydrophobicContact CB-CD2 3.82Å; C35-W90 VanDerWaalsContact CB-CE2 3.47Å; C35-W90 HydrophobicContact CB-CE3 4.21Å; C35-W90 HydrophobicContact CB-CG 4.36Å; C35-W90 HydrophobicContact CB-CH2 4.17Å; C35-W90 HydrophobicContact CB-CZ2 3.71Å; C35-W90 HydrophobicContact CB-CZ3 4.34Å; C35-W90 VanDerWaalsContact SG-CG 3.55Å
36R97.8Very high96.2Very high30 Ų3050.9 Ų50.911%0.11326%0.262CS..Hα-helixtrans-62.2-31.4178-63.1-79.3-178.7-160.44.8112.3E32 W33 L40 E97 W143 F144E32-R36 HydrophobicContact CG-CG 4.04Å; E32-R36 WeakPolarHBondContact O-CG 3.3Å; E32-R36 PolarHBondContact O-N 3.3Å; E32-R36 IonicContact OE1-CZ 2.81Å; E32-R36 IonicContact OE1-NE 3.63Å; E32-R36 PolarHBondContact OE1-NE 2.61Å; E32-R36 IonicContact OE1-NH2 3.75Å; E32-R36 PolarHBondContact OE1-NH2 3.25Å; W33-R36 PolarHBondContact O-N 3.45Å; R36-L40 WeakPolarHBondContact O-CB 3.37Å; R36-L40 PolarHBondContact O-N 3.28Å; R36-E97 IonicContact CZ-OE1 2.61Å; R36-E97 IonicContact NH1-OE1 3.35Å; R36-E97 PolarHBondContact NH1-OE1 3.37Å; R36-E97 IonicContact NH2-OE1 2.72Å; R36-E97 PolarHBondContact NH2-OE1 2.91Å; R36-W143 HydrophobicContact CB-CE3 4.12Å; R36-W143 HydrophobicContact CB-CZ3 4.19Å; R36-W143 HydrophobicContact CG-CD2 3.89Å; R36-W143 HydrophobicContact CG-CE3 3.81Å; R36-W143 HydrophobicContact CG-CH2 4.16Å; R36-W143 HydrophobicContact CG-CZ2 4.23Å; R36-W143 HydrophobicContact CG-CZ3 3.95Å; R36-F144 HydrophobicContact CB-CE1 4.11Å; R36-F144 HydrophobicContact CB-CE2 4.26Å; R36-F144 HydrophobicContact CB-CZ 3.61Å
37L98Very high96.4Very high47 Ų4749.8 Ų49.825%0.24626%0.257CS..Hα-helixtrans-66.8-41.3170.8-73.5176.2000112L22 W33 N34 C35 L40 L41 F144L22-L37 HydrophobicContact CD1-CB 4.02Å; L22-L37 HydrophobicContact CD2-CD1 4.37Å; W33-L37 PolarHBondContact O-N 3.48Å; N34-L37 PolarHBondContact O-N 3.1Å; C35-L37 PolarHBondContact O-N 3.11Å; L37-L40 PolarHBondContact O-N 3.05Å; L37-L41 PolarHBondContact O-N 3.32Å; L37-F144 HydrophobicContact CD2-CE1 4.32Å; L37-F144 HydrophobicContact CD2-CE2 4.34Å; L37-F144 HydrophobicContact CD2-CZ 3.73Å; L37-F144 HydrophobicContact CG-CE1 4.38Å; L37-F144 HydrophobicContact CG-CZ 3.93Å
38V98.4Very high96.9Very high0 Ų046.1 Ų46.10%025%0.247CC..Hα-helixtrans-62.3-45.6173.6-179.90000110.5W15 L18 Y19 L22 N34 C35 L40 L41 H42 Y83 F86W15-V38 HydrophobicContact CE3-CG1 3.62Å; W15-V38 HydrophobicContact CZ3-CG1 4.09Å; L18-V38 HydrophobicContact CD2-CG1 4.39Å; L18-V38 HydrophobicContact CD2-CG2 4.29Å; L18-V38 HydrophobicContact CG-CG2 4.27Å; Y19-V38 HydrophobicContact CD2-CG2 4.39Å; L22-V38 HydrophobicContact CD1-CG2 3.61Å; N34-V38 WeakPolarHBondContact O-CG2 3.31Å; N34-V38 PolarHBondContact O-N 3.19Å; C35-V38 WeakPolarHBondContact O-CA 3.45Å; C35-V38 WeakPolarHBondContact O-CB 3.32Å; C35-V38 PolarHBondContact O-N 3.16Å; V38-L40 VanDerWaalsContact C-N 3.34Å; V38-L40 PolarHBondContact O-N 2.94Å; V38-L41 PolarHBondContact O-N 3.23Å; V38-H42 PolarHBondContact O-N 3.08Å; V38-Y83 HydrophobicContact CG1-CD2 4.29Å; V38-Y83 HydrophobicContact CG1-CE2 4.16Å; V38-F86 HydrophobicContact CB-CE1 4.24Å; V38-F86 HydrophobicContact CG1-CD1 4.3Å; V38-F86 HydrophobicContact CG1-CE1 3.79Å
39T98Very high97.2Very high5 Ų542.3 Ų42.33%0.03122%0.217CC..Hα-helixtrans-57.6-45.1175-55.10000112.2C35 H42 G43 Y83 N136 Q140C35-T39 PolarHBondContact O-N 2.9Å; C35-T39 PolarHBondContact O-OG1 3.3Å; T39-H42 PolarHBondContact O-N 3.4Å; T39-G43 PolarHBondContact O-N 3.12Å; T39-Y83 VanDerWaalsContact CA-OH 3.32Å; T39-Y83 WeakPolarHBondContact CA-OH 3.49Å; T39-Y83 WeakPolarHBondContact CB-OH 3.32Å; T39-Y83 WeakPolarHBondContact CG2-OH 3.43Å; T39-Y83 PolarHBondContact OG1-OH 3.24Å; T39-N136 VanDerWaalsContact CG2-ND2 3.33Å; T39-N136 WeakPolarHBondContact CG2-ND2 3.44Å; T39-Q140 VanDerWaalsContact CG2-CD 3.49Å; T39-Q140 HydrophobicContact CG2-CG 3.96Å
40L98.3Very high97.7Very high39 Ų3936.6 Ų36.620%0.20420%0.196CC..Hα-helixtrans-62.1-45.2177.2177.861.6000111.6R36 L37 V38 G43 I44 P137 Q140 F144R36-L40 WeakPolarHBondContact O-CB 3.37Å; R36-L40 PolarHBondContact O-N 3.28Å; L37-L40 PolarHBondContact O-N 3.05Å; V38-L40 VanDerWaalsContact C-N 3.34Å; V38-L40 PolarHBondContact O-N 2.94Å; L40-G43 PolarHBondContact O-N 3.24Å; L40-I44 HydrophobicContact CD1-CD1 4.05Å; L40-I44 HydrophobicContact CD1-CG1 4.41Å; L40-I44 HydrophobicContact CG-CD1 4.1Å; L40-I44 WeakPolarHBondContact O-CG1 3.49Å; L40-I44 PolarHBondContact O-N 3.15Å; L40-P137 HydrophobicContact CD1-CB 3.79Å; L40-P137 HydrophobicContact CD1-CG 4.33Å; L40-Q140 HydrophobicContact CB-CB 4.18Å; L40-Q140 HydrophobicContact CB-CG 4.14Å; L40-Q140 HydrophobicContact CD1-CB 4.21Å; L40-F144 HydrophobicContact CD2-CE2 4.29Å
41L98.4Very high97.9Very high86 Ų8636.1 Ų36.145%0.4519%0.189SC..Hα-helixtrans-63.3-44.8178.4-178.465.5000111.5W15 L18 L37 V38 I44 L45W15-L41 HydrophobicContact CZ3-CD2 4.34Å; L18-L41 HydrophobicContact CD2-CD2 3.47Å; L18-L41 VanDerWaalsContact CD2-CD2 3.47Å; L37-L41 PolarHBondContact O-N 3.32Å; V38-L41 PolarHBondContact O-N 3.23Å; L41-I44 PolarHBondContact O-N 2.83Å; L41-L45 WeakPolarHBondContact O-CB 3.11Å; L41-L45 PolarHBondContact O-N 2.87Å
42H98.5Very high98Very high0 Ų035.8 Ų35.80%019%0.185CC..Hα-helixtrans-58.6-49.5175.217466.6000111.4W15 V38 T39 I44 L45 A46 Y83W15-H42 HydrophobicContact CH2-CB 3.8Å; W15-H42 HydrophobicContact CZ2-CB 4.24Å; W15-H42 AromaticContact CZ2-ND1 3.67Å; W15-H42 HydrophobicContact CZ3-CB 4.18Å; V38-H42 PolarHBondContact O-N 3.08Å; T39-H42 PolarHBondContact O-N 3.4Å; H42-I44 VanDerWaalsContact C-N 3.32Å; H42-I44 PolarHBondContact O-N 3.36Å; H42-L45 PolarHBondContact O-N 3.43Å; H42-A46 VanDerWaalsContact O-CB 3.24Å; H42-A46 WeakPolarHBondContact O-CB 3.49Å; H42-A46 PolarHBondContact O-N 3.38Å; H42-Y83 HydrophobicContact CB-CD1 4.07Å; H42-Y83 HydrophobicContact CB-CD2 3.43Å; H42-Y83 VanDerWaalsContact CB-CD2 3.43Å; H42-Y83 HydrophobicContact CB-CE1 4.25Å; H42-Y83 HydrophobicContact CB-CE2 3.61Å; H42-Y83 HydrophobicContact CB-CG 3.69Å; H42-Y83 AromaticContact CD2-CD1 3.03Å; H42-Y83 WeakPolarHBondContact CD2-CD1 3.21Å; H42-Y83 AromaticContact CD2-CE1 3.32Å; H42-Y83 WeakPolarHBondContact CD2-CE1 3.41Å; H42-Y83 AromaticContact CD2-CG 3.49Å; H42-Y83 VanDerWaalsContact CD2-CG 3.49Å; H42-Y83 AromaticContact CD2-CZ 3.97Å; H42-Y83 AromaticContact CE1-CD1 3.85Å; H42-Y83 AromaticContact CE1-CG 3.93Å; H42-Y83 AromaticContact CG-CD1 3.32Å; H42-Y83 AromaticContact CG-CD2 3.54Å; H42-Y83 AromaticContact CG-CE1 3.81Å; H42-Y83 AromaticContact CG-CE2 3.98Å; H42-Y83 AromaticContact CG-CG 3.19Å; H42-Y83 WeakPolarHBondContact ND1-CB 3.34Å; H42-Y83 AromaticContact ND1-CD1 3.8Å; H42-Y83 AromaticContact ND1-CG 3.5Å; H42-Y83 AromaticContact NE2-CD1 3.4Å; H42-Y83 WeakPolarHBondContact NE2-CD1 3.46Å; H42-Y83 AromaticContact NE2-CG 3.93Å
43G97.9Very high98.1Very high0 Ų033 Ų330%017%0.171CC..Hα-helixtrans-57-45.1-18000000112.1T39 L40 V47T39-G43 PolarHBondContact O-N 3.12Å; L40-G43 PolarHBondContact O-N 3.24Å; G43-V47 WeakPolarHBondContact O-CB 3.15Å; G43-V47 WeakPolarHBondContact O-CG2 3.3Å; G43-V47 PolarHBondContact O-N 2.84Å
44I98.2Very high97.9Very high83 Ų8331.9 Ų31.943%0.42617%0.172SC..Hα-helixtrans-62-50.2175.9-66.6166.9000110.8L40 L41 H42 A46 V47 C48 P137L40-I44 HydrophobicContact CD1-CD1 4.05Å; L40-I44 HydrophobicContact CD1-CG1 4.41Å; L40-I44 HydrophobicContact CG-CD1 4.1Å; L40-I44 WeakPolarHBondContact O-CG1 3.49Å; L40-I44 PolarHBondContact O-N 3.15Å; L41-I44 PolarHBondContact O-N 2.83Å; H42-I44 VanDerWaalsContact C-N 3.32Å; H42-I44 PolarHBondContact O-N 3.36Å; I44-A46 PolarHBondContact O-N 3.33Å; I44-V47 PolarHBondContact O-N 3.36Å; I44-C48 WeakPolarHBondContact O-CB 3.49Å; I44-C48 PolarHBondContact O-N 3Å; I44-C48 PolarHBondContact O-SG 2.89Å; I44-P137 HydrophobicContact CG1-CG 4.31Å
45L98.1Very high97.8Very high66 Ų6639.2 Ų39.235%0.34620%0.2SC..Hα-helixtrans-60.2-47.6-179-178.666.3000111.7W15 L41 H42 C48 I49 I79W15-L45 HydrophobicContact CH2-CD2 4.14Å; W15-L45 HydrophobicContact CZ2-CD2 4.26Å; L41-L45 WeakPolarHBondContact O-CB 3.11Å; L41-L45 PolarHBondContact O-N 2.87Å; H42-L45 PolarHBondContact O-N 3.43Å; L45-C48 PolarHBondContact O-N 3.28Å; L45-I49 HydrophobicContact CD1-CD1 3.7Å; L45-I49 HydrophobicContact CD1-CG1 4.21Å; L45-I49 HydrophobicContact CD2-CD1 4.48Å; L45-I49 HydrophobicContact CG-CD1 3.76Å; L45-I49 VanDerWaalsContact O-CG1 3.31Å; L45-I49 WeakPolarHBondContact O-CG1 3.37Å; L45-I49 PolarHBondContact O-N 3.42Å; L45-I79 HydrophobicContact CD2-CG2 3.98Å
46A98.3Very high97.7Very high4 Ų443.7 Ų43.73%0.03323%0.227CC..Hα-helixtrans-60.7-47.918000000110.8H42 I44 C48 I49 T50 I129 E133H42-A46 VanDerWaalsContact O-CB 3.24Å; H42-A46 WeakPolarHBondContact O-CB 3.49Å; H42-A46 PolarHBondContact O-N 3.38Å; I44-A46 PolarHBondContact O-N 3.33Å; A46-C48 PolarHBondContact O-N 3.47Å; A46-I49 PolarHBondContact O-N 3.49Å; A46-T50 WeakPolarHBondContact O-CB 3.42Å; A46-T50 WeakPolarHBondContact O-CG2 3.36Å; A46-T50 PolarHBondContact O-N 3.48Å; A46-T50 PolarHBondContact O-OG1 2.95Å; A46-I129 HydrophobicContact CB-CG2 4.06Å; A46-E133 HydrophobicContact CB-CB 4.29Å; A46-E133 HydrophobicContact CB-CG 4.05Å
47V98.4Very high97.6Very high27 Ų2746.3 Ų46.316%0.16424%0.241CC..Hα-helixtrans-59.8-46.7177.3169.50000111.1G43 I44 T50 A51 F130 E133 I134G43-V47 WeakPolarHBondContact O-CB 3.15Å; G43-V47 WeakPolarHBondContact O-CG2 3.3Å; G43-V47 PolarHBondContact O-N 2.84Å; I44-V47 PolarHBondContact O-N 3.36Å; V47-T50 PolarHBondContact O-OG1 2.94Å; V47-A51 WeakPolarHBondContact O-CB 3.26Å; V47-A51 PolarHBondContact O-N 2.96Å; V47-F130 HydrophobicContact CG1-CD2 4.18Å; V47-F130 HydrophobicContact CG1-CE2 3.76Å; V47-E133 HydrophobicContact CG2-CB 3.85Å; V47-I134 HydrophobicContact CG1-CG1 4.32Å; V47-I134 HydrophobicContact CG2-CB 4.09Å
48C98.4Very high97.3Very high78 Ų7844.8 Ų44.853%0.52724%0.236SC..Hα-helixtrans-62.8-48.9179.7-70.70000112.4I44 L45 A46 Y52I44-C48 WeakPolarHBondContact O-CB 3.49Å; I44-C48 PolarHBondContact O-N 3Å; I44-C48 PolarHBondContact O-SG 2.89Å; L45-C48 PolarHBondContact O-N 3.28Å; A46-C48 PolarHBondContact O-N 3.47Å; C48-Y52 PolarHBondContact O-N 3.06Å; C48-Y52 VanDerWaalsContact O-N 3.07Å
49I98.3Very high97.1Very high36 Ų3646.4 Ų46.419%0.18525%0.247CC..Hα-helixtrans-65-46.9-178.8-65.1171000110.4L45 A46 Y52 I53 L72 A76 I79L45-I49 HydrophobicContact CD1-CD1 3.7Å; L45-I49 HydrophobicContact CD1-CG1 4.21Å; L45-I49 HydrophobicContact CD2-CD1 4.48Å; L45-I49 HydrophobicContact CG-CD1 3.76Å; L45-I49 VanDerWaalsContact O-CG1 3.31Å; L45-I49 WeakPolarHBondContact O-CG1 3.37Å; L45-I49 PolarHBondContact O-N 3.42Å; A46-I49 PolarHBondContact O-N 3.49Å; I49-Y52 WeakPolarHBondContact O-CB 3.34Å; I49-Y52 PolarHBondContact O-N 2.87Å; I49-I53 HydrophobicContact CG2-CD1 3.98Å; I49-I53 WeakPolarHBondContact O-CG1 3.48Å; I49-I53 PolarHBondContact O-N 2.89Å; I49-L72 HydrophobicContact CG2-CD1 4.4Å; I49-A76 HydrophobicContact CG2-CB 3.63Å; I49-I79 HydrophobicContact CD1-CD1 4.26Å
50T98.3Very high96.9Very high4 Ų450.6 Ų50.63%0.02526%0.262CS..Hα-helixtrans-73-29-177.356.30000112.9A46 V47 I53 G54 A76 C126 I129 F130A46-T50 WeakPolarHBondContact O-CB 3.42Å; A46-T50 WeakPolarHBondContact O-CG2 3.36Å; A46-T50 PolarHBondContact O-N 3.48Å; A46-T50 PolarHBondContact O-OG1 2.95Å; V47-T50 PolarHBondContact O-OG1 2.94Å; T50-I53 PolarHBondContact O-N 2.81Å; T50-G54 PolarHBondContact O-N 3.32Å; T50-A76 HydrophobicContact CG2-CB 4.44Å; T50-C126 WeakPolarHBondContact CB-O 3.5Å; T50-C126 HydrophobicContact CG2-CB 4.04Å; T50-C126 WeakPolarHBondContact CG2-O 3.45Å; T50-I129 HydrophobicContact CG2-CB 4.27Å; T50-I129 HydrophobicContact CG2-CG2 3.97Å; T50-F130 WeakPolarHBondContact OG1-CA 3.25Å; T50-F130 VanDerWaalsContact OG1-CB 3.29Å; T50-F130 WeakPolarHBondContact OG1-CB 3.49Å; T50-F130 WeakPolarHBondContact OG1-CD2 3.46Å
51A97.7Very high96.7Very high26 Ų2649.1 Ų49.122%0.21526%0.255CS..Hα-helixtrans-62.2-46.8167.500000111.2V47 I53 G54 Y55 F130V47-A51 WeakPolarHBondContact O-CB 3.26Å; V47-A51 PolarHBondContact O-N 2.96Å; A51-I53 VanDerWaalsContact C-N 3.33Å; A51-I53 PolarHBondContact O-N 3.33Å; A51-G54 PolarHBondContact O-N 3.25Å; A51-Y55 HydrophobicContact CB-CD2 4.28Å; A51-Y55 WeakPolarHBondContact O-CB 3.43Å; A51-Y55 VanDerWaalsContact O-CD2 3.28Å; A51-Y55 WeakPolarHBondContact O-CD2 3.41Å; A51-Y55 PolarHBondContact O-N 2.68Å; A51-F130 HydrophobicContact CB-CD2 4.16Å; A51-F130 HydrophobicContact CB-CE2 3.7Å
52Y98.2Very high96.5Very high121 Ų12146.2 Ų46.248%0.47524%0.239SC..Hα-helixtrans-60.4-44.7177.3179.7-88.6000111.4C48 I49 G54 V56 E57 L72C48-Y52 PolarHBondContact O-N 3.06Å; C48-Y52 VanDerWaalsContact O-N 3.07Å; I49-Y52 WeakPolarHBondContact O-CB 3.34Å; I49-Y52 PolarHBondContact O-N 2.87Å; Y52-G54 PolarHBondContact O-N 3.39Å; Y52-V56 HydrophobicContact CD2-CB 3.88Å; Y52-V56 HydrophobicContact CD2-CG1 4.21Å; Y52-V56 HydrophobicContact CD2-CG2 3.92Å; Y52-V56 HydrophobicContact CE2-CB 3.84Å; Y52-V56 HydrophobicContact CE2-CG1 3.65Å; Y52-V56 HydrophobicContact CE2-CG2 4.19Å; Y52-V56 HydrophobicContact CG-CB 4.33Å; Y52-V56 WeakPolarHBondContact O-CA 3.35Å; Y52-V56 VanDerWaalsContact O-CB 3.31Å; Y52-V56 WeakPolarHBondContact O-CB 3.37Å; Y52-V56 PolarHBondContact O-N 2.92Å; Y52-E57 HydrophobicContact CD1-CB 4.43Å; Y52-E57 HydrophobicContact CE1-CB 4.1Å; Y52-E57 PolarHBondContact O-N 3.43Å; Y52-L72 HydrophobicContact CD1-CD2 3.63Å; Y52-L72 HydrophobicContact CE1-CD2 3.76Å
53I97.8Very high96.3Very high0 Ų049.9 Ų49.90%026%0.261CS..Iπ-helixtrans-57.1-49.8174.3-68.6165.3000110.6I49 T50 A51 G58 L72 Q73 A76 I123 C126I49-I53 HydrophobicContact CG2-CD1 3.98Å; I49-I53 WeakPolarHBondContact O-CG1 3.48Å; I49-I53 PolarHBondContact O-N 2.89Å; T50-I53 PolarHBondContact O-N 2.81Å; A51-I53 VanDerWaalsContact C-N 3.33Å; A51-I53 PolarHBondContact O-N 3.33Å; I53-G58 WeakPolarHBondContact O-CA 3.43Å; I53-G58 PolarHBondContact O-N 3.34Å; I53-L72 HydrophobicContact CD1-CD2 4.46Å; I53-L72 HydrophobicContact CD1-CG 4Å; I53-L72 HydrophobicContact CG1-CB 4.47Å; I53-L72 HydrophobicContact CG1-CD2 3.68Å; I53-L72 HydrophobicContact CG1-CG 3.75Å; I53-Q73 HydrophobicContact CD1-CG 4.21Å; I53-Q73 HydrophobicContact CG2-CG 3.68Å; I53-A76 HydrophobicContact CD1-CB 3.71Å; I53-I123 HydrophobicContact CG2-CD1 3.77Å; I53-C126 HydrophobicContact CD1-CB 4.44Å; I53-C126 HydrophobicContact CG2-CB 4.38Å
54G94.5Very high96.2Very high13 Ų1353.7 Ų53.713%0.13428%0.279CS..Iπ-helixtrans-69.2-45.5-175.400000113.6T50 A51 Y52 W60T50-G54 PolarHBondContact O-N 3.32Å; A51-G54 PolarHBondContact O-N 3.25Å; Y52-G54 PolarHBondContact O-N 3.39Å; G54-W60 WeakPolarHBondContact O-CZ3 3.43Å
55Y94.4Very high96.1Very high155 Ų15550 Ų5061%0.60826%0.26SS*.Iπ-helixtrans-97.4-17.3-169.3-67.2-73.9000114.5A51 W60 F130A51-Y55 HydrophobicContact CB-CD2 4.28Å; A51-Y55 WeakPolarHBondContact O-CB 3.43Å; A51-Y55 VanDerWaalsContact O-CD2 3.28Å; A51-Y55 WeakPolarHBondContact O-CD2 3.41Å; A51-Y55 PolarHBondContact O-N 2.68Å; Y55-W60 HydrophobicContact CD1-CH2 4.09Å; Y55-W60 AromaticContact CD1-CZ3 3.81Å; Y55-W60 HydrophobicContact CD1-CZ3 3.81Å; Y55-W60 AromaticContact CE1-CH2 3.62Å; Y55-W60 HydrophobicContact CE1-CH2 3.62Å; Y55-W60 AromaticContact CE1-CZ3 3.8Å; Y55-W60 HydrophobicContact CE1-CZ3 3.8Å; Y55-W60 HydrophobicContact CG-CZ3 4.48Å; Y55-F130 HydrophobicContact CE2-CZ 4.35Å
56V96.3Very high95.9Very high98 Ų9847.4 Ų47.459%0.59425%0.249SC*.Iπ-helixtrans-122-56.8-174.2-171.90000112.1Y52Y52-V56 HydrophobicContact CD2-CB 3.88Å; Y52-V56 HydrophobicContact CD2-CG1 4.21Å; Y52-V56 HydrophobicContact CD2-CG2 3.92Å; Y52-V56 HydrophobicContact CE2-CB 3.84Å; Y52-V56 HydrophobicContact CE2-CG1 3.65Å; Y52-V56 HydrophobicContact CE2-CG2 4.19Å; Y52-V56 HydrophobicContact CG-CB 4.33Å; Y52-V56 WeakPolarHBondContact O-CA 3.35Å; Y52-V56 VanDerWaalsContact O-CB 3.31Å; Y52-V56 WeakPolarHBondContact O-CB 3.37Å; Y52-V56 PolarHBondContact O-N 2.92Å
57E95.2Very high95.9Very high85 Ų8548.8 Ų48.840%0.39726%0.257SS..Iπ-helixtrans-76.7-43.9-175.5-172.6-177.6-101.800112.3Y52 T70 L72Y52-E57 HydrophobicContact CD1-CB 4.43Å; Y52-E57 HydrophobicContact CE1-CB 4.1Å; Y52-E57 PolarHBondContact O-N 3.43Å; E57-T70 PolarHBondContact OE2-OG1 2.98Å; E57-L72 WeakPolarHBondContact OE1-CB 3.05Å; E57-L72 VanDerWaalsContact OE1-CD2 3.31Å; E57-L72 WeakPolarHBondContact OE1-CD2 3.47Å; E57-L72 WeakPolarHBondContact OE2-CB 3.1Å
58G91.4Very high95.8Very high14 Ų1456.1 Ų56.114%0.14429%0.287CS..  trans74.9-170.7-172.400000114.2I53 Q73I53-G58 WeakPolarHBondContact O-CA 3.43Å; I53-G58 PolarHBondContact O-N 3.34Å; G58-Q73 PolarHBondContact O-NE2 3.43Å
59P94.3Very high95.8Very high34 Ų3453.3 Ų53.322%0.22127%0.267CS..  cis-71.3168.8-1.933.2-36.7000112.3H64 T67 I123P59-H64 HydrophobicContact CB-CB 3.63Å; P59-H64 HydrophobicContact CG-CB 3.97Å; P59-T67 HydrophobicContact CG-CG2 4.44Å; P59-T67 WeakPolarHBondContact CG-OG1 3.34Å; P59-I123 HydrophobicContact CG-CB 4.43Å; P59-I123 HydrophobicContact CG-CG2 4.47Å; P59-I123 WeakPolarHBondContact O-CD1 3.26Å; P59-I123 WeakPolarHBondContact O-CG1 3.32Å
60W94.1Very high95.7Very high93 Ų9353.1 Ų53.135%0.35227%0.267SS..  trans-77.8123.2-176.3-177.2-121.4000111.9G54 Y55 F62 T63 H64G54-W60 WeakPolarHBondContact O-CZ3 3.43Å; Y55-W60 HydrophobicContact CD1-CH2 4.09Å; Y55-W60 AromaticContact CD1-CZ3 3.81Å; Y55-W60 HydrophobicContact CD1-CZ3 3.81Å; Y55-W60 AromaticContact CE1-CH2 3.62Å; Y55-W60 HydrophobicContact CE1-CH2 3.62Å; Y55-W60 AromaticContact CE1-CZ3 3.8Å; Y55-W60 HydrophobicContact CE1-CZ3 3.8Å; Y55-W60 HydrophobicContact CG-CZ3 4.48Å; W60-F62 VanDerWaalsContact C-N 3.25Å; W60-F62 HydrophobicContact CD2-CD2 4.27Å; W60-F62 AromaticContact CE2-CD2 3.41Å; W60-F62 VanDerWaalsContact CE2-CD2 3.41Å; W60-F62 HydrophobicContact CH2-CD2 4.37Å; W60-F62 HydrophobicContact CH2-CE2 4.23Å; W60-F62 AromaticContact CZ2-CD2 3.47Å; W60-F62 HydrophobicContact CZ2-CD2 3.47Å; W60-F62 VanDerWaalsContact CZ2-CD2 3.47Å; W60-F62 AromaticContact CZ2-CE2 3.62Å; W60-F62 HydrophobicContact CZ2-CE2 3.62Å; W60-F62 AromaticContact NE1-CD2 3.39Å; W60-F62 AromaticContact NE1-CG 3.92Å; W60-F62 PolarHBondContact O-N 2.91Å; W60-F62 VanDerWaalsContact O-N 3.09Å; W60-T63 WeakPolarHBondContact CB-OG1 3.41Å; W60-T63 PolarHBondContact O-N 3.11Å; W60-T63 PolarHBondContact O-OG1 2.9Å; W60-T63 VanDerWaalsContact O-OG1 3.06Å; W60-H64 PolarHBondContact O-N 3.07Å
61P93.3Very high95.6Very high8 Ų858 Ų585%0.05230%0.299CS..THydrogen-bonded Turntrans-56.9-31.9-170.714.1-28.3000114.8T63 I123 A127 M178P61-T63 VanDerWaalsContact C-N 3.27Å; P61-T63 PolarHBondContact O-N 3.3Å; P61-I123 HydrophobicContact CB-CG1 3.95Å; P61-I123 HydrophobicContact CG-CG1 4.42Å; P61-A127 HydrophobicContact CB-CB 3.92Å; P61-A127 HydrophobicContact CG-CB 4.06Å; P61-M178 HydrophobicContact CB-CE 3.53Å; P61-M178 HydrophobicContact CB-SD 4.29Å; P61-M178 HydrophobicContact CG-CE 4.38Å
62F95.3Very high95.6Very high26 Ų2659.1 Ų59.111%0.11430%0.301CS..THydrogen-bonded Turntrans-77.5-11.3-177.5-63.5-91.3000114.2W60 V174 R177 M178 C181W60-F62 VanDerWaalsContact C-N 3.25Å; W60-F62 HydrophobicContact CD2-CD2 4.27Å; W60-F62 AromaticContact CE2-CD2 3.41Å; W60-F62 VanDerWaalsContact CE2-CD2 3.41Å; W60-F62 HydrophobicContact CH2-CD2 4.37Å; W60-F62 HydrophobicContact CH2-CE2 4.23Å; W60-F62 AromaticContact CZ2-CD2 3.47Å; W60-F62 HydrophobicContact CZ2-CD2 3.47Å; W60-F62 VanDerWaalsContact CZ2-CD2 3.47Å; W60-F62 AromaticContact CZ2-CE2 3.62Å; W60-F62 HydrophobicContact CZ2-CE2 3.62Å; W60-F62 AromaticContact NE1-CD2 3.39Å; W60-F62 AromaticContact NE1-CG 3.92Å; W60-F62 PolarHBondContact O-N 2.91Å; W60-F62 VanDerWaalsContact O-N 3.09Å; F62-V174 HydrophobicContact CZ-CG1 3.95Å; F62-R177 HydrophobicContact CD1-CG 3.92Å; F62-R177 HydrophobicContact CE1-CB 3.97Å; F62-R177 HydrophobicContact CE1-CG 3.73Å; F62-M178 HydrophobicContact CD1-CG 3.89Å; F62-M178 HydrophobicContact CE1-CB 4.18Å; F62-M178 HydrophobicContact CE1-CG 3.24Å; F62-M178 HydrophobicContact CE2-CG 4Å; F62-M178 HydrophobicContact CE2-SD 4.39Å; F62-M178 HydrophobicContact CZ-CG 3.31Å; F62-M178 HydrophobicContact CZ-SD 4.13Å; F62-C181 PolarHBondContact O-SG 2.93Å; F62-C181 VanDerWaalsContact O-SG 3.36Å
63T94.2Very high95.6Very high77 Ų7753.4 Ų53.447%0.47228%0.279SS..THydrogen-bonded Turntrans-124.2-24.2-172.949.20000112.6W60 P61 R187W60-T63 WeakPolarHBondContact CB-OG1 3.41Å; W60-T63 PolarHBondContact O-N 3.11Å; W60-T63 PolarHBondContact O-OG1 2.9Å; W60-T63 VanDerWaalsContact O-OG1 3.06Å; P61-T63 VanDerWaalsContact C-N 3.27Å; P61-T63 PolarHBondContact O-N 3.3Å; T63-R187 PolarHBondContact O-NH1 2.94Å
64H94.9Very high95.6Very high80 Ų8055.9 Ų55.937%0.3729%0.291SS..  trans-123.141.7-176.5-60.784.5000113.8P59 W60 T67P59-H64 HydrophobicContact CB-CB 3.63Å; P59-H64 HydrophobicContact CG-CB 3.97Å; W60-H64 PolarHBondContact O-N 3.07Å; H64-T67 HydrophobicContact CB-CG2 3.89Å; H64-T67 WeakPolarHBondContact O-CG2 3.35Å; H64-T67 PolarHBondContact O-OG1 3.45Å
65P95.9Very high95.8Very high4 Ų458.1 Ų58.13%0.02631%0.305CS..THydrogen-bonded Turntrans-63.5145.8173.130.3-35.6000110.4E124 S185 R187 P188P65-E124 VanDerWaalsContact CA-CD 3.46Å; P65-E124 WeakPolarHBondContact CA-OE1 3.41Å; P65-E124 WeakPolarHBondContact CA-OE2 3.37Å; P65-E124 VanDerWaalsContact CB-CD 3.49Å; P65-E124 HydrophobicContact CB-CG 3.96Å; P65-E124 WeakPolarHBondContact CB-OE1 3.28Å; P65-S185 VanDerWaalsContact CG-CB 3.49Å; P65-R187 WeakPolarHBondContact O-CB 3.49Å; P65-P188 HydrophobicContact CB-CG 3.9Å
66G95.6Very high96Very high12 Ų1250.9 Ų50.912%0.12428%0.278CS..THydrogen-bonded Turntrans79.311.5178.800000115.1E124G66-E124 VanDerWaalsContact N-CD 3.27Å; G66-E124 PolarHBondContact N-OE1 2.92Å; G66-E124 PolarHBondContact N-OE2 3.42Å
67T96.6Very high96.1Very high34 Ų3446.2 Ų46.221%0.20925%0.249CC..PPolyproline II helixtrans-72.3160174520000112.2P59 H64 E120 S121P59-T67 HydrophobicContact CG-CG2 4.44Å; P59-T67 WeakPolarHBondContact CG-OG1 3.34Å; H64-T67 HydrophobicContact CB-CG2 3.89Å; H64-T67 WeakPolarHBondContact O-CG2 3.35Å; H64-T67 PolarHBondContact O-OG1 3.45Å; T67-E120 CarbonylContact O-C 3.54Å; T67-E120 WeakPolarHBondContact O-CA 3.22Å; T67-S121 PolarHBondContact O-N 3.09Å
68K97.5Very high96.3Very high180 Ų18042.8 Ų42.878%0.78323%0.234SC*.BIsolated β-bridgetrans-58.2145.3173.4-67.1-171.8179-178.70111.3T70 G119K68-T70 PolarHBondContact O-N 3.46Å; K68-G119 WeakPolarHBondContact CA-O 3.35Å
69N97.4Very high96.6Very high20 Ų2044.3 Ų44.311%0.10724%0.238CC..PPolyproline II helixtrans-68.6129.7179.7-58.4-11000110.3I74 T115 G119 E120 S121 G122N69-I74 HydrophobicContact CB-CD1 4.03Å; N69-I74 HydrophobicContact CB-CG1 3.72Å; N69-T115 PolarHBondContact ND2-O 3.35Å; N69-G119 VanDerWaalsContact CG-C 3.41Å; N69-G119 PolarHBondContact N-O 3.18Å; N69-G119 WeakPolarHBondContact ND2-CA 3.4Å; N69-E120 WeakPolarHBondContact OD1-CA 3.47Å; N69-E120 PolarHBondContact OD1-N 3.32Å; N69-E120 PolarHBondContact OD1-O 3.28Å; N69-S121 PolarHBondContact OD1-N 3.01Å; N69-G122 WeakPolarHBondContact OD1-CA 3.26Å; N69-G122 PolarHBondContact OD1-N 2.88Å
70T97.2Very high96.8Very high31 Ų3142.8 Ų42.819%0.1923%0.228CC..PPolyproline II helixtrans-76.3157.6170.473.40000110.4E57 K68 L72 Q73 I74E57-T70 PolarHBondContact OE2-OG1 2.98Å; K68-T70 PolarHBondContact O-N 3.46Å; T70-L72 PolarHBondContact O-N 3.14Å; T70-Q73 VanDerWaalsContact N-OE1 3.09Å; T70-Q73 PolarHBondContact O-N 2.85Å; T70-Q73 WeakPolarHBondContact OG1-CB 3.24Å; T70-Q73 VanDerWaalsContact OG1-CD 3.31Å; T70-Q73 WeakPolarHBondContact OG1-CG 3.28Å; T70-Q73 PolarHBondContact OG1-N 3.3Å; T70-I74 WeakPolarHBondContact O-CG1 3.4Å; T70-I74 PolarHBondContact O-N 2.98Å
71P96.7Very high97Very high106 Ų10638.4 Ų38.469%0.68821%0.212SC*.Hα-helixtrans-54.2-40.6174.7-27.936.4000113.1I74 S75P71-I74 WeakPolarHBondContact O-CB 3.43Å; P71-I74 PolarHBondContact O-N 3.06Å; P71-S75 PolarHBondContact O-N 2.93Å; P71-S75 PolarHBondContact O-OG 3.47Å
72L97.3Very high97.3Very high51 Ų5138 Ų3827%0.26721%0.209SC..Hα-helixtrans-70.1-38.9179.4-17459.6000112.4I49 Y52 I53 E57 T70 I74 S75 A76I49-L72 HydrophobicContact CG2-CD1 4.4Å; Y52-L72 HydrophobicContact CD1-CD2 3.63Å; Y52-L72 HydrophobicContact CE1-CD2 3.76Å; I53-L72 HydrophobicContact CD1-CD2 4.46Å; I53-L72 HydrophobicContact CD1-CG 4Å; I53-L72 HydrophobicContact CG1-CB 4.47Å; I53-L72 HydrophobicContact CG1-CD2 3.68Å; I53-L72 HydrophobicContact CG1-CG 3.75Å; E57-L72 WeakPolarHBondContact OE1-CB 3.05Å; E57-L72 VanDerWaalsContact OE1-CD2 3.31Å; E57-L72 WeakPolarHBondContact OE1-CD2 3.47Å; E57-L72 WeakPolarHBondContact OE2-CB 3.1Å; T70-L72 PolarHBondContact O-N 3.14Å; L72-I74 VanDerWaalsContact C-N 3.32Å; L72-I74 PolarHBondContact O-N 3.35Å; L72-S75 PolarHBondContact O-N 2.96Å; L72-A76 WeakPolarHBondContact O-CB 3.3Å; L72-A76 PolarHBondContact O-N 3.28Å
73Q98.4Very high97.4Very high0 Ų036.8 Ų36.80%020%0.204CC..Hα-helixtrans-59.8-43.2171.6-71.816513.300111.6I53 G58 T70 A76 M77I53-Q73 HydrophobicContact CD1-CG 4.21Å; I53-Q73 HydrophobicContact CG2-CG 3.68Å; G58-Q73 PolarHBondContact O-NE2 3.43Å; T70-Q73 VanDerWaalsContact N-OE1 3.09Å; T70-Q73 PolarHBondContact O-N 2.85Å; T70-Q73 WeakPolarHBondContact OG1-CB 3.24Å; T70-Q73 VanDerWaalsContact OG1-CD 3.31Å; T70-Q73 WeakPolarHBondContact OG1-CG 3.28Å; T70-Q73 PolarHBondContact OG1-N 3.3Å; Q73-A76 PolarHBondContact O-N 3.48Å; Q73-M77 HydrophobicContact CB-CE 4.39Å; Q73-M77 WeakPolarHBondContact O-CB 3.39Å; Q73-M77 WeakPolarHBondContact O-CE 3.44Å; Q73-M77 WeakPolarHBondContact O-CG 3.49Å; Q73-M77 PolarHBondContact O-N 3.1Å
74I98.1Very high97.6Very high52 Ų5233.3 Ų33.327%0.26718%0.182SC..Hα-helixtrans-60.2-48.7175-67.2168.3000110.2L4 N69 T70 P71 L72 A76 M77 V78 L116L4-I74 HydrophobicContact CD2-CG2 3.58Å; N69-I74 HydrophobicContact CB-CD1 4.03Å; N69-I74 HydrophobicContact CB-CG1 3.72Å; T70-I74 WeakPolarHBondContact O-CG1 3.4Å; T70-I74 PolarHBondContact O-N 2.98Å; P71-I74 WeakPolarHBondContact O-CB 3.43Å; P71-I74 PolarHBondContact O-N 3.06Å; L72-I74 VanDerWaalsContact C-N 3.32Å; L72-I74 PolarHBondContact O-N 3.35Å; I74-A76 PolarHBondContact O-N 2.97Å; I74-M77 PolarHBondContact O-N 2.82Å; I74-V78 HydrophobicContact CG2-CG2 4.2Å; I74-V78 WeakPolarHBondContact O-CB 3.31Å; I74-V78 VanDerWaalsContact O-CG2 3.27Å; I74-V78 WeakPolarHBondContact O-CG2 3.31Å; I74-V78 PolarHBondContact O-N 3.21Å; I74-L116 HydrophobicContact CB-CD2 4.44Å; I74-L116 HydrophobicContact CG1-CD2 4.37Å; I74-L116 HydrophobicContact CG2-CD2 4.05Å
75S97.8Very high97.8Very high61 Ų6132.4 Ų32.443%0.42718%0.18SC..Hα-helixtrans-59.1-46.2177.7-66.80000112.3P71 L72 M77 V78 I79P71-S75 PolarHBondContact O-N 2.93Å; P71-S75 PolarHBondContact O-OG 3.47Å; L72-S75 PolarHBondContact O-N 2.96Å; S75-M77 VanDerWaalsContact C-N 3.35Å; S75-M77 PolarHBondContact O-N 3.34Å; S75-V78 PolarHBondContact O-N 2.89Å; S75-I79 WeakPolarHBondContact O-CB 3.44Å; S75-I79 VanDerWaalsContact O-CG1 3.27Å; S75-I79 WeakPolarHBondContact O-CG1 3.1Å; S75-I79 PolarHBondContact O-N 3.37Å
76A98.4Very high98Very high3 Ų333.1 Ų33.13%0.02518%0.182CC..Hα-helixtrans-59.7-44.5177.800000112I49 T50 I53 L72 Q73 I74 S80I49-A76 HydrophobicContact CG2-CB 3.63Å; T50-A76 HydrophobicContact CG2-CB 4.44Å; I53-A76 HydrophobicContact CD1-CB 3.71Å; L72-A76 WeakPolarHBondContact O-CB 3.3Å; L72-A76 PolarHBondContact O-N 3.28Å; Q73-A76 PolarHBondContact O-N 3.48Å; I74-A76 PolarHBondContact O-N 2.97Å; A76-S80 WeakPolarHBondContact O-CB 3.1Å; A76-S80 PolarHBondContact O-N 3.13Å; A76-S80 PolarHBondContact O-OG 2.92Å
77M98.6Very high98.1Very high0 Ų033 Ų330%018%0.179CC..Hα-helixtrans-65.9-41.6176.3-78.3-170.5-71.900112.5Q73 I74 S75 S80 L81 I112 T115 L116 S125 I129Q73-M77 HydrophobicContact CB-CE 4.39Å; Q73-M77 WeakPolarHBondContact O-CB 3.39Å; Q73-M77 WeakPolarHBondContact O-CE 3.44Å; Q73-M77 WeakPolarHBondContact O-CG 3.49Å; Q73-M77 PolarHBondContact O-N 3.1Å; I74-M77 PolarHBondContact O-N 2.82Å; S75-M77 VanDerWaalsContact C-N 3.35Å; S75-M77 PolarHBondContact O-N 3.34Å; M77-S80 PolarHBondContact O-N 2.92Å; M77-L81 WeakPolarHBondContact O-CB 3.33Å; M77-L81 PolarHBondContact O-N 2.84Å; M77-I112 HydrophobicContact CB-CG2 3.82Å; M77-I112 HydrophobicContact CG-CG2 4.26Å; M77-I112 HydrophobicContact SD-CG2 4.46Å; M77-T115 HydrophobicContact CE-CG2 3.93Å; M77-T115 HydrophobicContact SD-CG2 3.57Å; M77-T115 VanDerWaalsContact SD-CG2 3.57Å; M77-L116 HydrophobicContact CB-CD1 4.43Å; M77-L116 HydrophobicContact CB-CD2 4.09Å; M77-L116 HydrophobicContact CB-CG 4.34Å; M77-L116 HydrophobicContact CE-CD2 3.82Å; M77-L116 HydrophobicContact CE-CG 4.45Å; M77-L116 HydrophobicContact SD-CD2 4.38Å; M77-L116 HydrophobicContact SD-CG 4.44Å; M77-S125 VanDerWaalsContact SD-CB 3.57Å; M77-I129 HydrophobicContact CG-CD1 4.21Å
78V98.5Very high98.1Very high13 Ų1332.9 Ų32.98%0.07918%0.176CC..Hα-helixtrans-66.1-42.9178.9166.90000111.5L4 G7 V8 I74 S75 S80 L81 G82 L116L4-V78 HydrophobicContact CD2-CG2 4.03Å; G7-V78 VanDerWaalsContact C-CG1 3.48Å; V8-V78 HydrophobicContact CG2-CG1 4.01Å; V8-V78 HydrophobicContact CG2-CG2 4.28Å; I74-V78 HydrophobicContact CG2-CG2 4.2Å; I74-V78 WeakPolarHBondContact O-CB 3.31Å; I74-V78 VanDerWaalsContact O-CG2 3.27Å; I74-V78 WeakPolarHBondContact O-CG2 3.31Å; I74-V78 PolarHBondContact O-N 3.21Å; S75-V78 PolarHBondContact O-N 2.89Å; V78-S80 VanDerWaalsContact C-N 3.34Å; V78-S80 PolarHBondContact O-N 2.85Å; V78-L81 PolarHBondContact O-N 3Å; V78-G82 PolarHBondContact O-N 3.45Å; V78-L116 HydrophobicContact CG2-CD1 4.12Å; V78-L116 HydrophobicContact CG2-CD2 4.37Å
79I98.5Very high98.2Very high45 Ų4526.3 Ų26.323%0.23116%0.16CC..Hα-helixtrans-60.4-45.9175.1-69.1166000110.3W15 L45 I49 S75 Y83W15-I79 HydrophobicContact CZ2-CG2 3.86Å; W15-I79 PolarHBondContact NE1-O 3.49Å; W15-I79 VanDerWaalsContact NE1-O 3.09Å; L45-I79 HydrophobicContact CD2-CG2 3.98Å; I49-I79 HydrophobicContact CD1-CD1 4.26Å; S75-I79 WeakPolarHBondContact O-CB 3.44Å; S75-I79 VanDerWaalsContact O-CG1 3.27Å; S75-I79 WeakPolarHBondContact O-CG1 3.1Å; S75-I79 PolarHBondContact O-N 3.37Å; I79-Y83 PolarHBondContact O-N 3.44Å; I79-Y83 VanDerWaalsContact O-N 3.16Å
80S98.7Very high98.2Very high2 Ų226.1 Ų26.11%0.01416%0.158CC..Hα-helixtrans-70.6-37.4-179-51.50000112.9A76 M77 V78 Y83 F84A76-S80 WeakPolarHBondContact O-CB 3.1Å; A76-S80 PolarHBondContact O-N 3.13Å; A76-S80 PolarHBondContact O-OG 2.92Å; M77-S80 PolarHBondContact O-N 2.92Å; V78-S80 VanDerWaalsContact C-N 3.34Å; V78-S80 PolarHBondContact O-N 2.85Å; S80-Y83 PolarHBondContact O-N 2.9Å; S80-F84 WeakPolarHBondContact O-CD2 3.31Å; S80-F84 WeakPolarHBondContact O-CG 3.49Å; S80-F84 PolarHBondContact O-N 3.17Å
81L98.8Very high98.2Very high1 Ų124.9 Ų24.91%0.00515%0.15CC..Hα-helixtrans-63-45.1174.9179.159.4000111.5V8 M77 V78 Y83 F84 I85 I109 I112 L113 L116V8-L81 HydrophobicContact CG1-CD2 4.1Å; V8-L81 HydrophobicContact CG1-CG 4.15Å; V8-L81 HydrophobicContact CG2-CD2 3.72Å; V8-L81 HydrophobicContact CG2-CG 4.44Å; M77-L81 WeakPolarHBondContact O-CB 3.33Å; M77-L81 PolarHBondContact O-N 2.84Å; V78-L81 PolarHBondContact O-N 3Å; L81-Y83 VanDerWaalsContact C-N 3.28Å; L81-Y83 PolarHBondContact O-N 3.45Å; L81-F84 PolarHBondContact O-N 3.07Å; L81-I85 HydrophobicContact CD1-CD1 3.95Å; L81-I85 HydrophobicContact CD1-CG1 4.23Å; L81-I85 HydrophobicContact CG-CD1 3.99Å; L81-I85 VanDerWaalsContact O-CG1 3.29Å; L81-I85 WeakPolarHBondContact O-CG1 3.24Å; L81-I85 PolarHBondContact O-N 3.06Å; L81-I109 HydrophobicContact CD1-CB 4.35Å; L81-I109 HydrophobicContact CD1-CG1 4.4Å; L81-I109 HydrophobicContact CD1-CG2 3.91Å; L81-I112 HydrophobicContact CB-CG2 3.91Å; L81-I112 HydrophobicContact CD1-CG2 4.46Å; L81-I112 HydrophobicContact CD2-CG2 4.21Å; L81-I112 HydrophobicContact CG-CG2 4.43Å; L81-L113 HydrophobicContact CD1-CD2 4.4Å; L81-L113 HydrophobicContact CD1-CG 4.14Å; L81-L113 HydrophobicContact CD2-CD2 3.59Å; L81-L113 HydrophobicContact CD2-CG 4.12Å; L81-L116 HydrophobicContact CD2-CD1 4.02Å
82G98.6Very high98.2Very high0 Ų024 Ų240%014%0.142CC..Hα-helixtrans-58.4-41.6174.700000112.1L12 V78 F86L12-G82 WeakPolarHBondContact CD1-O 3.13Å; V78-G82 PolarHBondContact O-N 3.45Å; G82-F86 PolarHBondContact O-N 2.92Å
83Y98.8Very high98.2Very high1 Ų130.2 Ų30.20%0.00416%0.163CC..Hα-helixtrans-65-50.6175168.6-96.5000111.9W15 V38 T39 H42 I79 S80 L81 I85 F86 D87W15-Y83 VanDerWaalsContact CD1-CA 3.5Å; W15-Y83 VanDerWaalsContact CD1-N 3.27Å; W15-Y83 HydrophobicContact CD2-CD2 4.28Å; W15-Y83 HydrophobicContact CE3-CD2 4.41Å; V38-Y83 HydrophobicContact CG1-CD2 4.29Å; V38-Y83 HydrophobicContact CG1-CE2 4.16Å; T39-Y83 VanDerWaalsContact CA-OH 3.32Å; T39-Y83 WeakPolarHBondContact CA-OH 3.49Å; T39-Y83 WeakPolarHBondContact CB-OH 3.32Å; T39-Y83 WeakPolarHBondContact CG2-OH 3.43Å; T39-Y83 PolarHBondContact OG1-OH 3.24Å; H42-Y83 HydrophobicContact CB-CD1 4.07Å; H42-Y83 HydrophobicContact CB-CD2 3.43Å; H42-Y83 VanDerWaalsContact CB-CD2 3.43Å; H42-Y83 HydrophobicContact CB-CE1 4.25Å; H42-Y83 HydrophobicContact CB-CE2 3.61Å; H42-Y83 HydrophobicContact CB-CG 3.69Å; H42-Y83 AromaticContact CD2-CD1 3.03Å; H42-Y83 WeakPolarHBondContact CD2-CD1 3.21Å; H42-Y83 AromaticContact CD2-CE1 3.32Å; H42-Y83 WeakPolarHBondContact CD2-CE1 3.41Å; H42-Y83 AromaticContact CD2-CG 3.49Å; H42-Y83 VanDerWaalsContact CD2-CG 3.49Å; H42-Y83 AromaticContact CD2-CZ 3.97Å; H42-Y83 AromaticContact CE1-CD1 3.85Å; H42-Y83 AromaticContact CE1-CG 3.93Å; H42-Y83 AromaticContact CG-CD1 3.32Å; H42-Y83 AromaticContact CG-CD2 3.54Å; H42-Y83 AromaticContact CG-CE1 3.81Å; H42-Y83 AromaticContact CG-CE2 3.98Å; H42-Y83 AromaticContact CG-CG 3.19Å; H42-Y83 WeakPolarHBondContact ND1-CB 3.34Å; H42-Y83 AromaticContact ND1-CD1 3.8Å; H42-Y83 AromaticContact ND1-CG 3.5Å; H42-Y83 AromaticContact NE2-CD1 3.4Å; H42-Y83 WeakPolarHBondContact NE2-CD1 3.46Å; H42-Y83 AromaticContact NE2-CG 3.93Å; I79-Y83 PolarHBondContact O-N 3.44Å; I79-Y83 VanDerWaalsContact O-N 3.16Å; S80-Y83 PolarHBondContact O-N 2.9Å; L81-Y83 VanDerWaalsContact C-N 3.28Å; L81-Y83 PolarHBondContact O-N 3.45Å; Y83-I85 VanDerWaalsContact C-N 3.26Å; Y83-I85 PolarHBondContact O-N 3.03Å; Y83-F86 HydrophobicContact CD2-CD1 4.38Å; Y83-F86 HydrophobicContact CE2-CD1 4.44Å; Y83-F86 WeakPolarHBondContact O-CA 3.33Å; Y83-F86 WeakPolarHBondContact O-CB 3.2Å; Y83-F86 PolarHBondContact O-N 3.46Å; Y83-D87 HydrophobicContact CE1-CB 3.95Å; Y83-D87 HydrophobicContact CE2-CB 4.19Å; Y83-D87 WeakPolarHBondContact O-CB 3.44Å; Y83-D87 PolarHBondContact O-N 2.86Å; Y83-D87 PolarHBondContact OH-OD1 2.86Å; Y83-D87 PolarHBondContact OH-OD2 3.46Å
84F98.6Very high98Very high3 Ų334.1 Ų34.11%0.01318%0.181CC..Hα-helixtrans-63.5-32.4-176.8-70.8-38.2000112.6S80 L81 M88 H105 I109 I112S80-F84 WeakPolarHBondContact O-CD2 3.31Å; S80-F84 WeakPolarHBondContact O-CG 3.49Å; S80-F84 PolarHBondContact O-N 3.17Å; L81-F84 PolarHBondContact O-N 3.07Å; F84-M88 WeakPolarHBondContact O-CB 3.49Å; F84-M88 PolarHBondContact O-N 3.48Å; F84-H105 AromaticContact CD1-ND1 3.83Å; F84-I109 HydrophobicContact CB-CD1 4.2Å; F84-I109 HydrophobicContact CB-CG1 3.69Å; F84-I112 HydrophobicContact CD2-CD1 3.77Å; F84-I112 HydrophobicContact CE2-CD1 3.81Å
85I98.6Very high97.9Very high62 Ų6242.1 Ų42.132%0.31821%0.208SC..Hα-helixtrans-65.8-45.8172.2-68.2166.7000110.7V8 L12 L81 Y83 G89 I109V8-I85 HydrophobicContact CG1-CD1 4.08Å; L12-I85 HydrophobicContact CD1-CB 4.29Å; L12-I85 HydrophobicContact CD1-CG2 3.98Å; L12-I85 HydrophobicContact CD2-CG2 4Å; L81-I85 HydrophobicContact CD1-CD1 3.95Å; L81-I85 HydrophobicContact CD1-CG1 4.23Å; L81-I85 HydrophobicContact CG-CD1 3.99Å; L81-I85 VanDerWaalsContact O-CG1 3.29Å; L81-I85 WeakPolarHBondContact O-CG1 3.24Å; L81-I85 PolarHBondContact O-N 3.06Å; Y83-I85 VanDerWaalsContact C-N 3.26Å; Y83-I85 PolarHBondContact O-N 3.03Å; I85-G89 PolarHBondContact O-N 3.23Å; I85-I109 HydrophobicContact CG1-CD1 4.39Å
86F98.6Very high97.4Very high18 Ų1841.2 Ų41.28%0.07920%0.2CC..Hα-helixtrans-57.1-52.3174.6161.4-99000111.4L12 W15 I16 Y19 V38 G82 Y83 G89 W90L12-F86 HydrophobicContact CD1-CB 3.76Å; W15-F86 HydrophobicContact CB-CB 4.26Å; W15-F86 HydrophobicContact CB-CD1 4.43Å; W15-F86 HydrophobicContact CB-CG 4.22Å; I16-F86 HydrophobicContact CG1-CD2 3.78Å; I16-F86 HydrophobicContact CG1-CE2 4.41Å; Y19-F86 HydrophobicContact CD1-CE2 4.16Å; Y19-F86 HydrophobicContact CD1-CZ 4.31Å; Y19-F86 HydrophobicContact CD2-CZ 4.01Å; Y19-F86 AromaticContact CG-CE2 3.97Å; Y19-F86 HydrophobicContact CG-CE2 3.97Å; Y19-F86 AromaticContact CG-CZ 3.73Å; Y19-F86 HydrophobicContact CG-CZ 3.73Å; V38-F86 HydrophobicContact CB-CE1 4.24Å; V38-F86 HydrophobicContact CG1-CD1 4.3Å; V38-F86 HydrophobicContact CG1-CE1 3.79Å; G82-F86 PolarHBondContact O-N 2.92Å; Y83-F86 HydrophobicContact CD2-CD1 4.38Å; Y83-F86 HydrophobicContact CE2-CD1 4.44Å; Y83-F86 WeakPolarHBondContact O-CA 3.33Å; Y83-F86 WeakPolarHBondContact O-CB 3.2Å; Y83-F86 PolarHBondContact O-N 3.46Å; F86-G89 PolarHBondContact O-N 2.87Å; F86-W90 WeakPolarHBondContact O-CB 3.34Å; F86-W90 PolarHBondContact O-N 3.46Å
87D98.2Very high97.2Very high11 Ų1143.3 Ų43.36%0.05921%0.209CC..Hα-helixtrans-66.7-40.3-174.9-163.132.3000111.7Y83 W90 C91 H105Y83-D87 HydrophobicContact CE1-CB 3.95Å; Y83-D87 HydrophobicContact CE2-CB 4.19Å; Y83-D87 WeakPolarHBondContact O-CB 3.44Å; Y83-D87 PolarHBondContact O-N 2.86Å; Y83-D87 PolarHBondContact OH-OD1 2.86Å; Y83-D87 PolarHBondContact OH-OD2 3.46Å; D87-W90 PolarHBondContact O-N 2.97Å; D87-C91 WeakPolarHBondContact O-CB 3.16Å; D87-C91 PolarHBondContact O-N 2.78Å; D87-C91 PolarHBondContact O-SG 3.35Å; D87-H105 IonicContact OD2-CE1 3.55Å; D87-H105 PolarHBondContact OD2-CE1 2.97Å; D87-H105 IonicContact OD2-ND1 3.64Å; D87-H105 IonicContact OD2-NE2 3.2Å
88M97.9Very high96.9Very high30 Ų3045.1 Ų45.115%0.14823%0.227CC..Hα-helixtrans-58.2-50.3172176.465.286.500111.4F84 W90 C91 V92 L102 H105 T106 I109F84-M88 WeakPolarHBondContact O-CB 3.49Å; F84-M88 PolarHBondContact O-N 3.48Å; M88-W90 VanDerWaalsContact C-N 3.28Å; M88-W90 PolarHBondContact O-N 3.4Å; M88-C91 PolarHBondContact O-N 3.18Å; M88-V92 HydrophobicContact CG-CG2 4.48Å; M88-V92 WeakPolarHBondContact O-CB 3.35Å; M88-V92 WeakPolarHBondContact O-CG2 3.41Å; M88-V92 PolarHBondContact O-N 3.05Å; M88-V92 HydrophobicContact SD-CG2 3.99Å; M88-L102 WeakPolarHBondContact CE-O 3.46Å; M88-L102 HydrophobicContact SD-CD2 3.96Å; M88-H105 HydrophobicContact CE-CB 3.35Å; M88-H105 HydrophobicContact SD-CB 4.27Å; M88-T106 VanDerWaalsContact CE-N 3.32Å; M88-T106 WeakPolarHBondContact CE-OG1 3.4Å; M88-I109 HydrophobicContact CB-CD1 4.07Å; M88-I109 HydrophobicContact CE-CD1 4.24Å; M88-I109 HydrophobicContact CG-CD1 4.43Å
89G97.9Very high96.7Very high42 Ų4249.3 Ų49.343%0.43326%0.255SS..Hα-helixtrans-59.7-41.617900000111.8I85 F86 Y93I85-G89 PolarHBondContact O-N 3.23Å; F86-G89 PolarHBondContact O-N 2.87Å; G89-Y93 VanDerWaalsContact O-CB 3.24Å; G89-Y93 WeakPolarHBondContact O-CB 3.31Å; G89-Y93 PolarHBondContact O-N 3.35Å
90W98Very high96.6Very high17 Ų1749.1 Ų49.16%0.06426%0.256CS..Hα-helixtrans-64.3-49.1177.1-164.597.9000111.8Y19 E32 C35 F86 D87 M88 V92 Y93 F94 T96Y19-W90 AromaticContact CE2-NE1 3.75Å; Y19-W90 AromaticContact CZ-NE1 3.48Å; Y19-W90 PolarHBondContact OH-NE1 3.47Å; Y19-W90 VanDerWaalsContact OH-NE1 3.17Å; E32-W90 HydrophobicContact CB-CH2 3.64Å; E32-W90 HydrophobicContact CB-CZ2 4.1Å; E32-W90 HydrophobicContact CG-CH2 3.63Å; E32-W90 HydrophobicContact CG-CZ2 4.48Å; E32-W90 HydrophobicContact CG-CZ3 4.28Å; C35-W90 HydrophobicContact CB-CD2 3.82Å; C35-W90 VanDerWaalsContact CB-CE2 3.47Å; C35-W90 HydrophobicContact CB-CE3 4.21Å; C35-W90 HydrophobicContact CB-CG 4.36Å; C35-W90 HydrophobicContact CB-CH2 4.17Å; C35-W90 HydrophobicContact CB-CZ2 3.71Å; C35-W90 HydrophobicContact CB-CZ3 4.34Å; C35-W90 VanDerWaalsContact SG-CG 3.55Å; F86-W90 WeakPolarHBondContact O-CB 3.34Å; F86-W90 PolarHBondContact O-N 3.46Å; D87-W90 PolarHBondContact O-N 2.97Å; M88-W90 VanDerWaalsContact C-N 3.28Å; M88-W90 PolarHBondContact O-N 3.4Å; W90-V92 VanDerWaalsContact C-N 3.35Å; W90-V92 PolarHBondContact O-N 3.42Å; W90-Y93 PolarHBondContact O-N 3.01Å; W90-F94 AromaticContact CD1-CD2 3.82Å; W90-F94 AromaticContact CD1-CE2 3.72Å; W90-F94 AromaticContact CD2-CD2 3.59Å; W90-F94 HydrophobicContact CD2-CD2 3.59Å; W90-F94 HydrophobicContact CD2-CE2 4.22Å; W90-F94 HydrophobicContact CD2-CG 4.43Å; W90-F94 AromaticContact CE2-CD2 3.23Å; W90-F94 AromaticContact CE2-CE2 3.57Å; W90-F94 HydrophobicContact CE3-CB 4.43Å; W90-F94 HydrophobicContact CE3-CD2 4.25Å; W90-F94 AromaticContact CG-CD2 3.89Å; W90-F94 HydrophobicContact CG-CD2 3.89Å; W90-F94 HydrophobicContact CG-CE2 4.26Å; W90-F94 HydrophobicContact CH2-CB 4.06Å; W90-F94 HydrophobicContact CH2-CD2 4.17Å; W90-F94 HydrophobicContact CH2-CG 4.18Å; W90-F94 HydrophobicContact CZ2-CB 4.26Å; W90-F94 AromaticContact CZ2-CD2 3.54Å; W90-F94 HydrophobicContact CZ2-CD2 3.54Å; W90-F94 AromaticContact CZ2-CE2 3.98Å; W90-F94 HydrophobicContact CZ2-CE2 3.98Å; W90-F94 AromaticContact CZ2-CG 3.87Å; W90-F94 HydrophobicContact CZ2-CG 3.87Å; W90-F94 HydrophobicContact CZ3-CB 4.21Å; W90-F94 AromaticContact NE1-CD2 3.44Å; W90-F94 AromaticContact NE1-CE2 3.27Å; W90-F94 VanDerWaalsContact NE1-CE2 3.27Å; W90-F94 WeakPolarHBondContact O-CD2 3.33Å; W90-F94 PolarHBondContact O-N 3.37Å; W90-T96 HydrophobicContact CE3-CG2 4.41Å; W90-T96 HydrophobicContact CH2-CG2 3.55Å; W90-T96 HydrophobicContact CZ3-CG2 3.34Å; W90-T96 VanDerWaalsContact CZ3-OG1 3.26Å; W90-T96 WeakPolarHBondContact CZ3-OG1 3.5Å
91C96.7Very high96.4Very high4 Ų451.4 Ų51.43%0.02727%0.267CS..Hα-helixtrans-62.1-39179.2-70.30000112.7D87 M88 R95 T96 E97 L102D87-C91 WeakPolarHBondContact O-CB 3.16Å; D87-C91 PolarHBondContact O-N 2.78Å; D87-C91 PolarHBondContact O-SG 3.35Å; M88-C91 PolarHBondContact O-N 3.18Å; C91-R95 WeakPolarHBondContact O-CA 3.45Å; C91-R95 PolarHBondContact O-N 2.95Å; C91-T96 PolarHBondContact O-N 2.91Å; C91-E97 HydrophobicContact CB-CB 4.3Å; C91-E97 HydrophobicContact CB-CG 4.22Å; C91-E97 VanDerWaalsContact SG-CG 3.51Å; C91-L102 HydrophobicContact CB-CD2 3.95Å
92V97.1Very high96.3Very high87 Ų8753.6 Ų53.653%0.52728%0.278SS..Hα-helixtrans-69.4-43.1176.5169.70000111.1M88 W90 L102M88-V92 HydrophobicContact CG-CG2 4.48Å; M88-V92 WeakPolarHBondContact O-CB 3.35Å; M88-V92 WeakPolarHBondContact O-CG2 3.41Å; M88-V92 PolarHBondContact O-N 3.05Å; M88-V92 HydrophobicContact SD-CG2 3.99Å; W90-V92 VanDerWaalsContact C-N 3.35Å; W90-V92 PolarHBondContact O-N 3.42Å; V92-L102 HydrophobicContact CG2-CD2 4.28Å
93Y96.9Very high96.3Very high182 Ų18257 Ų5771%0.71430%0.299SS*.Hα-helixtrans-66.8-48-178.8-178-93000112.1G89 W90G89-Y93 VanDerWaalsContact O-CB 3.24Å; G89-Y93 WeakPolarHBondContact O-CB 3.31Å; G89-Y93 PolarHBondContact O-N 3.35Å; W90-Y93 PolarHBondContact O-N 3.01Å
94F95.4Very high96.2Very high83 Ų8357.2 Ų57.236%0.36430%0.3SS..Hα-helixtrans-89.3-7.3-178.2-71.7-77.1000114.2F31 W90 T96F31-F94 HydrophobicContact CB-CZ 4.4Å; W90-F94 AromaticContact CD1-CD2 3.82Å; W90-F94 AromaticContact CD1-CE2 3.72Å; W90-F94 AromaticContact CD2-CD2 3.59Å; W90-F94 HydrophobicContact CD2-CD2 3.59Å; W90-F94 HydrophobicContact CD2-CE2 4.22Å; W90-F94 HydrophobicContact CD2-CG 4.43Å; W90-F94 AromaticContact CE2-CD2 3.23Å; W90-F94 AromaticContact CE2-CE2 3.57Å; W90-F94 HydrophobicContact CE3-CB 4.43Å; W90-F94 HydrophobicContact CE3-CD2 4.25Å; W90-F94 AromaticContact CG-CD2 3.89Å; W90-F94 HydrophobicContact CG-CD2 3.89Å; W90-F94 HydrophobicContact CG-CE2 4.26Å; W90-F94 HydrophobicContact CH2-CB 4.06Å; W90-F94 HydrophobicContact CH2-CD2 4.17Å; W90-F94 HydrophobicContact CH2-CG 4.18Å; W90-F94 HydrophobicContact CZ2-CB 4.26Å; W90-F94 AromaticContact CZ2-CD2 3.54Å; W90-F94 HydrophobicContact CZ2-CD2 3.54Å; W90-F94 AromaticContact CZ2-CE2 3.98Å; W90-F94 HydrophobicContact CZ2-CE2 3.98Å; W90-F94 AromaticContact CZ2-CG 3.87Å; W90-F94 HydrophobicContact CZ2-CG 3.87Å; W90-F94 HydrophobicContact CZ3-CB 4.21Å; W90-F94 AromaticContact NE1-CD2 3.44Å; W90-F94 AromaticContact NE1-CE2 3.27Å; W90-F94 VanDerWaalsContact NE1-CE2 3.27Å; W90-F94 WeakPolarHBondContact O-CD2 3.33Å; W90-F94 PolarHBondContact O-N 3.37Å; F94-T96 VanDerWaalsContact C-N 3.29Å; F94-T96 HydrophobicContact CB-CG2 3.83Å; F94-T96 PolarHBondContact O-N 3.42Å
95R94.4Very high96.2Very high220 Ų22057.5 Ų57.583%0.8330%0.301SS*.THydrogen-bonded Turntrans53.840.9179.6-55.9-175.7-179.5-179.20.6113.7C91C91-R95 WeakPolarHBondContact O-CA 3.45Å; C91-R95 PolarHBondContact O-N 2.95Å
96T89.2Confident96.2Very high42 Ų4257.5 Ų57.526%0.25830%0.304SS..  trans-85.1-23.1-174.549.20000114.4W90 C91 F94W90-T96 HydrophobicContact CE3-CG2 4.41Å; W90-T96 HydrophobicContact CH2-CG2 3.55Å; W90-T96 HydrophobicContact CZ3-CG2 3.34Å; W90-T96 VanDerWaalsContact CZ3-OG1 3.26Å; W90-T96 WeakPolarHBondContact CZ3-OG1 3.5Å; C91-T96 PolarHBondContact O-N 2.91Å; F94-T96 VanDerWaalsContact C-N 3.29Å; F94-T96 HydrophobicContact CB-CG2 3.83Å; F94-T96 PolarHBondContact O-N 3.42Å
97E92.3Very high96.1Very high46 Ų4658.9 Ų58.922%0.21531%0.311CS..SBendtrans-116.4149-172.5-64.9-60.5158.800112.4R36 C91 M101R36-E97 IonicContact CZ-OE1 2.61Å; R36-E97 IonicContact NH1-OE1 3.35Å; R36-E97 PolarHBondContact NH1-OE1 3.37Å; R36-E97 IonicContact NH2-OE1 2.72Å; R36-E97 PolarHBondContact NH2-OE1 2.91Å; C91-E97 HydrophobicContact CB-CB 4.3Å; C91-E97 HydrophobicContact CB-CG 4.22Å; C91-E97 VanDerWaalsContact SG-CG 3.51Å; E97-M101 HydrophobicContact CB-CB 4.01Å
98G92.9Very high96.1Very high38 Ų3858.9 Ų58.939%0.39231%0.312SS..  trans-76.4166.9178.600000113.6V100 M101 L102G98-V100 VanDerWaalsContact C-N 3.27Å; G98-V100 PolarHBondContact O-N 2.84Å; G98-M101 PolarHBondContact O-N 3.25Å; G98-M101 VanDerWaalsContact O-N 3.09Å; G98-L102 PolarHBondContact O-N 3.18Å; G98-L102 VanDerWaalsContact O-N 3.16Å
99P94.8Very high96.1Very high102 Ų10258.6 Ų58.666%0.66231%0.311SS*.Hα-helixtrans-59.4-33.8-175.122.9-34000113.7M101 L102 V103P99-M101 PolarHBondContact O-N 2.96Å; P99-L102 PolarHBondContact O-N 3.44Å; P99-V103 WeakPolarHBondContact O-CG2 3.36Å; P99-V103 PolarHBondContact O-N 3.23Å
100V95.7Very high96.2Very high41 Ų4161.5 Ų61.525%0.24832%0.316CS..Hα-helixtrans-64-40.9178.4-175.30000111.3G98 V103 H104 L202 V205 F206G98-V100 VanDerWaalsContact C-N 3.27Å; G98-V100 PolarHBondContact O-N 2.84Å; V100-V103 PolarHBondContact O-N 2.94Å; V100-H104 PolarHBondContact O-N 2.88Å; V100-L202 HydrophobicContact CG1-CD1 3.84Å; V100-V205 HydrophobicContact CG1-CG1 3.91Å; V100-V205 HydrophobicContact CG2-CG1 4.36Å; V100-F206 HydrophobicContact CB-CE1 4.29Å; V100-F206 HydrophobicContact CG1-CD1 3.97Å; V100-F206 HydrophobicContact CG1-CE1 3.54Å; V100-F206 HydrophobicContact CG1-CE2 4.31Å; V100-F206 HydrophobicContact CG1-CZ 3.74Å
101M95.8Very high96.2Very high50 Ų5062.1 Ų62.125%0.24633%0.328CS..Hα-helixtrans-66.8-42.5174.6-76.5-61.3-61.200111.1E97 G98 P99 V103 H104 H105 F206E97-M101 HydrophobicContact CB-CB 4.01Å; G98-M101 PolarHBondContact O-N 3.25Å; G98-M101 VanDerWaalsContact O-N 3.09Å; P99-M101 PolarHBondContact O-N 2.96Å; M101-V103 VanDerWaalsContact C-N 3.32Å; M101-V103 PolarHBondContact O-N 2.89Å; M101-H104 WeakPolarHBondContact O-CA 3.29Å; M101-H104 VanDerWaalsContact O-CB 3.28Å; M101-H104 WeakPolarHBondContact O-CB 3.5Å; M101-H104 PolarHBondContact O-N 3.29Å; M101-H105 PolarHBondContact O-CD2 3.31Å; M101-H105 PolarHBondContact O-N 2.99Å; M101-F206 HydrophobicContact CG-CE1 4.18Å; M101-F206 HydrophobicContact CG-CZ 4.36Å; M101-F206 HydrophobicContact SD-CE1 3.54Å; M101-F206 VanDerWaalsContact SD-CE1 3.54Å; M101-F206 HydrophobicContact SD-CZ 3.47Å; M101-F206 WeakPolarHBondContact SD-CZ 3.43Å
102L97Very high96.3Very high47 Ų4762.2 Ų62.225%0.24633%0.328CS..Hα-helixtrans-62.4-39.1176.4-61.7179.8000112.2M88 C91 V92 G98 P99 H104 H105 T106M88-L102 WeakPolarHBondContact CE-O 3.46Å; M88-L102 HydrophobicContact SD-CD2 3.96Å; C91-L102 HydrophobicContact CB-CD2 3.95Å; V92-L102 HydrophobicContact CG2-CD2 4.28Å; G98-L102 PolarHBondContact O-N 3.18Å; G98-L102 VanDerWaalsContact O-N 3.16Å; P99-L102 PolarHBondContact O-N 3.44Å; L102-H104 VanDerWaalsContact C-N 3.33Å; L102-H105 PolarHBondContact O-N 3.36Å; L102-T106 WeakPolarHBondContact O-CB 3.37Å; L102-T106 PolarHBondContact O-N 2.86Å; L102-T106 PolarHBondContact O-OG1 3.32Å
103V97.8Very high96.3Very high70 Ų7061.9 Ų61.942%0.42432%0.323SS..Hα-helixtrans-62.6-42.2172.1170.60000110.6P99 V100 M101 H105 T106 M107 L202P99-V103 WeakPolarHBondContact O-CG2 3.36Å; P99-V103 PolarHBondContact O-N 3.23Å; V100-V103 PolarHBondContact O-N 2.94Å; M101-V103 VanDerWaalsContact C-N 3.32Å; M101-V103 PolarHBondContact O-N 2.89Å; V103-H105 PolarHBondContact O-N 3.04Å; V103-T106 PolarHBondContact O-N 3.13Å; V103-M107 HydrophobicContact CG1-CG 4.23Å; V103-M107 HydrophobicContact CG1-SD 3.65Å; V103-M107 WeakPolarHBondContact O-CB 3.48Å; V103-M107 VanDerWaalsContact O-CG 3.3Å; V103-M107 WeakPolarHBondContact O-CG 3.46Å; V103-M107 PolarHBondContact O-N 3.41Å; V103-L202 HydrophobicContact CG1-CD1 4.26Å; V103-L202 HydrophobicContact CG1-CD2 4.29Å
104H97.1Very high96.3Very high7 Ų755.2 Ų55.23%0.03230%0.299CS..Hα-helixtrans-58.1-48.7175.5178.752.1000113V100 M101 L102 M107 S108 R171 L202 F206V100-H104 PolarHBondContact O-N 2.88Å; M101-H104 WeakPolarHBondContact O-CA 3.29Å; M101-H104 VanDerWaalsContact O-CB 3.28Å; M101-H104 WeakPolarHBondContact O-CB 3.5Å; M101-H104 PolarHBondContact O-N 3.29Å; L102-H104 VanDerWaalsContact C-N 3.33Å; H104-M107 PolarHBondContact O-N 3.03Å; H104-S108 WeakPolarHBondContact O-CB 3.29Å; H104-S108 PolarHBondContact O-N 2.96Å; H104-S108 PolarHBondContact O-OG 2.92Å; H104-R171 PolarHBondContact CE1-NH1 3.26Å; H104-L202 HydrophobicContact CB-CD2 3.6Å; H104-F206 HydrophobicContact CB-CE2 3.88Å; H104-F206 HydrophobicContact CB-CZ 3.86Å; H104-F206 AromaticContact CG-CE2 3.93Å
105H97.6Very high96.5Very high9 Ų951.4 Ų51.44%0.04228%0.283CS..Hα-helixtrans-63.1-43.3176.3-73.6-78.2000111.5F84 D87 M88 M101 L102 V103 M107 S108 I109F84-H105 AromaticContact CD1-ND1 3.83Å; D87-H105 IonicContact OD2-CE1 3.55Å; D87-H105 PolarHBondContact OD2-CE1 2.97Å; D87-H105 IonicContact OD2-ND1 3.64Å; D87-H105 IonicContact OD2-NE2 3.2Å; M88-H105 HydrophobicContact CE-CB 3.35Å; M88-H105 HydrophobicContact SD-CB 4.27Å; M101-H105 PolarHBondContact O-CD2 3.31Å; M101-H105 PolarHBondContact O-N 2.99Å; L102-H105 PolarHBondContact O-N 3.36Å; V103-H105 PolarHBondContact O-N 3.04Å; H105-M107 PolarHBondContact O-N 3.19Å; H105-S108 PolarHBondContact O-N 3.27Å; H105-I109 WeakPolarHBondContact O-CB 3.46Å; H105-I109 VanDerWaalsContact O-CG1 3.26Å; H105-I109 WeakPolarHBondContact O-CG1 3.37Å; H105-I109 PolarHBondContact O-N 3.48Å
106T98Very high96.6Very high62 Ų6241.7 Ų41.738%0.3825%0.247SC..Hα-helixtrans-59.7-49.2179-56.40000111M88 L102 V103 S108 I109 L110M88-T106 VanDerWaalsContact CE-N 3.32Å; M88-T106 WeakPolarHBondContact CE-OG1 3.4Å; L102-T106 WeakPolarHBondContact O-CB 3.37Å; L102-T106 PolarHBondContact O-N 2.86Å; L102-T106 PolarHBondContact O-OG1 3.32Å; V103-T106 PolarHBondContact O-N 3.13Å; T106-S108 VanDerWaalsContact C-N 3.33Å; T106-S108 PolarHBondContact O-N 3.47Å; T106-I109 PolarHBondContact O-N 3.38Å; T106-L110 HydrophobicContact CG2-CD1 3.98Å; T106-L110 HydrophobicContact CG2-CG 4.44Å; T106-L110 WeakPolarHBondContact O-CB 3.35Å; T106-L110 VanDerWaalsContact O-CG 3.28Å; T106-L110 WeakPolarHBondContact O-CG 3.32Å; T106-L110 PolarHBondContact O-N 3.48Å
107M97.8Very high97Very high46 Ų4643.4 Ų43.423%0.22726%0.261CS..Hα-helixtrans-66-36.1179.4-68.2176.163.900112.2V103 H104 H105 G111 A198 M199 L202V103-M107 HydrophobicContact CG1-CG 4.23Å; V103-M107 HydrophobicContact CG1-SD 3.65Å; V103-M107 WeakPolarHBondContact O-CB 3.48Å; V103-M107 VanDerWaalsContact O-CG 3.3Å; V103-M107 WeakPolarHBondContact O-CG 3.46Å; V103-M107 PolarHBondContact O-N 3.41Å; H104-M107 PolarHBondContact O-N 3.03Å; H105-M107 PolarHBondContact O-N 3.19Å; M107-G111 PolarHBondContact O-N 3.42Å; M107-A198 HydrophobicContact CE-CB 3.3Å; M107-M199 HydrophobicContact CB-SD 3.52Å; M107-M199 VanDerWaalsContact CB-SD 3.52Å; M107-M199 HydrophobicContact CE-CG 4.05Å; M107-M199 HydrophobicContact CE-SD 3.88Å; M107-M199 HydrophobicContact SD-SD 4.48Å; M107-L202 HydrophobicContact SD-CD2 3.92Å
108S98.1Very high97.2Very high11 Ų1143.1 Ų43.18%0.07726%0.261CS..Hα-helixtrans-65.3-45.2175.8-56.20000111.4H104 H105 T106 G111 I112H104-S108 WeakPolarHBondContact O-CB 3.29Å; H104-S108 PolarHBondContact O-N 2.96Å; H104-S108 PolarHBondContact O-OG 2.92Å; H105-S108 PolarHBondContact O-N 3.27Å; T106-S108 VanDerWaalsContact C-N 3.33Å; T106-S108 PolarHBondContact O-N 3.47Å; S108-G111 PolarHBondContact O-N 3.28Å; S108-I112 VanDerWaalsContact O-CG1 3.28Å; S108-I112 WeakPolarHBondContact O-CG1 3.4Å; S108-I112 PolarHBondContact O-N 3.32Å
109I98.6Very high97.4Very high24 Ų2443 Ų4312%0.12326%0.259CS..Hα-helixtrans-60.1-50.9175.5-70.2165.1000110.4L81 F84 I85 M88 H105 T106 G111 I112 L113L81-I109 HydrophobicContact CD1-CB 4.35Å; L81-I109 HydrophobicContact CD1-CG1 4.4Å; L81-I109 HydrophobicContact CD1-CG2 3.91Å; F84-I109 HydrophobicContact CB-CD1 4.2Å; F84-I109 HydrophobicContact CB-CG1 3.69Å; I85-I109 HydrophobicContact CG1-CD1 4.39Å; M88-I109 HydrophobicContact CB-CD1 4.07Å; M88-I109 HydrophobicContact CE-CD1 4.24Å; M88-I109 HydrophobicContact CG-CD1 4.43Å; H105-I109 WeakPolarHBondContact O-CB 3.46Å; H105-I109 VanDerWaalsContact O-CG1 3.26Å; H105-I109 WeakPolarHBondContact O-CG1 3.37Å; H105-I109 PolarHBondContact O-N 3.48Å; T106-I109 PolarHBondContact O-N 3.38Å; I109-G111 PolarHBondContact O-N 2.92Å; I109-I112 PolarHBondContact O-N 2.91Å; I109-L113 HydrophobicContact CG2-CD1 3.82Å; I109-L113 HydrophobicContact CG2-CG 4.48Å; I109-L113 WeakPolarHBondContact O-CB 3.4Å; I109-L113 VanDerWaalsContact O-CG 3.29Å; I109-L113 WeakPolarHBondContact O-CG 3.34Å; I109-L113 PolarHBondContact O-N 3.42Å
110L98.4Very high97.5Very high104 Ų10439.7 Ų39.755%0.54524%0.235SC..Hα-helixtrans-64-40.7-179.3-68.2176.7000112.1T106 L113 L114T106-L110 HydrophobicContact CG2-CD1 3.98Å; T106-L110 HydrophobicContact CG2-CG 4.44Å; T106-L110 WeakPolarHBondContact O-CB 3.35Å; T106-L110 VanDerWaalsContact O-CG 3.28Å; T106-L110 WeakPolarHBondContact O-CG 3.32Å; T106-L110 PolarHBondContact O-N 3.48Å; L110-L113 PolarHBondContact O-N 3.25Å; L110-L114 VanDerWaalsContact O-CB 3.24Å; L110-L114 WeakPolarHBondContact O-CB 3.37Å; L110-L114 PolarHBondContact O-N 2.97Å
111G98.1Very high97.6Very high29 Ų2937.8 Ų37.830%0.29922%0.223SC..Hα-helixtrans-63.9-42.1177.600000112.7M107 S108 I109 T115M107-G111 PolarHBondContact O-N 3.42Å; S108-G111 PolarHBondContact O-N 3.28Å; I109-G111 PolarHBondContact O-N 2.92Å; G111-T115 WeakPolarHBondContact O-CB 3.41Å; G111-T115 PolarHBondContact O-N 3.08Å; G111-T115 PolarHBondContact O-OG1 2.9Å
112I98.5Very high97.6Very high6 Ų635.4 Ų35.43%0.03121%0.211CC..Hα-helixtrans-67.1-46175.6-67166.4000110.9M77 L81 F84 S108 I109 L114 T115 L116 I129M77-I112 HydrophobicContact CB-CG2 3.82Å; M77-I112 HydrophobicContact CG-CG2 4.26Å; M77-I112 HydrophobicContact SD-CG2 4.46Å; L81-I112 HydrophobicContact CB-CG2 3.91Å; L81-I112 HydrophobicContact CD1-CG2 4.46Å; L81-I112 HydrophobicContact CD2-CG2 4.21Å; L81-I112 HydrophobicContact CG-CG2 4.43Å; F84-I112 HydrophobicContact CD2-CD1 3.77Å; F84-I112 HydrophobicContact CE2-CD1 3.81Å; S108-I112 VanDerWaalsContact O-CG1 3.28Å; S108-I112 WeakPolarHBondContact O-CG1 3.4Å; S108-I112 PolarHBondContact O-N 3.32Å; I109-I112 PolarHBondContact O-N 2.91Å; I112-L114 VanDerWaalsContact C-N 3.31Å; I112-L114 PolarHBondContact O-N 3.26Å; I112-T115 PolarHBondContact O-N 3.48Å; I112-L116 HydrophobicContact CG2-CD1 3.73Å; I112-L116 HydrophobicContact CG2-CG 4.17Å; I112-L116 WeakPolarHBondContact O-CB 3.37Å; I112-L116 WeakPolarHBondContact O-CG 3.32Å; I112-L116 PolarHBondContact O-N 3.28Å; I112-I129 HydrophobicContact CD1-CD1 4.02Å; I112-I129 HydrophobicContact CD1-CG1 4.49Å; I112-I129 HydrophobicContact CG1-CD1 4.29Å
113L98.2Very high97.7Very high81 Ų8133.2 Ų33.242%0.42420%0.2SC..Hα-helixtrans-58.3-44.1176.7-74.9170.7000111.7L81 I109 L110 L116 S117L81-L113 HydrophobicContact CD1-CD2 4.4Å; L81-L113 HydrophobicContact CD1-CG 4.14Å; L81-L113 HydrophobicContact CD2-CD2 3.59Å; L81-L113 HydrophobicContact CD2-CG 4.12Å; I109-L113 HydrophobicContact CG2-CD1 3.82Å; I109-L113 HydrophobicContact CG2-CG 4.48Å; I109-L113 WeakPolarHBondContact O-CB 3.4Å; I109-L113 VanDerWaalsContact O-CG 3.29Å; I109-L113 WeakPolarHBondContact O-CG 3.34Å; I109-L113 PolarHBondContact O-N 3.42Å; L110-L113 PolarHBondContact O-N 3.25Å; L113-L116 PolarHBondContact O-N 3Å; L113-S117 WeakPolarHBondContact O-CB 3.47Å; L113-S117 PolarHBondContact O-N 3.2Å; L113-S117 PolarHBondContact O-OG 3.44Å
114L97.8Very high97.6Very high41 Ų4130.2 Ų30.222%0.21518%0.181CC..Hα-helixtrans-60-50.1176.2-179.761.9000111.1L110 I112 L116 S117 L118 I191 I192L110-L114 VanDerWaalsContact O-CB 3.24Å; L110-L114 WeakPolarHBondContact O-CB 3.37Å; L110-L114 PolarHBondContact O-N 2.97Å; I112-L114 VanDerWaalsContact C-N 3.31Å; I112-L114 PolarHBondContact O-N 3.26Å; L114-L116 PolarHBondContact O-N 3.24Å; L114-S117 WeakPolarHBondContact CA-OG 3.33Å; L114-S117 PolarHBondContact O-N 3.27Å; L114-S117 PolarHBondContact O-OG 3.43Å; L114-L118 HydrophobicContact CD1-CD1 3.72Å; L114-L118 HydrophobicContact CD1-CG 4Å; L114-L118 HydrophobicContact CG-CD1 3.9Å; L114-L118 HydrophobicContact CG-CG 4.47Å; L114-L118 WeakPolarHBondContact O-CB 3.28Å; L114-L118 VanDerWaalsContact O-CG 3.29Å; L114-L118 WeakPolarHBondContact O-CG 3.44Å; L114-L118 PolarHBondContact O-N 2.91Å; L114-I191 HydrophobicContact CD1-CD1 4.11Å; L114-I191 HydrophobicContact CD1-CG2 4.32Å; L114-I191 HydrophobicContact CD2-CD1 4.17Å; L114-I191 HydrophobicContact CD2-CG1 3.85Å; L114-I191 HydrophobicContact CD2-CG2 4.14Å; L114-I192 HydrophobicContact CD2-CD1 3.81Å; L114-I192 HydrophobicContact CG-CD1 3.91Å
115T97.8Very high97.7Very high3 Ų330.7 Ų30.72%0.01819%0.185CC..Hα-helixtrans-61.8-41.7179.5-590000112.4N69 M77 G111 I112 G119 E120 S121 S125N69-T115 PolarHBondContact ND2-O 3.35Å; M77-T115 HydrophobicContact CE-CG2 3.93Å; M77-T115 HydrophobicContact SD-CG2 3.57Å; M77-T115 VanDerWaalsContact SD-CG2 3.57Å; G111-T115 WeakPolarHBondContact O-CB 3.41Å; G111-T115 PolarHBondContact O-N 3.08Å; G111-T115 PolarHBondContact O-OG1 2.9Å; I112-T115 PolarHBondContact O-N 3.48Å; T115-G119 PolarHBondContact O-N 3.37Å; T115-E120 VanDerWaalsContact CG2-O 3.3Å; T115-E120 WeakPolarHBondContact CG2-O 3.31Å; T115-S121 WeakPolarHBondContact CG2-O 3.1Å; T115-S125 WeakPolarHBondContact CB-OG 3.29Å; T115-S125 WeakPolarHBondContact CG2-OG 3.41Å; T115-S125 PolarHBondContact OG1-OG 3.47Å
116L97.7Very high97.7Very high17 Ų1730.3 Ų30.39%0.08918%0.184CC..Hα-helixtrans-66.9-39.6176.7-72.6173.8000112.3L4 I74 M77 V78 L81 I112 L113 L114L4-L116 HydrophobicContact CD2-CD2 4.42Å; I74-L116 HydrophobicContact CB-CD2 4.44Å; I74-L116 HydrophobicContact CG1-CD2 4.37Å; I74-L116 HydrophobicContact CG2-CD2 4.05Å; M77-L116 HydrophobicContact CB-CD1 4.43Å; M77-L116 HydrophobicContact CB-CD2 4.09Å; M77-L116 HydrophobicContact CB-CG 4.34Å; M77-L116 HydrophobicContact CE-CD2 3.82Å; M77-L116 HydrophobicContact CE-CG 4.45Å; M77-L116 HydrophobicContact SD-CD2 4.38Å; M77-L116 HydrophobicContact SD-CG 4.44Å; V78-L116 HydrophobicContact CG2-CD1 4.12Å; V78-L116 HydrophobicContact CG2-CD2 4.37Å; L81-L116 HydrophobicContact CD2-CD1 4.02Å; I112-L116 HydrophobicContact CG2-CD1 3.73Å; I112-L116 HydrophobicContact CG2-CG 4.17Å; I112-L116 WeakPolarHBondContact O-CB 3.37Å; I112-L116 WeakPolarHBondContact O-CG 3.32Å; I112-L116 PolarHBondContact O-N 3.28Å; L113-L116 PolarHBondContact O-N 3Å; L114-L116 PolarHBondContact O-N 3.24Å
117S96.5Very high97.7Very high77 Ų7728 Ų2854%0.53817%0.171SC..Hα-helixtrans-71.1-35.8178.763.50000113.1L113 L114L113-S117 WeakPolarHBondContact O-CB 3.47Å; L113-S117 PolarHBondContact O-N 3.2Å; L113-S117 PolarHBondContact O-OG 3.44Å; L114-S117 WeakPolarHBondContact CA-OG 3.33Å; L114-S117 PolarHBondContact O-N 3.27Å; L114-S117 PolarHBondContact O-OG 3.43Å
118L96.4Very high97.7Very high41 Ų4128.6 Ų28.622%0.21518%0.177CC..Hα-helixtrans-77.1-27.1176.7-65.5176.3000112.6L114 E120 I191 I192L114-L118 HydrophobicContact CD1-CD1 3.72Å; L114-L118 HydrophobicContact CD1-CG 4Å; L114-L118 HydrophobicContact CG-CD1 3.9Å; L114-L118 HydrophobicContact CG-CG 4.47Å; L114-L118 WeakPolarHBondContact O-CB 3.28Å; L114-L118 VanDerWaalsContact O-CG 3.29Å; L114-L118 WeakPolarHBondContact O-CG 3.44Å; L114-L118 PolarHBondContact O-N 2.91Å; L118-E120 HydrophobicContact CB-CG 3.91Å; L118-E120 PolarHBondContact O-N 3.38Å; L118-I191 HydrophobicContact CD1-CG2 4.23Å; L118-I192 HydrophobicContact CD1-CD1 3.91Å; L118-I192 HydrophobicContact CD1-CG1 3.91Å
119G97.1Very high97.7Very high34 Ų3428.3 Ų28.335%0.35118%0.175SC..THydrogen-bonded Turntrans74.613.5-179.200000114.2K68 N69 T115K68-G119 WeakPolarHBondContact CA-O 3.35Å; N69-G119 VanDerWaalsContact CG-C 3.41Å; N69-G119 PolarHBondContact N-O 3.18Å; N69-G119 WeakPolarHBondContact ND2-CA 3.4Å; T115-G119 PolarHBondContact O-N 3.37Å
120E97.1Very high97.7Very high34 Ų3428.4 Ų28.416%0.15917%0.174CC..BIsolated β-bridgetrans-140.2163.8-178.865.2-171.3-140.300110.1T67 N69 T115 L118 G122 R189T67-E120 CarbonylContact O-C 3.54Å; T67-E120 WeakPolarHBondContact O-CA 3.22Å; N69-E120 WeakPolarHBondContact OD1-CA 3.47Å; N69-E120 PolarHBondContact OD1-N 3.32Å; N69-E120 PolarHBondContact OD1-O 3.28Å; T115-E120 VanDerWaalsContact CG2-O 3.3Å; T115-E120 WeakPolarHBondContact CG2-O 3.31Å; L118-E120 HydrophobicContact CB-CG 3.91Å; L118-E120 PolarHBondContact O-N 3.38Å; E120-G122 VanDerWaalsContact C-N 3.31Å; E120-R189 VanDerWaalsContact CD-NE 3.33Å; E120-R189 VanDerWaalsContact OE1-CD 3.25Å; E120-R189 WeakPolarHBondContact OE1-CD 3.47Å; E120-R189 WeakPolarHBondContact OE1-CG 3.03Å; E120-R189 IonicContact OE1-CZ 3.23Å; E120-R189 IonicContact OE1-NE 3.07Å; E120-R189 PolarHBondContact OE1-NE 3.43Å; E120-R189 IonicContact OE1-NH2 3.74Å; E120-R189 IonicContact OE2-CZ 3.53Å; E120-R189 IonicContact OE2-NE 2.94Å; E120-R189 PolarHBondContact OE2-NE 3.4Å; E120-R189 IonicContact OE2-NH2 2.88Å; E120-R189 PolarHBondContact OE2-NH2 3.49Å
121S97.5Very high97.6Very high0 Ų023.9 Ų23.90%015%0.152CC..  trans7021.3-178.6-38.40000115.4T67 N69 T115 I123 E124 S125T67-S121 PolarHBondContact O-N 3.09Å; N69-S121 PolarHBondContact OD1-N 3.01Å; T115-S121 WeakPolarHBondContact CG2-O 3.1Å; S121-I123 VanDerWaalsContact C-N 3.28Å; S121-I123 PolarHBondContact O-N 2.95Å; S121-E124 WeakPolarHBondContact CA-OE2 3.5Å; S121-E124 WeakPolarHBondContact CB-OE2 3.46Å; S121-E124 PolarHBondContact O-N 3.25Å; S121-S125 PolarHBondContact O-N 2.97Å; S121-S125 VanDerWaalsContact O-N 3.12Å
122G97.4Very high97.4Very high0 Ų022.8 Ų22.80%014%0.14CC..Hα-helixtrans-62-35.1178.500000112.8N69 E120 S125 C126N69-G122 WeakPolarHBondContact OD1-CA 3.26Å; N69-G122 PolarHBondContact OD1-N 2.88Å; E120-G122 VanDerWaalsContact C-N 3.31Å; G122-S125 PolarHBondContact O-N 3.34Å; G122-C126 WeakPolarHBondContact O-CB 3.34Å; G122-C126 PolarHBondContact O-N 3.07Å; G122-C126 PolarHBondContact O-SG 2.77Å; G122-C126 VanDerWaalsContact O-SG 3.33Å
123I97.5Very high97.4Very high2 Ų222.9 Ų22.91%0.0114%0.14CC..Hα-helixtrans-67.8-39.7177.3-170.862.6000112.4I53 P59 P61 S121 C126 A127I53-I123 HydrophobicContact CG2-CD1 3.77Å; P59-I123 HydrophobicContact CG-CB 4.43Å; P59-I123 HydrophobicContact CG-CG2 4.47Å; P59-I123 WeakPolarHBondContact O-CD1 3.26Å; P59-I123 WeakPolarHBondContact O-CG1 3.32Å; P61-I123 HydrophobicContact CB-CG1 3.95Å; P61-I123 HydrophobicContact CG-CG1 4.42Å; S121-I123 VanDerWaalsContact C-N 3.28Å; S121-I123 PolarHBondContact O-N 2.95Å; I123-C126 PolarHBondContact O-N 3.16Å; I123-A127 VanDerWaalsContact O-CB 3.3Å; I123-A127 WeakPolarHBondContact O-CB 3.48Å; I123-A127 PolarHBondContact O-N 3.33Å
124E96.9Very high97.4Very high6 Ų620.9 Ų20.93%0.02813%0.129CC..Hα-helixtrans-62.1-47.4172.8-69.1117.9119.800110.6P65 G66 S121 C126 A127 V128 E182 P188P65-E124 VanDerWaalsContact CA-CD 3.46Å; P65-E124 WeakPolarHBondContact CA-OE1 3.41Å; P65-E124 WeakPolarHBondContact CA-OE2 3.37Å; P65-E124 VanDerWaalsContact CB-CD 3.49Å; P65-E124 HydrophobicContact CB-CG 3.96Å; P65-E124 WeakPolarHBondContact CB-OE1 3.28Å; G66-E124 VanDerWaalsContact N-CD 3.27Å; G66-E124 PolarHBondContact N-OE1 2.92Å; G66-E124 PolarHBondContact N-OE2 3.42Å; S121-E124 WeakPolarHBondContact CA-OE2 3.5Å; S121-E124 WeakPolarHBondContact CB-OE2 3.46Å; S121-E124 PolarHBondContact O-N 3.25Å; E124-C126 PolarHBondContact O-N 3.4Å; E124-A127 PolarHBondContact O-N 3.49Å; E124-V128 WeakPolarHBondContact O-CG2 3.47Å; E124-V128 PolarHBondContact O-N 3.35Å; E124-E182 HydrophobicContact CG-CG 4.5Å; E124-P188 VanDerWaalsContact OE1-CG 3.29Å; E124-P188 WeakPolarHBondContact OE1-CG 3.49Å
125S97.9Very high97.3Very high17 Ų1719 Ų1912%0.11912%0.119CC..Hα-helixtrans-59.6-46177.3-78.10000112.6M77 T115 S121 G122 A127 V128 I129M77-S125 VanDerWaalsContact SD-CB 3.57Å; T115-S125 WeakPolarHBondContact CB-OG 3.29Å; T115-S125 WeakPolarHBondContact CG2-OG 3.41Å; T115-S125 PolarHBondContact OG1-OG 3.47Å; S121-S125 PolarHBondContact O-N 2.97Å; S121-S125 VanDerWaalsContact O-N 3.12Å; G122-S125 PolarHBondContact O-N 3.34Å; S125-A127 VanDerWaalsContact C-N 3.31Å; S125-A127 PolarHBondContact O-N 2.76Å; S125-V128 PolarHBondContact O-N 2.96Å; S125-I129 VanDerWaalsContact O-CG1 3.25Å; S125-I129 WeakPolarHBondContact O-CG1 3.33Å; S125-I129 PolarHBondContact O-N 2.6Å
126C98.4Very high97.2Very high1 Ų119.7 Ų19.71%0.00712%0.123CC..Hα-helixtrans-62.5-38.6177.1-74.30000112.3T50 I53 G122 I123 E124 I129 F130T50-C126 WeakPolarHBondContact CB-O 3.5Å; T50-C126 HydrophobicContact CG2-CB 4.04Å; T50-C126 WeakPolarHBondContact CG2-O 3.45Å; I53-C126 HydrophobicContact CD1-CB 4.44Å; I53-C126 HydrophobicContact CG2-CB 4.38Å; G122-C126 WeakPolarHBondContact O-CB 3.34Å; G122-C126 PolarHBondContact O-N 3.07Å; G122-C126 PolarHBondContact O-SG 2.77Å; G122-C126 VanDerWaalsContact O-SG 3.33Å; I123-C126 PolarHBondContact O-N 3.16Å; E124-C126 PolarHBondContact O-N 3.4Å; C126-I129 PolarHBondContact O-N 2.84Å; C126-F130 WeakPolarHBondContact O-CB 3.42Å; C126-F130 PolarHBondContact O-N 3.39Å
127A97.6Very high97.2Very high14 Ų1420.4 Ų20.412%0.11613%0.128CC..Hα-helixtrans-72.3-34.9177.800000112.7P61 I123 E124 S125 F130 A131 M178P61-A127 HydrophobicContact CB-CB 3.92Å; P61-A127 HydrophobicContact CG-CB 4.06Å; I123-A127 VanDerWaalsContact O-CB 3.3Å; I123-A127 WeakPolarHBondContact O-CB 3.48Å; I123-A127 PolarHBondContact O-N 3.33Å; E124-A127 PolarHBondContact O-N 3.49Å; S125-A127 VanDerWaalsContact C-N 3.31Å; S125-A127 PolarHBondContact O-N 2.76Å; A127-F130 WeakPolarHBondContact O-CB 3.27Å; A127-F130 PolarHBondContact O-N 2.91Å; A127-A131 WeakPolarHBondContact O-CB 3.45Å; A127-A131 PolarHBondContact O-N 3.07Å; A127-M178 HydrophobicContact CB-CE 3.3Å; A127-M178 HydrophobicContact CB-SD 3.59Å; A127-M178 VanDerWaalsContact CB-SD 3.59Å
128V97.5Very high97.2Very high58 Ų5818.2 Ų18.235%0.35211%0.11SC..Hα-helixtrans-64-45170.6170.70000110.3E124 S125 F130 A131 S132 M199E124-V128 WeakPolarHBondContact O-CG2 3.47Å; E124-V128 PolarHBondContact O-N 3.35Å; S125-V128 PolarHBondContact O-N 2.96Å; V128-F130 VanDerWaalsContact C-N 3.34Å; V128-F130 PolarHBondContact O-N 3.47Å; V128-A131 PolarHBondContact O-N 3.5Å; V128-S132 WeakPolarHBondContact O-CB 3.5Å; V128-S132 PolarHBondContact O-N 3.43Å; V128-S132 PolarHBondContact O-OG 2.87Å; V128-S132 VanDerWaalsContact O-OG 3.07Å; V128-M199 HydrophobicContact CG1-CE 4.27Å
129I98.4Very high97.2Very high6 Ų618.7 Ų18.73%0.03111%0.113CC..Hα-helixtrans-57.9-46.8173.7-69.4164.1000110.4A46 T50 M77 I112 S125 C126 S132 E133A46-I129 HydrophobicContact CB-CG2 4.06Å; T50-I129 HydrophobicContact CG2-CB 4.27Å; T50-I129 HydrophobicContact CG2-CG2 3.97Å; M77-I129 HydrophobicContact CG-CD1 4.21Å; I112-I129 HydrophobicContact CD1-CD1 4.02Å; I112-I129 HydrophobicContact CD1-CG1 4.49Å; I112-I129 HydrophobicContact CG1-CD1 4.29Å; S125-I129 VanDerWaalsContact O-CG1 3.25Å; S125-I129 WeakPolarHBondContact O-CG1 3.33Å; S125-I129 PolarHBondContact O-N 2.6Å; C126-I129 PolarHBondContact O-N 2.84Å; I129-S132 WeakPolarHBondContact CA-OG 3.04Å; I129-S132 PolarHBondContact O-N 2.86Å; I129-S132 PolarHBondContact O-OG 2.86Å; I129-E133 HydrophobicContact CG2-CG 4.15Å; I129-E133 VanDerWaalsContact O-CB 3.28Å; I129-E133 WeakPolarHBondContact O-CB 3.4Å; I129-E133 WeakPolarHBondContact O-CG 3.49Å; I129-E133 PolarHBondContact O-N 3.02Å
130F98.4Very high97.2Very high26 Ų2617.5 Ų17.511%0.11410%0.098CC..Hα-helixtrans-57-54.1176.9179.2-103.7000111.5V47 T50 A51 Y55 C126 A127 V128 S132 E133 I134 M170V47-F130 HydrophobicContact CG1-CD2 4.18Å; V47-F130 HydrophobicContact CG1-CE2 3.76Å; T50-F130 WeakPolarHBondContact OG1-CA 3.25Å; T50-F130 VanDerWaalsContact OG1-CB 3.29Å; T50-F130 WeakPolarHBondContact OG1-CB 3.49Å; T50-F130 WeakPolarHBondContact OG1-CD2 3.46Å; A51-F130 HydrophobicContact CB-CD2 4.16Å; A51-F130 HydrophobicContact CB-CE2 3.7Å; Y55-F130 HydrophobicContact CE2-CZ 4.35Å; C126-F130 WeakPolarHBondContact O-CB 3.42Å; C126-F130 PolarHBondContact O-N 3.39Å; A127-F130 WeakPolarHBondContact O-CB 3.27Å; A127-F130 PolarHBondContact O-N 2.91Å; V128-F130 VanDerWaalsContact C-N 3.34Å; V128-F130 PolarHBondContact O-N 3.47Å; F130-S132 VanDerWaalsContact C-N 3.26Å; F130-S132 PolarHBondContact O-N 2.84Å; F130-E133 PolarHBondContact O-N 2.91Å; F130-I134 HydrophobicContact CE1-CD1 4.06Å; F130-I134 HydrophobicContact CE2-CD1 4.28Å; F130-I134 HydrophobicContact CZ-CD1 3.68Å; F130-I134 VanDerWaalsContact O-CB 3.31Å; F130-I134 WeakPolarHBondContact O-CB 3.14Å; F130-I134 PolarHBondContact O-N 2.71Å; F130-M170 HydrophobicContact CD1-CE 3.7Å; F130-M170 HydrophobicContact CE1-CE 3.44Å; F130-M170 VanDerWaalsContact CE1-CE 3.44Å
131A96.4Very high97.2Very high9 Ų918.2 Ų18.27%0.07411%0.105CC..Hα-helixtrans-64.7-31.2-177.900000112.3A127 V128 M170A127-A131 WeakPolarHBondContact O-CB 3.45Å; A127-A131 PolarHBondContact O-N 3.07Å; V128-A131 PolarHBondContact O-N 3.5Å; A131-M170 HydrophobicContact CB-CE 4.14Å
132S94.9Very high97.1Very high6 Ų620.2 Ų20.24%0.04211%0.113CC..Hα-helixtrans-75.1-48.2176.764.70000112.2V128 I129 F130 T135 R171V128-S132 WeakPolarHBondContact O-CB 3.5Å; V128-S132 PolarHBondContact O-N 3.43Å; V128-S132 PolarHBondContact O-OG 2.87Å; V128-S132 VanDerWaalsContact O-OG 3.07Å; I129-S132 WeakPolarHBondContact CA-OG 3.04Å; I129-S132 PolarHBondContact O-N 2.86Å; I129-S132 PolarHBondContact O-OG 2.86Å; F130-S132 VanDerWaalsContact C-N 3.26Å; F130-S132 PolarHBondContact O-N 2.84Å; S132-T135 PolarHBondContact O-OG1 2.73Å; S132-R171 VanDerWaalsContact C-NH2 3.34Å; S132-R171 VanDerWaalsContact CA-CZ 3.43Å; S132-R171 VanDerWaalsContact CA-NH2 3.27Å; S132-R171 PolarHBondContact O-NH2 2.89Å
133E97.8Very high97.1Very high8 Ų822 Ų224%0.03712%0.12CC..Hα-helixtrans-79.3-23.7-172.8-67.4-53.5131.700113.7A46 V47 I129 F130 T135 N136 P137A46-E133 HydrophobicContact CB-CB 4.29Å; A46-E133 HydrophobicContact CB-CG 4.05Å; V47-E133 HydrophobicContact CG2-CB 3.85Å; I129-E133 HydrophobicContact CG2-CG 4.15Å; I129-E133 VanDerWaalsContact O-CB 3.28Å; I129-E133 WeakPolarHBondContact O-CB 3.4Å; I129-E133 WeakPolarHBondContact O-CG 3.49Å; I129-E133 PolarHBondContact O-N 3.02Å; F130-E133 PolarHBondContact O-N 2.91Å; E133-T135 PolarHBondContact O-N 2.8Å; E133-N136 WeakPolarHBondContact O-CB 3.3Å; E133-N136 PolarHBondContact O-N 2.93Å; E133-N136 WeakPolarHBondContact OE2-CB 3.33Å; E133-N136 PolarHBondContact OE2-ND2 3.16Å; E133-P137 WeakPolarHBondContact O-CD 3.47Å
134I97.5Very high97.1Very high39 Ų3923 Ų2320%0.212%0.124CC..THydrogen-bonded Turntrans-59.9-26.1-179.7-160177.2000113.3V47 F130 L166 M170V47-I134 HydrophobicContact CG1-CG1 4.32Å; V47-I134 HydrophobicContact CG2-CB 4.09Å; F130-I134 HydrophobicContact CE1-CD1 4.06Å; F130-I134 HydrophobicContact CE2-CD1 4.28Å; F130-I134 HydrophobicContact CZ-CD1 3.68Å; F130-I134 VanDerWaalsContact O-CB 3.31Å; F130-I134 WeakPolarHBondContact O-CB 3.14Å; F130-I134 PolarHBondContact O-N 2.71Å; I134-L166 HydrophobicContact CD1-CD1 4.35Å; I134-L166 HydrophobicContact CG1-CD2 4.25Å; I134-L166 HydrophobicContact CG2-CD2 4.4Å; I134-L166 HydrophobicContact CG2-CG 4.35Å; I134-L166 WeakPolarHBondContact O-CD2 3.48Å; I134-M170 HydrophobicContact CD1-CG 4.47Å; I134-M170 HydrophobicContact CG2-CB 3.99Å; I134-M170 HydrophobicContact CG2-CE 4.38Å; I134-M170 HydrophobicContact CG2-CG 3.73Å
135T96.3Very high97.1Very high1 Ų123.3 Ų23.31%0.00613%0.126CC..THydrogen-bonded Turntrans-84.6-17.1175.259.30000113.9S132 E133 L138 L139 L166 F167S132-T135 PolarHBondContact O-OG1 2.73Å; E133-T135 PolarHBondContact O-N 2.8Å; T135-L138 PolarHBondContact O-N 3.48Å; T135-L139 PolarHBondContact O-N 3.28Å; T135-L166 HydrophobicContact CG2-CB 4.27Å; T135-L166 HydrophobicContact CG2-CD2 4.17Å; T135-L166 HydrophobicContact CG2-CG 3.94Å; T135-F167 HydrophobicContact CG2-CB 4.15Å; T135-F167 HydrophobicContact CG2-CD2 4.41Å
136N96.4Very high97Very high18 Ų1828.2 Ų28.210%0.09614%0.141CC..Hα-helixtrans-68-41.7-170.7-170.220.3000113.1T39 E133 L138 L139 Q140T39-N136 VanDerWaalsContact CG2-ND2 3.33Å; T39-N136 WeakPolarHBondContact CG2-ND2 3.44Å; E133-N136 WeakPolarHBondContact O-CB 3.3Å; E133-N136 PolarHBondContact O-N 2.93Å; E133-N136 WeakPolarHBondContact OE2-CB 3.33Å; E133-N136 PolarHBondContact OE2-ND2 3.16Å; N136-L138 PolarHBondContact O-N 3.39Å; N136-L138 VanDerWaalsContact O-N 3.11Å; N136-L139 WeakPolarHBondContact O-CA 3.42Å; N136-L139 WeakPolarHBondContact O-CB 3.25Å; N136-L139 PolarHBondContact O-N 3.22Å; N136-Q140 WeakPolarHBondContact O-CG 3.28Å; N136-Q140 PolarHBondContact O-N 3.01Å; N136-Q140 PolarHBondContact OD1-NE2 3.43Å
137P97.1Very high96.9Very high31 Ų3133.3 Ų33.320%0.20117%0.165CC..Hα-helixtrans-54.3-34.7174.8-29.336.3000113.8L40 I44 E133 T141L40-P137 HydrophobicContact CD1-CB 3.79Å; L40-P137 HydrophobicContact CD1-CG 4.33Å; I44-P137 HydrophobicContact CG1-CG 4.31Å; E133-P137 WeakPolarHBondContact O-CD 3.47Å; P137-T141 VanDerWaalsContact O-CB 3.3Å; P137-T141 WeakPolarHBondContact O-CB 3.43Å; P137-T141 PolarHBondContact O-N 3.39Å; P137-T141 PolarHBondContact O-OG1 3.36Å
138L97.3Very high96.8Very high31 Ų3136.5 Ų36.516%0.16218%0.18CC..Hα-helixtrans-71.3-39.3176.5-63.3170.9000111.9T135 N136 T141 R142 V159 L162 F163 L166T135-L138 PolarHBondContact O-N 3.48Å; N136-L138 PolarHBondContact O-N 3.39Å; N136-L138 VanDerWaalsContact O-N 3.11Å; L138-T141 PolarHBondContact O-N 3.17Å; L138-R142 WeakPolarHBondContact O-CB 3.19Å; L138-R142 PolarHBondContact O-N 2.89Å; L138-V159 HydrophobicContact CB-CG1 4.41Å; L138-V159 VanDerWaalsContact O-CG1 3.32Å; L138-V159 WeakPolarHBondContact O-CG1 3.42Å; L138-L162 HydrophobicContact CD1-CB 3.88Å; L138-L162 HydrophobicContact CD2-CB 4.26Å; L138-L162 HydrophobicContact CD2-CD1 4.45Å; L138-F163 HydrophobicContact CB-CB 4.1Å; L138-F163 HydrophobicContact CB-CD2 4.37Å; L138-F163 HydrophobicContact CD1-CB 4.29Å; L138-L166 HydrophobicContact CD1-CD2 3.86Å
139L94.9Very high96.7Very high52 Ų5237.1 Ų37.127%0.27220%0.198SC..Hα-helixtrans-61.6-45.7173-73.5175000111.8T135 N136 R142 W143 F163T135-L139 PolarHBondContact O-N 3.28Å; N136-L139 WeakPolarHBondContact O-CA 3.42Å; N136-L139 WeakPolarHBondContact O-CB 3.25Å; N136-L139 PolarHBondContact O-N 3.22Å; L139-R142 WeakPolarHBondContact O-CB 3.49Å; L139-R142 PolarHBondContact O-N 3.34Å; L139-W143 PolarHBondContact O-N 3.36Å; L139-F163 HydrophobicContact CD1-CE2 3.68Å; L139-F163 HydrophobicContact CD1-CZ 4.14Å; L139-F163 HydrophobicContact CD2-CD1 4.42Å; L139-F163 HydrophobicContact CD2-CD2 3.81Å; L139-F163 HydrophobicContact CD2-CE1 4.04Å; L139-F163 HydrophobicContact CD2-CE2 3.39Å; L139-F163 HydrophobicContact CD2-CG 4.31Å; L139-F163 HydrophobicContact CD2-CZ 3.52Å; L139-F163 HydrophobicContact CG-CD2 3.75Å; L139-F163 HydrophobicContact CG-CE2 3.33Å; L139-F163 HydrophobicContact CG-CZ 3.96Å
140Q97.6Very high96.5Very high8 Ų843.5 Ų43.54%0.03722%0.222CC..Hα-helixtrans-64.2-45.7177-57.8-45.6-46.400110.9T39 L40 N136 R142 W143 F144T39-Q140 VanDerWaalsContact CG2-CD 3.49Å; T39-Q140 HydrophobicContact CG2-CG 3.96Å; L40-Q140 HydrophobicContact CB-CB 4.18Å; L40-Q140 HydrophobicContact CB-CG 4.14Å; L40-Q140 HydrophobicContact CD1-CB 4.21Å; N136-Q140 WeakPolarHBondContact O-CG 3.28Å; N136-Q140 PolarHBondContact O-N 3.01Å; N136-Q140 PolarHBondContact OD1-NE2 3.43Å; Q140-R142 VanDerWaalsContact C-N 3.29Å; Q140-R142 PolarHBondContact O-N 3.13Å; Q140-W143 WeakPolarHBondContact O-CB 3.43Å; Q140-W143 PolarHBondContact O-N 3.41Å; Q140-W143 VanDerWaalsContact O-N 3.09Å; Q140-F144 HydrophobicContact CB-CD2 4.42Å; Q140-F144 HydrophobicContact CB-CE2 4.12Å; Q140-F144 WeakPolarHBondContact O-CD2 3.38Å; Q140-F144 PolarHBondContact O-N 3.32Å
141T97.3Very high96.3Very high50 Ų5043.5 Ų43.531%0.30722%0.221SC..Hα-helixtrans-56.7-44.1176.3-59.10000111.5P137 L138 W143 F144 L145 V159P137-T141 VanDerWaalsContact O-CB 3.3Å; P137-T141 WeakPolarHBondContact O-CB 3.43Å; P137-T141 PolarHBondContact O-N 3.39Å; P137-T141 PolarHBondContact O-OG1 3.36Å; L138-T141 PolarHBondContact O-N 3.17Å; T141-W143 VanDerWaalsContact C-N 3.34Å; T141-W143 PolarHBondContact O-N 2.97Å; T141-F144 PolarHBondContact O-N 2.88Å; T141-L145 HydrophobicContact CG2-CD1 4.15Å; T141-L145 HydrophobicContact CG2-CG 4.4Å; T141-L145 VanDerWaalsContact O-CG 3.3Å; T141-L145 WeakPolarHBondContact O-CG 3.4Å; T141-L145 PolarHBondContact O-N 3.45Å; T141-V159 HydrophobicContact CG2-CG2 3.84Å
142R96.5Very high96.1Very high42 Ų4250.2 Ų50.216%0.15825%0.251CS..Hα-helixtrans-59.3-43.9176.1-174.6-171.7-175.5-144.71.1112.1L138 L139 Q140 L145 R146 Y151 V159 D160L138-R142 WeakPolarHBondContact O-CB 3.19Å; L138-R142 PolarHBondContact O-N 2.89Å; L139-R142 WeakPolarHBondContact O-CB 3.49Å; L139-R142 PolarHBondContact O-N 3.34Å; Q140-R142 VanDerWaalsContact C-N 3.29Å; Q140-R142 PolarHBondContact O-N 3.13Å; R142-L145 PolarHBondContact O-N 3.09Å; R142-R146 WeakPolarHBondContact O-CG 3.43Å; R142-R146 PolarHBondContact O-N 3.47Å; R142-Y151 HydrophobicContact CG-CD2 4.19Å; R142-Y151 HydrophobicContact CG-CE2 3.83Å; R142-V159 HydrophobicContact CB-CG1 3.88Å; R142-D160 VanDerWaalsContact CD-OD1 3.26Å; R142-D160 WeakPolarHBondContact CD-OD1 3.44Å; R142-D160 IonicContact CZ-OD1 2.73Å; R142-D160 IonicContact NE-OD1 2.8Å; R142-D160 PolarHBondContact NE-OD1 3.18Å; R142-D160 IonicContact NH2-OD1 3.2Å
143W97.1Very high96Very high38 Ų3851.7 Ų51.714%0.14426%0.261CS..Hα-helixtrans-62.9-46.8176.7-175.5100.5000111.2E32 W33 R36 L139 Q140 T141 L145 R146 Q147E32-W143 HydrophobicContact CB-CH2 4.37Å; E32-W143 HydrophobicContact CB-CZ2 4.05Å; E32-W143 HydrophobicContact CG-CH2 4.08Å; E32-W143 HydrophobicContact CG-CZ2 3.47Å; E32-W143 VanDerWaalsContact CG-CZ2 3.47Å; E32-W143 PolarHBondContact OE1-NE1 2.96Å; W33-W143 HydrophobicContact CB-CH2 4.04Å; W33-W143 HydrophobicContact CB-CZ3 4.25Å; W33-W143 HydrophobicContact CD2-CZ3 4.19Å; W33-W143 HydrophobicContact CE3-CH2 4.18Å; W33-W143 AromaticContact CE3-CZ3 3.77Å; W33-W143 HydrophobicContact CE3-CZ3 3.77Å; W33-W143 HydrophobicContact CG-CZ3 4.43Å; W33-W143 HydrophobicContact CZ3-CZ3 4.47Å; R36-W143 HydrophobicContact CB-CE3 4.12Å; R36-W143 HydrophobicContact CB-CZ3 4.19Å; R36-W143 HydrophobicContact CG-CD2 3.89Å; R36-W143 HydrophobicContact CG-CE3 3.81Å; R36-W143 HydrophobicContact CG-CH2 4.16Å; R36-W143 HydrophobicContact CG-CZ2 4.23Å; R36-W143 HydrophobicContact CG-CZ3 3.95Å; L139-W143 PolarHBondContact O-N 3.36Å; Q140-W143 WeakPolarHBondContact O-CB 3.43Å; Q140-W143 PolarHBondContact O-N 3.41Å; Q140-W143 VanDerWaalsContact O-N 3.09Å; T141-W143 VanDerWaalsContact C-N 3.34Å; T141-W143 PolarHBondContact O-N 2.97Å; W143-L145 VanDerWaalsContact C-N 3.35Å; W143-L145 PolarHBondContact O-N 2.91Å; W143-R146 WeakPolarHBondContact O-CB 3.36Å; W143-R146 PolarHBondContact O-N 3.34Å; W143-R146 VanDerWaalsContact O-N 3.12Å; W143-Q147 HydrophobicContact CD2-CG 3.98Å; W143-Q147 HydrophobicContact CE3-CG 3.83Å; W143-Q147 HydrophobicContact CH2-CG 3.51Å; W143-Q147 HydrophobicContact CZ2-CG 3.67Å; W143-Q147 VanDerWaalsContact CZ2-NE2 3.33Å; W143-Q147 HydrophobicContact CZ3-CB 4.45Å; W143-Q147 HydrophobicContact CZ3-CG 3.6Å; W143-Q147 PolarHBondContact O-N 3.06Å; W143-Q147 VanDerWaalsContact O-N 3.08Å
144F97.3Very high95.8Very high21 Ų2157.6 Ų57.69%0.09229%0.293CS..Hα-helixtrans-61.7-40.4177.3-70.7-61.1000112.5W33 R36 L37 L40 Q140 T141 R146 Q147 L148W33-F144 AromaticContact CD2-CD1 3.89Å; W33-F144 HydrophobicContact CD2-CD1 3.89Å; W33-F144 AromaticContact CD2-CE1 3.67Å; W33-F144 HydrophobicContact CD2-CE1 3.67Å; W33-F144 AromaticContact CE2-CD1 3.79Å; W33-F144 AromaticContact CE2-CE1 3.59Å; W33-F144 AromaticContact CE3-CD1 3.89Å; W33-F144 HydrophobicContact CE3-CD1 3.89Å; W33-F144 HydrophobicContact CE3-CE1 4.12Å; W33-F144 HydrophobicContact CG-CE1 4.01Å; W33-F144 AromaticContact CH2-CD1 3.69Å; W33-F144 HydrophobicContact CH2-CD1 3.69Å; W33-F144 HydrophobicContact CH2-CE1 4.35Å; W33-F144 AromaticContact CZ2-CD1 3.7Å; W33-F144 HydrophobicContact CZ2-CD1 3.7Å; W33-F144 AromaticContact CZ2-CE1 3.95Å; W33-F144 HydrophobicContact CZ2-CE1 3.95Å; W33-F144 AromaticContact CZ3-CD1 3.8Å; W33-F144 HydrophobicContact CZ3-CD1 3.8Å; W33-F144 HydrophobicContact CZ3-CE1 4.44Å; W33-F144 AromaticContact NE1-CE1 3.89Å; R36-F144 HydrophobicContact CB-CE1 4.11Å; R36-F144 HydrophobicContact CB-CE2 4.26Å; R36-F144 HydrophobicContact CB-CZ 3.61Å; L37-F144 HydrophobicContact CD2-CE1 4.32Å; L37-F144 HydrophobicContact CD2-CE2 4.34Å; L37-F144 HydrophobicContact CD2-CZ 3.73Å; L37-F144 HydrophobicContact CG-CE1 4.38Å; L37-F144 HydrophobicContact CG-CZ 3.93Å; L40-F144 HydrophobicContact CD2-CE2 4.29Å; Q140-F144 HydrophobicContact CB-CD2 4.42Å; Q140-F144 HydrophobicContact CB-CE2 4.12Å; Q140-F144 WeakPolarHBondContact O-CD2 3.38Å; Q140-F144 PolarHBondContact O-N 3.32Å; T141-F144 PolarHBondContact O-N 2.88Å; F144-R146 VanDerWaalsContact C-N 3.27Å; F144-R146 PolarHBondContact O-N 3.44Å; F144-Q147 PolarHBondContact O-N 3.11Å; F144-L148 WeakPolarHBondContact O-CB 3.41Å; F144-L148 VanDerWaalsContact O-CG 3.31Å; F144-L148 WeakPolarHBondContact O-CG 3.38Å; F144-L148 PolarHBondContact O-N 3.15Å
145L97.1Very high95.6Very high13 Ų1358.9 Ų58.97%0.06830%0.302CS..Hα-helixtrans-61-36.3175.6-73.5172.5000112.2T141 R142 W143 G149 R150 Y151 T155 V159T141-L145 HydrophobicContact CG2-CD1 4.15Å; T141-L145 HydrophobicContact CG2-CG 4.4Å; T141-L145 VanDerWaalsContact O-CG 3.3Å; T141-L145 WeakPolarHBondContact O-CG 3.4Å; T141-L145 PolarHBondContact O-N 3.45Å; R142-L145 PolarHBondContact O-N 3.09Å; W143-L145 VanDerWaalsContact C-N 3.35Å; W143-L145 PolarHBondContact O-N 2.91Å; L145-G149 PolarHBondContact O-N 3.02Å; L145-R150 HydrophobicContact CD2-CB 3.96Å; L145-R150 CarbonylContact O-C 3.55Å; L145-R150 PolarHBondContact O-N 3.38Å; L145-Y151 PolarHBondContact O-N 3.09Å; L145-Y151 VanDerWaalsContact O-N 3.16Å; L145-T155 HydrophobicContact CD1-CG2 4.06Å; L145-T155 HydrophobicContact CD2-CG2 4.34Å; L145-V159 HydrophobicContact CD1-CG2 4.1Å
146R95.9Very high95.6Very high120 Ų12058.9 Ų58.945%0.45330%0.302SS..Hα-helixtrans-66.1-46.4174.5-72.5176173.5-171.2-4.2111.5R142 W143 F144 L148 G149 Y151R142-R146 WeakPolarHBondContact O-CG 3.43Å; R142-R146 PolarHBondContact O-N 3.47Å; W143-R146 WeakPolarHBondContact O-CB 3.36Å; W143-R146 PolarHBondContact O-N 3.34Å; W143-R146 VanDerWaalsContact O-N 3.12Å; F144-R146 VanDerWaalsContact C-N 3.27Å; F144-R146 PolarHBondContact O-N 3.44Å; R146-L148 PolarHBondContact O-N 3.2Å; R146-G149 PolarHBondContact O-N 3.06Å; R146-Y151 HydrophobicContact CG-CD1 4.28Å; R146-Y151 HydrophobicContact CG-CD2 3.7Å; R146-Y151 HydrophobicContact CG-CE2 4.43Å; R146-Y151 HydrophobicContact CG-CG 3.6Å; R146-Y151 PolarHBondContact NH2-OH 3.39Å
147Q95.4Very high95.5Very high109 Ų10961.2 Ų61.251%0.50931%0.313SS..Hα-helixtrans-64.4-29.9178.7-65.8-58.9-13.300113.2W33 W143 F144 G149W33-Q147 HydrophobicContact CE3-CB 4.15Å; W33-Q147 HydrophobicContact CE3-CG 4.48Å; W33-Q147 HydrophobicContact CZ3-CB 3.73Å; W33-Q147 HydrophobicContact CZ3-CG 4.49Å; W143-Q147 HydrophobicContact CD2-CG 3.98Å; W143-Q147 HydrophobicContact CE3-CG 3.83Å; W143-Q147 HydrophobicContact CH2-CG 3.51Å; W143-Q147 HydrophobicContact CZ2-CG 3.67Å; W143-Q147 VanDerWaalsContact CZ2-NE2 3.33Å; W143-Q147 HydrophobicContact CZ3-CB 4.45Å; W143-Q147 HydrophobicContact CZ3-CG 3.6Å; W143-Q147 PolarHBondContact O-N 3.06Å; W143-Q147 VanDerWaalsContact O-N 3.08Å; F144-Q147 PolarHBondContact O-N 3.11Å; Q147-G149 VanDerWaalsContact C-N 3.31Å
148L95.1Very high95.4Very high80 Ų8063 Ų6342%0.41932%0.323SS..THydrogen-bonded Turntrans-85.31.5175.8-65.9173.7000113.6W33 F144 R146 R150W33-L148 HydrophobicContact CH2-CD1 4.28Å; W33-L148 HydrophobicContact CH2-CD2 3.86Å; W33-L148 HydrophobicContact CH2-CG 3.97Å; W33-L148 HydrophobicContact CZ3-CD2 4.3Å; W33-L148 HydrophobicContact CZ3-CG 4.35Å; F144-L148 WeakPolarHBondContact O-CB 3.41Å; F144-L148 VanDerWaalsContact O-CG 3.31Å; F144-L148 WeakPolarHBondContact O-CG 3.38Å; F144-L148 PolarHBondContact O-N 3.15Å; R146-L148 PolarHBondContact O-N 3.2Å; L148-R150 HydrophobicContact CB-CG 4.35Å; L148-R150 PolarHBondContact O-N 3.03Å
149G95.6Very high95.4Very high71 Ų7162 Ų6273%0.73232%0.318SS*.THydrogen-bonded Turntrans67.916.1-176.400000114.3L145 R146 Q147L145-G149 PolarHBondContact O-N 3.02Å; R146-G149 PolarHBondContact O-N 3.06Å; Q147-G149 VanDerWaalsContact C-N 3.31Å
150R94.7Very high95.5Very high140 Ų14059.9 Ų59.953%0.52831%0.307SS..  trans-106.210.4-174.8-67.2179.365.6-167.4-0.8113.6L145 L148 E152 S153L145-R150 HydrophobicContact CD2-CB 3.96Å; L145-R150 CarbonylContact O-C 3.55Å; L145-R150 PolarHBondContact O-N 3.38Å; L148-R150 HydrophobicContact CB-CG 4.35Å; L148-R150 PolarHBondContact O-N 3.03Å; R150-E152 PolarHBondContact O-N 3.07Å; R150-S153 VanDerWaalsContact O-CB 3.29Å; R150-S153 WeakPolarHBondContact O-CB 3.12Å; R150-S153 PolarHBondContact O-N 3.44Å; R150-S153 PolarHBondContact O-OG 3.06Å
151Y93.7Very high95.4Very high27 Ų2764 Ų6411%0.10633%0.332CS..THydrogen-bonded Turntrans-67.3-34-176.5174.5-102.8000113.8R142 L145 R146 S153 G156 D160R142-Y151 HydrophobicContact CG-CD2 4.19Å; R142-Y151 HydrophobicContact CG-CE2 3.83Å; L145-Y151 PolarHBondContact O-N 3.09Å; L145-Y151 VanDerWaalsContact O-N 3.16Å; R146-Y151 HydrophobicContact CG-CD1 4.28Å; R146-Y151 HydrophobicContact CG-CD2 3.7Å; R146-Y151 HydrophobicContact CG-CE2 4.43Å; R146-Y151 HydrophobicContact CG-CG 3.6Å; R146-Y151 PolarHBondContact NH2-OH 3.39Å; Y151-S153 PolarHBondContact O-N 3.05Å; Y151-G156 WeakPolarHBondContact O-CA 3.27Å; Y151-D160 PolarHBondContact OH-OD2 3.49Å; Y151-D160 VanDerWaalsContact OH-OD2 3.11Å
152E91.8Very high95.4Very high150 Ų15065.7 Ų65.770%0.70134%0.339SS*.THydrogen-bonded Turntrans-78.78.4177.4-58.8-57.914500113.3R150R150-E152 PolarHBondContact O-N 3.07Å
153S93.6Very high95.4Very high37 Ų3764.4 Ų64.426%0.25934%0.335SS..SBendtrans-82.6165.1175.571.40000112.3R150 Y151 T155 G156 E157R150-S153 VanDerWaalsContact O-CB 3.29Å; R150-S153 WeakPolarHBondContact O-CB 3.12Å; R150-S153 PolarHBondContact O-N 3.44Å; R150-S153 PolarHBondContact O-OG 3.06Å; Y151-S153 PolarHBondContact O-N 3.05Å; S153-T155 PolarHBondContact O-N 3.34Å; S153-T155 VanDerWaalsContact O-N 3.12Å; S153-T155 PolarHBondContact OG-N 3.02Å; S153-G156 PolarHBondContact O-N 3.01Å; S153-E157 PolarHBondContact O-N 2.99Å
154L93.6Very high95.4Very high132 Ų13264.4 Ų64.469%0.69134%0.339SS*.Hα-helixtrans-50.5-37.3171.518062.7000112.1G156 E157 V158L154-G156 PolarHBondContact O-N 3.23Å; L154-E157 PolarHBondContact O-N 3.42Å; L154-V158 HydrophobicContact CD1-CG2 4.36Å; L154-V158 HydrophobicContact CG-CG2 4.42Å; L154-V158 WeakPolarHBondContact O-CG2 3.5Å; L154-V158 PolarHBondContact O-N 3.31Å
155T94.3Very high95.4Very high66 Ų6667.8 Ų67.841%0.40536%0.361SS..Hα-helixtrans-61.2-43.5176.8-50.90000111.8L145 S153 E157 V158 V159L145-T155 HydrophobicContact CD1-CG2 4.06Å; L145-T155 HydrophobicContact CD2-CG2 4.34Å; S153-T155 PolarHBondContact O-N 3.34Å; S153-T155 VanDerWaalsContact O-N 3.12Å; S153-T155 PolarHBondContact OG-N 3.02Å; T155-E157 VanDerWaalsContact C-N 3.3Å; T155-E157 PolarHBondContact O-N 3.46Å; T155-V158 PolarHBondContact O-N 3.48Å; T155-V159 WeakPolarHBondContact O-CB 3.35Å; T155-V159 VanDerWaalsContact O-CG2 3.25Å; T155-V159 WeakPolarHBondContact O-CG2 3.18Å; T155-V159 PolarHBondContact O-N 3.2Å
156G95.2Very high95.4Very high1 Ų169.3 Ų69.31%0.0137%0.369CS..Hα-helixtrans-65.4-34.717700000112.6Y151 S153 L154 D160Y151-G156 WeakPolarHBondContact O-CA 3.27Å; S153-G156 PolarHBondContact O-N 3.01Å; L154-G156 PolarHBondContact O-N 3.23Å; G156-D160 PolarHBondContact O-N 3.45Å; G156-D160 VanDerWaalsContact O-N 3.1Å
157E94.1Very high95.5Very high66 Ų6663.8 Ų63.831%0.30835%0.348SS..Hα-helixtrans-66.3-47.1173.7-57.4-161.5165.200112.8S153 L154 T155 V159 D160 V161 K221S153-E157 PolarHBondContact O-N 2.99Å; L154-E157 PolarHBondContact O-N 3.42Å; T155-E157 VanDerWaalsContact C-N 3.3Å; T155-E157 PolarHBondContact O-N 3.46Å; E157-V159 VanDerWaalsContact C-N 3.31Å; E157-V159 PolarHBondContact O-N 2.85Å; E157-D160 PolarHBondContact O-N 3.3Å; E157-V161 WeakPolarHBondContact O-CG2 3.48Å; E157-V161 PolarHBondContact O-N 3.33Å; E157-K221 WeakPolarHBondContact OE1-CE 3.24Å; E157-K221 IonicContact OE1-NZ 2.9Å; E157-K221 PolarHBondContact OE1-NZ 2.73Å; E157-K221 IonicContact OE2-NZ 3.92Å; E157-K221 PolarHBondContact OE2-NZ 3.49Å
158V96.4Very high95.6Very high69 Ų6961.3 Ų61.342%0.41834%0.34SS..Hα-helixtrans-59.3-44.6176.8169.70000110.4L154 T155 D160 V161 L162L154-V158 HydrophobicContact CD1-CG2 4.36Å; L154-V158 HydrophobicContact CG-CG2 4.42Å; L154-V158 WeakPolarHBondContact O-CG2 3.5Å; L154-V158 PolarHBondContact O-N 3.31Å; T155-V158 PolarHBondContact O-N 3.48Å; V158-D160 PolarHBondContact O-N 3.09Å; V158-V161 PolarHBondContact O-N 2.86Å; V158-L162 HydrophobicContact CG1-CD1 3.65Å; V158-L162 HydrophobicContact CG1-CG 4.11Å; V158-L162 WeakPolarHBondContact O-CB 3.34Å; V158-L162 VanDerWaalsContact O-CG 3.25Å; V158-L162 WeakPolarHBondContact O-CG 3.47Å; V158-L162 PolarHBondContact O-N 2.71Å
159V97.2Very high95.8Very high10 Ų1063 Ų636%0.06134%0.344CS..Hα-helixtrans-60.5-45.5178.1168.40000111.7L138 T141 R142 L145 T155 E157 F163L138-V159 HydrophobicContact CB-CG1 4.41Å; L138-V159 VanDerWaalsContact O-CG1 3.32Å; L138-V159 WeakPolarHBondContact O-CG1 3.42Å; T141-V159 HydrophobicContact CG2-CG2 3.84Å; R142-V159 HydrophobicContact CB-CG1 3.88Å; L145-V159 HydrophobicContact CD1-CG2 4.1Å; T155-V159 WeakPolarHBondContact O-CB 3.35Å; T155-V159 VanDerWaalsContact O-CG2 3.25Å; T155-V159 WeakPolarHBondContact O-CG2 3.18Å; T155-V159 PolarHBondContact O-N 3.2Å; E157-V159 VanDerWaalsContact C-N 3.31Å; E157-V159 PolarHBondContact O-N 2.85Å; V159-F163 VanDerWaalsContact O-CB 3.25Å; V159-F163 WeakPolarHBondContact O-CB 3.5Å; V159-F163 PolarHBondContact O-N 3.09Å
160D95.7Very high95.9Very high7 Ų760.2 Ų60.24%0.03731%0.313CS..Hα-helixtrans-63.1-43.3178-81.3-18.8000111.7R142 Y151 G156 E157 V158 F163 V164 F213 K217R142-D160 VanDerWaalsContact CD-OD1 3.26Å; R142-D160 WeakPolarHBondContact CD-OD1 3.44Å; R142-D160 IonicContact CZ-OD1 2.73Å; R142-D160 IonicContact NE-OD1 2.8Å; R142-D160 PolarHBondContact NE-OD1 3.18Å; R142-D160 IonicContact NH2-OD1 3.2Å; Y151-D160 PolarHBondContact OH-OD2 3.49Å; Y151-D160 VanDerWaalsContact OH-OD2 3.11Å; G156-D160 PolarHBondContact O-N 3.45Å; G156-D160 VanDerWaalsContact O-N 3.1Å; E157-D160 PolarHBondContact O-N 3.3Å; V158-D160 PolarHBondContact O-N 3.09Å; D160-F163 PolarHBondContact O-N 2.97Å; D160-V164 VanDerWaalsContact O-CG2 3.3Å; D160-V164 WeakPolarHBondContact O-CG2 3.33Å; D160-V164 PolarHBondContact O-N 3.4Å; D160-F213 HydrophobicContact CB-CE1 4.49Å; D160-F213 WeakPolarHBondContact OD2-CZ 3.38Å; D160-K217 IonicContact OD2-NZ 2.68Å; D160-K217 PolarHBondContact OD2-NZ 2.85Å
161V96.1Very high96Very high94 Ų9454.6 Ų54.657%0.5729%0.292SS*.Hα-helixtrans-65.3-48.2178.7172.10000110.9E157 V158 F163 V164 V165E157-V161 WeakPolarHBondContact O-CG2 3.48Å; E157-V161 PolarHBondContact O-N 3.33Å; V158-V161 PolarHBondContact O-N 2.86Å; V161-F163 VanDerWaalsContact C-N 3.28Å; V161-F163 PolarHBondContact O-N 2.88Å; V161-V164 PolarHBondContact O-N 2.9Å; V161-V165 HydrophobicContact CG1-CG2 4.32Å; V161-V165 WeakPolarHBondContact O-CG2 3.39Å; V161-V165 PolarHBondContact O-N 3.22Å
162L97.3Very high96.2Very high87 Ų8754.2 Ų54.246%0.45529%0.291SS..Hα-helixtrans-59.2-42.3177.2-72.9176.6000111.2L138 V158 V165 L166L138-L162 HydrophobicContact CD1-CB 3.88Å; L138-L162 HydrophobicContact CD2-CB 4.26Å; L138-L162 HydrophobicContact CD2-CD1 4.45Å; V158-L162 HydrophobicContact CG1-CD1 3.65Å; V158-L162 HydrophobicContact CG1-CG 4.11Å; V158-L162 WeakPolarHBondContact O-CB 3.34Å; V158-L162 VanDerWaalsContact O-CG 3.25Å; V158-L162 WeakPolarHBondContact O-CG 3.47Å; V158-L162 PolarHBondContact O-N 2.71Å; L162-V165 PolarHBondContact O-N 3.47Å; L162-L166 WeakPolarHBondContact O-CB 3.42Å; L162-L166 PolarHBondContact O-N 3.29Å
163F97.1Very high96.5Very high15 Ų1551.2 Ų51.27%0.06628%0.283CS..Hα-helixtrans-60.2-48.3177.8171.3-102.1000111.2L138 L139 V159 D160 V161 F167 I210L138-F163 HydrophobicContact CB-CB 4.1Å; L138-F163 HydrophobicContact CB-CD2 4.37Å; L138-F163 HydrophobicContact CD1-CB 4.29Å; L139-F163 HydrophobicContact CD1-CE2 3.68Å; L139-F163 HydrophobicContact CD1-CZ 4.14Å; L139-F163 HydrophobicContact CD2-CD1 4.42Å; L139-F163 HydrophobicContact CD2-CD2 3.81Å; L139-F163 HydrophobicContact CD2-CE1 4.04Å; L139-F163 HydrophobicContact CD2-CE2 3.39Å; L139-F163 HydrophobicContact CD2-CG 4.31Å; L139-F163 HydrophobicContact CD2-CZ 3.52Å; L139-F163 HydrophobicContact CG-CD2 3.75Å; L139-F163 HydrophobicContact CG-CE2 3.33Å; L139-F163 HydrophobicContact CG-CZ 3.96Å; V159-F163 VanDerWaalsContact O-CB 3.25Å; V159-F163 WeakPolarHBondContact O-CB 3.5Å; V159-F163 PolarHBondContact O-N 3.09Å; D160-F163 PolarHBondContact O-N 2.97Å; V161-F163 VanDerWaalsContact C-N 3.28Å; V161-F163 PolarHBondContact O-N 2.88Å; F163-F167 HydrophobicContact CE2-CD2 4.29Å; F163-F167 HydrophobicContact CZ-CD2 4.01Å; F163-F167 WeakPolarHBondContact O-CB 3.24Å; F163-F167 PolarHBondContact O-N 3.16Å; F163-I210 HydrophobicContact CE1-CD1 3.64Å; F163-I210 HydrophobicContact CE1-CG1 3.94Å; F163-I210 HydrophobicContact CZ-CD1 3.83Å; F163-I210 HydrophobicContact CZ-CG1 4.47Å
164V97.1Very high96.7Very high38 Ų3851 Ų5123%0.2328%0.28CS..Hα-helixtrans-62.1-50.2179.4173.90000111.2D160 V161 L166 F167 V168 I210D160-V164 VanDerWaalsContact O-CG2 3.3Å; D160-V164 WeakPolarHBondContact O-CG2 3.33Å; D160-V164 PolarHBondContact O-N 3.4Å; V161-V164 PolarHBondContact O-N 2.9Å; V164-L166 PolarHBondContact O-N 2.97Å; V164-F167 PolarHBondContact O-N 3Å; V164-V168 HydrophobicContact CG1-CG2 4.38Å; V164-V168 VanDerWaalsContact O-CG2 3.22Å; V164-V168 WeakPolarHBondContact O-CG2 3.23Å; V164-V168 PolarHBondContact O-N 3.17Å; V164-I210 HydrophobicContact CG1-CG2 4.35Å; V164-I210 HydrophobicContact CG2-CG2 3.75Å
165V97.3Very high96.8Very high92 Ų9245.4 Ų45.456%0.55825%0.254SS*.Hα-helixtrans-60.2-48.3-178.7170.50000110.6V161 L162 F167 V168 F169V161-V165 HydrophobicContact CG1-CG2 4.32Å; V161-V165 WeakPolarHBondContact O-CG2 3.39Å; V161-V165 PolarHBondContact O-N 3.22Å; L162-V165 PolarHBondContact O-N 3.47Å; V165-F167 PolarHBondContact O-N 3.26Å; V165-V168 PolarHBondContact O-N 2.87Å; V165-F169 WeakPolarHBondContact O-CB 3.48Å; V165-F169 PolarHBondContact O-N 3.47Å
166L97.2Very high97Very high44 Ų4443.1 Ų43.123%0.2324%0.244CC..Hα-helixtrans-66.4-38.8-178.9-170.663.1000111.5I134 T135 L138 L162 V164 F169 M170I134-L166 HydrophobicContact CD1-CD1 4.35Å; I134-L166 HydrophobicContact CG1-CD2 4.25Å; I134-L166 HydrophobicContact CG2-CD2 4.4Å; I134-L166 HydrophobicContact CG2-CG 4.35Å; I134-L166 WeakPolarHBondContact O-CD2 3.48Å; T135-L166 HydrophobicContact CG2-CB 4.27Å; T135-L166 HydrophobicContact CG2-CD2 4.17Å; T135-L166 HydrophobicContact CG2-CG 3.94Å; L138-L166 HydrophobicContact CD1-CD2 3.86Å; L162-L166 WeakPolarHBondContact O-CB 3.42Å; L162-L166 PolarHBondContact O-N 3.29Å; V164-L166 PolarHBondContact O-N 2.97Å; L166-F169 PolarHBondContact O-N 2.79Å; L166-M170 HydrophobicContact CD1-CG 3.71Å; L166-M170 HydrophobicContact CG-CG 4.24Å; L166-M170 VanDerWaalsContact O-CB 3.26Å; L166-M170 WeakPolarHBondContact O-CB 3.47Å; L166-M170 WeakPolarHBondContact O-CG 3.15Å; L166-M170 PolarHBondContact O-N 2.83Å
167F97.8Very high97.1Very high5 Ų550 Ų502%0.02227%0.269CS..Hα-helixtrans-62.5-49.2176-172.4-78.9000111.7T135 F163 V164 V165 F169 R171 I172 F206 M207 I210T135-F167 HydrophobicContact CG2-CB 4.15Å; T135-F167 HydrophobicContact CG2-CD2 4.41Å; F163-F167 HydrophobicContact CE2-CD2 4.29Å; F163-F167 HydrophobicContact CZ-CD2 4.01Å; F163-F167 WeakPolarHBondContact O-CB 3.24Å; F163-F167 PolarHBondContact O-N 3.16Å; V164-F167 PolarHBondContact O-N 3Å; V165-F167 PolarHBondContact O-N 3.26Å; F167-F169 PolarHBondContact O-N 3.46Å; F167-R171 HydrophobicContact CD1-CB 4.41Å; F167-R171 HydrophobicContact CD2-CG 4.19Å; F167-R171 HydrophobicContact CE1-CB 4.19Å; F167-R171 HydrophobicContact CE2-CG 4.1Å; F167-R171 HydrophobicContact CG-CG 4.48Å; F167-R171 HydrophobicContact CZ-CB 4.21Å; F167-R171 HydrophobicContact CZ-CG 4.29Å; F167-R171 VanDerWaalsContact O-CB 3.3Å; F167-R171 WeakPolarHBondContact O-CB 3.39Å; F167-R171 PolarHBondContact O-N 3.32Å; F167-I172 HydrophobicContact CE1-CD1 4.5Å; F167-F206 HydrophobicContact CE1-CB 4.32Å; F167-F206 HydrophobicContact CE2-CB 4.07Å; F167-F206 HydrophobicContact CZ-CB 3.48Å; F167-F206 VanDerWaalsContact CZ-CB 3.48Å; F167-F206 HydrophobicContact CZ-CG 4.38Å; F167-M207 HydrophobicContact CD1-CE 3.77Å; F167-M207 HydrophobicContact CE1-CB 4.31Å; F167-M207 HydrophobicContact CE1-CE 4.04Å; F167-I210 HydrophobicContact CB-CD1 4.3Å; F167-I210 HydrophobicContact CD1-CD1 3.6Å; F167-I210 HydrophobicContact CD2-CD1 3.69Å; F167-I210 HydrophobicContact CE1-CD1 3.8Å; F167-I210 HydrophobicContact CE2-CD1 3.86Å; F167-I210 HydrophobicContact CG-CD1 3.57Å; F167-I210 HydrophobicContact CZ-CD1 3.94Å
168V97.9Very high97.2Very high56 Ų5647.7 Ų47.734%0.33926%0.259SS..Iπ-helixtrans-57.9-51177.1175.60000109.9V164 V165 I172 V173 M207V164-V168 HydrophobicContact CG1-CG2 4.38Å; V164-V168 VanDerWaalsContact O-CG2 3.22Å; V164-V168 WeakPolarHBondContact O-CG2 3.23Å; V164-V168 PolarHBondContact O-N 3.17Å; V165-V168 PolarHBondContact O-N 2.87Å; V168-I172 WeakPolarHBondContact O-CA 3.41Å; V168-I172 VanDerWaalsContact O-CB 3.28Å; V168-I172 WeakPolarHBondContact O-CB 3.27Å; V168-I172 PolarHBondContact O-N 3.44Å; V168-I172 VanDerWaalsContact O-N 3.13Å; V168-V173 PolarHBondContact O-N 3.4Å; V168-V173 VanDerWaalsContact O-N 3.1Å; V168-M207 HydrophobicContact CB-CE 3.99Å; V168-M207 HydrophobicContact CG1-CE 4.39Å; V168-M207 HydrophobicContact CG2-CE 3.34Å; V168-M207 HydrophobicContact CG2-SD 4.15Å
169F98.2Very high97.2Very high115 Ų11545.2 Ų45.250%0.50424%0.243SC..Iπ-helixtrans-64.4-52.9-175.8-177.2-108.3000111.9V165 L166 F167 V173 V174V165-F169 WeakPolarHBondContact O-CB 3.48Å; V165-F169 PolarHBondContact O-N 3.47Å; L166-F169 PolarHBondContact O-N 2.79Å; F167-F169 PolarHBondContact O-N 3.46Å; F169-V173 WeakPolarHBondContact O-CB 3.44Å; F169-V173 PolarHBondContact O-N 2.77Å; F169-V174 HydrophobicContact CD1-CG2 4.3Å; F169-V174 HydrophobicContact CE1-CG2 3.97Å; F169-V174 HydrophobicContact CE2-CG2 4.44Å; F169-V174 HydrophobicContact CZ-CG2 4.05Å; F169-V174 WeakPolarHBondContact O-CG2 3.38Å; F169-V174 PolarHBondContact O-N 3.07Å
170M97.4Very high97.3Very high13 Ų1351.8 Ų51.86%0.06427%0.268CS..Iπ-helixtrans-77-44.1-173.2-68.4-59.7-53.200113.1F130 A131 I134 L166 V174 G175F130-M170 HydrophobicContact CD1-CE 3.7Å; F130-M170 HydrophobicContact CE1-CE 3.44Å; F130-M170 VanDerWaalsContact CE1-CE 3.44Å; A131-M170 HydrophobicContact CB-CE 4.14Å; I134-M170 HydrophobicContact CD1-CG 4.47Å; I134-M170 HydrophobicContact CG2-CB 3.99Å; I134-M170 HydrophobicContact CG2-CE 4.38Å; I134-M170 HydrophobicContact CG2-CG 3.73Å; L166-M170 HydrophobicContact CD1-CG 3.71Å; L166-M170 HydrophobicContact CG-CG 4.24Å; L166-M170 VanDerWaalsContact O-CB 3.26Å; L166-M170 WeakPolarHBondContact O-CB 3.47Å; L166-M170 WeakPolarHBondContact O-CG 3.15Å; L166-M170 PolarHBondContact O-N 2.83Å; M170-V174 HydrophobicContact CE-CG1 4.26Å; M170-V174 WeakPolarHBondContact O-CB 3.42Å; M170-V174 HydrophobicContact SD-CG2 4.25Å; M170-G175 PolarHBondContact O-N 2.93Å
171R96.9Very high97.3Very high23 Ų2352.3 Ų52.39%0.08727%0.272CS..Iπ-helixtrans-87.9-33.5-173.6-60.1-138.4-170.4-171.42.4113.5H104 S132 F167H104-R171 PolarHBondContact CE1-NH1 3.26Å; S132-R171 VanDerWaalsContact C-NH2 3.34Å; S132-R171 VanDerWaalsContact CA-CZ 3.43Å; S132-R171 VanDerWaalsContact CA-NH2 3.27Å; S132-R171 PolarHBondContact O-NH2 2.89Å; F167-R171 HydrophobicContact CD1-CB 4.41Å; F167-R171 HydrophobicContact CD2-CG 4.19Å; F167-R171 HydrophobicContact CE1-CB 4.19Å; F167-R171 HydrophobicContact CE2-CG 4.1Å; F167-R171 HydrophobicContact CG-CG 4.48Å; F167-R171 HydrophobicContact CZ-CB 4.21Å; F167-R171 HydrophobicContact CZ-CG 4.29Å; F167-R171 VanDerWaalsContact O-CB 3.3Å; F167-R171 WeakPolarHBondContact O-CB 3.39Å; F167-R171 PolarHBondContact O-N 3.32Å
172I97.8Very high97.4Very high18 Ų1848.4 Ų48.49%0.09225%0.247CC..Iπ-helixtrans-94.9-56.4-178.6-52.3-52.6000111.3F167 V168 G176 Y200 W204 M207F167-I172 HydrophobicContact CE1-CD1 4.5Å; V168-I172 WeakPolarHBondContact O-CA 3.41Å; V168-I172 VanDerWaalsContact O-CB 3.28Å; V168-I172 WeakPolarHBondContact O-CB 3.27Å; V168-I172 PolarHBondContact O-N 3.44Å; V168-I172 VanDerWaalsContact O-N 3.13Å; I172-G176 WeakPolarHBondContact O-CA 3.45Å; I172-G176 PolarHBondContact O-N 3.18Å; I172-Y200 PolarHBondContact O-OH 3.46Å; I172-W204 HydrophobicContact CD1-CD2 4.24Å; I172-W204 HydrophobicContact CD1-CG 4.43Å; I172-W204 HydrophobicContact CG2-CH2 3.92Å; I172-W204 HydrophobicContact CG2-CZ2 3.49Å; I172-W204 VanDerWaalsContact CG2-CZ2 3.49Å; I172-M207 HydrophobicContact CD1-CB 4.41Å; I172-M207 HydrophobicContact CD1-CE 4.18Å; I172-M207 HydrophobicContact CG1-CE 3.36Å
173V98Very high97.4Very high88 Ų8847.8 Ų47.853%0.53324%0.244SC..Iπ-helixtrans-73.4-59.2-174.4-177.80000111.2V168 F169 G176 R177V168-V173 PolarHBondContact O-N 3.4Å; V168-V173 VanDerWaalsContact O-N 3.1Å; F169-V173 WeakPolarHBondContact O-CB 3.44Å; F169-V173 PolarHBondContact O-N 2.77Å; V173-G176 PolarHBondContact O-N 3.33Å; V173-R177 PolarHBondContact O-N 3.41Å; V173-R177 VanDerWaalsContact O-N 3.08Å
174V97.4Very high97.4Very high31 Ų3152 Ų5219%0.18827%0.266CS..Iπ-helixtrans-66.2-47.4-179.7175.20000110.1F62 F169 M170 G176 R177 M178F62-V174 HydrophobicContact CZ-CG1 3.95Å; F169-V174 HydrophobicContact CD1-CG2 4.3Å; F169-V174 HydrophobicContact CE1-CG2 3.97Å; F169-V174 HydrophobicContact CE2-CG2 4.44Å; F169-V174 HydrophobicContact CZ-CG2 4.05Å; F169-V174 WeakPolarHBondContact O-CG2 3.38Å; F169-V174 PolarHBondContact O-N 3.07Å; M170-V174 HydrophobicContact CE-CG1 4.26Å; M170-V174 WeakPolarHBondContact O-CB 3.42Å; M170-V174 HydrophobicContact SD-CG2 4.25Å; V174-G176 PolarHBondContact O-N 2.94Å; V174-R177 PolarHBondContact O-N 2.88Å; V174-M178 WeakPolarHBondContact O-CG 3.32Å; V174-M178 PolarHBondContact O-N 3.21Å
175G96.9Very high97.3Very high16 Ų1650.6 Ų50.617%0.16526%0.258CS..Hα-helixtrans-58-42.3175.700000113.7M170 M178 L179M170-G175 PolarHBondContact O-N 2.93Å; G175-M178 WeakPolarHBondContact O-CB 3.29Å; G175-M178 PolarHBondContact O-N 3.28Å; G175-L179 WeakPolarHBondContact O-CB 3.5Å; G175-L179 PolarHBondContact O-N 3.49Å
176G97.3Very high97.2Very high17 Ų1752 Ų5218%0.17527%0.269CS..Hα-helixtrans-65.6-41.4176.900000112.7I172 V173 V174 M178 L179 Y180I172-G176 WeakPolarHBondContact O-CA 3.45Å; I172-G176 PolarHBondContact O-N 3.18Å; V173-G176 PolarHBondContact O-N 3.33Å; V174-G176 PolarHBondContact O-N 2.94Å; G176-M178 VanDerWaalsContact C-N 3.34Å; G176-L179 PolarHBondContact O-N 3.16Å; G176-Y180 WeakPolarHBondContact O-CB 3.13Å; G176-Y180 PolarHBondContact O-N 3.09Å
177R97.7Very high97Very high146 Ų14656.3 Ų56.355%0.55128%0.283SS*.Hα-helixtrans-64.4-40.1174.4-174.8-179.6-175.9-109.73.1111.7F62 V173 V174 Y180 C181F62-R177 HydrophobicContact CD1-CG 3.92Å; F62-R177 HydrophobicContact CE1-CB 3.97Å; F62-R177 HydrophobicContact CE1-CG 3.73Å; V173-R177 PolarHBondContact O-N 3.41Å; V173-R177 VanDerWaalsContact O-N 3.08Å; V174-R177 PolarHBondContact O-N 2.88Å; R177-Y180 PolarHBondContact O-N 3.04Å; R177-C181 PolarHBondContact O-N 3.4Å; R177-C181 VanDerWaalsContact O-N 3.09Å; R177-C181 PolarHBondContact O-SG 3.05Å; R177-C181 VanDerWaalsContact O-SG 3.34Å
178M96.3Very high96.9Very high18 Ų1856.4 Ų56.49%0.08928%0.283CS..Hα-helixtrans-62.5-48.9175.6-81.3-158.357.500112.1P61 F62 A127 V174 G175 G176 Y180 C181 E182P61-M178 HydrophobicContact CB-CE 3.53Å; P61-M178 HydrophobicContact CB-SD 4.29Å; P61-M178 HydrophobicContact CG-CE 4.38Å; F62-M178 HydrophobicContact CD1-CG 3.89Å; F62-M178 HydrophobicContact CE1-CB 4.18Å; F62-M178 HydrophobicContact CE1-CG 3.24Å; F62-M178 HydrophobicContact CE2-CG 4Å; F62-M178 HydrophobicContact CE2-SD 4.39Å; F62-M178 HydrophobicContact CZ-CG 3.31Å; F62-M178 HydrophobicContact CZ-SD 4.13Å; A127-M178 HydrophobicContact CB-CE 3.3Å; A127-M178 HydrophobicContact CB-SD 3.59Å; A127-M178 VanDerWaalsContact CB-SD 3.59Å; V174-M178 WeakPolarHBondContact O-CG 3.32Å; V174-M178 PolarHBondContact O-N 3.21Å; G175-M178 WeakPolarHBondContact O-CB 3.29Å; G175-M178 PolarHBondContact O-N 3.28Å; G176-M178 VanDerWaalsContact C-N 3.34Å; M178-Y180 VanDerWaalsContact C-N 3.27Å; M178-Y180 PolarHBondContact O-N 3.33Å; M178-C181 WeakPolarHBondContact O-CB 3.33Å; M178-C181 PolarHBondContact O-N 3.2Å; M178-C181 VanDerWaalsContact O-N 3.13Å; M178-E182 PolarHBondContact O-N 2.95Å
179L97.6Very high96.8Very high17 Ų1759.5 Ų59.59%0.08929%0.289CS..Hα-helixtrans-59-41.1176.8178.562.4000111.1G175 G176 C181 E182 L183 V197 Y200G175-L179 WeakPolarHBondContact O-CB 3.5Å; G175-L179 PolarHBondContact O-N 3.49Å; G176-L179 PolarHBondContact O-N 3.16Å; L179-C181 PolarHBondContact O-N 2.82Å; L179-E182 PolarHBondContact O-N 3.28Å; L179-L183 HydrophobicContact CD1-CD1 4.11Å; L179-L183 HydrophobicContact CD1-CD2 4.36Å; L179-L183 HydrophobicContact CD1-CG 3.94Å; L179-L183 HydrophobicContact CD2-CD1 4.44Å; L179-L183 HydrophobicContact CG-CD1 3.88Å; L179-L183 HydrophobicContact CG-CG 4.16Å; L179-L183 WeakPolarHBondContact O-CB 3.47Å; L179-L183 VanDerWaalsContact O-CG 3.23Å; L179-L183 WeakPolarHBondContact O-CG 3.38Å; L179-L183 PolarHBondContact O-N 3.39Å; L179-V197 HydrophobicContact CD1-CG2 4.1Å; L179-V197 HydrophobicContact CD2-CG2 4.33Å; L179-Y200 HydrophobicContact CD2-CD1 3.58Å; L179-Y200 HydrophobicContact CD2-CE1 4.39Å; L179-Y200 HydrophobicContact CD2-CG 3.7Å
180Y97.9Very high96.7Very high147 Ų14760.4 Ų60.458%0.57630%0.298SS*.Hα-helixtrans-57.5-49.2174.7173.9-101.4000111.9G176 R177 M178 E182 L183 I184G176-Y180 WeakPolarHBondContact O-CB 3.13Å; G176-Y180 PolarHBondContact O-N 3.09Å; R177-Y180 PolarHBondContact O-N 3.04Å; M178-Y180 VanDerWaalsContact C-N 3.27Å; M178-Y180 PolarHBondContact O-N 3.33Å; Y180-E182 VanDerWaalsContact C-N 3.31Å; Y180-E182 PolarHBondContact O-N 2.83Å; Y180-L183 PolarHBondContact O-N 2.91Å; Y180-I184 HydrophobicContact CD1-CD1 4.34Å; Y180-I184 HydrophobicContact CD2-CG2 4.19Å; Y180-I184 HydrophobicContact CE1-CD1 3.81Å; Y180-I184 HydrophobicContact CE1-CG2 4.38Å; Y180-I184 HydrophobicContact CE2-CG2 3.74Å; Y180-I184 WeakPolarHBondContact O-CG1 3.35Å; Y180-I184 WeakPolarHBondContact O-CG2 3.13Å; Y180-I184 PolarHBondContact O-N 3.27Å; Y180-I184 VanDerWaalsContact O-N 3.09Å
181C97.3Very high96.7Very high18 Ų1864.3 Ų64.312%0.12232%0.318CS..Hα-helixtrans-59.3-40.3176.9-69.20000112.7F62 R177 M178 L179 I184 S185F62-C181 PolarHBondContact O-SG 2.93Å; F62-C181 VanDerWaalsContact O-SG 3.36Å; R177-C181 PolarHBondContact O-N 3.4Å; R177-C181 VanDerWaalsContact O-N 3.09Å; R177-C181 PolarHBondContact O-SG 3.05Å; R177-C181 VanDerWaalsContact O-SG 3.34Å; M178-C181 WeakPolarHBondContact O-CB 3.33Å; M178-C181 PolarHBondContact O-N 3.2Å; M178-C181 VanDerWaalsContact O-N 3.13Å; L179-C181 PolarHBondContact O-N 2.82Å; C181-I184 WeakPolarHBondContact O-CG1 3.17Å; C181-S185 WeakPolarHBondContact O-CB 3.45Å; C181-S185 PolarHBondContact O-N 3.25Å
182E96.5Very high96.7Very high12 Ų1263.9 Ų63.96%0.05632%0.318CS..Hα-helixtrans-64.7-46.5176.2-173.3-172.7151.400111.7E124 M178 L179 Y180 I184 S185 P188 I192 K193E124-E182 HydrophobicContact CG-CG 4.5Å; M178-E182 PolarHBondContact O-N 2.95Å; L179-E182 PolarHBondContact O-N 3.28Å; Y180-E182 VanDerWaalsContact C-N 3.31Å; Y180-E182 PolarHBondContact O-N 2.83Å; E182-I184 PolarHBondContact O-N 3.22Å; E182-S185 PolarHBondContact O-N 3.34Å; E182-P188 HydrophobicContact CG-CB 4.24Å; E182-P188 HydrophobicContact CG-CG 4.01Å; E182-I192 WeakPolarHBondContact OE1-CG2 3.48Å; E182-K193 HydrophobicContact CG-CG 4.44Å; E182-K193 VanDerWaalsContact O-CE 3.27Å; E182-K193 WeakPolarHBondContact O-CE 3.34Å; E182-K193 VanDerWaalsContact OE1-CA 3.32Å; E182-K193 WeakPolarHBondContact OE1-CA 3.3Å; E182-K193 PolarHBondContact OE1-N 3.31Å
183L97.5Very high96.7Very high74 Ų7464.7 Ų64.739%0.38732%0.321SS..Hα-helixtrans-65.3-41.3-177-72.2177.2000112.7L179 Y180 S185 K193 V197L179-L183 HydrophobicContact CD1-CD1 4.11Å; L179-L183 HydrophobicContact CD1-CD2 4.36Å; L179-L183 HydrophobicContact CD1-CG 3.94Å; L179-L183 HydrophobicContact CD2-CD1 4.44Å; L179-L183 HydrophobicContact CG-CD1 3.88Å; L179-L183 HydrophobicContact CG-CG 4.16Å; L179-L183 WeakPolarHBondContact O-CB 3.47Å; L179-L183 VanDerWaalsContact O-CG 3.23Å; L179-L183 WeakPolarHBondContact O-CG 3.38Å; L179-L183 PolarHBondContact O-N 3.39Å; Y180-L183 PolarHBondContact O-N 2.91Å; L183-S185 VanDerWaalsContact C-N 3.32Å; L183-K193 HydrophobicContact CD2-CB 3.94Å; L183-K193 HydrophobicContact CD2-CD 4.22Å; L183-K193 HydrophobicContact CD2-CG 4.26Å; L183-K193 PolarHBondContact O-NZ 3.16Å; L183-V197 HydrophobicContact CD1-CG2 4.38Å; L183-V197 HydrophobicContact CD2-CG2 4.07Å
184I97Very high96.7Very high103 Ų10364 Ų6453%0.52832%0.319SS..Hα-helixtrans-74.9-22.2178.468.1175.9000112.9Y180 C181 E182Y180-I184 HydrophobicContact CD1-CD1 4.34Å; Y180-I184 HydrophobicContact CD2-CG2 4.19Å; Y180-I184 HydrophobicContact CE1-CD1 3.81Å; Y180-I184 HydrophobicContact CE1-CG2 4.38Å; Y180-I184 HydrophobicContact CE2-CG2 3.74Å; Y180-I184 WeakPolarHBondContact O-CG1 3.35Å; Y180-I184 WeakPolarHBondContact O-CG2 3.13Å; Y180-I184 PolarHBondContact O-N 3.27Å; Y180-I184 VanDerWaalsContact O-N 3.09Å; C181-I184 WeakPolarHBondContact O-CG1 3.17Å; E182-I184 PolarHBondContact O-N 3.22Å
185S95.3Very high96.7Very high10 Ų1064.1 Ų64.17%0.0733%0.327CS..  trans-70.6135.9-178.51800000111P65 C181 E182 L183 R187 P188 K193P65-S185 VanDerWaalsContact CG-CB 3.49Å; C181-S185 WeakPolarHBondContact O-CB 3.45Å; C181-S185 PolarHBondContact O-N 3.25Å; E182-S185 PolarHBondContact O-N 3.34Å; L183-S185 VanDerWaalsContact C-N 3.32Å; S185-R187 PolarHBondContact O-N 3.31Å; S185-R187 PolarHBondContact OG-N 3.49Å; S185-P188 WeakPolarHBondContact OG-CD 3.3Å; S185-K193 WeakPolarHBondContact O-CE 3.45Å; S185-K193 PolarHBondContact O-NZ 2.96Å
186P94.9Very high96.7Very high121 Ų12164.1 Ų64.179%0.78633%0.327SS*.SBendtrans-77.3-8.5175.232.1-35.5000113.1
187R94.6Very high96.7Very high135 Ų13566.2 Ų66.251%0.50934%0.336SS..SBendtrans-81.6-50.1-171.8-51.4-176.4-175.2108.5-1.4114.1T63 P65 S185 R189T63-R187 PolarHBondContact O-NH1 2.94Å; P65-R187 WeakPolarHBondContact O-CB 3.49Å; S185-R187 PolarHBondContact O-N 3.31Å; S185-R187 PolarHBondContact OG-N 3.49Å; R187-R189 PolarHBondContact O-N 3.27Å
188P95.1Very high96.7Very high6 Ų661.2 Ų61.24%0.03933%0.325CS..SBendtrans-64.1134.7-176.9-20.132.4000110.9P65 E124 E182 S185 I192 K193P65-P188 HydrophobicContact CB-CG 3.9Å; E124-P188 VanDerWaalsContact OE1-CG 3.29Å; E124-P188 WeakPolarHBondContact OE1-CG 3.49Å; E182-P188 HydrophobicContact CG-CB 4.24Å; E182-P188 HydrophobicContact CG-CG 4.01Å; S185-P188 WeakPolarHBondContact OG-CD 3.3Å; P188-I192 HydrophobicContact CB-CB 4.5Å; P188-I192 HydrophobicContact CB-CG2 4.26Å; P188-K193 HydrophobicContact CB-CG 4.25Å; P188-K193 WeakPolarHBondContact O-CE 3.48Å
189R95.7Very high96.8Very high121 Ų12161.6 Ų61.646%0.45733%0.327SS..  trans-60.2150.7173.6-71.2177.2-154.3-1568110.8E120 R187 I191 I192 K193E120-R189 VanDerWaalsContact CD-NE 3.33Å; E120-R189 VanDerWaalsContact OE1-CD 3.25Å; E120-R189 WeakPolarHBondContact OE1-CD 3.47Å; E120-R189 WeakPolarHBondContact OE1-CG 3.03Å; E120-R189 IonicContact OE1-CZ 3.23Å; E120-R189 IonicContact OE1-NE 3.07Å; E120-R189 PolarHBondContact OE1-NE 3.43Å; E120-R189 IonicContact OE1-NH2 3.74Å; E120-R189 IonicContact OE2-CZ 3.53Å; E120-R189 IonicContact OE2-NE 2.94Å; E120-R189 PolarHBondContact OE2-NE 3.4Å; E120-R189 IonicContact OE2-NH2 2.88Å; E120-R189 PolarHBondContact OE2-NH2 3.49Å; R187-R189 PolarHBondContact O-N 3.27Å; R189-I191 HydrophobicContact CB-CG2 4.12Å; R189-I191 PolarHBondContact O-N 3.5Å; R189-I191 VanDerWaalsContact O-N 3.12Å; R189-I192 WeakPolarHBondContact O-CB 3.28Å; R189-I192 PolarHBondContact O-N 2.86Å; R189-K193 PolarHBondContact O-N 3.31Å
190L96.6Very high96.8Very high134 Ų13463.4 Ų63.470%0.70233%0.333SS*.Hα-helixtrans-53.4-37.4178.9-177.761.7000112.7I192 K193 C194L190-I192 VanDerWaalsContact C-N 3.33Å; L190-I192 PolarHBondContact O-N 2.96Å; L190-K193 WeakPolarHBondContact O-CB 3.26Å; L190-K193 PolarHBondContact O-N 2.87Å; L190-C194 PolarHBondContact O-N 3.49Å; L190-C194 PolarHBondContact O-SG 2.74Å
191I96.8Very high96.8Very high95 Ų9560.4 Ų60.449%0.48733%0.33SS..Hα-helixtrans-64.8-35178.6-165.6169.4000113L114 L118 R189 G195L114-I191 HydrophobicContact CD1-CD1 4.11Å; L114-I191 HydrophobicContact CD1-CG2 4.32Å; L114-I191 HydrophobicContact CD2-CD1 4.17Å; L114-I191 HydrophobicContact CD2-CG1 3.85Å; L114-I191 HydrophobicContact CD2-CG2 4.14Å; L118-I191 HydrophobicContact CD1-CG2 4.23Å; R189-I191 HydrophobicContact CB-CG2 4.12Å; R189-I191 PolarHBondContact O-N 3.5Å; R189-I191 VanDerWaalsContact O-N 3.12Å; I191-G195 PolarHBondContact O-N 3.25Å; I191-G195 VanDerWaalsContact O-N 3.07Å
192I96.8Very high96.8Very high14 Ų1460.2 Ų60.27%0.07233%0.328CS..Hα-helixtrans-66.8-47.1174.6-66.7-67000109.4L114 L118 E182 P188 R189 L190 C194 G195 G196L114-I192 HydrophobicContact CD2-CD1 3.81Å; L114-I192 HydrophobicContact CG-CD1 3.91Å; L118-I192 HydrophobicContact CD1-CD1 3.91Å; L118-I192 HydrophobicContact CD1-CG1 3.91Å; E182-I192 WeakPolarHBondContact OE1-CG2 3.48Å; P188-I192 HydrophobicContact CB-CB 4.5Å; P188-I192 HydrophobicContact CB-CG2 4.26Å; R189-I192 WeakPolarHBondContact O-CB 3.28Å; R189-I192 PolarHBondContact O-N 2.86Å; L190-I192 VanDerWaalsContact C-N 3.33Å; L190-I192 PolarHBondContact O-N 2.96Å; I192-C194 VanDerWaalsContact C-N 3.34Å; I192-C194 PolarHBondContact O-N 2.89Å; I192-G195 CarbonylContact O-C 3.53Å; I192-G195 WeakPolarHBondContact O-CA 3.34Å; I192-G195 PolarHBondContact O-N 3.5Å; I192-G196 PolarHBondContact O-N 3.27Å
193K97.8Very high96.8Very high36 Ų3660.2 Ų60.216%0.15733%0.329CS..Hα-helixtrans-56.4-45.2175.5-64.7-174.8179.2-166.90112.8E182 L183 S185 P188 R189 L190 G195 G196 V197E182-K193 HydrophobicContact CG-CG 4.44Å; E182-K193 VanDerWaalsContact O-CE 3.27Å; E182-K193 WeakPolarHBondContact O-CE 3.34Å; E182-K193 VanDerWaalsContact OE1-CA 3.32Å; E182-K193 WeakPolarHBondContact OE1-CA 3.3Å; E182-K193 PolarHBondContact OE1-N 3.31Å; L183-K193 HydrophobicContact CD2-CB 3.94Å; L183-K193 HydrophobicContact CD2-CD 4.22Å; L183-K193 HydrophobicContact CD2-CG 4.26Å; L183-K193 PolarHBondContact O-NZ 3.16Å; S185-K193 WeakPolarHBondContact O-CE 3.45Å; S185-K193 PolarHBondContact O-NZ 2.96Å; P188-K193 HydrophobicContact CB-CG 4.25Å; P188-K193 WeakPolarHBondContact O-CE 3.48Å; R189-K193 PolarHBondContact O-N 3.31Å; L190-K193 WeakPolarHBondContact O-CB 3.26Å; L190-K193 PolarHBondContact O-N 2.87Å; K193-G195 VanDerWaalsContact C-N 3.29Å; K193-G195 PolarHBondContact O-N 3.09Å; K193-G196 PolarHBondContact O-N 2.87Å; K193-V197 WeakPolarHBondContact O-CG2 3.4Å; K193-V197 PolarHBondContact O-N 3.28Å
194C97.8Very high96.9Very high74 Ų7462.6 Ų62.650%0.533%0.333SS..Hα-helixtrans-60.5-41175.1-700000111.5L190 I192 A198L190-C194 PolarHBondContact O-N 3.49Å; L190-C194 PolarHBondContact O-SG 2.74Å; I192-C194 VanDerWaalsContact C-N 3.34Å; I192-C194 PolarHBondContact O-N 2.89Å; C194-A198 WeakPolarHBondContact O-CB 3.4Å; C194-A198 PolarHBondContact O-N 3.4Å
195G97.1Very high96.9Very high33 Ų3360.6 Ų60.634%0.3433%0.326SS..Hα-helixtrans-61.2-45.5173.300000112.9I191 I192 K193 A198 M199I191-G195 PolarHBondContact O-N 3.25Å; I191-G195 VanDerWaalsContact O-N 3.07Å; I192-G195 CarbonylContact O-C 3.53Å; I192-G195 WeakPolarHBondContact O-CA 3.34Å; I192-G195 PolarHBondContact O-N 3.5Å; K193-G195 VanDerWaalsContact C-N 3.29Å; K193-G195 PolarHBondContact O-N 3.09Å; G195-A198 PolarHBondContact O-N 3.27Å; G195-M199 WeakPolarHBondContact O-CG 3.16Å; G195-M199 PolarHBondContact O-N 3.42Å
196G97Very high97Very high16 Ų1661.5 Ų61.517%0.16533%0.328CS..Hα-helixtrans-59.6-47175.800000112.6I192 K193 A198 M199 Y200I192-G196 PolarHBondContact O-N 3.27Å; K193-G196 PolarHBondContact O-N 2.87Å; G196-A198 PolarHBondContact O-N 3.5Å; G196-M199 PolarHBondContact O-N 3.05Å; G196-Y200 WeakPolarHBondContact O-CB 3.34Å; G196-Y200 PolarHBondContact O-N 3.36Å
197V98.3Very high97.1Very high61 Ų6157.3 Ų57.337%0.3730%0.299SS..Hα-helixtrans-59.3-47.1174.7172.30000110.9L179 L183 K193 M199 Y200 V201L179-V197 HydrophobicContact CD1-CG2 4.1Å; L179-V197 HydrophobicContact CD2-CG2 4.33Å; L183-V197 HydrophobicContact CD1-CG2 4.38Å; L183-V197 HydrophobicContact CD2-CG2 4.07Å; K193-V197 WeakPolarHBondContact O-CG2 3.4Å; K193-V197 PolarHBondContact O-N 3.28Å; V197-M199 PolarHBondContact O-N 3.26Å; V197-Y200 PolarHBondContact O-N 3.22Å; V197-V201 HydrophobicContact CG1-CG2 4.42Å; V197-V201 WeakPolarHBondContact O-CG2 3.33Å; V197-V201 PolarHBondContact O-N 3.39Å
198A97.8Very high97.2Very high40 Ų4054.4 Ų54.433%0.33130%0.296SS..Hα-helixtrans-62.1-44.5-17900000111.6M107 C194 G195 G196 Y200 V201 L202M107-A198 HydrophobicContact CE-CB 3.3Å; C194-A198 WeakPolarHBondContact O-CB 3.4Å; C194-A198 PolarHBondContact O-N 3.4Å; G195-A198 PolarHBondContact O-N 3.27Å; G196-A198 PolarHBondContact O-N 3.5Å; A198-Y200 VanDerWaalsContact C-N 3.31Å; A198-Y200 PolarHBondContact O-N 2.97Å; A198-V201 PolarHBondContact O-N 2.92Å; A198-L202 PolarHBondContact O-N 3.28Å
199M97.1Very high97.2Very high27 Ų2757 Ų5713%0.13331%0.31CS..Hα-helixtrans-64.2-34.9176.4-77.3-64-71.200112.7M107 V128 G195 G196 V197 L202 S203M107-M199 HydrophobicContact CB-SD 3.52Å; M107-M199 VanDerWaalsContact CB-SD 3.52Å; M107-M199 HydrophobicContact CE-CG 4.05Å; M107-M199 HydrophobicContact CE-SD 3.88Å; M107-M199 HydrophobicContact SD-SD 4.48Å; V128-M199 HydrophobicContact CG1-CE 4.27Å; G195-M199 WeakPolarHBondContact O-CG 3.16Å; G195-M199 PolarHBondContact O-N 3.42Å; G196-M199 PolarHBondContact O-N 3.05Å; V197-M199 PolarHBondContact O-N 3.26Å; M199-L202 PolarHBondContact O-N 2.85Å; M199-S203 PolarHBondContact O-N 2.9Å; M199-S203 PolarHBondContact O-OG 2.83Å; M199-S203 VanDerWaalsContact O-OG 3.05Å
200Y98.1Very high97.2Very high55 Ų5552.1 Ų52.122%0.21629%0.292CS..Hα-helixtrans-70.8-41.4175.9-171-117.4000112.2I172 L179 G196 V197 A198 L202 S203 W204I172-Y200 PolarHBondContact O-OH 3.46Å; L179-Y200 HydrophobicContact CD2-CD1 3.58Å; L179-Y200 HydrophobicContact CD2-CE1 4.39Å; L179-Y200 HydrophobicContact CD2-CG 3.7Å; G196-Y200 WeakPolarHBondContact O-CB 3.34Å; G196-Y200 PolarHBondContact O-N 3.36Å; V197-Y200 PolarHBondContact O-N 3.22Å; A198-Y200 VanDerWaalsContact C-N 3.31Å; A198-Y200 PolarHBondContact O-N 2.97Å; Y200-L202 VanDerWaalsContact C-N 3.28Å; Y200-L202 PolarHBondContact O-N 3.44Å; Y200-S203 WeakPolarHBondContact O-CA 3.48Å; Y200-S203 WeakPolarHBondContact O-CB 3.19Å; Y200-S203 PolarHBondContact O-N 3.47Å; Y200-W204 AromaticContact CD1-NE1 3.97Å; Y200-W204 AromaticContact CE1-CD1 3.8Å; Y200-W204 AromaticContact CE1-NE1 3.27Å; Y200-W204 VanDerWaalsContact CE1-NE1 3.27Å; Y200-W204 AromaticContact CE2-NE1 3.95Å; Y200-W204 AromaticContact CZ-NE1 3.25Å; Y200-W204 VanDerWaalsContact CZ-NE1 3.25Å; Y200-W204 PolarHBondContact O-N 2.87Å; Y200-W204 VanDerWaalsContact O-N 3.11Å; Y200-W204 PolarHBondContact OH-NE1 3.06Å
201V98.3Very high97.2Very high84 Ų8447.6 Ų47.651%0.50928%0.278SS..Hα-helixtrans-57.3-43.9171.5168.90000110.5V197 A198 S203 W204 V205V197-V201 HydrophobicContact CG1-CG2 4.42Å; V197-V201 WeakPolarHBondContact O-CG2 3.33Å; V197-V201 PolarHBondContact O-N 3.39Å; A198-V201 PolarHBondContact O-N 2.92Å; V201-S203 VanDerWaalsContact C-N 3.27Å; V201-S203 PolarHBondContact O-N 3.01Å; V201-W204 WeakPolarHBondContact O-CB 3.33Å; V201-W204 PolarHBondContact O-N 3.12Å; V201-V205 PolarHBondContact O-N 3.47Å
202L97.2Very high97.1Very high13 Ų1349.7 Ų49.77%0.06828%0.279CS..Hα-helixtrans-62.4-34.8176.6-17262.7000112.6V100 V103 H104 M107 A198 M199 Y200 W204 V205 F206V100-L202 HydrophobicContact CG1-CD1 3.84Å; V103-L202 HydrophobicContact CG1-CD1 4.26Å; V103-L202 HydrophobicContact CG1-CD2 4.29Å; H104-L202 HydrophobicContact CB-CD2 3.6Å; M107-L202 HydrophobicContact SD-CD2 3.92Å; A198-L202 PolarHBondContact O-N 3.28Å; M199-L202 PolarHBondContact O-N 2.85Å; Y200-L202 VanDerWaalsContact C-N 3.28Å; Y200-L202 PolarHBondContact O-N 3.44Å; L202-W204 VanDerWaalsContact C-N 3.3Å; L202-W204 PolarHBondContact O-N 3.38Å; L202-V205 HydrophobicContact CD1-CB 4.49Å; L202-V205 WeakPolarHBondContact O-CB 3.27Å; L202-V205 PolarHBondContact O-N 2.97Å; L202-F206 HydrophobicContact CD1-CE2 4.41Å; L202-F206 HydrophobicContact CD2-CE2 4.3Å; L202-F206 HydrophobicContact CG-CD2 4.25Å; L202-F206 HydrophobicContact CG-CE2 3.91Å; L202-F206 VanDerWaalsContact O-CD2 3.27Å; L202-F206 WeakPolarHBondContact O-CD2 3.41Å; L202-F206 PolarHBondContact O-N 2.93Å
203S97Very high96.9Very high13 Ų1350.9 Ų50.99%0.09128%0.284CS..Hα-helixtrans-64-34.5173.7-60.30000112.4M199 Y200 V201 M207M199-S203 PolarHBondContact O-N 2.9Å; M199-S203 PolarHBondContact O-OG 2.83Å; M199-S203 VanDerWaalsContact O-OG 3.05Å; Y200-S203 WeakPolarHBondContact O-CA 3.48Å; Y200-S203 WeakPolarHBondContact O-CB 3.19Å; Y200-S203 PolarHBondContact O-N 3.47Å; V201-S203 VanDerWaalsContact C-N 3.27Å; V201-S203 PolarHBondContact O-N 3.01Å; S203-M207 PolarHBondContact O-N 3.2Å
204W98.3Very high96.7Very high123 Ų12351.2 Ų51.247%0.46629%0.293SS..Hα-helixtrans-70.2-36.4171.4-80.798.8000113.2I172 Y200 V201 L202 F206 M207 V208I172-W204 HydrophobicContact CD1-CD2 4.24Å; I172-W204 HydrophobicContact CD1-CG 4.43Å; I172-W204 HydrophobicContact CG2-CH2 3.92Å; I172-W204 HydrophobicContact CG2-CZ2 3.49Å; I172-W204 VanDerWaalsContact CG2-CZ2 3.49Å; Y200-W204 AromaticContact CD1-NE1 3.97Å; Y200-W204 AromaticContact CE1-CD1 3.8Å; Y200-W204 AromaticContact CE1-NE1 3.27Å; Y200-W204 VanDerWaalsContact CE1-NE1 3.27Å; Y200-W204 AromaticContact CE2-NE1 3.95Å; Y200-W204 AromaticContact CZ-NE1 3.25Å; Y200-W204 VanDerWaalsContact CZ-NE1 3.25Å; Y200-W204 PolarHBondContact O-N 2.87Å; Y200-W204 VanDerWaalsContact O-N 3.11Å; Y200-W204 PolarHBondContact OH-NE1 3.06Å; V201-W204 WeakPolarHBondContact O-CB 3.33Å; V201-W204 PolarHBondContact O-N 3.12Å; L202-W204 VanDerWaalsContact C-N 3.3Å; L202-W204 PolarHBondContact O-N 3.38Å; W204-F206 VanDerWaalsContact C-N 3.34Å; W204-M207 HydrophobicContact CE3-CB 4.37Å; W204-M207 HydrophobicContact CE3-CG 4.33Å; W204-M207 HydrophobicContact CZ3-CG 4.44Å; W204-M207 WeakPolarHBondContact O-CB 3.29Å; W204-M207 PolarHBondContact O-N 3.39Å; W204-M207 VanDerWaalsContact O-N 3.15Å; W204-V208 WeakPolarHBondContact O-CG2 3.47Å; W204-V208 PolarHBondContact O-N 2.73Å
205V98.1Very high96.5Very high62 Ų6254.5 Ų54.538%0.37630%0.296SS..Hα-helixtrans-59.4-47.9172.5175.30000110.2V100 V201 L202 M207 V208 D209V100-V205 HydrophobicContact CG1-CG1 3.91Å; V100-V205 HydrophobicContact CG2-CG1 4.36Å; V201-V205 PolarHBondContact O-N 3.47Å; L202-V205 HydrophobicContact CD1-CB 4.49Å; L202-V205 WeakPolarHBondContact O-CB 3.27Å; L202-V205 PolarHBondContact O-N 2.97Å; V205-M207 VanDerWaalsContact C-N 3.31Å; V205-M207 PolarHBondContact O-N 2.9Å; V205-V208 PolarHBondContact O-N 3.26Å; V205-D209 PolarHBondContact O-N 3.01Å
206F96.8Very high96.4Very high28 Ų2860.2 Ų60.212%0.12331%0.307CS..Hα-helixtrans-59.6-40.1173-76.7-57.2000112.6V100 M101 H104 F167 L202 W204 V208 D209 I210V100-F206 HydrophobicContact CB-CE1 4.29Å; V100-F206 HydrophobicContact CG1-CD1 3.97Å; V100-F206 HydrophobicContact CG1-CE1 3.54Å; V100-F206 HydrophobicContact CG1-CE2 4.31Å; V100-F206 HydrophobicContact CG1-CZ 3.74Å; M101-F206 HydrophobicContact CG-CE1 4.18Å; M101-F206 HydrophobicContact CG-CZ 4.36Å; M101-F206 HydrophobicContact SD-CE1 3.54Å; M101-F206 VanDerWaalsContact SD-CE1 3.54Å; M101-F206 HydrophobicContact SD-CZ 3.47Å; M101-F206 WeakPolarHBondContact SD-CZ 3.43Å; H104-F206 HydrophobicContact CB-CE2 3.88Å; H104-F206 HydrophobicContact CB-CZ 3.86Å; H104-F206 AromaticContact CG-CE2 3.93Å; F167-F206 HydrophobicContact CE1-CB 4.32Å; F167-F206 HydrophobicContact CE2-CB 4.07Å; F167-F206 HydrophobicContact CZ-CB 3.48Å; F167-F206 VanDerWaalsContact CZ-CB 3.48Å; F167-F206 HydrophobicContact CZ-CG 4.38Å; L202-F206 HydrophobicContact CD1-CE2 4.41Å; L202-F206 HydrophobicContact CD2-CE2 4.3Å; L202-F206 HydrophobicContact CG-CD2 4.25Å; L202-F206 HydrophobicContact CG-CE2 3.91Å; L202-F206 VanDerWaalsContact O-CD2 3.27Å; L202-F206 WeakPolarHBondContact O-CD2 3.41Å; L202-F206 PolarHBondContact O-N 2.93Å; W204-F206 VanDerWaalsContact C-N 3.34Å; F206-V208 VanDerWaalsContact C-N 3.3Å; F206-V208 PolarHBondContact O-N 3.33Å; F206-D209 PolarHBondContact O-N 2.85Å; F206-D209 VanDerWaalsContact O-N 3.16Å; F206-I210 WeakPolarHBondContact O-CB 3.35Å; F206-I210 VanDerWaalsContact O-CG1 3.24Å; F206-I210 WeakPolarHBondContact O-CG1 3.45Å; F206-I210 PolarHBondContact O-N 3.4Å
207M97.3Very high96Very high34 Ų3461.4 Ų61.417%0.16731%0.308CS..Hα-helixtrans-58.2-41.2176.3-17956.27600112.1F167 V168 I172 S203 W204 V205 D209 I210 G211F167-M207 HydrophobicContact CD1-CE 3.77Å; F167-M207 HydrophobicContact CE1-CB 4.31Å; F167-M207 HydrophobicContact CE1-CE 4.04Å; V168-M207 HydrophobicContact CB-CE 3.99Å; V168-M207 HydrophobicContact CG1-CE 4.39Å; V168-M207 HydrophobicContact CG2-CE 3.34Å; V168-M207 HydrophobicContact CG2-SD 4.15Å; I172-M207 HydrophobicContact CD1-CB 4.41Å; I172-M207 HydrophobicContact CD1-CE 4.18Å; I172-M207 HydrophobicContact CG1-CE 3.36Å; S203-M207 PolarHBondContact O-N 3.2Å; W204-M207 HydrophobicContact CE3-CB 4.37Å; W204-M207 HydrophobicContact CE3-CG 4.33Å; W204-M207 HydrophobicContact CZ3-CG 4.44Å; W204-M207 WeakPolarHBondContact O-CB 3.29Å; W204-M207 PolarHBondContact O-N 3.39Å; W204-M207 VanDerWaalsContact O-N 3.15Å; V205-M207 VanDerWaalsContact C-N 3.31Å; V205-M207 PolarHBondContact O-N 2.9Å; M207-D209 PolarHBondContact O-N 3.28Å; M207-I210 PolarHBondContact O-N 3.46Å; M207-G211 PolarHBondContact O-N 3.35Å
208V97.3Very high95.7Very high73 Ų7361.6 Ų61.644%0.44231%0.312SS..Hα-helixtrans-62-44176.4171.90000111W204 V205 F206 G211 R212W204-V208 WeakPolarHBondContact O-CG2 3.47Å; W204-V208 PolarHBondContact O-N 2.73Å; V205-V208 PolarHBondContact O-N 3.26Å; F206-V208 VanDerWaalsContact C-N 3.3Å; F206-V208 PolarHBondContact O-N 3.33Å; V208-G211 PolarHBondContact O-N 2.89Å; V208-R212 VanDerWaalsContact O-CG 3.29Å; V208-R212 WeakPolarHBondContact O-CG 3.39Å; V208-R212 PolarHBondContact O-N 3.45Å
209D95.1Very high95.4Very high62 Ų6262.8 Ų62.833%0.33231%0.311SS..Hα-helixtrans-68.1-37.4179-72.9-23.4000112.7V205 F206 M207 R212 F213V205-D209 PolarHBondContact O-N 3.01Å; F206-D209 PolarHBondContact O-N 2.85Å; F206-D209 VanDerWaalsContact O-N 3.16Å; M207-D209 PolarHBondContact O-N 3.28Å; D209-R212 PolarHBondContact O-N 3.27Å; D209-R212 IonicContact OD1-NH1 3.9Å; D209-R212 PolarHBondContact OD1-NH1 2.83Å; D209-F213 WeakPolarHBondContact O-CB 3.39Å; D209-F213 PolarHBondContact O-N 3.46Å
210I94.9Very high95.1Very high18 Ų1864 Ų649%0.09232%0.322CS..Hα-helixtrans-64.4-44.1172.8-67.8169.1000110.6F163 V164 F167 F206 M207 R212 F213 A214F163-I210 HydrophobicContact CE1-CD1 3.64Å; F163-I210 HydrophobicContact CE1-CG1 3.94Å; F163-I210 HydrophobicContact CZ-CD1 3.83Å; F163-I210 HydrophobicContact CZ-CG1 4.47Å; V164-I210 HydrophobicContact CG1-CG2 4.35Å; V164-I210 HydrophobicContact CG2-CG2 3.75Å; F167-I210 HydrophobicContact CB-CD1 4.3Å; F167-I210 HydrophobicContact CD1-CD1 3.6Å; F167-I210 HydrophobicContact CD2-CD1 3.69Å; F167-I210 HydrophobicContact CE1-CD1 3.8Å; F167-I210 HydrophobicContact CE2-CD1 3.86Å; F167-I210 HydrophobicContact CG-CD1 3.57Å; F167-I210 HydrophobicContact CZ-CD1 3.94Å; F206-I210 WeakPolarHBondContact O-CB 3.35Å; F206-I210 VanDerWaalsContact O-CG1 3.24Å; F206-I210 WeakPolarHBondContact O-CG1 3.45Å; F206-I210 PolarHBondContact O-N 3.4Å; M207-I210 PolarHBondContact O-N 3.46Å; I210-R212 PolarHBondContact O-N 2.95Å; I210-F213 WeakPolarHBondContact O-CB 3.27Å; I210-F213 PolarHBondContact O-N 2.99Å; I210-F213 VanDerWaalsContact O-N 3.17Å; I210-A214 WeakPolarHBondContact O-CB 3.32Å; I210-A214 PolarHBondContact O-N 3.48Å
211G95.6Very high94.6Very high38 Ų3865.6 Ų65.639%0.39233%0.33SS..Hα-helixtrans-61.1-44.2176.300000112.1M207 V208 F213 A214 Y215M207-G211 PolarHBondContact O-N 3.35Å; V208-G211 PolarHBondContact O-N 2.89Å; G211-F213 VanDerWaalsContact C-N 3.32Å; G211-F213 PolarHBondContact O-N 3.45Å; G211-A214 PolarHBondContact O-N 2.88Å; G211-Y215 WeakPolarHBondContact O-CB 3.46Å; G211-Y215 PolarHBondContact O-N 2.93Å
212R95.7Very high94.2Very high139 Ų13967.8 Ų67.853%0.52533%0.33SS..Hα-helixtrans-60.4-41.6173-72.4167.6175.4171.8-3.8111.8V208 D209 I210 R216V208-R212 VanDerWaalsContact O-CG 3.29Å; V208-R212 WeakPolarHBondContact O-CG 3.39Å; V208-R212 PolarHBondContact O-N 3.45Å; D209-R212 PolarHBondContact O-N 3.27Å; D209-R212 IonicContact OD1-NH1 3.9Å; D209-R212 PolarHBondContact OD1-NH1 2.83Å; I210-R212 PolarHBondContact O-N 2.95Å; R212-R216 WeakPolarHBondContact O-CB 3.35Å; R212-R216 WeakPolarHBondContact O-CG 3.47Å; R212-R216 PolarHBondContact O-N 3.44Å
213F93.2Very high94Very high40 Ų4072.3 Ų72.318%0.17535%0.346CS..Hα-helixtrans-62-50.5175.1162.9-103.8000111.9D160 D209 I210 G211 Y215 R216 K217D160-F213 HydrophobicContact CB-CE1 4.49Å; D160-F213 WeakPolarHBondContact OD2-CZ 3.38Å; D209-F213 WeakPolarHBondContact O-CB 3.39Å; D209-F213 PolarHBondContact O-N 3.46Å; I210-F213 WeakPolarHBondContact O-CB 3.27Å; I210-F213 PolarHBondContact O-N 2.99Å; I210-F213 VanDerWaalsContact O-N 3.17Å; G211-F213 VanDerWaalsContact C-N 3.32Å; G211-F213 PolarHBondContact O-N 3.45Å; F213-Y215 VanDerWaalsContact C-N 3.33Å; F213-Y215 PolarHBondContact O-N 3.5Å; F213-R216 PolarHBondContact O-N 2.75Å; F213-K217 HydrophobicContact CE2-CD 4.4Å; F213-K217 HydrophobicContact CZ-CD 3.88Å; F213-K217 WeakPolarHBondContact O-CB 3.34Å; F213-K217 PolarHBondContact O-N 2.96Å
214A93.1Very high93.7Very high42 Ų4276.7 Ų76.735%0.34737%0.368SS..Hα-helixtrans-60.8-42.3179.200000111.6I210 G211 K217 S218I210-A214 WeakPolarHBondContact O-CB 3.32Å; I210-A214 PolarHBondContact O-N 3.48Å; G211-A214 PolarHBondContact O-N 2.88Å; A214-K217 PolarHBondContact O-N 3.26Å; A214-S218 WeakPolarHBondContact O-CB 3.49Å; A214-S218 PolarHBondContact O-N 3.38Å; A214-S218 PolarHBondContact O-OG 3.05Å
215Y93.9Very high93.3Very high143 Ų14377.2 Ų77.256%0.56137%0.37SS*.Hα-helixtrans-60.7-50.5175-179.5-103.9000111.8G211 F213 K217 S218 Q219G211-Y215 WeakPolarHBondContact O-CB 3.46Å; G211-Y215 PolarHBondContact O-N 2.93Å; F213-Y215 VanDerWaalsContact C-N 3.33Å; F213-Y215 PolarHBondContact O-N 3.5Å; Y215-K217 VanDerWaalsContact C-N 3.32Å; Y215-K217 PolarHBondContact O-N 3.33Å; Y215-S218 PolarHBondContact O-N 3.01Å; Y215-S218 PolarHBondContact O-OG 2.99Å; Y215-Q219 HydrophobicContact CD1-CG 4.25Å; Y215-Q219 HydrophobicContact CD2-CG 4.32Å; Y215-Q219 HydrophobicContact CE1-CG 3.85Å; Y215-Q219 HydrophobicContact CE2-CG 3.92Å; Y215-Q219 HydrophobicContact CG-CG 4.48Å; Y215-Q219 WeakPolarHBondContact O-CB 3.49Å; Y215-Q219 WeakPolarHBondContact O-CG 3.29Å; Y215-Q219 PolarHBondContact O-N 3.14Å; Y215-Q219 PolarHBondContact OH-NE2 3.46Å
216R93.6Very high93Very high153 Ų15378.7 Ų78.758%0.57737%0.369SS*.Hα-helixtrans-59.9-41.2177.9-74.2-172.3-62.6-108.40.8112.4R212 F213 S220R212-R216 WeakPolarHBondContact O-CB 3.35Å; R212-R216 WeakPolarHBondContact O-CG 3.47Å; R212-R216 PolarHBondContact O-N 3.44Å; F213-R216 PolarHBondContact O-N 2.75Å; R216-S220 PolarHBondContact O-N 2.88Å
217K90.6Very high92.7Very high42 Ų4280.7 Ų80.718%0.18338%0.381CS..Hα-helixtrans-65.9-46.8178.8-167.6174.3-173.1-178.30111.5D160 F213 A214 Y215 Q219 S220 K221D160-K217 IonicContact OD2-NZ 2.68Å; D160-K217 PolarHBondContact OD2-NZ 2.85Å; F213-K217 HydrophobicContact CE2-CD 4.4Å; F213-K217 HydrophobicContact CZ-CD 3.88Å; F213-K217 WeakPolarHBondContact O-CB 3.34Å; F213-K217 PolarHBondContact O-N 2.96Å; A214-K217 PolarHBondContact O-N 3.26Å; Y215-K217 VanDerWaalsContact C-N 3.32Å; Y215-K217 PolarHBondContact O-N 3.33Å; K217-Q219 PolarHBondContact O-N 2.97Å; K217-S220 PolarHBondContact O-N 3.28Å; K217-K221 PolarHBondContact O-N 3.32Å
218S90.4Very high92.4Very high64 Ų6485 Ų8545%0.44840%0.401SS..Hα-helixtrans-62-42.8177.765.10000112.3A214 Y215 S220 K221 Y222A214-S218 WeakPolarHBondContact O-CB 3.49Å; A214-S218 PolarHBondContact O-N 3.38Å; A214-S218 PolarHBondContact O-OG 3.05Å; Y215-S218 PolarHBondContact O-N 3.01Å; Y215-S218 PolarHBondContact O-OG 2.99Å; S218-S220 PolarHBondContact O-N 2.94Å; S218-K221 PolarHBondContact O-N 2.99Å; S218-Y222 WeakPolarHBondContact O-CB 3.46Å; S218-Y222 PolarHBondContact O-N 2.82Å
219Q92.8Very high91.8Very high65 Ų6586.2 Ų86.230%0.30440%0.401SS..Hα-helixtrans-59.9-42.3174.3-79.5-75.3-25.700112.4Y215 K217 Y222 R223Y215-Q219 HydrophobicContact CD1-CG 4.25Å; Y215-Q219 HydrophobicContact CD2-CG 4.32Å; Y215-Q219 HydrophobicContact CE1-CG 3.85Å; Y215-Q219 HydrophobicContact CE2-CG 3.92Å; Y215-Q219 HydrophobicContact CG-CG 4.48Å; Y215-Q219 WeakPolarHBondContact O-CB 3.49Å; Y215-Q219 WeakPolarHBondContact O-CG 3.29Å; Y215-Q219 PolarHBondContact O-N 3.14Å; Y215-Q219 PolarHBondContact OH-NE2 3.46Å; K217-Q219 PolarHBondContact O-N 2.97Å; Q219-Y222 PolarHBondContact O-N 3.42Å; Q219-R223 WeakPolarHBondContact O-CG 3.43Å; Q219-R223 PolarHBondContact O-N 3.48Å
220S89.7Confident91.5Very high52 Ų5289 Ų8936%0.36441%0.41SS..Hα-helixtrans-62.9-46.9176.4-162.80000111.9R216 K217 S218 Y222 R223 L224R216-S220 PolarHBondContact O-N 2.88Å; K217-S220 PolarHBondContact O-N 3.28Å; S218-S220 PolarHBondContact O-N 2.94Å; S220-Y222 PolarHBondContact O-N 3.3Å; S220-R223 PolarHBondContact O-N 3.38Å; S220-L224 WeakPolarHBondContact O-CG 3.46Å; S220-L224 PolarHBondContact O-N 3.07Å
221K88.5Confident91.1Very high90 Ų9093.4 Ų93.439%0.39143%0.433SS..Hα-helixtrans-61.9-42.6176.5-74.3-169.1168-1610112.4E157 K217 S218 R223 L224 W225E157-K221 WeakPolarHBondContact OE1-CE 3.24Å; E157-K221 IonicContact OE1-NZ 2.9Å; E157-K221 PolarHBondContact OE1-NZ 2.73Å; E157-K221 IonicContact OE2-NZ 3.92Å; E157-K221 PolarHBondContact OE2-NZ 3.49Å; K217-K221 PolarHBondContact O-N 3.32Å; S218-K221 PolarHBondContact O-N 2.99Å; K221-R223 PolarHBondContact O-N 3.04Å; K221-L224 PolarHBondContact O-N 3.4Å; K221-W225 WeakPolarHBondContact O-CB 3.42Å; K221-W225 PolarHBondContact O-N 3.35Å
222Y90Very high90.5Very high130 Ų13094.7 Ų94.751%0.5144%0.44SS..Hα-helixtrans-62-42.7177.6177.1-108.5000112S218 Q219 S220 W225 R226S218-Y222 WeakPolarHBondContact O-CB 3.46Å; S218-Y222 PolarHBondContact O-N 2.82Å; Q219-Y222 PolarHBondContact O-N 3.42Å; S220-Y222 PolarHBondContact O-N 3.3Å; Y222-W225 HydrophobicContact CD2-CE3 4.24Å; Y222-W225 HydrophobicContact CE2-CE3 4.1Å; Y222-W225 HydrophobicContact CE2-CZ3 4.11Å; Y222-W225 PolarHBondContact O-N 3.45Å; Y222-R226 VanDerWaalsContact O-CB 3.29Å; Y222-R226 WeakPolarHBondContact O-CB 3.28Å; Y222-R226 PolarHBondContact O-N 2.98Å
223R91.9Very high89.8Confident108 Ų10890.8 Ų90.841%0.40844%0.438SS..Hα-helixtrans-61.6-47.7174.8-73.4-171-60.1-90.32.6111.9Q219 S220 K221 W225 R226 D227Q219-R223 WeakPolarHBondContact O-CG 3.43Å; Q219-R223 PolarHBondContact O-N 3.48Å; S220-R223 PolarHBondContact O-N 3.38Å; K221-R223 PolarHBondContact O-N 3.04Å; R223-W225 PolarHBondContact O-N 2.9Å; R223-R226 PolarHBondContact O-N 3.41Å; R223-D227 WeakPolarHBondContact O-CB 3.46Å; R223-D227 PolarHBondContact O-N 3.01Å
224L90.3Very high89.1Confident104 Ų10493.3 Ų93.355%0.54546%0.457SS..Hα-helixtrans-57.5-48.2177-75163.3000111.8S220 K221 R226 D227 Q228S220-L224 WeakPolarHBondContact O-CG 3.46Å; S220-L224 PolarHBondContact O-N 3.07Å; K221-L224 PolarHBondContact O-N 3.4Å; L224-R226 PolarHBondContact O-N 3.43Å; L224-D227 PolarHBondContact O-N 3Å; L224-Q228 WeakPolarHBondContact O-CB 3.44Å; L224-Q228 VanDerWaalsContact O-CG 3.29Å; L224-Q228 WeakPolarHBondContact O-CG 3.29Å; L224-Q228 PolarHBondContact O-N 2.86Å
225W90.3Very high88.1Confident134 Ų13496.8 Ų96.851%0.50847%0.469SS..Hα-helixtrans-59-47.8176.6174.989000111.5K221 Y222 R223 D227 Q228 H229K221-W225 WeakPolarHBondContact O-CB 3.42Å; K221-W225 PolarHBondContact O-N 3.35Å; Y222-W225 HydrophobicContact CD2-CE3 4.24Å; Y222-W225 HydrophobicContact CE2-CE3 4.1Å; Y222-W225 HydrophobicContact CE2-CZ3 4.11Å; Y222-W225 PolarHBondContact O-N 3.45Å; R223-W225 PolarHBondContact O-N 2.9Å; W225-D227 PolarHBondContact O-N 3.28Å; W225-Q228 PolarHBondContact O-N 3.19Å; W225-H229 AromaticContact CD1-CE1 3.39Å; W225-H229 AromaticContact CD1-ND1 3.77Å; W225-H229 AromaticContact CD2-CE1 3.89Å; W225-H229 AromaticContact CD2-ND1 3.75Å; W225-H229 AromaticContact CE2-CE1 3.22Å; W225-H229 AromaticContact CE2-ND1 3.51Å; W225-H229 AromaticContact CE2-NE2 3.54Å; W225-H229 AromaticContact CG-CE1 3.97Å; W225-H229 AromaticContact CG-ND1 3.9Å; W225-H229 AromaticContact CZ2-CD2 3.76Å; W225-H229 AromaticContact CZ2-CE1 3.69Å; W225-H229 AromaticContact CZ2-ND1 3.97Å; W225-H229 AromaticContact CZ2-NE2 3.51Å; W225-H229 AromaticContact NE1-CE1 2.92Å; W225-H229 PolarHBondContact NE1-CE1 3.27Å; W225-H229 AromaticContact NE1-ND1 3.57Å; W225-H229 AromaticContact NE1-NE2 3.48Å; W225-H229 PolarHBondContact NE1-NE2 3.4Å; W225-H229 PolarHBondContact O-N 2.93Å; W225-H229 PolarHBondContact O-ND1 2.99Å
226R91.9Very high86.6Confident93 Ų9392 Ų9235%0.35146%0.464SS..Hα-helixtrans-62-43.9179.7-176.4-16568.7179.3-3.3111.8Y222 R223 L224 H229 K230Y222-R226 VanDerWaalsContact O-CB 3.29Å; Y222-R226 WeakPolarHBondContact O-CB 3.28Å; Y222-R226 PolarHBondContact O-N 2.98Å; R223-R226 PolarHBondContact O-N 3.41Å; L224-R226 PolarHBondContact O-N 3.43Å; R226-H229 PolarHBondContact O-N 3.25Å; R226-K230 WeakPolarHBondContact O-CG 3.33Å; R226-K230 PolarHBondContact O-N 2.88Å
227D91.4Very high84.9Confident70 Ų7091.6 Ų91.637%0.37447%0.468SS..Hα-helixtrans-70.8-35.7-177-61.9-13.4000110.6R223 L224 W225 K230 L231R223-D227 WeakPolarHBondContact O-CB 3.46Å; R223-D227 PolarHBondContact O-N 3.01Å; L224-D227 PolarHBondContact O-N 3Å; W225-D227 PolarHBondContact O-N 3.28Å; D227-K230 PolarHBondContact O-N 3.48Å; D227-L231 WeakPolarHBondContact O-CG 3.42Å; D227-L231 PolarHBondContact O-N 3.43Å
228Q89.4Confident83.1Confident125 Ų12594.7 Ų94.758%0.58449%0.49SS*.Hα-helixtrans-61.4-43.2168.8-74.7174.2-16.400112.5L224 W225 L231 A232L224-Q228 WeakPolarHBondContact O-CB 3.44Å; L224-Q228 VanDerWaalsContact O-CG 3.29Å; L224-Q228 WeakPolarHBondContact O-CG 3.29Å; L224-Q228 PolarHBondContact O-N 2.86Å; W225-Q228 PolarHBondContact O-N 3.19Å; Q228-L231 PolarHBondContact O-N 2.94Å; Q228-A232 WeakPolarHBondContact O-CB 3.25Å; Q228-A232 PolarHBondContact O-N 2.9Å
229H86Confident81.3Confident98 Ų9894.8 Ų94.845%0.45450%0.502SS..Hα-helixtrans-66.4-38.2178.1-77.962.3000112.1W225 R226 A232 A233W225-H229 AromaticContact CD1-CE1 3.39Å; W225-H229 AromaticContact CD1-ND1 3.77Å; W225-H229 AromaticContact CD2-CE1 3.89Å; W225-H229 AromaticContact CD2-ND1 3.75Å; W225-H229 AromaticContact CE2-CE1 3.22Å; W225-H229 AromaticContact CE2-ND1 3.51Å; W225-H229 AromaticContact CE2-NE2 3.54Å; W225-H229 AromaticContact CG-CE1 3.97Å; W225-H229 AromaticContact CG-ND1 3.9Å; W225-H229 AromaticContact CZ2-CD2 3.76Å; W225-H229 AromaticContact CZ2-CE1 3.69Å; W225-H229 AromaticContact CZ2-ND1 3.97Å; W225-H229 AromaticContact CZ2-NE2 3.51Å; W225-H229 AromaticContact NE1-CE1 2.92Å; W225-H229 PolarHBondContact NE1-CE1 3.27Å; W225-H229 AromaticContact NE1-ND1 3.57Å; W225-H229 AromaticContact NE1-NE2 3.48Å; W225-H229 PolarHBondContact NE1-NE2 3.4Å; W225-H229 PolarHBondContact O-N 2.93Å; W225-H229 PolarHBondContact O-ND1 2.99Å; R226-H229 PolarHBondContact O-N 3.25Å; H229-A232 PolarHBondContact O-N 3.42Å; H229-A233 WeakPolarHBondContact O-CB 3.2Å; H229-A233 PolarHBondContact O-N 2.82Å
230K88.1Confident79.2Confident121 Ų121100.1 Ų100.153%0.52652%0.524SS..Hα-helixtrans-62.6-47.4173.3-74.7-179.1176.8-171.50111.7R226 D227 A232 A233 V234R226-K230 WeakPolarHBondContact O-CG 3.33Å; R226-K230 PolarHBondContact O-N 2.88Å; D227-K230 PolarHBondContact O-N 3.48Å; K230-A232 VanDerWaalsContact C-N 3.34Å; K230-A232 PolarHBondContact O-N 3.45Å; K230-A233 PolarHBondContact O-N 2.89Å; K230-V234 WeakPolarHBondContact O-CG2 3.41Å; K230-V234 PolarHBondContact O-N 2.95Å
231L85.9Confident77.2Confident110 Ų110102.8 Ų102.858%0.57654%0.538SS*.Hα-helixtrans-60.5-42.6177.3-75.4164.5000112D227 Q228 A233 V234 N235D227-L231 WeakPolarHBondContact O-CG 3.42Å; D227-L231 PolarHBondContact O-N 3.43Å; Q228-L231 PolarHBondContact O-N 2.94Å; L231-A233 VanDerWaalsContact C-N 3.33Å; L231-A233 PolarHBondContact O-N 3.04Å; L231-V234 PolarHBondContact O-N 3.33Å; L231-N235 WeakPolarHBondContact O-CB 3.32Å; L231-N235 PolarHBondContact O-N 3.44Å
232A83.3Confident75Confident65 Ų65109.9 Ų109.954%0.53758%0.58SS.*Hα-helixtrans-62.5-39.3175.600000112.3Q228 H229 K230 G236Q228-A232 WeakPolarHBondContact O-CB 3.25Å; Q228-A232 PolarHBondContact O-N 2.9Å; H229-A232 PolarHBondContact O-N 3.42Å; K230-A232 VanDerWaalsContact C-N 3.34Å; K230-A232 PolarHBondContact O-N 3.45Å; A232-G236 PolarHBondContact O-N 2.95Å
233A81.3Confident74.2Confident57 Ų57108.9 Ų108.947%0.47158%0.584SS.*Hα-helixtrans-68.1-39.7176.700000112.9H229 K230 L231 H237H229-A233 WeakPolarHBondContact O-CB 3.2Å; H229-A233 PolarHBondContact O-N 2.82Å; K230-A233 PolarHBondContact O-N 2.89Å; L231-A233 VanDerWaalsContact C-N 3.33Å; L231-A233 PolarHBondContact O-N 3.04Å; A233-H237 PolarHBondContact O-CD2 2.72Å; A233-H237 PolarHBondContact O-N 3.29Å
234V78.4Confident73.3Confident94 Ų94108.9 Ų108.957%0.5759%0.593SS**Hα-helixtrans-64.9-47.5174.8176.80000110.8K230 L231 G236 H237 V238K230-V234 WeakPolarHBondContact O-CG2 3.41Å; K230-V234 PolarHBondContact O-N 2.95Å; L231-V234 PolarHBondContact O-N 3.33Å; V234-G236 VanDerWaalsContact C-N 3.32Å; V234-G236 PolarHBondContact O-N 3.12Å; V234-H237 PolarHBondContact O-N 3.44Å; V234-V238 PolarHBondContact O-N 2.88Å
235N73.4Confident72.4Confident114 Ų114109.2 Ų109.261%0.6160%0.596SS**Hα-helixtrans-66.4-33.6179.6-69.2-11.2000112.4L231 H237 V238L231-N235 WeakPolarHBondContact O-CB 3.32Å; L231-N235 PolarHBondContact O-N 3.44Å; N235-H237 VanDerWaalsContact C-N 3.28Å; N235-H237 PolarHBondContact O-N 3.35Å; N235-V238 PolarHBondContact O-N 3.19Å
236G61.7Low71.3Confident44 Ų44107.7 Ų107.745%0.45460%0.601SS.*Hα-helixtrans-68.8-21.2175.700000114.5A232 V234A232-G236 PolarHBondContact O-N 2.95Å; V234-G236 VanDerWaalsContact C-N 3.32Å; V234-G236 PolarHBondContact O-N 3.12Å
237H57.1Low70Confident144 Ų144108.6 Ų108.667%0.66762%0.616SS**Hα-helixtrans-83.6-24.8174.7-86.8-55.2000113.7A233 V234 N235 G239A233-H237 PolarHBondContact O-CD2 2.72Å; A233-H237 PolarHBondContact O-N 3.29Å; V234-H237 PolarHBondContact O-N 3.44Å; N235-H237 VanDerWaalsContact C-N 3.28Å; N235-H237 PolarHBondContact O-N 3.35Å; H237-G239 VanDerWaalsContact C-N 3.32Å
238V53.9Low68.6Low106 Ų106111.2 Ų111.264%0.64263%0.632SS**Hα-helixtrans-73.5-23.5177.6178.90000112.1V234 N235V234-V238 PolarHBondContact O-N 2.88Å; N235-V238 PolarHBondContact O-N 3.19Å
239G51.8Low67.1Low67 Ų67110.2 Ų110.269%0.69164%0.636SS**THydrogen-bonded Turntrans-89.111179.100000116.2H237H237-G239 VanDerWaalsContact C-N 3.32Å
240K49.8Very low65.7Low176 Ų176111.2 Ų111.277%0.76565%0.65SS**THydrogen-bonded Turntrans-119.611.4-177.8-79.1-171175.9-177.90114.4
241T46.6Very low63.8Low109 Ų109110.3 Ų110.367%0.66966%0.66SS**  trans-107.974.7172.649.40000109
242D42.4Very low61.8Low238 Ų238110.4 Ų110.4100%1.27367%0.668SS**  trans-142.40161-77.6-30.9000108.2

Retrieved 242 of 242 residues in 610.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).