A0A077YX05_TRITR Loading...

Lung 7-TM R domain containing protein

AlphaFold DB , UniProt , Accession A0A077YX05, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 397 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
1M41.2Very low60.6Low195 Ų19588 Ų8896%0.96144%0.437SS*.  01010-67.3173.4134.500109.7S3 N135M1-S3 PolarHBondContact O-N 3.12Å; M1-N135 VanDerWaalsContact N-CG 3.34Å; M1-N135 PolarHBondContact N-ND2 3.35Å; M1-N135 PolarHBondContact N-OD1 3.48Å
2T52.3Low61.2Low35 Ų3591.8 Ų91.822%0.21545%0.449CS..  trans-49.5116.3152.328.50000105.7W4 I128T2-W4 PolarHBondContact O-N 3.37Å; T2-I128 HydrophobicContact CG2-CG2 4.02Å
3S58.5Low61.8Low56 Ų5687.1 Ų87.139%0.39243%0.434SS..  trans-56.5133.3-175.9178.30000106.9M1 R5 Q6M1-S3 PolarHBondContact O-N 3.12Å; S3-R5 CarbonylContact O-C 3.44Å; S3-R5 PolarHBondContact O-N 3.18Å; S3-R5 WeakPolarHBondContact OG-CB 3.43Å; S3-R5 PolarHBondContact OG-N 3.09Å; S3-Q6 WeakPolarHBondContact O-CB 3.48Å; S3-Q6 PolarHBondContact O-N 3.05Å
4W58.3Low62.4Low128 Ų12882.6 Ų82.649%0.48541%0.414SS..Hα-helixtrans-47.8-26.5173.9-104.886.1000112.3T2 Q6 V7 A8 L290 F294T2-W4 PolarHBondContact O-N 3.37Å; W4-Q6 PolarHBondContact O-N 3.13Å; W4-V7 PolarHBondContact O-N 3.05Å; W4-A8 VanDerWaalsContact O-CB 3.31Å; W4-A8 WeakPolarHBondContact O-CB 3.29Å; W4-A8 PolarHBondContact O-N 3.33Å; W4-L290 HydrophobicContact CD2-CD1 4.44Å; W4-L290 HydrophobicContact CD2-CD2 3.76Å; W4-L290 HydrophobicContact CD2-CG 4.36Å; W4-L290 HydrophobicContact CE3-CD1 4.47Å; W4-L290 HydrophobicContact CE3-CD2 4.28Å; W4-L290 HydrophobicContact CE3-CG 4.42Å; W4-L290 HydrophobicContact CG-CD2 4.06Å; W4-L290 HydrophobicContact CH2-CD2 4.44Å; W4-L290 HydrophobicContact CZ2-CD2 3.95Å; W4-F294 HydrophobicContact CZ3-CD2 4.4Å
5R60.8Low62.8Low194 Ų19479.7 Ų79.773%0.73240%0.402SS*.Hα-helixtrans-57.3-42.1170.6-61.7179.667.9-174.70.9113.6S3 A8 L9S3-R5 CarbonylContact O-C 3.44Å; S3-R5 PolarHBondContact O-N 3.18Å; S3-R5 WeakPolarHBondContact OG-CB 3.43Å; S3-R5 PolarHBondContact OG-N 3.09Å; R5-A8 PolarHBondContact O-N 2.9Å; R5-L9 VanDerWaalsContact O-CB 3.3Å; R5-L9 WeakPolarHBondContact O-CB 3.39Å; R5-L9 WeakPolarHBondContact O-CD1 3.33Å; R5-L9 VanDerWaalsContact O-CG 3.31Å; R5-L9 WeakPolarHBondContact O-CG 3.34Å; R5-L9 PolarHBondContact O-N 3.17Å
6Q66.2Low63.2Low106 Ų10682.1 Ų82.150%0.49541%0.409SS..Hα-helixtrans-67.8-41.7178-69.6-179.1-32.400111.5S3 W4 F10S3-Q6 WeakPolarHBondContact O-CB 3.48Å; S3-Q6 PolarHBondContact O-N 3.05Å; W4-Q6 PolarHBondContact O-N 3.13Å; Q6-F10 WeakPolarHBondContact O-CB 3.21Å; Q6-F10 PolarHBondContact O-N 3.35Å
7V64.6Low63.6Low22 Ų2281.4 Ų81.413%0.13340%0.403CS..Hα-helixtrans-63.8-47.3175-176.90000109.8W4 L9 F10 V11 W125 M143W4-V7 PolarHBondContact O-N 3.05Å; V7-L9 PolarHBondContact O-N 3.42Å; V7-F10 PolarHBondContact O-N 3.27Å; V7-V11 HydrophobicContact CG1-CG2 4.34Å; V7-V11 VanDerWaalsContact O-CG2 3.26Å; V7-V11 WeakPolarHBondContact O-CG2 3.28Å; V7-V11 PolarHBondContact O-N 3.12Å; V7-W125 HydrophobicContact CB-CH2 4.42Å; V7-W125 HydrophobicContact CG1-CH2 4.33Å; V7-W125 HydrophobicContact CG2-CH2 4.13Å; V7-M143 HydrophobicContact CG1-SD 4.47Å
8A63.5Low63.9Low52 Ų5277.6 Ų77.643%0.4339%0.387SS..Hα-helixtrans-60.4-45.617800000112.2W4 R5 F10 V11 F12W4-A8 VanDerWaalsContact O-CB 3.31Å; W4-A8 WeakPolarHBondContact O-CB 3.29Å; W4-A8 PolarHBondContact O-N 3.33Å; R5-A8 PolarHBondContact O-N 2.9Å; A8-F10 VanDerWaalsContact C-N 3.33Å; A8-F10 PolarHBondContact O-N 3.27Å; A8-V11 PolarHBondContact O-N 3.42Å; A8-F12 VanDerWaalsContact O-CB 3.31Å; A8-F12 WeakPolarHBondContact O-CB 3.49Å; A8-F12 PolarHBondContact O-N 2.75Å
9L66.8Low64.1Low121 Ų12176.2 Ų76.263%0.63438%0.381SS*.Hα-helixtrans-60.2-42.3175.4-82.7162.4000111.9R5 V7 F12 A13R5-L9 VanDerWaalsContact O-CB 3.3Å; R5-L9 WeakPolarHBondContact O-CB 3.39Å; R5-L9 WeakPolarHBondContact O-CD1 3.33Å; R5-L9 VanDerWaalsContact O-CG 3.31Å; R5-L9 WeakPolarHBondContact O-CG 3.34Å; R5-L9 PolarHBondContact O-N 3.17Å; V7-L9 PolarHBondContact O-N 3.42Å; L9-F12 PolarHBondContact O-N 3.45Å; L9-A13 WeakPolarHBondContact O-CB 3.46Å; L9-A13 PolarHBondContact O-N 3.18Å
10F68.9Low64.3Low16 Ų1674.5 Ų74.57%0.0738%0.377CS..Hα-helixtrans-67.9-44.5178.1-176.6-105.6000112.1Q6 V7 A8 F12 A13 V14 L121 W125 M143 V147Q6-F10 WeakPolarHBondContact O-CB 3.21Å; Q6-F10 PolarHBondContact O-N 3.35Å; V7-F10 PolarHBondContact O-N 3.27Å; A8-F10 VanDerWaalsContact C-N 3.33Å; A8-F10 PolarHBondContact O-N 3.27Å; F10-F12 VanDerWaalsContact C-N 3.29Å; F10-F12 PolarHBondContact O-N 2.66Å; F10-A13 PolarHBondContact O-N 2.67Å; F10-V14 HydrophobicContact CD1-CG2 4.29Å; F10-V14 HydrophobicContact CD2-CG2 4.5Å; F10-V14 HydrophobicContact CE1-CG2 3.93Å; F10-V14 HydrophobicContact CE2-CG2 4.18Å; F10-V14 HydrophobicContact CZ-CG2 3.86Å; F10-V14 WeakPolarHBondContact O-CB 3.37Å; F10-V14 VanDerWaalsContact O-CG2 3.32Å; F10-V14 WeakPolarHBondContact O-CG2 3.41Å; F10-V14 PolarHBondContact O-N 3.02Å; F10-L121 HydrophobicContact CE2-CB 4.02Å; F10-L121 HydrophobicContact CE2-CD2 4.17Å; F10-L121 HydrophobicContact CZ-CB 4.41Å; F10-W125 HydrophobicContact CB-CE3 4.12Å; F10-W125 HydrophobicContact CB-CH2 4.3Å; F10-W125 HydrophobicContact CB-CZ3 3.56Å; F10-W125 AromaticContact CD1-CD2 3.85Å; F10-W125 HydrophobicContact CD1-CD2 3.85Å; F10-W125 AromaticContact CD1-CE3 3.39Å; F10-W125 HydrophobicContact CD1-CE3 3.39Å; F10-W125 AromaticContact CD1-CH2 3.83Å; F10-W125 HydrophobicContact CD1-CH2 3.83Å; F10-W125 HydrophobicContact CD1-CZ2 4.26Å; F10-W125 AromaticContact CD1-CZ3 3.38Å; F10-W125 HydrophobicContact CD1-CZ3 3.38Å; F10-W125 AromaticContact CD2-CE3 3.78Å; F10-W125 HydrophobicContact CD2-CE3 3.78Å; F10-W125 HydrophobicContact CD2-CZ3 4.13Å; F10-W125 HydrophobicContact CE1-CB 4.42Å; F10-W125 AromaticContact CE1-CD2 3.65Å; F10-W125 HydrophobicContact CE1-CD2 3.65Å; F10-W125 AromaticContact CE1-CE3 3.62Å; F10-W125 HydrophobicContact CE1-CE3 3.62Å; F10-W125 HydrophobicContact CE1-CG 4.02Å; F10-W125 HydrophobicContact CE1-CZ3 4.09Å; F10-W125 HydrophobicContact CE2-CB 4.28Å; F10-W125 HydrophobicContact CE2-CD2 4.45Å; F10-W125 AromaticContact CE2-CE3 3.97Å; F10-W125 HydrophobicContact CE2-CE3 3.97Å; F10-W125 HydrophobicContact CG-CD2 4.36Å; F10-W125 AromaticContact CG-CE3 3.49Å; F10-W125 HydrophobicContact CG-CE3 3.49Å; F10-W125 VanDerWaalsContact CG-CE3 3.49Å; F10-W125 HydrophobicContact CG-CH2 4.25Å; F10-W125 AromaticContact CG-CZ3 3.43Å; F10-W125 HydrophobicContact CG-CZ3 3.43Å; F10-W125 VanDerWaalsContact CG-CZ3 3.43Å; F10-W125 HydrophobicContact CZ-CB 3.9Å; F10-W125 AromaticContact CZ-CD2 3.98Å; F10-W125 HydrophobicContact CZ-CD2 3.98Å; F10-W125 AromaticContact CZ-CE3 3.91Å; F10-W125 HydrophobicContact CZ-CE3 3.91Å; F10-W125 AromaticContact CZ-CG 4Å; F10-W125 HydrophobicContact CZ-CG 4Å; F10-M143 HydrophobicContact CD1-CE 3.34Å; F10-M143 HydrophobicContact CD1-SD 4.14Å; F10-M143 HydrophobicContact CE1-CE 3.67Å; F10-M143 HydrophobicContact CE1-SD 4.44Å; F10-V147 HydrophobicContact CE1-CG2 3.9Å; F10-V147 HydrophobicContact CZ-CG2 3.96Å
11V66Low64.5Low43 Ų4371.1 Ų71.126%0.26136%0.36SS..Hα-helixtrans-55.7-48.2171.8173.90000109.8V7 A8 A13 V14 V15 M143V7-V11 HydrophobicContact CG1-CG2 4.34Å; V7-V11 VanDerWaalsContact O-CG2 3.26Å; V7-V11 WeakPolarHBondContact O-CG2 3.28Å; V7-V11 PolarHBondContact O-N 3.12Å; A8-V11 PolarHBondContact O-N 3.42Å; V11-A13 PolarHBondContact O-N 2.78Å; V11-V14 PolarHBondContact O-N 3.02Å; V11-V15 HydrophobicContact CG1-CG2 4.17Å; V11-V15 VanDerWaalsContact O-CB 3.28Å; V11-V15 WeakPolarHBondContact O-CB 3.45Å; V11-V15 VanDerWaalsContact O-CG2 3.26Å; V11-V15 WeakPolarHBondContact O-CG2 3.37Å; V11-V15 PolarHBondContact O-N 3.23Å; V11-M143 HydrophobicContact CB-CE 4.11Å; V11-M143 HydrophobicContact CG2-CE 3.29Å; V11-M143 HydrophobicContact CG2-SD 3.95Å
12F66.9Low65.7Low133 Ų13365.9 Ų65.958%0.58333%0.333SS*.Hα-helixtrans-63.6-42-178.4-148-86.6000111.7A8 L9 F10 V15 F16A8-F12 VanDerWaalsContact O-CB 3.31Å; A8-F12 WeakPolarHBondContact O-CB 3.49Å; A8-F12 PolarHBondContact O-N 2.75Å; L9-F12 PolarHBondContact O-N 3.45Å; F10-F12 VanDerWaalsContact C-N 3.29Å; F10-F12 PolarHBondContact O-N 2.66Å; F12-V15 PolarHBondContact O-N 3.38Å; F12-F16 WeakPolarHBondContact O-CB 3.48Å; F12-F16 PolarHBondContact O-N 3.45Å
13A70.1Confident66.2Low31 Ų3166.3 Ų66.326%0.25634%0.34SS..Hα-helixtrans-62.4-49.517500000111.3L9 F10 V11 V15 F16 F17L9-A13 WeakPolarHBondContact O-CB 3.46Å; L9-A13 PolarHBondContact O-N 3.18Å; F10-A13 PolarHBondContact O-N 2.67Å; V11-A13 PolarHBondContact O-N 2.78Å; A13-V15 VanDerWaalsContact C-N 3.34Å; A13-V15 PolarHBondContact O-N 2.81Å; A13-F16 PolarHBondContact O-N 2.97Å; A13-F17 HydrophobicContact CB-CD2 4.36Å; A13-F17 HydrophobicContact CB-CE2 4.32Å; A13-F17 WeakPolarHBondContact O-CB 3.29Å; A13-F17 WeakPolarHBondContact O-CD2 3.32Å; A13-F17 PolarHBondContact O-N 3.22Å
14V69.7Low66.6Low25 Ų2570.7 Ų70.715%0.15235%0.348CS..Hα-helixtrans-61-44.2178.9171.30000111.1F10 V11 A18 F118 L121 V147F10-V14 HydrophobicContact CD1-CG2 4.29Å; F10-V14 HydrophobicContact CD2-CG2 4.5Å; F10-V14 HydrophobicContact CE1-CG2 3.93Å; F10-V14 HydrophobicContact CE2-CG2 4.18Å; F10-V14 HydrophobicContact CZ-CG2 3.86Å; F10-V14 WeakPolarHBondContact O-CB 3.37Å; F10-V14 VanDerWaalsContact O-CG2 3.32Å; F10-V14 WeakPolarHBondContact O-CG2 3.41Å; F10-V14 PolarHBondContact O-N 3.02Å; V11-V14 PolarHBondContact O-N 3.02Å; V14-A18 WeakPolarHBondContact O-CB 3.49Å; V14-A18 PolarHBondContact O-N 2.98Å; V14-F118 HydrophobicContact CG1-CE1 4.38Å; V14-L121 HydrophobicContact CG2-CD1 4.47Å; V14-V147 HydrophobicContact CG1-CG2 4.44Å; V14-V147 HydrophobicContact CG2-CG2 4.13Å
15V67.7Low66.9Low38 Ų3865.1 Ų65.123%0.2333%0.328CS..Hα-helixtrans-63.3-46176.3162.40000111.1V11 F12 A13 A18 N19 Y301V11-V15 HydrophobicContact CG1-CG2 4.17Å; V11-V15 VanDerWaalsContact O-CB 3.28Å; V11-V15 WeakPolarHBondContact O-CB 3.45Å; V11-V15 VanDerWaalsContact O-CG2 3.26Å; V11-V15 WeakPolarHBondContact O-CG2 3.37Å; V11-V15 PolarHBondContact O-N 3.23Å; F12-V15 PolarHBondContact O-N 3.38Å; A13-V15 VanDerWaalsContact C-N 3.34Å; A13-V15 PolarHBondContact O-N 2.81Å; V15-A18 PolarHBondContact O-N 3.36Å; V15-N19 VanDerWaalsContact O-CB 3.28Å; V15-N19 WeakPolarHBondContact O-CB 3.45Å; V15-N19 VanDerWaalsContact O-CG 3.28Å; V15-N19 PolarHBondContact O-N 3.08Å; V15-Y301 HydrophobicContact CB-CD2 4.48Å; V15-Y301 HydrophobicContact CB-CE2 4.35Å; V15-Y301 HydrophobicContact CG1-CD2 3.38Å; V15-Y301 HydrophobicContact CG1-CE2 3.46Å; V15-Y301 VanDerWaalsContact CG1-CE2 3.46Å; V15-Y301 HydrophobicContact CG1-CG 4.48Å; V15-Y301 HydrophobicContact CG2-CD2 4.29Å; V15-Y301 HydrophobicContact CG2-CE2 4.1Å
16F70.1Confident67Low118 Ų11859.9 Ų59.952%0.51831%0.308SS..Hα-helixtrans-61.4-52.1178.6-177.5-97000110.6F12 A13 A18 N19 S20F12-F16 WeakPolarHBondContact O-CB 3.48Å; F12-F16 PolarHBondContact O-N 3.45Å; A13-F16 PolarHBondContact O-N 2.97Å; F16-A18 VanDerWaalsContact C-N 3.32Å; F16-A18 PolarHBondContact O-N 3.41Å; F16-N19 PolarHBondContact O-N 3.5Å; F16-S20 WeakPolarHBondContact O-CB 3.46Å; F16-S20 PolarHBondContact O-N 2.96Å; F16-S20 PolarHBondContact O-OG 3.35Å
17F69.8Low66.8Low71 Ų7158 Ų5831%0.31130%0.304SS..Hα-helixtrans-62.5-37.8177.4-73.9-62.4000112.6A13 C21 F118 L121A13-F17 HydrophobicContact CB-CD2 4.36Å; A13-F17 HydrophobicContact CB-CE2 4.32Å; A13-F17 WeakPolarHBondContact O-CB 3.29Å; A13-F17 WeakPolarHBondContact O-CD2 3.32Å; A13-F17 PolarHBondContact O-N 3.22Å; F17-C21 VanDerWaalsContact O-CB 3.26Å; F17-C21 WeakPolarHBondContact O-CB 3.44Å; F17-C21 PolarHBondContact O-N 3.44Å; F17-F118 HydrophobicContact CB-CE1 4.2Å; F17-F118 HydrophobicContact CB-CZ 4.12Å; F17-L121 HydrophobicContact CD2-CD1 4.34Å
18A68.8Low66.6Low13 Ų1358 Ų5811%0.10730%0.303CS..Hα-helixtrans-65.6-46.2176.200000111.8V14 V15 F16 C21 E22 F118V14-A18 WeakPolarHBondContact O-CB 3.49Å; V14-A18 PolarHBondContact O-N 2.98Å; V15-A18 PolarHBondContact O-N 3.36Å; F16-A18 VanDerWaalsContact C-N 3.32Å; F16-A18 PolarHBondContact O-N 3.41Å; A18-C21 PolarHBondContact O-N 3.33Å; A18-E22 PolarHBondContact O-N 2.95Å; A18-E22 VanDerWaalsContact O-N 3.08Å; A18-F118 HydrophobicContact CB-CZ 4.27Å
19N68Low66.4Low50 Ų5060.4 Ų60.427%0.26730%0.304SS..Hα-helixtrans-66-42.4177.4-75.7-12.4000111.6V15 F16 C21 E22 A23V15-N19 VanDerWaalsContact O-CB 3.28Å; V15-N19 WeakPolarHBondContact O-CB 3.45Å; V15-N19 VanDerWaalsContact O-CG 3.28Å; V15-N19 PolarHBondContact O-N 3.08Å; F16-N19 PolarHBondContact O-N 3.5Å; N19-C21 VanDerWaalsContact C-N 3.32Å; N19-C21 PolarHBondContact O-N 3.35Å; N19-E22 PolarHBondContact O-N 3.49Å; N19-A23 WeakPolarHBondContact O-CB 3.37Å; N19-A23 PolarHBondContact O-N 2.88Å
20S68.6Low65.7Low43 Ų4357.3 Ų57.330%0.30129%0.288SS..Hα-helixtrans-62.3-39.5176.3-63.20000112F16 R24F16-S20 WeakPolarHBondContact O-CB 3.46Å; F16-S20 PolarHBondContact O-N 2.96Å; F16-S20 PolarHBondContact O-OG 3.35Å; S20-R24 VanDerWaalsContact O-CB 3.31Å; S20-R24 WeakPolarHBondContact O-CB 3.48Å; S20-R24 PolarHBondContact O-N 2.9Å
21C66.7Low64.9Low3 Ų364.3 Ų64.32%0.0232%0.321CS..Hα-helixtrans-61.1-56.3175.2-175.70000110.4F17 A18 N19 A23 R24 I25 F114F17-C21 VanDerWaalsContact O-CB 3.26Å; F17-C21 WeakPolarHBondContact O-CB 3.44Å; F17-C21 PolarHBondContact O-N 3.44Å; A18-C21 PolarHBondContact O-N 3.33Å; N19-C21 VanDerWaalsContact C-N 3.32Å; N19-C21 PolarHBondContact O-N 3.35Å; C21-A23 PolarHBondContact O-N 3.22Å; C21-R24 PolarHBondContact O-N 3.04Å; C21-I25 VanDerWaalsContact O-CD1 3.23Å; C21-I25 WeakPolarHBondContact O-CD1 3.47Å; C21-I25 VanDerWaalsContact O-CG1 3.23Å; C21-I25 WeakPolarHBondContact O-CG1 3.43Å; C21-I25 PolarHBondContact O-N 3.41Å; C21-I25 VanDerWaalsContact SG-CD1 3.57Å; C21-F114 HydrophobicContact CB-CD1 3.98Å; C21-F114 HydrophobicContact CB-CD2 4.1Å; C21-F114 HydrophobicContact CB-CE1 3.9Å; C21-F114 HydrophobicContact CB-CE2 4.03Å; C21-F114 HydrophobicContact CB-CG 4.09Å; C21-F114 HydrophobicContact CB-CZ 3.94Å
22E67.5Low64.3Low86 Ų8664.8 Ų64.840%0.40232%0.321SS..Hα-helixtrans-63.8-39.2-177.4-72.2-178.1-155.200113A18 N19 I25 R26 K150A18-E22 PolarHBondContact O-N 2.95Å; A18-E22 VanDerWaalsContact O-N 3.08Å; N19-E22 PolarHBondContact O-N 3.49Å; E22-I25 PolarHBondContact O-N 3.32Å; E22-R26 WeakPolarHBondContact O-CG 3.38Å; E22-R26 PolarHBondContact O-N 2.91Å; E22-K150 IonicContact OE1-NZ 3.36Å; E22-K150 PolarHBondContact OE1-NZ 2.97Å
23A63.6Low63.2Low44 Ų4460.9 Ų60.936%0.36432%0.319SS..Hα-helixtrans-61.9-47.6175.400000111.4N19 C21 I25 R26 T27N19-A23 WeakPolarHBondContact O-CB 3.37Å; N19-A23 PolarHBondContact O-N 2.88Å; C21-A23 PolarHBondContact O-N 3.22Å; A23-I25 VanDerWaalsContact C-N 3.31Å; A23-I25 PolarHBondContact O-N 3.36Å; A23-R26 PolarHBondContact O-N 3.04Å; A23-T27 PolarHBondContact O-N 3.28Å; A23-T27 PolarHBondContact O-OG1 3.13Å
24R66Low62.2Low147 Ų14760.7 Ų60.756%0.55532%0.315SS*.Hα-helixtrans-62.2-40.2179.6-170.563.9174.9-178.43.2111.8S20 C21 T27 L28S20-R24 VanDerWaalsContact O-CB 3.31Å; S20-R24 WeakPolarHBondContact O-CB 3.48Å; S20-R24 PolarHBondContact O-N 2.9Å; C21-R24 PolarHBondContact O-N 3.04Å; R24-T27 PolarHBondContact O-N 3.2Å; R24-L28 HydrophobicContact CG-CD1 4.44Å; R24-L28 WeakPolarHBondContact O-CG 3.41Å; R24-L28 PolarHBondContact O-N 3.48Å
25I64.8Low60.7Low12 Ų1265.2 Ų65.26%0.06234%0.338CS..Hα-helixtrans-63.1-46.1177-66.1153.9000110.8C21 E22 A23 T27 L28 K29 Y111C21-I25 VanDerWaalsContact O-CD1 3.23Å; C21-I25 WeakPolarHBondContact O-CD1 3.47Å; C21-I25 VanDerWaalsContact O-CG1 3.23Å; C21-I25 WeakPolarHBondContact O-CG1 3.43Å; C21-I25 PolarHBondContact O-N 3.41Å; C21-I25 VanDerWaalsContact SG-CD1 3.57Å; E22-I25 PolarHBondContact O-N 3.32Å; A23-I25 VanDerWaalsContact C-N 3.31Å; A23-I25 PolarHBondContact O-N 3.36Å; I25-T27 VanDerWaalsContact C-N 3.33Å; I25-T27 PolarHBondContact O-N 2.89Å; I25-L28 PolarHBondContact O-N 3.05Å; I25-K29 PolarHBondContact O-N 2.63Å; I25-Y111 HydrophobicContact CD1-CD1 4.49Å; I25-Y111 HydrophobicContact CD1-CE1 3.6Å; I25-Y111 HydrophobicContact CD1-CE2 4.01Å; I25-Y111 VanDerWaalsContact CD1-OH 3.22Å; I25-Y111 WeakPolarHBondContact CD1-OH 3.44Å; I25-Y111 HydrophobicContact CG1-CE2 4.22Å
26R62.2Low59.5Low83 Ų8365.6 Ų65.631%0.31334%0.337SS..Hα-helixtrans-62.1-41.2177.7-72.4-178.3-176.3-100.3-4111.5E22 A23 L28 K29 L30E22-R26 WeakPolarHBondContact O-CG 3.38Å; E22-R26 PolarHBondContact O-N 2.91Å; A23-R26 PolarHBondContact O-N 3.04Å; R26-L28 PolarHBondContact O-N 3.33Å; R26-K29 PolarHBondContact O-N 2.97Å; R26-L30 WeakPolarHBondContact O-CB 3.32Å; R26-L30 WeakPolarHBondContact O-CD1 3.47Å; R26-L30 WeakPolarHBondContact O-CG 3.46Å; R26-L30 PolarHBondContact O-N 3.01Å
27T61.9Low58.1Low68 Ų6867.6 Ų67.642%0.41735%0.345SS..Hα-helixtrans-61.1-43.6175.4-51.10000111.9A23 R24 I25 K29 L30 E31A23-T27 PolarHBondContact O-N 3.28Å; A23-T27 PolarHBondContact O-OG1 3.13Å; R24-T27 PolarHBondContact O-N 3.2Å; I25-T27 VanDerWaalsContact C-N 3.33Å; I25-T27 PolarHBondContact O-N 2.89Å; T27-K29 VanDerWaalsContact C-N 3.35Å; T27-K29 PolarHBondContact O-N 3.21Å; T27-L30 PolarHBondContact O-N 3.45Å; T27-E31 PolarHBondContact O-N 3.3Å; T27-E31 VanDerWaalsContact O-N 3.09Å
28L61.9Low56.5Low21 Ų2172 Ų7211%0.1136%0.364CS..Hα-helixtrans-64.5-37.6178-70.3170.2000112.6R24 I25 R26 V107 I110R24-L28 HydrophobicContact CG-CD1 4.44Å; R24-L28 WeakPolarHBondContact O-CG 3.41Å; R24-L28 PolarHBondContact O-N 3.48Å; I25-L28 PolarHBondContact O-N 3.05Å; R26-L28 PolarHBondContact O-N 3.33Å; L28-V107 HydrophobicContact CB-CG2 4.43Å; L28-V107 HydrophobicContact CD1-CG2 3.99Å; L28-I110 HydrophobicContact CD1-CD1 3.47Å; L28-I110 VanDerWaalsContact CD1-CD1 3.47Å
29K58.3Low55.1Low103 Ų10379.4 Ų79.445%0.44840%0.402SS..Hα-helixtrans-69.9-33.8173.9-71.8-170.3173.5-168.90112.7I25 R26 T27 L32I25-K29 PolarHBondContact O-N 2.63Å; R26-K29 PolarHBondContact O-N 2.97Å; T27-K29 VanDerWaalsContact C-N 3.35Å; T27-K29 PolarHBondContact O-N 3.21Å; K29-L32 PolarHBondContact O-N 3.01Å
30L53Low53.7Low56 Ų5681.5 Ų81.529%0.29341%0.414SS..Hα-helixtrans-72.4-33.7-179.9-77.2163.4000113.4R26 T27 L32 G33 V312 V316R26-L30 WeakPolarHBondContact O-CB 3.32Å; R26-L30 WeakPolarHBondContact O-CD1 3.47Å; R26-L30 WeakPolarHBondContact O-CG 3.46Å; R26-L30 PolarHBondContact O-N 3.01Å; T27-L30 PolarHBondContact O-N 3.45Å; L30-L32 PolarHBondContact O-N 3.46Å; L30-L32 VanDerWaalsContact O-N 3.13Å; L30-G33 WeakPolarHBondContact O-CA 3.24Å; L30-G33 PolarHBondContact O-N 3.38Å; L30-V312 HydrophobicContact CD1-CG1 4.36Å; L30-V316 HydrophobicContact CD2-CG2 3.36Å
31E52.3Low52.7Low163 Ų16383.6 Ų83.676%0.76244%0.441SS*.THydrogen-bonded Turntrans-61.9-17.4174.4-74.6-163.5166.300112.8T27 G33T27-E31 PolarHBondContact O-N 3.3Å; T27-E31 VanDerWaalsContact O-N 3.09Å; E31-G33 VanDerWaalsContact C-N 3.31Å
32L51.8Low51.7Low53 Ų5391.9 Ų91.928%0.27747%0.472SS..THydrogen-bonded Turntrans-85.11.9171.5-10686.6000114.7K29 L30 S34 G103K29-L32 PolarHBondContact O-N 3.01Å; L30-L32 PolarHBondContact O-N 3.46Å; L30-L32 VanDerWaalsContact O-N 3.13Å; L32-S34 PolarHBondContact O-N 2.89Å; L32-G103 VanDerWaalsContact CD1-N 3.34Å
33G45.3Very low50.6Low51 Ų5199.9 Ų99.953%0.52650%0.499SS..  trans-33.591-172.500000115.3L30 E31L30-G33 WeakPolarHBondContact O-CA 3.24Å; L30-G33 PolarHBondContact O-N 3.38Å; E31-G33 VanDerWaalsContact C-N 3.31Å
34S48.4Very low49.7Very low27 Ų27104.5 Ų104.519%0.18951%0.511CS..  trans-2.9121.1152.550.90000116.3L32 F36L32-S34 PolarHBondContact O-N 2.89Å; S34-F36 VanDerWaalsContact C-N 3.28Å; S34-F36 VanDerWaalsContact CB-CD2 3.42Å; S34-F36 PolarHBondContact O-N 2.93Å; S34-F36 WeakPolarHBondContact OG-CD2 3.46Å; S34-F36 WeakPolarHBondContact OG-CE2 3.49Å
35L39.1Very low49Very low120 Ų120104.6 Ų104.663%0.62852%0.521SS*.  trans-7580.9166.9-122.1155.1000109.2F37L35-F37 HydrophobicContact CD2-CD2 4.28Å; L35-F37 HydrophobicContact CD2-CE2 3.7Å; L35-F37 HydrophobicContact CD2-CZ 3.96Å; L35-F37 PolarHBondContact O-N 3.35Å
36F42.5Very low48.4Very low46 Ų46107.7 Ų107.720%0.20254%0.535CS..  trans-81.5108.4170.9-79.6-72.7000109.8S34 K38 E46 I237S34-F36 VanDerWaalsContact C-N 3.28Å; S34-F36 VanDerWaalsContact CB-CD2 3.42Å; S34-F36 PolarHBondContact O-N 2.93Å; S34-F36 WeakPolarHBondContact OG-CD2 3.46Å; S34-F36 WeakPolarHBondContact OG-CE2 3.49Å; F36-K38 PolarHBondContact O-N 2.9Å; F36-E46 WeakPolarHBondContact CD1-OE1 3.4Å; F36-E46 WeakPolarHBondContact CE1-OE1 3.44Å; F36-E46 WeakPolarHBondContact CZ-OE1 3.43Å; F36-I237 HydrophobicContact CE1-CG2 4.2Å; F36-I237 WeakPolarHBondContact CE1-O 3.2Å; F36-I237 HydrophobicContact CE2-CB 4.06Å; F36-I237 HydrophobicContact CE2-CG2 3.66Å; F36-I237 HydrophobicContact CZ-CB 3.6Å; F36-I237 HydrophobicContact CZ-CG2 3.46Å; F36-I237 VanDerWaalsContact CZ-CG2 3.46Å; F36-I237 WeakPolarHBondContact CZ-O 3.25Å
37F40.2Very low48Very low159 Ų159109.1 Ų109.170%0.69755%0.548SS*.  trans-73.4108.8166-79.2-85.6000109.1L35L35-F37 HydrophobicContact CD2-CD2 4.28Å; L35-F37 HydrophobicContact CD2-CE2 3.7Å; L35-F37 HydrophobicContact CD2-CZ 3.96Å; L35-F37 PolarHBondContact O-N 3.35Å
38K36.7Very low47.9Very low164 Ų164108.2 Ų108.271%0.71354%0.542SS*.  trans-89.1129.4171.4-152171.2-174.4174.50108.2F36F36-K38 PolarHBondContact O-N 2.9Å
39N37.8Very low47.9Very low169 Ų169111.2 Ų111.290%0.90455%0.554SS**SBendtrans79.352.7174.5-149.326.9000116.9
40D39.5Very low48.3Very low94 Ų94107.5 Ų107.550%0.50354%0.538SS..  trans-133.3129.3160.6-161.3-4.5000109.8R42D40-R42 PolarHBondContact O-N 3.22Å
41G47.1Very low49Very low86 Ų86105.7 Ų105.789%0.88753%0.533SS*.  trans-75.712.9-169.500000115
42R46.7Very low49.9Very low177 Ų177101.6 Ų101.667%0.66851%0.513SS*.SBendtrans-90.6131.3177.3-56.1-178.9-168.2-164.40.3107.9D40 F44D40-R42 PolarHBondContact O-N 3.22Å; R42-F44 HydrophobicContact CB-CD2 3.66Å; R42-F44 HydrophobicContact CB-CE2 3.55Å; R42-F44 HydrophobicContact CB-CZ 4.33Å; R42-F44 HydrophobicContact CG-CE2 4.11Å; R42-F44 PolarHBondContact O-N 2.76Å
43R44.5Very low51Low255 Ų255101.4 Ų101.496%0.96251%0.514SS*.  trans-62.679.4164.9-87.6-172.1-178.2-1641.5108.5I45R43-I45 PolarHBondContact O-N 2.72Å
44F44.5Very low52.4Low141 Ų141105.8 Ų105.862%0.61853%0.53SS*.  trans-74.1123169-82.7-77000108R42R42-F44 HydrophobicContact CB-CD2 3.66Å; R42-F44 HydrophobicContact CB-CE2 3.55Å; R42-F44 HydrophobicContact CB-CZ 4.33Å; R42-F44 HydrophobicContact CG-CE2 4.11Å; R42-F44 PolarHBondContact O-N 2.76Å
45I50.5Low53.6Low148 Ų148107.3 Ų107.376%0.75955%0.55SS**  trans-84.6116.6165.7-61.3163.8000104.1R43 I47R43-I45 PolarHBondContact O-N 2.72Å; I45-I47 PolarHBondContact O-N 3.05Å
46E52.2Low55.3Low78 Ų78102.7 Ų102.736%0.36453%0.532SS..  trans-56.2115170.2-71.7-172.1134.800107.8F36 T48 K49F36-E46 WeakPolarHBondContact CD1-OE1 3.4Å; F36-E46 WeakPolarHBondContact CE1-OE1 3.44Å; F36-E46 WeakPolarHBondContact CZ-OE1 3.43Å; E46-T48 VanDerWaalsContact C-N 3.33Å; E46-K49 IonicContact OE1-NZ 3.9Å; E46-K49 WeakPolarHBondContact OE2-CE 3.48Å; E46-K49 IonicContact OE2-NZ 2.68Å; E46-K49 PolarHBondContact OE2-NZ 2.93Å
47I54.2Low56.7Low112 Ų112104.6 Ų104.657%0.57455%0.547SS*.  trans-71.7-35.1-175.2-56-180000109.8I45I45-I47 PolarHBondContact O-N 3.05Å
48T59.3Low58.4Low49 Ų49100.4 Ų100.430%0.30153%0.532SS..  trans-171.7141.3-175.2166.70000112.5E46 F50 L58 E93E46-T48 VanDerWaalsContact C-N 3.33Å; T48-F50 VanDerWaalsContact OG1-CB 3.23Å; T48-F50 WeakPolarHBondContact OG1-CB 3.41Å; T48-F50 PolarHBondContact OG1-N 3Å; T48-L58 HydrophobicContact CG2-CD1 4.44Å; T48-L58 HydrophobicContact CG2-CD2 3.95Å; T48-E93 WeakPolarHBondContact CB-OE1 3.46Å; T48-E93 PolarHBondContact OG1-OE1 3.29Å
49K63.1Low60.1Low84 Ų8496.6 Ų96.637%0.36552%0.516SS..  trans-102.310.1168.8-73.9177.1175.21370112.6E46 G51E46-K49 IonicContact OE1-NZ 3.9Å; E46-K49 WeakPolarHBondContact OE2-CE 3.48Å; E46-K49 IonicContact OE2-NZ 2.68Å; E46-K49 PolarHBondContact OE2-NZ 2.93Å; K49-G51 PolarHBondContact O-N 3.47Å
50F66.7Low61.8Low26 Ų2691.2 Ų91.211%0.11449%0.49CS..  trans-77.2124.2-169.3-165.4-94.1000112T48 F52 E93 N95 Y99 L100 S101T48-F50 VanDerWaalsContact OG1-CB 3.23Å; T48-F50 WeakPolarHBondContact OG1-CB 3.41Å; T48-F50 PolarHBondContact OG1-N 3Å; F50-F52 HydrophobicContact CB-CE2 4.06Å; F50-F52 HydrophobicContact CB-CZ 4.02Å; F50-F52 AromaticContact CD1-CD1 3.65Å; F50-F52 HydrophobicContact CD1-CD1 3.65Å; F50-F52 HydrophobicContact CD1-CD2 4.2Å; F50-F52 AromaticContact CD1-CE1 3.44Å; F50-F52 HydrophobicContact CD1-CE1 3.44Å; F50-F52 VanDerWaalsContact CD1-CE1 3.44Å; F50-F52 AromaticContact CD1-CE2 4Å; F50-F52 HydrophobicContact CD1-CE2 4Å; F50-F52 HydrophobicContact CD1-CG 4.03Å; F50-F52 AromaticContact CD1-CZ 3.61Å; F50-F52 HydrophobicContact CD1-CZ 3.61Å; F50-F52 AromaticContact CE1-CD1 3.92Å; F50-F52 HydrophobicContact CE1-CD1 3.92Å; F50-F52 AromaticContact CE1-CE1 3.89Å; F50-F52 HydrophobicContact CE1-CE1 3.89Å; F50-F52 HydrophobicContact CE1-CZ 4.48Å; F50-F52 HydrophobicContact CG-CE1 4.4Å; F50-F52 HydrophobicContact CG-CZ 4.2Å; F50-F52 WeakPolarHBondContact O-CD2 3.31Å; F50-F52 VanDerWaalsContact O-CE2 3.28Å; F50-F52 WeakPolarHBondContact O-CE2 3.3Å; F50-F52 PolarHBondContact O-N 3.34Å; F50-E93 HydrophobicContact CB-CB 4.37Å; F50-E93 HydrophobicContact CB-CG 4.19Å; F50-E93 VanDerWaalsContact CB-OE2 3.29Å; F50-E93 WeakPolarHBondContact CB-OE2 3.43Å; F50-E93 HydrophobicContact CD1-CB 4.1Å; F50-E93 HydrophobicContact CD2-CB 3.84Å; F50-E93 HydrophobicContact CD2-CG 4.47Å; F50-E93 VanDerWaalsContact CD2-OE2 3.29Å; F50-E93 WeakPolarHBondContact CD2-OE2 3.46Å; F50-E93 HydrophobicContact CE1-CB 4.27Å; F50-E93 HydrophobicContact CE2-CB 4.05Å; F50-E93 HydrophobicContact CG-CB 3.86Å; F50-E93 HydrophobicContact CG-CG 4.23Å; F50-E93 HydrophobicContact CZ-CB 4.25Å; F50-N95 HydrophobicContact CE1-CB 4.47Å; F50-N95 WeakPolarHBondContact CE1-ND2 3.5Å; F50-N95 WeakPolarHBondContact CZ-ND2 3.25Å; F50-Y99 VanDerWaalsContact CE2-O 3.29Å; F50-Y99 WeakPolarHBondContact CE2-O 3.25Å; F50-L100 VanDerWaalsContact CE2-C 3.46Å; F50-L100 VanDerWaalsContact CZ-C 3.42Å; F50-L100 VanDerWaalsContact CZ-O 3.24Å; F50-L100 WeakPolarHBondContact CZ-O 3.47Å; F50-S101 VanDerWaalsContact CE2-N 3.28Å
51G67.1Low63.1Low18 Ų1892.9 Ų92.919%0.18649%0.489CS..  trans-75.3113.1171.600000110.9K49 N95 H102K49-G51 PolarHBondContact O-N 3.47Å; G51-N95 PolarHBondContact O-ND2 3.02Å; G51-H102 WeakPolarHBondContact O-CB 3.46Å; G51-H102 PolarHBondContact O-N 2.9Å
52F70.7Confident64Low77 Ų7793.6 Ų93.634%0.33847%0.472SS..PPolyproline II helixtrans-89.5135.1177.4-63.3-84.2000111.7F50 L58 E93 N95F50-F52 HydrophobicContact CB-CE2 4.06Å; F50-F52 HydrophobicContact CB-CZ 4.02Å; F50-F52 AromaticContact CD1-CD1 3.65Å; F50-F52 HydrophobicContact CD1-CD1 3.65Å; F50-F52 HydrophobicContact CD1-CD2 4.2Å; F50-F52 AromaticContact CD1-CE1 3.44Å; F50-F52 HydrophobicContact CD1-CE1 3.44Å; F50-F52 VanDerWaalsContact CD1-CE1 3.44Å; F50-F52 AromaticContact CD1-CE2 4Å; F50-F52 HydrophobicContact CD1-CE2 4Å; F50-F52 HydrophobicContact CD1-CG 4.03Å; F50-F52 AromaticContact CD1-CZ 3.61Å; F50-F52 HydrophobicContact CD1-CZ 3.61Å; F50-F52 AromaticContact CE1-CD1 3.92Å; F50-F52 HydrophobicContact CE1-CD1 3.92Å; F50-F52 AromaticContact CE1-CE1 3.89Å; F50-F52 HydrophobicContact CE1-CE1 3.89Å; F50-F52 HydrophobicContact CE1-CZ 4.48Å; F50-F52 HydrophobicContact CG-CE1 4.4Å; F50-F52 HydrophobicContact CG-CZ 4.2Å; F50-F52 WeakPolarHBondContact O-CD2 3.31Å; F50-F52 VanDerWaalsContact O-CE2 3.28Å; F50-F52 WeakPolarHBondContact O-CE2 3.3Å; F50-F52 PolarHBondContact O-N 3.34Å; F52-L58 HydrophobicContact CE1-CB 4.07Å; F52-L58 HydrophobicContact CZ-CB 3.76Å; F52-L58 HydrophobicContact CZ-CD1 4.18Å; F52-L58 HydrophobicContact CZ-CG 4.4Å; F52-E93 HydrophobicContact CZ-CG 4.27Å; F52-N95 WeakPolarHBondContact CA-OD1 3.44Å
53V75.1Confident64.8Low49 Ų4989.8 Ų89.830%0.29746%0.462SS..PPolyproline II helixtrans-84163.3165.4-177.40000109G55 G56 N95 H102 M105V53-G55 PolarHBondContact O-N 3.1Å; V53-G55 VanDerWaalsContact O-N 3.1Å; V53-G56 PolarHBondContact O-N 3.45Å; V53-N95 PolarHBondContact N-OD1 2.9Å; V53-H102 HydrophobicContact CG2-CB 3.89Å; V53-H102 WeakPolarHBondContact CG2-ND1 3.33Å; V53-M105 HydrophobicContact CG2-CE 3.58Å; V53-M105 HydrophobicContact CG2-SD 4.08Å
54V74.5Confident65.7Low142 Ų14282.7 Ų82.786%0.86144%0.443SS*.THydrogen-bonded Turntrans-49.8120.4169-1780000109.6
55G74.2Confident66.4Low60 Ų6081.2 Ų81.262%0.61944%0.436SS*.THydrogen-bonded Turntrans89.72.3-175.800000115.6V53V53-G55 PolarHBondContact O-N 3.1Å; V53-G55 VanDerWaalsContact O-N 3.1Å
56G74.6Confident66.5Low23 Ų2378.8 Ų78.824%0.23743%0.428CS..  trans-65.7144.8169.400000111.7V53 K94V53-G56 PolarHBondContact O-N 3.45Å; G56-K94 CarbonylContact C-O 3.59Å; G56-K94 WeakPolarHBondContact CA-O 3.44Å
57T71.2Confident66.6Low85 Ų8580.3 Ų80.352%0.52145%0.447SS..EExtended strand (participates in β ladder)trans-124132.8-176.256.30000110.4K94T57-K94 PolarHBondContact N-O 3.38Å; T57-K94 PolarHBondContact O-N 3.26Å; T57-K94 VanDerWaalsContact O-N 3.09Å
58L76.7Confident66.6Low72 Ų7280.8 Ų80.838%0.37746%0.457SS..EExtended strand (participates in β ladder)trans-107.2112.5168.7176.667.5000108.2T48 F52 V60 I91 E93T48-L58 HydrophobicContact CG2-CD1 4.44Å; T48-L58 HydrophobicContact CG2-CD2 3.95Å; F52-L58 HydrophobicContact CE1-CB 4.07Å; F52-L58 HydrophobicContact CZ-CB 3.76Å; F52-L58 HydrophobicContact CZ-CD1 4.18Å; F52-L58 HydrophobicContact CZ-CG 4.4Å; L58-V60 HydrophobicContact CD1-CG2 4.23Å; L58-V60 HydrophobicContact CD2-CG2 4.18Å; L58-V60 HydrophobicContact CG-CG2 3.93Å; L58-I91 HydrophobicContact CD1-CG2 3.53Å; L58-E93 HydrophobicContact CD1-CG 3.55Å
59E72.9Confident66Low83 Ų8385 Ų8539%0.38848%0.478SS..EExtended strand (participates in β ladder)trans-106.7110.6175.6-169.5-178.217200109.3R61 I92E59-R61 HydrophobicContact CG-CG 4.38Å; E59-R61 IonicContact OE1-CZ 3.15Å; E59-R61 IonicContact OE1-NE 2.74Å; E59-R61 PolarHBondContact OE1-NE 3.22Å; E59-R61 IonicContact OE1-NH2 2.72Å; E59-R61 PolarHBondContact OE1-NH2 2.9Å; E59-R61 IonicContact OE2-NH2 3.95Å; E59-I92 HydrophobicContact CB-CB 4.35Å; E59-I92 PolarHBondContact N-O 2.93Å; E59-I92 PolarHBondContact O-N 3.24Å
60V73Confident65.1Low57 Ų5789.2 Ų89.235%0.34550%0.501SS..EExtended strand (participates in β ladder)trans-104.1111.4177.3-176.70000108.6L58 L62 V89 I91L58-V60 HydrophobicContact CD1-CG2 4.23Å; L58-V60 HydrophobicContact CD2-CG2 4.18Å; L58-V60 HydrophobicContact CG-CG2 3.93Å; V60-L62 HydrophobicContact CG1-CD1 3.81Å; V60-L62 HydrophobicContact CG1-CG 3.9Å; V60-V89 HydrophobicContact CG1-CG1 4.08Å; V60-I91 HydrophobicContact CG1-CG1 4.29Å; V60-I91 HydrophobicContact CG2-CG1 4.44Å; V60-I91 HydrophobicContact CG2-CG2 4.44Å
61R67.5Low64Low128 Ų12897.2 Ų97.248%0.48354%0.539SS..EExtended strand (participates in β ladder)trans-102.8115.7172.2-57-176.8177.3-1751.9109.8E59 V89 S90E59-R61 HydrophobicContact CG-CG 4.38Å; E59-R61 IonicContact OE1-CZ 3.15Å; E59-R61 IonicContact OE1-NE 2.74Å; E59-R61 PolarHBondContact OE1-NE 3.22Å; E59-R61 IonicContact OE1-NH2 2.72Å; E59-R61 PolarHBondContact OE1-NH2 2.9Å; E59-R61 IonicContact OE2-NH2 3.95Å; R61-V89 WeakPolarHBondContact O-CA 3.27Å; R61-S90 WeakPolarHBondContact CB-OG 3.45Å; R61-S90 PolarHBondContact N-O 3.29Å; R61-S90 PolarHBondContact O-N 3.49Å
62L64.8Low62.8Low102 Ų102101.6 Ų101.653%0.53456%0.562SS.*EExtended strand (participates in β ladder)trans-102.1106.2-178.1-75.4141.1000107.4V60 F65 V89V60-L62 HydrophobicContact CG1-CD1 3.81Å; V60-L62 HydrophobicContact CG1-CG 3.9Å; L62-F65 VanDerWaalsContact C-CE2 3.48Å; L62-F65 VanDerWaalsContact CA-CE2 3.43Å; L62-F65 HydrophobicContact CB-CD2 3.57Å; L62-F65 HydrophobicContact CB-CE2 3.24Å; L62-F65 HydrophobicContact CB-CZ 3.94Å; L62-F65 HydrophobicContact CD2-CD2 4.27Å; L62-F65 HydrophobicContact CD2-CE1 3.73Å; L62-F65 HydrophobicContact CD2-CE2 3.37Å; L62-F65 HydrophobicContact CD2-CZ 3.05Å; L62-F65 HydrophobicContact CG-CE2 3.86Å; L62-F65 HydrophobicContact CG-CZ 4.05Å; L62-V89 HydrophobicContact CD2-CG1 4.12Å; L62-V89 HydrophobicContact CD2-CG2 4.08Å; L62-V89 HydrophobicContact CG-CG1 4.41Å
63Q63.5Low61.2Low96 Ų96109.4 Ų109.445%0.44959%0.589SS.*EExtended strand (participates in β ladder)trans-104.9140.7-179.2-62.4-1742.300111.6Q88Q63-Q88 PolarHBondContact N-O 3.05Å
64N64.4Low59.5Low107 Ų107112.5 Ų112.557%0.57261%0.613SS**SBendtrans63.142.2175.4-55-36.1000115.3
65F58.4Low57.8Low109 Ų109110.6 Ų110.648%0.47861%0.612SS.*  trans-75.6127.4173.2-77.7-96.2000110.7L62 V87 V89L62-F65 VanDerWaalsContact C-CE2 3.48Å; L62-F65 VanDerWaalsContact CA-CE2 3.43Å; L62-F65 HydrophobicContact CB-CD2 3.57Å; L62-F65 HydrophobicContact CB-CE2 3.24Å; L62-F65 HydrophobicContact CB-CZ 3.94Å; L62-F65 HydrophobicContact CD2-CD2 4.27Å; L62-F65 HydrophobicContact CD2-CE1 3.73Å; L62-F65 HydrophobicContact CD2-CE2 3.37Å; L62-F65 HydrophobicContact CD2-CZ 3.05Å; L62-F65 HydrophobicContact CG-CE2 3.86Å; L62-F65 HydrophobicContact CG-CZ 4.05Å; F65-V87 HydrophobicContact CE1-CG1 4.3Å; F65-V87 HydrophobicContact CE2-CG1 4.12Å; F65-V87 HydrophobicContact CZ-CG1 3.63Å; F65-V89 HydrophobicContact CE2-CG2 4.46Å; F65-V89 HydrophobicContact CZ-CG2 4.03Å
66T52.8Low56.1Low97 Ų97117.1 Ų117.160%0.59562%0.623SS**  trans-109.6112168.1-45.90000107.3P68T66-P68 WeakPolarHBondContact O-CD 3.25Å
67C54.7Low54.4Low110 Ų110124 Ų12474%0.74365%0.649SS**  trans-72.5123.3171.5-65.10000107.9N69C67-N69 PolarHBondContact O-N 3.35Å; C67-N69 VanDerWaalsContact O-N 3.12Å
68P53.5Low52.7Low122 Ų122129.6 Ų129.679%0.79267%0.669SS**  trans-58.4123.6169.523.5-29.7000107.5T66 M70T66-P68 WeakPolarHBondContact O-CD 3.25Å; P68-M70 PolarHBondContact O-N 3.23Å
69N46.4Very low50.9Low138 Ų138130.9 Ų130.974%0.73868%0.68SS**  trans-49.1112.4-177.7-1668.2000108.4C67 E71C67-N69 PolarHBondContact O-N 3.35Å; C67-N69 VanDerWaalsContact O-N 3.12Å; N69-E71 PolarHBondContact O-N 2.74Å; N69-E71 VanDerWaalsContact O-N 3.11Å
70M45.8Very low49.2Very low173 Ų173138.7 Ų138.785%0.85271%0.706SS**  trans-51.4124.8167.1-81.5-166.5-163.300105.7P68 T72P68-M70 PolarHBondContact O-N 3.23Å; M70-T72 PolarHBondContact O-N 2.84Å
71E42.9Very low47.9Very low194 Ų194141.8 Ų141.891%0.90773%0.725SS**  trans-52.688.2-176.7-144.1162.2-165.900109.7N69 R73N69-E71 PolarHBondContact O-N 2.74Å; N69-E71 VanDerWaalsContact O-N 3.11Å; E71-R73 VanDerWaalsContact C-N 3.31Å; E71-R73 PolarHBondContact O-N 2.88Å
72T40.6Very low46.5Very low109 Ų109144.1 Ų144.167%0.66974%0.74SS**  trans-63.3103.4165.219.30000104.4M70 S74M70-T72 PolarHBondContact O-N 2.84Å; T72-S74 PolarHBondContact O-N 2.86Å
73R37.9Very low45.6Very low242 Ų242149.5 Ų149.591%0.91375%0.754SS**SBendtrans-46.991.3159.4-82178.5161.6-172.6-4.4108.8E71E71-R73 VanDerWaalsContact C-N 3.31Å; E71-R73 PolarHBondContact O-N 2.88Å
74S38.8Very low44.7Very low114 Ų114150.6 Ų150.680%0.79777%0.772SS**  trans-177.8128.3139.2-89.10000109T72T72-S74 PolarHBondContact O-N 2.86Å
75A40.4Very low44Very low101 Ų101148 Ų14884%0.83576%0.762SS**  trans-41.9149.1-177.200000114.8
76K38.5Very low43.6Very low198 Ų198152.5 Ų152.586%0.86178%0.776SS**  trans92.758.4146-140.6-179.4-167.3-1760116.8
77E38.1Very low43.7Very low167 Ų167152 Ų15278%0.7877%0.773SS**  trans-145.186.6153.2-156.973.3-131.900109.1V79E77-V79 VanDerWaalsContact C-N 3.26Å; E77-V79 HydrophobicContact CG-CG2 4.11Å; E77-V79 PolarHBondContact O-N 3.17Å
78Q34.4Very low43.9Very low203 Ų203151.8 Ų151.895%0.94976%0.761SS**  trans-76.179.1170-79.5-168-1800109.2
79V40.7Very low44.4Very low98 Ų98149.2 Ų149.259%0.59474%0.742SS**  trans-112.7108.3164.4178.40000107.6E77 V81E77-V79 VanDerWaalsContact C-N 3.26Å; E77-V79 HydrophobicContact CG-CG2 4.11Å; E77-V79 PolarHBondContact O-N 3.17Å; V79-V81 PolarHBondContact O-N 3.17Å
80R35.3Very low45.3Very low247 Ų247145.1 Ų145.193%0.93273%0.725SS**  trans-55.391.3173.9-84.5-173.1-92.3-151.6-7.1110.5H82R80-H82 VanDerWaalsContact C-N 3.27Å; R80-H82 PolarHBondContact O-N 3.07Å; R80-H82 VanDerWaalsContact O-N 3.08Å
81V46.5Very low46.6Very low123 Ų123140.3 Ų140.375%0.74570%0.702SS**  trans-83.675.6169-173.10000108.5V79V79-V81 PolarHBondContact O-N 3.17Å
82H39.3Very low48Very low176 Ų176134.5 Ų134.582%0.81568%0.676SS**  trans-98.866.7167.4-153.882.3000108.9R80R80-H82 VanDerWaalsContact C-N 3.27Å; R80-H82 PolarHBondContact O-N 3.07Å; R80-H82 VanDerWaalsContact O-N 3.08Å
83R44.3Very low49.7Very low215 Ų215131.8 Ų131.881%0.81166%0.656SS**  trans-102.388.4168.4-99.2-173.4179.4138.50.1108.9S85R83-S85 PolarHBondContact O-N 3.3Å; R83-S85 PolarHBondContact O-OG 3.36Å
84S44.8Very low51.5Low120 Ų120124.1 Ų124.184%0.83963%0.629SS**  trans-61.599.6162.4-176.60000108
85S49.6Very low53.4Low51 Ų51118.7 Ų118.736%0.35759%0.591SS.*  trans-98.9127.7178.2-55.10000108R83 V87R83-S85 PolarHBondContact O-N 3.3Å; R83-S85 PolarHBondContact O-OG 3.36Å; S85-V87 PolarHBondContact O-N 3.27Å
86R49.7Very low55Low205 Ų205117.6 Ų117.677%0.77458%0.575SS**  trans-61.7107.7-179.7-171.5-175.5-61.7-177.51.6109.1Q88R86-Q88 PolarHBondContact O-N 3.41Å
87V56.4Low56.8Low87 Ų87114 Ų11453%0.52757%0.57SS.*  trans-67.5120.3175.2177.70000108.2F65 S85 V89F65-V87 HydrophobicContact CE1-CG1 4.3Å; F65-V87 HydrophobicContact CE2-CG1 4.12Å; F65-V87 HydrophobicContact CZ-CG1 3.63Å; S85-V87 PolarHBondContact O-N 3.27Å; V87-V89 HydrophobicContact CG1-CG2 3.78Å
88Q57.1Low58.6Low105 Ų105106.8 Ų106.849%0.49154%0.539SS..EExtended strand (participates in β ladder)trans-115.2116.2169.7-67.2-17014.100107.9Q63 R86Q63-Q88 PolarHBondContact N-O 3.05Å; R86-Q88 PolarHBondContact O-N 3.41Å
89V65.5Low60.7Low67 Ų67100.7 Ų100.741%0.40651%0.507SS..EExtended strand (participates in β ladder)trans-109.8117.9174.1-171.30000106.4V60 R61 L62 F65 V87 I91V60-V89 HydrophobicContact CG1-CG1 4.08Å; R61-V89 WeakPolarHBondContact O-CA 3.27Å; L62-V89 HydrophobicContact CD2-CG1 4.12Å; L62-V89 HydrophobicContact CD2-CG2 4.08Å; L62-V89 HydrophobicContact CG-CG1 4.41Å; F65-V89 HydrophobicContact CE2-CG2 4.46Å; F65-V89 HydrophobicContact CZ-CG2 4.03Å; V87-V89 HydrophobicContact CG1-CG2 3.78Å; V89-I91 HydrophobicContact CG1-CD1 4.3Å; V89-I91 HydrophobicContact CG1-CG1 3.92Å
90S65.3Low62.6Low52 Ų5296.6 Ų96.636%0.36448%0.482SS..EExtended strand (participates in β ladder)trans-106.4115.7171.166.50000108.6R61R61-S90 WeakPolarHBondContact CB-OG 3.45Å; R61-S90 PolarHBondContact N-O 3.29Å; R61-S90 PolarHBondContact O-N 3.49Å
91I71.7Confident64.5Low72 Ų7285 Ų8537%0.36944%0.439SS..EExtended strand (participates in β ladder)trans-104.8123.6178.1-58.6173.6000106.9L58 V60 V89 E93L58-I91 HydrophobicContact CD1-CG2 3.53Å; V60-I91 HydrophobicContact CG1-CG1 4.29Å; V60-I91 HydrophobicContact CG2-CG1 4.44Å; V60-I91 HydrophobicContact CG2-CG2 4.44Å; V89-I91 HydrophobicContact CG1-CD1 4.3Å; V89-I91 HydrophobicContact CG1-CG1 3.92Å; I91-E93 HydrophobicContact CG2-CG 4.06Å
92I73.1Confident65.6Low72 Ų7284.2 Ų84.237%0.36943%0.427SS..EExtended strand (participates in β ladder)trans-114.6116.9175.4-56.7172.8000107.7E59E59-I92 HydrophobicContact CB-CB 4.35Å; E59-I92 PolarHBondContact N-O 2.93Å; E59-I92 PolarHBondContact O-N 3.24Å
93E75.8Confident66.9Low52 Ų5276.5 Ų76.524%0.24340%0.395CS..EExtended strand (participates in β ladder)trans-109.3121.2178.8-69.1168.8168.600108.9T48 F50 F52 L58 I91 Y99T48-E93 WeakPolarHBondContact CB-OE1 3.46Å; T48-E93 PolarHBondContact OG1-OE1 3.29Å; F50-E93 HydrophobicContact CB-CB 4.37Å; F50-E93 HydrophobicContact CB-CG 4.19Å; F50-E93 VanDerWaalsContact CB-OE2 3.29Å; F50-E93 WeakPolarHBondContact CB-OE2 3.43Å; F50-E93 HydrophobicContact CD1-CB 4.1Å; F50-E93 HydrophobicContact CD2-CB 3.84Å; F50-E93 HydrophobicContact CD2-CG 4.47Å; F50-E93 VanDerWaalsContact CD2-OE2 3.29Å; F50-E93 WeakPolarHBondContact CD2-OE2 3.46Å; F50-E93 HydrophobicContact CE1-CB 4.27Å; F50-E93 HydrophobicContact CE2-CB 4.05Å; F50-E93 HydrophobicContact CG-CB 3.86Å; F50-E93 HydrophobicContact CG-CG 4.23Å; F50-E93 HydrophobicContact CZ-CB 4.25Å; F52-E93 HydrophobicContact CZ-CG 4.27Å; L58-E93 HydrophobicContact CD1-CG 3.55Å; I91-E93 HydrophobicContact CG2-CG 4.06Å; E93-Y99 WeakPolarHBondContact O-CD1 3.42Å
94K75.5Confident68.4Low81 Ų8168.7 Ų68.735%0.35237%0.368SS..EExtended strand (participates in β ladder)trans-139130.8-178.6-177.5172.5-177.11710110.8G56 T57 Y99G56-K94 CarbonylContact C-O 3.59Å; G56-K94 WeakPolarHBondContact CA-O 3.44Å; T57-K94 PolarHBondContact N-O 3.38Å; T57-K94 PolarHBondContact O-N 3.26Å; T57-K94 VanDerWaalsContact O-N 3.09Å; K94-Y99 HydrophobicContact CB-CD1 4.13Å; K94-Y99 HydrophobicContact CB-CE1 4.02Å; K94-Y99 HydrophobicContact CD-CD1 4.5Å; K94-Y99 HydrophobicContact CD-CE1 3.8Å; K94-Y99 HydrophobicContact CD-CE2 4.49Å; K94-Y99 HydrophobicContact CG-CD1 4.2Å; K94-Y99 HydrophobicContact CG-CE1 3.98Å; K94-Y99 PolarHBondContact NZ-OH 3.43Å
95N78.9Confident69.8Low0 Ų065.1 Ų65.10%034%0.338CS..BIsolated β-bridgetrans-92157162.3-78.2-40.1000110F50 G51 F52 V53 T97 S98 L100 M105F50-N95 HydrophobicContact CE1-CB 4.47Å; F50-N95 WeakPolarHBondContact CE1-ND2 3.5Å; F50-N95 WeakPolarHBondContact CZ-ND2 3.25Å; G51-N95 PolarHBondContact O-ND2 3.02Å; F52-N95 WeakPolarHBondContact CA-OD1 3.44Å; V53-N95 PolarHBondContact N-OD1 2.9Å; N95-T97 PolarHBondContact O-N 3.05Å; N95-S98 CarbonylContact C-O 3.59Å; N95-S98 WeakPolarHBondContact CA-O 3.32Å; N95-S98 VanDerWaalsContact CB-O 3.27Å; N95-S98 WeakPolarHBondContact CB-O 3.44Å; N95-S98 PolarHBondContact N-O 3.19Å; N95-S98 PolarHBondContact O-N 3.04Å; N95-S98 VanDerWaalsContact O-O 3.05Å; N95-L100 PolarHBondContact ND2-O 3.48Å; N95-M105 HydrophobicContact CB-CE 3.3Å; N95-M105 VanDerWaalsContact CG-CE 3.43Å; N95-M105 WeakPolarHBondContact ND2-CE 3.22Å
96P74.5Confident71.4Confident78 Ų7865.4 Ų65.451%0.50634%0.339SS..THydrogen-bonded Turntrans-53.2-35-171.9-25.932.8000113.9
97T76.2Confident72.9Confident122 Ų12255.9 Ų55.975%0.74830%0.303SS*.THydrogen-bonded Turntrans-103.3-18-175.353.80000114.1N95N95-T97 PolarHBondContact O-N 3.05Å
98S76.5Confident74.3Confident17 Ų1752.1 Ų52.112%0.11928%0.281CS..BIsolated β-bridgetrans-163.9158.5-171.159.30000113N95 L100 G165N95-S98 CarbonylContact C-O 3.59Å; N95-S98 WeakPolarHBondContact CA-O 3.32Å; N95-S98 VanDerWaalsContact CB-O 3.27Å; N95-S98 WeakPolarHBondContact CB-O 3.44Å; N95-S98 PolarHBondContact N-O 3.19Å; N95-S98 PolarHBondContact O-N 3.04Å; N95-S98 VanDerWaalsContact O-O 3.05Å; S98-L100 PolarHBondContact O-N 3.26Å; S98-G165 WeakPolarHBondContact CA-O 3.36Å
99Y79.2Confident75.7Confident75 Ų7550.8 Ų50.829%0.29428%0.283SS..SBendtrans-835.8169.7-66.1-88.4000113.5F50 E93 K94 G165 I166 G168F50-Y99 VanDerWaalsContact CE2-O 3.29Å; F50-Y99 WeakPolarHBondContact CE2-O 3.25Å; E93-Y99 WeakPolarHBondContact O-CD1 3.42Å; K94-Y99 HydrophobicContact CB-CD1 4.13Å; K94-Y99 HydrophobicContact CB-CE1 4.02Å; K94-Y99 HydrophobicContact CD-CD1 4.5Å; K94-Y99 HydrophobicContact CD-CE1 3.8Å; K94-Y99 HydrophobicContact CD-CE2 4.49Å; K94-Y99 HydrophobicContact CG-CD1 4.2Å; K94-Y99 HydrophobicContact CG-CE1 3.98Å; K94-Y99 PolarHBondContact NZ-OH 3.43Å; Y99-G165 PolarHBondContact N-O 3.32Å; Y99-I166 WeakPolarHBondContact CD2-O 3.33Å; Y99-I166 WeakPolarHBondContact CE2-O 3.43Å; Y99-G168 VanDerWaalsContact CG-CA 3.48Å
100L79.3Confident76.6Confident11 Ų1149.4 Ų49.46%0.05827%0.273CS..SBendtrans-84.7146.8173.9-75.4142.3000111.5F50 N95 S98 E104 M105 P108 M161F50-L100 VanDerWaalsContact CE2-C 3.46Å; F50-L100 VanDerWaalsContact CZ-C 3.42Å; F50-L100 VanDerWaalsContact CZ-O 3.24Å; F50-L100 WeakPolarHBondContact CZ-O 3.47Å; N95-L100 PolarHBondContact ND2-O 3.48Å; S98-L100 PolarHBondContact O-N 3.26Å; L100-E104 HydrophobicContact CD2-CB 3.97Å; L100-M105 HydrophobicContact CB-CG 4.42Å; L100-P108 HydrophobicContact CD1-CG 4.24Å; L100-M161 HydrophobicContact CD2-SD 4.38Å
101S75.3Confident77.7Confident4 Ų448.1 Ų48.13%0.02826%0.261CS..  trans-63.5153.617274.30000110.8F50 G103 E104 M105F50-S101 VanDerWaalsContact CE2-N 3.28Å; S101-G103 VanDerWaalsContact C-N 3.34Å; S101-G103 PolarHBondContact O-N 3.01Å; S101-E104 PolarHBondContact O-N 3.37Å; S101-E104 WeakPolarHBondContact OG-CB 3.34Å; S101-E104 VanDerWaalsContact OG-CG 3.25Å; S101-E104 WeakPolarHBondContact OG-CG 3.3Å; S101-E104 PolarHBondContact OG-OE2 2.72Å; S101-M105 WeakPolarHBondContact O-CG 3.47Å; S101-M105 PolarHBondContact O-N 3.34Å
102H69.2Low78.5Confident106 Ų10648.4 Ų48.449%0.49126%0.261SS..THydrogen-bonded Turntrans-52.2-45.7-171.9-179.745.9000114.2G51 V53 E104G51-H102 WeakPolarHBondContact O-CB 3.46Å; G51-H102 PolarHBondContact O-N 2.9Å; V53-H102 HydrophobicContact CG2-CB 3.89Å; V53-H102 WeakPolarHBondContact CG2-ND1 3.33Å; H102-E104 VanDerWaalsContact C-N 3.3Å; H102-E104 PolarHBondContact O-N 2.88Å
103G68.3Low79.2Confident14 Ų1449.2 Ų49.214%0.14427%0.269CS..THydrogen-bonded Turntrans-79-12.4-179.900000114.1L32 S101 P106L32-G103 VanDerWaalsContact CD1-N 3.34Å; S101-G103 VanDerWaalsContact C-N 3.34Å; S101-G103 PolarHBondContact O-N 3.01Å; G103-P106 WeakPolarHBondContact O-CD 3.44Å
104E74.7Confident79.8Confident51 Ų5148.3 Ų48.324%0.23827%0.265CS..THydrogen-bonded Turntrans-94.9-13.4175.3-66.2179.6137.300113.3L100 S101 H102 P106 V107 P108L100-E104 HydrophobicContact CD2-CB 3.97Å; S101-E104 PolarHBondContact O-N 3.37Å; S101-E104 WeakPolarHBondContact OG-CB 3.34Å; S101-E104 VanDerWaalsContact OG-CG 3.25Å; S101-E104 WeakPolarHBondContact OG-CG 3.3Å; S101-E104 PolarHBondContact OG-OE2 2.72Å; H102-E104 VanDerWaalsContact C-N 3.3Å; H102-E104 PolarHBondContact O-N 2.88Å; E104-P106 VanDerWaalsContact C-CD 3.45Å; E104-P106 VanDerWaalsContact C-N 3.33Å; E104-V107 HydrophobicContact CB-CG2 4.34Å; E104-V107 HydrophobicContact CG-CG2 4.47Å; E104-V107 VanDerWaalsContact O-CB 3.26Å; E104-V107 WeakPolarHBondContact O-CB 3.49Å; E104-V107 PolarHBondContact O-N 2.89Å; E104-P108 WeakPolarHBondContact O-CD 3.34Å
105M74.3Confident80.6Confident46 Ų4644.7 Ų44.723%0.22725%0.25CC..THydrogen-bonded Turntrans-49.5-43.1173.4-67.6-180-17900114.3V53 N95 L100 S101 P108V53-M105 HydrophobicContact CG2-CE 3.58Å; V53-M105 HydrophobicContact CG2-SD 4.08Å; N95-M105 HydrophobicContact CB-CE 3.3Å; N95-M105 VanDerWaalsContact CG-CE 3.43Å; N95-M105 WeakPolarHBondContact ND2-CE 3.22Å; L100-M105 HydrophobicContact CB-CG 4.42Å; S101-M105 WeakPolarHBondContact O-CG 3.47Å; S101-M105 PolarHBondContact O-N 3.34Å; M105-P108 WeakPolarHBondContact O-CD 3.44Å
106P82.5Confident81.2Confident56 Ų5647.6 Ų47.636%0.36427%0.273SS..THydrogen-bonded Turntrans-81.3-15.1177.932.3-36.3000113.8G103 E104 S109 I110G103-P106 WeakPolarHBondContact O-CD 3.44Å; E104-P106 VanDerWaalsContact C-CD 3.45Å; E104-P106 VanDerWaalsContact C-N 3.33Å; P106-S109 PolarHBondContact O-N 2.9Å; P106-I110 HydrophobicContact CB-CD1 4.33Å; P106-I110 VanDerWaalsContact O-CG1 3.31Å; P106-I110 WeakPolarHBondContact O-CG1 3.32Å; P106-I110 PolarHBondContact O-N 3.45Å; P106-I110 VanDerWaalsContact O-N 3.12Å
107V81.8Confident81.9Confident5 Ų546.7 Ų46.73%0.0326%0.264CS..Hα-helixtrans-59.2-46.9-174.2175.90000113.7L28 E104 S109 I110 Y111L28-V107 HydrophobicContact CB-CG2 4.43Å; L28-V107 HydrophobicContact CD1-CG2 3.99Å; E104-V107 HydrophobicContact CB-CG2 4.34Å; E104-V107 HydrophobicContact CG-CG2 4.47Å; E104-V107 VanDerWaalsContact O-CB 3.26Å; E104-V107 WeakPolarHBondContact O-CB 3.49Å; E104-V107 PolarHBondContact O-N 2.89Å; V107-S109 VanDerWaalsContact C-N 3.34Å; V107-S109 PolarHBondContact O-N 3.25Å; V107-I110 WeakPolarHBondContact O-CB 3.44Å; V107-I110 PolarHBondContact O-N 3.25Å; V107-Y111 HydrophobicContact CG1-CD2 3.56Å; V107-Y111 HydrophobicContact CG1-CE2 3.35Å; V107-Y111 VanDerWaalsContact O-CD2 3.28Å; V107-Y111 WeakPolarHBondContact O-CD2 3.44Å; V107-Y111 PolarHBondContact O-N 3.43Å
108P86.4Confident82.6Confident9 Ų940.9 Ų40.96%0.05823%0.228CC..Hα-helixtrans-59.4-44.1179.121.3-32.5000112L100 E104 M105 I110 Y111 M112 M161L100-P108 HydrophobicContact CD1-CG 4.24Å; E104-P108 WeakPolarHBondContact O-CD 3.34Å; M105-P108 WeakPolarHBondContact O-CD 3.44Å; P108-I110 VanDerWaalsContact C-N 3.3Å; P108-I110 PolarHBondContact O-N 2.89Å; P108-Y111 PolarHBondContact O-N 3.25Å; P108-M112 WeakPolarHBondContact O-CG 3.4Å; P108-M112 PolarHBondContact O-N 3.24Å; P108-M161 HydrophobicContact CB-CB 4.04Å
109S85.9Confident83.4Confident77 Ų7745.1 Ų45.154%0.53824%0.244SC..Hα-helixtrans-60.7-40.3177.4-58.80000112.1P106 V107 M112 V113P106-S109 PolarHBondContact O-N 2.9Å; V107-S109 VanDerWaalsContact C-N 3.34Å; V107-S109 PolarHBondContact O-N 3.25Å; S109-M112 PolarHBondContact O-N 3.02Å; S109-V113 WeakPolarHBondContact O-CG2 3.21Å; S109-V113 PolarHBondContact O-N 2.75Å
110I85.1Confident84Confident38 Ų3844.3 Ų44.320%0.19525%0.253CS..Hα-helixtrans-61.1-48.2176-68.9167.2000110.4L28 P106 V107 P108 M112 V113 F114L28-I110 HydrophobicContact CD1-CD1 3.47Å; L28-I110 VanDerWaalsContact CD1-CD1 3.47Å; P106-I110 HydrophobicContact CB-CD1 4.33Å; P106-I110 VanDerWaalsContact O-CG1 3.31Å; P106-I110 WeakPolarHBondContact O-CG1 3.32Å; P106-I110 PolarHBondContact O-N 3.45Å; P106-I110 VanDerWaalsContact O-N 3.12Å; V107-I110 WeakPolarHBondContact O-CB 3.44Å; V107-I110 PolarHBondContact O-N 3.25Å; P108-I110 VanDerWaalsContact C-N 3.3Å; P108-I110 PolarHBondContact O-N 2.89Å; I110-M112 VanDerWaalsContact C-N 3.32Å; I110-M112 PolarHBondContact O-N 3.42Å; I110-V113 PolarHBondContact O-N 3.38Å; I110-F114 HydrophobicContact CG2-CD2 3.51Å; I110-F114 HydrophobicContact CG2-CE2 3.52Å; I110-F114 VanDerWaalsContact O-CD2 3.22Å; I110-F114 WeakPolarHBondContact O-CD2 3.25Å; I110-F114 PolarHBondContact O-N 2.88Å
111Y87.1Confident84.5Confident25 Ų2545.4 Ų45.410%0.09826%0.259CS..Hα-helixtrans-60.9-38.7176.7-81.1-73.7000112.7I25 V107 P108 F114 S115 V154 H157I25-Y111 HydrophobicContact CD1-CD1 4.49Å; I25-Y111 HydrophobicContact CD1-CE1 3.6Å; I25-Y111 HydrophobicContact CD1-CE2 4.01Å; I25-Y111 VanDerWaalsContact CD1-OH 3.22Å; I25-Y111 WeakPolarHBondContact CD1-OH 3.44Å; I25-Y111 HydrophobicContact CG1-CE2 4.22Å; V107-Y111 HydrophobicContact CG1-CD2 3.56Å; V107-Y111 HydrophobicContact CG1-CE2 3.35Å; V107-Y111 VanDerWaalsContact O-CD2 3.28Å; V107-Y111 WeakPolarHBondContact O-CD2 3.44Å; V107-Y111 PolarHBondContact O-N 3.43Å; P108-Y111 PolarHBondContact O-N 3.25Å; Y111-F114 PolarHBondContact O-N 3.28Å; Y111-S115 VanDerWaalsContact O-CB 3.31Å; Y111-S115 WeakPolarHBondContact O-CB 3.38Å; Y111-S115 PolarHBondContact O-N 3.05Å; Y111-V154 HydrophobicContact CD1-CB 4.46Å; Y111-V154 HydrophobicContact CD1-CG1 3.69Å; Y111-V154 HydrophobicContact CG-CG1 4.48Å; Y111-V154 WeakPolarHBondContact O-CG1 3.34Å; Y111-H157 HydrophobicContact CD1-CB 4.48Å; Y111-H157 AromaticContact CD2-CD2 3.69Å; Y111-H157 AromaticContact CE1-CD2 3.61Å; Y111-H157 AromaticContact CE2-CD2 3.25Å; Y111-H157 WeakPolarHBondContact CE2-CD2 3.27Å; Y111-H157 AromaticContact CE2-NE2 3.67Å; Y111-H157 AromaticContact CZ-CD2 3.19Å; Y111-H157 AromaticContact CZ-NE2 3.63Å; Y111-H157 PolarHBondContact OH-CD2 2.97Å; Y111-H157 PolarHBondContact OH-NE2 2.87Å
112M88.5Confident85.3Confident78 Ų7847.3 Ų47.338%0.38427%0.267SS..Hα-helixtrans-63.2-45.7176.8-68.1-60.4-68.300112P108 S109 I110 S115 A116 L155 L159P108-M112 WeakPolarHBondContact O-CG 3.4Å; P108-M112 PolarHBondContact O-N 3.24Å; S109-M112 PolarHBondContact O-N 3.02Å; I110-M112 VanDerWaalsContact C-N 3.32Å; I110-M112 PolarHBondContact O-N 3.42Å; M112-S115 PolarHBondContact O-N 2.79Å; M112-A116 PolarHBondContact O-N 3.01Å; M112-L155 HydrophobicContact CE-CD1 3.88Å; M112-L155 HydrophobicContact SD-CD1 3.79Å; M112-L159 HydrophobicContact CE-CD2 4.45Å; M112-L159 HydrophobicContact SD-CD2 4.31Å; M112-L159 HydrophobicContact SD-CG 4.5Å
113V89.5Confident86.4Confident89 Ų8945 Ų4554%0.53926%0.262SS..Hα-helixtrans-63.5-47.3177.2172.90000111S109 I110 S115 A116 I117S109-V113 WeakPolarHBondContact O-CG2 3.21Å; S109-V113 PolarHBondContact O-N 2.75Å; I110-V113 PolarHBondContact O-N 3.38Å; V113-S115 VanDerWaalsContact C-N 3.3Å; V113-S115 PolarHBondContact O-N 3.47Å; V113-A116 PolarHBondContact O-N 3.37Å; V113-I117 HydrophobicContact CG1-CD1 4.01Å; V113-I117 WeakPolarHBondContact O-CG1 3Å; V113-I117 PolarHBondContact O-N 3.43Å
114F87.6Confident87.4Confident33 Ų3350.2 Ų50.215%0.14528%0.281CS..Hα-helixtrans-62.8-37.3177.5-84-70.3000112.2C21 I110 Y111 I117 F118 V154C21-F114 HydrophobicContact CB-CD1 3.98Å; C21-F114 HydrophobicContact CB-CD2 4.1Å; C21-F114 HydrophobicContact CB-CE1 3.9Å; C21-F114 HydrophobicContact CB-CE2 4.03Å; C21-F114 HydrophobicContact CB-CG 4.09Å; C21-F114 HydrophobicContact CB-CZ 3.94Å; I110-F114 HydrophobicContact CG2-CD2 3.51Å; I110-F114 HydrophobicContact CG2-CE2 3.52Å; I110-F114 VanDerWaalsContact O-CD2 3.22Å; I110-F114 WeakPolarHBondContact O-CD2 3.25Å; I110-F114 PolarHBondContact O-N 2.88Å; Y111-F114 PolarHBondContact O-N 3.28Å; F114-I117 PolarHBondContact O-N 3.01Å; F114-F118 HydrophobicContact CB-CE2 4.36Å; F114-F118 HydrophobicContact CD1-CE2 4.49Å; F114-F118 WeakPolarHBondContact O-CD2 3.46Å; F114-F118 PolarHBondContact O-N 3.32Å; F114-V154 HydrophobicContact CB-CG1 4.23Å
115S91.8Very high88Confident5 Ų548.6 Ų48.64%0.03527%0.272CS..Hα-helixtrans-61.7-45.8175.5-175.10000111.2Y111 M112 V113 I117 F118 F119 S151 L155Y111-S115 VanDerWaalsContact O-CB 3.31Å; Y111-S115 WeakPolarHBondContact O-CB 3.38Å; Y111-S115 PolarHBondContact O-N 3.05Å; M112-S115 PolarHBondContact O-N 2.79Å; V113-S115 VanDerWaalsContact C-N 3.3Å; V113-S115 PolarHBondContact O-N 3.47Å; S115-I117 VanDerWaalsContact C-N 3.31Å; S115-I117 PolarHBondContact O-N 3Å; S115-F118 PolarHBondContact O-N 2.89Å; S115-F119 WeakPolarHBondContact O-CB 3.31Å; S115-F119 PolarHBondContact O-N 3.43Å; S115-S151 PolarHBondContact O-OG 3.49Å; S115-S151 PolarHBondContact OG-O 3.43Å; S115-L155 VanDerWaalsContact OG-CB 3.32Å; S115-L155 WeakPolarHBondContact OG-CB 3.35Å
116A91.9Very high88.6Confident60 Ų6047.8 Ų47.850%0.49627%0.272SS..Hα-helixtrans-59.9-40.8176.300000112.3M112 V113 F119 A120M112-A116 PolarHBondContact O-N 3.01Å; V113-A116 PolarHBondContact O-N 3.37Å; A116-F119 PolarHBondContact O-N 2.88Å; A116-A120 WeakPolarHBondContact O-CB 3.44Å; A116-A120 PolarHBondContact O-N 2.9Å
117I90Very high88.9Confident60 Ų6051.6 Ų51.631%0.30828%0.283SS..Hα-helixtrans-63.4-48.2175.9-66.5167.2000110.9V113 F114 S115 F119 A120 L121V113-I117 HydrophobicContact CG1-CD1 4.01Å; V113-I117 WeakPolarHBondContact O-CG1 3Å; V113-I117 PolarHBondContact O-N 3.43Å; F114-I117 PolarHBondContact O-N 3.01Å; S115-I117 VanDerWaalsContact C-N 3.31Å; S115-I117 PolarHBondContact O-N 3Å; I117-F119 VanDerWaalsContact C-N 3.29Å; I117-F119 PolarHBondContact O-N 3.31Å; I117-A120 PolarHBondContact O-N 3.19Å; I117-L121 HydrophobicContact CG2-CD1 4.23Å; I117-L121 WeakPolarHBondContact O-CG 3.37Å; I117-L121 PolarHBondContact O-N 3.28Å
118F89.8Confident89.1Confident0 Ų053.4 Ų53.40%029%0.292CS..Hα-helixtrans-63.1-36.9177.9-75-58.8000112.2V14 F17 A18 F114 S115 L121 F122 V147 K150V14-F118 HydrophobicContact CG1-CE1 4.38Å; F17-F118 HydrophobicContact CB-CE1 4.2Å; F17-F118 HydrophobicContact CB-CZ 4.12Å; A18-F118 HydrophobicContact CB-CZ 4.27Å; F114-F118 HydrophobicContact CB-CE2 4.36Å; F114-F118 HydrophobicContact CD1-CE2 4.49Å; F114-F118 WeakPolarHBondContact O-CD2 3.46Å; F114-F118 PolarHBondContact O-N 3.32Å; S115-F118 PolarHBondContact O-N 2.89Å; F118-L121 HydrophobicContact CD1-CD1 4.47Å; F118-L121 PolarHBondContact O-N 2.91Å; F118-F122 WeakPolarHBondContact O-CB 3.39Å; F118-F122 PolarHBondContact O-N 3.48Å; F118-V147 WeakPolarHBondContact O-CG1 3.31Å; F118-K150 HydrophobicContact CD1-CG 4.36Å; F118-K150 HydrophobicContact CD2-CG 4.14Å; F118-K150 HydrophobicContact CE1-CG 4.38Å; F118-K150 HydrophobicContact CE2-CG 4.17Å; F118-K150 HydrophobicContact CG-CG 4.27Å; F118-K150 HydrophobicContact CZ-CG 4.3Å
119F93.6Very high89Confident105 Ų10554.4 Ų54.446%0.46130%0.296SS..Hα-helixtrans-65-45.1175.2-168.2-107.4000111.8S115 A116 I117 L121 F122 C123 F148 S151S115-F119 WeakPolarHBondContact O-CB 3.31Å; S115-F119 PolarHBondContact O-N 3.43Å; A116-F119 PolarHBondContact O-N 2.88Å; I117-F119 VanDerWaalsContact C-N 3.29Å; I117-F119 PolarHBondContact O-N 3.31Å; F119-L121 VanDerWaalsContact C-N 3.32Å; F119-L121 PolarHBondContact O-N 3.33Å; F119-F122 HydrophobicContact CD2-CD1 4.46Å; F119-F122 HydrophobicContact CE2-CD1 4.34Å; F119-F122 WeakPolarHBondContact O-CB 3.5Å; F119-F122 PolarHBondContact O-N 2.96Å; F119-F122 VanDerWaalsContact O-N 3.11Å; F119-C123 VanDerWaalsContact CE1-SG 3.56Å; F119-C123 PolarHBondContact O-N 3.45Å; F119-C123 PolarHBondContact O-SG 2.86Å; F119-C123 VanDerWaalsContact O-SG 3.38Å; F119-F148 HydrophobicContact CE2-CE2 4.43Å; F119-S151 WeakPolarHBondContact CB-OG 3.3Å; F119-S151 PolarHBondContact N-OG 3.4Å
120A91.4Very high88.9Confident58 Ų5856.6 Ų56.648%0.47930%0.301SS..Hα-helixtrans-60.4-42.1176.100000111.8A116 I117 F122 C123 F124A116-A120 WeakPolarHBondContact O-CB 3.44Å; A116-A120 PolarHBondContact O-N 2.9Å; I117-A120 PolarHBondContact O-N 3.19Å; A120-F122 VanDerWaalsContact C-N 3.34Å; A120-F122 PolarHBondContact O-N 3.15Å; A120-C123 PolarHBondContact O-N 3.39Å; A120-F124 WeakPolarHBondContact O-CB 3.26Å; A120-F124 PolarHBondContact O-N 3.48Å
121L90.6Very high88.8Confident34 Ų3458 Ų5818%0.17831%0.314CS..Hα-helixtrans-62.2-39.6173.7-72.1174.9000112.1F10 V14 F17 I117 F118 F119 W125 V147F10-L121 HydrophobicContact CE2-CB 4.02Å; F10-L121 HydrophobicContact CE2-CD2 4.17Å; F10-L121 HydrophobicContact CZ-CB 4.41Å; V14-L121 HydrophobicContact CG2-CD1 4.47Å; F17-L121 HydrophobicContact CD2-CD1 4.34Å; I117-L121 HydrophobicContact CG2-CD1 4.23Å; I117-L121 WeakPolarHBondContact O-CG 3.37Å; I117-L121 PolarHBondContact O-N 3.28Å; F118-L121 HydrophobicContact CD1-CD1 4.47Å; F118-L121 PolarHBondContact O-N 2.91Å; F119-L121 VanDerWaalsContact C-N 3.32Å; F119-L121 PolarHBondContact O-N 3.33Å; L121-W125 VanDerWaalsContact O-CB 3.27Å; L121-W125 WeakPolarHBondContact O-CB 3.29Å; L121-W125 PolarHBondContact O-N 2.85Å; L121-V147 HydrophobicContact CB-CG1 4.5Å
122F91.3Very high88.5Confident44 Ų4462.9 Ų62.919%0.19334%0.336CS..Hα-helixtrans-64.4-45.2174.2168.1-105.8000112.3F118 F119 A120 W125 S126 G144 V147 F148F118-F122 WeakPolarHBondContact O-CB 3.39Å; F118-F122 PolarHBondContact O-N 3.48Å; F119-F122 HydrophobicContact CD2-CD1 4.46Å; F119-F122 HydrophobicContact CE2-CD1 4.34Å; F119-F122 WeakPolarHBondContact O-CB 3.5Å; F119-F122 PolarHBondContact O-N 2.96Å; F119-F122 VanDerWaalsContact O-N 3.11Å; A120-F122 VanDerWaalsContact C-N 3.34Å; A120-F122 PolarHBondContact O-N 3.15Å; F122-W125 PolarHBondContact O-N 3.35Å; F122-S126 VanDerWaalsContact CE2-OG 3.31Å; F122-S126 WeakPolarHBondContact CE2-OG 3.37Å; F122-S126 WeakPolarHBondContact CZ-OG 3.4Å; F122-S126 VanDerWaalsContact O-CB 3.3Å; F122-S126 WeakPolarHBondContact O-CB 3.15Å; F122-S126 PolarHBondContact O-N 3.38Å; F122-S126 PolarHBondContact O-OG 3.11Å; F122-G144 WeakPolarHBondContact CD2-O 3.49Å; F122-V147 HydrophobicContact CB-CG1 3.97Å; F122-F148 HydrophobicContact CD1-CB 4.47Å; F122-F148 AromaticContact CD1-CD2 3.85Å; F122-F148 HydrophobicContact CD1-CD2 3.85Å; F122-F148 HydrophobicContact CD2-CB 3.73Å; F122-F148 HydrophobicContact CE1-CB 4.46Å; F122-F148 AromaticContact CE1-CD2 3.65Å; F122-F148 HydrophobicContact CE1-CD2 3.65Å; F122-F148 HydrophobicContact CE1-CE2 4.23Å; F122-F148 HydrophobicContact CE1-CG 4.32Å; F122-F148 HydrophobicContact CE2-CB 3.73Å; F122-F148 HydrophobicContact CE2-CD2 4.4Å; F122-F148 HydrophobicContact CE2-CG 4.29Å; F122-F148 HydrophobicContact CG-CB 4.11Å; F122-F148 HydrophobicContact CG-CD2 4.3Å; F122-F148 HydrophobicContact CZ-CB 4.1Å; F122-F148 AromaticContact CZ-CD2 3.95Å; F122-F148 HydrophobicContact CZ-CD2 3.95Å; F122-F148 HydrophobicContact CZ-CG 4.16Å
123C91.9Very high87.7Confident57 Ų5767 Ų6739%0.38535%0.352SS..Hα-helixtrans-60.3-46.1176-69.30000111.1F119 A120 S126 F127F119-C123 VanDerWaalsContact CE1-SG 3.56Å; F119-C123 PolarHBondContact O-N 3.45Å; F119-C123 PolarHBondContact O-SG 2.86Å; F119-C123 VanDerWaalsContact O-SG 3.38Å; A120-C123 PolarHBondContact O-N 3.39Å; C123-S126 PolarHBondContact O-N 3.23Å; C123-F127 WeakPolarHBondContact O-CB 3.37Å; C123-F127 PolarHBondContact O-N 2.93Å
124F88.9Confident86.8Confident124 Ų12471.9 Ų71.954%0.54437%0.369SS..Hα-helixtrans-61.4-45.1176.8-179.1-107.8000112.2A120 F127 I128A120-F124 WeakPolarHBondContact O-CB 3.26Å; A120-F124 PolarHBondContact O-N 3.48Å; F124-F127 PolarHBondContact O-N 3.41Å; F124-I128 HydrophobicContact CD1-CD1 3.9Å; F124-I128 HydrophobicContact CE1-CD1 3.43Å; F124-I128 VanDerWaalsContact CE1-CD1 3.43Å; F124-I128 HydrophobicContact CE2-CD1 4.31Å; F124-I128 HydrophobicContact CZ-CD1 3.67Å; F124-I128 HydrophobicContact CZ-CG1 4.49Å; F124-I128 WeakPolarHBondContact O-CG1 3.49Å; F124-I128 PolarHBondContact O-N 3.48Å; F124-I128 VanDerWaalsContact O-N 3.1Å
125W88Confident86Confident17 Ų1772.8 Ų72.86%0.06438%0.375CS..Hα-helixtrans-62.6-44.9177.1-170.7-105.5000112V7 F10 L121 F122 F127 I128 L129 H140 M143V7-W125 HydrophobicContact CB-CH2 4.42Å; V7-W125 HydrophobicContact CG1-CH2 4.33Å; V7-W125 HydrophobicContact CG2-CH2 4.13Å; F10-W125 HydrophobicContact CB-CE3 4.12Å; F10-W125 HydrophobicContact CB-CH2 4.3Å; F10-W125 HydrophobicContact CB-CZ3 3.56Å; F10-W125 AromaticContact CD1-CD2 3.85Å; F10-W125 HydrophobicContact CD1-CD2 3.85Å; F10-W125 AromaticContact CD1-CE3 3.39Å; F10-W125 HydrophobicContact CD1-CE3 3.39Å; F10-W125 AromaticContact CD1-CH2 3.83Å; F10-W125 HydrophobicContact CD1-CH2 3.83Å; F10-W125 HydrophobicContact CD1-CZ2 4.26Å; F10-W125 AromaticContact CD1-CZ3 3.38Å; F10-W125 HydrophobicContact CD1-CZ3 3.38Å; F10-W125 AromaticContact CD2-CE3 3.78Å; F10-W125 HydrophobicContact CD2-CE3 3.78Å; F10-W125 HydrophobicContact CD2-CZ3 4.13Å; F10-W125 HydrophobicContact CE1-CB 4.42Å; F10-W125 AromaticContact CE1-CD2 3.65Å; F10-W125 HydrophobicContact CE1-CD2 3.65Å; F10-W125 AromaticContact CE1-CE3 3.62Å; F10-W125 HydrophobicContact CE1-CE3 3.62Å; F10-W125 HydrophobicContact CE1-CG 4.02Å; F10-W125 HydrophobicContact CE1-CZ3 4.09Å; F10-W125 HydrophobicContact CE2-CB 4.28Å; F10-W125 HydrophobicContact CE2-CD2 4.45Å; F10-W125 AromaticContact CE2-CE3 3.97Å; F10-W125 HydrophobicContact CE2-CE3 3.97Å; F10-W125 HydrophobicContact CG-CD2 4.36Å; F10-W125 AromaticContact CG-CE3 3.49Å; F10-W125 HydrophobicContact CG-CE3 3.49Å; F10-W125 VanDerWaalsContact CG-CE3 3.49Å; F10-W125 HydrophobicContact CG-CH2 4.25Å; F10-W125 AromaticContact CG-CZ3 3.43Å; F10-W125 HydrophobicContact CG-CZ3 3.43Å; F10-W125 VanDerWaalsContact CG-CZ3 3.43Å; F10-W125 HydrophobicContact CZ-CB 3.9Å; F10-W125 AromaticContact CZ-CD2 3.98Å; F10-W125 HydrophobicContact CZ-CD2 3.98Å; F10-W125 AromaticContact CZ-CE3 3.91Å; F10-W125 HydrophobicContact CZ-CE3 3.91Å; F10-W125 AromaticContact CZ-CG 4Å; F10-W125 HydrophobicContact CZ-CG 4Å; L121-W125 VanDerWaalsContact O-CB 3.27Å; L121-W125 WeakPolarHBondContact O-CB 3.29Å; L121-W125 PolarHBondContact O-N 2.85Å; F122-W125 PolarHBondContact O-N 3.35Å; W125-F127 VanDerWaalsContact C-N 3.32Å; W125-F127 PolarHBondContact O-N 3.43Å; W125-I128 PolarHBondContact O-N 2.85Å; W125-L129 HydrophobicContact CG-CD1 4.15Å; W125-L129 WeakPolarHBondContact O-CD1 3.48Å; W125-L129 WeakPolarHBondContact O-CG 3.26Å; W125-L129 PolarHBondContact O-N 3.07Å; W125-H140 PolarHBondContact NE1-O 3.48Å; W125-M143 HydrophobicContact CH2-SD 4.38Å; W125-M143 HydrophobicContact CZ2-SD 4.02Å
126S87.9Confident85Confident30 Ų3074.7 Ų74.721%0.2139%0.387CS..Hα-helixtrans-62.8-39.2177.4-60.60000111.8F122 C123 I128 L129 L130F122-S126 VanDerWaalsContact CE2-OG 3.31Å; F122-S126 WeakPolarHBondContact CE2-OG 3.37Å; F122-S126 WeakPolarHBondContact CZ-OG 3.4Å; F122-S126 VanDerWaalsContact O-CB 3.3Å; F122-S126 WeakPolarHBondContact O-CB 3.15Å; F122-S126 PolarHBondContact O-N 3.38Å; F122-S126 PolarHBondContact O-OG 3.11Å; C123-S126 PolarHBondContact O-N 3.23Å; S126-I128 PolarHBondContact O-N 2.93Å; S126-L129 WeakPolarHBondContact O-CB 3.43Å; S126-L129 PolarHBondContact O-N 3.29Å; S126-L130 WeakPolarHBondContact O-CB 3.35Å; S126-L130 VanDerWaalsContact O-CG 3.28Å; S126-L130 WeakPolarHBondContact O-CG 3.49Å; S126-L130 PolarHBondContact O-N 2.87Å
127F88Confident84.3Confident136 Ų13678.9 Ų78.960%0.59639%0.391SS*.Hα-helixtrans-61.5-42.9174.3177.8-99.6000112.3C123 F124 W125 L130 S131C123-F127 WeakPolarHBondContact O-CB 3.37Å; C123-F127 PolarHBondContact O-N 2.93Å; F124-F127 PolarHBondContact O-N 3.41Å; W125-F127 VanDerWaalsContact C-N 3.32Å; W125-F127 PolarHBondContact O-N 3.43Å; F127-L130 PolarHBondContact O-N 2.98Å; F127-S131 WeakPolarHBondContact O-CB 3.16Å; F127-S131 PolarHBondContact O-N 3.39Å; F127-S131 PolarHBondContact O-OG 3.08Å
128I85Confident83.8Confident42 Ų4282.3 Ų82.322%0.21540%0.403CS..Hα-helixtrans-63.3-45.8175.9-67.7169000111.1T2 F124 W125 S126 L130 S131 K132T2-I128 HydrophobicContact CG2-CG2 4.02Å; F124-I128 HydrophobicContact CD1-CD1 3.9Å; F124-I128 HydrophobicContact CE1-CD1 3.43Å; F124-I128 VanDerWaalsContact CE1-CD1 3.43Å; F124-I128 HydrophobicContact CE2-CD1 4.31Å; F124-I128 HydrophobicContact CZ-CD1 3.67Å; F124-I128 HydrophobicContact CZ-CG1 4.49Å; F124-I128 WeakPolarHBondContact O-CG1 3.49Å; F124-I128 PolarHBondContact O-N 3.48Å; F124-I128 VanDerWaalsContact O-N 3.1Å; W125-I128 PolarHBondContact O-N 2.85Å; S126-I128 PolarHBondContact O-N 2.93Å; I128-L130 VanDerWaalsContact C-N 3.33Å; I128-L130 PolarHBondContact O-N 3.41Å; I128-S131 PolarHBondContact O-N 3.41Å; I128-K132 PolarHBondContact O-N 3.37Å; I128-K132 VanDerWaalsContact O-N 3.12Å
129L84.7Confident83.4Confident30 Ų3084.2 Ų84.216%0.15741%0.413CS..Hα-helixtrans-56.9-45.4177-81.8153.5000111.7W125 S126 K132 V136 H140 I141W125-L129 HydrophobicContact CG-CD1 4.15Å; W125-L129 WeakPolarHBondContact O-CD1 3.48Å; W125-L129 WeakPolarHBondContact O-CG 3.26Å; W125-L129 PolarHBondContact O-N 3.07Å; S126-L129 WeakPolarHBondContact O-CB 3.43Å; S126-L129 PolarHBondContact O-N 3.29Å; L129-K132 PolarHBondContact O-N 3.1Å; L129-V136 HydrophobicContact CD2-CB 4.28Å; L129-V136 HydrophobicContact CD2-CG1 3.38Å; L129-V136 HydrophobicContact CD2-CG2 3.93Å; L129-V136 WeakPolarHBondContact O-CG2 3.32Å; L129-H140 HydrophobicContact CD2-CB 3.7Å; L129-I141 HydrophobicContact CD2-CG1 4.42Å
130L84.3Confident82.8Confident123 Ų12380.8 Ų80.864%0.64440%0.399SS*.Hα-helixtrans-68.8-34.5178.5-69.8172.1000112.6S126 F127 I128 K132 K133S126-L130 WeakPolarHBondContact O-CB 3.35Å; S126-L130 VanDerWaalsContact O-CG 3.28Å; S126-L130 WeakPolarHBondContact O-CG 3.49Å; S126-L130 PolarHBondContact O-N 2.87Å; F127-L130 PolarHBondContact O-N 2.98Å; I128-L130 VanDerWaalsContact C-N 3.33Å; I128-L130 PolarHBondContact O-N 3.41Å; L130-K132 VanDerWaalsContact C-N 3.34Å; L130-K133 WeakPolarHBondContact O-CG 2.9Å
131S83.3Confident82.5Confident67 Ų6782.4 Ų82.447%0.46940%0.398SS..Hα-helixtrans-72.6-24.3179.6-61.50000113.4F127 I128F127-S131 WeakPolarHBondContact O-CB 3.16Å; F127-S131 PolarHBondContact O-N 3.39Å; F127-S131 PolarHBondContact O-OG 3.08Å; I128-S131 PolarHBondContact O-N 3.41Å
132K80Confident82.1Confident129 Ų12983 Ų8356%0.56140%0.401SS*.THydrogen-bonded Turntrans-124.248.3-173.7-61.2-63-176.9-168.20113I128 L129 L130 E134 N135 V136I128-K132 PolarHBondContact O-N 3.37Å; I128-K132 VanDerWaalsContact O-N 3.12Å; L129-K132 PolarHBondContact O-N 3.1Å; L130-K132 VanDerWaalsContact C-N 3.34Å; K132-E134 VanDerWaalsContact C-N 3.28Å; K132-E134 PolarHBondContact O-N 2.98Å; K132-E134 VanDerWaalsContact O-N 3.09Å; K132-N135 PolarHBondContact O-N 3.36Å; K132-V136 WeakPolarHBondContact O-CG2 3.47Å
133K72.8Confident81.8Confident163 Ų16382.1 Ų82.171%0.70940%0.398SS*.G310 helixtrans-47.5-40.4-174.8-69.4-173.3178.5178.40115.2L130 N135 V136L130-K133 WeakPolarHBondContact O-CG 2.9Å; K133-N135 PolarHBondContact O-N 2.91Å; K133-V136 PolarHBondContact O-N 3.4Å
134E70.9Confident81.5Confident192 Ų19279.5 Ų79.590%0.89738%0.381SS*.G310 helixtrans-63.2-21.8-177.8-78.8-169.5139.200114.8K132K132-E134 VanDerWaalsContact C-N 3.28Å; K132-E134 PolarHBondContact O-N 2.98Å; K132-E134 VanDerWaalsContact O-N 3.09Å
135N69Low81.5Confident52 Ų5276.5 Ų76.528%0.27837%0.372SS..G310 helixtrans-111.416.7-175.9-70-92.9000113.2M1 K132 K133 Y137M1-N135 VanDerWaalsContact N-CG 3.34Å; M1-N135 PolarHBondContact N-ND2 3.35Å; M1-N135 PolarHBondContact N-OD1 3.48Å; K132-N135 PolarHBondContact O-N 3.36Å; K133-N135 PolarHBondContact O-N 2.91Å; N135-Y137 PolarHBondContact O-N 3.33Å
136V72.6Confident81.4Confident46 Ų4677 Ų7728%0.27938%0.376SS..  trans-89.6100.5-176.3-178.40000111.2L129 K132 K133 I141L129-V136 HydrophobicContact CD2-CB 4.28Å; L129-V136 HydrophobicContact CD2-CG1 3.38Å; L129-V136 HydrophobicContact CD2-CG2 3.93Å; L129-V136 WeakPolarHBondContact O-CG2 3.32Å; K132-V136 WeakPolarHBondContact O-CG2 3.47Å; K133-V136 PolarHBondContact O-N 3.4Å; V136-I141 HydrophobicContact CG1-CD1 4Å; V136-I141 HydrophobicContact CG1-CG1 3.77Å
137Y75.4Confident81.5Confident148 Ų14875.8 Ų75.858%0.5837%0.368SS*.  trans-78.7150.6166.5-59.5-81.5000111.1N135 I139 H140N135-Y137 PolarHBondContact O-N 3.33Å; Y137-I139 PolarHBondContact O-N 3.48Å; Y137-H140 AromaticContact CD2-CE1 3.8Å; Y137-H140 WeakPolarHBondContact O-CB 3.39Å; Y137-H140 PolarHBondContact O-N 2.84Å; Y137-H140 PolarHBondContact O-ND1 2.9Å
138K80.5Confident81.6Confident131 Ų13172.9 Ų72.957%0.5736%0.355SS*.Hα-helixtrans-52.7-30.7176.8-70.2-177.4174.4-176.10113.8H140 I141 L142 W200K138-H140 VanDerWaalsContact C-N 3.28Å; K138-H140 PolarHBondContact O-N 3.31Å; K138-I141 WeakPolarHBondContact O-CB 3.35Å; K138-I141 PolarHBondContact O-N 2.86Å; K138-L142 PolarHBondContact O-N 3.08Å; K138-W200 HydrophobicContact CB-CZ2 4.43Å; K138-W200 HydrophobicContact CD-CH2 3.94Å; K138-W200 HydrophobicContact CD-CZ2 3.4Å; K138-W200 HydrophobicContact CG-CZ2 4.48Å
139I80.8Confident81.7Confident40 Ų4072 Ų7221%0.20535%0.35CS..Hα-helixtrans-58-39.8174.8-57.8176.2000111.5Y137 I141 L142 M143 I196 W200Y137-I139 PolarHBondContact O-N 3.48Å; I139-I141 VanDerWaalsContact C-N 3.33Å; I139-I141 PolarHBondContact O-N 3.44Å; I139-L142 PolarHBondContact O-N 3.24Å; I139-M143 WeakPolarHBondContact O-CB 3.47Å; I139-M143 PolarHBondContact O-N 2.91Å; I139-I196 HydrophobicContact CG2-CG1 3.96Å; I139-W200 HydrophobicContact CD1-CB 3.96Å; I139-W200 HydrophobicContact CG1-CB 4.23Å
140H81.4Confident81.8Confident34 Ų3471.5 Ų71.516%0.15735%0.347CS..Hα-helixtrans-69.4-34.4-179.7-61.483000111.9W125 L129 Y137 K138 G144W125-H140 PolarHBondContact NE1-O 3.48Å; L129-H140 HydrophobicContact CD2-CB 3.7Å; Y137-H140 AromaticContact CD2-CE1 3.8Å; Y137-H140 WeakPolarHBondContact O-CB 3.39Å; Y137-H140 PolarHBondContact O-N 2.84Å; Y137-H140 PolarHBondContact O-ND1 2.9Å; K138-H140 VanDerWaalsContact C-N 3.28Å; K138-H140 PolarHBondContact O-N 3.31Å; H140-G144 PolarHBondContact O-N 3.03Å
141I85Confident82.1Confident91 Ų9165.8 Ų65.847%0.46732%0.318SS..Hα-helixtrans-66.9-47.1173.7-58.8175.7000109.4L129 V136 K138 I139 M143 G144 V145L129-I141 HydrophobicContact CD2-CG1 4.42Å; V136-I141 HydrophobicContact CG1-CD1 4Å; V136-I141 HydrophobicContact CG1-CG1 3.77Å; K138-I141 WeakPolarHBondContact O-CB 3.35Å; K138-I141 PolarHBondContact O-N 2.86Å; I139-I141 VanDerWaalsContact C-N 3.33Å; I139-I141 PolarHBondContact O-N 3.44Å; I141-M143 VanDerWaalsContact C-N 3.3Å; I141-M143 PolarHBondContact O-N 3.07Å; I141-G144 WeakPolarHBondContact O-CA 3.42Å; I141-G144 PolarHBondContact O-N 2.99Å; I141-V145 WeakPolarHBondContact O-CG2 3.31Å; I141-V145 PolarHBondContact O-N 2.95Å
142L82.8Confident82.4Confident46 Ų4664.8 Ų64.824%0.24131%0.307CS..Hα-helixtrans-58.5-42.3177.3-173.166.8000111.6K138 I139 G144 V145 L146 T192 L195K138-L142 PolarHBondContact O-N 3.08Å; I139-L142 PolarHBondContact O-N 3.24Å; L142-G144 VanDerWaalsContact C-N 3.35Å; L142-G144 PolarHBondContact O-N 3.41Å; L142-V145 WeakPolarHBondContact O-CB 3.33Å; L142-V145 PolarHBondContact O-N 3.34Å; L142-L146 PolarHBondContact O-N 3.44Å; L142-T192 HydrophobicContact CD2-CG2 3.89Å; L142-T192 VanDerWaalsContact CD2-OG1 3.25Å; L142-T192 WeakPolarHBondContact CD2-OG1 3.38Å; L142-T192 HydrophobicContact CG-CG2 4.25Å; L142-T192 WeakPolarHBondContact CG-OG1 3.23Å; L142-L195 HydrophobicContact CD2-CD2 3.52Å
143M84Confident82.8Confident26 Ų2658.8 Ų58.813%0.12828%0.281CS..Hα-helixtrans-63-39.3174-171.3179.4-179.600112.4V7 F10 V11 W125 I139 I141 V145 L146 V147V7-M143 HydrophobicContact CG1-SD 4.47Å; F10-M143 HydrophobicContact CD1-CE 3.34Å; F10-M143 HydrophobicContact CD1-SD 4.14Å; F10-M143 HydrophobicContact CE1-CE 3.67Å; F10-M143 HydrophobicContact CE1-SD 4.44Å; V11-M143 HydrophobicContact CB-CE 4.11Å; V11-M143 HydrophobicContact CG2-CE 3.29Å; V11-M143 HydrophobicContact CG2-SD 3.95Å; W125-M143 HydrophobicContact CH2-SD 4.38Å; W125-M143 HydrophobicContact CZ2-SD 4.02Å; I139-M143 WeakPolarHBondContact O-CB 3.47Å; I139-M143 PolarHBondContact O-N 2.91Å; I141-M143 VanDerWaalsContact C-N 3.3Å; I141-M143 PolarHBondContact O-N 3.07Å; M143-V145 VanDerWaalsContact C-N 3.34Å; M143-L146 WeakPolarHBondContact O-CB 3.32Å; M143-L146 PolarHBondContact O-N 3.48Å; M143-V147 PolarHBondContact O-N 2.99Å
144G86.6Confident83.4Confident3 Ų351.4 Ų51.43%0.03125%0.249CC..Hα-helixtrans-60.8-43.1173.200000112.3F122 H140 I141 L142 L146 V147 F148F122-G144 WeakPolarHBondContact CD2-O 3.49Å; H140-G144 PolarHBondContact O-N 3.03Å; I141-G144 WeakPolarHBondContact O-CA 3.42Å; I141-G144 PolarHBondContact O-N 2.99Å; L142-G144 VanDerWaalsContact C-N 3.35Å; L142-G144 PolarHBondContact O-N 3.41Å; G144-L146 VanDerWaalsContact C-N 3.32Å; G144-L146 PolarHBondContact O-N 3.48Å; G144-V147 PolarHBondContact O-N 2.98Å; G144-F148 PolarHBondContact O-N 3.44Å
145V88.3Confident84.3Confident60 Ų6045 Ų4536%0.36422%0.221SC..Hα-helixtrans-60.7-40.4175.3173.50000111.3I141 L142 M143 V147 F148 L149I141-V145 WeakPolarHBondContact O-CG2 3.31Å; I141-V145 PolarHBondContact O-N 2.95Å; L142-V145 WeakPolarHBondContact O-CB 3.33Å; L142-V145 PolarHBondContact O-N 3.34Å; M143-V145 VanDerWaalsContact C-N 3.34Å; V145-V147 PolarHBondContact O-N 3.44Å; V145-F148 PolarHBondContact O-N 3.33Å; V145-L149 HydrophobicContact CG1-CD1 3.8Å; V145-L149 HydrophobicContact CG1-CG 4.24Å; V145-L149 WeakPolarHBondContact O-CB 3.29Å; V145-L149 WeakPolarHBondContact O-CG 3.27Å; V145-L149 PolarHBondContact O-N 3.49Å
146L86.9Confident85.1Confident28 Ų2843.2 Ų43.215%0.14721%0.211CC..Hα-helixtrans-60.1-45.1175.6-72.1178.7000112.9L142 M143 G144 F148 L149 K150 L188 L189 T192L142-L146 PolarHBondContact O-N 3.44Å; M143-L146 WeakPolarHBondContact O-CB 3.32Å; M143-L146 PolarHBondContact O-N 3.48Å; G144-L146 VanDerWaalsContact C-N 3.32Å; G144-L146 PolarHBondContact O-N 3.48Å; L146-F148 VanDerWaalsContact C-N 3.34Å; L146-L149 PolarHBondContact O-N 3.33Å; L146-K150 WeakPolarHBondContact O-CB 3.42Å; L146-K150 PolarHBondContact O-N 3.18Å; L146-L188 HydrophobicContact CD2-CB 3.48Å; L146-L188 VanDerWaalsContact CD2-CB 3.48Å; L146-L189 HydrophobicContact CD2-CB 4.38Å; L146-T192 HydrophobicContact CD1-CG2 3.81Å; L146-T192 WeakPolarHBondContact CD1-OG1 3.43Å
147V88.9Confident85.6Confident4 Ų441.9 Ų41.92%0.02420%0.202CC..Hα-helixtrans-66.3-40.7179.8-179.70000110.4F10 V14 F118 L121 F122 M143 G144 V145 K150 S151F10-V147 HydrophobicContact CE1-CG2 3.9Å; F10-V147 HydrophobicContact CZ-CG2 3.96Å; V14-V147 HydrophobicContact CG1-CG2 4.44Å; V14-V147 HydrophobicContact CG2-CG2 4.13Å; F118-V147 WeakPolarHBondContact O-CG1 3.31Å; L121-V147 HydrophobicContact CB-CG1 4.5Å; F122-V147 HydrophobicContact CB-CG1 3.97Å; M143-V147 PolarHBondContact O-N 2.99Å; G144-V147 PolarHBondContact O-N 2.98Å; V145-V147 PolarHBondContact O-N 3.44Å; V147-K150 PolarHBondContact O-N 3.41Å; V147-S151 PolarHBondContact O-N 3.06Å
148F90.5Very high86.1Confident75 Ų7534.8 Ų34.833%0.32917%0.174SC..Hα-helixtrans-60.7-49.1174.7-179.3-114.4000112.4F119 F122 G144 V145 L146 K150 S151 I152F119-F148 HydrophobicContact CE2-CE2 4.43Å; F122-F148 HydrophobicContact CD1-CB 4.47Å; F122-F148 AromaticContact CD1-CD2 3.85Å; F122-F148 HydrophobicContact CD1-CD2 3.85Å; F122-F148 HydrophobicContact CD2-CB 3.73Å; F122-F148 HydrophobicContact CE1-CB 4.46Å; F122-F148 AromaticContact CE1-CD2 3.65Å; F122-F148 HydrophobicContact CE1-CD2 3.65Å; F122-F148 HydrophobicContact CE1-CE2 4.23Å; F122-F148 HydrophobicContact CE1-CG 4.32Å; F122-F148 HydrophobicContact CE2-CB 3.73Å; F122-F148 HydrophobicContact CE2-CD2 4.4Å; F122-F148 HydrophobicContact CE2-CG 4.29Å; F122-F148 HydrophobicContact CG-CB 4.11Å; F122-F148 HydrophobicContact CG-CD2 4.3Å; F122-F148 HydrophobicContact CZ-CB 4.1Å; F122-F148 AromaticContact CZ-CD2 3.95Å; F122-F148 HydrophobicContact CZ-CD2 3.95Å; F122-F148 HydrophobicContact CZ-CG 4.16Å; G144-F148 PolarHBondContact O-N 3.44Å; V145-F148 PolarHBondContact O-N 3.33Å; L146-F148 VanDerWaalsContact C-N 3.34Å; F148-K150 VanDerWaalsContact C-N 3.31Å; F148-K150 PolarHBondContact O-N 3.2Å; F148-S151 VanDerWaalsContact O-CB 3.29Å; F148-S151 WeakPolarHBondContact O-CB 3.47Å; F148-S151 PolarHBondContact O-N 3.26Å; F148-S151 VanDerWaalsContact O-N 3.1Å; F148-I152 HydrophobicContact CD1-CD1 3.93Å; F148-I152 HydrophobicContact CD2-CD1 4.37Å; F148-I152 HydrophobicContact CE1-CD1 3.35Å; F148-I152 HydrophobicContact CE1-CG1 4.48Å; F148-I152 HydrophobicContact CE2-CD1 3.85Å; F148-I152 HydrophobicContact CE2-CG1 4.33Å; F148-I152 HydrophobicContact CG-CD1 4.42Å; F148-I152 HydrophobicContact CZ-CD1 3.33Å; F148-I152 HydrophobicContact CZ-CG1 4.28Å; F148-I152 PolarHBondContact O-N 2.91Å
149L87.9Confident86.4Confident23 Ų2330.8 Ų30.812%0.1216%0.158CC..Hα-helixtrans-63.8-35.8177.4-71.2173.3000112.2V145 L146 S153 L181 I184 L188V145-L149 HydrophobicContact CG1-CD1 3.8Å; V145-L149 HydrophobicContact CG1-CG 4.24Å; V145-L149 WeakPolarHBondContact O-CB 3.29Å; V145-L149 WeakPolarHBondContact O-CG 3.27Å; V145-L149 PolarHBondContact O-N 3.49Å; L146-L149 PolarHBondContact O-N 3.33Å; L149-S153 WeakPolarHBondContact O-CB 3.37Å; L149-S153 PolarHBondContact O-N 3.15Å; L149-L181 HydrophobicContact CD2-CD2 3.97Å; L149-I184 HydrophobicContact CD1-CG2 4.09Å; L149-L188 HydrophobicContact CD1-CD1 3.18Å
150K86.4Confident86.6Confident20 Ų2029.2 Ų29.29%0.08715%0.151CC..Hα-helixtrans-62.2-44171.1-179.776176.4-171.40111E22 F118 L146 V147 F148 S153 V154 K185E22-K150 IonicContact OE1-NZ 3.36Å; E22-K150 PolarHBondContact OE1-NZ 2.97Å; F118-K150 HydrophobicContact CD1-CG 4.36Å; F118-K150 HydrophobicContact CD2-CG 4.14Å; F118-K150 HydrophobicContact CE1-CG 4.38Å; F118-K150 HydrophobicContact CE2-CG 4.17Å; F118-K150 HydrophobicContact CG-CG 4.27Å; F118-K150 HydrophobicContact CZ-CG 4.3Å; L146-K150 WeakPolarHBondContact O-CB 3.42Å; L146-K150 PolarHBondContact O-N 3.18Å; V147-K150 PolarHBondContact O-N 3.41Å; F148-K150 VanDerWaalsContact C-N 3.31Å; F148-K150 PolarHBondContact O-N 3.2Å; K150-S153 PolarHBondContact O-N 3.26Å; K150-V154 HydrophobicContact CD-CG2 4.21Å; K150-V154 HydrophobicContact CG-CG2 4.43Å; K150-V154 WeakPolarHBondContact O-CB 3.19Å; K150-V154 VanDerWaalsContact O-CG2 3.27Å; K150-V154 WeakPolarHBondContact O-CG2 3.39Å; K150-V154 PolarHBondContact O-N 3.12Å; K150-K185 HydrophobicContact CB-CD 4.44Å; K150-K185 HydrophobicContact CD-CD 3.93Å; K150-K185 VanDerWaalsContact CD-CE 3.4Å
151S90.2Very high86.6Confident4 Ų428.9 Ų28.93%0.02815%0.15CC..Hα-helixtrans-58.8-48.2177.7-169.80000111.8S115 F119 V147 F148 L155S115-S151 PolarHBondContact O-OG 3.49Å; S115-S151 PolarHBondContact OG-O 3.43Å; F119-S151 WeakPolarHBondContact CB-OG 3.3Å; F119-S151 PolarHBondContact N-OG 3.4Å; V147-S151 PolarHBondContact O-N 3.06Å; F148-S151 VanDerWaalsContact O-CB 3.29Å; F148-S151 WeakPolarHBondContact O-CB 3.47Å; F148-S151 PolarHBondContact O-N 3.26Å; F148-S151 VanDerWaalsContact O-N 3.1Å; S151-L155 WeakPolarHBondContact O-CB 3.48Å; S151-L155 PolarHBondContact O-N 3.02Å
152I90.3Very high86.6Confident46 Ų4630.6 Ų30.624%0.23615%0.151CC..Hα-helixtrans-67.5-44.7178.6-64.1176.2000110.9F148 V154 L155 L156 L181F148-I152 HydrophobicContact CD1-CD1 3.93Å; F148-I152 HydrophobicContact CD2-CD1 4.37Å; F148-I152 HydrophobicContact CE1-CD1 3.35Å; F148-I152 HydrophobicContact CE1-CG1 4.48Å; F148-I152 HydrophobicContact CE2-CD1 3.85Å; F148-I152 HydrophobicContact CE2-CG1 4.33Å; F148-I152 HydrophobicContact CG-CD1 4.42Å; F148-I152 HydrophobicContact CZ-CD1 3.33Å; F148-I152 HydrophobicContact CZ-CG1 4.28Å; F148-I152 PolarHBondContact O-N 2.91Å; I152-V154 VanDerWaalsContact C-N 3.32Å; I152-V154 PolarHBondContact O-N 3.02Å; I152-L155 WeakPolarHBondContact O-CB 3.37Å; I152-L155 PolarHBondContact O-N 3.39Å; I152-L155 VanDerWaalsContact O-N 3.15Å; I152-L156 HydrophobicContact CG2-CD1 3.82Å; I152-L156 HydrophobicContact CG2-CG 4.13Å; I152-L156 WeakPolarHBondContact O-CG 3.33Å; I152-L156 PolarHBondContact O-N 3.1Å; I152-L181 HydrophobicContact CG2-CD1 3.68Å
153S86.8Confident86.7Confident3 Ų331.3 Ų31.32%0.02115%0.152CC..Hα-helixtrans-58.1-45179.1172.10000111.5L149 K150 H157 Y178L149-S153 WeakPolarHBondContact O-CB 3.37Å; L149-S153 PolarHBondContact O-N 3.15Å; K150-S153 PolarHBondContact O-N 3.26Å; S153-H157 WeakPolarHBondContact O-CB 3.46Å; S153-H157 PolarHBondContact O-N 2.9Å; S153-H157 VanDerWaalsContact O-N 3.14Å; S153-Y178 WeakPolarHBondContact O-CD2 3.45Å
154V86Confident86.6Confident7 Ų731.2 Ų31.24%0.04215%0.152CC..Hα-helixtrans-68.5-39.2176.3169.30000111.1Y111 F114 K150 I152 H157 G158Y111-V154 HydrophobicContact CD1-CB 4.46Å; Y111-V154 HydrophobicContact CD1-CG1 3.69Å; Y111-V154 HydrophobicContact CG-CG1 4.48Å; Y111-V154 WeakPolarHBondContact O-CG1 3.34Å; F114-V154 HydrophobicContact CB-CG1 4.23Å; K150-V154 HydrophobicContact CD-CG2 4.21Å; K150-V154 HydrophobicContact CG-CG2 4.43Å; K150-V154 WeakPolarHBondContact O-CB 3.19Å; K150-V154 VanDerWaalsContact O-CG2 3.27Å; K150-V154 WeakPolarHBondContact O-CG2 3.39Å; K150-V154 PolarHBondContact O-N 3.12Å; I152-V154 VanDerWaalsContact C-N 3.32Å; I152-V154 PolarHBondContact O-N 3.02Å; V154-H157 PolarHBondContact O-N 3.15Å; V154-G158 PolarHBondContact O-N 3.21Å
155L89.3Confident86.3Confident59 Ų5931.3 Ų31.331%0.30915%0.153SC..Hα-helixtrans-59.5-52.4176.9-175.160.1000111.5M112 S115 S151 I152 H157 G158 L159M112-L155 HydrophobicContact CE-CD1 3.88Å; M112-L155 HydrophobicContact SD-CD1 3.79Å; S115-L155 VanDerWaalsContact OG-CB 3.32Å; S115-L155 WeakPolarHBondContact OG-CB 3.35Å; S151-L155 WeakPolarHBondContact O-CB 3.48Å; S151-L155 PolarHBondContact O-N 3.02Å; I152-L155 WeakPolarHBondContact O-CB 3.37Å; I152-L155 PolarHBondContact O-N 3.39Å; I152-L155 VanDerWaalsContact O-N 3.15Å; L155-H157 VanDerWaalsContact C-N 3.26Å; L155-H157 PolarHBondContact O-N 3.04Å; L155-G158 PolarHBondContact O-N 3.45Å; L155-G158 VanDerWaalsContact O-N 3.13Å; L155-L159 HydrophobicContact CD1-CD1 4.41Å; L155-L159 HydrophobicContact CD1-CG 4.38Å; L155-L159 HydrophobicContact CG-CD1 4.05Å; L155-L159 HydrophobicContact CG-CG 4.4Å; L155-L159 WeakPolarHBondContact O-CG 3.31Å; L155-L159 PolarHBondContact O-N 3.03Å
156L87Confident85.9Confident13 Ų1333 Ų337%0.06816%0.159CC..Hα-helixtrans-64.3-34.7-177.9-68.9175.4000111.8I152 L159 N160 W174 L177 L181I152-L156 HydrophobicContact CG2-CD1 3.82Å; I152-L156 HydrophobicContact CG2-CG 4.13Å; I152-L156 WeakPolarHBondContact O-CG 3.33Å; I152-L156 PolarHBondContact O-N 3.1Å; L156-L159 PolarHBondContact O-N 2.85Å; L156-N160 VanDerWaalsContact O-CB 3.22Å; L156-N160 WeakPolarHBondContact O-CB 3.4Å; L156-N160 PolarHBondContact O-N 3.31Å; L156-W174 HydrophobicContact CD2-CE3 3.81Å; L156-W174 HydrophobicContact CD2-CZ3 3.67Å; L156-L177 HydrophobicContact CD1-CD2 3.74Å; L156-L177 HydrophobicContact CD1-CG 3.76Å; L156-L177 HydrophobicContact CD2-CD2 4.05Å; L156-L181 HydrophobicContact CD1-CD1 3.13Å
157H82Confident85.5Confident18 Ų1836.6 Ų36.68%0.08318%0.175CC..Hα-helixtrans-64.3-45.6172.6-162.272.8000111.9Y111 S153 V154 L155 N160 M161 Y178Y111-H157 HydrophobicContact CD1-CB 4.48Å; Y111-H157 AromaticContact CD2-CD2 3.69Å; Y111-H157 AromaticContact CE1-CD2 3.61Å; Y111-H157 AromaticContact CE2-CD2 3.25Å; Y111-H157 WeakPolarHBondContact CE2-CD2 3.27Å; Y111-H157 AromaticContact CE2-NE2 3.67Å; Y111-H157 AromaticContact CZ-CD2 3.19Å; Y111-H157 AromaticContact CZ-NE2 3.63Å; Y111-H157 PolarHBondContact OH-CD2 2.97Å; Y111-H157 PolarHBondContact OH-NE2 2.87Å; S153-H157 WeakPolarHBondContact O-CB 3.46Å; S153-H157 PolarHBondContact O-N 2.9Å; S153-H157 VanDerWaalsContact O-N 3.14Å; V154-H157 PolarHBondContact O-N 3.15Å; L155-H157 VanDerWaalsContact C-N 3.26Å; L155-H157 PolarHBondContact O-N 3.04Å; H157-N160 PolarHBondContact O-N 3.4Å; H157-M161 WeakPolarHBondContact O-CG 3.32Å; H157-M161 PolarHBondContact O-N 3.48Å; H157-Y178 HydrophobicContact CB-CD2 3.62Å; H157-Y178 HydrophobicContact CB-CE2 3.48Å; H157-Y178 VanDerWaalsContact CB-CE2 3.48Å; H157-Y178 HydrophobicContact CB-CG 4.45Å; H157-Y178 AromaticContact CE1-CE1 3.95Å; H157-Y178 AromaticContact CE1-CZ 3.84Å; H157-Y178 AromaticContact CG-CE2 3.62Å; H157-Y178 AromaticContact CG-CZ 3.82Å; H157-Y178 AromaticContact ND1-CD1 3.77Å; H157-Y178 AromaticContact ND1-CD2 3.73Å; H157-Y178 AromaticContact ND1-CE1 3.33Å; H157-Y178 VanDerWaalsContact ND1-CE1 3.33Å; H157-Y178 WeakPolarHBondContact ND1-CE1 3.35Å; H157-Y178 AromaticContact ND1-CE2 3.31Å; H157-Y178 VanDerWaalsContact ND1-CE2 3.31Å; H157-Y178 WeakPolarHBondContact ND1-CE2 3.08Å; H157-Y178 AromaticContact ND1-CG 3.95Å; H157-Y178 AromaticContact ND1-CZ 3.09Å; H157-Y178 PolarHBondContact ND1-OH 3.38Å
158G86Confident84.6Confident0 Ų038.1 Ų38.10%019%0.191CC..Hα-helixtrans-61-43.3175.700000112.6V154 L155 M161 Y162V154-G158 PolarHBondContact O-N 3.21Å; L155-G158 PolarHBondContact O-N 3.45Å; L155-G158 VanDerWaalsContact O-N 3.13Å; G158-M161 PolarHBondContact O-N 3.4Å; G158-Y162 VanDerWaalsContact O-CB 3.32Å; G158-Y162 WeakPolarHBondContact O-CB 3.49Å; G158-Y162 PolarHBondContact O-N 3.4Å
159L87.1Confident83.6Confident46 Ų4641.6 Ų41.624%0.24121%0.208CC..Hα-helixtrans-65.5-44.2176.1-71.2177000112M112 L155 L156 M161 Y162 F163M112-L159 HydrophobicContact CE-CD2 4.45Å; M112-L159 HydrophobicContact SD-CD2 4.31Å; M112-L159 HydrophobicContact SD-CG 4.5Å; L155-L159 HydrophobicContact CD1-CD1 4.41Å; L155-L159 HydrophobicContact CD1-CG 4.38Å; L155-L159 HydrophobicContact CG-CD1 4.05Å; L155-L159 HydrophobicContact CG-CG 4.4Å; L155-L159 WeakPolarHBondContact O-CG 3.31Å; L155-L159 PolarHBondContact O-N 3.03Å; L156-L159 PolarHBondContact O-N 2.85Å; L159-M161 VanDerWaalsContact C-N 3.34Å; L159-M161 PolarHBondContact O-N 3.38Å; L159-Y162 WeakPolarHBondContact O-CB 3.28Å; L159-Y162 PolarHBondContact O-N 3.38Å; L159-F163 WeakPolarHBondContact O-CD2 3.26Å; L159-F163 PolarHBondContact O-N 3.04Å
160N84.5Confident82.5Confident7 Ų745.3 Ų45.34%0.03723%0.225CC..Hα-helixtrans-57.6-49.1176-172.452.9000110.5L156 H157 Y162 F163 I164 W174L156-N160 VanDerWaalsContact O-CB 3.22Å; L156-N160 WeakPolarHBondContact O-CB 3.4Å; L156-N160 PolarHBondContact O-N 3.31Å; H157-N160 PolarHBondContact O-N 3.4Å; N160-Y162 VanDerWaalsContact C-N 3.33Å; N160-Y162 PolarHBondContact O-N 3.24Å; N160-F163 PolarHBondContact O-N 2.88Å; N160-I164 WeakPolarHBondContact O-CB 3.31Å; N160-I164 WeakPolarHBondContact O-CD1 3.32Å; N160-I164 WeakPolarHBondContact O-CG1 3.36Å; N160-I164 PolarHBondContact O-N 3.25Å; N160-W174 HydrophobicContact CB-CB 4.36Å
161M82Confident81.5Confident28 Ų2847.9 Ų47.914%0.13824%0.239CC..Hα-helixtrans-62.7-37.6176.3-71.9-66.3-175.400112.9L100 P108 H157 G158 L159 I164 G165L100-M161 HydrophobicContact CD2-SD 4.38Å; P108-M161 HydrophobicContact CB-CB 4.04Å; H157-M161 WeakPolarHBondContact O-CG 3.32Å; H157-M161 PolarHBondContact O-N 3.48Å; G158-M161 PolarHBondContact O-N 3.4Å; L159-M161 VanDerWaalsContact C-N 3.34Å; L159-M161 PolarHBondContact O-N 3.38Å; M161-I164 HydrophobicContact SD-CD1 4.44Å; M161-G165 PolarHBondContact O-N 3.32Å
162Y85.6Confident80.4Confident126 Ų12654.2 Ų54.249%0.49427%0.269SS..Hα-helixtrans-64.2-45.7175.9177.8-99.8000112.1G158 L159 N160 G165 I166G158-Y162 VanDerWaalsContact O-CB 3.32Å; G158-Y162 WeakPolarHBondContact O-CB 3.49Å; G158-Y162 PolarHBondContact O-N 3.4Å; L159-Y162 WeakPolarHBondContact O-CB 3.28Å; L159-Y162 PolarHBondContact O-N 3.38Å; N160-Y162 VanDerWaalsContact C-N 3.33Å; N160-Y162 PolarHBondContact O-N 3.24Å; Y162-G165 PolarHBondContact O-N 3.04Å; Y162-I166 HydrophobicContact CD1-CD1 4.17Å; Y162-I166 HydrophobicContact CE1-CD1 3.52Å; Y162-I166 HydrophobicContact CE2-CD1 3.9Å; Y162-I166 PolarHBondContact O-N 3.16Å; Y162-I166 WeakPolarHBondContact OH-CD1 3.32Å
163F84.6Confident79.5Confident62 Ų6255.6 Ų55.627%0.27229%0.287SS..Hα-helixtrans-64.9-42.5176.7-78.3-63.4000112.1L159 N160 G165 I166 Q167L159-F163 WeakPolarHBondContact O-CD2 3.26Å; L159-F163 PolarHBondContact O-N 3.04Å; N160-F163 PolarHBondContact O-N 2.88Å; F163-G165 VanDerWaalsContact C-N 3.25Å; F163-G165 PolarHBondContact O-N 2.95Å; F163-I166 PolarHBondContact O-N 2.88Å; F163-I166 VanDerWaalsContact O-N 3.16Å; F163-Q167 PolarHBondContact O-N 3.31Å
164I81Confident78.8Confident24 Ų2459.5 Ų59.512%0.12330%0.301CS..Hα-helixtrans-58-42.3173.5-67162.3000110.3N160 M161 I166 G168 Q170N160-I164 WeakPolarHBondContact O-CB 3.31Å; N160-I164 WeakPolarHBondContact O-CD1 3.32Å; N160-I164 WeakPolarHBondContact O-CG1 3.36Å; N160-I164 PolarHBondContact O-N 3.25Å; M161-I164 HydrophobicContact SD-CD1 4.44Å; I164-I166 VanDerWaalsContact C-N 3.26Å; I164-I166 PolarHBondContact O-N 3.47Å; I164-G168 VanDerWaalsContact O-CA 3.24Å; I164-G168 WeakPolarHBondContact O-CA 3.39Å; I164-G168 PolarHBondContact O-N 3.41Å; I164-Q170 HydrophobicContact CD1-CB 4.46Å; I164-Q170 HydrophobicContact CD1-CG 3.68Å; I164-Q170 HydrophobicContact CG1-CB 4.36Å; I164-Q170 HydrophobicContact CG1-CG 3.81Å
165G80.7Confident78.3Confident5 Ų559.4 Ų59.45%0.05230%0.301CS..Hα-helixtrans-59.8-32.1178.200000114.7S98 Y99 M161 Y162 F163S98-G165 WeakPolarHBondContact CA-O 3.36Å; Y99-G165 PolarHBondContact N-O 3.32Å; M161-G165 PolarHBondContact O-N 3.32Å; Y162-G165 PolarHBondContact O-N 3.04Å; F163-G165 VanDerWaalsContact C-N 3.25Å; F163-G165 PolarHBondContact O-N 2.95Å
166I80Confident77.6Confident95 Ų9560.1 Ų60.149%0.48731%0.307SS..Hα-helixtrans-93.6-48.8-177.2-65.2176000111.9Y99 Y162 F163 I164Y99-I166 WeakPolarHBondContact CD2-O 3.33Å; Y99-I166 WeakPolarHBondContact CE2-O 3.43Å; Y162-I166 HydrophobicContact CD1-CD1 4.17Å; Y162-I166 HydrophobicContact CE1-CD1 3.52Å; Y162-I166 HydrophobicContact CE2-CD1 3.9Å; Y162-I166 PolarHBondContact O-N 3.16Å; Y162-I166 WeakPolarHBondContact OH-CD1 3.32Å; F163-I166 PolarHBondContact O-N 2.88Å; F163-I166 VanDerWaalsContact O-N 3.16Å; I164-I166 VanDerWaalsContact C-N 3.26Å; I164-I166 PolarHBondContact O-N 3.47Å
167Q78.4Confident77.1Confident104 Ų10463 Ų6349%0.48632%0.322SS..Hα-helixtrans-90.1-18.5-172.8-71.8169.1-6.100112.8F163 Q169 L171F163-Q167 PolarHBondContact O-N 3.31Å; Q167-Q169 PolarHBondContact O-N 3.42Å; Q167-Q169 VanDerWaalsContact O-N 3.13Å; Q167-L171 VanDerWaalsContact OE1-CD1 3.24Å
168G70.8Confident76.8Confident35 Ų3563.2 Ų63.236%0.36132%0.323SS..SBendtrans69.20.2-176.200000114.3Y99 I164Y99-G168 VanDerWaalsContact CG-CA 3.48Å; I164-G168 VanDerWaalsContact O-CA 3.24Å; I164-G168 WeakPolarHBondContact O-CA 3.39Å; I164-G168 PolarHBondContact O-N 3.41Å
169Q69.5Low76.5Confident148 Ų14865.7 Ų65.769%0.69233%0.332SS*.SBendtrans-121.6136.9176.5-66.5-168-2600109.7Q167 L171Q167-Q169 PolarHBondContact O-N 3.42Å; Q167-Q169 VanDerWaalsContact O-N 3.13Å; Q169-L171 PolarHBondContact O-N 2.84Å
170Q65.4Low76.2Confident101 Ų10167.4 Ų67.447%0.47234%0.341SS..  trans-71.7121.8171.7-60.8-175.9-3100108.2I164 E172I164-Q170 HydrophobicContact CD1-CB 4.46Å; I164-Q170 HydrophobicContact CD1-CG 3.68Å; I164-Q170 HydrophobicContact CG1-CB 4.36Å; I164-Q170 HydrophobicContact CG1-CG 3.81Å; Q170-E172 PolarHBondContact O-N 2.85Å
171L63.9Low76Confident74 Ų7468.3 Ų68.339%0.38735%0.346SS..  trans-76.8106.1165.7-100.672.9000107.7Q167 Q169 A173 W174 A175Q167-L171 VanDerWaalsContact OE1-CD1 3.24Å; Q169-L171 PolarHBondContact O-N 2.84Å; L171-A173 PolarHBondContact O-N 3.15Å; L171-W174 PolarHBondContact O-N 2.87Å; L171-A175 PolarHBondContact O-N 3.38Å
172E68.5Low75.8Confident138 Ų13868.3 Ų68.365%0.64535%0.346SS*.Hα-helixtrans-41.9-41.4-179.9-65.5-65151.600113.3Q170 W174 A175 V176Q170-E172 PolarHBondContact O-N 2.85Å; E172-W174 PolarHBondContact O-N 2.92Å; E172-A175 PolarHBondContact O-N 3.47Å; E172-V176 VanDerWaalsContact O-CG2 3.27Å; E172-V176 WeakPolarHBondContact O-CG2 3.39Å; E172-V176 PolarHBondContact O-N 3.24Å
173A70Confident75.6Confident74 Ų7464.4 Ų64.461%0.61233%0.333SS*.Hα-helixtrans-61.8-40.5-177.900000113.8L171 L177L171-A173 PolarHBondContact O-N 3.15Å; A173-L177 WeakPolarHBondContact O-CB 3.49Å; A173-L177 PolarHBondContact O-N 2.86Å
174W73.5Confident75.5Confident86 Ų8664.8 Ų64.833%0.32634%0.337SS..Hα-helixtrans-73.4-37.7-179.6-66.9114.5000111.7L156 N160 L171 E172 L177 Y178L156-W174 HydrophobicContact CD2-CE3 3.81Å; L156-W174 HydrophobicContact CD2-CZ3 3.67Å; N160-W174 HydrophobicContact CB-CB 4.36Å; L171-W174 PolarHBondContact O-N 2.87Å; E172-W174 PolarHBondContact O-N 2.92Å; W174-L177 HydrophobicContact CE3-CD2 4.38Å; W174-L177 HydrophobicContact CZ3-CD2 4.38Å; W174-L177 PolarHBondContact O-N 3.38Å; W174-Y178 WeakPolarHBondContact O-CB 3.37Å; W174-Y178 PolarHBondContact O-N 2.95Å
175A75.4Confident75.5Confident4 Ų464.7 Ų64.73%0.03334%0.336CS..Hα-helixtrans-62.5-50.2175.100000110.7L171 E172 L177 Y178 Y179L171-A175 PolarHBondContact O-N 3.38Å; E172-A175 PolarHBondContact O-N 3.47Å; A175-L177 VanDerWaalsContact C-N 3.35Å; A175-L177 PolarHBondContact O-N 3.25Å; A175-Y178 WeakPolarHBondContact O-CB 3.27Å; A175-Y178 PolarHBondContact O-N 3.38Å; A175-Y179 VanDerWaalsContact C-CD2 3.49Å; A175-Y179 HydrophobicContact CB-CE2 3.88Å; A175-Y179 WeakPolarHBondContact O-CD2 3.42Å; A175-Y179 WeakPolarHBondContact O-CE2 3.44Å; A175-Y179 PolarHBondContact O-N 3.38Å
176V74.4Confident75.4Confident74 Ų7465.2 Ų65.245%0.44834%0.341SS..Hα-helixtrans-58-46.2176.81730000111.4E172 Y178 Y179 I180E172-V176 VanDerWaalsContact O-CG2 3.27Å; E172-V176 WeakPolarHBondContact O-CG2 3.39Å; E172-V176 PolarHBondContact O-N 3.24Å; V176-Y178 VanDerWaalsContact C-N 3.33Å; V176-Y178 PolarHBondContact O-N 2.96Å; V176-Y179 PolarHBondContact O-N 2.96Å; V176-I180 HydrophobicContact CG1-CD1 3.73Å; V176-I180 HydrophobicContact CG1-CG1 4.36Å; V176-I180 VanDerWaalsContact O-CG1 3.31Å; V176-I180 WeakPolarHBondContact O-CG1 3.31Å; V176-I180 PolarHBondContact O-N 3.41Å
177L75.5Confident75.3Confident73 Ų7362 Ų6238%0.38233%0.327SS..Hα-helixtrans-62.8-41179-174.364.2000111.8L156 A173 W174 A175 I180 L181L156-L177 HydrophobicContact CD1-CD2 3.74Å; L156-L177 HydrophobicContact CD1-CG 3.76Å; L156-L177 HydrophobicContact CD2-CD2 4.05Å; A173-L177 WeakPolarHBondContact O-CB 3.49Å; A173-L177 PolarHBondContact O-N 2.86Å; W174-L177 HydrophobicContact CE3-CD2 4.38Å; W174-L177 HydrophobicContact CZ3-CD2 4.38Å; W174-L177 PolarHBondContact O-N 3.38Å; A175-L177 VanDerWaalsContact C-N 3.35Å; A175-L177 PolarHBondContact O-N 3.25Å; L177-I180 PolarHBondContact O-N 2.87Å; L177-L181 HydrophobicContact CD1-CD1 4.25Å; L177-L181 HydrophobicContact CG-CD1 4.14Å; L177-L181 WeakPolarHBondContact O-CB 3.41Å; L177-L181 PolarHBondContact O-N 3.33Å
178Y76.5Confident75.5Confident24 Ų2459.6 Ų59.69%0.09432%0.317CS..Hα-helixtrans-59-48.3173.7165.2-105.3000111.3S153 H157 W174 A175 V176 I180 L181 H182S153-Y178 WeakPolarHBondContact O-CD2 3.45Å; H157-Y178 HydrophobicContact CB-CD2 3.62Å; H157-Y178 HydrophobicContact CB-CE2 3.48Å; H157-Y178 VanDerWaalsContact CB-CE2 3.48Å; H157-Y178 HydrophobicContact CB-CG 4.45Å; H157-Y178 AromaticContact CE1-CE1 3.95Å; H157-Y178 AromaticContact CE1-CZ 3.84Å; H157-Y178 AromaticContact CG-CE2 3.62Å; H157-Y178 AromaticContact CG-CZ 3.82Å; H157-Y178 AromaticContact ND1-CD1 3.77Å; H157-Y178 AromaticContact ND1-CD2 3.73Å; H157-Y178 AromaticContact ND1-CE1 3.33Å; H157-Y178 VanDerWaalsContact ND1-CE1 3.33Å; H157-Y178 WeakPolarHBondContact ND1-CE1 3.35Å; H157-Y178 AromaticContact ND1-CE2 3.31Å; H157-Y178 VanDerWaalsContact ND1-CE2 3.31Å; H157-Y178 WeakPolarHBondContact ND1-CE2 3.08Å; H157-Y178 AromaticContact ND1-CG 3.95Å; H157-Y178 AromaticContact ND1-CZ 3.09Å; H157-Y178 PolarHBondContact ND1-OH 3.38Å; W174-Y178 WeakPolarHBondContact O-CB 3.37Å; W174-Y178 PolarHBondContact O-N 2.95Å; A175-Y178 WeakPolarHBondContact O-CB 3.27Å; A175-Y178 PolarHBondContact O-N 3.38Å; V176-Y178 VanDerWaalsContact C-N 3.33Å; V176-Y178 PolarHBondContact O-N 2.96Å; Y178-I180 PolarHBondContact O-N 2.88Å; Y178-L181 PolarHBondContact O-N 2.87Å; Y178-H182 AromaticContact CE2-ND1 3.94Å; Y178-H182 AromaticContact CZ-ND1 3.55Å; Y178-H182 VanDerWaalsContact O-CB 3.31Å; Y178-H182 WeakPolarHBondContact O-CB 3.39Å; Y178-H182 PolarHBondContact O-N 3.15Å; Y178-H182 PolarHBondContact OH-ND1 3.34Å
179Y79.6Confident75.9Confident51 Ų5161.1 Ų61.120%0.232%0.316CS..Hα-helixtrans-62.6-44.3179.6-63.9-48.8000112A175 V176 L181 H182 L183 I230 E234A175-Y179 VanDerWaalsContact C-CD2 3.49Å; A175-Y179 HydrophobicContact CB-CE2 3.88Å; A175-Y179 WeakPolarHBondContact O-CD2 3.42Å; A175-Y179 WeakPolarHBondContact O-CE2 3.44Å; A175-Y179 PolarHBondContact O-N 3.38Å; V176-Y179 PolarHBondContact O-N 2.96Å; Y179-L181 VanDerWaalsContact C-N 3.35Å; Y179-L181 PolarHBondContact O-N 2.82Å; Y179-H182 WeakPolarHBondContact O-CB 3.41Å; Y179-H182 PolarHBondContact O-N 3.43Å; Y179-L183 WeakPolarHBondContact O-CG 3.48Å; Y179-L183 PolarHBondContact O-N 3.4Å; Y179-I230 HydrophobicContact CD1-CB 4.41Å; Y179-I230 HydrophobicContact CD1-CD1 4.17Å; Y179-I230 HydrophobicContact CD1-CG1 4.08Å; Y179-I230 HydrophobicContact CD1-CG2 3.47Å; Y179-I230 VanDerWaalsContact CD1-CG2 3.47Å; Y179-I230 HydrophobicContact CE1-CG2 3.75Å; Y179-I230 HydrophobicContact CG-CD1 4.49Å; Y179-I230 HydrophobicContact CG-CG2 4Å; Y179-E234 PolarHBondContact OH-OE1 3.14Å
180I81.1Confident76.4Confident83 Ų8355.1 Ų55.143%0.42629%0.288SS..Hα-helixtrans-58.8-48.3177-68.9168.5000110.4V176 L177 Y178 H182 L183 I184V176-I180 HydrophobicContact CG1-CD1 3.73Å; V176-I180 HydrophobicContact CG1-CG1 4.36Å; V176-I180 VanDerWaalsContact O-CG1 3.31Å; V176-I180 WeakPolarHBondContact O-CG1 3.31Å; V176-I180 PolarHBondContact O-N 3.41Å; L177-I180 PolarHBondContact O-N 2.87Å; Y178-I180 PolarHBondContact O-N 2.88Å; I180-H182 VanDerWaalsContact C-N 3.3Å; I180-H182 PolarHBondContact O-N 2.93Å; I180-L183 PolarHBondContact O-N 3.5Å; I180-I184 HydrophobicContact CG2-CD1 3.78Å; I180-I184 HydrophobicContact CG2-CG1 4.49Å; I180-I184 WeakPolarHBondContact O-CG1 3.07Å; I180-I184 PolarHBondContact O-N 3.3Å
181L79.1Confident77Confident25 Ų2551.6 Ų51.613%0.13128%0.279CS..Hα-helixtrans-68-31.3178.8-78.2164.4000112.6L149 I152 L156 L177 Y178 Y179 K185L149-L181 HydrophobicContact CD2-CD2 3.97Å; I152-L181 HydrophobicContact CG2-CD1 3.68Å; L156-L181 HydrophobicContact CD1-CD1 3.13Å; L177-L181 HydrophobicContact CD1-CD1 4.25Å; L177-L181 HydrophobicContact CG-CD1 4.14Å; L177-L181 WeakPolarHBondContact O-CB 3.41Å; L177-L181 PolarHBondContact O-N 3.33Å; Y178-L181 PolarHBondContact O-N 2.87Å; Y179-L181 VanDerWaalsContact C-N 3.35Å; Y179-L181 PolarHBondContact O-N 2.82Å; L181-K185 WeakPolarHBondContact O-CB 3.36Å; L181-K185 PolarHBondContact O-N 3.17Å
182H78.5Confident77.7Confident29 Ų2948.4 Ų48.413%0.13426%0.262CS..Hα-helixtrans-63.4-45.4172.6-160.6112.9000111.1Y178 Y179 I180 K185 G186Y178-H182 AromaticContact CE2-ND1 3.94Å; Y178-H182 AromaticContact CZ-ND1 3.55Å; Y178-H182 VanDerWaalsContact O-CB 3.31Å; Y178-H182 WeakPolarHBondContact O-CB 3.39Å; Y178-H182 PolarHBondContact O-N 3.15Å; Y178-H182 PolarHBondContact OH-ND1 3.34Å; Y179-H182 WeakPolarHBondContact O-CB 3.41Å; Y179-H182 PolarHBondContact O-N 3.43Å; I180-H182 VanDerWaalsContact C-N 3.3Å; I180-H182 PolarHBondContact O-N 2.93Å; H182-K185 PolarHBondContact O-N 3.47Å; H182-G186 PolarHBondContact O-N 2.96Å
183L81.6Confident78.2Confident43 Ų4343.1 Ų43.123%0.22524%0.238CC..Hα-helixtrans-61.6-47.4175.6-69.1178.1000112.1Y179 I180 K185 G186 S187 N226 I227 I230Y179-L183 WeakPolarHBondContact O-CG 3.48Å; Y179-L183 PolarHBondContact O-N 3.4Å; I180-L183 PolarHBondContact O-N 3.5Å; L183-K185 VanDerWaalsContact C-N 3.34Å; L183-K185 PolarHBondContact O-N 3.05Å; L183-G186 PolarHBondContact O-N 2.93Å; L183-S187 PolarHBondContact O-N 3.4Å; L183-S187 PolarHBondContact O-OG 3.37Å; L183-N226 VanDerWaalsContact CD2-C 3.48Å; L183-N226 HydrophobicContact CD2-CB 3.46Å; L183-N226 VanDerWaalsContact CD2-CB 3.46Å; L183-I227 HydrophobicContact CD1-CG1 4.15Å; L183-I227 HydrophobicContact CD2-CB 4.48Å; L183-I227 HydrophobicContact CD2-CG1 3.71Å; L183-I230 HydrophobicContact CD1-CD1 4.37Å; L183-I230 HydrophobicContact CD2-CD1 3.52Å; L183-I230 HydrophobicContact CG-CD1 3.67Å
184I82.3Confident78.4Confident71 Ų7139.8 Ų39.836%0.36421%0.21SC..Hα-helixtrans-62.4-43.6179-68.2169.3000110.2L149 I180 S187 L188L149-I184 HydrophobicContact CD1-CG2 4.09Å; I180-I184 HydrophobicContact CG2-CD1 3.78Å; I180-I184 HydrophobicContact CG2-CG1 4.49Å; I180-I184 WeakPolarHBondContact O-CG1 3.07Å; I180-I184 PolarHBondContact O-N 3.3Å; I184-S187 PolarHBondContact O-OG 2.99Å; I184-L188 HydrophobicContact CG2-CD1 3.66Å; I184-L188 HydrophobicContact CG2-CG 4.33Å; I184-L188 VanDerWaalsContact O-CB 3.32Å; I184-L188 WeakPolarHBondContact O-CB 3.4Å; I184-L188 VanDerWaalsContact O-CG 3.25Å; I184-L188 WeakPolarHBondContact O-CG 3.27Å; I184-L188 PolarHBondContact O-N 3.47Å
185K80.5Confident78.5Confident22 Ų2236.5 Ų36.510%0.09620%0.199CC..Hα-helixtrans-62.4-46177177.9-162.1140.2-1600111.7K150 L181 H182 L183 L188 L189K150-K185 HydrophobicContact CB-CD 4.44Å; K150-K185 HydrophobicContact CD-CD 3.93Å; K150-K185 VanDerWaalsContact CD-CE 3.4Å; L181-K185 WeakPolarHBondContact O-CB 3.36Å; L181-K185 PolarHBondContact O-N 3.17Å; H182-K185 PolarHBondContact O-N 3.47Å; L183-K185 VanDerWaalsContact C-N 3.34Å; L183-K185 PolarHBondContact O-N 3.05Å; K185-L188 PolarHBondContact O-N 2.93Å; K185-L189 WeakPolarHBondContact O-CB 3.43Å; K185-L189 PolarHBondContact O-N 3.38Å
186G79.3Confident78.4Confident15 Ų1538 Ų3816%0.15521%0.207CC..Hα-helixtrans-61.1-48.7-179.300000112.4H182 L183 L189 F190 N226H182-G186 PolarHBondContact O-N 2.96Å; L183-G186 PolarHBondContact O-N 2.93Å; G186-L189 PolarHBondContact O-N 3.23Å; G186-F190 PolarHBondContact O-N 3.17Å; G186-N226 WeakPolarHBondContact CA-OD1 3.42Å
187S78.4Confident78.1Confident28 Ų2834.6 Ų34.620%0.19619%0.186CC..Hα-helixtrans-63.5-43.217753.80000113L183 I184 L189 G191 Q222L183-S187 PolarHBondContact O-N 3.4Å; L183-S187 PolarHBondContact O-OG 3.37Å; I184-S187 PolarHBondContact O-OG 2.99Å; S187-L189 PolarHBondContact O-N 2.92Å; S187-G191 PolarHBondContact O-N 2.9Å; S187-Q222 PolarHBondContact O-OE1 2.99Å
188L80.9Confident77.7Confident54 Ų5431.7 Ų31.728%0.28317%0.172SC..Hα-helixtrans-66.9-37.3178.4-74.2172.4000113L146 L149 I184 K185 F190 G191 T192L146-L188 HydrophobicContact CD2-CB 3.48Å; L146-L188 VanDerWaalsContact CD2-CB 3.48Å; L149-L188 HydrophobicContact CD1-CD1 3.18Å; I184-L188 HydrophobicContact CG2-CD1 3.66Å; I184-L188 HydrophobicContact CG2-CG 4.33Å; I184-L188 VanDerWaalsContact O-CB 3.32Å; I184-L188 WeakPolarHBondContact O-CB 3.4Å; I184-L188 VanDerWaalsContact O-CG 3.25Å; I184-L188 WeakPolarHBondContact O-CG 3.27Å; I184-L188 PolarHBondContact O-N 3.47Å; K185-L188 PolarHBondContact O-N 2.93Å; L188-F190 VanDerWaalsContact C-N 3.35Å; L188-G191 PolarHBondContact O-N 3.25Å; L188-T192 WeakPolarHBondContact O-CB 3.32Å; L188-T192 PolarHBondContact O-N 2.76Å; L188-T192 PolarHBondContact O-OG1 3.26Å
189L80.2Confident77Confident66 Ų6631 Ų3135%0.34617%0.172SC..Hα-helixtrans-60.5-48.6179.2-179.9141.9000110.2L146 K185 G186 S187 T192 I193L146-L189 HydrophobicContact CD2-CB 4.38Å; K185-L189 WeakPolarHBondContact O-CB 3.43Å; K185-L189 PolarHBondContact O-N 3.38Å; G186-L189 PolarHBondContact O-N 3.23Å; S187-L189 PolarHBondContact O-N 2.92Å; L189-T192 PolarHBondContact O-N 2.92Å; L189-I193 HydrophobicContact CD2-CD1 3.66Å; L189-I193 HydrophobicContact CG-CD1 4.44Å; L189-I193 WeakPolarHBondContact O-CG1 2.95Å; L189-I193 PolarHBondContact O-N 3.43Å; L189-I193 VanDerWaalsContact O-N 3.07Å
190F79.5Confident76.2Confident22 Ų2233 Ų3310%0.09618%0.179CC..Hα-helixtrans-67.4-44.8178.9-168.1-69.3000111.8G186 L188 T192 I193 V194 V218 Q222 C256 V260G186-F190 PolarHBondContact O-N 3.17Å; L188-F190 VanDerWaalsContact C-N 3.35Å; F190-T192 PolarHBondContact O-N 3.37Å; F190-I193 PolarHBondContact O-N 3.47Å; F190-I193 VanDerWaalsContact O-N 3.08Å; F190-V194 HydrophobicContact CD1-CG2 3.78Å; F190-V194 HydrophobicContact CE1-CG2 3.58Å; F190-V194 PolarHBondContact O-N 3.22Å; F190-V218 HydrophobicContact CD1-CG1 4.36Å; F190-V218 HydrophobicContact CE1-CG1 3.37Å; F190-V218 HydrophobicContact CZ-CG1 3.72Å; F190-Q222 HydrophobicContact CB-CG 4.14Å; F190-Q222 HydrophobicContact CD1-CG 3.95Å; F190-Q222 HydrophobicContact CD2-CG 4.02Å; F190-Q222 HydrophobicContact CE1-CG 4.22Å; F190-Q222 HydrophobicContact CE2-CG 4.28Å; F190-Q222 HydrophobicContact CG-CG 3.78Å; F190-Q222 HydrophobicContact CZ-CG 4.31Å; F190-C256 HydrophobicContact CE2-CB 4.09Å; F190-C256 WeakPolarHBondContact CE2-O 3.36Å; F190-C256 WeakPolarHBondContact CE2-SG 3.37Å; F190-C256 VanDerWaalsContact CZ-O 3.27Å; F190-C256 WeakPolarHBondContact CZ-O 3.29Å; F190-C256 VanDerWaalsContact CZ-SG 3.52Å; F190-V260 HydrophobicContact CD1-CG2 4.29Å; F190-V260 HydrophobicContact CD2-CG2 3.79Å; F190-V260 HydrophobicContact CE1-CG2 3.64Å; F190-V260 HydrophobicContact CE2-CB 4.46Å; F190-V260 HydrophobicContact CE2-CG2 3.01Å; F190-V260 HydrophobicContact CG-CG2 4.41Å; F190-V260 HydrophobicContact CZ-CB 4.23Å; F190-V260 HydrophobicContact CZ-CG2 2.99Å
191G77.6Confident74.9Confident27 Ų2733.7 Ų33.728%0.27819%0.187SC..Hα-helixtrans-55.4-38.9175.200000112.4S187 L188 L195S187-G191 PolarHBondContact O-N 2.9Å; L188-G191 PolarHBondContact O-N 3.25Å; G191-L195 VanDerWaalsContact O-CB 3.3Å; G191-L195 WeakPolarHBondContact O-CB 3.02Å; G191-L195 PolarHBondContact O-N 3.3Å
192T79.8Confident73.4Confident7 Ų734.6 Ų34.64%0.04319%0.192CC..Hα-helixtrans-68.5-40.4176.5-55.50000112.2L142 L146 L188 L189 F190 L195 I196L142-T192 HydrophobicContact CD2-CG2 3.89Å; L142-T192 VanDerWaalsContact CD2-OG1 3.25Å; L142-T192 WeakPolarHBondContact CD2-OG1 3.38Å; L142-T192 HydrophobicContact CG-CG2 4.25Å; L142-T192 WeakPolarHBondContact CG-OG1 3.23Å; L146-T192 HydrophobicContact CD1-CG2 3.81Å; L146-T192 WeakPolarHBondContact CD1-OG1 3.43Å; L188-T192 WeakPolarHBondContact O-CB 3.32Å; L188-T192 PolarHBondContact O-N 2.76Å; L188-T192 PolarHBondContact O-OG1 3.26Å; L189-T192 PolarHBondContact O-N 2.92Å; F190-T192 PolarHBondContact O-N 3.37Å; T192-L195 WeakPolarHBondContact O-CB 3.44Å; T192-L195 PolarHBondContact O-N 3.06Å; T192-I196 HydrophobicContact CG2-CD1 4.03Å; T192-I196 HydrophobicContact CG2-CG1 4.44Å; T192-I196 VanDerWaalsContact O-CG1 3.25Å; T192-I196 WeakPolarHBondContact O-CG1 3.34Å; T192-I196 PolarHBondContact O-N 2.95Å
193I79.3Confident72Confident27 Ų2736.7 Ų36.714%0.13820%0.201CC..Hα-helixtrans-60.4-47.6176.6-68.5167.7000110.6L189 F190 L195 I196 G197 V260 V298L189-I193 HydrophobicContact CD2-CD1 3.66Å; L189-I193 HydrophobicContact CG-CD1 4.44Å; L189-I193 WeakPolarHBondContact O-CG1 2.95Å; L189-I193 PolarHBondContact O-N 3.43Å; L189-I193 VanDerWaalsContact O-N 3.07Å; F190-I193 PolarHBondContact O-N 3.47Å; F190-I193 VanDerWaalsContact O-N 3.08Å; I193-L195 VanDerWaalsContact C-N 3.3Å; I193-L195 PolarHBondContact O-N 3.41Å; I193-I196 PolarHBondContact O-N 3.45Å; I193-G197 PolarHBondContact O-N 2.88Å; I193-V260 HydrophobicContact CG2-CG1 3.66Å; I193-V298 HydrophobicContact CG2-CG1 4.05Å
194V74.1Confident70.7Confident4 Ų443.4 Ų43.42%0.02423%0.228CC..Hα-helixtrans-64.2-38.7177.8-179.10000111F190 I196 G197 T198 L215 P263F190-V194 HydrophobicContact CD1-CG2 3.78Å; F190-V194 HydrophobicContact CE1-CG2 3.58Å; F190-V194 PolarHBondContact O-N 3.22Å; V194-I196 VanDerWaalsContact C-N 3.33Å; V194-I196 PolarHBondContact O-N 3.17Å; V194-G197 PolarHBondContact O-N 2.91Å; V194-T198 HydrophobicContact CG1-CG2 4.09Å; V194-T198 WeakPolarHBondContact O-CB 3.38Å; V194-T198 WeakPolarHBondContact O-CG2 3.07Å; V194-T198 PolarHBondContact O-N 3.48Å; V194-T198 PolarHBondContact O-OG1 2.93Å; V194-L215 HydrophobicContact CB-CD2 4.28Å; V194-L215 HydrophobicContact CG1-CD2 3.59Å; V194-P263 HydrophobicContact CG1-CB 4.43Å; V194-P263 HydrophobicContact CG1-CG 4.48Å
195L74.2Confident69.2Low18 Ų1846.7 Ų46.79%0.09425%0.247CC..Hα-helixtrans-63.8-37.5176.9-170.665.6000112.6L142 G191 T192 I193 T198 G199 W200 F203L142-L195 HydrophobicContact CD2-CD2 3.52Å; G191-L195 VanDerWaalsContact O-CB 3.3Å; G191-L195 WeakPolarHBondContact O-CB 3.02Å; G191-L195 PolarHBondContact O-N 3.3Å; T192-L195 WeakPolarHBondContact O-CB 3.44Å; T192-L195 PolarHBondContact O-N 3.06Å; I193-L195 VanDerWaalsContact C-N 3.3Å; I193-L195 PolarHBondContact O-N 3.41Å; L195-T198 PolarHBondContact O-OG1 3.25Å; L195-G199 WeakPolarHBondContact O-CA 3.12Å; L195-G199 PolarHBondContact O-N 3.25Å; L195-W200 HydrophobicContact CD1-CE3 3.7Å; L195-W200 HydrophobicContact CD1-CZ3 3.9Å; L195-W200 HydrophobicContact CD2-CE3 3.78Å; L195-W200 HydrophobicContact CD2-CZ3 3.79Å; L195-W200 HydrophobicContact CG-CE3 4.04Å; L195-W200 HydrophobicContact CG-CZ3 4.36Å; L195-F203 HydrophobicContact CD1-CD2 3.41Å; L195-F203 VanDerWaalsContact CD1-CD2 3.41Å; L195-F203 HydrophobicContact CD1-CE2 3.34Å; L195-F203 HydrophobicContact CD1-CG 4.2Å; L195-F203 HydrophobicContact CD1-CZ 4.14Å
196I73.3Confident67.6Low36 Ų3651.3 Ų51.319%0.18527%0.267CS..Hα-helixtrans-66.6-45174.5-63.3160.9000109.7I139 T192 I193 V194 G199 F291 F294I139-I196 HydrophobicContact CG2-CG1 3.96Å; T192-I196 HydrophobicContact CG2-CD1 4.03Å; T192-I196 HydrophobicContact CG2-CG1 4.44Å; T192-I196 VanDerWaalsContact O-CG1 3.25Å; T192-I196 WeakPolarHBondContact O-CG1 3.34Å; T192-I196 PolarHBondContact O-N 2.95Å; I193-I196 PolarHBondContact O-N 3.45Å; V194-I196 VanDerWaalsContact C-N 3.33Å; V194-I196 PolarHBondContact O-N 3.17Å; I196-G199 PolarHBondContact O-N 3.48Å; I196-F291 WeakPolarHBondContact O-CE1 3.42Å; I196-F294 HydrophobicContact CB-CE1 3.99Å; I196-F294 HydrophobicContact CB-CZ 3.95Å; I196-F294 HydrophobicContact CD1-CZ 3.95Å; I196-F294 HydrophobicContact CG2-CD1 3.96Å; I196-F294 HydrophobicContact CG2-CE1 3.29Å; I196-F294 HydrophobicContact CG2-CE2 4.04Å; I196-F294 HydrophobicContact CG2-CZ 3.35Å
197G68.3Low66.3Low2 Ų251.9 Ų51.92%0.02127%0.266CS..Hα-helixtrans-64.4-43.5-179.100000114.2I193 V194 G199 S267I193-G197 PolarHBondContact O-N 2.88Å; V194-G197 PolarHBondContact O-N 2.91Å; G197-G199 VanDerWaalsContact C-N 3.34Å; G197-S267 WeakPolarHBondContact O-CB 3.11Å; G197-S267 PolarHBondContact O-OG 3.37Å
198T67.2Low65.4Low12 Ų1253.6 Ų53.67%0.07428%0.276CS..Hα-helixtrans-74.9-25.2176.653.10000112.5V194 L195 P263V194-T198 HydrophobicContact CG1-CG2 4.09Å; V194-T198 WeakPolarHBondContact O-CB 3.38Å; V194-T198 WeakPolarHBondContact O-CG2 3.07Å; V194-T198 PolarHBondContact O-N 3.48Å; V194-T198 PolarHBondContact O-OG1 2.93Å; L195-T198 PolarHBondContact O-OG1 3.25Å; T198-P263 HydrophobicContact CG2-CB 4.06Å
199G61.9Low64.7Low10 Ų1056.1 Ų56.110%0.10329%0.286CS..  trans73.6131.6-179.900000112.9L195 I196 G197 T201 L202 F203L195-G199 WeakPolarHBondContact O-CA 3.12Å; L195-G199 PolarHBondContact O-N 3.25Å; I196-G199 PolarHBondContact O-N 3.48Å; G197-G199 VanDerWaalsContact C-N 3.34Å; G199-T201 PolarHBondContact O-N 2.9Å; G199-T201 VanDerWaalsContact O-N 3.12Å; G199-L202 PolarHBondContact O-N 2.8Å; G199-F203 PolarHBondContact O-N 3.24Å
200W63.3Low64.1Low91 Ų9161 Ų6135%0.34530%0.3SS..Hα-helixtrans-60.5-27.4-177.7-169.9-93000114K138 I139 L195 F203K138-W200 HydrophobicContact CB-CZ2 4.43Å; K138-W200 HydrophobicContact CD-CH2 3.94Å; K138-W200 HydrophobicContact CD-CZ2 3.4Å; K138-W200 HydrophobicContact CG-CZ2 4.48Å; I139-W200 HydrophobicContact CD1-CB 3.96Å; I139-W200 HydrophobicContact CG1-CB 4.23Å; L195-W200 HydrophobicContact CD1-CE3 3.7Å; L195-W200 HydrophobicContact CD1-CZ3 3.9Å; L195-W200 HydrophobicContact CD2-CE3 3.78Å; L195-W200 HydrophobicContact CD2-CZ3 3.79Å; L195-W200 HydrophobicContact CG-CE3 4.04Å; L195-W200 HydrophobicContact CG-CZ3 4.36Å; W200-F203 VanDerWaalsContact O-CB 3.29Å; W200-F203 WeakPolarHBondContact O-CB 3.12Å; W200-F203 PolarHBondContact O-N 2.97Å
201T53.9Low63.7Low99 Ų9961.5 Ų61.561%0.60730%0.304SS*.Hα-helixtrans-75.6-32.7-177.359.10000113.1G199 F203G199-T201 PolarHBondContact O-N 2.9Å; G199-T201 VanDerWaalsContact O-N 3.12Å; T201-F203 VanDerWaalsContact C-N 3.33Å
202L47.1Very low63.5Low43 Ų4366.5 Ų66.523%0.22531%0.314CS..Hα-helixtrans-74.8-30.1171.2-69.2171000110.1G199 K204 N205 F206 L207G199-L202 PolarHBondContact O-N 2.8Å; L202-K204 VanDerWaalsContact C-N 3.29Å; L202-K204 PolarHBondContact O-N 3.48Å; L202-N205 PolarHBondContact O-N 3.4Å; L202-F206 HydrophobicContact CB-CB 4.36Å; L202-F206 HydrophobicContact CD2-CB 4.14Å; L202-F206 CarbonylContact O-C 3.29Å; L202-F206 VanDerWaalsContact O-C 3.29Å; L202-F206 WeakPolarHBondContact O-CA 3.32Å; L202-F206 WeakPolarHBondContact O-CB 3.2Å; L202-F206 PolarHBondContact O-N 3.28Å; L202-L207 PolarHBondContact O-N 3.02Å
203F49.9Very low63.3Low73 Ų7372.9 Ų72.932%0.3234%0.341SS..Hα-helixtrans-56.8-34.1-178.7-146.4-83.4000115L195 G199 W200 T201 L207 L215L195-F203 HydrophobicContact CD1-CD2 3.41Å; L195-F203 VanDerWaalsContact CD1-CD2 3.41Å; L195-F203 HydrophobicContact CD1-CE2 3.34Å; L195-F203 HydrophobicContact CD1-CG 4.2Å; L195-F203 HydrophobicContact CD1-CZ 4.14Å; G199-F203 PolarHBondContact O-N 3.24Å; W200-F203 VanDerWaalsContact O-CB 3.29Å; W200-F203 WeakPolarHBondContact O-CB 3.12Å; W200-F203 PolarHBondContact O-N 2.97Å; T201-F203 VanDerWaalsContact C-N 3.33Å; F203-L207 HydrophobicContact CD1-CD1 3.64Å; F203-L207 HydrophobicContact CD1-CG 4.41Å; F203-L207 HydrophobicContact CD2-CD1 3.37Å; F203-L207 HydrophobicContact CD2-CD2 4.32Å; F203-L207 HydrophobicContact CD2-CG 3.78Å; F203-L207 HydrophobicContact CE1-CD1 3.46Å; F203-L207 VanDerWaalsContact CE1-CD1 3.46Å; F203-L207 HydrophobicContact CE2-CD1 3.21Å; F203-L207 HydrophobicContact CE2-CD2 4.43Å; F203-L207 HydrophobicContact CE2-CG 4.07Å; F203-L207 HydrophobicContact CG-CD1 3.61Å; F203-L207 HydrophobicContact CG-CG 3.99Å; F203-L207 HydrophobicContact CZ-CD1 3.24Å; F203-L207 HydrophobicContact CZ-CG 4.47Å; F203-L215 HydrophobicContact CE2-CD1 4.24Å; F203-L215 HydrophobicContact CZ-CD1 4.41Å
204K53.5Low63.1Low184 Ų18473.2 Ų73.280%0.834%0.343SS*.THydrogen-bonded Turntrans-73.2-33.5-174.9-158.9180-179.2-171.50113.3L202L202-K204 VanDerWaalsContact C-N 3.29Å; L202-K204 PolarHBondContact O-N 3.48Å
205N51.9Low63.2Low140 Ų14074.4 Ų74.475%0.74935%0.349SS*.THydrogen-bonded Turntrans-126.2-15.1-172.2-680.1000114L202L202-N205 PolarHBondContact O-N 3.4Å
206F46.1Very low63.4Low119 Ų11980.6 Ų80.652%0.52238%0.379SS..  trans-141.213.3-161.2-107.5-77.5000114.1L202 V208L202-F206 HydrophobicContact CB-CB 4.36Å; L202-F206 HydrophobicContact CD2-CB 4.14Å; L202-F206 CarbonylContact O-C 3.29Å; L202-F206 VanDerWaalsContact O-C 3.29Å; L202-F206 WeakPolarHBondContact O-CA 3.32Å; L202-F206 WeakPolarHBondContact O-CB 3.2Å; L202-F206 PolarHBondContact O-N 3.28Å; F206-V208 HydrophobicContact CD1-CG2 4.01Å; F206-V208 WeakPolarHBondContact O-CG2 3.26Å; F206-V208 PolarHBondContact O-N 3.31Å
207L51.8Low63.7Low27 Ų2783 Ų8314%0.14140%0.396CS..  trans-66.278.2151.9-89.9-177.1000106.4L202 F203 E209 D211 L215L202-L207 PolarHBondContact O-N 3.02Å; F203-L207 HydrophobicContact CD1-CD1 3.64Å; F203-L207 HydrophobicContact CD1-CG 4.41Å; F203-L207 HydrophobicContact CD2-CD1 3.37Å; F203-L207 HydrophobicContact CD2-CD2 4.32Å; F203-L207 HydrophobicContact CD2-CG 3.78Å; F203-L207 HydrophobicContact CE1-CD1 3.46Å; F203-L207 VanDerWaalsContact CE1-CD1 3.46Å; F203-L207 HydrophobicContact CE2-CD1 3.21Å; F203-L207 HydrophobicContact CE2-CD2 4.43Å; F203-L207 HydrophobicContact CE2-CG 4.07Å; F203-L207 HydrophobicContact CG-CD1 3.61Å; F203-L207 HydrophobicContact CG-CG 3.99Å; F203-L207 HydrophobicContact CZ-CD1 3.24Å; F203-L207 HydrophobicContact CZ-CG 4.47Å; L207-E209 PolarHBondContact O-N 3.34Å; L207-D211 HydrophobicContact CD2-CB 3.27Å; L207-D211 HydrophobicContact CG-CB 4.49Å; L207-L215 HydrophobicContact CD1-CD1 4.06Å; L207-L215 HydrophobicContact CD2-CD1 4.26Å
208V59.1Low64.4Low65 Ų6583.3 Ų83.339%0.39440%0.397SS..  trans-38.4134.8168.1172.10000105.6F206 R210 D211 R212F206-V208 HydrophobicContact CD1-CG2 4.01Å; F206-V208 WeakPolarHBondContact O-CG2 3.26Å; F206-V208 PolarHBondContact O-N 3.31Å; V208-R210 HydrophobicContact CG1-CB 3.8Å; V208-R210 CarbonylContact O-C 3.53Å; V208-R210 PolarHBondContact O-N 2.84Å; V208-D211 PolarHBondContact O-N 2.81Å; V208-R212 PolarHBondContact O-N 3.27Å
209E66.6Low65.1Low107 Ų10786.6 Ų86.650%0.541%0.413SS..Hα-helixtrans-34.7-33.3174.4-10659.5-147.100113.8L207 R212 K213L207-E209 PolarHBondContact O-N 3.34Å; E209-R212 IonicContact OE1-CZ 3.16Å; E209-R212 IonicContact OE1-NH1 2.78Å; E209-R212 PolarHBondContact OE1-NH1 3.43Å; E209-R212 IonicContact OE1-NH2 2.67Å; E209-R212 PolarHBondContact OE1-NH2 3.5Å; E209-K213 WeakPolarHBondContact O-CB 3.19Å; E209-K213 VanDerWaalsContact O-CG 3.24Å; E209-K213 WeakPolarHBondContact O-CG 3.13Å; E209-K213 PolarHBondContact O-N 2.86Å
210R68.8Low66.2Low167 Ų16789.4 Ų89.463%0.6343%0.43SS*.Hα-helixtrans-59.8-52.9172.6-169.2-179.4-66.3145.9-0.4114.6V208 R212 K213 L214 W266V208-R210 HydrophobicContact CG1-CB 3.8Å; V208-R210 CarbonylContact O-C 3.53Å; V208-R210 PolarHBondContact O-N 2.84Å; R210-R212 VanDerWaalsContact C-N 3.33Å; R210-K213 PolarHBondContact O-N 3.4Å; R210-L214 PolarHBondContact O-N 2.96Å; R210-W266 HydrophobicContact CG-CH2 4.32Å; R210-W266 HydrophobicContact CG-CZ3 4.25Å
211D70.6Confident67.2Low34 Ų3487.5 Ų87.518%0.18243%0.426CS..Hα-helixtrans-68.3-36.5-178.5-65.9-18.2000110.9L207 V208 L214 L215 W266L207-D211 HydrophobicContact CD2-CB 3.27Å; L207-D211 HydrophobicContact CG-CB 4.49Å; V208-D211 PolarHBondContact O-N 2.81Å; D211-L214 PolarHBondContact O-N 3.29Å; D211-L215 WeakPolarHBondContact O-CG 3.28Å; D211-L215 PolarHBondContact O-N 3.38Å; D211-W266 WeakPolarHBondContact OD1-CZ3 3.47Å
212R72.1Confident68.7Low131 Ų13183 Ų8349%0.49440%0.398SS..Hα-helixtrans-61.8-43.3173.6-170.8175.172.7-130.93.6111.7V208 E209 R210 L214 L215 M216V208-R212 PolarHBondContact O-N 3.27Å; E209-R212 IonicContact OE1-CZ 3.16Å; E209-R212 IonicContact OE1-NH1 2.78Å; E209-R212 PolarHBondContact OE1-NH1 3.43Å; E209-R212 IonicContact OE1-NH2 2.67Å; E209-R212 PolarHBondContact OE1-NH2 3.5Å; R210-R212 VanDerWaalsContact C-N 3.33Å; R212-L214 VanDerWaalsContact C-N 3.33Å; R212-L215 PolarHBondContact O-N 3.3Å; R212-M216 WeakPolarHBondContact O-CB 3.32Å; R212-M216 PolarHBondContact O-N 2.79Å
213K77.3Confident70.6Confident141 Ų14183.7 Ų83.761%0.61340%0.404SS*.Hα-helixtrans-61.8-41.1173.8-78.3174.5-177.8-175.90111.6E209 R210 M216 V217E209-K213 WeakPolarHBondContact O-CB 3.19Å; E209-K213 VanDerWaalsContact O-CG 3.24Å; E209-K213 WeakPolarHBondContact O-CG 3.13Å; E209-K213 PolarHBondContact O-N 2.86Å; R210-K213 PolarHBondContact O-N 3.4Å; K213-M216 PolarHBondContact O-N 3.08Å; K213-V217 WeakPolarHBondContact O-CG2 3.48Å; K213-V217 PolarHBondContact O-N 3.37Å; K213-V217 VanDerWaalsContact O-N 3.15Å
214L74.9Confident72.3Confident34 Ų3483.3 Ų83.318%0.17841%0.407CS..Hα-helixtrans-63-46.8177.4-164.1153000110.8R210 D211 R212 M216 V217 V218 I262 P263 W266R210-L214 PolarHBondContact O-N 2.96Å; D211-L214 PolarHBondContact O-N 3.29Å; R212-L214 VanDerWaalsContact C-N 3.33Å; L214-M216 VanDerWaalsContact C-N 3.32Å; L214-M216 PolarHBondContact O-N 2.85Å; L214-V217 PolarHBondContact O-N 2.98Å; L214-V218 HydrophobicContact CD2-CB 4.43Å; L214-V218 HydrophobicContact CD2-CG2 3.66Å; L214-V218 HydrophobicContact CG-CG2 4.32Å; L214-V218 VanDerWaalsContact O-CB 3.29Å; L214-V218 WeakPolarHBondContact O-CB 3.46Å; L214-V218 WeakPolarHBondContact O-CG2 3.31Å; L214-V218 PolarHBondContact O-N 3.41Å; L214-I262 HydrophobicContact CD1-CG2 4.02Å; L214-P263 HydrophobicContact CD1-CG 4.36Å; L214-P263 HydrophobicContact CD2-CG 3.76Å; L214-W266 HydrophobicContact CD1-CH2 3.74Å; L214-W266 HydrophobicContact CD1-CZ3 3.63Å
215L75.5Confident73.7Confident29 Ų2975.2 Ų75.215%0.15237%0.373CS..Hα-helixtrans-58.8-41.5173.8-73.3174.5000112.7V194 F203 L207 D211 R212 V217 V218 I219V194-L215 HydrophobicContact CB-CD2 4.28Å; V194-L215 HydrophobicContact CG1-CD2 3.59Å; F203-L215 HydrophobicContact CE2-CD1 4.24Å; F203-L215 HydrophobicContact CZ-CD1 4.41Å; L207-L215 HydrophobicContact CD1-CD1 4.06Å; L207-L215 HydrophobicContact CD2-CD1 4.26Å; D211-L215 WeakPolarHBondContact O-CG 3.28Å; D211-L215 PolarHBondContact O-N 3.38Å; R212-L215 PolarHBondContact O-N 3.3Å; L215-V217 PolarHBondContact O-N 2.97Å; L215-V218 PolarHBondContact O-N 2.84Å; L215-I219 HydrophobicContact CB-CD1 4.48Å; L215-I219 WeakPolarHBondContact O-CB 3.45Å; L215-I219 VanDerWaalsContact O-CG1 3.27Å; L215-I219 WeakPolarHBondContact O-CG1 3.19Å; L215-I219 PolarHBondContact O-N 3.4Å
216M77.8Confident75.3Confident148 Ų14869.7 Ų69.773%0.72934%0.343SS*.Hα-helixtrans-63-29.1179-172.3177.1-177.600112.9R212 K213 L214 P220R212-M216 WeakPolarHBondContact O-CB 3.32Å; R212-M216 PolarHBondContact O-N 2.79Å; K213-M216 PolarHBondContact O-N 3.08Å; L214-M216 VanDerWaalsContact C-N 3.32Å; L214-M216 PolarHBondContact O-N 2.85Å; M216-P220 WeakPolarHBondContact O-CD 3.22Å; M216-P220 WeakPolarHBondContact O-CG 3.23Å
217V80.7Confident77.1Confident87 Ų8767.7 Ų67.753%0.52734%0.337SS..Hα-helixtrans-86.4-40175.8173.70000111.4K213 L214 L215 P220 I221K213-V217 WeakPolarHBondContact O-CG2 3.48Å; K213-V217 PolarHBondContact O-N 3.37Å; K213-V217 VanDerWaalsContact O-N 3.15Å; L214-V217 PolarHBondContact O-N 2.98Å; L215-V217 PolarHBondContact O-N 2.97Å; V217-P220 WeakPolarHBondContact O-CD 3.38Å; V217-I221 HydrophobicContact CG1-CD1 3.76Å; V217-I221 WeakPolarHBondContact O-CD1 3.33Å; V217-I221 WeakPolarHBondContact O-CG1 3.31Å; V217-I221 PolarHBondContact O-N 2.89Å
218V81.8Confident78.5Confident9 Ų967.2 Ų67.26%0.05534%0.337CS..Hα-helixtrans-76-33.8-171.6168.90000112.4F190 L214 L215 I221 Q222 A259F190-V218 HydrophobicContact CD1-CG1 4.36Å; F190-V218 HydrophobicContact CE1-CG1 3.37Å; F190-V218 HydrophobicContact CZ-CG1 3.72Å; L214-V218 HydrophobicContact CD2-CB 4.43Å; L214-V218 HydrophobicContact CD2-CG2 3.66Å; L214-V218 HydrophobicContact CG-CG2 4.32Å; L214-V218 VanDerWaalsContact O-CB 3.29Å; L214-V218 WeakPolarHBondContact O-CB 3.46Å; L214-V218 WeakPolarHBondContact O-CG2 3.31Å; L214-V218 PolarHBondContact O-N 3.41Å; L215-V218 PolarHBondContact O-N 2.84Å; V218-I221 PolarHBondContact O-N 3.3Å; V218-Q222 VanDerWaalsContact O-CG 3.32Å; V218-Q222 WeakPolarHBondContact O-CG 3.13Å; V218-Q222 PolarHBondContact O-N 2.85Å; V218-Q222 PolarHBondContact O-NE2 3.46Å; V218-Q222 VanDerWaalsContact O-NE2 3.12Å; V218-A259 HydrophobicContact CG1-CB 4.09Å; V218-A259 HydrophobicContact CG2-CB 3.62Å
219I81.9Confident79.6Confident80 Ų8065.8 Ų65.841%0.4133%0.327SS..Hα-helixtrans-63.1-49.9177-68.1167.4000111.8L215 I221 Q222 V223L215-I219 HydrophobicContact CB-CD1 4.48Å; L215-I219 WeakPolarHBondContact O-CB 3.45Å; L215-I219 VanDerWaalsContact O-CG1 3.27Å; L215-I219 WeakPolarHBondContact O-CG1 3.19Å; L215-I219 PolarHBondContact O-N 3.4Å; I219-I221 VanDerWaalsContact C-N 3.33Å; I219-I221 PolarHBondContact O-N 3.19Å; I219-Q222 WeakPolarHBondContact O-CB 3.39Å; I219-Q222 PolarHBondContact O-N 3.46Å; I219-V223 PolarHBondContact O-N 3.13Å; I219-V223 VanDerWaalsContact O-N 3.15Å
220P84.9Confident80.2Confident70 Ų7061.9 Ų61.946%0.45531%0.309SS..Hα-helixtrans-57.9-42.1174-27.234.1000113.7M216 V217 Q222 V223 V224M216-P220 WeakPolarHBondContact O-CD 3.22Å; M216-P220 WeakPolarHBondContact O-CG 3.23Å; V217-P220 WeakPolarHBondContact O-CD 3.38Å; P220-Q222 VanDerWaalsContact C-N 3.29Å; P220-Q222 PolarHBondContact O-N 2.83Å; P220-V223 PolarHBondContact O-N 3.37Å; P220-V223 VanDerWaalsContact O-N 3.1Å; P220-V224 WeakPolarHBondContact O-CG2 3.49Å; P220-V224 PolarHBondContact O-N 3.5Å
221I86Confident80.7Confident51 Ų5156.3 Ų56.326%0.26229%0.294SS..Hα-helixtrans-61.1-39.4178.1-68.1169.8000110.9V217 V218 I219 V223 V224 D225V217-I221 HydrophobicContact CG1-CD1 3.76Å; V217-I221 WeakPolarHBondContact O-CD1 3.33Å; V217-I221 WeakPolarHBondContact O-CG1 3.31Å; V217-I221 PolarHBondContact O-N 2.89Å; V218-I221 PolarHBondContact O-N 3.3Å; I219-I221 VanDerWaalsContact C-N 3.33Å; I219-I221 PolarHBondContact O-N 3.19Å; I221-V223 VanDerWaalsContact C-N 3.34Å; I221-V223 PolarHBondContact O-N 2.96Å; I221-V224 PolarHBondContact O-N 3.36Å; I221-D225 PolarHBondContact O-N 2.86Å
222Q84.5Confident80.9Confident5 Ų555.7 Ų55.72%0.02329%0.29CS..Hα-helixtrans-63.1-40.3174.2-69.9155.438.600112.5S187 F190 V218 I219 P220 V224 D225 N226 C256S187-Q222 PolarHBondContact O-OE1 2.99Å; F190-Q222 HydrophobicContact CB-CG 4.14Å; F190-Q222 HydrophobicContact CD1-CG 3.95Å; F190-Q222 HydrophobicContact CD2-CG 4.02Å; F190-Q222 HydrophobicContact CE1-CG 4.22Å; F190-Q222 HydrophobicContact CE2-CG 4.28Å; F190-Q222 HydrophobicContact CG-CG 3.78Å; F190-Q222 HydrophobicContact CZ-CG 4.31Å; V218-Q222 VanDerWaalsContact O-CG 3.32Å; V218-Q222 WeakPolarHBondContact O-CG 3.13Å; V218-Q222 PolarHBondContact O-N 2.85Å; V218-Q222 PolarHBondContact O-NE2 3.46Å; V218-Q222 VanDerWaalsContact O-NE2 3.12Å; I219-Q222 WeakPolarHBondContact O-CB 3.39Å; I219-Q222 PolarHBondContact O-N 3.46Å; P220-Q222 VanDerWaalsContact C-N 3.29Å; P220-Q222 PolarHBondContact O-N 2.83Å; Q222-V224 VanDerWaalsContact C-N 3.28Å; Q222-V224 PolarHBondContact O-N 3.5Å; Q222-D225 PolarHBondContact O-N 2.88Å; Q222-N226 PolarHBondContact O-N 2.99Å; Q222-N226 PolarHBondContact O-ND2 3.45Å; Q222-C256 WeakPolarHBondContact CG-SG 3.4Å
223V86.3Confident81Confident56 Ų5654.1 Ų54.134%0.33929%0.292SS..Hα-helixtrans-62.5-42.9178176.90000109.3I219 P220 I221 D225 N226 I227I219-V223 PolarHBondContact O-N 3.13Å; I219-V223 VanDerWaalsContact O-N 3.15Å; P220-V223 PolarHBondContact O-N 3.37Å; P220-V223 VanDerWaalsContact O-N 3.1Å; I221-V223 VanDerWaalsContact C-N 3.34Å; I221-V223 PolarHBondContact O-N 2.96Å; V223-D225 PolarHBondContact O-N 3.4Å; V223-N226 PolarHBondContact O-N 3.22Å; V223-I227 HydrophobicContact CG1-CD1 3.89Å; V223-I227 HydrophobicContact CG1-CG1 4.47Å; V223-I227 VanDerWaalsContact O-CG1 3.23Å; V223-I227 WeakPolarHBondContact O-CG1 3.41Å; V223-I227 PolarHBondContact O-N 3.35Å
224V86.4Confident80.7Confident66 Ų6652.5 Ų52.540%0.429%0.286SS..Hα-helixtrans-61.2-42.6174.5176.30000111.8P220 I221 Q222 I227 A228 F252P220-V224 WeakPolarHBondContact O-CG2 3.49Å; P220-V224 PolarHBondContact O-N 3.5Å; I221-V224 PolarHBondContact O-N 3.36Å; Q222-V224 VanDerWaalsContact C-N 3.28Å; Q222-V224 PolarHBondContact O-N 3.5Å; V224-I227 PolarHBondContact O-N 2.83Å; V224-A228 WeakPolarHBondContact O-CB 3.49Å; V224-A228 PolarHBondContact O-N 2.88Å; V224-F252 HydrophobicContact CG1-CD2 3.82Å; V224-F252 HydrophobicContact CG1-CE2 3.5Å; V224-F252 HydrophobicContact CG1-CZ 4.21Å
225D83.7Confident80.4Confident14 Ų1451.9 Ų51.98%0.07528%0.284CS..Hα-helixtrans-64-42.4178.5-168.140000112.1I221 Q222 V223 I227 A228 L229 F252 D253I221-D225 PolarHBondContact O-N 2.86Å; Q222-D225 PolarHBondContact O-N 2.88Å; V223-D225 PolarHBondContact O-N 3.4Å; D225-I227 VanDerWaalsContact C-N 3.35Å; D225-I227 PolarHBondContact O-N 2.81Å; D225-A228 PolarHBondContact O-N 3.39Å; D225-L229 PolarHBondContact O-N 2.99Å; D225-F252 HydrophobicContact CB-CB 4.32Å; D225-D253 PolarHBondContact OD1-N 3.42Å
226N84.4Confident79.8Confident23 Ų2356.1 Ų56.112%0.12330%0.303CS..Hα-helixtrans-67.4-34.4174.8-69.4-68.4000112L183 G186 Q222 V223 I230L183-N226 VanDerWaalsContact CD2-C 3.48Å; L183-N226 HydrophobicContact CD2-CB 3.46Å; L183-N226 VanDerWaalsContact CD2-CB 3.46Å; G186-N226 WeakPolarHBondContact CA-OD1 3.42Å; Q222-N226 PolarHBondContact O-N 2.99Å; Q222-N226 PolarHBondContact O-ND2 3.45Å; V223-N226 PolarHBondContact O-N 3.22Å; N226-I230 WeakPolarHBondContact O-CG1 3.5Å; N226-I230 PolarHBondContact O-N 2.92Å
227I83.5Confident79Confident78 Ų7852.4 Ų52.440%0.429%0.285SS..Hα-helixtrans-66.5-44172.2-68.7165.8000110.3L183 V223 V224 D225 L229 I230 V231L183-I227 HydrophobicContact CD1-CG1 4.15Å; L183-I227 HydrophobicContact CD2-CB 4.48Å; L183-I227 HydrophobicContact CD2-CG1 3.71Å; V223-I227 HydrophobicContact CG1-CD1 3.89Å; V223-I227 HydrophobicContact CG1-CG1 4.47Å; V223-I227 VanDerWaalsContact O-CG1 3.23Å; V223-I227 WeakPolarHBondContact O-CG1 3.41Å; V223-I227 PolarHBondContact O-N 3.35Å; V224-I227 PolarHBondContact O-N 2.83Å; D225-I227 VanDerWaalsContact C-N 3.35Å; D225-I227 PolarHBondContact O-N 2.81Å; I227-L229 VanDerWaalsContact C-N 3.28Å; I227-L229 PolarHBondContact O-N 3.5Å; I227-I230 PolarHBondContact O-N 2.92Å; I227-I230 VanDerWaalsContact O-N 3.13Å; I227-V231 HydrophobicContact CG2-CG2 4.28Å; I227-V231 WeakPolarHBondContact O-CG2 3.28Å; I227-V231 PolarHBondContact O-N 2.51Å
228A82.8Confident78Confident16 Ų1651.2 Ų51.213%0.13229%0.291CS..Hα-helixtrans-61.1-38.3178.900000111.6V224 D225 V231 L232 F249V224-A228 WeakPolarHBondContact O-CB 3.49Å; V224-A228 PolarHBondContact O-N 2.88Å; D225-A228 PolarHBondContact O-N 3.39Å; A228-V231 PolarHBondContact O-N 3.13Å; A228-L232 VanDerWaalsContact O-CB 3.28Å; A228-L232 WeakPolarHBondContact O-CB 3.41Å; A228-L232 PolarHBondContact O-N 2.84Å; A228-F249 HydrophobicContact CB-CB 4.46Å; A228-F249 HydrophobicContact CB-CD2 4.37Å
229L80.2Confident77.1Confident36 Ų3655.8 Ų55.819%0.18831%0.312CS..Hα-helixtrans-59.4-47.4172.4179.260.6000111.9D225 I227 L232 D233 F249D225-L229 PolarHBondContact O-N 2.99Å; I227-L229 VanDerWaalsContact C-N 3.28Å; I227-L229 PolarHBondContact O-N 3.5Å; L229-L232 WeakPolarHBondContact O-CB 3.46Å; L229-L232 PolarHBondContact O-N 3.06Å; L229-D233 PolarHBondContact O-N 3.03Å; L229-F249 HydrophobicContact CB-CD2 4.22Å; L229-F249 HydrophobicContact CB-CE2 3.76Å; L229-F249 HydrophobicContact CB-CZ 4.47Å; L229-F249 HydrophobicContact CD1-CE1 4.5Å; L229-F249 HydrophobicContact CD1-CE2 3.97Å; L229-F249 HydrophobicContact CD1-CZ 3.83Å; L229-F249 HydrophobicContact CG-CE2 4.36Å
230I79.5Confident76.5Confident24 Ų2460.1 Ų60.112%0.12333%0.33CS..Hα-helixtrans-63.4-45.7179.3-66.9165.3000110.7Y179 L183 N226 I227 L232 D233 E234Y179-I230 HydrophobicContact CD1-CB 4.41Å; Y179-I230 HydrophobicContact CD1-CD1 4.17Å; Y179-I230 HydrophobicContact CD1-CG1 4.08Å; Y179-I230 HydrophobicContact CD1-CG2 3.47Å; Y179-I230 VanDerWaalsContact CD1-CG2 3.47Å; Y179-I230 HydrophobicContact CE1-CG2 3.75Å; Y179-I230 HydrophobicContact CG-CD1 4.49Å; Y179-I230 HydrophobicContact CG-CG2 4Å; L183-I230 HydrophobicContact CD1-CD1 4.37Å; L183-I230 HydrophobicContact CD2-CD1 3.52Å; L183-I230 HydrophobicContact CG-CD1 3.67Å; N226-I230 WeakPolarHBondContact O-CG1 3.5Å; N226-I230 PolarHBondContact O-N 2.92Å; I227-I230 PolarHBondContact O-N 2.92Å; I227-I230 VanDerWaalsContact O-N 3.13Å; I230-L232 VanDerWaalsContact C-N 3.26Å; I230-L232 PolarHBondContact O-N 3.46Å; I230-D233 PolarHBondContact O-N 3.42Å; I230-E234 WeakPolarHBondContact O-CG 3.22Å; I230-E234 PolarHBondContact O-N 3.22Å; I230-E234 VanDerWaalsContact O-N 3.12Å
231V79.9Confident75.8Confident51 Ų5164.1 Ų64.131%0.30934%0.336SS..Hα-helixtrans-60.7-40.4176.91730000110.5I227 A228 E234 T235I227-V231 HydrophobicContact CG2-CG2 4.28Å; I227-V231 WeakPolarHBondContact O-CG2 3.28Å; I227-V231 PolarHBondContact O-N 2.51Å; A228-V231 PolarHBondContact O-N 3.13Å; V231-E234 PolarHBondContact O-N 2.64Å; V231-T235 HydrophobicContact CG1-CG2 4.1Å; V231-T235 WeakPolarHBondContact O-CB 3.47Å; V231-T235 WeakPolarHBondContact O-CG2 3.23Å; V231-T235 PolarHBondContact O-N 3Å; V231-T235 PolarHBondContact O-OG1 3.11Å
232L74.9Confident75.1Confident20 Ų2064.5 Ų64.511%0.10534%0.335CS..Hα-helixtrans-63.7-42.1178.3-176.363.7000112A228 L229 I230 E234 T235 Y242 S246 F249A228-L232 VanDerWaalsContact O-CB 3.28Å; A228-L232 WeakPolarHBondContact O-CB 3.41Å; A228-L232 PolarHBondContact O-N 2.84Å; L229-L232 WeakPolarHBondContact O-CB 3.46Å; L229-L232 PolarHBondContact O-N 3.06Å; I230-L232 VanDerWaalsContact C-N 3.26Å; I230-L232 PolarHBondContact O-N 3.46Å; L232-E234 VanDerWaalsContact C-N 3.3Å; L232-E234 PolarHBondContact O-N 2.81Å; L232-T235 WeakPolarHBondContact CA-OG1 3.22Å; L232-T235 PolarHBondContact O-N 3.25Å; L232-T235 PolarHBondContact O-OG1 2.66Å; L232-Y242 HydrophobicContact CD1-CD2 3.64Å; L232-Y242 HydrophobicContact CD1-CE2 3.45Å; L232-Y242 VanDerWaalsContact CD1-CE2 3.45Å; L232-Y242 HydrophobicContact CD1-CG 4.34Å; L232-Y242 HydrophobicContact CG-CE2 4.23Å; L232-S246 WeakPolarHBondContact CD1-OG 3.23Å; L232-F249 HydrophobicContact CD2-CB 4.41Å; L232-F249 HydrophobicContact CD2-CD1 4.01Å; L232-F249 HydrophobicContact CD2-CG 4.28Å
233D73.1Confident74.6Confident99 Ų9970 Ų7053%0.52936%0.36SS..Hα-helixtrans-64.9-32.1178.4-80.5-15.9000112.7L229 I230L229-D233 PolarHBondContact O-N 3.03Å; I230-D233 PolarHBondContact O-N 3.42Å
234E71.6Confident74.1Confident107 Ų10774.9 Ų74.950%0.537%0.373SS..Hα-helixtrans-84.1-23175.7-65.5-57.1135.300113.3Y179 I230 V231 L232Y179-E234 PolarHBondContact OH-OE1 3.14Å; I230-E234 WeakPolarHBondContact O-CG 3.22Å; I230-E234 PolarHBondContact O-N 3.22Å; I230-E234 VanDerWaalsContact O-N 3.12Å; V231-E234 PolarHBondContact O-N 2.64Å; L232-E234 VanDerWaalsContact C-N 3.3Å; L232-E234 PolarHBondContact O-N 2.81Å
235T68.2Low73.6Confident20 Ų2072.1 Ų72.112%0.12336%0.357CS..SBendtrans-79.4132.1-179.952.70000112V231 L232 R241 Y242V231-T235 HydrophobicContact CG1-CG2 4.1Å; V231-T235 WeakPolarHBondContact O-CB 3.47Å; V231-T235 WeakPolarHBondContact O-CG2 3.23Å; V231-T235 PolarHBondContact O-N 3Å; V231-T235 PolarHBondContact O-OG1 3.11Å; L232-T235 WeakPolarHBondContact CA-OG1 3.22Å; L232-T235 PolarHBondContact O-N 3.25Å; L232-T235 PolarHBondContact O-OG1 2.66Å; T235-R241 HydrophobicContact CG2-CG 4.26Å; T235-Y242 WeakPolarHBondContact O-CD2 3.31Å
236E64.3Low73.4Confident119 Ų11972.1 Ų72.156%0.55636%0.357SS*.PPolyproline II helixtrans-72.1135.3177.8-63.5174174.800112.3G238 Y242E236-G238 PolarHBondContact O-N 3.38Å; E236-Y242 WeakPolarHBondContact O-CB 3.3Å
237I60.2Low73.2Confident69 Ų6977.9 Ų77.935%0.35438%0.381SS..THydrogen-bonded Turntrans-60.1129.5172.7-55164.1000109.1F36 Y242F36-I237 HydrophobicContact CE1-CG2 4.2Å; F36-I237 WeakPolarHBondContact CE1-O 3.2Å; F36-I237 HydrophobicContact CE2-CB 4.06Å; F36-I237 HydrophobicContact CE2-CG2 3.66Å; F36-I237 HydrophobicContact CZ-CB 3.6Å; F36-I237 HydrophobicContact CZ-CG2 3.46Å; F36-I237 VanDerWaalsContact CZ-CG2 3.46Å; F36-I237 WeakPolarHBondContact CZ-O 3.25Å; I237-Y242 HydrophobicContact CG1-CD2 4.33Å; I237-Y242 HydrophobicContact CG1-CE1 4.27Å; I237-Y242 HydrophobicContact CG1-CE2 3.82Å; I237-Y242 HydrophobicContact CG2-CE1 4.37Å
238G59.9Low73.1Confident63 Ų6376.3 Ų76.365%0.64937%0.374SS*.THydrogen-bonded Turntrans109.3-14.2177.800000114.9E236E236-G238 PolarHBondContact O-N 3.38Å
239Q62.3Low73.1Confident105 Ų10576.5 Ų76.549%0.49137%0.372SS..SBendtrans-81.8145.2168.9-64.8-161.3-13.800111.2R241 Y242 E243Q239-R241 PolarHBondContact O-N 3.43Å; Q239-Y242 WeakPolarHBondContact O-CB 3.28Å; Q239-Y242 PolarHBondContact O-N 3.45Å; Q239-E243 PolarHBondContact O-N 3.24Å
240Q70.6Confident73.1Confident170 Ų17077.3 Ų77.379%0.79438%0.375SS*.Hα-helixtrans-53.7-30.9174.2-171.3-177.76.300112.2Y242 E243 W244Q240-Y242 PolarHBondContact O-N 2.91Å; Q240-E243 PolarHBondContact O-N 3.38Å; Q240-W244 PolarHBondContact O-N 3.38Å; Q240-W244 VanDerWaalsContact O-N 3.17Å
241R70Confident73.3Confident154 Ų15480.5 Ų80.558%0.58139%0.392SS*.Hα-helixtrans-62.5-38175.1-171.6176.1-175.8107.40.1112.8T235 Q239 S245T235-R241 HydrophobicContact CG2-CG 4.26Å; Q239-R241 PolarHBondContact O-N 3.43Å; R241-S245 VanDerWaalsContact O-CB 3.22Å; R241-S245 WeakPolarHBondContact O-CB 3.28Å; R241-S245 PolarHBondContact O-N 2.95Å; R241-S245 PolarHBondContact O-OG 3.38Å
242Y71.5Confident73.5Confident60 Ų6080.6 Ų80.624%0.23539%0.388CS..Hα-helixtrans-66.7-45.1178178.2-88.8000111.2L232 T235 E236 I237 Q239 Q240 W244 S245 S246L232-Y242 HydrophobicContact CD1-CD2 3.64Å; L232-Y242 HydrophobicContact CD1-CE2 3.45Å; L232-Y242 VanDerWaalsContact CD1-CE2 3.45Å; L232-Y242 HydrophobicContact CD1-CG 4.34Å; L232-Y242 HydrophobicContact CG-CE2 4.23Å; T235-Y242 WeakPolarHBondContact O-CD2 3.31Å; E236-Y242 WeakPolarHBondContact O-CB 3.3Å; I237-Y242 HydrophobicContact CG1-CD2 4.33Å; I237-Y242 HydrophobicContact CG1-CE1 4.27Å; I237-Y242 HydrophobicContact CG1-CE2 3.82Å; I237-Y242 HydrophobicContact CG2-CE1 4.37Å; Q239-Y242 WeakPolarHBondContact O-CB 3.28Å; Q239-Y242 PolarHBondContact O-N 3.45Å; Q240-Y242 PolarHBondContact O-N 2.91Å; Y242-W244 PolarHBondContact O-N 3.12Å; Y242-S245 PolarHBondContact O-N 2.88Å; Y242-S246 WeakPolarHBondContact CE1-OG 3.22Å; Y242-S246 WeakPolarHBondContact O-CB 3.47Å; Y242-S246 PolarHBondContact O-N 2.97Å; Y242-S246 PolarHBondContact O-OG 3.33Å
243E73.2Confident73.9Confident119 Ų11980.6 Ų80.656%0.55639%0.389SS*.Hα-helixtrans-62.5-44.7179-66.8-166.6172.500112.1Q239 Q240 K247Q239-E243 PolarHBondContact O-N 3.24Å; Q240-E243 PolarHBondContact O-N 3.38Å; E243-K247 WeakPolarHBondContact O-CG 3.39Å; E243-K247 PolarHBondContact O-N 3.27Å; E243-K247 VanDerWaalsContact O-N 3.1Å
244W76.8Confident74.4Confident160 Ų16080.9 Ų80.961%0.60639%0.39SS*.Hα-helixtrans-66.2-45.3177.5176.283.6000111.7Q240 Y242 S246 K247 L248Q240-W244 PolarHBondContact O-N 3.38Å; Q240-W244 VanDerWaalsContact O-N 3.17Å; Y242-W244 PolarHBondContact O-N 3.12Å; W244-S246 VanDerWaalsContact C-N 3.35Å; W244-S246 PolarHBondContact O-N 3.39Å; W244-K247 PolarHBondContact O-N 3.37Å; W244-L248 HydrophobicContact CH2-CD2 3.71Å; W244-L248 HydrophobicContact CZ2-CD2 3.94Å; W244-L248 HydrophobicContact CZ3-CD2 4.2Å; W244-L248 WeakPolarHBondContact O-CB 3.43Å; W244-L248 PolarHBondContact O-N 3.38Å
245S75.5Confident75Confident8 Ų879.4 Ų79.46%0.05639%0.385CS..Hα-helixtrans-65.5-37.6179-54.20000111.9R241 Y242 L248 F249R241-S245 VanDerWaalsContact O-CB 3.22Å; R241-S245 WeakPolarHBondContact O-CB 3.28Å; R241-S245 PolarHBondContact O-N 2.95Å; R241-S245 PolarHBondContact O-OG 3.38Å; Y242-S245 PolarHBondContact O-N 2.88Å; S245-L248 PolarHBondContact O-N 3.27Å; S245-F249 WeakPolarHBondContact O-CB 3.5Å; S245-F249 PolarHBondContact O-N 3.38Å
246S78.3Confident75.7Confident13 Ų1378.8 Ų78.89%0.09138%0.381CS..Hα-helixtrans-61.2-47.5174.4-65.70000111.8L232 Y242 W244 L248 F249 I250L232-S246 WeakPolarHBondContact CD1-OG 3.23Å; Y242-S246 WeakPolarHBondContact CE1-OG 3.22Å; Y242-S246 WeakPolarHBondContact O-CB 3.47Å; Y242-S246 PolarHBondContact O-N 2.97Å; Y242-S246 PolarHBondContact O-OG 3.33Å; W244-S246 VanDerWaalsContact C-N 3.35Å; W244-S246 PolarHBondContact O-N 3.39Å; S246-L248 VanDerWaalsContact C-N 3.33Å; S246-L248 PolarHBondContact O-N 2.98Å; S246-F249 PolarHBondContact O-N 3.04Å; S246-I250 VanDerWaalsContact O-CG1 3.31Å; S246-I250 WeakPolarHBondContact O-CG1 3.2Å; S246-I250 PolarHBondContact O-N 3.08Å
247K81Confident76.6Confident144 Ų14474.1 Ų74.163%0.62636%0.361SS*.Hα-helixtrans-62.5-42.2177.5-74.2173.8-178168.30111.4E243 W244 I250 L251E243-K247 WeakPolarHBondContact O-CG 3.39Å; E243-K247 PolarHBondContact O-N 3.27Å; E243-K247 VanDerWaalsContact O-N 3.1Å; W244-K247 PolarHBondContact O-N 3.37Å; K247-I250 PolarHBondContact O-N 3.17Å; K247-L251 PolarHBondContact O-N 3.03Å; K247-L251 VanDerWaalsContact O-N 3.08Å
248L81.7Confident77.7Confident46 Ų4673.2 Ų73.224%0.24136%0.364CS..Hα-helixtrans-64.9-43.7178.7-168.169000111.9W244 S245 S246 L251 F252W244-L248 HydrophobicContact CH2-CD2 3.71Å; W244-L248 HydrophobicContact CZ2-CD2 3.94Å; W244-L248 HydrophobicContact CZ3-CD2 4.2Å; W244-L248 WeakPolarHBondContact O-CB 3.43Å; W244-L248 PolarHBondContact O-N 3.38Å; S245-L248 PolarHBondContact O-N 3.27Å; S246-L248 VanDerWaalsContact C-N 3.33Å; S246-L248 PolarHBondContact O-N 2.98Å; L248-L251 PolarHBondContact O-N 3.21Å; L248-F252 HydrophobicContact CD1-CD2 4.42Å; L248-F252 HydrophobicContact CD1-CE1 4.33Å; L248-F252 HydrophobicContact CD1-CE2 3.79Å; L248-F252 HydrophobicContact CD1-CZ 3.74Å; L248-F252 HydrophobicContact CD2-CE2 3.81Å; L248-F252 HydrophobicContact CD2-CZ 4.39Å; L248-F252 HydrophobicContact CG-CD2 3.96Å; L248-F252 HydrophobicContact CG-CE2 3.54Å; L248-F252 HydrophobicContact CG-CZ 4.05Å; L248-F252 PolarHBondContact O-N 3.41Å
249F81.6Confident78.8Confident20 Ų2070.8 Ų70.89%0.08834%0.338CS..Hα-helixtrans-57.7-48.7174.3172.2-109000111.6A228 L229 L232 S245 S246 L251 F252 D253 K309A228-F249 HydrophobicContact CB-CB 4.46Å; A228-F249 HydrophobicContact CB-CD2 4.37Å; L229-F249 HydrophobicContact CB-CD2 4.22Å; L229-F249 HydrophobicContact CB-CE2 3.76Å; L229-F249 HydrophobicContact CB-CZ 4.47Å; L229-F249 HydrophobicContact CD1-CE1 4.5Å; L229-F249 HydrophobicContact CD1-CE2 3.97Å; L229-F249 HydrophobicContact CD1-CZ 3.83Å; L229-F249 HydrophobicContact CG-CE2 4.36Å; L232-F249 HydrophobicContact CD2-CB 4.41Å; L232-F249 HydrophobicContact CD2-CD1 4.01Å; L232-F249 HydrophobicContact CD2-CG 4.28Å; S245-F249 WeakPolarHBondContact O-CB 3.5Å; S245-F249 PolarHBondContact O-N 3.38Å; S246-F249 PolarHBondContact O-N 3.04Å; F249-L251 VanDerWaalsContact C-N 3.29Å; F249-L251 PolarHBondContact O-N 3.12Å; F249-F252 PolarHBondContact O-N 3.46Å; F249-D253 WeakPolarHBondContact O-CB 3.16Å; F249-D253 PolarHBondContact O-N 2.88Å; F249-K309 HydrophobicContact CE1-CD 4.2Å; F249-K309 HydrophobicContact CZ-CD 4.5Å
250I81.6Confident79.6Confident53 Ų5366 Ų6627%0.27232%0.315SS..Hα-helixtrans-59.7-41.3178.6-66.4165.5000111.4S246 K247 L254S246-I250 VanDerWaalsContact O-CG1 3.31Å; S246-I250 WeakPolarHBondContact O-CG1 3.2Å; S246-I250 PolarHBondContact O-N 3.08Å; K247-I250 PolarHBondContact O-N 3.17Å; I250-L254 WeakPolarHBondContact O-CB 3.35Å; I250-L254 PolarHBondContact O-N 3.26Å
251L83.3Confident80.1Confident91 Ų9159.7 Ų59.748%0.47629%0.287SS..Hα-helixtrans-64.7-50.3179.4-179.766.8000112.1K247 L248 F249 L254 I255K247-L251 PolarHBondContact O-N 3.03Å; K247-L251 VanDerWaalsContact O-N 3.08Å; L248-L251 PolarHBondContact O-N 3.21Å; F249-L251 VanDerWaalsContact C-N 3.29Å; F249-L251 PolarHBondContact O-N 3.12Å; L251-L254 WeakPolarHBondContact O-CB 3.41Å; L251-L254 PolarHBondContact O-N 3.23Å; L251-I255 HydrophobicContact CD1-CD1 4.43Å; L251-I255 HydrophobicContact CG-CD1 4.25Å; L251-I255 WeakPolarHBondContact O-CG1 3.43Å; L251-I255 PolarHBondContact O-N 3.26Å; L251-I255 VanDerWaalsContact O-N 3.08Å
252F84.4Confident80.6Confident52 Ų5255.6 Ų55.623%0.22828%0.276CS..Hα-helixtrans-65-43.2-179.8-72.4-29.6000112.3V224 D225 L248 F249 L254 I255 C256V224-F252 HydrophobicContact CG1-CD2 3.82Å; V224-F252 HydrophobicContact CG1-CE2 3.5Å; V224-F252 HydrophobicContact CG1-CZ 4.21Å; D225-F252 HydrophobicContact CB-CB 4.32Å; L248-F252 HydrophobicContact CD1-CD2 4.42Å; L248-F252 HydrophobicContact CD1-CE1 4.33Å; L248-F252 HydrophobicContact CD1-CE2 3.79Å; L248-F252 HydrophobicContact CD1-CZ 3.74Å; L248-F252 HydrophobicContact CD2-CE2 3.81Å; L248-F252 HydrophobicContact CD2-CZ 4.39Å; L248-F252 HydrophobicContact CG-CD2 3.96Å; L248-F252 HydrophobicContact CG-CE2 3.54Å; L248-F252 HydrophobicContact CG-CZ 4.05Å; L248-F252 PolarHBondContact O-N 3.41Å; F249-F252 PolarHBondContact O-N 3.46Å; F252-L254 VanDerWaalsContact C-N 3.3Å; F252-L254 PolarHBondContact O-N 3.41Å; F252-I255 PolarHBondContact O-N 3.05Å; F252-C256 VanDerWaalsContact O-CB 3.32Å; F252-C256 WeakPolarHBondContact O-CB 3.49Å; F252-C256 PolarHBondContact O-N 3.45Å
253D83.3Confident80.8Confident21 Ų2153.1 Ų53.111%0.11227%0.267CS..Hα-helixtrans-57.2-46.8174.6-169.826.6000109.1D225 F249 I255 C256 C257 R306 K309D225-D253 PolarHBondContact OD1-N 3.42Å; F249-D253 WeakPolarHBondContact O-CB 3.16Å; F249-D253 PolarHBondContact O-N 2.88Å; D253-I255 PolarHBondContact O-N 3.41Å; D253-C256 VanDerWaalsContact O-CB 3.29Å; D253-C256 WeakPolarHBondContact O-CB 3.23Å; D253-C256 PolarHBondContact O-N 3.48Å; D253-C257 PolarHBondContact O-N 3.43Å; D253-R306 PolarHBondContact O-NH2 2.89Å; D253-R306 IonicContact OD1-CZ 3.17Å; D253-R306 IonicContact OD1-NE 3.61Å; D253-R306 IonicContact OD1-NH1 3.82Å; D253-R306 IonicContact OD1-NH2 2.66Å; D253-R306 PolarHBondContact OD1-NH2 2.78Å; D253-R306 IonicContact OD2-CZ 2.7Å; D253-R306 IonicContact OD2-NE 3.03Å; D253-R306 PolarHBondContact OD2-NE 3.36Å; D253-R306 IonicContact OD2-NH1 2.81Å; D253-R306 PolarHBondContact OD2-NH1 3.46Å; D253-R306 IonicContact OD2-NH2 3.11Å; D253-R306 PolarHBondContact OD2-NH2 3.13Å; D253-R306 VanDerWaalsContact OD2-NH2 3.11Å; D253-K309 IonicContact OD1-NZ 3.71Å; D253-K309 WeakPolarHBondContact OD2-CE 3.2Å; D253-K309 IonicContact OD2-NZ 2.54Å; D253-K309 PolarHBondContact OD2-NZ 3.01Å
254L83.4Confident80.9Confident104 Ų10447.8 Ų47.855%0.54524%0.242SC..Hα-helixtrans-58-46.5177.8179.264.1000112.9I250 L251 F252 C256 C257 A258I250-L254 WeakPolarHBondContact O-CB 3.35Å; I250-L254 PolarHBondContact O-N 3.26Å; L251-L254 WeakPolarHBondContact O-CB 3.41Å; L251-L254 PolarHBondContact O-N 3.23Å; F252-L254 VanDerWaalsContact C-N 3.3Å; F252-L254 PolarHBondContact O-N 3.41Å; L254-C256 VanDerWaalsContact C-N 3.3Å; L254-C256 PolarHBondContact O-N 3.01Å; L254-C257 PolarHBondContact O-N 3.5Å; L254-A258 PolarHBondContact O-N 3.23Å
255I84.9Confident81.1Confident77 Ų7743.6 Ų43.640%0.39523%0.231SC..Hα-helixtrans-59.8-43.6176.1-68167.8000110.3L251 F252 D253 C257 A258 A259L251-I255 HydrophobicContact CD1-CD1 4.43Å; L251-I255 HydrophobicContact CG-CD1 4.25Å; L251-I255 WeakPolarHBondContact O-CG1 3.43Å; L251-I255 PolarHBondContact O-N 3.26Å; L251-I255 VanDerWaalsContact O-N 3.08Å; F252-I255 PolarHBondContact O-N 3.05Å; D253-I255 PolarHBondContact O-N 3.41Å; I255-C257 VanDerWaalsContact C-N 3.32Å; I255-C257 PolarHBondContact O-N 2.98Å; I255-A258 PolarHBondContact O-N 2.87Å; I255-A259 WeakPolarHBondContact O-CB 3.48Å; I255-A259 PolarHBondContact O-N 3.16Å
256C82.5Confident81.2Confident6 Ų648 Ų484%0.04125%0.247CC..Hα-helixtrans-59.4-43178.4-149.40000111.1F190 Q222 F252 D253 L254 A259 V260F190-C256 HydrophobicContact CE2-CB 4.09Å; F190-C256 WeakPolarHBondContact CE2-O 3.36Å; F190-C256 WeakPolarHBondContact CE2-SG 3.37Å; F190-C256 VanDerWaalsContact CZ-O 3.27Å; F190-C256 WeakPolarHBondContact CZ-O 3.29Å; F190-C256 VanDerWaalsContact CZ-SG 3.52Å; Q222-C256 WeakPolarHBondContact CG-SG 3.4Å; F252-C256 VanDerWaalsContact O-CB 3.32Å; F252-C256 WeakPolarHBondContact O-CB 3.49Å; F252-C256 PolarHBondContact O-N 3.45Å; D253-C256 VanDerWaalsContact O-CB 3.29Å; D253-C256 WeakPolarHBondContact O-CB 3.23Å; D253-C256 PolarHBondContact O-N 3.48Å; L254-C256 VanDerWaalsContact C-N 3.3Å; L254-C256 PolarHBondContact O-N 3.01Å; C256-A259 WeakPolarHBondContact O-CB 3.18Å; C256-A259 PolarHBondContact O-N 3.27Å; C256-V260 PolarHBondContact O-N 3.37Å
257C82.8Confident81Confident21 Ų2147.8 Ų47.814%0.14225%0.245CC..Hα-helixtrans-67.3-41.4177.2-83.50000113.6D253 L254 I255 A259 V260 I261 I302 R306D253-C257 PolarHBondContact O-N 3.43Å; L254-C257 PolarHBondContact O-N 3.5Å; I255-C257 VanDerWaalsContact C-N 3.32Å; I255-C257 PolarHBondContact O-N 2.98Å; C257-A259 PolarHBondContact O-N 3.34Å; C257-V260 PolarHBondContact O-N 3.37Å; C257-I261 WeakPolarHBondContact O-CG1 3.49Å; C257-I261 PolarHBondContact O-N 2.95Å; C257-I302 HydrophobicContact CB-CG2 4.26Å; C257-I302 WeakPolarHBondContact SG-CG2 3.29Å; C257-R306 PolarHBondContact SG-NH2 2.82Å
258A83.5Confident80.8Confident51 Ų5142 Ų4242%0.42122%0.221SC..Hα-helixtrans-60-39.7171.900000111.2L254 I255 V260 I261 I262L254-A258 PolarHBondContact O-N 3.23Å; I255-A258 PolarHBondContact O-N 2.87Å; A258-V260 PolarHBondContact O-N 2.92Å; A258-I261 PolarHBondContact O-N 3.32Å; A258-I262 WeakPolarHBondContact O-CG1 3.36Å; A258-I262 PolarHBondContact O-N 2.54Å
259A82.1Confident80.7Confident12 Ų1246.1 Ų46.110%0.09924%0.237CC..Hα-helixtrans-67.1-29.617900000114.2V218 I255 C256 C257 P263V218-A259 HydrophobicContact CG1-CB 4.09Å; V218-A259 HydrophobicContact CG2-CB 3.62Å; I255-A259 WeakPolarHBondContact O-CB 3.48Å; I255-A259 PolarHBondContact O-N 3.16Å; C256-A259 WeakPolarHBondContact O-CB 3.18Å; C256-A259 PolarHBondContact O-N 3.27Å; C257-A259 PolarHBondContact O-N 3.34Å; A259-P263 WeakPolarHBondContact O-CD 3.31Å
260V78.9Confident80.4Confident3 Ų348.6 Ų48.62%0.01825%0.249CC..Hα-helixtrans-67.5-41.2170.6179.40000111.2F190 I193 C256 C257 A258 P263 I264 I302F190-V260 HydrophobicContact CD1-CG2 4.29Å; F190-V260 HydrophobicContact CD2-CG2 3.79Å; F190-V260 HydrophobicContact CE1-CG2 3.64Å; F190-V260 HydrophobicContact CE2-CB 4.46Å; F190-V260 HydrophobicContact CE2-CG2 3.01Å; F190-V260 HydrophobicContact CG-CG2 4.41Å; F190-V260 HydrophobicContact CZ-CB 4.23Å; F190-V260 HydrophobicContact CZ-CG2 2.99Å; I193-V260 HydrophobicContact CG2-CG1 3.66Å; C256-V260 PolarHBondContact O-N 3.37Å; C257-V260 PolarHBondContact O-N 3.37Å; A258-V260 PolarHBondContact O-N 2.92Å; V260-P263 WeakPolarHBondContact O-CD 3.37Å; V260-I264 HydrophobicContact CG1-CD1 3.7Å; V260-I264 WeakPolarHBondContact O-CD1 3.46Å; V260-I264 WeakPolarHBondContact O-CG1 3.45Å; V260-I302 HydrophobicContact CG1-CD1 4.46Å
261I81.1Confident80Confident38 Ų3846.5 Ų46.520%0.19524%0.238CC..Hα-helixtrans-70-39.5-171.6-68168.6000110.7C257 A258 I264 L265 I299C257-I261 WeakPolarHBondContact O-CG1 3.49Å; C257-I261 PolarHBondContact O-N 2.95Å; A258-I261 PolarHBondContact O-N 3.32Å; I261-I264 PolarHBondContact O-N 2.99Å; I261-I264 VanDerWaalsContact O-N 3.15Å; I261-L265 HydrophobicContact CG2-CD1 3.66Å; I261-L265 HydrophobicContact CG2-CG 3.86Å; I261-L265 WeakPolarHBondContact O-CG 3.19Å; I261-L265 PolarHBondContact O-N 2.96Å; I261-I299 HydrophobicContact CD1-CD1 4.38Å; I261-I299 HydrophobicContact CG1-CD1 4.44Å
262I80.9Confident79.8Confident69 Ų6946.5 Ų46.535%0.35424%0.236SC..Hα-helixtrans-56.2-54.2-175.8-70.1163.4000112.8L214 A258 I264 L265 W266L214-I262 HydrophobicContact CD1-CG2 4.02Å; A258-I262 WeakPolarHBondContact O-CG1 3.36Å; A258-I262 PolarHBondContact O-N 2.54Å; I262-I264 VanDerWaalsContact C-N 3.28Å; I262-I264 PolarHBondContact O-N 3.39Å; I262-L265 PolarHBondContact O-N 3.28Å; I262-W266 HydrophobicContact CG2-CD2 3.93Å; I262-W266 HydrophobicContact CG2-CE3 4.16Å; I262-W266 HydrophobicContact CG2-CH2 3.67Å; I262-W266 HydrophobicContact CG2-CZ2 3.41Å; I262-W266 VanDerWaalsContact CG2-CZ2 3.41Å; I262-W266 HydrophobicContact CG2-CZ3 4.04Å; I262-W266 PolarHBondContact O-N 2.96Å
263P75.4Confident79.6Confident7 Ų750 Ų505%0.04525%0.253CS..Hα-helixtrans-61.1-33.9176.6-25.434.8000113.5V194 T198 L214 A259 V260 W266 S267V194-P263 HydrophobicContact CG1-CB 4.43Å; V194-P263 HydrophobicContact CG1-CG 4.48Å; T198-P263 HydrophobicContact CG2-CB 4.06Å; L214-P263 HydrophobicContact CD1-CG 4.36Å; L214-P263 HydrophobicContact CD2-CG 3.76Å; A259-P263 WeakPolarHBondContact O-CD 3.31Å; V260-P263 WeakPolarHBondContact O-CD 3.37Å; P263-W266 PolarHBondContact O-N 3.06Å; P263-S267 WeakPolarHBondContact O-CB 3.26Å; P263-S267 PolarHBondContact O-N 3.45Å
264I76.8Confident79.2Confident7 Ų750 Ų504%0.03626%0.256CS..Hα-helixtrans-68.9-43.6178.6-58.8168000110.2V260 I261 I262 W266 S267 I268 Y295V260-I264 HydrophobicContact CG1-CD1 3.7Å; V260-I264 WeakPolarHBondContact O-CD1 3.46Å; V260-I264 WeakPolarHBondContact O-CG1 3.45Å; I261-I264 PolarHBondContact O-N 2.99Å; I261-I264 VanDerWaalsContact O-N 3.15Å; I262-I264 VanDerWaalsContact C-N 3.28Å; I262-I264 PolarHBondContact O-N 3.39Å; I264-W266 VanDerWaalsContact C-N 3.31Å; I264-W266 PolarHBondContact O-N 3.13Å; I264-S267 WeakPolarHBondContact O-CB 3.35Å; I264-S267 PolarHBondContact O-N 3.25Å; I264-I268 HydrophobicContact CG2-CD1 4.2Å; I264-I268 WeakPolarHBondContact O-CG1 3.22Å; I264-I268 PolarHBondContact O-N 2.91Å; I264-Y295 HydrophobicContact CB-CD2 4.25Å; I264-Y295 HydrophobicContact CD1-CD2 4.43Å; I264-Y295 HydrophobicContact CG2-CD2 3.44Å; I264-Y295 VanDerWaalsContact CG2-CD2 3.44Å; I264-Y295 HydrophobicContact CG2-CE2 4.07Å; I264-Y295 HydrophobicContact CG2-CG 4.15Å
265L79.3Confident78.8Confident72 Ų7245.8 Ų45.838%0.37724%0.235SC..Hα-helixtrans-61.6-39.9174.8-68.6177.9000111.8I261 I262 I268 K269I261-L265 HydrophobicContact CG2-CD1 3.66Å; I261-L265 HydrophobicContact CG2-CG 3.86Å; I261-L265 WeakPolarHBondContact O-CG 3.19Å; I261-L265 PolarHBondContact O-N 2.96Å; I262-L265 PolarHBondContact O-N 3.28Å; L265-I268 PolarHBondContact O-N 3.16Å; L265-K269 WeakPolarHBondContact O-CG 3.31Å; L265-K269 PolarHBondContact O-N 3.1Å
266W77.5Confident78.4Confident100 Ų10049.1 Ų49.138%0.37925%0.249SC..Hα-helixtrans-65.1-42.1174.4-68-14000112.4R210 D211 L214 I262 P263 I264 I268 K269 H270R210-W266 HydrophobicContact CG-CH2 4.32Å; R210-W266 HydrophobicContact CG-CZ3 4.25Å; D211-W266 WeakPolarHBondContact OD1-CZ3 3.47Å; L214-W266 HydrophobicContact CD1-CH2 3.74Å; L214-W266 HydrophobicContact CD1-CZ3 3.63Å; I262-W266 HydrophobicContact CG2-CD2 3.93Å; I262-W266 HydrophobicContact CG2-CE3 4.16Å; I262-W266 HydrophobicContact CG2-CH2 3.67Å; I262-W266 HydrophobicContact CG2-CZ2 3.41Å; I262-W266 VanDerWaalsContact CG2-CZ2 3.41Å; I262-W266 HydrophobicContact CG2-CZ3 4.04Å; I262-W266 PolarHBondContact O-N 2.96Å; P263-W266 PolarHBondContact O-N 3.06Å; I264-W266 VanDerWaalsContact C-N 3.31Å; I264-W266 PolarHBondContact O-N 3.13Å; W266-I268 VanDerWaalsContact C-N 3.33Å; W266-I268 PolarHBondContact O-N 3.42Å; W266-K269 PolarHBondContact O-N 3.32Å; W266-H270 WeakPolarHBondContact O-CB 3.24Å; W266-H270 PolarHBondContact O-N 3.49Å
267S76Confident78.2Confident9 Ų954.6 Ų54.66%0.06328%0.282CS..Hα-helixtrans-58.8-43.5176.2-177.20000111.9G197 P263 I264 H270 L271G197-S267 WeakPolarHBondContact O-CB 3.11Å; G197-S267 PolarHBondContact O-OG 3.37Å; P263-S267 WeakPolarHBondContact O-CB 3.26Å; P263-S267 PolarHBondContact O-N 3.45Å; I264-S267 WeakPolarHBondContact O-CB 3.35Å; I264-S267 PolarHBondContact O-N 3.25Å; S267-H270 PolarHBondContact O-N 3.06Å; S267-L271 WeakPolarHBondContact O-CB 3.29Å; S267-L271 WeakPolarHBondContact O-CG 3.25Å; S267-L271 PolarHBondContact O-N 3.42Å
268I76.2Confident77.3Confident24 Ų2457.9 Ų57.912%0.12330%0.298CS..Hα-helixtrans-62.7-50.3175.6-66.7169.5000110.6I264 L265 W266 H270 L271 E272 L288 Y295I264-I268 HydrophobicContact CG2-CD1 4.2Å; I264-I268 WeakPolarHBondContact O-CG1 3.22Å; I264-I268 PolarHBondContact O-N 2.91Å; L265-I268 PolarHBondContact O-N 3.16Å; W266-I268 VanDerWaalsContact C-N 3.33Å; W266-I268 PolarHBondContact O-N 3.42Å; I268-H270 VanDerWaalsContact C-N 3.31Å; I268-H270 PolarHBondContact O-N 3.46Å; I268-L271 PolarHBondContact O-N 2.67Å; I268-E272 WeakPolarHBondContact O-CB 3.44Å; I268-E272 PolarHBondContact O-N 2.88Å; I268-L288 HydrophobicContact CB-CD1 4.34Å; I268-L288 HydrophobicContact CG2-CD1 3.83Å; I268-Y295 HydrophobicContact CD1-CG 4.4Å
269K78.8Confident76.8Confident132 Ų13259.7 Ų59.757%0.57432%0.322SS*.Hα-helixtrans-59.9-41179.3-75.8-175.4175.2-174.10112.4L265 W266 E272 Q273L265-K269 WeakPolarHBondContact O-CG 3.31Å; L265-K269 PolarHBondContact O-N 3.1Å; W266-K269 PolarHBondContact O-N 3.32Å; K269-E272 PolarHBondContact O-N 2.98Å; K269-Q273 WeakPolarHBondContact O-CG 3.37Å; K269-Q273 PolarHBondContact O-N 2.98Å
270H75.1Confident76.4Confident71 Ų7166.4 Ų66.433%0.32935%0.349SS..Hα-helixtrans-64.3-44.5176.9175.2-85.6000111.6W266 S267 I268 E272 Q273 A274W266-H270 WeakPolarHBondContact O-CB 3.24Å; W266-H270 PolarHBondContact O-N 3.49Å; S267-H270 PolarHBondContact O-N 3.06Å; I268-H270 VanDerWaalsContact C-N 3.31Å; I268-H270 PolarHBondContact O-N 3.46Å; H270-E272 VanDerWaalsContact C-N 3.3Å; H270-E272 PolarHBondContact O-N 2.81Å; H270-Q273 PolarHBondContact O-N 3.36Å; H270-A274 WeakPolarHBondContact O-CB 3.13Å; H270-A274 PolarHBondContact O-N 3.08Å
271L73.9Confident76.2Confident10 Ų1067.9 Ų67.95%0.05236%0.361CS..Hα-helixtrans-65.1-34.7176.5-75.9169000112.4S267 I268 S275 K287 L288 F291S267-L271 WeakPolarHBondContact O-CB 3.29Å; S267-L271 WeakPolarHBondContact O-CG 3.25Å; S267-L271 PolarHBondContact O-N 3.42Å; I268-L271 PolarHBondContact O-N 2.67Å; L271-S275 PolarHBondContact O-N 3.02Å; L271-K287 HydrophobicContact CD2-CD 4.26Å; L271-L288 HydrophobicContact CB-CD1 3.72Å; L271-L288 HydrophobicContact CD1-CD1 4.35Å; L271-F291 HydrophobicContact CD1-CD2 3.65Å; L271-F291 HydrophobicContact CD1-CE2 4.01Å; L271-F291 HydrophobicContact CD1-CG 4.3Å
272E79.4Confident75.9Confident91 Ų9171 Ų7143%0.42538%0.382SS..Hα-helixtrans-66.1-47.7174.3-173.7177.5-175.200111.3I268 K269 H270 A274 S275 Q276 L288I268-E272 WeakPolarHBondContact O-CB 3.44Å; I268-E272 PolarHBondContact O-N 2.88Å; K269-E272 PolarHBondContact O-N 2.98Å; H270-E272 VanDerWaalsContact C-N 3.3Å; H270-E272 PolarHBondContact O-N 2.81Å; E272-A274 PolarHBondContact O-N 3.39Å; E272-S275 WeakPolarHBondContact O-CB 3.41Å; E272-S275 PolarHBondContact O-N 3.25Å; E272-S275 PolarHBondContact O-OG 3.39Å; E272-Q276 PolarHBondContact O-N 2.92Å; E272-L288 HydrophobicContact CB-CD2 4.46Å
273Q79.7Confident75.6Confident126 Ų12673.9 Ų73.959%0.58939%0.392SS*.Hα-helixtrans-60.4-43.9174.9-73174.3-15.700111.9K269 H270 S275 Q276 T277K269-Q273 WeakPolarHBondContact O-CG 3.37Å; K269-Q273 PolarHBondContact O-N 2.98Å; H270-Q273 PolarHBondContact O-N 3.36Å; Q273-S275 PolarHBondContact O-N 3.45Å; Q273-Q276 PolarHBondContact O-N 3.04Å; Q273-Q276 VanDerWaalsContact O-N 3.13Å; Q273-T277 PolarHBondContact O-N 3.39Å; Q273-T277 PolarHBondContact O-OG1 2.98Å
274A74.6Confident75.5Confident21 Ų2174.5 Ų74.517%0.17440%0.395CS..Hα-helixtrans-64.1-24.817500000112.8H270 E272 D278 N284H270-A274 WeakPolarHBondContact O-CB 3.13Å; H270-A274 PolarHBondContact O-N 3.08Å; E272-A274 PolarHBondContact O-N 3.39Å; A274-D278 WeakPolarHBondContact O-CB 3.48Å; A274-D278 PolarHBondContact O-N 3.25Å; A274-N284 PolarHBondContact O-ND2 2.76Å; A274-N284 VanDerWaalsContact O-ND2 3.17Å
275S74.6Confident75.4Confident14 Ų1478 Ų7810%0.09841%0.414CS..Hα-helixtrans-75.9-25.2175.178.50000113.3L271 E272 Q273 A281L271-S275 PolarHBondContact O-N 3.02Å; E272-S275 WeakPolarHBondContact O-CB 3.41Å; E272-S275 PolarHBondContact O-N 3.25Å; E272-S275 PolarHBondContact O-OG 3.39Å; Q273-S275 PolarHBondContact O-N 3.45Å; S275-A281 VanDerWaalsContact O-CB 3.32Å; S275-A281 WeakPolarHBondContact O-CB 3.45Å
276Q77.6Confident75.2Confident148 Ų14880.8 Ų80.869%0.69242%0.424SS*.Hα-helixtrans-80.6-28.9-179.5-68.8-179.4-10.200112.8E272 Q273E272-Q276 PolarHBondContact O-N 2.92Å; Q273-Q276 PolarHBondContact O-N 3.04Å; Q273-Q276 VanDerWaalsContact O-N 3.13Å
277T77.2Confident74.9Confident121 Ų12179.1 Ų79.174%0.74242%0.42SS*.Hα-helixtrans-100.4-20.1-174.854.20000114.4Q273Q273-T277 PolarHBondContact O-N 3.39Å; Q273-T277 PolarHBondContact O-OG1 2.98Å
278D65Low74.7Confident89 Ų8979.3 Ų79.348%0.47642%0.42SS..  trans-94.5139.9-175.1-98.2-33.9000114.2A274 K280 A281A274-D278 WeakPolarHBondContact O-CB 3.48Å; A274-D278 PolarHBondContact O-N 3.25Å; D278-K280 PolarHBondContact O-N 3.35Å; D278-A281 PolarHBondContact O-N 3.45Å; D278-A281 VanDerWaalsContact O-N 3.13Å
279G72.8Confident74.6Confident89 Ų8986.9 Ų86.992%0.91845%0.447SS*.THydrogen-bonded Turntrans-62.62.516700000115
280K72.6Confident74.2Confident153 Ų15383.4 Ų83.467%0.66544%0.435SS*.THydrogen-bonded Turntrans-113.226.3175-66.9-179.3-179.4173.50112.8D278 V282 F283 N284D278-K280 PolarHBondContact O-N 3.35Å; K280-V282 PolarHBondContact O-N 2.9Å; K280-F283 PolarHBondContact O-N 3.12Å; K280-N284 PolarHBondContact O-N 2.89Å
281A75.2Confident74Confident34 Ų3481.5 Ų81.528%0.28143%0.426SS..Hα-helixtrans-44.3-42.6-177.200000114.4S275 D278 F283 N284 L285S275-A281 VanDerWaalsContact O-CB 3.32Å; S275-A281 WeakPolarHBondContact O-CB 3.45Å; D278-A281 PolarHBondContact O-N 3.45Å; D278-A281 VanDerWaalsContact O-N 3.13Å; A281-F283 VanDerWaalsContact C-N 3.33Å; A281-F283 PolarHBondContact O-N 3.43Å; A281-N284 PolarHBondContact O-N 2.79Å; A281-L285 WeakPolarHBondContact O-CB 3.35Å; A281-L285 VanDerWaalsContact O-CG 3.29Å; A281-L285 WeakPolarHBondContact O-CG 3.21Å; A281-L285 PolarHBondContact O-N 3.41Å
282V76.3Confident74.2Confident104 Ų10484.9 Ų84.963%0.6344%0.441SS*.Hα-helixtrans-57.6-43.2179.6-179.30000112.3K280 Q286K280-V282 PolarHBondContact O-N 2.9Å; V282-Q286 WeakPolarHBondContact O-CG 3.34Å; V282-Q286 PolarHBondContact O-N 2.76Å; V282-Q286 VanDerWaalsContact O-N 3.08Å
283F74.1Confident73.9Confident130 Ų13086.7 Ų86.757%0.5745%0.45SS*.Hα-helixtrans-69.2-41.8179.5-179.5-99.9000111.6K280 A281 Q286 K287K280-F283 PolarHBondContact O-N 3.12Å; A281-F283 VanDerWaalsContact C-N 3.33Å; A281-F283 PolarHBondContact O-N 3.43Å; F283-Q286 PolarHBondContact O-N 2.94Å; F283-K287 WeakPolarHBondContact O-CB 3.48Å; F283-K287 PolarHBondContact O-N 3.47Å
284N73.5Confident73.6Confident20 Ų2082.5 Ų82.511%0.10743%0.429CS..Hα-helixtrans-65.3-40177.8-72.8-14.7000111.5A274 K280 A281 K287 L288A274-N284 PolarHBondContact O-ND2 2.76Å; A274-N284 VanDerWaalsContact O-ND2 3.17Å; K280-N284 PolarHBondContact O-N 2.89Å; A281-N284 PolarHBondContact O-N 2.79Å; N284-K287 PolarHBondContact O-N 3.19Å; N284-L288 WeakPolarHBondContact O-CB 3.37Å; N284-L288 PolarHBondContact O-N 3.33Å
285L73.5Confident73.7Confident81 Ų8183.9 Ų83.942%0.42443%0.43SS..Hα-helixtrans-65.9-40.9176-71.4172.9000112.8A281 K287 L288 R289A281-L285 WeakPolarHBondContact O-CB 3.35Å; A281-L285 VanDerWaalsContact O-CG 3.29Å; A281-L285 WeakPolarHBondContact O-CG 3.21Å; A281-L285 PolarHBondContact O-N 3.41Å; L285-K287 VanDerWaalsContact C-N 3.34Å; L285-L288 WeakPolarHBondContact O-CB 3.35Å; L285-L288 PolarHBondContact O-N 3.48Å; L285-R289 PolarHBondContact O-N 2.89Å
286Q74.8Confident73.9Confident129 Ų12988.4 Ų88.460%0.60345%0.453SS*.Hα-helixtrans-62.7-42.5174.6-76.7180-7.100111.5V282 F283 L288 R289 L290V282-Q286 WeakPolarHBondContact O-CG 3.34Å; V282-Q286 PolarHBondContact O-N 2.76Å; V282-Q286 VanDerWaalsContact O-N 3.08Å; F283-Q286 PolarHBondContact O-N 2.94Å; Q286-L288 VanDerWaalsContact C-N 3.34Å; Q286-L288 PolarHBondContact O-N 3.45Å; Q286-R289 PolarHBondContact O-N 3.49Å; Q286-L290 PolarHBondContact O-N 3.01Å
287K71.2Confident73.8Confident66 Ų6684.8 Ų84.829%0.28744%0.44SS..Hα-helixtrans-61.3-42.9174.7-172172.5179.3-1790111.2L271 F283 N284 L285 L290 F291L271-K287 HydrophobicContact CD2-CD 4.26Å; F283-K287 WeakPolarHBondContact O-CB 3.48Å; F283-K287 PolarHBondContact O-N 3.47Å; N284-K287 PolarHBondContact O-N 3.19Å; L285-K287 VanDerWaalsContact C-N 3.34Å; K287-L290 PolarHBondContact O-N 3.19Å; K287-F291 HydrophobicContact CD-CE2 4.31Å; K287-F291 HydrophobicContact CG-CD2 3.89Å; K287-F291 HydrophobicContact CG-CE2 3.71Å; K287-F291 VanDerWaalsContact O-CD2 3.25Å; K287-F291 WeakPolarHBondContact O-CD2 3.35Å; K287-F291 PolarHBondContact O-N 3.05Å; K287-F291 VanDerWaalsContact O-N 3.07Å
288L72.3Confident73.7Confident13 Ų1379.6 Ų79.67%0.06841%0.409CS..Hα-helixtrans-59.4-46.5177.3-169.470000112.3I268 L271 E272 N284 L285 Q286 L290 F291 Q292I268-L288 HydrophobicContact CB-CD1 4.34Å; I268-L288 HydrophobicContact CG2-CD1 3.83Å; L271-L288 HydrophobicContact CB-CD1 3.72Å; L271-L288 HydrophobicContact CD1-CD1 4.35Å; E272-L288 HydrophobicContact CB-CD2 4.46Å; N284-L288 WeakPolarHBondContact O-CB 3.37Å; N284-L288 PolarHBondContact O-N 3.33Å; L285-L288 WeakPolarHBondContact O-CB 3.35Å; L285-L288 PolarHBondContact O-N 3.48Å; Q286-L288 VanDerWaalsContact C-N 3.34Å; Q286-L288 PolarHBondContact O-N 3.45Å; L288-L290 VanDerWaalsContact C-N 3.3Å; L288-L290 PolarHBondContact O-N 3.01Å; L288-F291 PolarHBondContact O-N 3.47Å; L288-F291 VanDerWaalsContact O-N 3.17Å; L288-Q292 WeakPolarHBondContact O-CG 3.12Å; L288-Q292 PolarHBondContact O-N 3.47Å
289R73.7Confident74.4Confident182 Ų18276.8 Ų76.869%0.68739%0.393SS*.Hα-helixtrans-60.3-39178.2-74.1-172.4-177.5173.31.8112.5L285 Q286 Q292 Q293L285-R289 PolarHBondContact O-N 2.89Å; Q286-R289 PolarHBondContact O-N 3.49Å; R289-Q292 PolarHBondContact O-N 3.17Å; R289-Q293 WeakPolarHBondContact O-CG 3.46Å; R289-Q293 PolarHBondContact O-N 2.95Å; R289-Q293 VanDerWaalsContact O-N 3.08Å
290L70.3Confident74.7Confident60 Ų6075.5 Ų75.531%0.31437%0.37SS..Hα-helixtrans-65.4-42.7176.4-166.774.1000111.4W4 Q286 K287 L288 Q292 Q293 F294W4-L290 HydrophobicContact CD2-CD1 4.44Å; W4-L290 HydrophobicContact CD2-CD2 3.76Å; W4-L290 HydrophobicContact CD2-CG 4.36Å; W4-L290 HydrophobicContact CE3-CD1 4.47Å; W4-L290 HydrophobicContact CE3-CD2 4.28Å; W4-L290 HydrophobicContact CE3-CG 4.42Å; W4-L290 HydrophobicContact CG-CD2 4.06Å; W4-L290 HydrophobicContact CH2-CD2 4.44Å; W4-L290 HydrophobicContact CZ2-CD2 3.95Å; Q286-L290 PolarHBondContact O-N 3.01Å; K287-L290 PolarHBondContact O-N 3.19Å; L288-L290 VanDerWaalsContact C-N 3.3Å; L288-L290 PolarHBondContact O-N 3.01Å; L290-Q292 VanDerWaalsContact C-N 3.35Å; L290-Q293 PolarHBondContact O-N 3.21Å; L290-F294 PolarHBondContact O-N 3.09Å
291F72.7Confident74.9Confident31 Ų3171.2 Ų71.214%0.13635%0.349CS..Hα-helixtrans-63.5-38.3174.5-86.9-70.7000112.6I196 L271 K287 L288 F294 Y295I196-F291 WeakPolarHBondContact O-CE1 3.42Å; L271-F291 HydrophobicContact CD1-CD2 3.65Å; L271-F291 HydrophobicContact CD1-CE2 4.01Å; L271-F291 HydrophobicContact CD1-CG 4.3Å; K287-F291 HydrophobicContact CD-CE2 4.31Å; K287-F291 HydrophobicContact CG-CD2 3.89Å; K287-F291 HydrophobicContact CG-CE2 3.71Å; K287-F291 VanDerWaalsContact O-CD2 3.25Å; K287-F291 WeakPolarHBondContact O-CD2 3.35Å; K287-F291 PolarHBondContact O-N 3.05Å; K287-F291 VanDerWaalsContact O-N 3.07Å; L288-F291 PolarHBondContact O-N 3.47Å; L288-F291 VanDerWaalsContact O-N 3.17Å; F291-F294 PolarHBondContact O-N 3.21Å; F291-Y295 VanDerWaalsContact O-CB 3.26Å; F291-Y295 WeakPolarHBondContact O-CB 3.41Å; F291-Y295 PolarHBondContact O-N 2.92Å
292Q76.3Confident74.9Confident80 Ų8070.6 Ų70.637%0.37434%0.341SS..Hα-helixtrans-63.4-44.6176.2-73.7173.3-1000112L288 R289 L290 Y295 I296L288-Q292 WeakPolarHBondContact O-CG 3.12Å; L288-Q292 PolarHBondContact O-N 3.47Å; R289-Q292 PolarHBondContact O-N 3.17Å; L290-Q292 VanDerWaalsContact C-N 3.35Å; Q292-Y295 WeakPolarHBondContact O-CB 3.2Å; Q292-Y295 PolarHBondContact O-N 3.46Å; Q292-I296 WeakPolarHBondContact O-CG1 3.26Å; Q292-I296 PolarHBondContact O-N 3Å
293Q73.9Confident74.8Confident130 Ų13072.4 Ų72.461%0.60734%0.338SS*.Hα-helixtrans-62-45.5175.9-72179.4-14.900111.5R289 L290 Y295 I296 V297R289-Q293 WeakPolarHBondContact O-CG 3.46Å; R289-Q293 PolarHBondContact O-N 2.95Å; R289-Q293 VanDerWaalsContact O-N 3.08Å; L290-Q293 PolarHBondContact O-N 3.21Å; Q293-Y295 VanDerWaalsContact C-N 3.34Å; Q293-Y295 PolarHBondContact O-N 3.46Å; Q293-I296 PolarHBondContact O-N 3.33Å; Q293-V297 WeakPolarHBondContact O-CG2 3.27Å; Q293-V297 PolarHBondContact O-N 3.49Å; Q293-V297 VanDerWaalsContact O-N 3.15Å
294F73.3Confident74.8Confident37 Ų3770.7 Ų70.716%0.16233%0.334CS..Hα-helixtrans-60.5-43.5175.6178-100.6000111.9W4 I196 L290 F291 V297 V298W4-F294 HydrophobicContact CZ3-CD2 4.4Å; I196-F294 HydrophobicContact CB-CE1 3.99Å; I196-F294 HydrophobicContact CB-CZ 3.95Å; I196-F294 HydrophobicContact CD1-CZ 3.95Å; I196-F294 HydrophobicContact CG2-CD1 3.96Å; I196-F294 HydrophobicContact CG2-CE1 3.29Å; I196-F294 HydrophobicContact CG2-CE2 4.04Å; I196-F294 HydrophobicContact CG2-CZ 3.35Å; L290-F294 PolarHBondContact O-N 3.09Å; F291-F294 PolarHBondContact O-N 3.21Å; F294-V297 PolarHBondContact O-N 2.84Å; F294-V298 HydrophobicContact CD1-CG2 4.13Å; F294-V298 HydrophobicContact CD2-CG2 4.46Å; F294-V298 HydrophobicContact CE1-CG2 3.6Å; F294-V298 HydrophobicContact CE2-CG2 3.99Å; F294-V298 HydrophobicContact CZ-CG2 3.51Å; F294-V298 WeakPolarHBondContact O-CG2 3.36Å; F294-V298 PolarHBondContact O-N 3.24Å
295Y77.4Confident74.8Confident50 Ų5071.5 Ų71.520%0.19634%0.34CS..Hα-helixtrans-59.1-46.8176.6166.8-106.8000112.6I264 I268 F291 Q292 Q293 V297 V298 I299I264-Y295 HydrophobicContact CB-CD2 4.25Å; I264-Y295 HydrophobicContact CD1-CD2 4.43Å; I264-Y295 HydrophobicContact CG2-CD2 3.44Å; I264-Y295 VanDerWaalsContact CG2-CD2 3.44Å; I264-Y295 HydrophobicContact CG2-CE2 4.07Å; I264-Y295 HydrophobicContact CG2-CG 4.15Å; I268-Y295 HydrophobicContact CD1-CG 4.4Å; F291-Y295 VanDerWaalsContact O-CB 3.26Å; F291-Y295 WeakPolarHBondContact O-CB 3.41Å; F291-Y295 PolarHBondContact O-N 2.92Å; Q292-Y295 WeakPolarHBondContact O-CB 3.2Å; Q292-Y295 PolarHBondContact O-N 3.46Å; Q293-Y295 VanDerWaalsContact C-N 3.34Å; Q293-Y295 PolarHBondContact O-N 3.46Å; Y295-V297 VanDerWaalsContact C-N 3.29Å; Y295-V297 PolarHBondContact O-N 3.39Å; Y295-V298 PolarHBondContact O-N 2.84Å; Y295-I299 HydrophobicContact CD2-CD1 4.04Å; Y295-I299 HydrophobicContact CD2-CG1 4.05Å; Y295-I299 HydrophobicContact CE1-CD1 3.78Å; Y295-I299 HydrophobicContact CE2-CD1 3.25Å; Y295-I299 HydrophobicContact CE2-CG1 3.72Å; Y295-I299 WeakPolarHBondContact O-CB 3.38Å; Y295-I299 PolarHBondContact O-N 2.92Å; Y295-I299 WeakPolarHBondContact OH-CD1 3.14Å
296I77.5Confident75Confident110 Ų11068.9 Ų68.956%0.56432%0.324SS*.Hα-helixtrans-59.7-42.1177.6-67.8165.2000110.5Q292 Q293 I299 C300Q292-I296 WeakPolarHBondContact O-CG1 3.26Å; Q292-I296 PolarHBondContact O-N 3Å; Q293-I296 PolarHBondContact O-N 3.33Å; I296-I299 PolarHBondContact O-N 2.87Å; I296-C300 WeakPolarHBondContact O-CB 3.24Å; I296-C300 PolarHBondContact O-N 3.23Å
297V77Confident74.8Confident72 Ų7266.8 Ų66.844%0.43632%0.316SS..Hα-helixtrans-64.4-44.9177.4173.50000111.5Q293 F294 Y295 C300 Y301Q293-V297 WeakPolarHBondContact O-CG2 3.27Å; Q293-V297 PolarHBondContact O-N 3.49Å; Q293-V297 VanDerWaalsContact O-N 3.15Å; F294-V297 PolarHBondContact O-N 2.84Å; Y295-V297 VanDerWaalsContact C-N 3.29Å; Y295-V297 PolarHBondContact O-N 3.39Å; V297-C300 PolarHBondContact O-N 2.71Å; V297-Y301 WeakPolarHBondContact O-CB 3.37Å; V297-Y301 PolarHBondContact O-N 3.32Å
298V75.3Confident74.8Confident12 Ų1266.6 Ų66.67%0.07332%0.321CS..Hα-helixtrans-63.4-44.9178.1171.30000111.2I193 F294 Y295 Y301 I302I193-V298 HydrophobicContact CG2-CG1 4.05Å; F294-V298 HydrophobicContact CD1-CG2 4.13Å; F294-V298 HydrophobicContact CD2-CG2 4.46Å; F294-V298 HydrophobicContact CE1-CG2 3.6Å; F294-V298 HydrophobicContact CE2-CG2 3.99Å; F294-V298 HydrophobicContact CZ-CG2 3.51Å; F294-V298 WeakPolarHBondContact O-CG2 3.36Å; F294-V298 PolarHBondContact O-N 3.24Å; Y295-V298 PolarHBondContact O-N 2.84Å; V298-Y301 WeakPolarHBondContact O-CB 3.39Å; V298-Y301 PolarHBondContact O-N 3.46Å; V298-I302 HydrophobicContact CG1-CD1 3.93Å; V298-I302 WeakPolarHBondContact O-CG1 3.29Å; V298-I302 PolarHBondContact O-N 3.49Å
299I79.6Confident74.4Confident29 Ų2968.2 Ų68.215%0.14933%0.327CS..Hα-helixtrans-62.4-46.4176.1-79.4-156.4000111.2I261 Y295 I296 Y301 I302 Y303I261-I299 HydrophobicContact CD1-CD1 4.38Å; I261-I299 HydrophobicContact CG1-CD1 4.44Å; Y295-I299 HydrophobicContact CD2-CD1 4.04Å; Y295-I299 HydrophobicContact CD2-CG1 4.05Å; Y295-I299 HydrophobicContact CE1-CD1 3.78Å; Y295-I299 HydrophobicContact CE2-CD1 3.25Å; Y295-I299 HydrophobicContact CE2-CG1 3.72Å; Y295-I299 WeakPolarHBondContact O-CB 3.38Å; Y295-I299 PolarHBondContact O-N 2.92Å; Y295-I299 WeakPolarHBondContact OH-CD1 3.14Å; I296-I299 PolarHBondContact O-N 2.87Å; I299-Y301 VanDerWaalsContact C-N 3.29Å; I299-Y301 PolarHBondContact O-N 3.43Å; I299-I302 PolarHBondContact O-N 3.09Å; I299-Y303 HydrophobicContact CG2-CD2 3.36Å; I299-Y303 HydrophobicContact CG2-CE2 3.35Å; I299-Y303 VanDerWaalsContact O-CD2 3.23Å; I299-Y303 WeakPolarHBondContact O-CD2 3.42Å; I299-Y303 PolarHBondContact O-N 2.74Å
300C78.5Confident74Confident63 Ų6365.4 Ų65.443%0.42632%0.318SS..Hα-helixtrans-58.8-44176.4-174.80000110.6I296 V297 Y303 L304I296-C300 WeakPolarHBondContact O-CB 3.24Å; I296-C300 PolarHBondContact O-N 3.23Å; V297-C300 PolarHBondContact O-N 2.71Å; C300-Y303 PolarHBondContact O-N 2.84Å; C300-L304 VanDerWaalsContact O-CB 3.3Å; C300-L304 WeakPolarHBondContact O-CB 2.97Å; C300-L304 WeakPolarHBondContact O-CG 3.11Å; C300-L304 PolarHBondContact O-N 3.04Å
301Y75.6Confident73.9Confident62 Ų6267.9 Ų67.924%0.24333%0.33CS..Hα-helixtrans-60.2-46.3174.7171.3-101.9000112.6V15 V297 V298 I299 L304 T305V15-Y301 HydrophobicContact CB-CD2 4.48Å; V15-Y301 HydrophobicContact CB-CE2 4.35Å; V15-Y301 HydrophobicContact CG1-CD2 3.38Å; V15-Y301 HydrophobicContact CG1-CE2 3.46Å; V15-Y301 VanDerWaalsContact CG1-CE2 3.46Å; V15-Y301 HydrophobicContact CG1-CG 4.48Å; V15-Y301 HydrophobicContact CG2-CD2 4.29Å; V15-Y301 HydrophobicContact CG2-CE2 4.1Å; V297-Y301 WeakPolarHBondContact O-CB 3.37Å; V297-Y301 PolarHBondContact O-N 3.32Å; V298-Y301 WeakPolarHBondContact O-CB 3.39Å; V298-Y301 PolarHBondContact O-N 3.46Å; I299-Y301 VanDerWaalsContact C-N 3.29Å; I299-Y301 PolarHBondContact O-N 3.43Å; Y301-L304 PolarHBondContact O-N 3.4Å; Y301-T305 HydrophobicContact CD2-CG2 4.06Å; Y301-T305 HydrophobicContact CE1-CG2 4.29Å; Y301-T305 HydrophobicContact CE2-CG2 3.64Å; Y301-T305 WeakPolarHBondContact O-CB 3.39Å; Y301-T305 VanDerWaalsContact O-CG2 3.31Å; Y301-T305 WeakPolarHBondContact O-CG2 3.4Å; Y301-T305 PolarHBondContact O-N 2.92Å; Y301-T305 PolarHBondContact O-OG1 3.37Å
302I76.5Confident73.4Confident22 Ų2267.7 Ų67.711%0.11333%0.332CS..Hα-helixtrans-60.7-48176.2-71.1169.8000110.3C257 V260 V298 I299 T305 R306C257-I302 HydrophobicContact CB-CG2 4.26Å; C257-I302 WeakPolarHBondContact SG-CG2 3.29Å; V260-I302 HydrophobicContact CG1-CD1 4.46Å; V298-I302 HydrophobicContact CG1-CD1 3.93Å; V298-I302 WeakPolarHBondContact O-CG1 3.29Å; V298-I302 PolarHBondContact O-N 3.49Å; I299-I302 PolarHBondContact O-N 3.09Å; I302-T305 WeakPolarHBondContact CA-OG1 3.35Å; I302-T305 PolarHBondContact O-N 3.19Å; I302-T305 PolarHBondContact O-OG1 2.98Å; I302-R306 WeakPolarHBondContact O-CB 3.35Å; I302-R306 WeakPolarHBondContact O-CG 3.36Å; I302-R306 PolarHBondContact O-N 2.72Å
303Y74.1Confident72.7Confident141 Ų14167.8 Ų67.855%0.55333%0.332SS*.Hα-helixtrans-64.1-43.8178.9-81.6-61.9000112.5I299 C300 T305 R306 I307I299-Y303 HydrophobicContact CG2-CD2 3.36Å; I299-Y303 HydrophobicContact CG2-CE2 3.35Å; I299-Y303 VanDerWaalsContact O-CD2 3.23Å; I299-Y303 WeakPolarHBondContact O-CD2 3.42Å; I299-Y303 PolarHBondContact O-N 2.74Å; C300-Y303 PolarHBondContact O-N 2.84Å; Y303-T305 PolarHBondContact O-N 3.35Å; Y303-R306 PolarHBondContact O-N 2.68Å; Y303-I307 WeakPolarHBondContact O-CB 2.9Å; Y303-I307 WeakPolarHBondContact O-CD1 3.38Å; Y303-I307 WeakPolarHBondContact O-CG1 3.35Å; Y303-I307 PolarHBondContact O-N 2.86Å
304L74.1Confident72.2Confident94 Ų9463.2 Ų63.249%0.49232%0.317SS..Hα-helixtrans-62.4-44.8177.6-72.2174.6000111.2C300 Y301 R306 I307 V308C300-L304 VanDerWaalsContact O-CB 3.3Å; C300-L304 WeakPolarHBondContact O-CB 2.97Å; C300-L304 WeakPolarHBondContact O-CG 3.11Å; C300-L304 PolarHBondContact O-N 3.04Å; Y301-L304 PolarHBondContact O-N 3.4Å; L304-R306 VanDerWaalsContact C-N 3.28Å; L304-R306 PolarHBondContact O-N 2.94Å; L304-I307 PolarHBondContact O-N 3.05Å; L304-V308 VanDerWaalsContact O-CG2 3.28Å; L304-V308 WeakPolarHBondContact O-CG2 3.42Å; L304-V308 PolarHBondContact O-N 3.01Å
305T72.7Confident71.8Confident38 Ų3863.6 Ų63.623%0.23332%0.324CS..Hα-helixtrans-64.4-32.317751.70000112.4Y301 I302 Y303 K309Y301-T305 HydrophobicContact CD2-CG2 4.06Å; Y301-T305 HydrophobicContact CE1-CG2 4.29Å; Y301-T305 HydrophobicContact CE2-CG2 3.64Å; Y301-T305 WeakPolarHBondContact O-CB 3.39Å; Y301-T305 VanDerWaalsContact O-CG2 3.31Å; Y301-T305 WeakPolarHBondContact O-CG2 3.4Å; Y301-T305 PolarHBondContact O-N 2.92Å; Y301-T305 PolarHBondContact O-OG1 3.37Å; I302-T305 WeakPolarHBondContact CA-OG1 3.35Å; I302-T305 PolarHBondContact O-N 3.19Å; I302-T305 PolarHBondContact O-OG1 2.98Å; Y303-T305 PolarHBondContact O-N 3.35Å; T305-K309 PolarHBondContact O-N 3.03Å
306R78.5Confident70.9Confident26 Ų2663.7 Ų63.710%0.09833%0.329CS..Hα-helixtrans-70.7-47.3172.4-69.9-67.7176.4130.611113.5D253 C257 I302 Y303 L304 V308 K309 Y310D253-R306 PolarHBondContact O-NH2 2.89Å; D253-R306 IonicContact OD1-CZ 3.17Å; D253-R306 IonicContact OD1-NE 3.61Å; D253-R306 IonicContact OD1-NH1 3.82Å; D253-R306 IonicContact OD1-NH2 2.66Å; D253-R306 PolarHBondContact OD1-NH2 2.78Å; D253-R306 IonicContact OD2-CZ 2.7Å; D253-R306 IonicContact OD2-NE 3.03Å; D253-R306 PolarHBondContact OD2-NE 3.36Å; D253-R306 IonicContact OD2-NH1 2.81Å; D253-R306 PolarHBondContact OD2-NH1 3.46Å; D253-R306 IonicContact OD2-NH2 3.11Å; D253-R306 PolarHBondContact OD2-NH2 3.13Å; D253-R306 VanDerWaalsContact OD2-NH2 3.11Å; C257-R306 PolarHBondContact SG-NH2 2.82Å; I302-R306 WeakPolarHBondContact O-CB 3.35Å; I302-R306 WeakPolarHBondContact O-CG 3.36Å; I302-R306 PolarHBondContact O-N 2.72Å; Y303-R306 PolarHBondContact O-N 2.68Å; L304-R306 VanDerWaalsContact C-N 3.28Å; L304-R306 PolarHBondContact O-N 2.94Å; R306-V308 PolarHBondContact O-N 3Å; R306-K309 WeakPolarHBondContact O-CA 3.46Å; R306-K309 WeakPolarHBondContact O-CB 3.28Å; R306-K309 PolarHBondContact O-N 2.97Å; R306-Y310 HydrophobicContact CB-CE2 4.48Å; R306-Y310 VanDerWaalsContact O-CD2 3.23Å; R306-Y310 WeakPolarHBondContact O-CD2 3.26Å; R306-Y310 PolarHBondContact O-N 2.88Å
307I71.4Confident69.9Low84 Ų8465.1 Ų65.143%0.43133%0.334SS..Hα-helixtrans-58-42.3178.3-70.2163.3000109.3Y303 L304 K309 Y310 L311Y303-I307 WeakPolarHBondContact O-CB 2.9Å; Y303-I307 WeakPolarHBondContact O-CD1 3.38Å; Y303-I307 WeakPolarHBondContact O-CG1 3.35Å; Y303-I307 PolarHBondContact O-N 2.86Å; L304-I307 PolarHBondContact O-N 3.05Å; I307-K309 VanDerWaalsContact C-N 3.29Å; I307-K309 PolarHBondContact O-N 3.3Å; I307-Y310 PolarHBondContact O-N 2.9Å; I307-L311 HydrophobicContact CG2-CD1 3.66Å; I307-L311 HydrophobicContact CG2-CG 3.92Å; I307-L311 WeakPolarHBondContact O-CB 3.23Å; I307-L311 VanDerWaalsContact O-CG 3.26Å; I307-L311 WeakPolarHBondContact O-CG 3.03Å; I307-L311 PolarHBondContact O-N 3.01Å
308V69.3Low68.6Low63 Ų6367.9 Ų67.938%0.38234%0.342SS..Hα-helixtrans-57.3-41.4174.6171.60000111.8L304 R306 L311 V312L304-V308 VanDerWaalsContact O-CG2 3.28Å; L304-V308 WeakPolarHBondContact O-CG2 3.42Å; L304-V308 PolarHBondContact O-N 3.01Å; R306-V308 PolarHBondContact O-N 3Å; V308-L311 PolarHBondContact O-N 3.47Å; V308-V312 HydrophobicContact CG1-CG2 4.35Å; V308-V312 WeakPolarHBondContact O-CB 3.1Å; V308-V312 WeakPolarHBondContact O-CG2 3.38Å; V308-V312 PolarHBondContact O-N 3.39Å
309K64.6Low67.5Low47 Ų4769.7 Ų69.720%0.20436%0.358CS..Hα-helixtrans-63.9-44.5176.6-72-167.5-76.4-164.50112.5F249 D253 T305 R306 I307 V312 Q313F249-K309 HydrophobicContact CE1-CD 4.2Å; F249-K309 HydrophobicContact CZ-CD 4.5Å; D253-K309 IonicContact OD1-NZ 3.71Å; D253-K309 WeakPolarHBondContact OD2-CE 3.2Å; D253-K309 IonicContact OD2-NZ 2.54Å; D253-K309 PolarHBondContact OD2-NZ 3.01Å; T305-K309 PolarHBondContact O-N 3.03Å; R306-K309 WeakPolarHBondContact O-CA 3.46Å; R306-K309 WeakPolarHBondContact O-CB 3.28Å; R306-K309 PolarHBondContact O-N 2.97Å; I307-K309 VanDerWaalsContact C-N 3.29Å; I307-K309 PolarHBondContact O-N 3.3Å; K309-V312 PolarHBondContact O-N 2.94Å; K309-Q313 PolarHBondContact O-N 3.22Å; K309-Q313 VanDerWaalsContact O-N 3.12Å
310Y65.8Low66Low123 Ų12370 Ų7048%0.48236%0.361SS..Hα-helixtrans-66.2-42.2176.2-70.1-62.8000112.7R306 I307 V312 Q313 A314R306-Y310 HydrophobicContact CB-CE2 4.48Å; R306-Y310 VanDerWaalsContact O-CD2 3.23Å; R306-Y310 WeakPolarHBondContact O-CD2 3.26Å; R306-Y310 PolarHBondContact O-N 2.88Å; I307-Y310 PolarHBondContact O-N 2.9Å; Y310-V312 VanDerWaalsContact C-N 3.3Å; Y310-V312 PolarHBondContact O-N 2.95Å; Y310-Q313 PolarHBondContact O-N 3.47Å; Y310-A314 PolarHBondContact O-N 3.08Å
311L66.9Low64.3Low111 Ų11174 Ų7458%0.58137%0.374SS*.Hα-helixtrans-62.1-39.3176.6-72.9176.6000111.5I307 V308 A314 S315I307-L311 HydrophobicContact CG2-CD1 3.66Å; I307-L311 HydrophobicContact CG2-CG 3.92Å; I307-L311 WeakPolarHBondContact O-CB 3.23Å; I307-L311 VanDerWaalsContact O-CG 3.26Å; I307-L311 WeakPolarHBondContact O-CG 3.03Å; I307-L311 PolarHBondContact O-N 3.01Å; V308-L311 PolarHBondContact O-N 3.47Å; L311-A314 PolarHBondContact O-N 2.53Å; L311-S315 WeakPolarHBondContact O-CB 3.01Å; L311-S315 PolarHBondContact O-N 3.27Å; L311-S315 PolarHBondContact O-OG 3.4Å
312V62.5Low62.8Low27 Ų2776.4 Ų76.416%0.16439%0.39CS..Hα-helixtrans-63.5-45.7175.5168.90000110.4L30 V308 K309 Y310 A314 S315 V316L30-V312 HydrophobicContact CD1-CG1 4.36Å; V308-V312 HydrophobicContact CG1-CG2 4.35Å; V308-V312 WeakPolarHBondContact O-CB 3.1Å; V308-V312 WeakPolarHBondContact O-CG2 3.38Å; V308-V312 PolarHBondContact O-N 3.39Å; K309-V312 PolarHBondContact O-N 2.94Å; Y310-V312 VanDerWaalsContact C-N 3.3Å; Y310-V312 PolarHBondContact O-N 2.95Å; V312-A314 PolarHBondContact O-N 3.16Å; V312-S315 WeakPolarHBondContact CA-OG 3.47Å; V312-S315 PolarHBondContact O-N 3.24Å; V312-S315 PolarHBondContact O-OG 3.43Å; V312-V316 WeakPolarHBondContact O-CG2 3.26Å; V312-V316 PolarHBondContact O-N 3.06Å
313Q62.7Low61.4Low83 Ų8378.1 Ų78.139%0.38840%0.402SS..Hα-helixtrans-60.5-44175.8-72.6176.9-28.800112.4K309 Y310 S315 V316 E317K309-Q313 PolarHBondContact O-N 3.22Å; K309-Q313 VanDerWaalsContact O-N 3.12Å; Y310-Q313 PolarHBondContact O-N 3.47Å; Q313-S315 PolarHBondContact O-N 3.47Å; Q313-V316 PolarHBondContact O-N 3.22Å; Q313-E317 PolarHBondContact O-N 2.85Å
314A62.6Low59.6Low34 Ų3476.6 Ų76.628%0.28140%0.398SS..Hα-helixtrans-63.7-40.7175.800000112Y310 L311 V312 V316 E317 H318Y310-A314 PolarHBondContact O-N 3.08Å; L311-A314 PolarHBondContact O-N 2.53Å; V312-A314 PolarHBondContact O-N 3.16Å; A314-V316 VanDerWaalsContact C-N 3.29Å; A314-V316 PolarHBondContact O-N 2.72Å; A314-E317 PolarHBondContact O-N 3.1Å; A314-H318 PolarHBondContact O-CD2 2.82Å; A314-H318 PolarHBondContact O-N 3.12Å
315S64.8Low57.8Low45 Ų4575.7 Ų75.732%0.31541%0.405SS..Hα-helixtrans-63.9-34.5177.969.20000112.6L311 V312 Q313 A319L311-S315 WeakPolarHBondContact O-CB 3.01Å; L311-S315 PolarHBondContact O-N 3.27Å; L311-S315 PolarHBondContact O-OG 3.4Å; V312-S315 WeakPolarHBondContact CA-OG 3.47Å; V312-S315 PolarHBondContact O-N 3.24Å; V312-S315 PolarHBondContact O-OG 3.43Å; Q313-S315 PolarHBondContact O-N 3.47Å; S315-A319 VanDerWaalsContact O-CB 3.26Å; S315-A319 WeakPolarHBondContact O-CB 3.49Å; S315-A319 PolarHBondContact O-N 3.14Å
316V58Low56.3Low51 Ų5182.6 Ų82.631%0.30943%0.428SS..Hα-helixtrans-64.9-45.5173.7174.60000110.6L30 V312 Q313 A314 H318 A319 V320L30-V316 HydrophobicContact CD2-CG2 3.36Å; V312-V316 WeakPolarHBondContact O-CG2 3.26Å; V312-V316 PolarHBondContact O-N 3.06Å; Q313-V316 PolarHBondContact O-N 3.22Å; A314-V316 VanDerWaalsContact C-N 3.29Å; A314-V316 PolarHBondContact O-N 2.72Å; V316-H318 PolarHBondContact O-N 3.04Å; V316-A319 PolarHBondContact O-N 3.07Å; V316-V320 VanDerWaalsContact O-CG2 3.26Å; V316-V320 WeakPolarHBondContact O-CG2 3.5Å; V316-V320 PolarHBondContact O-N 3.04Å; V316-V320 VanDerWaalsContact O-N 3.16Å
317E56.8Low54.2Low140 Ų14083.9 Ų83.965%0.65444%0.444SS*.Hα-helixtrans-62.9-41.9178.6-71.7-176.3167.600112.4Q313 A314Q313-E317 PolarHBondContact O-N 2.85Å; A314-E317 PolarHBondContact O-N 3.1Å
318H49.5Very low52.4Low130 Ų13086.7 Ų86.760%0.60246%0.455SS*.Hα-helixtrans-71-40178.7-66.8-53.3000112.9A314 V316 V320 Q321A314-H318 PolarHBondContact O-CD2 2.82Å; A314-H318 PolarHBondContact O-N 3.12Å; V316-H318 PolarHBondContact O-N 3.04Å; H318-V320 VanDerWaalsContact C-N 3.28Å; H318-V320 PolarHBondContact O-N 3.35Å; H318-Q321 PolarHBondContact O-N 3.37Å; H318-Q321 VanDerWaalsContact O-N 3.14Å
319A52.8Low50.8Low51 Ų5191.7 Ų91.742%0.42147%0.472SS..Hα-helixtrans-62.8-36.1177.500000111.8S315 V316 Q321 I322S315-A319 VanDerWaalsContact O-CB 3.26Å; S315-A319 WeakPolarHBondContact O-CB 3.49Å; S315-A319 PolarHBondContact O-N 3.14Å; V316-A319 PolarHBondContact O-N 3.07Å; A319-Q321 PolarHBondContact O-N 3.44Å; A319-I322 PolarHBondContact O-N 3Å
320V49.2Very low49.4Very low36 Ų3695 Ų9522%0.21850%0.496CS..Hα-helixtrans-65.2-19.9176.5168.20000112.9V316 H318 P323V316-V320 VanDerWaalsContact O-CG2 3.26Å; V316-V320 WeakPolarHBondContact O-CG2 3.5Å; V316-V320 PolarHBondContact O-N 3.04Å; V316-V320 VanDerWaalsContact O-N 3.16Å; H318-V320 VanDerWaalsContact C-N 3.28Å; H318-V320 PolarHBondContact O-N 3.35Å; V320-P323 WeakPolarHBondContact O-CD 3.32Å
321Q42.3Very low48Very low147 Ų14794.8 Ų94.869%0.68751%0.507SS*.Hα-helixtrans-82.8-19.2179.4-152.9156.2-64.800113.3H318 A319 F324H318-Q321 PolarHBondContact O-N 3.37Å; H318-Q321 VanDerWaalsContact O-N 3.14Å; A319-Q321 PolarHBondContact O-N 3.44Å; Q321-F324 PolarHBondContact O-N 3.3Å
322I43.4Very low46.3Very low112 Ų11293 Ų9357%0.57450%0.504SS*.Hα-helixtrans-67-35.7-174.7-52.5176.7000113.4A319 F324A319-I322 PolarHBondContact O-N 3Å; I322-F324 VanDerWaalsContact C-N 3.31Å; I322-F324 PolarHBondContact O-N 3.11Å
323P47.3Very low44.6Very low58 Ų5896.5 Ų96.538%0.37753%0.53SS..Hα-helixtrans-67.1-25.7177.3-21.333.3000114.5V320 A325 Y326 A327V320-P323 WeakPolarHBondContact O-CD 3.32Å; P323-A325 PolarHBondContact O-N 3.03Å; P323-Y326 PolarHBondContact O-N 3.42Å; P323-A327 PolarHBondContact O-N 3.49Å
324F35.5Very low43.3Very low108 Ų10897.4 Ų97.447%0.47454%0.543SS..Hα-helixtrans-68.3-34.5-176-97.2-82000113Q321 I322 Y326 H328Q321-F324 PolarHBondContact O-N 3.3Å; I322-F324 VanDerWaalsContact C-N 3.31Å; I322-F324 PolarHBondContact O-N 3.11Å; F324-Y326 VanDerWaalsContact C-N 3.33Å; F324-Y326 PolarHBondContact O-N 3.49Å; F324-H328 PolarHBondContact O-N 2.91Å
325A37.9Very low41.9Very low75 Ų75100.9 Ų100.962%0.6257%0.565SS**Hα-helixtrans-68-33.8176.900000112.3P323P323-A325 PolarHBondContact O-N 3.03Å
326Y39.3Very low40.2Very low183 Ų183109.8 Ų109.872%0.71859%0.591SS**Hα-helixtrans-75.6-37.8177-90.1-84.4000112.8P323 F324 H328 F329P323-Y326 PolarHBondContact O-N 3.42Å; F324-Y326 VanDerWaalsContact C-N 3.33Å; F324-Y326 PolarHBondContact O-N 3.49Å; Y326-H328 PolarHBondContact O-N 3.23Å; Y326-F329 PolarHBondContact O-N 2.65Å
327A34.6Very low39Very low53 Ų53115.4 Ų115.444%0.43862%0.619SS.*Hα-helixtrans-67.6-35.717900000112.6P323 F329 V330 V331P323-A327 PolarHBondContact O-N 3.49Å; A327-F329 VanDerWaalsContact C-N 3.29Å; A327-F329 PolarHBondContact O-N 2.92Å; A327-V330 PolarHBondContact O-N 3.35Å; A327-V331 PolarHBondContact O-N 2.97Å
328H33.5Very low38Very low144 Ų144113.3 Ų113.367%0.66762%0.619SS**Hα-helixtrans-69.6-26.4-179.9-136.6-97.9000113.2F324 Y326 S332F324-H328 PolarHBondContact O-N 2.91Å; Y326-H328 PolarHBondContact O-N 3.23Å; H328-S332 PolarHBondContact O-OG 2.74Å
329F36Very low37.4Very low168 Ų168113.5 Ų113.574%0.73763%0.63SS**Hα-helixtrans-73.4-30.7174.9-167-102.8000112.5Y326 A327Y326-F329 PolarHBondContact O-N 2.65Å; A327-F329 VanDerWaalsContact C-N 3.29Å; A327-F329 PolarHBondContact O-N 2.92Å
330V35.6Very low36.6Very low116 Ų116115.9 Ų115.970%0.70364%0.643SS**Hα-helixtrans-82.8-32.7-178178.90000112.5A327A327-V330 PolarHBondContact O-N 3.35Å
331V37.3Very low36.1Very low118 Ų118116 Ų11672%0.71565%0.651SS**Hα-helixtrans-83.9-18.9-176.9-179.50000113.1A327A327-V331 PolarHBondContact O-N 2.97Å
332S31.1Very low36.1Very low75 Ų75115.4 Ų115.452%0.52465%0.652SS.*THydrogen-bonded Turntrans-91.910.4-176.855.40000115.4H328H328-S332 PolarHBondContact O-OG 2.74Å
333S26.8Very low36Very low100 Ų100117.6 Ų117.670%0.69966%0.66SS**  trans-135.662.5170.5-72.70000114.1
334P34.6Very low35.7Very low102 Ų102125.2 Ų125.266%0.66268%0.681SS**  trans-74.5132.1158.718.4-4.3000108.7
335S33.4Very low36Very low106 Ų106125.5 Ų125.574%0.74169%0.687SS**SBendtrans82.849159.274.60000120.3
336R29.3Very low36.3Very low232 Ų232127.4 Ų127.488%0.87569%0.686SS**  trans-16765.3149.5-133166.7-77.6-126.71.5117.5
337L32.2Very low36.6Very low169 Ų169127.7 Ų127.789%0.88569%0.691SS**  trans-132.788.7152.6-103.5102.2000109.9
338S35.5Very low37Very low96 Ų96129.6 Ų129.667%0.67170%0.701SS**  trans-57.3144.3161.662.60000109.2C340S338-C340 PolarHBondContact O-N 3.19Å
339T38.7Very low37.2Very low134 Ų134132 Ų13282%0.82270%0.704SS**THydrogen-bonded Turntrans-61.715.2-169.844.20000116.3
340C34.6Very low37.1Very low102 Ų102127.2 Ų127.269%0.68970%0.703SS**THydrogen-bonded Turntrans-87.8-19.1-179.5-87.80000114.8S338S338-C340 PolarHBondContact O-N 3.19Å
341G40.3Very low37Very low39 Ų39127.6 Ų127.640%0.40270%0.7SS.*Hα-helixtrans-72.9-41.3-175.800000113.9Q343 R344G341-Q343 VanDerWaalsContact C-N 3.3Å; G341-Q343 PolarHBondContact O-N 3.2Å; G341-R344 PolarHBondContact O-N 3.05Å
342L41Very low36.8Very low134 Ų134130.3 Ų130.370%0.70271%0.705SS**Hα-helixtrans-72.6-24.6-170.2-148.671.9000112.9
343Q41Very low36.8Very low157 Ų157132.9 Ų132.973%0.73472%0.721SS**Hα-helixtrans-81.3-20-178.8-157.6148-22.100113.5G341G341-Q343 VanDerWaalsContact C-N 3.3Å; G341-Q343 PolarHBondContact O-N 3.2Å
344R41.2Very low37Very low219 Ų219132.5 Ų132.583%0.82672%0.718SS**Hα-helixtrans-78.9-33.2172.6-89.4-173.2-169.7-148.31113G341 S348G341-R344 PolarHBondContact O-N 3.05Å; R344-S348 PolarHBondContact O-N 3.38Å
345L43Very low36.8Very low114 Ų114133.4 Ų133.460%0.59773%0.727SS**Hα-helixtrans-72.6-37-179.7-81.4160.3000112.5K347 S348L345-K347 VanDerWaalsContact C-N 3.33Å; L345-K347 PolarHBondContact O-N 3.24Å; L345-S348 PolarHBondContact O-N 3.25Å
346L43.1Very low36.6Very low114 Ų114133.7 Ų133.760%0.59773%0.728SS**Hα-helixtrans-67.3-29.5177.3-88.2150.8000113.6
347K45.6Very low36.5Very low189 Ų189126.3 Ų126.382%0.82273%0.725SS**Hα-helixtrans-76.8-26.3173.6-95.8-172.1177.3-170.10113.7L345 W349L345-K347 VanDerWaalsContact C-N 3.33Å; L345-K347 PolarHBondContact O-N 3.24Å; K347-W349 PolarHBondContact O-N 2.72Å
348S43Very low36.3Very low93 Ų93125.8 Ų125.865%0.6572%0.722SS**Hα-helixtrans-71.4-17.5179-174.60000113.2R344 L345R344-S348 PolarHBondContact O-N 3.38Å; L345-S348 PolarHBondContact O-N 3.25Å
349W39.2Very low35.9Very low194 Ų194125.7 Ų125.774%0.73573%0.727SS**THydrogen-bonded Turntrans-105.813-176.3-79.169.5000114.2K347 L351K347-W349 PolarHBondContact O-N 2.72Å; W349-L351 HydrophobicContact CB-CD1 3.97Å; W349-L351 WeakPolarHBondContact O-CG 3.36Å; W349-L351 PolarHBondContact O-N 3.02Å
350G33.3Very low35.3Very low68 Ų68129.3 Ų129.370%0.70173%0.734SS**THydrogen-bonded Turntrans58.410.5168.700000115.7H352G350-H352 PolarHBondContact O-N 3.1Å
351L33.3Very low34.9Very low125 Ų125129.1 Ų129.165%0.65473%0.734SS**  trans-83.884.4-176.2-78.6146.8000108.5W349 C353W349-L351 HydrophobicContact CB-CD1 3.97Å; W349-L351 WeakPolarHBondContact O-CG 3.36Å; W349-L351 PolarHBondContact O-N 3.02Å; L351-C353 PolarHBondContact O-N 3.14Å
352H33.6Very low34.3Very low174 Ų174132.9 Ų132.981%0.80675%0.754SS**  trans-62.3114.4158.4-99.5-132000107.9G350 S354G350-H352 PolarHBondContact O-N 3.1Å; H352-S354 PolarHBondContact O-N 3.5Å
353C30.4Very low33.5Very low129 Ų129133.3 Ų133.387%0.87276%0.757SS**  trans-66.584.8171.9-164.90000108.5L351L351-C353 PolarHBondContact O-N 3.14Å
354S31.9Very low32.8Very low92 Ų92134.4 Ų134.464%0.64376%0.762SS**  trans-102.3134.6166.3-650000107.4H352H352-S354 PolarHBondContact O-N 3.5Å
355S30.3Very low32Very low121 Ų121135 Ų13585%0.84677%0.765SS**  trans90.256.9175.6-43.70000116.2G357S355-G357 VanDerWaalsContact C-N 3.26Å; S355-G357 PolarHBondContact O-N 3.27Å
356C28.9Very low31.2Very low112 Ų112135 Ų13576%0.75777%0.771SS**  trans-91.872.1143.5-145.60000107.8L358C356-L358 PolarHBondContact O-N 3.1Å
357G26.6Very low30.3Very low78 Ų78136.2 Ų136.280%0.80478%0.784SS**  trans-8878171.800000109.3S355S355-G357 VanDerWaalsContact C-N 3.26Å; S355-G357 PolarHBondContact O-N 3.27Å
358L28.5Very low29.4Very low158 Ų158134.2 Ų134.283%0.82778%0.781SS**  trans-104.5114170-100.1149.8000108.4C356C356-L358 PolarHBondContact O-N 3.1Å
359A27.4Very low28.5Very low94 Ų94135.1 Ų135.178%0.77778%0.784SS**  trans-48.8135.9-172.600000113.5S361A359-S361 VanDerWaalsContact C-N 3.33Å; A359-S361 PolarHBondContact O-N 2.82Å
360Q26.4Very low27.9Very low209 Ų209132.4 Ų132.498%0.97779%0.789SS**  trans-60.792.2163.4-84.1157.2-65.400109.6
361S25.9Very low27.4Very low98 Ų98134.6 Ų134.669%0.68579%0.792SS**  trans-109.4108.4156.8176.50000107.1A359 N363A359-S361 VanDerWaalsContact C-N 3.33Å; A359-S361 PolarHBondContact O-N 2.82Å; S361-N363 PolarHBondContact O-N 3.22Å
362S26.7Very low27Very low119 Ų119133.2 Ų133.283%0.83280%0.799SS**  trans-44.3104.8168.651.30000110.1
363N24.8Very low26.5Very low143 Ų143135.5 Ų135.577%0.76580%0.802SS**  trans-134.7113.3166.3-144.3-1.6000109.4S361 R365S361-N363 PolarHBondContact O-N 3.22Å; N363-R365 PolarHBondContact O-N 3.01Å
364Q25.7Very low26.4Very low179 Ų179135 Ų13584%0.83680%0.797SS**PPolyproline II helixtrans-46.5118.7168.5-71.2163.4-2500108P366Q364-P366 WeakPolarHBondContact O-CD 3.43Å
365R24.1Very low26.1Very low233 Ų233136.2 Ų136.288%0.87981%0.806SS**PPolyproline II helixtrans-61.5123.7169.6-84.3-178.1-134.9-164.61.4107.8N363 T367N363-R365 PolarHBondContact O-N 3.01Å; R365-T367 PolarHBondContact O-N 2.8Å
366P26.7Very low25.9Very low113 Ų113142 Ų14273%0.73481%0.809SS**PPolyproline II helixtrans-65.8120.3163.726.7-28.4000107.4Q364 I368Q364-P366 WeakPolarHBondContact O-CD 3.43Å; P366-I368 PolarHBondContact O-N 3.34Å
367T24.8Very low25.8Very low140 Ų140142.6 Ų142.686%0.85981%0.809SS**  trans-55.1103.5171.137.40000109.8R365R365-T367 PolarHBondContact O-N 2.8Å
368I25.3Very low25.7Very low147 Ų147145.5 Ų145.575%0.75481%0.812SS**  trans-76.1121.2162.9-59.6172000106P366 T370P366-I368 PolarHBondContact O-N 3.34Å; I368-T370 PolarHBondContact O-N 3.23Å
369P25.1Very low25.6Very low112 Ų112147.3 Ų147.373%0.72781%0.813SS**  trans-68.3110.5179.826.4-29.8000108.8C371P369-C371 PolarHBondContact O-N 3.04Å
370T26.6Very low25.5Very low137 Ų137149 Ų14984%0.8481%0.814SS**  trans-60.5101.2167.938.70000109.1I368 A372I368-T370 PolarHBondContact O-N 3.23Å; T370-A372 PolarHBondContact O-N 3.41Å; T370-A372 VanDerWaalsContact O-N 3.1Å
371C22.5Very low25.4Very low113 Ų113146.9 Ų146.976%0.76481%0.809SS**  trans-60.9109.9162.8-71.60000108.3P369 Y373P369-C371 PolarHBondContact O-N 3.04Å; C371-Y373 PolarHBondContact O-N 3.32Å; C371-Y373 VanDerWaalsContact O-N 3.14Å
372A24.8Very low25.4Very low96 Ų96151 Ų15179%0.79382%0.817SS**  trans-62.8109.7175.300000109.7T370T370-A372 PolarHBondContact O-N 3.41Å; T370-A372 VanDerWaalsContact O-N 3.1Å
373Y24Very low25.5Very low223 Ų223151.1 Ų151.188%0.87582%0.816SS**  trans-71.5124.2166.4-97.7-95.1000108.7C371 S375C371-Y373 PolarHBondContact O-N 3.32Å; C371-Y373 VanDerWaalsContact O-N 3.14Å; Y373-S375 PolarHBondContact O-N 3.45Å
374P27.8Very low25.6Very low117 Ų117152.9 Ų152.976%0.7682%0.821SS**  trans-70.5122.9176.126.6-29.2000109.4R376P374-R376 PolarHBondContact O-N 3.33Å
375S25.2Very low25.6Very low119 Ų119154.8 Ų154.883%0.83282%0.821SS**  trans-50.5103.2174.238.60000111.5Y373 T377Y373-S375 PolarHBondContact O-N 3.45Å; S375-T377 PolarHBondContact O-N 3.41Å
376R27Very low25.7Very low242 Ų242149.5 Ų149.591%0.91382%0.815SS**  trans-78.3108173.5-173.6176.2-77.2-162.5-3.2109P374P374-R376 PolarHBondContact O-N 3.33Å
377T26.2Very low25.7Very low124 Ų124150.9 Ų150.976%0.76181%0.814SS**  trans-54.3131.4170.6420000111.8S375 K379S375-T377 PolarHBondContact O-N 3.41Å; T377-K379 PolarHBondContact O-N 3.39Å
378T24.6Very low25.9Very low140 Ų140153.8 Ų153.886%0.85982%0.816SS**  trans-47.7111.5170.930.70000113.2
379K26.3Very low26Very low195 Ų195154.7 Ų154.785%0.84882%0.822SS**  trans-132.993.4153.3-82.2-167.6176.6-179.40110T377T377-K379 PolarHBondContact O-N 3.39Å
380T25.6Very low26.2Very low130 Ų130152.6 Ų152.680%0.79882%0.821SS**  trans32.7101.9137.3460000118.6
381N23.5Very low26.3Very low165 Ų165154.2 Ų154.288%0.88282%0.823SS**  trans12.1102.3135.2-70.9-21.9000117.7
382Q25.7Very low26.5Very low183 Ų183159.7 Ų159.786%0.85583%0.827SS**  trans-144.5135.3137.8-77.1-166.5-19.700109.7M384Q382-M384 PolarHBondContact O-N 2.79Å
383P29.6Very low26.7Very low123 Ų123163.6 Ų163.680%0.79983%0.829SS**  trans-86.2112.8-169.833-30.6000110.8R385P383-R385 PolarHBondContact O-N 3.31Å; P383-R385 VanDerWaalsContact O-N 3.1Å
384M25.6Very low27Very low179 Ų179160.1 Ų160.188%0.88283%0.825SS**  trans-80.992.2174.4-144.4174.1-151.300109.2Q382Q382-M384 PolarHBondContact O-N 2.79Å
385R25.6Very low27Very low219 Ų219162.3 Ų162.383%0.82683%0.825SS**  trans-66.6138.9165.3-78.4-173.9178.9-169.70.1109.9P383P383-R385 PolarHBondContact O-N 3.31Å; P383-R385 VanDerWaalsContact O-N 3.1Å
386T27.2Very low27.5Very low122 Ų122167.1 Ų167.175%0.74883%0.831SS**  trans55.686.6147.6470000117.8
387I27.1Very low27.8Very low142 Ų142163.7 Ų163.773%0.72886%0.855SS**  trans-12271.5149.3-55.8175.8000106.5
388F28.4Very low27.9Very low202 Ų202165.7 Ų165.789%0.88686%0.86SS**  trans-150.524.4169.1-98.7-71.4000112.9
389D27.7Very low28.1Very low166 Ų166167 Ų16789%0.88886%0.86SS**  trans-102.486.9162.5-84.5-33.1000107.9
390G28.3Very low28.2Very low68 Ų68165.4 Ų165.470%0.70186%0.86SS**  trans-173.226-175.700000116.1
391I29.6Very low28.4Very low171 Ų171167.5 Ų167.588%0.87786%0.864SS**  trans-139.871.5164-51.2179.2000107.2
392R27.6Very low28.7Very low228 Ų228167.7 Ų167.786%0.8686%0.863SS**  trans-86.3118.5169.5-177.9177.7-89.8-171.5-5.5107.1
393H28.9Very low28.9Very low178 Ų178166.7 Ų166.782%0.82486%0.863SS**  trans15.4105.3152.7-71.2-91000116.9
394D30.3Very low28.8Very low150 Ų150169.8 Ų169.880%0.80287%0.868SS**  trans-134.1118.5149.9-96-36.5000110.6
395Q27.7Very low29Very low163 Ų163169.1 Ų169.176%0.76287%0.867SS**  trans61.6100149.4-54.4-149.4-12.800120
396F35.2Very low29.3Very low219 Ų219164.9 Ų164.996%0.96187%0.87SS**  -138100.2124-83.9-77.5000108
397A34.1Very low29.5Very low170 Ų170168.8 Ų168.8100%1.40588%0.881SS**  trans-81.70153.900000108.8

Retrieved 397 of 397 residues in 76.3 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).