A0A060WCK3_ONCMY Loading...

Solute carrier family 35 member F6

May play a role as a nucleotide-sugar transporter.

AlphaFold DB , UniProt , Accession A0A060WCK3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110529420, Length 375 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
1M49Very low83.7Confident241 Ų24197.4 Ų97.4100%1.18749%0.487SS*.  0130.80-77.1-175.6-100.300109
2A69.6Low84.4Confident101 Ų10192 Ų9284%0.83548%0.475SS*.PPolyproline II helixtrans-79.4134.1178.300000110.4
3W78.6Confident85.2Confident90 Ų9087.5 Ų87.534%0.34145%0.451SS..PPolyproline II helixtrans-64.1144.6176.4-70.27.6000111.1Q7 L8 A11 I288 T292 L296W3-Q7 HydrophobicContact CB-CB 4.27Å; W3-L8 HydrophobicContact CB-CD2 4.37Å; W3-L8 HydrophobicContact CB-CG 3.99Å; W3-L8 HydrophobicContact CE3-CD2 3.72Å; W3-L8 HydrophobicContact CE3-CG 4.22Å; W3-L8 HydrophobicContact CZ3-CD2 4.45Å; W3-A11 HydrophobicContact CZ3-CB 3.75Å; W3-I288 HydrophobicContact CD2-CD1 4.43Å; W3-I288 HydrophobicContact CZ2-CD1 4.39Å; W3-T292 HydrophobicContact CH2-CG2 3.97Å; W3-T292 HydrophobicContact CZ2-CG2 3.9Å; W3-L296 HydrophobicContact CH2-CD2 4.45Å
4T89.1Confident85.8Confident70 Ų7081.3 Ų81.343%0.42942%0.42SS..PPolyproline II helixtrans-69.8159174700000110.8Y6 Q7 L8T4-Y6 PolarHBondContact O-N 2.93Å; T4-Q7 PolarHBondContact O-N 3.18Å; T4-Q7 WeakPolarHBondContact OG1-CB 3.36Å; T4-Q7 VanDerWaalsContact OG1-CG 3.31Å; T4-Q7 WeakPolarHBondContact OG1-CG 3.38Å; T4-Q7 PolarHBondContact OG1-N 3.33Å; T4-Q7 VanDerWaalsContact OG1-N 3.12Å; T4-Q7 PolarHBondContact OG1-OE1 3.47Å; T4-L8 PolarHBondContact O-N 3.18Å
5K89.4Confident86.2Confident192 Ų19279 Ų7984%0.83541%0.408SS*.Hα-helixtrans-56.7-34.4174-67.6-176.3-179.3179.30112F9K5-F9 WeakPolarHBondContact O-CB 3.24Å; K5-F9 PolarHBondContact O-N 3.33Å
6Y89.4Confident86.6Confident110 Ų11078.9 Ų78.943%0.43141%0.412SS..Hα-helixtrans-69.1-46.2177.3-179.3-117000112T4 L8 F9 L10 E287T4-Y6 PolarHBondContact O-N 2.93Å; Y6-L8 VanDerWaalsContact C-N 3.34Å; Y6-L8 PolarHBondContact O-N 3.46Å; Y6-F9 WeakPolarHBondContact O-CB 3.25Å; Y6-F9 PolarHBondContact O-N 2.81Å; Y6-L10 HydrophobicContact CD1-CD1 4.03Å; Y6-L10 HydrophobicContact CE1-CD1 3.54Å; Y6-L10 HydrophobicContact CE1-CG 4.26Å; Y6-L10 HydrophobicContact CE2-CD1 4.32Å; Y6-L10 HydrophobicContact CE2-CD2 4.23Å; Y6-L10 HydrophobicContact CE2-CG 4.17Å; Y6-L10 WeakPolarHBondContact O-CG 3.37Å; Y6-L10 PolarHBondContact O-N 3.36Å; Y6-E287 HydrophobicContact CD1-CG 4.47Å; Y6-E287 HydrophobicContact CE1-CG 4.01Å
7Q89.2Confident87Confident31 Ų3175 Ų7515%0.14539%0.392CS..Hα-helixtrans-59.9-42.1175.1-76.2168.1-18.800112.3W3 T4 L10 A11 E287 I288W3-Q7 HydrophobicContact CB-CB 4.27Å; T4-Q7 PolarHBondContact O-N 3.18Å; T4-Q7 WeakPolarHBondContact OG1-CB 3.36Å; T4-Q7 VanDerWaalsContact OG1-CG 3.31Å; T4-Q7 WeakPolarHBondContact OG1-CG 3.38Å; T4-Q7 PolarHBondContact OG1-N 3.33Å; T4-Q7 VanDerWaalsContact OG1-N 3.12Å; T4-Q7 PolarHBondContact OG1-OE1 3.47Å; Q7-L10 PolarHBondContact O-N 2.88Å; Q7-A11 WeakPolarHBondContact O-CB 3.44Å; Q7-A11 PolarHBondContact O-N 2.98Å; Q7-E287 HydrophobicContact CG-CB 4.29Å; Q7-E287 PolarHBondContact NE2-O 3.35Å; Q7-E287 VanDerWaalsContact NE2-O 3.16Å; Q7-I288 HydrophobicContact CB-CD1 4.04Å; Q7-I288 HydrophobicContact CG-CD1 4Å; Q7-I288 HydrophobicContact CG-CG1 3.95Å
8L89.2Confident87.1Confident100 Ų10070.8 Ų70.852%0.52437%0.371SS..Hα-helixtrans-63.9-40.9174.6-76.2165.8000112.3W3 T4 Y6 A11 G12W3-L8 HydrophobicContact CB-CD2 4.37Å; W3-L8 HydrophobicContact CB-CG 3.99Å; W3-L8 HydrophobicContact CE3-CD2 3.72Å; W3-L8 HydrophobicContact CE3-CG 4.22Å; W3-L8 HydrophobicContact CZ3-CD2 4.45Å; T4-L8 PolarHBondContact O-N 3.18Å; Y6-L8 VanDerWaalsContact C-N 3.34Å; Y6-L8 PolarHBondContact O-N 3.46Å; L8-A11 PolarHBondContact O-N 3.31Å; L8-G12 PolarHBondContact O-N 2.89Å
9F93.9Very high87.2Confident127 Ų12767.4 Ų67.456%0.55735%0.353SS*.Hα-helixtrans-61.5-46.9175170.9-98.9000111.6K5 Y6 A11 G12 L13K5-F9 WeakPolarHBondContact O-CB 3.24Å; K5-F9 PolarHBondContact O-N 3.33Å; Y6-F9 WeakPolarHBondContact O-CB 3.25Å; Y6-F9 PolarHBondContact O-N 2.81Å; F9-A11 VanDerWaalsContact C-N 3.34Å; F9-A11 PolarHBondContact O-N 3.4Å; F9-G12 PolarHBondContact O-N 3.25Å; F9-L13 HydrophobicContact CE1-CD2 4.25Å; F9-L13 HydrophobicContact CZ-CD2 4.4Å; F9-L13 WeakPolarHBondContact O-CB 3.36Å; F9-L13 PolarHBondContact O-N 2.93Å
10L92.9Very high87.4Confident1 Ų168.4 Ų68.41%0.00536%0.358CS..Hα-helixtrans-61-42.7176.9-70.1177000111.9Y6 Q7 L13 M14 V284 E287Y6-L10 HydrophobicContact CD1-CD1 4.03Å; Y6-L10 HydrophobicContact CE1-CD1 3.54Å; Y6-L10 HydrophobicContact CE1-CG 4.26Å; Y6-L10 HydrophobicContact CE2-CD1 4.32Å; Y6-L10 HydrophobicContact CE2-CD2 4.23Å; Y6-L10 HydrophobicContact CE2-CG 4.17Å; Y6-L10 WeakPolarHBondContact O-CG 3.37Å; Y6-L10 PolarHBondContact O-N 3.36Å; Q7-L10 PolarHBondContact O-N 2.88Å; L10-L13 PolarHBondContact O-N 3.37Å; L10-M14 WeakPolarHBondContact O-CB 3.32Å; L10-M14 PolarHBondContact O-N 2.91Å; L10-V284 HydrophobicContact CB-CG2 3.87Å; L10-E287 HydrophobicContact CD1-CG 4.17Å
11A90.3Very high87.5Confident8 Ų865.6 Ų65.67%0.06634%0.343CS..Hα-helixtrans-62.7-44.1177.100000112.3W3 Q7 L8 F9 L15 L296W3-A11 HydrophobicContact CZ3-CB 3.75Å; Q7-A11 WeakPolarHBondContact O-CB 3.44Å; Q7-A11 PolarHBondContact O-N 2.98Å; L8-A11 PolarHBondContact O-N 3.31Å; F9-A11 VanDerWaalsContact C-N 3.34Å; F9-A11 PolarHBondContact O-N 3.4Å; A11-L15 WeakPolarHBondContact O-CB 3.21Å; A11-L15 PolarHBondContact O-N 3.46Å; A11-L296 HydrophobicContact CB-CD1 3.7Å; A11-L296 HydrophobicContact CB-CD2 3.84Å; A11-L296 HydrophobicContact CB-CG 4.45Å
12G92.4Very high89.3Confident33 Ų3355.4 Ų55.434%0.3430%0.295SS..Hα-helixtrans-65.5-40.2175.400000112.8L8 F9 L15 T16L8-G12 PolarHBondContact O-N 2.89Å; F9-G12 PolarHBondContact O-N 3.25Å; G12-L15 PolarHBondContact O-N 3.11Å; G12-T16 WeakPolarHBondContact O-CB 3.3Å; G12-T16 VanDerWaalsContact O-CG2 3.31Å; G12-T16 WeakPolarHBondContact O-CG2 3.22Å; G12-T16 PolarHBondContact O-N 3.17Å; G12-T16 PolarHBondContact O-OG1 3.24Å
13L94.8Very high90Very high33 Ų3352.1 Ų52.117%0.17326%0.263CS..Hα-helixtrans-62.5-48.2175.8-178.564.2000111F9 L10 L15 T16 T17 A280F9-L13 HydrophobicContact CE1-CD2 4.25Å; F9-L13 HydrophobicContact CZ-CD2 4.4Å; F9-L13 WeakPolarHBondContact O-CB 3.36Å; F9-L13 PolarHBondContact O-N 2.93Å; L10-L13 PolarHBondContact O-N 3.37Å; L13-L15 PolarHBondContact O-N 3.08Å; L13-T16 PolarHBondContact O-N 3.43Å; L13-T16 PolarHBondContact O-OG1 3.47Å; L13-T16 VanDerWaalsContact O-OG1 3.1Å; L13-T17 HydrophobicContact CD1-CG2 3.7Å; L13-T17 HydrophobicContact CG-CG2 4.4Å; L13-T17 WeakPolarHBondContact O-CB 3.36Å; L13-T17 WeakPolarHBondContact O-CG2 3.36Å; L13-T17 PolarHBondContact O-N 2.91Å; L13-T17 PolarHBondContact O-OG1 3.39Å; L13-A280 HydrophobicContact CB-CB 4.3Å; L13-A280 HydrophobicContact CD2-CB 4.03Å; L13-A280 HydrophobicContact CG-CB 4.08Å
14M93.1Very high90.5Very high1 Ų148.6 Ų48.61%0.00525%0.252CS..Hα-helixtrans-59.2-46.8176.7-176.1-176.8167.700111.3L10 G18 F277 A280 R293 L296 D297L10-M14 WeakPolarHBondContact O-CB 3.32Å; L10-M14 PolarHBondContact O-N 2.91Å; M14-G18 WeakPolarHBondContact O-CA 3.41Å; M14-G18 PolarHBondContact O-N 2.89Å; M14-F277 HydrophobicContact CE-CE2 3.62Å; M14-F277 HydrophobicContact CE-CZ 3.8Å; M14-F277 HydrophobicContact CG-CD2 3.81Å; M14-F277 HydrophobicContact CG-CE2 3.66Å; M14-F277 WeakPolarHBondContact O-CD2 3.32Å; M14-A280 HydrophobicContact CB-CB 3.79Å; M14-R293 HydrophobicContact CE-CG 3.56Å; M14-R293 WeakPolarHBondContact CE-O 3.24Å; M14-R293 HydrophobicContact SD-CG 3.95Å; M14-L296 HydrophobicContact CE-CB 4.18Å; M14-L296 HydrophobicContact SD-CB 3.86Å; M14-L296 HydrophobicContact SD-CD1 3.88Å; M14-D297 HydrophobicContact CE-CB 4.31Å
15L91.7Very high90.4Very high47 Ų4746 Ų4625%0.24624%0.238CC..Hα-helixtrans-62.1-50.6-179.3-176.265.4000111.7A11 G12 L13 S19 L299 R300 V303A11-L15 WeakPolarHBondContact O-CB 3.21Å; A11-L15 PolarHBondContact O-N 3.46Å; G12-L15 PolarHBondContact O-N 3.11Å; L13-L15 PolarHBondContact O-N 3.08Å; L15-S19 WeakPolarHBondContact O-CB 3.39Å; L15-S19 PolarHBondContact O-N 3.29Å; L15-S19 PolarHBondContact O-OG 3.21Å; L15-L299 HydrophobicContact CD1-CB 3.99Å; L15-R300 VanDerWaalsContact CD1-CA 3.4Å; L15-R300 HydrophobicContact CD1-CB 3.88Å; L15-R300 VanDerWaalsContact CD1-N 3.31Å; L15-V303 HydrophobicContact CD1-CG2 4.05Å; L15-V303 HydrophobicContact CD2-CG2 4.37Å; L15-V303 HydrophobicContact CG-CG2 4.32Å
16T92.9Very high90.2Very high77 Ų7738.9 Ų38.947%0.47221%0.207SC..Hα-helixtrans-66.3-51.6-176.750.50000112.1G12 L13 G18 S19 I20G12-T16 WeakPolarHBondContact O-CB 3.3Å; G12-T16 VanDerWaalsContact O-CG2 3.31Å; G12-T16 WeakPolarHBondContact O-CG2 3.22Å; G12-T16 PolarHBondContact O-N 3.17Å; G12-T16 PolarHBondContact O-OG1 3.24Å; L13-T16 PolarHBondContact O-N 3.43Å; L13-T16 PolarHBondContact O-OG1 3.47Å; L13-T16 VanDerWaalsContact O-OG1 3.1Å; T16-G18 VanDerWaalsContact C-N 3.33Å; T16-G18 PolarHBondContact O-N 3.14Å; T16-S19 PolarHBondContact O-N 2.9Å; T16-I20 VanDerWaalsContact O-CG1 3.3Å; T16-I20 WeakPolarHBondContact O-CG1 3.29Å; T16-I20 PolarHBondContact O-N 3.28Å
17T93.4Very high90Very high13 Ų1338 Ų388%0.0820%0.203CC..Hα-helixtrans-68-35.9-178.757.80000111.6L13 I20 N21 S273 F276 F277L13-T17 HydrophobicContact CD1-CG2 3.7Å; L13-T17 HydrophobicContact CG-CG2 4.4Å; L13-T17 WeakPolarHBondContact O-CB 3.36Å; L13-T17 WeakPolarHBondContact O-CG2 3.36Å; L13-T17 PolarHBondContact O-N 2.91Å; L13-T17 PolarHBondContact O-OG1 3.39Å; T17-I20 PolarHBondContact O-N 2.98Å; T17-N21 WeakPolarHBondContact O-CB 3.38Å; T17-N21 PolarHBondContact O-N 3.42Å; T17-S273 WeakPolarHBondContact O-CB 3.34Å; T17-F276 HydrophobicContact CG2-CB 3.67Å; T17-F276 HydrophobicContact CG2-CG 4.42Å; T17-F277 WeakPolarHBondContact OG1-CA 3.11Å; T17-F277 PolarHBondContact OG1-N 3.36Å
18G88.8Confident89.9Confident0 Ų036.5 Ų36.50%020%0.196CC..Hα-helixtrans-62.9-41.6172.500000113M14 T16 N21 T22 R300M14-G18 WeakPolarHBondContact O-CA 3.41Å; M14-G18 PolarHBondContact O-N 2.89Å; T16-G18 VanDerWaalsContact C-N 3.33Å; T16-G18 PolarHBondContact O-N 3.14Å; G18-N21 WeakPolarHBondContact O-CB 3.41Å; G18-N21 PolarHBondContact O-N 3.19Å; G18-T22 PolarHBondContact O-N 3.07Å; G18-R300 VanDerWaalsContact CA-CD 3.48Å; G18-R300 WeakPolarHBondContact O-CD 3.33Å
19S89.6Confident89.8Confident6 Ų635.1 Ų35.14%0.04219%0.189CC..Hα-helixtrans-65.7-43.1175.6-65.10000111.6L15 T16 N21 T22 L23 V303L15-S19 WeakPolarHBondContact O-CB 3.39Å; L15-S19 PolarHBondContact O-N 3.29Å; L15-S19 PolarHBondContact O-OG 3.21Å; T16-S19 PolarHBondContact O-N 2.9Å; S19-N21 VanDerWaalsContact C-N 3.29Å; S19-N21 PolarHBondContact O-N 3.26Å; S19-T22 PolarHBondContact O-N 3.44Å; S19-L23 WeakPolarHBondContact O-CB 3.14Å; S19-L23 VanDerWaalsContact O-CG 3.23Å; S19-L23 WeakPolarHBondContact O-CG 3.28Å; S19-L23 PolarHBondContact O-N 3.15Å; S19-V303 WeakPolarHBondContact OG-CB 3.47Å; S19-V303 WeakPolarHBondContact OG-CG1 3.22Å
20I91.1Very high89.3Confident87 Ų8733.9 Ų33.945%0.44619%0.186SC..Hα-helixtrans-59.6-41.4175.4-66168.5000110.8T16 T17 L23 S24T16-I20 VanDerWaalsContact O-CG1 3.3Å; T16-I20 WeakPolarHBondContact O-CG1 3.29Å; T16-I20 PolarHBondContact O-N 3.28Å; T17-I20 PolarHBondContact O-N 2.98Å; I20-L23 PolarHBondContact O-N 3.22Å; I20-S24 WeakPolarHBondContact O-CB 3.41Å; I20-S24 PolarHBondContact O-N 3.08Å; I20-S24 PolarHBondContact O-OG 3.48Å
21N90.1Very high89.1Confident9 Ų935.4 Ų35.45%0.04819%0.193CC..Hα-helixtrans-55.7-57.8177.3-177.880.7000111.7T17 G18 S19 L23 S24 A25 N270 S273 I274T17-N21 WeakPolarHBondContact O-CB 3.38Å; T17-N21 PolarHBondContact O-N 3.42Å; G18-N21 WeakPolarHBondContact O-CB 3.41Å; G18-N21 PolarHBondContact O-N 3.19Å; S19-N21 VanDerWaalsContact C-N 3.29Å; S19-N21 PolarHBondContact O-N 3.26Å; N21-L23 PolarHBondContact O-N 3.13Å; N21-S24 PolarHBondContact O-N 3.47Å; N21-A25 PolarHBondContact O-N 3.48Å; N21-N270 VanDerWaalsContact CG-OD1 3.32Å; N21-N270 PolarHBondContact O-OD1 3.45Å; N21-N270 PolarHBondContact OD1-O 3.47Å; N21-N270 PolarHBondContact OD1-OD1 2.87Å; N21-S273 WeakPolarHBondContact CA-OG 3.38Å; N21-S273 WeakPolarHBondContact CB-OG 3.25Å; N21-S273 PolarHBondContact N-OG 3.5Å; N21-S273 PolarHBondContact OD1-OG 3.33Å; N21-I274 WeakPolarHBondContact OD1-CB 3.38Å
22T85.1Confident89Confident27 Ų2737 Ų3717%0.16620%0.204CC..Hα-helixtrans-65.6-38.1-178.2-56.40000112.6G18 S19 K26 I304G18-T22 PolarHBondContact O-N 3.07Å; S19-T22 PolarHBondContact O-N 3.44Å; T22-K26 WeakPolarHBondContact O-CB 3.49Å; T22-K26 PolarHBondContact O-N 3.44Å; T22-I304 VanDerWaalsContact CB-CD1 3.46Å; T22-I304 HydrophobicContact CG2-CD1 3.73Å; T22-I304 HydrophobicContact CG2-CG1 4.4Å; T22-I304 HydrophobicContact CG2-CG2 4.13Å
23L85.9Confident88.8Confident32 Ų3235.8 Ų35.817%0.16819%0.19CC..Hα-helixtrans-66.6-37.6176.5-69.1169.8000111.9S19 I20 N21 W27 I304 V307 W313S19-L23 WeakPolarHBondContact O-CB 3.14Å; S19-L23 VanDerWaalsContact O-CG 3.23Å; S19-L23 WeakPolarHBondContact O-CG 3.28Å; S19-L23 PolarHBondContact O-N 3.15Å; I20-L23 PolarHBondContact O-N 3.22Å; N21-L23 PolarHBondContact O-N 3.13Å; L23-W27 VanDerWaalsContact O-CB 3.26Å; L23-W27 WeakPolarHBondContact O-CB 3.21Å; L23-W27 PolarHBondContact O-N 3.23Å; L23-I304 HydrophobicContact CD2-CG2 4.4Å; L23-V307 HydrophobicContact CD1-CB 4.27Å; L23-V307 HydrophobicContact CD1-CG1 3.77Å; L23-V307 HydrophobicContact CD2-CB 4.35Å; L23-V307 HydrophobicContact CD2-CG1 3.89Å; L23-W313 HydrophobicContact CD2-CE3 4.42Å; L23-W313 HydrophobicContact CD2-CZ3 3.83Å
24S89Confident88.4Confident16 Ų1638.7 Ų38.711%0.11220%0.201CC..Hα-helixtrans-69.9-40.7177.8-570000111.7I20 N21 W27 A28I20-S24 WeakPolarHBondContact O-CB 3.41Å; I20-S24 PolarHBondContact O-N 3.08Å; I20-S24 PolarHBondContact O-OG 3.48Å; N21-S24 PolarHBondContact O-N 3.47Å; S24-W27 PolarHBondContact O-N 2.94Å; S24-A28 PolarHBondContact O-N 2.99Å
25A86.2Confident88Confident17 Ų1738.8 Ų38.814%0.1420%0.203CC..Hα-helixtrans-60.7-49.8172.800000111.2N21 W27 A28 D29N21-A25 PolarHBondContact O-N 3.48Å; A25-W27 VanDerWaalsContact C-N 3.27Å; A25-W27 PolarHBondContact O-N 3.36Å; A25-A28 WeakPolarHBondContact O-CA 3.5Å; A25-A28 VanDerWaalsContact O-CB 3.32Å; A25-A28 WeakPolarHBondContact O-CB 3.42Å; A25-A28 PolarHBondContact O-N 2.85Å; A25-D29 PolarHBondContact O-N 3.09Å
26K84.3Confident87.6Confident41 Ų4138.1 Ų38.118%0.17820%0.201CC..Hα-helixtrans-59.4-38.6175.3-175.4167.7179.8176.40112T22 A28 D29 M30 W313 E314T22-K26 WeakPolarHBondContact O-CB 3.49Å; T22-K26 PolarHBondContact O-N 3.44Å; K26-A28 VanDerWaalsContact C-N 3.34Å; K26-D29 PolarHBondContact O-N 3.45Å; K26-M30 VanDerWaalsContact O-CG 3.32Å; K26-M30 WeakPolarHBondContact O-CG 3.1Å; K26-M30 PolarHBondContact O-N 2.99Å; K26-W313 HydrophobicContact CB-CZ3 4.38Å; K26-W313 HydrophobicContact CD-CE3 3.65Å; K26-W313 HydrophobicContact CD-CZ3 4.03Å; K26-W313 HydrophobicContact CG-CE3 4.09Å; K26-W313 HydrophobicContact CG-CZ3 4.11Å; K26-E314 IonicContact NZ-OE1 3.66Å; K26-E314 PolarHBondContact NZ-OE1 3.08Å; K26-E314 VanDerWaalsContact NZ-OE1 3.17Å
27W86.3Confident86.8Confident92 Ų9244.2 Ų44.235%0.34822%0.221SC..Hα-helixtrans-66.6-36.5176.2-169.835.5000112.2L23 S24 A25 M30 F31 M262 L265 A266 W313L23-W27 VanDerWaalsContact O-CB 3.26Å; L23-W27 WeakPolarHBondContact O-CB 3.21Å; L23-W27 PolarHBondContact O-N 3.23Å; S24-W27 PolarHBondContact O-N 2.94Å; A25-W27 VanDerWaalsContact C-N 3.27Å; A25-W27 PolarHBondContact O-N 3.36Å; W27-M30 PolarHBondContact O-N 3.31Å; W27-F31 HydrophobicContact CD2-CE2 4.02Å; W27-F31 HydrophobicContact CD2-CZ 4.18Å; W27-F31 AromaticContact CE2-CE2 3.85Å; W27-F31 AromaticContact CE2-CZ 3.52Å; W27-F31 HydrophobicContact CG-CE2 4.18Å; W27-F31 HydrophobicContact CZ2-CE2 4.35Å; W27-F31 AromaticContact CZ2-CZ 3.76Å; W27-F31 HydrophobicContact CZ2-CZ 3.76Å; W27-F31 AromaticContact NE1-CE2 3.85Å; W27-F31 AromaticContact NE1-CZ 3.44Å; W27-F31 WeakPolarHBondContact O-CD2 3.28Å; W27-F31 WeakPolarHBondContact O-CE2 3.45Å; W27-M262 HydrophobicContact CH2-CE 4.25Å; W27-M262 HydrophobicContact CZ2-CE 4.17Å; W27-L265 HydrophobicContact CH2-CD2 4.3Å; W27-A266 HydrophobicContact CD2-CB 4.42Å; W27-A266 HydrophobicContact CE3-CB 3.88Å; W27-A266 HydrophobicContact CZ3-CB 4.42Å; W27-W313 HydrophobicContact CB-CH2 4.32Å
28A87.4Confident85.6Confident0 Ų049.9 Ų49.90%025%0.251CS..Hα-helixtrans-60.9-48172.400000111.2S24 A25 K26 M30 F31 F44 A266 L267S24-A28 PolarHBondContact O-N 2.99Å; A25-A28 WeakPolarHBondContact O-CA 3.5Å; A25-A28 VanDerWaalsContact O-CB 3.32Å; A25-A28 WeakPolarHBondContact O-CB 3.42Å; A25-A28 PolarHBondContact O-N 2.85Å; K26-A28 VanDerWaalsContact C-N 3.34Å; A28-M30 PolarHBondContact O-N 3.22Å; A28-F31 PolarHBondContact O-N 2.94Å; A28-F31 VanDerWaalsContact O-N 3.12Å; A28-F44 HydrophobicContact CB-CD1 4.3Å; A28-F44 WeakPolarHBondContact O-CB 3.48Å; A28-A266 HydrophobicContact CB-CB 3.85Å; A28-L267 HydrophobicContact CB-CD2 4.39Å
29D85.7Confident84.9Confident70 Ų7050.8 Ų50.837%0.37426%0.257SS..Hα-helixtrans-61.7-28.2-179.3-64.8-25.6000113.6A25 K26 F31 Q50A25-D29 PolarHBondContact O-N 3.09Å; K26-D29 PolarHBondContact O-N 3.45Å; D29-F31 VanDerWaalsContact C-N 3.33Å; D29-Q50 PolarHBondContact OD1-NE2 3.17Å
30M85.4Confident84.5Confident101 Ų10155.1 Ų55.150%0.49829%0.285SS..THydrogen-bonded Turntrans-77.5-16.5179.4-72.8-179.770.400113.5K26 W27 A28 W313K26-M30 VanDerWaalsContact O-CG 3.32Å; K26-M30 WeakPolarHBondContact O-CG 3.1Å; K26-M30 PolarHBondContact O-N 2.99Å; W27-M30 PolarHBondContact O-N 3.31Å; A28-M30 PolarHBondContact O-N 3.22Å; M30-W313 HydrophobicContact SD-CD2 4.04Å; M30-W313 HydrophobicContact SD-CG 4.34Å; M30-W313 HydrophobicContact SD-CZ2 4.03Å
31F88.6Confident84.3Confident34 Ų3457.8 Ų57.815%0.14930%0.296CS..  trans-72.6141.3175.5-72-63.4000110.6W27 A28 D29 T43 F44 M262 I263 A266W27-F31 HydrophobicContact CD2-CE2 4.02Å; W27-F31 HydrophobicContact CD2-CZ 4.18Å; W27-F31 AromaticContact CE2-CE2 3.85Å; W27-F31 AromaticContact CE2-CZ 3.52Å; W27-F31 HydrophobicContact CG-CE2 4.18Å; W27-F31 HydrophobicContact CZ2-CE2 4.35Å; W27-F31 AromaticContact CZ2-CZ 3.76Å; W27-F31 HydrophobicContact CZ2-CZ 3.76Å; W27-F31 AromaticContact NE1-CE2 3.85Å; W27-F31 AromaticContact NE1-CZ 3.44Å; W27-F31 WeakPolarHBondContact O-CD2 3.28Å; W27-F31 WeakPolarHBondContact O-CE2 3.45Å; A28-F31 PolarHBondContact O-N 2.94Å; A28-F31 VanDerWaalsContact O-N 3.12Å; D29-F31 VanDerWaalsContact C-N 3.33Å; F31-T43 WeakPolarHBondContact O-CA 3.31Å; F31-F44 PolarHBondContact O-N 2.83Å; F31-M262 HydrophobicContact CE1-CB 3.93Å; F31-M262 HydrophobicContact CE2-CB 4.26Å; F31-M262 HydrophobicContact CZ-CB 3.74Å; F31-I263 HydrophobicContact CB-CD1 4.12Å; F31-I263 HydrophobicContact CB-CG1 3.73Å; F31-I263 HydrophobicContact CD2-CG1 4.02Å; F31-I263 HydrophobicContact CG-CG1 4.02Å; F31-A266 HydrophobicContact CE2-CB 4.17Å
32S87.4Confident84.1Confident42 Ų4258.6 Ų58.629%0.29430%0.299SS..EExtended strand (participates in β ladder)trans-114141.4168.7-60.60000109H42S32-H42 VanDerWaalsContact CA-O 3.32Å; S32-H42 WeakPolarHBondContact CA-O 3.34Å
33A87.8Confident84.2Confident6 Ų660.3 Ų60.35%0.0531%0.31CS..EExtended strand (participates in β ladder)trans-152.2156.817800000110.1G35 H42 Q256 N260 I263A33-G35 PolarHBondContact O-N 2.98Å; A33-H42 PolarHBondContact N-O 3.26Å; A33-H42 VanDerWaalsContact N-O 3.16Å; A33-H42 PolarHBondContact O-N 2.92Å; A33-Q256 HydrophobicContact CB-CB 3.92Å; A33-Q256 HydrophobicContact CB-CG 4.03Å; A33-Q256 PolarHBondContact O-NE2 3.42Å; A33-Q256 VanDerWaalsContact O-NE2 3.16Å; A33-N260 HydrophobicContact CB-CB 4.05Å; A33-I263 HydrophobicContact CB-CD1 4.16Å
34K87.4Confident84.3Confident95 Ų9558.9 Ų58.941%0.41330%0.302SS..EExtended strand (participates in β ladder)trans-65.6129.6173-166178.2177.5-174.90109.4D38 S39 H259K34-D38 IonicContact NZ-OD1 3.62Å; K34-D38 PolarHBondContact NZ-OD1 2.81Å; K34-S39 WeakPolarHBondContact CG-O 3.26Å; K34-H259 PolarHBondContact O-ND1 3.04Å
35G83.1Confident84Confident3 Ų359 Ų593%0.03130%0.303CS..  trans-82.9-167.8176.900000113.2A33 S39 D252A33-G35 PolarHBondContact O-N 2.98Å; G35-S39 WeakPolarHBondContact CA-OG 3.43Å; G35-S39 PolarHBondContact N-OG 2.98Å; G35-D252 WeakPolarHBondContact CA-OD1 3.14Å
36C83.8Confident84.1Confident32 Ų3258.2 Ų58.222%0.21630%0.297CS..SBendtrans-73.6153.4177.8-64.50000112.3D38 S39 L251 D252 C255C36-D38 PolarHBondContact O-N 2.92Å; C36-S39 PolarHBondContact N-OG 3.28Å; C36-S39 WeakPolarHBondContact O-CB 3.28Å; C36-S39 PolarHBondContact O-N 3.26Å; C36-S39 PolarHBondContact O-OG 2.92Å; C36-S39 VanDerWaalsContact O-OG 3.12Å; C36-L251 VanDerWaalsContact SG-C 3.59Å; C36-L251 PolarHBondContact SG-O 3.11Å; C36-D252 PolarHBondContact N-OD1 3.23Å; C36-C255 WeakPolarHBondContact CA-SG 3.26Å; C36-C255 HydrophobicContact CB-CB 3.98Å; C36-C255 WeakPolarHBondContact CB-SG 3.23Å; C36-C255 WeakPolarHBondContact SG-CB 3.4Å; C36-C255 CovalentContact SG-SG 2.03Å; C36-C255 PolarHBondContact SG-SG 3.37Å
37K75.6Confident84.2Confident206 Ų20657.2 Ų57.290%0.89629%0.294SS*.THydrogen-bonded Turntrans55.148.3170.7-58.6179.9-1791760114.6S39K37-S39 PolarHBondContact O-N 2.69Å; K37-S39 VanDerWaalsContact O-N 3.17Å
38D68.3Low84.4Confident132 Ų13253.2 Ų53.271%0.70628%0.279SS*.THydrogen-bonded Turntrans59.423.6177.9-63.7-51.9000115K34 C36K34-D38 IonicContact NZ-OD1 3.62Å; K34-D38 PolarHBondContact NZ-OD1 2.81Å; C36-D38 PolarHBondContact O-N 2.92Å
39S75.3Confident84.6Confident19 Ų1954 Ų5413%0.13328%0.284CS..PPolyproline II helixtrans-59.3144.8167.660.20000110.4K34 G35 C36 K37K34-S39 WeakPolarHBondContact CG-O 3.26Å; G35-S39 WeakPolarHBondContact CA-OG 3.43Å; G35-S39 PolarHBondContact N-OG 2.98Å; C36-S39 PolarHBondContact N-OG 3.28Å; C36-S39 WeakPolarHBondContact O-CB 3.28Å; C36-S39 PolarHBondContact O-N 3.26Å; C36-S39 PolarHBondContact O-OG 2.92Å; C36-S39 VanDerWaalsContact O-OG 3.12Å; K37-S39 PolarHBondContact O-N 2.69Å; K37-S39 VanDerWaalsContact O-N 3.17Å
40P81.7Confident84.8Confident97 Ų9750.8 Ų50.863%0.6327%0.267SS*.PPolyproline II helixtrans-61.3157.9177.726.7-34000110.7H42P40-H42 PolarHBondContact O-N 3.07Å; P40-H42 PolarHBondContact O-ND1 3.04Å
41E85.5Confident85.1Confident142 Ų14246.1 Ų46.166%0.66424%0.244SC*.EExtended strand (participates in β ladder)trans-58.9127.9171-175174177.600109.6
42H86.3Confident85.3Confident26 Ų2645.4 Ų45.412%0.1224%0.242CC..EExtended strand (participates in β ladder)trans-147.1166.7179.263.9-79.1000109.4S32 A33 P40 P243 D252 Q256S32-H42 VanDerWaalsContact CA-O 3.32Å; S32-H42 WeakPolarHBondContact CA-O 3.34Å; A33-H42 PolarHBondContact N-O 3.26Å; A33-H42 VanDerWaalsContact N-O 3.16Å; A33-H42 PolarHBondContact O-N 2.92Å; P40-H42 PolarHBondContact O-N 3.07Å; P40-H42 PolarHBondContact O-ND1 3.04Å; H42-P243 WeakPolarHBondContact NE2-CD 3.31Å; H42-D252 IonicContact CE1-OD1 2.88Å; H42-D252 IonicContact CE1-OD2 2.71Å; H42-D252 PolarHBondContact CE1-OD2 3.37Å; H42-D252 IonicContact NE2-OD2 2.75Å; H42-D252 PolarHBondContact NE2-OD2 3.3Å; H42-Q256 PolarHBondContact CD2-NE2 3.14Å; H42-Q256 PolarHBondContact CE1-NE2 3.09Å; H42-Q256 VanDerWaalsContact CE1-NE2 3.35Å; H42-Q256 PolarHBondContact NE2-NE2 3.47Å; H42-Q256 VanDerWaalsContact NE2-NE2 3.18Å; H42-Q256 PolarHBondContact O-NE2 3.08Å; H42-Q256 VanDerWaalsContact O-NE2 3.16Å
43T87.4Confident85.5Confident64 Ų6444.2 Ų44.239%0.39324%0.237SC..EExtended strand (participates in β ladder)trans-68.5151.7-177.750.60000111.5F31 S45F31-T43 WeakPolarHBondContact O-CA 3.31Å; T43-S45 VanDerWaalsContact C-N 3.28Å; T43-S45 PolarHBondContact O-N 3.26Å
44F87.3Confident85.8Confident1 Ų145.4 Ų45.40%0.00424%0.242CC..  trans-74.479.9176.6-173.8-97.8000110.4A28 F31 H46 Q50 A253 Q256 I257 I263 L267A28-F44 HydrophobicContact CB-CD1 4.3Å; A28-F44 WeakPolarHBondContact O-CB 3.48Å; F31-F44 PolarHBondContact O-N 2.83Å; F44-H46 AromaticContact CD2-CD2 3.84Å; F44-H46 HydrophobicContact CE1-CB 4.4Å; F44-H46 AromaticContact CE2-CD2 3.83Å; F44-H46 HydrophobicContact CZ-CB 4.21Å; F44-Q50 HydrophobicContact CE1-CG 4.01Å; F44-A253 HydrophobicContact CE2-CB 4.15Å; F44-A253 HydrophobicContact CZ-CB 4.47Å; F44-Q256 HydrophobicContact CD2-CB 4.09Å; F44-Q256 VanDerWaalsContact CD2-OE1 3.26Å; F44-Q256 HydrophobicContact CE2-CB 4.47Å; F44-I257 HydrophobicContact CE2-CD1 4.22Å; F44-I257 HydrophobicContact CE2-CG1 3.92Å; F44-I257 HydrophobicContact CZ-CD1 4.26Å; F44-I257 HydrophobicContact CZ-CG1 4.32Å; F44-I263 HydrophobicContact CB-CD1 4.47Å; F44-I263 HydrophobicContact CD1-CG2 4.28Å; F44-I263 HydrophobicContact CD2-CD1 3.97Å; F44-I263 HydrophobicContact CD2-CG2 3.94Å; F44-I263 HydrophobicContact CE1-CG2 4.17Å; F44-I263 HydrophobicContact CE2-CG2 3.84Å; F44-I263 HydrophobicContact CG-CD1 4.37Å; F44-I263 HydrophobicContact CG-CG2 4.18Å; F44-I263 HydrophobicContact CZ-CG2 3.96Å; F44-L267 HydrophobicContact CE1-CD2 4.13Å; F44-L267 HydrophobicContact CZ-CD1 4.19Å; F44-L267 HydrophobicContact CZ-CD2 4.43Å
45S84.3Confident86.1Confident19 Ų1941.1 Ų41.113%0.13322%0.223CC..  trans-105.574.5-178.1-166.50000110.7T43T43-S45 VanDerWaalsContact C-N 3.28Å; T43-S45 PolarHBondContact O-N 3.26Å
46H88.2Confident86.7Confident1 Ų144.9 Ų44.91%0.00524%0.242CC..  trans-131.368.3-176.6-63.8-72.4000111.4F44 F48 V49 Q50 E248 D249 D252 A253 Q256F44-H46 AromaticContact CD2-CD2 3.84Å; F44-H46 HydrophobicContact CE1-CB 4.4Å; F44-H46 AromaticContact CE2-CD2 3.83Å; F44-H46 HydrophobicContact CZ-CB 4.21Å; H46-F48 PolarHBondContact O-N 3.48Å; H46-V49 HydrophobicContact CB-CB 4.11Å; H46-V49 HydrophobicContact CB-CG2 4.41Å; H46-V49 PolarHBondContact O-N 3.46Å; H46-Q50 WeakPolarHBondContact O-CG 3.39Å; H46-Q50 PolarHBondContact O-N 3.05Å; H46-Q50 VanDerWaalsContact O-N 3.07Å; H46-E248 WeakPolarHBondContact CA-OE1 3.43Å; H46-E248 VanDerWaalsContact CB-OE1 3.29Å; H46-E248 WeakPolarHBondContact CB-OE1 3.26Å; H46-D249 PolarHBondContact CE1-O 2.87Å; H46-D249 PolarHBondContact ND1-O 3.31Å; H46-D252 IonicContact CE1-OD2 3.89Å; H46-D252 IonicContact NE2-OD2 2.77Å; H46-D252 PolarHBondContact NE2-OD2 2.98Å; H46-A253 HydrophobicContact CB-CB 3.89Å; H46-A253 VanDerWaalsContact CG-CB 3.49Å; H46-Q256 PolarHBondContact CD2-OE1 2.97Å; H46-Q256 VanDerWaalsContact CD2-OE1 3.3Å; H46-Q256 PolarHBondContact NE2-OE1 3.19Å; H46-Q256 VanDerWaalsContact NE2-OE1 3.11Å
47P86.6Confident87.2Confident19 Ų1943.4 Ų43.412%0.12323%0.232CC..Hα-helixtrans-64.6-34.8-173.324.3-34.2000113.4Q50 A51 Y106 E248P47-Q50 PolarHBondContact O-N 2.99Å; P47-A51 WeakPolarHBondContact O-CB 3.32Å; P47-A51 PolarHBondContact O-N 3.24Å; P47-Y106 HydrophobicContact CB-CD1 3.38Å; P47-Y106 HydrophobicContact CB-CD2 3.99Å; P47-Y106 HydrophobicContact CB-CE1 3.74Å; P47-Y106 HydrophobicContact CB-CE2 4.3Å; P47-Y106 HydrophobicContact CB-CG 3.52Å; P47-Y106 HydrophobicContact CG-CG 4.44Å; P47-E248 WeakPolarHBondContact CD-OE2 3.38Å
48F89.5Confident88.1Confident8 Ų833.9 Ų33.94%0.03519%0.191CC..Hα-helixtrans-76.2-33.5-178.6-63.9-81.8000111.9H46 Q50 A51 V52 L224 L228 F231 L247 E248H46-F48 PolarHBondContact O-N 3.48Å; F48-Q50 VanDerWaalsContact C-N 3.35Å; F48-A51 PolarHBondContact O-N 3.42Å; F48-V52 WeakPolarHBondContact O-CG2 3.29Å; F48-V52 PolarHBondContact O-N 2.96Å; F48-L224 HydrophobicContact CD1-CD1 4.31Å; F48-L228 HydrophobicContact CB-CD2 3.64Å; F48-F231 HydrophobicContact CB-CD2 4.43Å; F48-F231 AromaticContact CD1-CD2 3.98Å; F48-F231 HydrophobicContact CD1-CD2 3.98Å; F48-F231 AromaticContact CD1-CE2 3.55Å; F48-F231 HydrophobicContact CD1-CE2 3.55Å; F48-F231 HydrophobicContact CD2-CD2 4.27Å; F48-F231 HydrophobicContact CE1-CD2 4.24Å; F48-F231 AromaticContact CE1-CE2 3.58Å; F48-F231 HydrophobicContact CE1-CE2 3.58Å; F48-F231 HydrophobicContact CE1-CZ 4.35Å; F48-F231 AromaticContact CG-CD2 3.97Å; F48-F231 HydrophobicContact CG-CD2 3.97Å; F48-F231 HydrophobicContact CG-CE2 4.04Å; F48-F231 HydrophobicContact CZ-CE2 4.12Å; F48-L247 HydrophobicContact CD2-CG 4.46Å; F48-L247 HydrophobicContact CE2-CD1 3.71Å; F48-L247 HydrophobicContact CE2-CD2 4.41Å; F48-L247 HydrophobicContact CE2-CG 3.73Å; F48-L247 HydrophobicContact CZ-CD1 4.05Å; F48-L247 HydrophobicContact CZ-CD2 4.41Å; F48-L247 HydrophobicContact CZ-CG 4.18Å; F48-E248 HydrophobicContact CB-CB 4.22Å; F48-E248 HydrophobicContact CB-CG 3.9Å; F48-E248 HydrophobicContact CD2-CB 3.98Å; F48-E248 HydrophobicContact CD2-CG 4.39Å; F48-E248 WeakPolarHBondContact CD2-OE2 3.42Å; F48-E248 HydrophobicContact CG-CB 4.48Å; F48-E248 PolarHBondContact N-OE1 3.05Å
49V91.5Very high89.4Confident16 Ų1629 Ų2910%0.09717%0.165CC..Hα-helixtrans-63.9-42.3169.3169.90000110.4H46 A51 V52 G53 L228 E248 A250 A253H46-V49 HydrophobicContact CB-CB 4.11Å; H46-V49 HydrophobicContact CB-CG2 4.41Å; H46-V49 PolarHBondContact O-N 3.46Å; V49-A51 VanDerWaalsContact C-N 3.32Å; V49-A51 PolarHBondContact O-N 3.22Å; V49-V52 PolarHBondContact O-N 2.6Å; V49-G53 PolarHBondContact O-N 3.25Å; V49-L228 HydrophobicContact CG2-CD1 4.38Å; V49-E248 WeakPolarHBondContact CB-OE1 3.31Å; V49-E248 HydrophobicContact CG2-CG 4.17Å; V49-E248 WeakPolarHBondContact CG2-OE1 3.48Å; V49-E248 PolarHBondContact N-OE1 2.9Å; V49-A250 HydrophobicContact CG2-CB 3.75Å; V49-A253 HydrophobicContact CB-CB 4.36Å; V49-A253 HydrophobicContact CG1-CB 4.15Å; V49-A253 HydrophobicContact CG2-CB 3.98Å
50Q90.7Very high90.3Very high4 Ų430.5 Ų30.52%0.01918%0.175CC..Hα-helixtrans-61.2-41.2173.7-73.2-176.748.100112.1D29 F44 H46 P47 F48 G53 M54 L267D29-Q50 PolarHBondContact OD1-NE2 3.17Å; F44-Q50 HydrophobicContact CE1-CG 4.01Å; H46-Q50 WeakPolarHBondContact O-CG 3.39Å; H46-Q50 PolarHBondContact O-N 3.05Å; H46-Q50 VanDerWaalsContact O-N 3.07Å; P47-Q50 PolarHBondContact O-N 2.99Å; F48-Q50 VanDerWaalsContact C-N 3.35Å; Q50-G53 CarbonylContact O-C 3.56Å; Q50-G53 WeakPolarHBondContact O-CA 3.44Å; Q50-G53 PolarHBondContact O-N 3.02Å; Q50-G53 VanDerWaalsContact O-N 3.1Å; Q50-M54 WeakPolarHBondContact O-CG 3.35Å; Q50-M54 PolarHBondContact O-N 3.12Å; Q50-L267 HydrophobicContact CG-CD2 3.8Å
51A90.4Very high90.9Very high2 Ų226.1 Ų26.12%0.01715%0.147CC..Hα-helixtrans-64.1-38.6175.800000112.8P47 F48 V49 G53 M54 F55 Y106 L224P47-A51 WeakPolarHBondContact O-CB 3.32Å; P47-A51 PolarHBondContact O-N 3.24Å; F48-A51 PolarHBondContact O-N 3.42Å; V49-A51 VanDerWaalsContact C-N 3.32Å; V49-A51 PolarHBondContact O-N 3.22Å; A51-G53 VanDerWaalsContact C-N 3.29Å; A51-G53 PolarHBondContact O-N 3.19Å; A51-M54 WeakPolarHBondContact O-CB 3.47Å; A51-M54 PolarHBondContact O-N 3.46Å; A51-M54 VanDerWaalsContact O-N 3.08Å; A51-F55 VanDerWaalsContact O-CD2 3.23Å; A51-F55 WeakPolarHBondContact O-CD2 3.41Å; A51-F55 PolarHBondContact O-N 3.22Å; A51-Y106 HydrophobicContact CB-CE2 3.92Å; A51-L224 HydrophobicContact CB-CD2 3.55Å
52V93Very high91.2Very high19 Ų1920.9 Ų20.912%0.11512%0.123CC..Hα-helixtrans-60.8-41.5170.3170.70000110.8F48 V49 M54 F55 L56 F221 L224 L228F48-V52 WeakPolarHBondContact O-CG2 3.29Å; F48-V52 PolarHBondContact O-N 2.96Å; V49-V52 PolarHBondContact O-N 2.6Å; V52-M54 VanDerWaalsContact C-N 3.26Å; V52-M54 PolarHBondContact O-N 3.02Å; V52-F55 PolarHBondContact O-N 3.21Å; V52-L56 WeakPolarHBondContact O-CB 3.32Å; V52-L56 PolarHBondContact O-N 2.86Å; V52-F221 HydrophobicContact CG1-CD2 3.84Å; V52-F221 HydrophobicContact CG1-CE2 3.61Å; V52-L224 HydrophobicContact CG2-CB 4.05Å; V52-L224 HydrophobicContact CG2-CD2 3.68Å; V52-L224 HydrophobicContact CG2-CG 3.67Å; V52-L228 HydrophobicContact CG2-CD1 3.77Å; V52-L228 HydrophobicContact CG2-CG 4.16Å
53G92.9Very high91.6Very high17 Ų1723.7 Ų23.718%0.17514%0.142CC..Hα-helixtrans-61.6-32.2172.500000113.5V49 Q50 A51 G57 T271V49-G53 PolarHBondContact O-N 3.25Å; Q50-G53 CarbonylContact O-C 3.56Å; Q50-G53 WeakPolarHBondContact O-CA 3.44Å; Q50-G53 PolarHBondContact O-N 3.02Å; Q50-G53 VanDerWaalsContact O-N 3.1Å; A51-G53 VanDerWaalsContact C-N 3.29Å; A51-G53 PolarHBondContact O-N 3.19Å; G53-G57 PolarHBondContact O-N 2.83Å; G53-T271 WeakPolarHBondContact O-CG2 3.28Å; G53-T271 PolarHBondContact O-OG1 3.33Å
54M92.6Very high91.8Very high31 Ų3123.4 Ų23.415%0.15314%0.14CC..Hα-helixtrans-69.7-49.6175-71.1170.86300111.6Q50 A51 V52 L56 G57 E58 N270 I274Q50-M54 WeakPolarHBondContact O-CG 3.35Å; Q50-M54 PolarHBondContact O-N 3.12Å; A51-M54 WeakPolarHBondContact O-CB 3.47Å; A51-M54 PolarHBondContact O-N 3.46Å; A51-M54 VanDerWaalsContact O-N 3.08Å; V52-M54 VanDerWaalsContact C-N 3.26Å; V52-M54 PolarHBondContact O-N 3.02Å; M54-L56 PolarHBondContact O-N 3.31Å; M54-G57 WeakPolarHBondContact O-CA 3.41Å; M54-G57 PolarHBondContact O-N 3.36Å; M54-E58 PolarHBondContact O-N 2.69Å; M54-E58 VanDerWaalsContact O-N 3.1Å; M54-N270 WeakPolarHBondContact CG-ND2 3.32Å; M54-I274 HydrophobicContact CB-CG1 4.17Å; M54-I274 HydrophobicContact CB-CG2 4.35Å; M54-I274 HydrophobicContact CE-CD1 3.69Å; M54-I274 HydrophobicContact CE-CG1 4Å; M54-I274 HydrophobicContact CG-CG1 4.35Å; M54-I274 WeakPolarHBondContact O-CG2 3.23Å
55F94.1Very high92Very high6 Ų623.5 Ų23.53%0.02614%0.14CC..Hα-helixtrans-63.1-30.8175.8-74.3-59.8000112.9A51 V52 G57 E58 L59 D98 M99 F221 L224A51-F55 VanDerWaalsContact O-CD2 3.23Å; A51-F55 WeakPolarHBondContact O-CD2 3.41Å; A51-F55 PolarHBondContact O-N 3.22Å; V52-F55 PolarHBondContact O-N 3.21Å; F55-G57 VanDerWaalsContact C-N 3.29Å; F55-G57 PolarHBondContact O-N 3.04Å; F55-E58 WeakPolarHBondContact CD1-OE2 3.13Å; F55-E58 PolarHBondContact O-N 3.02Å; F55-L59 WeakPolarHBondContact O-CB 3.08Å; F55-L59 PolarHBondContact O-N 3.3Å; F55-D98 WeakPolarHBondContact CE1-OD2 3.25Å; F55-D98 WeakPolarHBondContact CZ-OD2 3.42Å; F55-M99 HydrophobicContact CE1-CG 4.3Å; F55-M99 HydrophobicContact CE2-CG 3.64Å; F55-M99 HydrophobicContact CZ-CB 4.37Å; F55-M99 HydrophobicContact CZ-CG 3.39Å; F55-F221 HydrophobicContact CB-CB 3.96Å; F55-L224 HydrophobicContact CD2-CB 4.44Å; F55-L224 HydrophobicContact CD2-CD2 3.82Å; F55-L224 HydrophobicContact CE2-CD2 3.85Å
56L95Very high92.2Very high82 Ų8227.6 Ų27.643%0.42916%0.157SC..Hα-helixtrans-62-39.1170.7-179.163.1000111.7V52 M54 L59 S60 F221V52-L56 WeakPolarHBondContact O-CB 3.32Å; V52-L56 PolarHBondContact O-N 2.86Å; M54-L56 PolarHBondContact O-N 3.31Å; L56-L59 HydrophobicContact CD1-CD2 4.44Å; L56-L59 PolarHBondContact O-N 3.41Å; L56-S60 PolarHBondContact O-N 2.9Å; L56-F221 HydrophobicContact CB-CD2 3.98Å; L56-F221 HydrophobicContact CB-CE2 4.03Å; L56-F221 HydrophobicContact CD1-CD2 4.37Å; L56-F221 HydrophobicContact CD1-CE2 4.02Å; L56-F221 HydrophobicContact CD1-CZ 4.42Å; L56-F221 HydrophobicContact CG-CE2 4.49Å
57G94.4Very high92.3Very high0 Ų033 Ų330%018%0.184CC..Hα-helixtrans-61.9-46.2173.900000111.6G53 M54 F55 S60 T271 A275G53-G57 PolarHBondContact O-N 2.83Å; M54-G57 WeakPolarHBondContact O-CA 3.41Å; M54-G57 PolarHBondContact O-N 3.36Å; F55-G57 VanDerWaalsContact C-N 3.29Å; F55-G57 PolarHBondContact O-N 3.04Å; G57-S60 WeakPolarHBondContact O-CB 3.3Å; G57-S60 PolarHBondContact O-N 3.36Å; G57-S60 PolarHBondContact O-OG 3.29Å; G57-T271 WeakPolarHBondContact CA-O 3.19Å; G57-A275 VanDerWaalsContact O-CB 3.31Å; G57-A275 WeakPolarHBondContact O-CB 3.47Å
58E94.5Very high92.4Very high6 Ų635.8 Ų35.83%0.02820%0.197CC..Hα-helixtrans-63.9-43.5175.6-67174.1-16700112.6M54 F55 S60 C61 V213 G214 N278M54-E58 PolarHBondContact O-N 2.69Å; M54-E58 VanDerWaalsContact O-N 3.1Å; F55-E58 WeakPolarHBondContact CD1-OE2 3.13Å; F55-E58 PolarHBondContact O-N 3.02Å; E58-S60 PolarHBondContact O-N 3.27Å; E58-C61 WeakPolarHBondContact O-CB 3.42Å; E58-C61 PolarHBondContact O-N 2.89Å; E58-V213 HydrophobicContact CB-CG1 3.82Å; E58-V213 HydrophobicContact CG-CG1 3.89Å; E58-G214 WeakPolarHBondContact O-CA 3.48Å; E58-N278 HydrophobicContact CG-CB 4.34Å; E58-N278 PolarHBondContact OE1-ND2 3.47Å
59L95.5Very high92.3Very high31 Ų3136.8 Ų36.816%0.16220%0.203CC..Hα-helixtrans-57.4-35.6174.5174.160.4000111.5F55 L56 C61 L62 F218 F221F55-L59 WeakPolarHBondContact O-CB 3.08Å; F55-L59 PolarHBondContact O-N 3.3Å; L56-L59 HydrophobicContact CD1-CD2 4.44Å; L56-L59 PolarHBondContact O-N 3.41Å; L59-C61 PolarHBondContact O-N 2.84Å; L59-L62 HydrophobicContact CD1-CD2 4.42Å; L59-L62 VanDerWaalsContact O-CB 3.26Å; L59-L62 WeakPolarHBondContact O-CB 3.2Å; L59-L62 PolarHBondContact O-N 3.16Å; L59-F218 HydrophobicContact CD1-CB 3.86Å; L59-F218 HydrophobicContact CD1-CD2 3.93Å; L59-F218 HydrophobicContact CD1-CG 4.41Å; L59-F221 HydrophobicContact CD2-CB 4.47Å; L59-F221 HydrophobicContact CD2-CD1 4.16Å; L59-F221 HydrophobicContact CD2-CG 4.29Å
60S95.2Very high92.1Very high50 Ų5039.4 Ų39.435%0.3522%0.221SC..Hα-helixtrans-60.9-27.2176.1860000112.8L56 G57 E58 L62 V63 V64L56-S60 PolarHBondContact O-N 2.9Å; G57-S60 WeakPolarHBondContact O-CB 3.3Å; G57-S60 PolarHBondContact O-N 3.36Å; G57-S60 PolarHBondContact O-OG 3.29Å; E58-S60 PolarHBondContact O-N 3.27Å; S60-L62 PolarHBondContact O-N 3.44Å; S60-V63 WeakPolarHBondContact O-CB 3.39Å; S60-V63 PolarHBondContact O-N 3.25Å; S60-V63 VanDerWaalsContact O-N 3.08Å; S60-V64 WeakPolarHBondContact O-CG2 3.35Å; S60-V64 PolarHBondContact O-N 3.47Å
61C93.7Very high92Very high5 Ų544 Ų443%0.03424%0.242CC..Hα-helixtrans-61.4-32.1173.3-650000112.1E58 L59 V64 F65 L210 V213E58-C61 WeakPolarHBondContact O-CB 3.42Å; E58-C61 PolarHBondContact O-N 2.89Å; L59-C61 PolarHBondContact O-N 2.84Å; C61-V64 PolarHBondContact O-N 3.48Å; C61-F65 VanDerWaalsContact O-CB 3.29Å; C61-F65 WeakPolarHBondContact O-CB 3.38Å; C61-F65 PolarHBondContact O-N 3.45Å; C61-L210 HydrophobicContact CB-CD2 4.06Å; C61-V213 HydrophobicContact CB-CB 4.39Å; C61-V213 HydrophobicContact CB-CG1 4.19Å
62L93Very high91.8Very high32 Ų3244.8 Ų44.817%0.16825%0.246CC..Hα-helixtrans-67.1-40.4174.6-165.661.3000111.2L59 S60 F65 H66 T215L59-L62 HydrophobicContact CD1-CD2 4.42Å; L59-L62 VanDerWaalsContact O-CB 3.26Å; L59-L62 WeakPolarHBondContact O-CB 3.2Å; L59-L62 PolarHBondContact O-N 3.16Å; S60-L62 PolarHBondContact O-N 3.44Å; L62-F65 WeakPolarHBondContact O-CB 3.5Å; L62-F65 PolarHBondContact O-N 3.12Å; L62-H66 PolarHBondContact O-CD2 3.18Å; L62-H66 PolarHBondContact O-N 2.83Å; L62-T215 HydrophobicContact CD1-CG2 4.49Å
63V92.8Very high91.4Very high84 Ų8454.2 Ų54.251%0.50928%0.28SS..Hα-helixtrans-63.6-47.5176.1-176.20000109.8S60 F65 H66 M67S60-V63 WeakPolarHBondContact O-CB 3.39Å; S60-V63 PolarHBondContact O-N 3.25Å; S60-V63 VanDerWaalsContact O-N 3.08Å; V63-F65 VanDerWaalsContact C-N 3.33Å; V63-F65 PolarHBondContact O-N 3.2Å; V63-H66 PolarHBondContact O-N 3.04Å; V63-M67 HydrophobicContact CG1-CE 4.1Å; V63-M67 WeakPolarHBondContact O-CG 3.45Å; V63-M67 PolarHBondContact O-N 2.86Å
64V92.6Very high91.1Very high58 Ų5863.5 Ų63.535%0.35231%0.309SS..Hα-helixtrans-60-43.4175.7176.10000111.2S60 C61 H66 M67 L68 L210S60-V64 WeakPolarHBondContact O-CG2 3.35Å; S60-V64 PolarHBondContact O-N 3.47Å; C61-V64 PolarHBondContact O-N 3.48Å; V64-H66 PolarHBondContact O-N 3.23Å; V64-M67 HydrophobicContact CB-CE 4.37Å; V64-M67 HydrophobicContact CG2-CE 3.94Å; V64-M67 PolarHBondContact O-N 3.12Å; V64-L68 HydrophobicContact CG1-CD1 4.09Å; V64-L68 HydrophobicContact CG1-CG 4.34Å; V64-L68 WeakPolarHBondContact O-CG 3.33Å; V64-L68 PolarHBondContact O-N 2.91Å; V64-L210 HydrophobicContact CG1-CD1 4.34Å
65F90.7Very high90.6Very high4 Ų468.2 Ų68.22%0.01833%0.326CS..Hα-helixtrans-57.5-49.1175.9179.5-106.9000111.7C61 L62 V63 M67 L68 L69 M80 H208 L210 R211C61-F65 VanDerWaalsContact O-CB 3.29Å; C61-F65 WeakPolarHBondContact O-CB 3.38Å; C61-F65 PolarHBondContact O-N 3.45Å; L62-F65 WeakPolarHBondContact O-CB 3.5Å; L62-F65 PolarHBondContact O-N 3.12Å; V63-F65 VanDerWaalsContact C-N 3.33Å; V63-F65 PolarHBondContact O-N 3.2Å; F65-M67 PolarHBondContact O-N 3.48Å; F65-L68 PolarHBondContact O-N 3.27Å; F65-L69 HydrophobicContact CD1-CD1 3.79Å; F65-L69 HydrophobicContact CD1-CG 4.38Å; F65-L69 HydrophobicContact CE1-CD1 3.31Å; F65-L69 HydrophobicContact CE1-CG 4.1Å; F65-L69 HydrophobicContact CE2-CD1 4.44Å; F65-L69 HydrophobicContact CE2-CD2 4.48Å; F65-L69 HydrophobicContact CE2-CG 4.42Å; F65-L69 HydrophobicContact CZ-CD1 3.69Å; F65-L69 HydrophobicContact CZ-CD2 4.22Å; F65-L69 HydrophobicContact CZ-CG 4.11Å; F65-L69 WeakPolarHBondContact O-CG 3.26Å; F65-L69 PolarHBondContact O-N 3.17Å; F65-M80 HydrophobicContact CD2-CE 3.38Å; F65-M80 HydrophobicContact CE2-CE 3.39Å; F65-M80 HydrophobicContact CG-CE 4.41Å; F65-M80 HydrophobicContact CZ-CE 4.42Å; F65-H208 HydrophobicContact CD2-CB 4.48Å; F65-H208 AromaticContact CD2-ND1 3.76Å; F65-H208 HydrophobicContact CE2-CB 3.7Å; F65-H208 AromaticContact CE2-CG 3.62Å; F65-H208 AromaticContact CE2-ND1 3.77Å; F65-H208 HydrophobicContact CZ-CB 4.35Å; F65-L210 HydrophobicContact CB-CB 3.94Å; F65-L210 HydrophobicContact CD2-CB 4.06Å; F65-L210 HydrophobicContact CG-CB 4.39Å; F65-R211 HydrophobicContact CD1-CB 4.02Å; F65-R211 HydrophobicContact CD1-CG 4.25Å; F65-R211 HydrophobicContact CD2-CB 4.2Å; F65-R211 HydrophobicContact CE1-CB 3.85Å; F65-R211 HydrophobicContact CE1-CG 3.91Å; F65-R211 HydrophobicContact CE2-CB 4.05Å; F65-R211 HydrophobicContact CG-CB 4.18Å; F65-R211 HydrophobicContact CZ-CB 3.88Å; F65-R211 HydrophobicContact CZ-CG 4.28Å
66H89.6Confident89.7Confident105 Ų10574.4 Ų74.449%0.48637%0.366SS..Hα-helixtrans-65.4-36.4177-77.7-63.5000113.1L62 V63 V64 L69 C70L62-H66 PolarHBondContact O-CD2 3.18Å; L62-H66 PolarHBondContact O-N 2.83Å; V63-H66 PolarHBondContact O-N 3.04Å; V64-H66 PolarHBondContact O-N 3.23Å; H66-L69 PolarHBondContact O-N 3.1Å; H66-C70 WeakPolarHBondContact O-CB 3.4Å; H66-C70 PolarHBondContact O-N 3.19Å; H66-C70 PolarHBondContact O-SG 3.35Å
67M90Very high88.9Confident115 Ų11577.1 Ų77.157%0.56738%0.377SS*.Hα-helixtrans-61.6-45.2173.2-73.5-169.6-67.900111.6V63 V64 F65 C70 H71V63-M67 HydrophobicContact CG1-CE 4.1Å; V63-M67 WeakPolarHBondContact O-CG 3.45Å; V63-M67 PolarHBondContact O-N 2.86Å; V64-M67 HydrophobicContact CB-CE 4.37Å; V64-M67 HydrophobicContact CG2-CE 3.94Å; V64-M67 PolarHBondContact O-N 3.12Å; F65-M67 PolarHBondContact O-N 3.48Å; M67-C70 PolarHBondContact O-N 2.91Å; M67-H71 WeakPolarHBondContact O-CB 3.4Å; M67-H71 PolarHBondContact O-N 3.39Å
68L89.1Confident87.9Confident77 Ų7781.5 Ų81.540%0.40341%0.405SS..Hα-helixtrans-63.5-42.1176.3-69.8174.8000111.7V64 F65 H71 D72 M80 L210V64-L68 HydrophobicContact CG1-CD1 4.09Å; V64-L68 HydrophobicContact CG1-CG 4.34Å; V64-L68 WeakPolarHBondContact O-CG 3.33Å; V64-L68 PolarHBondContact O-N 2.91Å; F65-L68 PolarHBondContact O-N 3.27Å; L68-H71 PolarHBondContact O-N 2.86Å; L68-D72 WeakPolarHBondContact O-CB 3.22Å; L68-D72 PolarHBondContact O-N 3.03Å; L68-M80 HydrophobicContact CB-CE 3.93Å; L68-M80 HydrophobicContact CB-SD 3.72Å; L68-M80 HydrophobicContact CD1-CE 4.42Å; L68-L210 HydrophobicContact CD1-CD1 3.7Å
69L87.6Confident86.9Confident28 Ų2889.3 Ų89.315%0.14744%0.439CS..Hα-helixtrans-61.6-46.1174.4-72-179.9000112.2F65 H66 H71 D72 R73 M80 T82F65-L69 HydrophobicContact CD1-CD1 3.79Å; F65-L69 HydrophobicContact CD1-CG 4.38Å; F65-L69 HydrophobicContact CE1-CD1 3.31Å; F65-L69 HydrophobicContact CE1-CG 4.1Å; F65-L69 HydrophobicContact CE2-CD1 4.44Å; F65-L69 HydrophobicContact CE2-CD2 4.48Å; F65-L69 HydrophobicContact CE2-CG 4.42Å; F65-L69 HydrophobicContact CZ-CD1 3.69Å; F65-L69 HydrophobicContact CZ-CD2 4.22Å; F65-L69 HydrophobicContact CZ-CG 4.11Å; F65-L69 WeakPolarHBondContact O-CG 3.26Å; F65-L69 PolarHBondContact O-N 3.17Å; H66-L69 PolarHBondContact O-N 3.1Å; L69-H71 VanDerWaalsContact C-N 3.26Å; L69-H71 PolarHBondContact O-N 3.28Å; L69-D72 PolarHBondContact O-N 2.67Å; L69-R73 WeakPolarHBondContact O-CB 3.32Å; L69-R73 WeakPolarHBondContact O-CG 3.22Å; L69-R73 PolarHBondContact O-N 3.39Å; L69-M80 HydrophobicContact CD2-CE 4.02Å; L69-M80 HydrophobicContact CD2-CG 4.12Å; L69-M80 HydrophobicContact CD2-SD 3.8Å; L69-M80 HydrophobicContact CG-CE 4.25Å; L69-M80 HydrophobicContact CG-SD 4.32Å; L69-T82 HydrophobicContact CD2-CG2 3.41Å; L69-T82 VanDerWaalsContact CD2-CG2 3.41Å
70C87.7Confident85.9Confident72 Ų7289.7 Ų89.749%0.48644%0.44SS..Hα-helixtrans-62.2-36.4176.8-760000111.7H66 M67 R74H66-C70 WeakPolarHBondContact O-CB 3.4Å; H66-C70 PolarHBondContact O-N 3.19Å; H66-C70 PolarHBondContact O-SG 3.35Å; M67-C70 PolarHBondContact O-N 2.91Å; C70-R74 WeakPolarHBondContact O-CG 3.21Å
71H88.3Confident84.7Confident100 Ų10092 Ų9246%0.46345%0.449SS..Hα-helixtrans-71.5-41.8176-174.483.8000112.2M67 L68 L69 R74 R75M67-H71 WeakPolarHBondContact O-CB 3.4Å; M67-H71 PolarHBondContact O-N 3.39Å; L68-H71 PolarHBondContact O-N 2.86Å; L69-H71 VanDerWaalsContact C-N 3.26Å; L69-H71 PolarHBondContact O-N 3.28Å; H71-R74 WeakPolarHBondContact O-CB 3.44Å; H71-R74 PolarHBondContact O-N 3.48Å; H71-R75 PolarHBondContact NE2-NE 3.44Å; H71-R75 PolarHBondContact NE2-NH2 3.03Å; H71-R75 VanDerWaalsContact NE2-NH2 3.14Å
72D86.4Confident83.4Confident19 Ų1995 Ų9510%0.10247%0.467CS..Hα-helixtrans-69.1-35.9179.1-164.357.3000111.8L68 L69 R74 R75 P78 K79 M80L68-D72 WeakPolarHBondContact O-CB 3.22Å; L68-D72 PolarHBondContact O-N 3.03Å; L69-D72 PolarHBondContact O-N 2.67Å; D72-R74 PolarHBondContact O-N 2.98Å; D72-R75 WeakPolarHBondContact O-CB 3.39Å; D72-R75 PolarHBondContact O-N 3.26Å; D72-P78 VanDerWaalsContact OD2-CA 3.25Å; D72-P78 WeakPolarHBondContact OD2-CA 3.29Å; D72-P78 VanDerWaalsContact OD2-CB 3.24Å; D72-P78 WeakPolarHBondContact OD2-CB 3.36Å; D72-K79 PolarHBondContact OD1-N 3.37Å; D72-K79 VanDerWaalsContact OD1-N 3.11Å; D72-K79 PolarHBondContact OD2-N 3.07Å; D72-M80 HydrophobicContact CB-CB 4.13Å; D72-M80 VanDerWaalsContact OD2-CB 3.22Å; D72-M80 WeakPolarHBondContact OD2-CB 3.36Å; D72-M80 PolarHBondContact OD2-N 3.44Å
73R84.3Confident82.2Confident216 Ų21694 Ų9482%0.81547%0.465SS*.THydrogen-bonded Turntrans-63.4-19.5171.9-72.3177.386.5168.89.1113.8L69L69-R73 WeakPolarHBondContact O-CB 3.32Å; L69-R73 WeakPolarHBondContact O-CG 3.22Å; L69-R73 PolarHBondContact O-N 3.39Å
74R85.8Confident81.1Confident212 Ų21295.9 Ų95.980%0.847%0.468SS*.THydrogen-bonded Turntrans-86.2-10.3173.4-67.4173-173.5-171.72.3112.4C70 H71 D72C70-R74 WeakPolarHBondContact O-CG 3.21Å; H71-R74 WeakPolarHBondContact O-CB 3.44Å; H71-R74 PolarHBondContact O-N 3.48Å; D72-R74 PolarHBondContact O-N 2.98Å
75R83.3Confident80Confident131 Ų13198.6 Ų98.649%0.49449%0.49SS..SBendtrans-81.2146.1176.6-64.2-176174.2-143.4-1.6110H71 D72 E77H71-R75 PolarHBondContact NE2-NE 3.44Å; H71-R75 PolarHBondContact NE2-NH2 3.03Å; H71-R75 VanDerWaalsContact NE2-NH2 3.14Å; D72-R75 WeakPolarHBondContact O-CB 3.39Å; D72-R75 PolarHBondContact O-N 3.26Å; R75-E77 PolarHBondContact O-N 3.46Å
76P74.9Confident79.5Confident135 Ų13599.2 Ų99.288%0.87749%0.492SS*.SBendtrans-64.1-27.9176.923.4-31.2000112.5
77E76.7Confident79.2Confident140 Ų140100.5 Ų100.565%0.65450%0.503SS*.SBendtrans-126.4100.7173.2-67.1-177.2171.100109.4R75 K79R75-E77 PolarHBondContact O-N 3.46Å; E77-K79 PolarHBondContact O-N 3.3Å
78P73.6Confident78.8Confident92 Ų9298.1 Ų98.160%0.59750%0.496SS*.  trans-67130.3176.126.2-31.9000110.1D72D72-P78 VanDerWaalsContact OD2-CA 3.25Å; D72-P78 WeakPolarHBondContact OD2-CA 3.29Å; D72-P78 VanDerWaalsContact OD2-CB 3.24Å; D72-P78 WeakPolarHBondContact OD2-CB 3.36Å
79K74.9Confident78.8Confident169 Ų169100 Ų10074%0.73551%0.506SS*.  trans-110.9-9.6-178-67.4-175.2179.5-1760112.9D72 E77 N81D72-K79 PolarHBondContact OD1-N 3.37Å; D72-K79 VanDerWaalsContact OD1-N 3.11Å; D72-K79 PolarHBondContact OD2-N 3.07Å; E77-K79 PolarHBondContact O-N 3.3Å; K79-N81 PolarHBondContact O-N 2.84Å
80M74Confident78.8Confident39 Ų39100.9 Ų100.919%0.19251%0.51CS..  trans-82.5112.2-173.7-166.6162.7172.100110.6F65 L68 L69 D72 T82F65-M80 HydrophobicContact CD2-CE 3.38Å; F65-M80 HydrophobicContact CE2-CE 3.39Å; F65-M80 HydrophobicContact CG-CE 4.41Å; F65-M80 HydrophobicContact CZ-CE 4.42Å; L68-M80 HydrophobicContact CB-CE 3.93Å; L68-M80 HydrophobicContact CB-SD 3.72Å; L68-M80 HydrophobicContact CD1-CE 4.42Å; L69-M80 HydrophobicContact CD2-CE 4.02Å; L69-M80 HydrophobicContact CD2-CG 4.12Å; L69-M80 HydrophobicContact CD2-SD 3.8Å; L69-M80 HydrophobicContact CG-CE 4.25Å; L69-M80 HydrophobicContact CG-SD 4.32Å; D72-M80 HydrophobicContact CB-CB 4.13Å; D72-M80 VanDerWaalsContact OD2-CB 3.22Å; D72-M80 WeakPolarHBondContact OD2-CB 3.36Å; D72-M80 PolarHBondContact OD2-N 3.44Å; M80-T82 PolarHBondContact O-N 3.31Å; M80-T82 VanDerWaalsContact O-N 3.17Å
81N70.9Confident78.8Confident100 Ų10097.4 Ų97.454%0.53549%0.487SS..  trans-71.1109.8170.1-175.43.9000108.7K79 G83 D206K79-N81 PolarHBondContact O-N 2.84Å; N81-G83 PolarHBondContact O-N 3.18Å; N81-G83 PolarHBondContact OD1-N 3.01Å; N81-G83 VanDerWaalsContact OD1-N 3.08Å; N81-D206 PolarHBondContact ND2-OD2 3.46Å; N81-D206 VanDerWaalsContact ND2-OD2 3.08Å
82T66.4Low79Confident68 Ų6894.9 Ų94.942%0.41748%0.477SS..  trans-73.5-4.3-17960.80000113.4L69 M80L69-T82 HydrophobicContact CD2-CG2 3.41Å; L69-T82 VanDerWaalsContact CD2-CG2 3.41Å; M80-T82 PolarHBondContact O-N 3.31Å; M80-T82 VanDerWaalsContact O-N 3.17Å
83G66.8Low79.4Confident11 Ų1196.9 Ų96.911%0.11349%0.49CS..  trans66.3177.3-167.400000111.4N81 D206N81-G83 PolarHBondContact O-N 3.18Å; N81-G83 PolarHBondContact OD1-N 3.01Å; N81-G83 VanDerWaalsContact OD1-N 3.08Å; G83-D206 VanDerWaalsContact CA-O 3.24Å; G83-D206 WeakPolarHBondContact CA-O 3.28Å
84Q70.4Confident79.8Confident122 Ų12286.6 Ų86.657%0.5745%0.452SS*.  trans-69.5151.5173.6-63.9-177.1-7.400110.7F86 H205Q84-F86 PolarHBondContact O-N 2.95Å; Q84-H205 PolarHBondContact N-O 2.94Å
85S69.6Low80.1Confident116 Ų11676.5 Ų76.581%0.81141%0.413SS*.  trans-69.3116.1168.355.90000109.2
86F79.2Confident80.6Confident16 Ų1673.8 Ų73.87%0.0741%0.408CS..  trans-118156.6172.565.3-86.2000110Q84 P88 L90 F91 H205 V207 R211Q84-F86 PolarHBondContact O-N 2.95Å; F86-P88 WeakPolarHBondContact O-CD 3.45Å; F86-L90 HydrophobicContact CD2-CB 4.42Å; F86-F91 HydrophobicContact CD2-CD2 4.08Å; F86-F91 AromaticContact CD2-CE2 3.96Å; F86-F91 HydrophobicContact CD2-CE2 3.96Å; F86-F91 HydrophobicContact CE1-CE2 4.43Å; F86-F91 AromaticContact CE2-CD2 3.36Å; F86-F91 HydrophobicContact CE2-CD2 3.36Å; F86-F91 AromaticContact CE2-CE2 3.34Å; F86-F91 HydrophobicContact CE2-CE2 3.34Å; F86-F91 AromaticContact CZ-CD2 3.97Å; F86-F91 HydrophobicContact CZ-CD2 3.97Å; F86-F91 AromaticContact CZ-CE2 3.6Å; F86-F91 HydrophobicContact CZ-CE2 3.6Å; F86-H205 HydrophobicContact CB-CB 4.4Å; F86-V207 HydrophobicContact CD1-CG1 4.34Å; F86-V207 HydrophobicContact CD1-CG2 3.62Å; F86-V207 HydrophobicContact CE1-CB 4.1Å; F86-V207 HydrophobicContact CE1-CG1 3.42Å; F86-V207 VanDerWaalsContact CE1-CG1 3.42Å; F86-V207 HydrophobicContact CE1-CG2 3.55Å; F86-V207 HydrophobicContact CG-CG2 4.34Å; F86-V207 HydrophobicContact CZ-CG1 3.79Å; F86-V207 HydrophobicContact CZ-CG2 4.21Å; F86-R211 HydrophobicContact CE1-CG 4.46Å; F86-R211 HydrophobicContact CZ-CG 4.33Å
87N83.4Confident81.5Confident133 Ų13368.5 Ų68.571%0.71138%0.375SS*.  trans-67120.3174.1-72.9-30.6000109.4L89 L90N87-L89 PolarHBondContact O-N 3.45Å; N87-L90 WeakPolarHBondContact O-CB 3.41Å; N87-L90 PolarHBondContact O-N 3.48Å
88P82.1Confident82.2Confident65 Ų6563 Ų6342%0.42235%0.35SS..G310 helixtrans-54.9-31.5-178.1-2835.9000113.7F86 L90 F91 F219F86-P88 WeakPolarHBondContact O-CD 3.45Å; P88-L90 PolarHBondContact O-N 2.95Å; P88-F91 PolarHBondContact O-N 3.41Å; P88-F219 HydrophobicContact CB-CZ 4.47Å; P88-F219 VanDerWaalsContact O-CE2 3.28Å; P88-F219 WeakPolarHBondContact O-CE2 3.43Å
89L87.9Confident83Confident117 Ų11759 Ų5961%0.61332%0.323SS*.G310 helixtrans-56.6-16175-67.9171.2000114.2N87 F91 L92 F219N87-L89 PolarHBondContact O-N 3.45Å; L89-F91 PolarHBondContact O-N 3.27Å; L89-L92 HydrophobicContact CD2-CD2 4.44Å; L89-L92 VanDerWaalsContact O-CB 3.28Å; L89-L92 WeakPolarHBondContact O-CB 3.34Å; L89-L92 PolarHBondContact O-N 3.36Å; L89-F219 HydrophobicContact CD2-CE1 4.15Å; L89-F219 HydrophobicContact CD2-CZ 4.04Å
90L87.9Confident83.8Confident45 Ų4554 Ų5424%0.23631%0.307CS..G310 helixtrans-63-29.7174-171.272.4000112.5F86 N87 P88 L92 P93 F201 H205F86-L90 HydrophobicContact CD2-CB 4.42Å; N87-L90 WeakPolarHBondContact O-CB 3.41Å; N87-L90 PolarHBondContact O-N 3.48Å; P88-L90 PolarHBondContact O-N 2.95Å; L90-L92 VanDerWaalsContact C-N 3.32Å; L90-P93 WeakPolarHBondContact O-CD 3.38Å; L90-F201 HydrophobicContact CD1-CD1 4.08Å; L90-F201 HydrophobicContact CD1-CD2 4.42Å; L90-F201 HydrophobicContact CD1-CE1 3.78Å; L90-F201 HydrophobicContact CD1-CE2 4.14Å; L90-F201 HydrophobicContact CD1-CG 4.4Å; L90-F201 HydrophobicContact CD1-CZ 3.81Å; L90-F201 HydrophobicContact CD2-CB 4.03Å; L90-F201 HydrophobicContact CD2-CD1 3.99Å; L90-F201 HydrophobicContact CD2-CD2 4.24Å; L90-F201 HydrophobicContact CD2-CG 3.83Å; L90-F201 HydrophobicContact CG-CD1 4.09Å; L90-F201 HydrophobicContact CG-CD2 3.86Å; L90-F201 HydrophobicContact CG-CE1 4.21Å; L90-F201 HydrophobicContact CG-CE2 3.97Å; L90-F201 HydrophobicContact CG-CG 3.92Å; L90-F201 HydrophobicContact CG-CZ 4.15Å; L90-F201 WeakPolarHBondContact O-CE2 3.46Å; L90-H205 VanDerWaalsContact CD2-CE1 3.41Å; L90-H205 WeakPolarHBondContact CD2-CE1 3.44Å
91F88.9Confident84.7Confident0 Ų052.2 Ų52.20%030%0.298CS..G310 helixtrans-87.80.1177.4-78.4-94.7000113.3F86 P88 L89 P94 A95 F201 V202 V207 A212F86-F91 HydrophobicContact CD2-CD2 4.08Å; F86-F91 AromaticContact CD2-CE2 3.96Å; F86-F91 HydrophobicContact CD2-CE2 3.96Å; F86-F91 HydrophobicContact CE1-CE2 4.43Å; F86-F91 AromaticContact CE2-CD2 3.36Å; F86-F91 HydrophobicContact CE2-CD2 3.36Å; F86-F91 AromaticContact CE2-CE2 3.34Å; F86-F91 HydrophobicContact CE2-CE2 3.34Å; F86-F91 AromaticContact CZ-CD2 3.97Å; F86-F91 HydrophobicContact CZ-CD2 3.97Å; F86-F91 AromaticContact CZ-CE2 3.6Å; F86-F91 HydrophobicContact CZ-CE2 3.6Å; P88-F91 PolarHBondContact O-N 3.41Å; L89-F91 PolarHBondContact O-N 3.27Å; F91-P94 WeakPolarHBondContact O-CD 3.41Å; F91-A95 WeakPolarHBondContact O-CB 3.31Å; F91-A95 PolarHBondContact O-N 3.49Å; F91-A95 VanDerWaalsContact O-N 3.1Å; F91-F201 HydrophobicContact CZ-CB 4.4Å; F91-V202 HydrophobicContact CZ-CG2 4.38Å; F91-V207 HydrophobicContact CE2-CG1 4.46Å; F91-V207 HydrophobicContact CE2-CG2 4.29Å; F91-V207 HydrophobicContact CZ-CG1 4.3Å; F91-V207 HydrophobicContact CZ-CG2 4.33Å; F91-A212 HydrophobicContact CD1-CB 4.45Å; F91-A212 HydrophobicContact CE1-CB 3.56Å; F91-A212 HydrophobicContact CZ-CB 3.64Å
92L92.3Very high85.5Confident47 Ų4748.4 Ų48.425%0.24628%0.278CS..Hα-helixtrans-65.8-46.5175.9178.367.5000112.6L89 L90 A95 L96 F219 I223L89-L92 HydrophobicContact CD2-CD2 4.44Å; L89-L92 VanDerWaalsContact O-CB 3.28Å; L89-L92 WeakPolarHBondContact O-CB 3.34Å; L89-L92 PolarHBondContact O-N 3.36Å; L90-L92 VanDerWaalsContact C-N 3.32Å; L92-A95 PolarHBondContact O-N 3.06Å; L92-L96 HydrophobicContact CD1-CD1 4.32Å; L92-L96 HydrophobicContact CD1-CG 4.16Å; L92-L96 HydrophobicContact CG-CD1 4.1Å; L92-L96 HydrophobicContact CG-CG 4.37Å; L92-L96 WeakPolarHBondContact O-CG 3.35Å; L92-L96 PolarHBondContact O-N 3.42Å; L92-F219 HydrophobicContact CB-CD2 4.41Å; L92-F219 HydrophobicContact CD1-CB 4.01Å; L92-F219 HydrophobicContact CD1-CD1 3.81Å; L92-F219 HydrophobicContact CD1-CE1 4.45Å; L92-F219 HydrophobicContact CD1-CG 3.88Å; L92-I223 HydrophobicContact CD1-CD1 3.64Å
93P93.4Very high86.5Confident60 Ų6046.3 Ų46.339%0.3927%0.266SS..Hα-helixtrans-61-45.4177.1-19.830.9000114L90 A95 L96 C97 L197L90-P93 WeakPolarHBondContact O-CD 3.38Å; P93-A95 PolarHBondContact O-N 3.3Å; P93-L96 PolarHBondContact O-N 3.39Å; P93-C97 PolarHBondContact O-N 2.87Å; P93-C97 PolarHBondContact O-SG 2.89Å; P93-C97 VanDerWaalsContact O-SG 3.38Å; P93-L197 HydrophobicContact CB-CD1 4.5Å
94P92.6Very high87.6Confident0 Ų047.9 Ų47.90%027%0.272CS..Hα-helixtrans-54.7-47.4170.4-27.435.1000113.2F91 L96 C97 D98 Q194 L197 E198 F201F91-P94 WeakPolarHBondContact O-CD 3.41Å; P94-L96 VanDerWaalsContact C-N 3.34Å; P94-L96 PolarHBondContact O-N 3.39Å; P94-C97 WeakPolarHBondContact O-CB 3.48Å; P94-C97 PolarHBondContact O-N 3.35Å; P94-C97 VanDerWaalsContact O-N 3.1Å; P94-D98 PolarHBondContact O-N 2.89Å; P94-Q194 HydrophobicContact CB-CG 4.37Å; P94-L197 HydrophobicContact CG-CB 4.09Å; P94-E198 HydrophobicContact CB-CG 4.16Å; P94-F201 HydrophobicContact CG-CD2 4.07Å; P94-F201 HydrophobicContact CG-CE2 3.92Å
95A92.8Very high88.4Confident0 Ų042.9 Ų42.90%025%0.249CC..Hα-helixtrans-60.1-41.4178.300000112.5F91 L92 P93 D98 M99 E216 F219F91-A95 WeakPolarHBondContact O-CB 3.31Å; F91-A95 PolarHBondContact O-N 3.49Å; F91-A95 VanDerWaalsContact O-N 3.1Å; L92-A95 PolarHBondContact O-N 3.06Å; P93-A95 PolarHBondContact O-N 3.3Å; A95-D98 PolarHBondContact O-N 2.87Å; A95-M99 WeakPolarHBondContact O-CB 3.24Å; A95-M99 WeakPolarHBondContact O-CG 3.4Å; A95-M99 PolarHBondContact O-N 3.5Å; A95-E216 HydrophobicContact CB-CG 3.91Å; A95-F219 HydrophobicContact CB-CB 3.93Å
96L93.9Very high89Confident74 Ų7439.2 Ų39.239%0.38722%0.218SC..Hα-helixtrans-65.4-39.3175.7-71.1173.8000111.8L92 P93 P94 T100 I223L92-L96 HydrophobicContact CD1-CD1 4.32Å; L92-L96 HydrophobicContact CD1-CG 4.16Å; L92-L96 HydrophobicContact CG-CD1 4.1Å; L92-L96 HydrophobicContact CG-CG 4.37Å; L92-L96 WeakPolarHBondContact O-CG 3.35Å; L92-L96 PolarHBondContact O-N 3.42Å; P93-L96 PolarHBondContact O-N 3.39Å; P94-L96 VanDerWaalsContact C-N 3.34Å; P94-L96 PolarHBondContact O-N 3.39Å; L96-T100 VanDerWaalsContact O-CB 3.23Å; L96-T100 WeakPolarHBondContact O-CB 3.37Å; L96-T100 PolarHBondContact O-N 2.91Å; L96-T100 PolarHBondContact O-OG1 3.1Å; L96-I223 HydrophobicContact CD2-CD1 3.96Å
97C94.3Very high89.2Confident25 Ų2540.6 Ų40.617%0.16923%0.227CC..Hα-helixtrans-63.8-46.7174.7-71.90000111.3P93 P94 T100 A101 I190 Q194P93-C97 PolarHBondContact O-N 2.87Å; P93-C97 PolarHBondContact O-SG 2.89Å; P93-C97 VanDerWaalsContact O-SG 3.38Å; P94-C97 WeakPolarHBondContact O-CB 3.48Å; P94-C97 PolarHBondContact O-N 3.35Å; P94-C97 VanDerWaalsContact O-N 3.1Å; C97-T100 PolarHBondContact O-N 3.32Å; C97-A101 VanDerWaalsContact O-CB 3.25Å; C97-A101 WeakPolarHBondContact O-CB 3.42Å; C97-A101 PolarHBondContact O-N 3.48Å; C97-I190 HydrophobicContact CB-CG2 3.84Å; C97-I190 WeakPolarHBondContact O-CG2 3.07Å; C97-Q194 HydrophobicContact CB-CB 3.76Å
98D91.6Very high89.2Confident24 Ų2434.2 Ų34.213%0.12819%0.193CC..Hα-helixtrans-59.8-51.3178.2-177.243.9000111.6F55 P94 A95 T100 A101 T102 Q194F55-D98 WeakPolarHBondContact CE1-OD2 3.25Å; F55-D98 WeakPolarHBondContact CZ-OD2 3.42Å; P94-D98 PolarHBondContact O-N 2.89Å; A95-D98 PolarHBondContact O-N 2.87Å; D98-T100 VanDerWaalsContact C-N 3.32Å; D98-T100 PolarHBondContact O-N 3.32Å; D98-A101 PolarHBondContact O-N 2.97Å; D98-T102 WeakPolarHBondContact O-CB 3.46Å; D98-T102 PolarHBondContact O-N 3.4Å; D98-T102 PolarHBondContact O-OG1 3.3Å; D98-T102 VanDerWaalsContact O-OG1 3.06Å; D98-Q194 VanDerWaalsContact CA-OE1 3.31Å; D98-Q194 HydrophobicContact CB-CG 4.44Å; D98-Q194 PolarHBondContact OD1-OE1 2.92Å
99M90.3Very high89Confident8 Ų833.7 Ų33.74%0.03919%0.186CC..Hα-helixtrans-55.9-46176-73.7179.461.800112.4F55 A95 S103 I223 L224 L227F55-M99 HydrophobicContact CE1-CG 4.3Å; F55-M99 HydrophobicContact CE2-CG 3.64Å; F55-M99 HydrophobicContact CZ-CB 4.37Å; F55-M99 HydrophobicContact CZ-CG 3.39Å; A95-M99 WeakPolarHBondContact O-CB 3.24Å; A95-M99 WeakPolarHBondContact O-CG 3.4Å; A95-M99 PolarHBondContact O-N 3.5Å; M99-S103 VanDerWaalsContact O-CB 3.27Å; M99-S103 WeakPolarHBondContact O-CB 3.39Å; M99-S103 PolarHBondContact O-N 3.43Å; M99-S103 PolarHBondContact O-OG 2.99Å; M99-I223 HydrophobicContact CE-CB 3.84Å; M99-I223 HydrophobicContact CE-CG2 3.55Å; M99-I223 HydrophobicContact SD-CB 3.86Å; M99-I223 HydrophobicContact SD-CG2 3.99Å; M99-L224 HydrophobicContact CE-CB 3.63Å; M99-L224 HydrophobicContact CE-CD1 4.01Å; M99-L224 HydrophobicContact CE-CG 4.38Å; M99-L227 HydrophobicContact CE-CD1 3.91Å
100T91.9Very high88.4Confident65 Ų6531 Ų3140%0.39917%0.173SC..Hα-helixtrans-68.7-46.1-177.5-57.10000110.9L96 C97 D98 S103 I104 I190L96-T100 VanDerWaalsContact O-CB 3.23Å; L96-T100 WeakPolarHBondContact O-CB 3.37Å; L96-T100 PolarHBondContact O-N 2.91Å; L96-T100 PolarHBondContact O-OG1 3.1Å; C97-T100 PolarHBondContact O-N 3.32Å; D98-T100 VanDerWaalsContact C-N 3.32Å; D98-T100 PolarHBondContact O-N 3.32Å; T100-S103 PolarHBondContact O-N 2.79Å; T100-I104 HydrophobicContact CG2-CD1 3.96Å; T100-I104 VanDerWaalsContact O-CG1 3.31Å; T100-I104 WeakPolarHBondContact O-CG1 3.49Å; T100-I104 PolarHBondContact O-N 3.21Å; T100-I190 HydrophobicContact CG2-CD1 3.91Å
101A92.6Very high87.9Confident0 Ų029.7 Ų29.70%017%0.165CC..Hα-helixtrans-60.8-46.7177.400000110.9C97 D98 I104 M105 I190 A191C97-A101 VanDerWaalsContact O-CB 3.25Å; C97-A101 WeakPolarHBondContact O-CB 3.42Å; C97-A101 PolarHBondContact O-N 3.48Å; D98-A101 PolarHBondContact O-N 2.97Å; A101-I104 PolarHBondContact O-N 2.81Å; A101-M105 WeakPolarHBondContact O-CB 3.34Å; A101-M105 WeakPolarHBondContact O-CG 3.46Å; A101-M105 PolarHBondContact O-N 3.46Å; A101-I190 HydrophobicContact CB-CB 4.09Å; A101-I190 HydrophobicContact CB-CG2 4.05Å; A101-A191 HydrophobicContact CB-CB 4.16Å
102T87.8Confident87.4Confident20 Ų2030.3 Ų30.312%0.12317%0.169CC..Hα-helixtrans-62.9-42.3178.3-68.30000112.1D98 M105 Y106D98-T102 WeakPolarHBondContact O-CB 3.46Å; D98-T102 PolarHBondContact O-N 3.4Å; D98-T102 PolarHBondContact O-OG1 3.3Å; D98-T102 VanDerWaalsContact O-OG1 3.06Å; T102-M105 WeakPolarHBondContact O-CB 3.26Å; T102-M105 PolarHBondContact O-N 2.72Å; T102-Y106 HydrophobicContact CG2-CD2 3.8Å; T102-Y106 HydrophobicContact CG2-CE2 3.26Å; T102-Y106 WeakPolarHBondContact O-CD2 3.14Å; T102-Y106 PolarHBondContact O-N 2.93Å
103S86.6Confident86.5Confident24 Ų2430.1 Ų30.117%0.16817%0.172CC..Hα-helixtrans-61.7-46.9175.4-60.10000112.5M99 T100 M105 Y106 V107M99-S103 VanDerWaalsContact O-CB 3.27Å; M99-S103 WeakPolarHBondContact O-CB 3.39Å; M99-S103 PolarHBondContact O-N 3.43Å; M99-S103 PolarHBondContact O-OG 2.99Å; T100-S103 PolarHBondContact O-N 2.79Å; S103-M105 VanDerWaalsContact C-N 3.32Å; S103-M105 PolarHBondContact O-N 2.92Å; S103-Y106 PolarHBondContact O-N 3.27Å; S103-V107 PolarHBondContact O-N 3.5Å; S103-V107 VanDerWaalsContact O-N 3.17Å
104I89.9Confident85.6Confident44 Ų4429.5 Ų29.523%0.22617%0.172CC..Hα-helixtrans-64-39.9177.3-65.3167.8000110.5T100 A101 Y106 V107 A108 L183 A187 I190T100-I104 HydrophobicContact CG2-CD1 3.96Å; T100-I104 VanDerWaalsContact O-CG1 3.31Å; T100-I104 WeakPolarHBondContact O-CG1 3.49Å; T100-I104 PolarHBondContact O-N 3.21Å; A101-I104 PolarHBondContact O-N 2.81Å; I104-Y106 VanDerWaalsContact C-N 3.34Å; I104-Y106 PolarHBondContact O-N 2.66Å; I104-V107 PolarHBondContact O-N 3.45Å; I104-A108 WeakPolarHBondContact O-CB 3.11Å; I104-A108 PolarHBondContact O-N 3.32Å; I104-L183 HydrophobicContact CG2-CB 3.98Å; I104-L183 HydrophobicContact CG2-CD2 4.2Å; I104-L183 VanDerWaalsContact CG2-O 3.31Å; I104-L183 WeakPolarHBondContact CG2-O 3.27Å; I104-A187 HydrophobicContact CB-CB 4.04Å; I104-A187 HydrophobicContact CG2-CB 3.89Å; I104-I190 HydrophobicContact CD1-CD1 3.75Å
105M88.2Confident84.6Confident18 Ų1830.3 Ų30.39%0.08918%0.178CC..Hα-helixtrans-60.4-40.5175.9-83-169.8-64.600112.5A101 T102 S103 A108 L109 F117 R121 A187 Q188A101-M105 WeakPolarHBondContact O-CB 3.34Å; A101-M105 WeakPolarHBondContact O-CG 3.46Å; A101-M105 PolarHBondContact O-N 3.46Å; T102-M105 WeakPolarHBondContact O-CB 3.26Å; T102-M105 PolarHBondContact O-N 2.72Å; S103-M105 VanDerWaalsContact C-N 3.32Å; S103-M105 PolarHBondContact O-N 2.92Å; M105-A108 PolarHBondContact O-N 3.19Å; M105-L109 PolarHBondContact O-N 3.41Å; M105-F117 HydrophobicContact CB-CE2 3.67Å; M105-F117 HydrophobicContact CB-CZ 3.93Å; M105-F117 HydrophobicContact CG-CE2 3.91Å; M105-F117 HydrophobicContact CG-CZ 4.24Å; M105-F117 WeakPolarHBondContact O-CE2 3.38Å; M105-F117 HydrophobicContact SD-CE2 4.31Å; M105-F117 HydrophobicContact SD-CZ 4.15Å; M105-R121 PolarHBondContact SD-NH2 3.07Å; M105-A187 HydrophobicContact CG-CB 3.69Å; M105-Q188 PolarHBondContact SD-NE2 3.34Å
106Y81.7Confident83.9Confident39 Ų3930.4 Ų30.415%0.15318%0.178CC..Hα-helixtrans-67.2-41.5176.9-74.8-56.7000113P47 A51 T102 S103 I104 A108 L109P47-Y106 HydrophobicContact CB-CD1 3.38Å; P47-Y106 HydrophobicContact CB-CD2 3.99Å; P47-Y106 HydrophobicContact CB-CE1 3.74Å; P47-Y106 HydrophobicContact CB-CE2 4.3Å; P47-Y106 HydrophobicContact CB-CG 3.52Å; P47-Y106 HydrophobicContact CG-CG 4.44Å; A51-Y106 HydrophobicContact CB-CE2 3.92Å; T102-Y106 HydrophobicContact CG2-CD2 3.8Å; T102-Y106 HydrophobicContact CG2-CE2 3.26Å; T102-Y106 WeakPolarHBondContact O-CD2 3.14Å; T102-Y106 PolarHBondContact O-N 2.93Å; S103-Y106 PolarHBondContact O-N 3.27Å; I104-Y106 VanDerWaalsContact C-N 3.34Å; I104-Y106 PolarHBondContact O-N 2.66Å; Y106-A108 VanDerWaalsContact C-N 3.27Å; Y106-A108 PolarHBondContact O-N 2.96Å; Y106-L109 HydrophobicContact CD1-CD1 4.02Å; Y106-L109 WeakPolarHBondContact O-CB 3.48Å; Y106-L109 PolarHBondContact O-N 2.91Å
107V82.3Confident83.3Confident44 Ų4427.4 Ų27.427%0.26716%0.162SC..Hα-helixtrans-60.3-42.7173.6175.50000110.2S103 I104 L109 N110 M111 L183S103-V107 PolarHBondContact O-N 3.5Å; S103-V107 VanDerWaalsContact O-N 3.17Å; I104-V107 PolarHBondContact O-N 3.45Å; V107-L109 PolarHBondContact O-N 2.97Å; V107-N110 PolarHBondContact O-N 3.31Å; V107-M111 HydrophobicContact CG1-SD 4.3Å; V107-L183 HydrophobicContact CG1-CD1 4.37Å
108A84.4Confident82.4Confident0 Ų027.1 Ų27.10%016%0.158CC..Hα-helixtrans-67.5-33.5179.200000113.7I104 M105 Y106 N110 M111 T112 G180 L183 I184I104-A108 WeakPolarHBondContact O-CB 3.11Å; I104-A108 PolarHBondContact O-N 3.32Å; M105-A108 PolarHBondContact O-N 3.19Å; Y106-A108 VanDerWaalsContact C-N 3.27Å; Y106-A108 PolarHBondContact O-N 2.96Å; A108-N110 PolarHBondContact O-N 2.79Å; A108-M111 PolarHBondContact O-N 3.48Å; A108-T112 WeakPolarHBondContact O-CG2 3.18Å; A108-T112 PolarHBondContact O-N 2.86Å; A108-G180 WeakPolarHBondContact CB-O 3.49Å; A108-L183 HydrophobicContact CB-CB 3.94Å; A108-I184 HydrophobicContact CB-CD1 4.24Å; A108-I184 HydrophobicContact CB-CG1 3.55Å
109L78.3Confident81.9Confident53 Ų5326.3 Ų26.328%0.27715%0.153SC..Hα-helixtrans-59.3-28.9174.9-88.7169.4000113.3M105 Y106 V107 M111 F117M105-L109 PolarHBondContact O-N 3.41Å; Y106-L109 HydrophobicContact CD1-CD1 4.02Å; Y106-L109 WeakPolarHBondContact O-CB 3.48Å; Y106-L109 PolarHBondContact O-N 2.91Å; V107-L109 PolarHBondContact O-N 2.97Å; L109-M111 VanDerWaalsContact C-N 3.3Å; L109-F117 HydrophobicContact CD1-CD1 4.34Å; L109-F117 HydrophobicContact CD1-CD2 4.35Å; L109-F117 HydrophobicContact CD1-CE1 3.82Å; L109-F117 HydrophobicContact CD1-CE2 3.88Å; L109-F117 HydrophobicContact CD1-CZ 3.53Å; L109-F117 HydrophobicContact CD2-CB 3.64Å; L109-F117 HydrophobicContact CD2-CD1 3.45Å; L109-F117 VanDerWaalsContact CD2-CD1 3.45Å; L109-F117 HydrophobicContact CD2-CD2 3.57Å; L109-F117 HydrophobicContact CD2-CE1 3.82Å; L109-F117 HydrophobicContact CD2-CE2 3.97Å; L109-F117 HydrophobicContact CD2-CG 3.26Å; L109-F117 HydrophobicContact CD2-CZ 4.03Å; L109-F117 HydrophobicContact CG-CD1 4.03Å; L109-F117 HydrophobicContact CG-CD2 3.51Å; L109-F117 HydrophobicContact CG-CE1 3.95Å; L109-F117 HydrophobicContact CG-CE2 3.47Å; L109-F117 VanDerWaalsContact CG-CE2 3.47Å; L109-F117 HydrophobicContact CG-CG 3.77Å; L109-F117 HydrophobicContact CG-CZ 3.64Å
110N75.3Confident81.7Confident62 Ų6226.1 Ų26.133%0.33215%0.153SC..THydrogen-bonded Turntrans-79-16.1176.1-69.5-20.6000112.8V107 A108 F239V107-N110 PolarHBondContact O-N 3.31Å; A108-N110 PolarHBondContact O-N 2.79Å; N110-F239 PolarHBondContact ND2-O 2.68Å
111M76.1Confident81.3Confident16 Ų1625.1 Ų25.18%0.07914%0.142CC..THydrogen-bonded Turntrans-105.8-25.8-174.9-60.8175.469.200113.3V107 A108 L109 E176 V177 T179 L183 F239V107-M111 HydrophobicContact CG1-SD 4.3Å; A108-M111 PolarHBondContact O-N 3.48Å; L109-M111 VanDerWaalsContact C-N 3.3Å; M111-E176 HydrophobicContact CB-CG 3.95Å; M111-E176 HydrophobicContact CE-CG 4.02Å; M111-E176 HydrophobicContact CG-CG 4.14Å; M111-V177 WeakPolarHBondContact O-CA 3.35Å; M111-T179 HydrophobicContact CE-CG2 3.58Å; M111-L183 HydrophobicContact SD-CD1 3.87Å; M111-F239 HydrophobicContact CE-CE1 3.74Å; M111-F239 HydrophobicContact CG-CD1 3.98Å; M111-F239 HydrophobicContact CG-CE1 3.92Å; M111-F239 HydrophobicContact SD-CD1 3.93Å; M111-F239 HydrophobicContact SD-CE1 3.52Å; M111-F239 VanDerWaalsContact SD-CE1 3.52Å
112T78.8Confident80.7Confident14 Ų1425.6 Ų25.69%0.08615%0.147CC..SBendtrans-119.3172.5-179.1-167.60000111.7A108 S116 F117 D181 I184A108-T112 WeakPolarHBondContact O-CG2 3.18Å; A108-T112 PolarHBondContact O-N 2.86Å; T112-S116 WeakPolarHBondContact OG1-CB 3.33Å; T112-F117 HydrophobicContact CG2-CB 4.3Å; T112-D181 WeakPolarHBondContact CB-OD1 3.44Å; T112-D181 PolarHBondContact OG1-OD1 3.21Å; T112-I184 HydrophobicContact CG2-CD1 3.42Å; T112-I184 VanDerWaalsContact CG2-CD1 3.42Å
113S74.7Confident80.7Confident43 Ų4324.7 Ų24.730%0.30114%0.141SC..  trans-76.5149.1177.486.40000111.8S115 S116 F117S113-S115 PolarHBondContact O-N 3.35Å; S113-S115 PolarHBondContact OG-OG 2.96Å; S113-S116 PolarHBondContact O-N 2.87Å; S113-S116 WeakPolarHBondContact OG-CB 3.14Å; S113-S116 PolarHBondContact OG-N 3.09Å; S113-S116 VanDerWaalsContact OG-N 3.14Å; S113-S116 PolarHBondContact OG-OG 3.02Å; S113-F117 WeakPolarHBondContact O-CB 3.41Å; S113-F117 PolarHBondContact O-N 3.42Å
114A73.6Confident80.8Confident47 Ų4723.7 Ų23.739%0.38813%0.134SC..Hα-helixtrans-59.7-31.7177.800000112.9Q118A114-Q118 VanDerWaalsContact O-CG 3.28Å; A114-Q118 WeakPolarHBondContact O-CG 3.2Å; A114-Q118 PolarHBondContact O-N 3.21Å; A114-Q118 VanDerWaalsContact O-N 3.13Å
115S72.6Confident80.7Confident17 Ų1721.7 Ų21.712%0.11912%0.123CC..Hα-helixtrans-70.4-47.717653.60000111.2S113 F117 Q118 M119 Q320S113-S115 PolarHBondContact O-N 3.35Å; S113-S115 PolarHBondContact OG-OG 2.96Å; S115-F117 VanDerWaalsContact C-N 3.3Å; S115-F117 PolarHBondContact O-N 3.47Å; S115-Q118 PolarHBondContact O-N 3.1Å; S115-M119 VanDerWaalsContact O-CG 3.22Å; S115-M119 WeakPolarHBondContact O-CG 3.3Å; S115-M119 PolarHBondContact O-N 3.33Å; S115-Q320 PolarHBondContact OG-NE2 3.38Å; S115-Q320 PolarHBondContact OG-OE1 2.96Å
116S77.4Confident80.8Confident1 Ų121.3 Ų21.31%0.00712%0.122CC..Hα-helixtrans-56.3-44.8173.9-53.40000111.4T112 S113 Q118 M119 L120 D162T112-S116 WeakPolarHBondContact OG1-CB 3.33Å; S113-S116 PolarHBondContact O-N 2.87Å; S113-S116 WeakPolarHBondContact OG-CB 3.14Å; S113-S116 PolarHBondContact OG-N 3.09Å; S113-S116 VanDerWaalsContact OG-N 3.14Å; S113-S116 PolarHBondContact OG-OG 3.02Å; S116-Q118 PolarHBondContact O-N 3.27Å; S116-M119 PolarHBondContact O-N 2.99Å; S116-L120 WeakPolarHBondContact O-CB 3.2Å; S116-L120 VanDerWaalsContact O-CG 3.3Å; S116-L120 WeakPolarHBondContact O-CG 3.37Å; S116-L120 PolarHBondContact O-N 3.29Å; S116-D162 WeakPolarHBondContact CB-OD2 3.38Å; S116-D162 PolarHBondContact OG-OD1 3.37Å; S116-D162 VanDerWaalsContact OG-OD1 3.12Å; S116-D162 PolarHBondContact OG-OD2 2.95Å
117F80.9Confident81.3Confident12 Ų1222.1 Ų22.15%0.05313%0.126CC..Hα-helixtrans-56.5-49.9175.9176.7-97.3000113.3M105 L109 T112 S113 S115 M119 R121 I184M105-F117 HydrophobicContact CB-CE2 3.67Å; M105-F117 HydrophobicContact CB-CZ 3.93Å; M105-F117 HydrophobicContact CG-CE2 3.91Å; M105-F117 HydrophobicContact CG-CZ 4.24Å; M105-F117 WeakPolarHBondContact O-CE2 3.38Å; M105-F117 HydrophobicContact SD-CE2 4.31Å; M105-F117 HydrophobicContact SD-CZ 4.15Å; L109-F117 HydrophobicContact CD1-CD1 4.34Å; L109-F117 HydrophobicContact CD1-CD2 4.35Å; L109-F117 HydrophobicContact CD1-CE1 3.82Å; L109-F117 HydrophobicContact CD1-CE2 3.88Å; L109-F117 HydrophobicContact CD1-CZ 3.53Å; L109-F117 HydrophobicContact CD2-CB 3.64Å; L109-F117 HydrophobicContact CD2-CD1 3.45Å; L109-F117 VanDerWaalsContact CD2-CD1 3.45Å; L109-F117 HydrophobicContact CD2-CD2 3.57Å; L109-F117 HydrophobicContact CD2-CE1 3.82Å; L109-F117 HydrophobicContact CD2-CE2 3.97Å; L109-F117 HydrophobicContact CD2-CG 3.26Å; L109-F117 HydrophobicContact CD2-CZ 4.03Å; L109-F117 HydrophobicContact CG-CD1 4.03Å; L109-F117 HydrophobicContact CG-CD2 3.51Å; L109-F117 HydrophobicContact CG-CE1 3.95Å; L109-F117 HydrophobicContact CG-CE2 3.47Å; L109-F117 VanDerWaalsContact CG-CE2 3.47Å; L109-F117 HydrophobicContact CG-CG 3.77Å; L109-F117 HydrophobicContact CG-CZ 3.64Å; T112-F117 HydrophobicContact CG2-CB 4.3Å; S113-F117 WeakPolarHBondContact O-CB 3.41Å; S113-F117 PolarHBondContact O-N 3.42Å; S115-F117 VanDerWaalsContact C-N 3.3Å; S115-F117 PolarHBondContact O-N 3.47Å; F117-M119 VanDerWaalsContact C-N 3.3Å; F117-M119 PolarHBondContact O-N 3.43Å; F117-R121 VanDerWaalsContact CE1-CZ 3.43Å; F117-R121 PolarHBondContact O-N 2.86Å; F117-R121 VanDerWaalsContact O-N 3.13Å; F117-I184 HydrophobicContact CB-CD1 4.18Å; F117-I184 HydrophobicContact CD2-CD1 3.79Å; F117-I184 HydrophobicContact CD2-CG1 3.87Å; F117-I184 HydrophobicContact CE2-CG1 4.4Å; F117-I184 HydrophobicContact CG-CD1 4.44Å
118Q76.7Confident81.6Confident19 Ų1920 Ų209%0.08911%0.114CC..Hα-helixtrans-64-36.8179.4-71.9171.933.600111.9A114 S115 S116 E314A114-Q118 VanDerWaalsContact O-CG 3.28Å; A114-Q118 WeakPolarHBondContact O-CG 3.2Å; A114-Q118 PolarHBondContact O-N 3.21Å; A114-Q118 VanDerWaalsContact O-N 3.13Å; S115-Q118 PolarHBondContact O-N 3.1Å; S116-Q118 PolarHBondContact O-N 3.27Å; Q118-E314 PolarHBondContact NE2-OE1 3.11Å
119M80.1Confident81.7Confident6 Ų620 Ų203%0.0311%0.114CC..Hα-helixtrans-73-45.8-179.5-66.7179.2-167.600112.1S115 S116 F117 R121 G122 V158 Q320 F324 L327S115-M119 VanDerWaalsContact O-CG 3.22Å; S115-M119 WeakPolarHBondContact O-CG 3.3Å; S115-M119 PolarHBondContact O-N 3.33Å; S116-M119 PolarHBondContact O-N 2.99Å; F117-M119 VanDerWaalsContact C-N 3.3Å; F117-M119 PolarHBondContact O-N 3.43Å; M119-R121 PolarHBondContact O-N 3.45Å; M119-G122 PolarHBondContact O-N 2.76Å; M119-V158 HydrophobicContact CB-CG1 4.06Å; M119-V158 HydrophobicContact CB-CG2 4.16Å; M119-V158 HydrophobicContact SD-CG1 4.15Å; M119-V158 HydrophobicContact SD-CG2 3.86Å; M119-Q320 HydrophobicContact CE-CB 3.87Å; M119-Q320 HydrophobicContact SD-CB 4.07Å; M119-F324 HydrophobicContact CE-CB 3.85Å; M119-F324 HydrophobicContact CE-CD2 4.45Å; M119-F324 HydrophobicContact CE-CG 4.22Å; M119-F324 HydrophobicContact CG-CB 4.35Å; M119-F324 HydrophobicContact CG-CD2 3.8Å; M119-F324 HydrophobicContact CG-CG 4.4Å; M119-F324 HydrophobicContact SD-CB 4.03Å; M119-L327 HydrophobicContact CB-CD1 4.05Å
120L85.1Confident82.3Confident4 Ų421 Ų212%0.02112%0.119CC..Hα-helixtrans-67.3-25.6179.6-70.8175.6000112.5S116 G122 A123 L155 D181 I184S116-L120 WeakPolarHBondContact O-CB 3.2Å; S116-L120 VanDerWaalsContact O-CG 3.3Å; S116-L120 WeakPolarHBondContact O-CG 3.37Å; S116-L120 PolarHBondContact O-N 3.29Å; L120-G122 PolarHBondContact O-N 3.35Å; L120-A123 WeakPolarHBondContact O-CB 3.17Å; L120-A123 PolarHBondContact O-N 3.14Å; L120-L155 HydrophobicContact CD2-CD2 3.89Å; L120-D181 HydrophobicContact CD1-CB 3.56Å; L120-D181 WeakPolarHBondContact CD1-OD1 3.14Å; L120-I184 HydrophobicContact CB-CB 4.24Å; L120-I184 HydrophobicContact CB-CD1 4.43Å; L120-I184 HydrophobicContact CB-CG2 3.56Å; L120-I184 HydrophobicContact CD1-CB 4.36Å; L120-I184 HydrophobicContact CD1-CD1 3.86Å
121R83.6Confident83Confident45 Ų4519.9 Ų19.917%0.1711%0.112CC..Hα-helixtrans-58.3-29.2169.8-171.6174.8-78.9173.2-13.8112.6M105 F117 M119 A123 V124 Q188M105-R121 PolarHBondContact SD-NH2 3.07Å; F117-R121 VanDerWaalsContact CE1-CZ 3.43Å; F117-R121 PolarHBondContact O-N 2.86Å; F117-R121 VanDerWaalsContact O-N 3.13Å; M119-R121 PolarHBondContact O-N 3.45Å; R121-A123 PolarHBondContact O-N 2.95Å; R121-A123 VanDerWaalsContact O-N 3.1Å; R121-V124 WeakPolarHBondContact O-CB 3.2Å; R121-V124 VanDerWaalsContact O-CG1 3.27Å; R121-V124 WeakPolarHBondContact O-CG1 3.28Å; R121-V124 PolarHBondContact O-N 3.38Å; R121-Q188 PolarHBondContact O-OE1 3.11Å
122G80.9Confident83.4Confident10 Ų1019.2 Ų19.210%0.10311%0.109CC..THydrogen-bonded Turntrans-59.4-19.1172.800000114.2M119 L120 V124 I125M119-G122 PolarHBondContact O-N 2.76Å; L120-G122 PolarHBondContact O-N 3.35Å; G122-V124 PolarHBondContact O-N 2.94Å; G122-I125 VanDerWaalsContact O-CG2 3.26Å; G122-I125 WeakPolarHBondContact O-CG2 3.46Å; G122-I125 PolarHBondContact O-N 2.67Å
123A87.2Confident83.8Confident0 Ų021.2 Ų21.20%012%0.121CC..THydrogen-bonded Turntrans-61.4-23176.500000113.6L120 R121 I125 I126 F127 L155 Q188L120-A123 WeakPolarHBondContact O-CB 3.17Å; L120-A123 PolarHBondContact O-N 3.14Å; R121-A123 PolarHBondContact O-N 2.95Å; R121-A123 VanDerWaalsContact O-N 3.1Å; A123-I125 PolarHBondContact O-N 3.34Å; A123-I125 VanDerWaalsContact O-N 3.08Å; A123-I126 WeakPolarHBondContact O-CB 2.87Å; A123-I126 PolarHBondContact O-N 2.96Å; A123-F127 HydrophobicContact CB-CE2 4.35Å; A123-L155 HydrophobicContact CB-CD1 3.47Å; A123-L155 VanDerWaalsContact CB-CD1 3.47Å; A123-L155 HydrophobicContact CB-CD2 3.84Å; A123-L155 HydrophobicContact CB-CG 4.3Å; A123-Q188 HydrophobicContact CB-CB 4.42Å; A123-Q188 HydrophobicContact CB-CG 4.22Å
124V89.3Confident84.3Confident4 Ų422.8 Ų22.82%0.02414%0.137CC..Hα-helixtrans-55.1-29.7-179.672.80000112.6R121 G122 I126 F127 T128 Q188 A191 A192 M294R121-V124 WeakPolarHBondContact O-CB 3.2Å; R121-V124 VanDerWaalsContact O-CG1 3.27Å; R121-V124 WeakPolarHBondContact O-CG1 3.28Å; R121-V124 PolarHBondContact O-N 3.38Å; G122-V124 PolarHBondContact O-N 2.94Å; V124-I126 VanDerWaalsContact C-N 3.31Å; V124-I126 PolarHBondContact O-N 3.27Å; V124-F127 PolarHBondContact O-N 3.21Å; V124-T128 VanDerWaalsContact O-CB 3.23Å; V124-T128 WeakPolarHBondContact O-CB 3.2Å; V124-T128 PolarHBondContact O-N 3.46Å; V124-T128 PolarHBondContact O-OG1 3.47Å; V124-Q188 HydrophobicContact CB-CB 4.33Å; V124-A191 HydrophobicContact CG2-CB 4.23Å; V124-A192 HydrophobicContact CG2-CB 4.16Å; V124-M294 HydrophobicContact CB-SD 4.26Å; V124-M294 HydrophobicContact CG1-CB 4.34Å; V124-M294 HydrophobicContact CG1-CG 4.2Å; V124-M294 HydrophobicContact CG1-SD 3.51Å; V124-M294 VanDerWaalsContact CG1-SD 3.51Å; V124-M294 HydrophobicContact CG2-SD 3.7Å
125I87.3Confident84.8Confident1 Ų126.2 Ų26.21%0.00514%0.143CC..Hα-helixtrans-62.8-36.5178.4-162.2174.5000112.4G122 A123 G129 T151 V295 A331 Y334G122-I125 VanDerWaalsContact O-CG2 3.26Å; G122-I125 WeakPolarHBondContact O-CG2 3.46Å; G122-I125 PolarHBondContact O-N 2.67Å; A123-I125 PolarHBondContact O-N 3.34Å; A123-I125 VanDerWaalsContact O-N 3.08Å; I125-G129 PolarHBondContact O-N 3.4Å; I125-T151 HydrophobicContact CG2-CG2 3.81Å; I125-V295 HydrophobicContact CD1-CG2 3.64Å; I125-A331 HydrophobicContact CD1-CB 4.16Å; I125-Y334 HydrophobicContact CD1-CD1 3.99Å; I125-Y334 HydrophobicContact CD1-CG 3.95Å; I125-Y334 HydrophobicContact CG1-CD1 4.41Å; I125-Y334 HydrophobicContact CG1-CG 4.46Å
126I89.9Confident85.2Confident11 Ų1127.8 Ų27.86%0.05615%0.15CC..Hα-helixtrans-66.8-53.4-179-65.4156000108.9A123 V124 G129 L130 I148 T151 I152 L155A123-I126 WeakPolarHBondContact O-CB 2.87Å; A123-I126 PolarHBondContact O-N 2.96Å; V124-I126 VanDerWaalsContact C-N 3.31Å; V124-I126 PolarHBondContact O-N 3.27Å; I126-G129 PolarHBondContact O-N 3.14Å; I126-L130 HydrophobicContact CG2-CD1 4.06Å; I126-L130 WeakPolarHBondContact O-CG 3.33Å; I126-L130 PolarHBondContact O-N 2.83Å; I126-I148 HydrophobicContact CG1-CG2 4.26Å; I126-I148 HydrophobicContact CG2-CG2 4.04Å; I126-T151 HydrophobicContact CD1-CG2 3.69Å; I126-T151 HydrophobicContact CG1-CG2 3.97Å; I126-I152 HydrophobicContact CD1-CG1 3.59Å; I126-I152 HydrophobicContact CG1-CG1 4.23Å; I126-I152 HydrophobicContact CG2-CD1 4.49Å; I126-L155 HydrophobicContact CD1-CD1 3.52Å
127F92.3Very high85.2Confident56 Ų5630.7 Ų30.725%0.24618%0.18CC..Hα-helixtrans-66.8-40.6-178.4-59.8-63.1000111.7A123 V124 G129 L130 L131 I185 Q188 V189 A192A123-F127 HydrophobicContact CB-CE2 4.35Å; V124-F127 PolarHBondContact O-N 3.21Å; F127-G129 VanDerWaalsContact C-N 3.35Å; F127-G129 PolarHBondContact O-N 3.44Å; F127-L130 PolarHBondContact O-N 2.88Å; F127-L131 VanDerWaalsContact O-CB 3.25Å; F127-L131 WeakPolarHBondContact O-CB 3.45Å; F127-L131 VanDerWaalsContact O-CG 3.22Å; F127-L131 WeakPolarHBondContact O-CG 3.49Å; F127-L131 PolarHBondContact O-N 3.24Å; F127-I185 HydrophobicContact CE2-CG2 4.15Å; F127-I185 HydrophobicContact CZ-CG2 4.07Å; F127-Q188 HydrophobicContact CD2-CB 4.31Å; F127-Q188 HydrophobicContact CE2-CB 4.47Å; F127-V189 HydrophobicContact CD1-CG2 3.85Å; F127-V189 HydrophobicContact CD2-CG2 3.84Å; F127-V189 HydrophobicContact CE1-CG2 3.71Å; F127-V189 HydrophobicContact CE2-CG2 3.7Å; F127-V189 HydrophobicContact CG-CG2 3.91Å; F127-V189 HydrophobicContact CZ-CG2 3.63Å; F127-A192 HydrophobicContact CB-CB 3.46Å; F127-A192 VanDerWaalsContact CB-CB 3.46Å
128T89.8Confident85Confident0 Ų033.7 Ų33.70%019%0.191CC..Hα-helixtrans-63.3-42.5177.5-56.60000110.9V124 S132 A192 M195 V196 A290 T291 M294V124-T128 VanDerWaalsContact O-CB 3.23Å; V124-T128 WeakPolarHBondContact O-CB 3.2Å; V124-T128 PolarHBondContact O-N 3.46Å; V124-T128 PolarHBondContact O-OG1 3.47Å; T128-S132 WeakPolarHBondContact O-CB 3.44Å; T128-S132 PolarHBondContact O-N 3.48Å; T128-S132 PolarHBondContact O-OG 2.84Å; T128-A192 WeakPolarHBondContact OG1-CB 3.45Å; T128-M195 HydrophobicContact CG2-CB 4.34Å; T128-V196 HydrophobicContact CG2-CG2 4.18Å; T128-A290 HydrophobicContact CG2-CB 4.31Å; T128-T291 HydrophobicContact CG2-CG2 4.27Å; T128-M294 HydrophobicContact CG2-CG 4.11Å
129G86.9Confident85.1Confident0 Ų043.5 Ų43.50%023%0.228CC..Hα-helixtrans-61.5-48.3176.300000112.5I125 I126 F127 S132 V133I125-G129 PolarHBondContact O-N 3.4Å; I126-G129 PolarHBondContact O-N 3.14Å; F127-G129 VanDerWaalsContact C-N 3.35Å; F127-G129 PolarHBondContact O-N 3.44Å; G129-S132 PolarHBondContact O-N 2.8Å; G129-V133 PolarHBondContact O-N 2.9Å
130L89.8Confident85Confident74 Ų7444.4 Ų44.439%0.38723%0.232SC..Hα-helixtrans-65.8-45.6179.2-67.6173.1000112.4I126 F127 S132 V133 A134 W145I126-L130 HydrophobicContact CG2-CD1 4.06Å; I126-L130 WeakPolarHBondContact O-CG 3.33Å; I126-L130 PolarHBondContact O-N 2.83Å; F127-L130 PolarHBondContact O-N 2.88Å; L130-S132 VanDerWaalsContact C-N 3.3Å; L130-S132 PolarHBondContact O-N 3.12Å; L130-V133 WeakPolarHBondContact O-CB 3.28Å; L130-V133 PolarHBondContact O-N 3.32Å; L130-A134 PolarHBondContact O-N 3.01Å; L130-W145 HydrophobicContact CD2-CH2 4.1Å; L130-W145 HydrophobicContact CD2-CZ3 4.33Å
131L90.6Very high84.8Confident38 Ų3847.5 Ų47.520%0.19925%0.251CS..Hα-helixtrans-66.6-32.1177.6-69.9170.6000111.7F127 V133 A134 F135 A192 V193 V196F127-L131 VanDerWaalsContact O-CB 3.25Å; F127-L131 WeakPolarHBondContact O-CB 3.45Å; F127-L131 VanDerWaalsContact O-CG 3.22Å; F127-L131 WeakPolarHBondContact O-CG 3.49Å; F127-L131 PolarHBondContact O-N 3.24Å; L131-V133 VanDerWaalsContact C-N 3.32Å; L131-V133 PolarHBondContact O-N 2.86Å; L131-A134 PolarHBondContact O-N 3.18Å; L131-F135 HydrophobicContact CB-CD2 4.31Å; L131-F135 HydrophobicContact CD2-CD2 4Å; L131-F135 HydrophobicContact CD2-CE2 3.66Å; L131-F135 WeakPolarHBondContact O-CB 3.33Å; L131-F135 WeakPolarHBondContact O-CD2 3.41Å; L131-F135 PolarHBondContact O-N 3.29Å; L131-A192 HydrophobicContact CD1-CB 3.91Å; L131-V193 HydrophobicContact CD1-CG2 3.77Å; L131-V196 HydrophobicContact CB-CB 4.49Å; L131-V196 HydrophobicContact CB-CG1 4.44Å; L131-V196 HydrophobicContact CB-CG2 3.8Å
132S85.1Confident84.6Confident1 Ų148.6 Ų48.61%0.00727%0.27CS..Hα-helixtrans-64-35.9173.6-65.70000112.4T128 G129 L130 L136 G137T128-S132 WeakPolarHBondContact O-CB 3.44Å; T128-S132 PolarHBondContact O-N 3.48Å; T128-S132 PolarHBondContact O-OG 2.84Å; G129-S132 PolarHBondContact O-N 2.8Å; L130-S132 VanDerWaalsContact C-N 3.3Å; L130-S132 PolarHBondContact O-N 3.12Å; S132-L136 WeakPolarHBondContact O-CA 3.45Å; S132-L136 VanDerWaalsContact O-CB 3.32Å; S132-L136 WeakPolarHBondContact O-CB 3.47Å; S132-L136 PolarHBondContact O-N 2.95Å; S132-L136 VanDerWaalsContact O-N 3.07Å; S132-G137 PolarHBondContact O-N 3.29Å
133V85.7Confident84.6Confident56 Ų5648.7 Ų48.734%0.33927%0.269SS..Hα-helixtrans-64.8-47172.6177.40000110.2G129 L130 L131 G137 R138 L140G129-V133 PolarHBondContact O-N 2.9Å; L130-V133 WeakPolarHBondContact O-CB 3.28Å; L130-V133 PolarHBondContact O-N 3.32Å; L131-V133 VanDerWaalsContact C-N 3.32Å; L131-V133 PolarHBondContact O-N 2.86Å; V133-G137 WeakPolarHBondContact O-CA 3.19Å; V133-G137 PolarHBondContact O-N 3.37Å; V133-R138 WeakPolarHBondContact CG2-O 3.48Å; V133-L140 HydrophobicContact CG2-CD1 3.53Å; V133-L140 HydrophobicContact CG2-CD2 4.28Å; V133-L140 HydrophobicContact CG2-CG 3.46Å; V133-L140 VanDerWaalsContact CG2-CG 3.46Å
134A86Confident84.3Confident77 Ų7750.7 Ų50.764%0.63628%0.279SS*.Hα-helixtrans-68.9-43.1-175.800000113.7L130 L131L130-A134 PolarHBondContact O-N 3.01Å; L131-A134 PolarHBondContact O-N 3.18Å
135F84.4Confident84.2Confident118 Ų11857 Ų5752%0.51830%0.302SS..Hα-helixtrans-102.9-25.1-170-73.4-78.3000115.1L131 V196L131-F135 HydrophobicContact CB-CD2 4.31Å; L131-F135 HydrophobicContact CD2-CD2 4Å; L131-F135 HydrophobicContact CD2-CE2 3.66Å; L131-F135 WeakPolarHBondContact O-CB 3.33Å; L131-F135 WeakPolarHBondContact O-CD2 3.41Å; L131-F135 PolarHBondContact O-N 3.29Å; F135-V196 HydrophobicContact CB-CG1 3.79Å; F135-V196 HydrophobicContact CD2-CG1 4.39Å; F135-V196 HydrophobicContact CG-CG1 4.36Å
136L81.3Confident84.2Confident51 Ų5160.5 Ų60.527%0.26732%0.323SS..Hα-helixtrans-108.9-6.4178.5-78.366.2000112.6S132 R138 V196 E199 K200S132-L136 WeakPolarHBondContact O-CA 3.45Å; S132-L136 VanDerWaalsContact O-CB 3.32Å; S132-L136 WeakPolarHBondContact O-CB 3.47Å; S132-L136 PolarHBondContact O-N 2.95Å; S132-L136 VanDerWaalsContact O-N 3.07Å; L136-R138 VanDerWaalsContact C-N 3.26Å; L136-R138 HydrophobicContact CB-CG 4.46Å; L136-R138 PolarHBondContact O-N 3.47Å; L136-V196 HydrophobicContact CD1-CG1 3.52Å; L136-E199 HydrophobicContact CD2-CB 4.16Å; L136-E199 VanDerWaalsContact CD2-CD 3.45Å; L136-E199 HydrophobicContact CD2-CG 3.63Å; L136-E199 WeakPolarHBondContact CD2-OE2 3.25Å; L136-K200 HydrophobicContact CD1-CB 4.3Å
137G76.4Confident84Confident62 Ų6260 Ų6064%0.63932%0.321SS*.  trans69.521.1178.500000114S132 V133S132-G137 PolarHBondContact O-N 3.29Å; V133-G137 WeakPolarHBondContact O-CA 3.19Å; V133-G137 PolarHBondContact O-N 3.37Å
138R76.4Confident83.7Confident74 Ų7457.6 Ų57.628%0.27931%0.311SS..PPolyproline II helixtrans-69.4145.5176.7-76.2-173.2171.9146.9-0.6110.9V133 L136 E199V133-R138 WeakPolarHBondContact CG2-O 3.48Å; L136-R138 VanDerWaalsContact C-N 3.26Å; L136-R138 HydrophobicContact CB-CG 4.46Å; L136-R138 PolarHBondContact O-N 3.47Å; R138-E199 IonicContact CZ-OE1 3.78Å; R138-E199 IonicContact CZ-OE2 3.85Å; R138-E199 IonicContact NH1-OE1 2.97Å; R138-E199 PolarHBondContact NH1-OE1 3.07Å; R138-E199 IonicContact NH1-OE2 3.47Å; R138-E199 PolarHBondContact NH1-OE2 2.71Å; R138-E199 IonicContact NH2-OE1 2.67Å; R138-E199 PolarHBondContact NH2-OE1 3.25Å; R138-E199 IonicContact NH2-OE2 3.98Å
139R79.1Confident83.8Confident226 Ų22664.6 Ų64.685%0.85334%0.341SS*.PPolyproline II helixtrans-98.8122.6168.9-64.6-173.4-179-1794.1109
140L77.5Confident83.9Confident25 Ų2565.9 Ų65.913%0.13135%0.349CS..PPolyproline II helixtrans-79.9129.5175.6-65.3171.5000109.7V133 Q144 W145 I148 Y334V133-L140 HydrophobicContact CG2-CD1 3.53Å; V133-L140 HydrophobicContact CG2-CD2 4.28Å; V133-L140 HydrophobicContact CG2-CG 3.46Å; V133-L140 VanDerWaalsContact CG2-CG 3.46Å; L140-Q144 VanDerWaalsContact CA-OE1 3.26Å; L140-Q144 HydrophobicContact CB-CB 4.24Å; L140-Q144 HydrophobicContact CD2-CB 4.19Å; L140-Q144 VanDerWaalsContact CD2-OE1 3.24Å; L140-W145 HydrophobicContact CD1-CZ2 4.19Å; L140-I148 HydrophobicContact CD1-CD1 3.97Å; L140-Y334 HydrophobicContact CD2-CE2 4.26Å; L140-Y334 VanDerWaalsContact CD2-OH 3.23Å; L140-Y334 WeakPolarHBondContact CD2-OH 3.32Å
141V81.2Confident83.8Confident68 Ų6862.4 Ų62.441%0.41233%0.331SS..PPolyproline II helixtrans-72.4160.3174-67.70000110.9S143 Q144 W145V141-S143 VanDerWaalsContact CG2-OG 3.32Å; V141-S143 WeakPolarHBondContact CG2-OG 3.38Å; V141-S143 PolarHBondContact O-N 3.1Å; V141-Q144 HydrophobicContact CG2-CB 4.1Å; V141-Q144 HydrophobicContact CG2-CG 3.67Å; V141-Q144 VanDerWaalsContact N-OE1 3.13Å; V141-Q144 WeakPolarHBondContact O-CB 3.36Å; V141-Q144 PolarHBondContact O-N 2.97Å; V141-W145 PolarHBondContact O-N 2.84Å
142A80.5Confident83.7Confident68 Ų6864.3 Ų64.356%0.56234%0.341SS*.Hα-helixtrans-54.6-39.1-178.100000112.9Q144 W145 T146A142-Q144 VanDerWaalsContact C-N 3.31Å; A142-Q144 PolarHBondContact O-N 3.43Å; A142-W145 WeakPolarHBondContact O-CB 3.31Å; A142-W145 PolarHBondContact O-N 3.36Å; A142-T146 PolarHBondContact O-N 2.96Å; A142-T146 PolarHBondContact O-OG1 2.78Å; A142-T146 VanDerWaalsContact O-OG1 3.14Å
143S79.6Confident84Confident13 Ų1368.5 Ų68.59%0.09136%0.362CS..Hα-helixtrans-64.3-31.517756.90000114.1V141 G147 H338V141-S143 VanDerWaalsContact CG2-OG 3.32Å; V141-S143 WeakPolarHBondContact CG2-OG 3.38Å; V141-S143 PolarHBondContact O-N 3.1Å; S143-G147 PolarHBondContact O-N 3.35Å; S143-H338 VanDerWaalsContact CB-CE1 3.44Å; S143-H338 WeakPolarHBondContact CB-CE1 3.38Å
144Q82.4Confident84.1Confident42 Ų4265.9 Ų65.920%0.19635%0.346CS..Hα-helixtrans-70.1-39.5173.9-76.3170.9-18.100111.5L140 V141 A142 G147 I148 Y334L140-Q144 VanDerWaalsContact CA-OE1 3.26Å; L140-Q144 HydrophobicContact CB-CB 4.24Å; L140-Q144 HydrophobicContact CD2-CB 4.19Å; L140-Q144 VanDerWaalsContact CD2-OE1 3.24Å; V141-Q144 HydrophobicContact CG2-CB 4.1Å; V141-Q144 HydrophobicContact CG2-CG 3.67Å; V141-Q144 VanDerWaalsContact N-OE1 3.13Å; V141-Q144 WeakPolarHBondContact O-CB 3.36Å; V141-Q144 PolarHBondContact O-N 2.97Å; A142-Q144 VanDerWaalsContact C-N 3.31Å; A142-Q144 PolarHBondContact O-N 3.43Å; Q144-G147 PolarHBondContact O-N 3.45Å; Q144-I148 WeakPolarHBondContact O-CG1 3.38Å; Q144-I148 PolarHBondContact O-N 2.62Å; Q144-Y334 HydrophobicContact CB-CD2 3.77Å; Q144-Y334 HydrophobicContact CB-CE2 3.63Å; Q144-Y334 HydrophobicContact CB-CG 4.41Å; Q144-Y334 HydrophobicContact CG-CD1 4.21Å; Q144-Y334 HydrophobicContact CG-CD2 3.94Å; Q144-Y334 HydrophobicContact CG-CE1 4.08Å; Q144-Y334 HydrophobicContact CG-CE2 3.85Å; Q144-Y334 HydrophobicContact CG-CG 4.12Å; Q144-Y334 VanDerWaalsContact CG-O 3.24Å; Q144-Y334 WeakPolarHBondContact CG-O 3.42Å; Q144-Y334 VanDerWaalsContact O-CD2 3.31Å; Q144-Y334 WeakPolarHBondContact O-CD2 3.39Å
145W85.6Confident84.1Confident136 Ų13663.3 Ų63.352%0.51532%0.322SS..Hα-helixtrans-62.8-43.4172.8-79.5103.9000112.3L130 L140 V141 A142 G147 I148 F149L130-W145 HydrophobicContact CD2-CH2 4.1Å; L130-W145 HydrophobicContact CD2-CZ3 4.33Å; L140-W145 HydrophobicContact CD1-CZ2 4.19Å; V141-W145 PolarHBondContact O-N 2.84Å; A142-W145 WeakPolarHBondContact O-CB 3.31Å; A142-W145 PolarHBondContact O-N 3.36Å; W145-G147 VanDerWaalsContact C-N 3.32Å; W145-G147 PolarHBondContact O-N 3.36Å; W145-I148 PolarHBondContact O-N 3.48Å; W145-F149 PolarHBondContact O-N 2.87Å
146T86.9Confident84.3Confident74 Ų7461.3 Ų61.345%0.45432%0.319SS..Hα-helixtrans-61-42.7173.3-50.40000111.2A142 I148 F149 V150 L333A142-T146 PolarHBondContact O-N 2.96Å; A142-T146 PolarHBondContact O-OG1 2.78Å; A142-T146 VanDerWaalsContact O-OG1 3.14Å; T146-I148 PolarHBondContact O-N 3Å; T146-F149 PolarHBondContact O-N 2.97Å; T146-V150 HydrophobicContact CG2-CG2 4.45Å; T146-V150 WeakPolarHBondContact O-CG2 3.41Å; T146-V150 PolarHBondContact O-N 2.88Å; T146-L333 HydrophobicContact CG2-CD1 4.41Å
147G85.9Confident84.6Confident0 Ų061.1 Ų61.10%032%0.317CS..Hα-helixtrans-60.1-43.9175.700000113.4S143 Q144 W145 V150 T151 G330S143-G147 PolarHBondContact O-N 3.35Å; Q144-G147 PolarHBondContact O-N 3.45Å; W145-G147 VanDerWaalsContact C-N 3.32Å; W145-G147 PolarHBondContact O-N 3.36Å; G147-V150 PolarHBondContact O-N 2.92Å; G147-T151 WeakPolarHBondContact O-CB 3.35Å; G147-T151 PolarHBondContact O-N 3.1Å; G147-T151 PolarHBondContact O-OG1 2.96Å; G147-G330 VanDerWaalsContact CA-O 3.23Å; G147-G330 WeakPolarHBondContact CA-O 3.39Å
148I87.7Confident84.9Confident7 Ų758.1 Ų58.14%0.03629%0.287CS..Hα-helixtrans-59.4-48.5174.1-72.4171.1000110.5I126 L140 Q144 W145 T146 V150 T151 I152 Y334I126-I148 HydrophobicContact CG1-CG2 4.26Å; I126-I148 HydrophobicContact CG2-CG2 4.04Å; L140-I148 HydrophobicContact CD1-CD1 3.97Å; Q144-I148 WeakPolarHBondContact O-CG1 3.38Å; Q144-I148 PolarHBondContact O-N 2.62Å; W145-I148 PolarHBondContact O-N 3.48Å; T146-I148 PolarHBondContact O-N 3Å; I148-V150 PolarHBondContact O-N 3.4Å; I148-T151 WeakPolarHBondContact O-CB 3.4Å; I148-T151 PolarHBondContact O-N 3.01Å; I148-I152 HydrophobicContact CG2-CD1 3.97Å; I148-I152 WeakPolarHBondContact O-CG1 3.09Å; I148-I152 PolarHBondContact O-N 3.08Å; I148-Y334 HydrophobicContact CD1-CD2 4.46Å; I148-Y334 HydrophobicContact CD1-CE2 3.93Å; I148-Y334 HydrophobicContact CG1-CD2 3.9Å; I148-Y334 HydrophobicContact CG1-CE2 3.85Å
149F90.1Very high85.2Confident146 Ų14655.9 Ų55.964%0.6429%0.287SS*.Hα-helixtrans-60.1-46.5-179.3178.4-98.4000112.4W145 T146 T151 I152 L153W145-F149 PolarHBondContact O-N 2.87Å; T146-F149 PolarHBondContact O-N 2.97Å; F149-T151 VanDerWaalsContact C-N 3.3Å; F149-T151 PolarHBondContact O-N 3.4Å; F149-I152 PolarHBondContact O-N 2.96Å; F149-L153 PolarHBondContact O-N 3.17Å; F149-L153 VanDerWaalsContact O-N 3.08Å
150V89.9Confident85.4Confident27 Ų2749.5 Ų49.516%0.16427%0.269CS..Hα-helixtrans-64-37.6177.1174.50000111.1T146 G147 I148 L153 G154 V326 V329 L333T146-V150 HydrophobicContact CG2-CG2 4.45Å; T146-V150 WeakPolarHBondContact O-CG2 3.41Å; T146-V150 PolarHBondContact O-N 2.88Å; G147-V150 PolarHBondContact O-N 2.92Å; I148-V150 PolarHBondContact O-N 3.4Å; V150-L153 WeakPolarHBondContact O-CB 3.26Å; V150-L153 PolarHBondContact O-N 3.45Å; V150-G154 PolarHBondContact O-N 3.49Å; V150-V326 HydrophobicContact CG1-CG1 3.93Å; V150-V326 WeakPolarHBondContact CG1-O 3.29Å; V150-V326 WeakPolarHBondContact O-CG1 3.47Å; V150-V329 HydrophobicContact CG1-CG1 4.36Å; V150-L333 HydrophobicContact CB-CD1 4.43Å; V150-L333 HydrophobicContact CG2-CD1 3.98Å
151T87.4Confident85.6Confident2 Ų248.4 Ų48.41%0.01226%0.263CS..Hα-helixtrans-63.6-42.4175.9-52.80000111.3I125 I126 G147 I148 F149 L153 G154 L155 L327I125-T151 HydrophobicContact CG2-CG2 3.81Å; I126-T151 HydrophobicContact CD1-CG2 3.69Å; I126-T151 HydrophobicContact CG1-CG2 3.97Å; G147-T151 WeakPolarHBondContact O-CB 3.35Å; G147-T151 PolarHBondContact O-N 3.1Å; G147-T151 PolarHBondContact O-OG1 2.96Å; I148-T151 WeakPolarHBondContact O-CB 3.4Å; I148-T151 PolarHBondContact O-N 3.01Å; F149-T151 VanDerWaalsContact C-N 3.3Å; F149-T151 PolarHBondContact O-N 3.4Å; T151-L153 VanDerWaalsContact C-N 3.32Å; T151-L153 PolarHBondContact O-N 3.28Å; T151-G154 PolarHBondContact O-N 2.95Å; T151-L155 WeakPolarHBondContact O-CG 3.33Å; T151-L155 PolarHBondContact O-N 3.23Å; T151-L327 HydrophobicContact CG2-CD2 3.65Å; T151-L327 VanDerWaalsContact O-CD2 3.26Å; T151-L327 WeakPolarHBondContact O-CD2 3.39Å
152I89.8Confident85.4Confident78 Ų7845.7 Ų45.740%0.425%0.247SC..Hα-helixtrans-60.2-43.6175.3-67.2168.3000110.7I126 I148 F149 G154 L155 V156I126-I152 HydrophobicContact CD1-CG1 3.59Å; I126-I152 HydrophobicContact CG1-CG1 4.23Å; I126-I152 HydrophobicContact CG2-CD1 4.49Å; I148-I152 HydrophobicContact CG2-CD1 3.97Å; I148-I152 WeakPolarHBondContact O-CG1 3.09Å; I148-I152 PolarHBondContact O-N 3.08Å; F149-I152 PolarHBondContact O-N 2.96Å; I152-G154 VanDerWaalsContact C-N 3.31Å; I152-G154 PolarHBondContact O-N 3.03Å; I152-L155 PolarHBondContact O-N 3.45Å; I152-V156 WeakPolarHBondContact O-CG2 3.22Å; I152-V156 PolarHBondContact O-N 2.98Å
153L90.4Very high85.3Confident89 Ų8946.9 Ų46.947%0.46624%0.239SC..Hα-helixtrans-59.4-43.2176-176.165.6000111.5F149 V150 T151 V156 M157F149-L153 PolarHBondContact O-N 3.17Å; F149-L153 VanDerWaalsContact O-N 3.08Å; V150-L153 WeakPolarHBondContact O-CB 3.26Å; V150-L153 PolarHBondContact O-N 3.45Å; T151-L153 VanDerWaalsContact C-N 3.32Å; T151-L153 PolarHBondContact O-N 3.28Å; L153-V156 PolarHBondContact O-N 3.4Å; L153-M157 HydrophobicContact CG-SD 4.45Å; L153-M157 WeakPolarHBondContact O-CG 3.38Å; L153-M157 PolarHBondContact O-N 3.26Å
154G87.9Confident85.3Confident0 Ų051.1 Ų51.10%026%0.26CS..Hα-helixtrans-59.9-44.5175.300000113V150 T151 I152 V156 M157 V158V150-G154 PolarHBondContact O-N 3.49Å; T151-G154 PolarHBondContact O-N 2.95Å; I152-G154 VanDerWaalsContact C-N 3.31Å; I152-G154 PolarHBondContact O-N 3.03Å; G154-V156 PolarHBondContact O-N 3.43Å; G154-M157 PolarHBondContact O-N 3.07Å; G154-V158 WeakPolarHBondContact O-CG2 3.49Å; G154-V158 PolarHBondContact O-N 3.12Å
155L86.4Confident84.5Confident24 Ų2452.2 Ų52.213%0.12627%0.272CS..Hα-helixtrans-61.8-44.1176.7-68.2174.8000112.1L120 A123 I126 T151 I152 M157 V158 G159 L327L120-L155 HydrophobicContact CD2-CD2 3.89Å; A123-L155 HydrophobicContact CB-CD1 3.47Å; A123-L155 VanDerWaalsContact CB-CD1 3.47Å; A123-L155 HydrophobicContact CB-CD2 3.84Å; A123-L155 HydrophobicContact CB-CG 4.3Å; I126-L155 HydrophobicContact CD1-CD1 3.52Å; T151-L155 WeakPolarHBondContact O-CG 3.33Å; T151-L155 PolarHBondContact O-N 3.23Å; I152-L155 PolarHBondContact O-N 3.45Å; L155-M157 VanDerWaalsContact C-N 3.3Å; L155-M157 PolarHBondContact O-N 3.3Å; L155-V158 PolarHBondContact O-N 3.46Å; L155-G159 PolarHBondContact O-N 3.19Å; L155-L327 HydrophobicContact CD2-CD1 4.41Å; L155-L327 HydrophobicContact CD2-CD2 3.82Å; L155-L327 HydrophobicContact CG-CD2 3.8Å
156V87.9Confident83.4Confident76 Ų7646.8 Ų46.846%0.46126%0.259SS..Hα-helixtrans-61.8-41.1177.1172.80000110.6I152 L153 G154 G159 L160I152-V156 WeakPolarHBondContact O-CG2 3.22Å; I152-V156 PolarHBondContact O-N 2.98Å; L153-V156 PolarHBondContact O-N 3.4Å; G154-V156 PolarHBondContact O-N 3.43Å; V156-G159 PolarHBondContact O-N 3.33Å; V156-L160 HydrophobicContact CG1-CD1 3.82Å; V156-L160 HydrophobicContact CG1-CG 4.29Å; V156-L160 WeakPolarHBondContact O-CB 3.4Å; V156-L160 VanDerWaalsContact O-CG 3.24Å; V156-L160 WeakPolarHBondContact O-CG 3.45Å; V156-L160 PolarHBondContact O-N 3.05Å
157M87Confident82Confident46 Ų4648.6 Ų48.623%0.22727%0.265CS..Hα-helixtrans-63.7-41.3176.5-72.2179.666.300112.8L153 G154 L155 A161 L322 V326L153-M157 HydrophobicContact CG-SD 4.45Å; L153-M157 WeakPolarHBondContact O-CG 3.38Å; L153-M157 PolarHBondContact O-N 3.26Å; G154-M157 PolarHBondContact O-N 3.07Å; L155-M157 VanDerWaalsContact C-N 3.3Å; L155-M157 PolarHBondContact O-N 3.3Å; M157-A161 WeakPolarHBondContact O-CB 3.43Å; M157-A161 PolarHBondContact O-N 3.33Å; M157-L322 HydrophobicContact CE-CB 4.45Å; M157-L322 HydrophobicContact CE-CD2 3.45Å; M157-L322 VanDerWaalsContact CE-CD2 3.45Å; M157-L322 HydrophobicContact CE-CG 3.61Å; M157-V326 HydrophobicContact SD-CG2 4.11Å
158V83.5Confident80.6Confident0 Ų057.5 Ų57.50%030%0.304CS..Hα-helixtrans-63.6-49.4176.2173.50000110.5M119 G154 L155 L160 A161 D162 L327M119-V158 HydrophobicContact CB-CG1 4.06Å; M119-V158 HydrophobicContact CB-CG2 4.16Å; M119-V158 HydrophobicContact SD-CG1 4.15Å; M119-V158 HydrophobicContact SD-CG2 3.86Å; G154-V158 WeakPolarHBondContact O-CG2 3.49Å; G154-V158 PolarHBondContact O-N 3.12Å; L155-V158 PolarHBondContact O-N 3.46Å; V158-L160 VanDerWaalsContact C-N 3.33Å; V158-L160 PolarHBondContact O-N 2.94Å; V158-A161 VanDerWaalsContact O-CB 3.32Å; V158-A161 WeakPolarHBondContact O-CB 3.4Å; V158-A161 PolarHBondContact O-N 3.46Å; V158-D162 PolarHBondContact O-N 3.06Å; V158-D162 VanDerWaalsContact O-N 3.08Å; V158-L327 HydrophobicContact CG2-CD1 4.08Å
159G82.1Confident79Confident27 Ų2762.3 Ų62.328%0.27833%0.33SS..Hα-helixtrans-62.6-36.7178.200000113.5L155 V156 A161 D162 F163L155-G159 PolarHBondContact O-N 3.19Å; V156-G159 PolarHBondContact O-N 3.33Å; G159-A161 VanDerWaalsContact C-N 3.35Å; G159-D162 PolarHBondContact O-N 3.31Å; G159-F163 WeakPolarHBondContact O-CB 3.38Å; G159-F163 PolarHBondContact O-N 2.85Å
160L83.9Confident77.6Confident92 Ų9261.6 Ų61.648%0.48233%0.333SS..Hα-helixtrans-67.6-34.9172.7-73.3171.8000112.2V156 V158 D162 F163 I164V156-L160 HydrophobicContact CG1-CD1 3.82Å; V156-L160 HydrophobicContact CG1-CG 4.29Å; V156-L160 WeakPolarHBondContact O-CB 3.4Å; V156-L160 VanDerWaalsContact O-CG 3.24Å; V156-L160 WeakPolarHBondContact O-CG 3.45Å; V156-L160 PolarHBondContact O-N 3.05Å; V158-L160 VanDerWaalsContact C-N 3.33Å; V158-L160 PolarHBondContact O-N 2.94Å; L160-D162 VanDerWaalsContact C-N 3.33Å; L160-F163 PolarHBondContact O-N 3.36Å; L160-I164 WeakPolarHBondContact O-CB 3.23Å; L160-I164 VanDerWaalsContact O-CG1 3.24Å; L160-I164 WeakPolarHBondContact O-CG1 3.38Å; L160-I164 PolarHBondContact O-N 3.05Å
161A81.5Confident76.2Confident1 Ų164.6 Ų64.61%0.00836%0.355CS..Hα-helixtrans-64.2-41.117700000111.6M157 V158 G159 S165 L319 Q320M157-A161 WeakPolarHBondContact O-CB 3.43Å; M157-A161 PolarHBondContact O-N 3.33Å; V158-A161 VanDerWaalsContact O-CB 3.32Å; V158-A161 WeakPolarHBondContact O-CB 3.4Å; V158-A161 PolarHBondContact O-N 3.46Å; G159-A161 VanDerWaalsContact C-N 3.35Å; A161-S165 VanDerWaalsContact O-CB 3.25Å; A161-S165 WeakPolarHBondContact O-CB 3.34Å; A161-S165 PolarHBondContact O-N 2.97Å; A161-S165 PolarHBondContact O-OG 2.88Å; A161-L319 HydrophobicContact CB-CB 4.07Å; A161-L319 HydrophobicContact CB-CD2 3.53Å; A161-L319 HydrophobicContact CB-CG 3.64Å; A161-Q320 HydrophobicContact CB-CG 4.38Å
162D77.4Confident74.8Confident12 Ų1272.1 Ų72.16%0.06439%0.39CS..Hα-helixtrans-70.2-39.1177.8-65.6-25.2000111.2S116 V158 G159 L160 S165 G166 V177 Q320S116-D162 WeakPolarHBondContact CB-OD2 3.38Å; S116-D162 PolarHBondContact OG-OD1 3.37Å; S116-D162 VanDerWaalsContact OG-OD1 3.12Å; S116-D162 PolarHBondContact OG-OD2 2.95Å; V158-D162 PolarHBondContact O-N 3.06Å; V158-D162 VanDerWaalsContact O-N 3.08Å; G159-D162 PolarHBondContact O-N 3.31Å; L160-D162 VanDerWaalsContact C-N 3.33Å; D162-S165 PolarHBondContact O-N 2.91Å; D162-G166 PolarHBondContact O-N 2.68Å; D162-V177 HydrophobicContact CB-CG1 4.19Å; D162-Q320 PolarHBondContact OD1-NE2 3.01Å
163F78.4Confident73.9Confident93 Ų9374 Ų7441%0.40840%0.395SS..Hα-helixtrans-60-47.1172.4-177.2-100.8000113G159 L160 N167 I178G159-F163 WeakPolarHBondContact O-CB 3.38Å; G159-F163 PolarHBondContact O-N 2.85Å; L160-F163 PolarHBondContact O-N 3.36Å; F163-N167 PolarHBondContact O-N 3.28Å; F163-I178 HydrophobicContact CD2-CD1 3.97Å; F163-I178 HydrophobicContact CE2-CD1 4.4Å
164I78.4Confident73.1Confident101 Ų10170.8 Ų70.852%0.51838%0.379SS..Hα-helixtrans-70.4-37.4-179.1-67.4166.6000111.1L160 N167L160-I164 WeakPolarHBondContact O-CB 3.23Å; L160-I164 VanDerWaalsContact O-CG1 3.24Å; L160-I164 WeakPolarHBondContact O-CG1 3.38Å; L160-I164 PolarHBondContact O-N 3.05Å; I164-N167 WeakPolarHBondContact O-CB 3.45Å; I164-N167 PolarHBondContact O-N 3.43Å
165S67.4Low72.6Confident65 Ų6574.3 Ų74.346%0.45540%0.403SS..Hα-helixtrans-70.3-34.7179.6-58.20000111.7A161 D162 N167A161-S165 VanDerWaalsContact O-CB 3.25Å; A161-S165 WeakPolarHBondContact O-CB 3.34Å; A161-S165 PolarHBondContact O-N 2.97Å; A161-S165 PolarHBondContact O-OG 2.88Å; D162-S165 PolarHBondContact O-N 2.91Å; S165-N167 VanDerWaalsContact C-N 3.33Å
166G61.7Low72.3Confident23 Ų2376.5 Ų76.524%0.23741%0.413CS..Hα-helixtrans-74.7-17.2175.700000114.3D162 K168 D169 L174D162-G166 PolarHBondContact O-N 2.68Å; G166-K168 PolarHBondContact O-N 2.83Å; G166-D169 PolarHBondContact O-N 2.89Å; G166-L174 VanDerWaalsContact C-CD2 3.44Å; G166-L174 VanDerWaalsContact CA-CD2 3.43Å
167N57.7Low72.1Confident111 Ų11174.5 Ų74.559%0.59440%0.401SS*.THydrogen-bonded Turntrans-66.61.4177.8-117.921000114.8F163 I164 S165F163-N167 PolarHBondContact O-N 3.28Å; I164-N167 WeakPolarHBondContact O-CB 3.45Å; I164-N167 PolarHBondContact O-N 3.43Å; S165-N167 VanDerWaalsContact C-N 3.33Å
168K55.6Low72Confident187 Ų18775.6 Ų75.681%0.81341%0.406SS*.THydrogen-bonded Turntrans-99.8-6.8177-72.7-179.1177.81750114.2G166G166-K168 PolarHBondContact O-N 2.83Å
169D54.1Low72.2Confident108 Ų10878.4 Ų78.458%0.57842%0.424SS*.SBendtrans-139.9160.5175.8-85-26000110.7G166 K173G166-D169 PolarHBondContact O-N 2.89Å; D169-K173 HydrophobicContact CB-CD 4.38Å; D169-K173 IonicContact OD2-NZ 3.03Å
170D60.4Low72.4Confident131 Ų13177.1 Ų77.170%0.70141%0.411SS*.  trans-26.7135.3-174.3-71-39000117.9H172 K173D170-H172 PolarHBondContact O-N 3.27Å; D170-K173 WeakPolarHBondContact O-CB 3.47Å; D170-K173 PolarHBondContact O-N 3.43Å
171S60.6Low72.7Confident91 Ų9173.4 Ų73.464%0.63639%0.391SS*.Hα-helixtrans-53.2-25.7178.756.80000115S175S171-S175 PolarHBondContact O-N 2.72Å
172H59.7Low73.1Confident160 Ų16078.2 Ų78.274%0.74142%0.416SS*.Hα-helixtrans-66.4-38175-80.6-74000112.8D170 S175 E176D170-H172 PolarHBondContact O-N 3.27Å; H172-S175 PolarHBondContact O-N 2.85Å; H172-E176 PolarHBondContact O-N 3.49Å
173K69.8Low73.8Confident117 Ų11780.3 Ų80.351%0.50943%0.427SS..Hα-helixtrans-70-35179.5-167.2175.3178.1-177.80111.5D169 D170 E176 V177D169-K173 HydrophobicContact CB-CD 4.38Å; D169-K173 IonicContact OD2-NZ 3.03Å; D170-K173 WeakPolarHBondContact O-CB 3.47Å; D170-K173 PolarHBondContact O-N 3.43Å; K173-E176 PolarHBondContact O-N 2.67Å; K173-V177 WeakPolarHBondContact O-CG2 3.47Å; K173-V177 PolarHBondContact O-N 2.86Å; K173-V177 VanDerWaalsContact O-N 3.14Å
174L73.6Confident74.4Confident22 Ų2275.9 Ų75.912%0.11541%0.408CS..Hα-helixtrans-62.8-46.9174.3-85168.8000112.9G166 E176 V177 I178G166-L174 VanDerWaalsContact C-CD2 3.44Å; G166-L174 VanDerWaalsContact CA-CD2 3.43Å; L174-E176 VanDerWaalsContact C-N 3.26Å; L174-E176 PolarHBondContact O-N 3.01Å; L174-V177 PolarHBondContact O-N 3.38Å; L174-I178 VanDerWaalsContact O-CG1 3.26Å; L174-I178 WeakPolarHBondContact O-CG1 3.19Å; L174-I178 PolarHBondContact O-N 3.46Å
175S78.5Confident75.1Confident74 Ų7473.7 Ų73.752%0.51740%0.396SS..Hα-helixtrans-62.7-35.5179.5-173.80000112S171 H172 T179S171-S175 PolarHBondContact O-N 2.72Å; H172-S175 PolarHBondContact O-N 2.85Å; S175-T179 VanDerWaalsContact O-CB 3.31Å; S175-T179 WeakPolarHBondContact O-CB 3.47Å; S175-T179 PolarHBondContact O-N 3.13Å; S175-T179 PolarHBondContact O-OG1 3.34Å
176E80.1Confident76.3Confident69 Ų6976 Ų7632%0.32240%0.402SS..Hα-helixtrans-67-48.4177.4-171.4170.9-168.700111.6M111 H172 K173 L174 I178 T179 G180M111-E176 HydrophobicContact CB-CG 3.95Å; M111-E176 HydrophobicContact CE-CG 4.02Å; M111-E176 HydrophobicContact CG-CG 4.14Å; H172-E176 PolarHBondContact O-N 3.49Å; K173-E176 PolarHBondContact O-N 2.67Å; L174-E176 VanDerWaalsContact C-N 3.26Å; L174-E176 PolarHBondContact O-N 3.01Å; E176-I178 PolarHBondContact O-N 3.16Å; E176-T179 PolarHBondContact O-N 3.03Å; E176-G180 PolarHBondContact O-N 3.38Å
177V82.6Confident77.9Confident35 Ų3575 Ų7521%0.21239%0.39CS..Hα-helixtrans-60.4-48.1177.5174.60000111.6M111 D162 K173 L174 T179 G180 D181M111-V177 WeakPolarHBondContact O-CA 3.35Å; D162-V177 HydrophobicContact CB-CG1 4.19Å; K173-V177 WeakPolarHBondContact O-CG2 3.47Å; K173-V177 PolarHBondContact O-N 2.86Å; K173-V177 VanDerWaalsContact O-N 3.14Å; L174-V177 PolarHBondContact O-N 3.38Å; V177-T179 VanDerWaalsContact C-N 3.29Å; V177-T179 PolarHBondContact O-N 3.04Å; V177-G180 WeakPolarHBondContact O-CA 3.43Å; V177-G180 PolarHBondContact O-N 3.34Å; V177-G180 VanDerWaalsContact O-N 3.12Å; V177-D181 PolarHBondContact O-N 3.13Å
178I84.9Confident79.6Confident68 Ų6869.9 Ų69.935%0.34936%0.363SS..Hα-helixtrans-61.9-39.7178.5-64.3165.9000111F163 L174 E176 G180 D181 L182F163-I178 HydrophobicContact CD2-CD1 3.97Å; F163-I178 HydrophobicContact CE2-CD1 4.4Å; L174-I178 VanDerWaalsContact O-CG1 3.26Å; L174-I178 WeakPolarHBondContact O-CG1 3.19Å; L174-I178 PolarHBondContact O-N 3.46Å; E176-I178 PolarHBondContact O-N 3.16Å; I178-G180 VanDerWaalsContact C-N 3.34Å; I178-D181 PolarHBondContact O-N 3.4Å; I178-L182 HydrophobicContact CG2-CD1 4.26Å; I178-L182 WeakPolarHBondContact O-CG 3.47Å; I178-L182 PolarHBondContact O-N 3.35Å
179T87.6Confident81.4Confident60 Ų6063.2 Ų63.237%0.36834%0.338SS..Hα-helixtrans-65-41.2177-570000110.6M111 S175 E176 V177 L182 L183M111-T179 HydrophobicContact CE-CG2 3.58Å; S175-T179 VanDerWaalsContact O-CB 3.31Å; S175-T179 WeakPolarHBondContact O-CB 3.47Å; S175-T179 PolarHBondContact O-N 3.13Å; S175-T179 PolarHBondContact O-OG1 3.34Å; E176-T179 PolarHBondContact O-N 3.03Å; V177-T179 VanDerWaalsContact C-N 3.29Å; V177-T179 PolarHBondContact O-N 3.04Å; T179-L182 PolarHBondContact O-N 3.41Å; T179-L183 HydrophobicContact CG2-CD1 4.35Å; T179-L183 VanDerWaalsContact O-CG 3.29Å; T179-L183 WeakPolarHBondContact O-CG 3.19Å; T179-L183 PolarHBondContact O-N 3.34Å
180G87.7Confident83.4Confident0 Ų060 Ų600%032%0.321CS..Hα-helixtrans-57.3-47.9172.500000112.5A108 E176 V177 I178 L182 L183 I184A108-G180 WeakPolarHBondContact CB-O 3.49Å; E176-G180 PolarHBondContact O-N 3.38Å; V177-G180 WeakPolarHBondContact O-CA 3.43Å; V177-G180 PolarHBondContact O-N 3.34Å; V177-G180 VanDerWaalsContact O-N 3.12Å; I178-G180 VanDerWaalsContact C-N 3.34Å; G180-L182 PolarHBondContact O-N 3.12Å; G180-L183 WeakPolarHBondContact O-CB 3.11Å; G180-L183 PolarHBondContact O-N 2.87Å; G180-I184 WeakPolarHBondContact O-CG1 3.48Å; G180-I184 PolarHBondContact O-N 3.49Å
181D88.8Confident85Confident13 Ų1354.2 Ų54.27%0.0729%0.291CS..Hα-helixtrans-62-42.5179.5-68.4-8.5000112.5T112 L120 V177 I178 I184 I185T112-D181 WeakPolarHBondContact CB-OD1 3.44Å; T112-D181 PolarHBondContact OG1-OD1 3.21Å; L120-D181 HydrophobicContact CD1-CB 3.56Å; L120-D181 WeakPolarHBondContact CD1-OD1 3.14Å; V177-D181 PolarHBondContact O-N 3.13Å; I178-D181 PolarHBondContact O-N 3.4Å; D181-I184 PolarHBondContact O-N 3.21Å; D181-I185 WeakPolarHBondContact O-CG1 3.39Å; D181-I185 PolarHBondContact O-N 3.37Å; D181-I185 VanDerWaalsContact O-N 3.08Å
182L90.2Very high86.5Confident103 Ų10349.9 Ų49.954%0.53926%0.261SS..Hα-helixtrans-64.1-40.7175-70.4175.5000112I178 T179 G180 I184 I185 M186I178-L182 HydrophobicContact CG2-CD1 4.26Å; I178-L182 WeakPolarHBondContact O-CG 3.47Å; I178-L182 PolarHBondContact O-N 3.35Å; T179-L182 PolarHBondContact O-N 3.41Å; G180-L182 PolarHBondContact O-N 3.12Å; L182-I184 VanDerWaalsContact C-N 3.31Å; L182-I184 PolarHBondContact O-N 2.95Å; L182-I185 PolarHBondContact O-N 3.08Å; L182-M186 WeakPolarHBondContact O-CG 3.09Å; L182-M186 PolarHBondContact O-N 3.25Å
183L91.9Very high88.2Confident55 Ų5544.7 Ų44.729%0.28824%0.24SC..Hα-helixtrans-62.1-38.8174.9-73.3174.5000111.6I104 V107 A108 M111 T179 G180 M186 A187I104-L183 HydrophobicContact CG2-CB 3.98Å; I104-L183 HydrophobicContact CG2-CD2 4.2Å; I104-L183 VanDerWaalsContact CG2-O 3.31Å; I104-L183 WeakPolarHBondContact CG2-O 3.27Å; V107-L183 HydrophobicContact CG1-CD1 4.37Å; A108-L183 HydrophobicContact CB-CB 3.94Å; M111-L183 HydrophobicContact SD-CD1 3.87Å; T179-L183 HydrophobicContact CG2-CD1 4.35Å; T179-L183 VanDerWaalsContact O-CG 3.29Å; T179-L183 WeakPolarHBondContact O-CG 3.19Å; T179-L183 PolarHBondContact O-N 3.34Å; G180-L183 WeakPolarHBondContact O-CB 3.11Å; G180-L183 PolarHBondContact O-N 2.87Å; L183-M186 PolarHBondContact O-N 3.47Å; L183-A187 WeakPolarHBondContact O-CB 3.09Å; L183-A187 PolarHBondContact O-N 3.49Å
184I91.6Very high89.4Confident0 Ų039.2 Ų39.20%022%0.216CC..Hα-helixtrans-62.5-46.2175.2-64.7157.5000110.7A108 T112 F117 L120 G180 D181 L182 M186 A187 Q188A108-I184 HydrophobicContact CB-CD1 4.24Å; A108-I184 HydrophobicContact CB-CG1 3.55Å; T112-I184 HydrophobicContact CG2-CD1 3.42Å; T112-I184 VanDerWaalsContact CG2-CD1 3.42Å; F117-I184 HydrophobicContact CB-CD1 4.18Å; F117-I184 HydrophobicContact CD2-CD1 3.79Å; F117-I184 HydrophobicContact CD2-CG1 3.87Å; F117-I184 HydrophobicContact CE2-CG1 4.4Å; F117-I184 HydrophobicContact CG-CD1 4.44Å; L120-I184 HydrophobicContact CB-CB 4.24Å; L120-I184 HydrophobicContact CB-CD1 4.43Å; L120-I184 HydrophobicContact CB-CG2 3.56Å; L120-I184 HydrophobicContact CD1-CB 4.36Å; L120-I184 HydrophobicContact CD1-CD1 3.86Å; G180-I184 WeakPolarHBondContact O-CG1 3.48Å; G180-I184 PolarHBondContact O-N 3.49Å; D181-I184 PolarHBondContact O-N 3.21Å; L182-I184 VanDerWaalsContact C-N 3.31Å; L182-I184 PolarHBondContact O-N 2.95Å; I184-M186 VanDerWaalsContact C-N 3.32Å; I184-M186 PolarHBondContact O-N 2.68Å; I184-A187 WeakPolarHBondContact O-CB 3.39Å; I184-A187 PolarHBondContact O-N 2.81Å; I184-Q188 HydrophobicContact CG2-CG 4.3Å; I184-Q188 VanDerWaalsContact O-CG 3.28Å; I184-Q188 WeakPolarHBondContact O-CG 3.22Å; I184-Q188 PolarHBondContact O-N 3.45Å; I184-Q188 PolarHBondContact O-NE2 2.99Å
185I92.3Very high90.2Very high55 Ų5539 Ų3928%0.28222%0.215SC..Hα-helixtrans-60.7-44.1178.8-66.6170.5000110.2F127 D181 L182 A187 Q188 V189F127-I185 HydrophobicContact CE2-CG2 4.15Å; F127-I185 HydrophobicContact CZ-CG2 4.07Å; D181-I185 WeakPolarHBondContact O-CG1 3.39Å; D181-I185 PolarHBondContact O-N 3.37Å; D181-I185 VanDerWaalsContact O-N 3.08Å; L182-I185 PolarHBondContact O-N 3.08Å; I185-A187 VanDerWaalsContact C-N 3.34Å; I185-A187 PolarHBondContact O-N 3.08Å; I185-Q188 PolarHBondContact O-N 3.45Å; I185-Q188 VanDerWaalsContact O-N 3.15Å; I185-V189 PolarHBondContact O-N 3.36Å; I185-V189 VanDerWaalsContact O-N 3.13Å
186M93.6Very high90.8Very high115 Ų11535.7 Ų35.757%0.56719%0.191SC*.Hα-helixtrans-60.7-42.7175.1-71.3-57.9-62.800111.9L182 L183 I184 Q188 V189 I190L182-M186 WeakPolarHBondContact O-CG 3.09Å; L182-M186 PolarHBondContact O-N 3.25Å; L183-M186 PolarHBondContact O-N 3.47Å; I184-M186 VanDerWaalsContact C-N 3.32Å; I184-M186 PolarHBondContact O-N 2.68Å; M186-Q188 VanDerWaalsContact C-N 3.31Å; M186-Q188 PolarHBondContact O-N 3.5Å; M186-V189 WeakPolarHBondContact O-CB 3.28Å; M186-V189 PolarHBondContact O-N 3.14Å; M186-I190 PolarHBondContact O-N 3.19Å
187A93.9Very high91.3Very high0 Ų034.4 Ų34.40%019%0.187CC..Hα-helixtrans-62.3-37.7174.500000112.4I104 M105 L183 I184 I185 V189 I190 A191I104-A187 HydrophobicContact CB-CB 4.04Å; I104-A187 HydrophobicContact CG2-CB 3.89Å; M105-A187 HydrophobicContact CG-CB 3.69Å; L183-A187 WeakPolarHBondContact O-CB 3.09Å; L183-A187 PolarHBondContact O-N 3.49Å; I184-A187 WeakPolarHBondContact O-CB 3.39Å; I184-A187 PolarHBondContact O-N 2.81Å; I185-A187 VanDerWaalsContact C-N 3.34Å; I185-A187 PolarHBondContact O-N 3.08Å; A187-V189 VanDerWaalsContact C-N 3.29Å; A187-V189 PolarHBondContact O-N 3.21Å; A187-I190 PolarHBondContact O-N 3.3Å; A187-A191 WeakPolarHBondContact O-CB 3.36Å; A187-A191 PolarHBondContact O-N 3.44Å
188Q93.6Very high91.7Very high5 Ų532.8 Ų32.82%0.02318%0.176CC..Hα-helixtrans-65.5-31.1176.8-63.6-31.6-64.700112.7M105 R121 A123 V124 F127 I184 I185 M186 A192M105-Q188 PolarHBondContact SD-NE2 3.34Å; R121-Q188 PolarHBondContact O-OE1 3.11Å; A123-Q188 HydrophobicContact CB-CB 4.42Å; A123-Q188 HydrophobicContact CB-CG 4.22Å; V124-Q188 HydrophobicContact CB-CB 4.33Å; F127-Q188 HydrophobicContact CD2-CB 4.31Å; F127-Q188 HydrophobicContact CE2-CB 4.47Å; I184-Q188 HydrophobicContact CG2-CG 4.3Å; I184-Q188 VanDerWaalsContact O-CG 3.28Å; I184-Q188 WeakPolarHBondContact O-CG 3.22Å; I184-Q188 PolarHBondContact O-N 3.45Å; I184-Q188 PolarHBondContact O-NE2 2.99Å; I185-Q188 PolarHBondContact O-N 3.45Å; I185-Q188 VanDerWaalsContact O-N 3.15Å; M186-Q188 VanDerWaalsContact C-N 3.31Å; M186-Q188 PolarHBondContact O-N 3.5Å; Q188-A192 VanDerWaalsContact O-CB 3.28Å; Q188-A192 WeakPolarHBondContact O-CB 3.25Å; Q188-A192 PolarHBondContact O-N 2.94Å
189V94.8Very high91.9Very high47 Ų4729.5 Ų29.529%0.28516%0.16SC..Hα-helixtrans-64.6-45.3172.4177.60000110.4F127 I185 M186 A187 A192 V193F127-V189 HydrophobicContact CD1-CG2 3.85Å; F127-V189 HydrophobicContact CD2-CG2 3.84Å; F127-V189 HydrophobicContact CE1-CG2 3.71Å; F127-V189 HydrophobicContact CE2-CG2 3.7Å; F127-V189 HydrophobicContact CG-CG2 3.91Å; F127-V189 HydrophobicContact CZ-CG2 3.63Å; I185-V189 PolarHBondContact O-N 3.36Å; I185-V189 VanDerWaalsContact O-N 3.13Å; M186-V189 WeakPolarHBondContact O-CB 3.28Å; M186-V189 PolarHBondContact O-N 3.14Å; A187-V189 VanDerWaalsContact C-N 3.29Å; A187-V189 PolarHBondContact O-N 3.21Å; V189-A192 PolarHBondContact O-N 3.41Å; V189-V193 WeakPolarHBondContact O-CG2 3.32Å; V189-V193 PolarHBondContact O-N 2.9Å
190I95.8Very high91.9Very high41 Ų4130.8 Ų30.821%0.2116%0.16CC..Hα-helixtrans-65.6-44.1179.1-57.4175.6000110.7C97 T100 A101 I104 M186 A187 A192 V193 Q194C97-I190 HydrophobicContact CB-CG2 3.84Å; C97-I190 WeakPolarHBondContact O-CG2 3.07Å; T100-I190 HydrophobicContact CG2-CD1 3.91Å; A101-I190 HydrophobicContact CB-CB 4.09Å; A101-I190 HydrophobicContact CB-CG2 4.05Å; I104-I190 HydrophobicContact CD1-CD1 3.75Å; M186-I190 PolarHBondContact O-N 3.19Å; A187-I190 PolarHBondContact O-N 3.3Å; I190-A192 VanDerWaalsContact C-N 3.31Å; I190-A192 PolarHBondContact O-N 3.4Å; I190-V193 WeakPolarHBondContact O-CB 3.27Å; I190-V193 PolarHBondContact O-N 2.83Å; I190-V193 VanDerWaalsContact O-N 3.16Å; I190-Q194 PolarHBondContact O-N 3.14Å
191A93.7Very high91.8Very high9 Ų932.2 Ų32.27%0.07417%0.166CC..Hα-helixtrans-60.3-39.9174.100000111.8A101 V124 A187 V193 Q194 M195A101-A191 HydrophobicContact CB-CB 4.16Å; V124-A191 HydrophobicContact CG2-CB 4.23Å; A187-A191 WeakPolarHBondContact O-CB 3.36Å; A187-A191 PolarHBondContact O-N 3.44Å; A191-V193 VanDerWaalsContact C-N 3.33Å; A191-V193 PolarHBondContact O-N 3.24Å; A191-Q194 WeakPolarHBondContact O-CB 3.25Å; A191-Q194 PolarHBondContact O-N 3.4Å; A191-M195 VanDerWaalsContact O-CG 3.25Å; A191-M195 WeakPolarHBondContact O-CG 3.41Å; A191-M195 PolarHBondContact O-N 3.28Å
192A93.1Very high91.7Very high0 Ų031.6 Ų31.60%016%0.163CC..Hα-helixtrans-64.6-36.7175.400000112.6V124 F127 T128 L131 Q188 V189 I190 M195 V196V124-A192 HydrophobicContact CG2-CB 4.16Å; F127-A192 HydrophobicContact CB-CB 3.46Å; F127-A192 VanDerWaalsContact CB-CB 3.46Å; T128-A192 WeakPolarHBondContact OG1-CB 3.45Å; L131-A192 HydrophobicContact CD1-CB 3.91Å; Q188-A192 VanDerWaalsContact O-CB 3.28Å; Q188-A192 WeakPolarHBondContact O-CB 3.25Å; Q188-A192 PolarHBondContact O-N 2.94Å; V189-A192 PolarHBondContact O-N 3.41Å; I190-A192 VanDerWaalsContact C-N 3.31Å; I190-A192 PolarHBondContact O-N 3.4Å; A192-M195 PolarHBondContact O-N 3.21Å; A192-V196 WeakPolarHBondContact O-CB 3.43Å; A192-V196 WeakPolarHBondContact O-CG2 3.23Å; A192-V196 PolarHBondContact O-N 3.24Å; A192-V196 VanDerWaalsContact O-N 3.11Å
193V94.4Very high91.4Very high50 Ų5031.7 Ų31.730%0.30316%0.157SC..Hα-helixtrans-62-47.4172.7171.50000110.6L131 V189 I190 A191 M195 V196 L197L131-V193 HydrophobicContact CD1-CG2 3.77Å; V189-V193 WeakPolarHBondContact O-CG2 3.32Å; V189-V193 PolarHBondContact O-N 2.9Å; I190-V193 WeakPolarHBondContact O-CB 3.27Å; I190-V193 PolarHBondContact O-N 2.83Å; I190-V193 VanDerWaalsContact O-N 3.16Å; A191-V193 VanDerWaalsContact C-N 3.33Å; A191-V193 PolarHBondContact O-N 3.24Å; V193-M195 PolarHBondContact O-N 3.2Å; V193-V196 PolarHBondContact O-N 3.47Å; V193-L197 HydrophobicContact CG1-CD1 3.81Å; V193-L197 HydrophobicContact CG1-CG 4.2Å; V193-L197 WeakPolarHBondContact O-CB 3.24Å; V193-L197 VanDerWaalsContact O-CG 3.28Å; V193-L197 WeakPolarHBondContact O-CG 3.32Å; V193-L197 PolarHBondContact O-N 3.21Å
194Q94.4Very high91Very high3 Ų336.3 Ų36.31%0.01418%0.175CC..Hα-helixtrans-52.3-53.9174.1172.2-159.2-15.100111P94 C97 D98 I190 A191 V196 L197 E198 E216P94-Q194 HydrophobicContact CB-CG 4.37Å; C97-Q194 HydrophobicContact CB-CB 3.76Å; D98-Q194 VanDerWaalsContact CA-OE1 3.31Å; D98-Q194 HydrophobicContact CB-CG 4.44Å; D98-Q194 PolarHBondContact OD1-OE1 2.92Å; I190-Q194 PolarHBondContact O-N 3.14Å; A191-Q194 WeakPolarHBondContact O-CB 3.25Å; A191-Q194 PolarHBondContact O-N 3.4Å; Q194-V196 VanDerWaalsContact C-N 3.29Å; Q194-V196 PolarHBondContact O-N 2.78Å; Q194-L197 PolarHBondContact O-N 3.03Å; Q194-L197 VanDerWaalsContact O-N 3.14Å; Q194-E198 HydrophobicContact CG-CG 4.38Å; Q194-E198 WeakPolarHBondContact CG-OE1 3.42Å; Q194-E198 PolarHBondContact NE2-OE1 3Å; Q194-E198 WeakPolarHBondContact O-CG 3.23Å; Q194-E198 PolarHBondContact O-N 2.91Å; Q194-E216 PolarHBondContact NE2-OE1 3.29Å
195M90.4Very high90.6Very high18 Ų1838.2 Ų38.29%0.08918%0.184CC..Hα-helixtrans-58.7-40.1-176.6-65.3-67.1153.200112.6T128 A191 A192 V193 E199 R293 M294T128-M195 HydrophobicContact CG2-CB 4.34Å; A191-M195 VanDerWaalsContact O-CG 3.25Å; A191-M195 WeakPolarHBondContact O-CG 3.41Å; A191-M195 PolarHBondContact O-N 3.28Å; A192-M195 PolarHBondContact O-N 3.21Å; V193-M195 PolarHBondContact O-N 3.2Å; M195-E199 WeakPolarHBondContact O-CB 3.45Å; M195-E199 PolarHBondContact O-N 3.39Å; M195-R293 VanDerWaalsContact SD-CZ 3.51Å; M195-M294 HydrophobicContact CE-CE 3.95Å; M195-M294 HydrophobicContact CG-CE 3.93Å; M195-M294 HydrophobicContact CG-SD 3.94Å; M195-M294 HydrophobicContact SD-CE 3.47Å; M195-M294 WeakPolarHBondContact SD-CE 3.23Å; M195-M294 HydrophobicContact SD-SD 4.29Å
196V90.7Very high90.1Very high4 Ų438.6 Ų38.62%0.02419%0.186CC..Hα-helixtrans-72-38.3178.9169.10000111.8T128 L131 F135 L136 A192 V193 Q194 K200T128-V196 HydrophobicContact CG2-CG2 4.18Å; L131-V196 HydrophobicContact CB-CB 4.49Å; L131-V196 HydrophobicContact CB-CG1 4.44Å; L131-V196 HydrophobicContact CB-CG2 3.8Å; F135-V196 HydrophobicContact CB-CG1 3.79Å; F135-V196 HydrophobicContact CD2-CG1 4.39Å; F135-V196 HydrophobicContact CG-CG1 4.36Å; L136-V196 HydrophobicContact CD1-CG1 3.52Å; A192-V196 WeakPolarHBondContact O-CB 3.43Å; A192-V196 WeakPolarHBondContact O-CG2 3.23Å; A192-V196 PolarHBondContact O-N 3.24Å; A192-V196 VanDerWaalsContact O-N 3.11Å; V193-V196 PolarHBondContact O-N 3.47Å; Q194-V196 VanDerWaalsContact C-N 3.29Å; Q194-V196 PolarHBondContact O-N 2.78Å; V196-K200 WeakPolarHBondContact O-CB 3.22Å; V196-K200 PolarHBondContact O-N 2.88Å
197L91.4Very high89.6Confident42 Ų4233.1 Ų33.122%0.2216%0.159CC..Hα-helixtrans-65.9-46.2174.7-71.7176.5000111.5P93 P94 V193 Q194 E199 K200 F201P93-L197 HydrophobicContact CB-CD1 4.5Å; P94-L197 HydrophobicContact CG-CB 4.09Å; V193-L197 HydrophobicContact CG1-CD1 3.81Å; V193-L197 HydrophobicContact CG1-CG 4.2Å; V193-L197 WeakPolarHBondContact O-CB 3.24Å; V193-L197 VanDerWaalsContact O-CG 3.28Å; V193-L197 WeakPolarHBondContact O-CG 3.32Å; V193-L197 PolarHBondContact O-N 3.21Å; Q194-L197 PolarHBondContact O-N 3.03Å; Q194-L197 VanDerWaalsContact O-N 3.14Å; L197-E199 PolarHBondContact O-N 3.47Å; L197-K200 PolarHBondContact O-N 3.46Å; L197-F201 HydrophobicContact CB-CE2 4.19Å; L197-F201 HydrophobicContact CD2-CZ 4.2Å; L197-F201 WeakPolarHBondContact O-CB 3.37Å; L197-F201 WeakPolarHBondContact O-CD2 3.41Å; L197-F201 WeakPolarHBondContact O-CG 3.48Å; L197-F201 PolarHBondContact O-N 3.03Å
198E90.3Very high89.4Confident0 Ų035.2 Ų35.20%017%0.169CC..Hα-helixtrans-55.7-50.7174.7-75.2174.1-165.900111P94 Q194 K200 F201 V202 I282 R293P94-E198 HydrophobicContact CB-CG 4.16Å; Q194-E198 HydrophobicContact CG-CG 4.38Å; Q194-E198 WeakPolarHBondContact CG-OE1 3.42Å; Q194-E198 PolarHBondContact NE2-OE1 3Å; Q194-E198 WeakPolarHBondContact O-CG 3.23Å; Q194-E198 PolarHBondContact O-N 2.91Å; E198-K200 VanDerWaalsContact C-N 3.32Å; E198-K200 PolarHBondContact O-N 3.33Å; E198-F201 PolarHBondContact O-N 3.23Å; E198-V202 VanDerWaalsContact O-CB 3.3Å; E198-V202 WeakPolarHBondContact O-CB 3.27Å; E198-V202 WeakPolarHBondContact O-CG2 3.22Å; E198-V202 PolarHBondContact O-N 3.24Å; E198-I282 HydrophobicContact CB-CD1 4.19Å; E198-I282 HydrophobicContact CG-CD1 4.16Å; E198-I282 WeakPolarHBondContact OE2-CD1 3.32Å; E198-R293 IonicContact OE2-CZ 3.69Å; E198-R293 IonicContact OE2-NH1 2.68Å; E198-R293 PolarHBondContact OE2-NH1 3.28Å; E198-R293 IonicContact OE2-NH2 3.93Å
199E89.1Confident89.2Confident0 Ų035.5 Ų35.50%017%0.172CC..Hα-helixtrans-56.6-49.2178.6-171.1168.8-145.600110.9L136 R138 M195 L197 F201 V202 Y203 T285 S289 A290L136-E199 HydrophobicContact CD2-CB 4.16Å; L136-E199 VanDerWaalsContact CD2-CD 3.45Å; L136-E199 HydrophobicContact CD2-CG 3.63Å; L136-E199 WeakPolarHBondContact CD2-OE2 3.25Å; R138-E199 IonicContact CZ-OE1 3.78Å; R138-E199 IonicContact CZ-OE2 3.85Å; R138-E199 IonicContact NH1-OE1 2.97Å; R138-E199 PolarHBondContact NH1-OE1 3.07Å; R138-E199 IonicContact NH1-OE2 3.47Å; R138-E199 PolarHBondContact NH1-OE2 2.71Å; R138-E199 IonicContact NH2-OE1 2.67Å; R138-E199 PolarHBondContact NH2-OE1 3.25Å; R138-E199 IonicContact NH2-OE2 3.98Å; M195-E199 WeakPolarHBondContact O-CB 3.45Å; M195-E199 PolarHBondContact O-N 3.39Å; L197-E199 PolarHBondContact O-N 3.47Å; E199-F201 VanDerWaalsContact C-N 3.33Å; E199-F201 PolarHBondContact O-N 3.04Å; E199-V202 PolarHBondContact O-N 3Å; E199-Y203 HydrophobicContact CG-CD2 3.55Å; E199-Y203 HydrophobicContact CG-CE2 3.59Å; E199-Y203 WeakPolarHBondContact O-CB 3.3Å; E199-Y203 VanDerWaalsContact O-CD2 3.26Å; E199-Y203 WeakPolarHBondContact O-CD2 3.28Å; E199-Y203 PolarHBondContact O-N 2.96Å; E199-T285 HydrophobicContact CB-CG2 3.65Å; E199-T285 HydrophobicContact CG-CG2 3.7Å; E199-S289 WeakPolarHBondContact OE1-CA 3.32Å; E199-A290 HydrophobicContact CB-CB 4.04Å; E199-A290 VanDerWaalsContact CD-CB 3.48Å; E199-A290 HydrophobicContact CG-CB 4.25Å; E199-A290 PolarHBondContact OE1-N 2.87Å; E199-A290 WeakPolarHBondContact OE2-CB 3.21Å
200K87.6Confident89Confident87 Ų8734.1 Ų34.138%0.37816%0.162SC..Hα-helixtrans-59.2-42178.7-173.3173.4-174.9167.60112.4L136 V196 L197 E198 K204L136-K200 HydrophobicContact CD1-CB 4.3Å; V196-K200 WeakPolarHBondContact O-CB 3.22Å; V196-K200 PolarHBondContact O-N 2.88Å; L197-K200 PolarHBondContact O-N 3.46Å; E198-K200 VanDerWaalsContact C-N 3.32Å; E198-K200 PolarHBondContact O-N 3.33Å; K200-K204 WeakPolarHBondContact O-CB 3.47Å; K200-K204 PolarHBondContact O-N 3.2Å
201F87.2Confident88.8Confident29 Ų2934.6 Ų34.613%0.12716%0.162CC..Hα-helixtrans-76.5-40.8-177.5-63-24.3000113L90 F91 P94 L197 E198 E199 K204 H205L90-F201 HydrophobicContact CD1-CD1 4.08Å; L90-F201 HydrophobicContact CD1-CD2 4.42Å; L90-F201 HydrophobicContact CD1-CE1 3.78Å; L90-F201 HydrophobicContact CD1-CE2 4.14Å; L90-F201 HydrophobicContact CD1-CG 4.4Å; L90-F201 HydrophobicContact CD1-CZ 3.81Å; L90-F201 HydrophobicContact CD2-CB 4.03Å; L90-F201 HydrophobicContact CD2-CD1 3.99Å; L90-F201 HydrophobicContact CD2-CD2 4.24Å; L90-F201 HydrophobicContact CD2-CG 3.83Å; L90-F201 HydrophobicContact CG-CD1 4.09Å; L90-F201 HydrophobicContact CG-CD2 3.86Å; L90-F201 HydrophobicContact CG-CE1 4.21Å; L90-F201 HydrophobicContact CG-CE2 3.97Å; L90-F201 HydrophobicContact CG-CG 3.92Å; L90-F201 HydrophobicContact CG-CZ 4.15Å; L90-F201 WeakPolarHBondContact O-CE2 3.46Å; F91-F201 HydrophobicContact CZ-CB 4.4Å; P94-F201 HydrophobicContact CG-CD2 4.07Å; P94-F201 HydrophobicContact CG-CE2 3.92Å; L197-F201 HydrophobicContact CB-CE2 4.19Å; L197-F201 HydrophobicContact CD2-CZ 4.2Å; L197-F201 WeakPolarHBondContact O-CB 3.37Å; L197-F201 WeakPolarHBondContact O-CD2 3.41Å; L197-F201 WeakPolarHBondContact O-CG 3.48Å; L197-F201 PolarHBondContact O-N 3.03Å; E198-F201 PolarHBondContact O-N 3.23Å; E199-F201 VanDerWaalsContact C-N 3.33Å; E199-F201 PolarHBondContact O-N 3.04Å; F201-K204 PolarHBondContact O-N 3.43Å; F201-H205 PolarHBondContact O-N 3.38Å; F201-H205 PolarHBondContact O-ND1 3.26Å
202V86.7Confident88.7Confident0 Ų034.2 Ų34.20%016%0.158CC..Hα-helixtrans-64.8-43.3178172.20000110.6F91 E198 E199 D206 V207 A212 I282 K286F91-V202 HydrophobicContact CZ-CG2 4.38Å; E198-V202 VanDerWaalsContact O-CB 3.3Å; E198-V202 WeakPolarHBondContact O-CB 3.27Å; E198-V202 WeakPolarHBondContact O-CG2 3.22Å; E198-V202 PolarHBondContact O-N 3.24Å; E199-V202 PolarHBondContact O-N 3Å; V202-D206 VanDerWaalsContact O-CA 3.3Å; V202-D206 WeakPolarHBondContact O-CA 2.91Å; V202-D206 PolarHBondContact O-N 3.15Å; V202-D206 VanDerWaalsContact O-N 3.13Å; V202-V207 PolarHBondContact O-N 3.44Å; V202-A212 HydrophobicContact CG2-CB 4.34Å; V202-I282 HydrophobicContact CG1-CG2 4.46Å; V202-I282 HydrophobicContact CG2-CG2 4.02Å; V202-K286 HydrophobicContact CG1-CB 3.88Å; V202-K286 HydrophobicContact CG1-CD 3.85Å; V202-K286 HydrophobicContact CG1-CG 3.87Å
203Y83.9Confident88.7Confident105 Ų10534.2 Ų34.241%0.41216%0.158SC..Hα-helixtrans-69.1-44.5174.9-84.2-69000112.5E199 H205 T285 K286E199-Y203 HydrophobicContact CG-CD2 3.55Å; E199-Y203 HydrophobicContact CG-CE2 3.59Å; E199-Y203 WeakPolarHBondContact O-CB 3.3Å; E199-Y203 VanDerWaalsContact O-CD2 3.26Å; E199-Y203 WeakPolarHBondContact O-CD2 3.28Å; E199-Y203 PolarHBondContact O-N 2.96Å; Y203-H205 PolarHBondContact O-N 3.22Å; Y203-T285 WeakPolarHBondContact CE2-O 3.42Å; Y203-T285 PolarHBondContact OH-O 3.44Å; Y203-T285 VanDerWaalsContact OH-O 3.12Å; Y203-K286 WeakPolarHBondContact CE1-O 3.49Å; Y203-K286 VanDerWaalsContact CZ-O 3.3Å; Y203-K286 PolarHBondContact OH-O 3.12Å
204K83.4Confident88.7Confident153 Ų15331.9 Ų31.967%0.66514%0.144SC*.Hα-helixtrans-67.4-36.6-174.9-176.5175178.9-178.90113.7K200 F201K200-K204 WeakPolarHBondContact O-CB 3.47Å; K200-K204 PolarHBondContact O-N 3.2Å; F201-K204 PolarHBondContact O-N 3.43Å
205H81.3Confident88.6Confident39 Ų3932.3 Ų32.318%0.18115%0.147CC..Hα-helixtrans-108.87.7-175.8-55.889.1000113.3Q84 F86 L90 F201 Y203 V207Q84-H205 PolarHBondContact N-O 2.94Å; F86-H205 HydrophobicContact CB-CB 4.4Å; L90-H205 VanDerWaalsContact CD2-CE1 3.41Å; L90-H205 WeakPolarHBondContact CD2-CE1 3.44Å; F201-H205 PolarHBondContact O-N 3.38Å; F201-H205 PolarHBondContact O-ND1 3.26Å; Y203-H205 PolarHBondContact O-N 3.22Å; H205-V207 HydrophobicContact CB-CG2 3.71Å; H205-V207 PolarHBondContact O-N 3.38Å
206D81.9Confident88.7Confident63 Ų6331.6 Ų31.634%0.33714%0.143SC..THydrogen-bonded Turntrans45.147-175.2-172.630.1000112.4N81 G83 V202 K286N81-D206 PolarHBondContact ND2-OD2 3.46Å; N81-D206 VanDerWaalsContact ND2-OD2 3.08Å; G83-D206 VanDerWaalsContact CA-O 3.24Å; G83-D206 WeakPolarHBondContact CA-O 3.28Å; V202-D206 VanDerWaalsContact O-CA 3.3Å; V202-D206 WeakPolarHBondContact O-CA 2.91Å; V202-D206 PolarHBondContact O-N 3.15Å; V202-D206 VanDerWaalsContact O-N 3.13Å; D206-K286 WeakPolarHBondContact OD1-CE 3.06Å; D206-K286 IonicContact OD1-NZ 2.69Å; D206-K286 PolarHBondContact OD1-NZ 3.36Å
207V84.1Confident88.8Confident1 Ų131.4 Ų31.41%0.00614%0.142CC..  trans-69.9139.2-173.9-1760000109.8F86 F91 V202 H205 R211 A212 K286F86-V207 HydrophobicContact CD1-CG1 4.34Å; F86-V207 HydrophobicContact CD1-CG2 3.62Å; F86-V207 HydrophobicContact CE1-CB 4.1Å; F86-V207 HydrophobicContact CE1-CG1 3.42Å; F86-V207 VanDerWaalsContact CE1-CG1 3.42Å; F86-V207 HydrophobicContact CE1-CG2 3.55Å; F86-V207 HydrophobicContact CG-CG2 4.34Å; F86-V207 HydrophobicContact CZ-CG1 3.79Å; F86-V207 HydrophobicContact CZ-CG2 4.21Å; F91-V207 HydrophobicContact CE2-CG1 4.46Å; F91-V207 HydrophobicContact CE2-CG2 4.29Å; F91-V207 HydrophobicContact CZ-CG1 4.3Å; F91-V207 HydrophobicContact CZ-CG2 4.33Å; V202-V207 PolarHBondContact O-N 3.44Å; H205-V207 HydrophobicContact CB-CG2 3.71Å; H205-V207 PolarHBondContact O-N 3.38Å; V207-R211 HydrophobicContact CG1-CB 4.38Å; V207-A212 HydrophobicContact CG1-CB 3.9Å; V207-K286 PolarHBondContact O-NZ 3.32Å
208H88.5Confident89Confident43 Ų4333.6 Ų33.620%0.19915%0.15CC..  trans-68.8130.3172.2-170.6-76000110.3F65 L210 R211 A212F65-H208 HydrophobicContact CD2-CB 4.48Å; F65-H208 AromaticContact CD2-ND1 3.76Å; F65-H208 HydrophobicContact CE2-CB 3.7Å; F65-H208 AromaticContact CE2-CG 3.62Å; F65-H208 AromaticContact CE2-ND1 3.77Å; F65-H208 HydrophobicContact CZ-CB 4.35Å; H208-L210 PolarHBondContact ND1-N 3.23Å; H208-L210 PolarHBondContact O-N 3.41Å; H208-R211 HydrophobicContact CB-CB 4.36Å; H208-R211 WeakPolarHBondContact O-CA 3.4Å; H208-R211 WeakPolarHBondContact O-CB 3.41Å; H208-R211 PolarHBondContact O-N 2.92Å; H208-A212 PolarHBondContact O-N 3.06Å; H208-A212 VanDerWaalsContact O-N 3.09Å
209P90.6Very high89.2Confident12 Ų1235 Ų358%0.07816%0.156CC..Hα-helixtrans-52.1-46-175-30.836.2000114.9R211 A212 V213 F279 I282 S283 K286P209-R211 VanDerWaalsContact C-N 3.25Å; P209-R211 PolarHBondContact O-N 2.98Å; P209-A212 PolarHBondContact O-N 3.33Å; P209-V213 WeakPolarHBondContact O-CG2 3.45Å; P209-V213 PolarHBondContact O-N 3.47Å; P209-F279 HydrophobicContact CB-CD2 3.94Å; P209-F279 HydrophobicContact CB-CE2 3.94Å; P209-I282 HydrophobicContact CB-CB 4.23Å; P209-I282 HydrophobicContact CB-CG2 3.81Å; P209-I282 HydrophobicContact CG-CG2 4.29Å; P209-S283 WeakPolarHBondContact CB-OG 3.4Å; P209-S283 WeakPolarHBondContact CG-OG 3.16Å; P209-K286 HydrophobicContact CG-CD 4.24Å
210L91.4Very high89.4Confident18 Ų1835 Ų359%0.09416%0.156CC..Hα-helixtrans-58.6-35.3176.5-69.3172.1000113.5C61 V64 F65 L68 H208 G214 F279C61-L210 HydrophobicContact CB-CD2 4.06Å; V64-L210 HydrophobicContact CG1-CD1 4.34Å; F65-L210 HydrophobicContact CB-CB 3.94Å; F65-L210 HydrophobicContact CD2-CB 4.06Å; F65-L210 HydrophobicContact CG-CB 4.39Å; L68-L210 HydrophobicContact CD1-CD1 3.7Å; H208-L210 PolarHBondContact ND1-N 3.23Å; H208-L210 PolarHBondContact O-N 3.41Å; L210-G214 PolarHBondContact O-N 3.44Å; L210-F279 HydrophobicContact CD2-CB 4.25Å; L210-F279 HydrophobicContact CD2-CD2 3.38Å; L210-F279 HydrophobicContact CD2-CE2 3.91Å; L210-F279 HydrophobicContact CD2-CG 3.89Å; L210-F279 HydrophobicContact CG-CD2 3.61Å; L210-F279 HydrophobicContact CG-CE2 3.71Å
211R91Very high89.7Confident51 Ų5133.1 Ų33.119%0.19215%0.148CC..Hα-helixtrans-73.7-41.6179.1-174.3-179.8175.5-174-2.9110.8F65 F86 V207 H208 P209 G214 T215F65-R211 HydrophobicContact CD1-CB 4.02Å; F65-R211 HydrophobicContact CD1-CG 4.25Å; F65-R211 HydrophobicContact CD2-CB 4.2Å; F65-R211 HydrophobicContact CE1-CB 3.85Å; F65-R211 HydrophobicContact CE1-CG 3.91Å; F65-R211 HydrophobicContact CE2-CB 4.05Å; F65-R211 HydrophobicContact CG-CB 4.18Å; F65-R211 HydrophobicContact CZ-CB 3.88Å; F65-R211 HydrophobicContact CZ-CG 4.28Å; F86-R211 HydrophobicContact CE1-CG 4.46Å; F86-R211 HydrophobicContact CZ-CG 4.33Å; V207-R211 HydrophobicContact CG1-CB 4.38Å; H208-R211 HydrophobicContact CB-CB 4.36Å; H208-R211 WeakPolarHBondContact O-CA 3.4Å; H208-R211 WeakPolarHBondContact O-CB 3.41Å; H208-R211 PolarHBondContact O-N 2.92Å; P209-R211 VanDerWaalsContact C-N 3.25Å; P209-R211 PolarHBondContact O-N 2.98Å; R211-G214 PolarHBondContact O-N 2.78Å; R211-T215 WeakPolarHBondContact O-CG2 3.4Å; R211-T215 PolarHBondContact O-N 3.14Å; R211-T215 PolarHBondContact O-OG1 3.49Å
212A91.6Very high90.1Very high0 Ų036.5 Ų36.50%016%0.163CC..Hα-helixtrans-58.5-56.8176.200000111.2F91 V202 V207 H208 P209 G214 T215 E216 I282F91-A212 HydrophobicContact CD1-CB 4.45Å; F91-A212 HydrophobicContact CE1-CB 3.56Å; F91-A212 HydrophobicContact CZ-CB 3.64Å; V202-A212 HydrophobicContact CG2-CB 4.34Å; V207-A212 HydrophobicContact CG1-CB 3.9Å; H208-A212 PolarHBondContact O-N 3.06Å; H208-A212 VanDerWaalsContact O-N 3.09Å; P209-A212 PolarHBondContact O-N 3.33Å; A212-G214 VanDerWaalsContact C-N 3.3Å; A212-G214 PolarHBondContact O-N 3.32Å; A212-T215 PolarHBondContact O-N 2.98Å; A212-T215 PolarHBondContact O-OG1 3.01Å; A212-E216 PolarHBondContact O-N 3.43Å; A212-I282 HydrophobicContact CB-CG2 4.28Å
213V93.4Very high90.4Very high1 Ų138.8 Ų38.81%0.00618%0.175CC..Hα-helixtrans-58.2-44.1177.5177.30000110.9E58 C61 P209 T215 E216 G217 N278 I282E58-V213 HydrophobicContact CB-CG1 3.82Å; E58-V213 HydrophobicContact CG-CG1 3.89Å; C61-V213 HydrophobicContact CB-CB 4.39Å; C61-V213 HydrophobicContact CB-CG1 4.19Å; P209-V213 WeakPolarHBondContact O-CG2 3.45Å; P209-V213 PolarHBondContact O-N 3.47Å; V213-T215 VanDerWaalsContact C-N 3.35Å; V213-T215 PolarHBondContact O-N 3.3Å; V213-E216 PolarHBondContact O-N 3.42Å; V213-G217 PolarHBondContact O-N 3.12Å; V213-N278 HydrophobicContact CG1-CB 3.68Å; V213-N278 HydrophobicContact CG2-CB 4.05Å; V213-N278 WeakPolarHBondContact CG2-O 3.47Å; V213-I282 HydrophobicContact CG2-CB 4.16Å; V213-I282 HydrophobicContact CG2-CG1 3.56Å
214G93.9Very high90.8Very high0 Ų033.9 Ų33.90%016%0.156CC..Hα-helixtrans-61.6-38.4178.700000114.3E58 L210 R211 A212 F218E58-G214 WeakPolarHBondContact O-CA 3.48Å; L210-G214 PolarHBondContact O-N 3.44Å; R211-G214 PolarHBondContact O-N 2.78Å; A212-G214 VanDerWaalsContact C-N 3.3Å; A212-G214 PolarHBondContact O-N 3.32Å; G214-F218 WeakPolarHBondContact O-CB 3.46Å; G214-F218 PolarHBondContact O-N 3.38Å
215T92.4Very high91.3Very high12 Ų1228.4 Ų28.47%0.07414%0.136CC..Hα-helixtrans-73.4-35.4176.648.20000112.9L62 R211 A212 V213 F218 F219L62-T215 HydrophobicContact CD1-CG2 4.49Å; R211-T215 WeakPolarHBondContact O-CG2 3.4Å; R211-T215 PolarHBondContact O-N 3.14Å; R211-T215 PolarHBondContact O-OG1 3.49Å; A212-T215 PolarHBondContact O-N 2.98Å; A212-T215 PolarHBondContact O-OG1 3.01Å; V213-T215 VanDerWaalsContact C-N 3.35Å; V213-T215 PolarHBondContact O-N 3.3Å; T215-F218 WeakPolarHBondContact O-CB 3.41Å; T215-F218 PolarHBondContact O-N 3.07Å; T215-F219 WeakPolarHBondContact O-CD2 3.22Å; T215-F219 PolarHBondContact O-N 3.18Å
216E92.1Very high91.9Very high4 Ų432.1 Ų32.12%0.01916%0.157CC..Hα-helixtrans-65.7-50.6174.1-176169.8-17700110.7A95 Q194 A212 V213 F218 F219 G220A95-E216 HydrophobicContact CB-CG 3.91Å; Q194-E216 PolarHBondContact NE2-OE1 3.29Å; A212-E216 PolarHBondContact O-N 3.43Å; V213-E216 PolarHBondContact O-N 3.42Å; E216-F218 PolarHBondContact O-N 3.31Å; E216-F219 PolarHBondContact O-N 3.06Å; E216-F219 VanDerWaalsContact O-N 3.12Å; E216-G220 PolarHBondContact O-N 3.31Å
217G93.6Very high92.4Very high0 Ų032.1 Ų32.10%016%0.157CC..Hα-helixtrans-56.8-35173.900000113.5V213 F221V213-G217 PolarHBondContact O-N 3.12Å; G217-F221 WeakPolarHBondContact O-CB 3.49Å; G217-F221 PolarHBondContact O-N 3.27Å
218F94.9Very high92.7Very high87 Ų8733.2 Ų33.238%0.38216%0.162SC..Hα-helixtrans-60.3-56.8172.5178.7-89.8000111.6L59 G214 T215 E216 G220 F221 F222L59-F218 HydrophobicContact CD1-CB 3.86Å; L59-F218 HydrophobicContact CD1-CD2 3.93Å; L59-F218 HydrophobicContact CD1-CG 4.41Å; G214-F218 WeakPolarHBondContact O-CB 3.46Å; G214-F218 PolarHBondContact O-N 3.38Å; T215-F218 WeakPolarHBondContact O-CB 3.41Å; T215-F218 PolarHBondContact O-N 3.07Å; E216-F218 PolarHBondContact O-N 3.31Å; F218-G220 PolarHBondContact O-N 3.32Å; F218-F221 PolarHBondContact O-N 3.28Å; F218-F222 HydrophobicContact CD1-CD2 4.26Å; F218-F222 AromaticContact CD2-CD2 3.95Å; F218-F222 HydrophobicContact CD2-CD2 3.95Å; F218-F222 AromaticContact CD2-CE2 3.53Å; F218-F222 HydrophobicContact CD2-CE2 3.53Å; F218-F222 HydrophobicContact CE1-CD2 4.1Å; F218-F222 HydrophobicContact CE1-CE2 4.36Å; F218-F222 AromaticContact CE2-CD2 3.79Å; F218-F222 HydrophobicContact CE2-CD2 3.79Å; F218-F222 AromaticContact CE2-CE2 3.23Å; F218-F222 HydrophobicContact CE2-CE2 3.23Å; F218-F222 HydrophobicContact CE2-CZ 4.16Å; F218-F222 HydrophobicContact CG-CD2 4.18Å; F218-F222 HydrophobicContact CG-CE2 4.22Å; F218-F222 AromaticContact CZ-CD2 3.85Å; F218-F222 HydrophobicContact CZ-CD2 3.85Å; F218-F222 AromaticContact CZ-CE2 3.69Å; F218-F222 HydrophobicContact CZ-CE2 3.69Å; F218-F222 WeakPolarHBondContact O-CD2 3.35Å; F218-F222 PolarHBondContact O-N 3.37Å
219F94.8Very high92.8Very high30 Ų3036.1 Ų36.113%0.13218%0.178CC..Hα-helixtrans-63.7-43.6179.9-69.3-65.9000111.7P88 L89 L92 A95 T215 E216 F221 F222 I223P88-F219 HydrophobicContact CB-CZ 4.47Å; P88-F219 VanDerWaalsContact O-CE2 3.28Å; P88-F219 WeakPolarHBondContact O-CE2 3.43Å; L89-F219 HydrophobicContact CD2-CE1 4.15Å; L89-F219 HydrophobicContact CD2-CZ 4.04Å; L92-F219 HydrophobicContact CB-CD2 4.41Å; L92-F219 HydrophobicContact CD1-CB 4.01Å; L92-F219 HydrophobicContact CD1-CD1 3.81Å; L92-F219 HydrophobicContact CD1-CE1 4.45Å; L92-F219 HydrophobicContact CD1-CG 3.88Å; A95-F219 HydrophobicContact CB-CB 3.93Å; T215-F219 WeakPolarHBondContact O-CD2 3.22Å; T215-F219 PolarHBondContact O-N 3.18Å; E216-F219 PolarHBondContact O-N 3.06Å; E216-F219 VanDerWaalsContact O-N 3.12Å; F219-F221 PolarHBondContact O-N 2.96Å; F219-F222 PolarHBondContact O-N 3.24Å; F219-I223 HydrophobicContact CB-CD1 4.28Å; F219-I223 WeakPolarHBondContact O-CB 3.29Å; F219-I223 WeakPolarHBondContact O-CD1 3.39Å; F219-I223 WeakPolarHBondContact O-CG1 3.21Å; F219-I223 PolarHBondContact O-N 3.36Å
220G92.4Very high92.8Very high0 Ų038.2 Ų38.20%019%0.192CC..Hα-helixtrans-56.8-49.4177.600000112.5E216 F218 F222 L224E216-G220 PolarHBondContact O-N 3.31Å; F218-G220 PolarHBondContact O-N 3.32Å; G220-F222 PolarHBondContact O-N 3.46Å; G220-L224 WeakPolarHBondContact O-CB 3.32Å; G220-L224 PolarHBondContact O-N 3.25Å
221F94.8Very high92.7Very high47 Ų4738.8 Ų38.821%0.20619%0.194CC..Hα-helixtrans-60.5-50.1-179.7179.3-98.8000112V52 F55 L56 L59 G217 F218 F219 S225V52-F221 HydrophobicContact CG1-CD2 3.84Å; V52-F221 HydrophobicContact CG1-CE2 3.61Å; F55-F221 HydrophobicContact CB-CB 3.96Å; L56-F221 HydrophobicContact CB-CD2 3.98Å; L56-F221 HydrophobicContact CB-CE2 4.03Å; L56-F221 HydrophobicContact CD1-CD2 4.37Å; L56-F221 HydrophobicContact CD1-CE2 4.02Å; L56-F221 HydrophobicContact CD1-CZ 4.42Å; L56-F221 HydrophobicContact CG-CE2 4.49Å; L59-F221 HydrophobicContact CD2-CB 4.47Å; L59-F221 HydrophobicContact CD2-CD1 4.16Å; L59-F221 HydrophobicContact CD2-CG 4.29Å; G217-F221 WeakPolarHBondContact O-CB 3.49Å; G217-F221 PolarHBondContact O-N 3.27Å; F218-F221 PolarHBondContact O-N 3.28Å; F219-F221 PolarHBondContact O-N 2.96Å; F221-S225 WeakPolarHBondContact O-CB 3.34Å; F221-S225 PolarHBondContact O-N 3.37Å; F221-S225 PolarHBondContact O-OG 3.3Å
222F94.9Very high92.6Very high100 Ų10038.1 Ų38.144%0.43919%0.192SC..Hα-helixtrans-69.3-45.1-177.2-77.9-73.3000112.4F218 F219 G220 L226F218-F222 HydrophobicContact CD1-CD2 4.26Å; F218-F222 AromaticContact CD2-CD2 3.95Å; F218-F222 HydrophobicContact CD2-CD2 3.95Å; F218-F222 AromaticContact CD2-CE2 3.53Å; F218-F222 HydrophobicContact CD2-CE2 3.53Å; F218-F222 HydrophobicContact CE1-CD2 4.1Å; F218-F222 HydrophobicContact CE1-CE2 4.36Å; F218-F222 AromaticContact CE2-CD2 3.79Å; F218-F222 HydrophobicContact CE2-CD2 3.79Å; F218-F222 AromaticContact CE2-CE2 3.23Å; F218-F222 HydrophobicContact CE2-CE2 3.23Å; F218-F222 HydrophobicContact CE2-CZ 4.16Å; F218-F222 HydrophobicContact CG-CD2 4.18Å; F218-F222 HydrophobicContact CG-CE2 4.22Å; F218-F222 AromaticContact CZ-CD2 3.85Å; F218-F222 HydrophobicContact CZ-CD2 3.85Å; F218-F222 AromaticContact CZ-CE2 3.69Å; F218-F222 HydrophobicContact CZ-CE2 3.69Å; F218-F222 WeakPolarHBondContact O-CD2 3.35Å; F218-F222 PolarHBondContact O-N 3.37Å; F219-F222 PolarHBondContact O-N 3.24Å; G220-F222 PolarHBondContact O-N 3.46Å; F222-L226 WeakPolarHBondContact O-CB 3.33Å; F222-L226 VanDerWaalsContact O-CG 3.27Å; F222-L226 WeakPolarHBondContact O-CG 3.44Å; F222-L226 PolarHBondContact O-N 2.91Å
223I94.2Very high92.5Very high49 Ų4946 Ų4625%0.25122%0.223SC..Hα-helixtrans-67.1-45.9-178.4-61.3169.2000109.6L92 L96 M99 F219 L226 L227L92-I223 HydrophobicContact CD1-CD1 3.64Å; L96-I223 HydrophobicContact CD2-CD1 3.96Å; M99-I223 HydrophobicContact CE-CB 3.84Å; M99-I223 HydrophobicContact CE-CG2 3.55Å; M99-I223 HydrophobicContact SD-CB 3.86Å; M99-I223 HydrophobicContact SD-CG2 3.99Å; F219-I223 HydrophobicContact CB-CD1 4.28Å; F219-I223 WeakPolarHBondContact O-CB 3.29Å; F219-I223 WeakPolarHBondContact O-CD1 3.39Å; F219-I223 WeakPolarHBondContact O-CG1 3.21Å; F219-I223 PolarHBondContact O-N 3.36Å; I223-L226 PolarHBondContact O-N 3.4Å; I223-L227 HydrophobicContact CG2-CD1 4.18Å; I223-L227 WeakPolarHBondContact O-CG 3.3Å; I223-L227 PolarHBondContact O-N 3.48Å
224L92.1Very high92.1Very high2 Ų249.5 Ų49.51%0.0124%0.241CC..Hα-helixtrans-68.3-40.3-178.6-169.361.4000111.6F48 A51 V52 F55 M99 G220 L226 L227 L228 F231F48-L224 HydrophobicContact CD1-CD1 4.31Å; A51-L224 HydrophobicContact CB-CD2 3.55Å; V52-L224 HydrophobicContact CG2-CB 4.05Å; V52-L224 HydrophobicContact CG2-CD2 3.68Å; V52-L224 HydrophobicContact CG2-CG 3.67Å; F55-L224 HydrophobicContact CD2-CB 4.44Å; F55-L224 HydrophobicContact CD2-CD2 3.82Å; F55-L224 HydrophobicContact CE2-CD2 3.85Å; M99-L224 HydrophobicContact CE-CB 3.63Å; M99-L224 HydrophobicContact CE-CD1 4.01Å; M99-L224 HydrophobicContact CE-CG 4.38Å; G220-L224 WeakPolarHBondContact O-CB 3.32Å; G220-L224 PolarHBondContact O-N 3.25Å; L224-L226 VanDerWaalsContact C-N 3.26Å; L224-L226 PolarHBondContact O-N 3.08Å; L224-L227 HydrophobicContact CD1-CB 4.48Å; L224-L227 CarbonylContact O-C 3.49Å; L224-L227 WeakPolarHBondContact O-CA 3.28Å; L224-L227 WeakPolarHBondContact O-CB 3.34Å; L224-L227 PolarHBondContact O-N 3.38Å; L224-L228 PolarHBondContact O-N 3Å; L224-F231 HydrophobicContact CD1-CE2 4.43Å
225S93.5Very high91.7Very high37 Ų3754.5 Ų54.526%0.25927%0.274SS..Hα-helixtrans-60-37.4174.8-62.60000112F221 L228F221-S225 WeakPolarHBondContact O-CB 3.34Å; F221-S225 PolarHBondContact O-N 3.37Å; F221-S225 PolarHBondContact O-OG 3.3Å; S225-L228 PolarHBondContact O-N 2.99Å
226L93.9Very high91.1Very high117 Ų11755.4 Ų55.461%0.61328%0.279SS*.Hα-helixtrans-69.3-35.7173.3-72.1172.8000112.1F222 I223 L224 L228 I229 P230F222-L226 WeakPolarHBondContact O-CB 3.33Å; F222-L226 VanDerWaalsContact O-CG 3.27Å; F222-L226 WeakPolarHBondContact O-CG 3.44Å; F222-L226 PolarHBondContact O-N 2.91Å; I223-L226 PolarHBondContact O-N 3.4Å; L224-L226 VanDerWaalsContact C-N 3.26Å; L224-L226 PolarHBondContact O-N 3.08Å; L226-L228 VanDerWaalsContact C-N 3.32Å; L226-I229 WeakPolarHBondContact O-CB 3.17Å; L226-I229 PolarHBondContact O-N 3.39Å; L226-P230 WeakPolarHBondContact O-CD 3.44Å
227L91.8Very high90.4Very high63 Ų6357 Ų5733%0.3330%0.297SS..Hα-helixtrans-70.2-23.2176-72.9173.9000113.7M99 I223 L224 I229 P230 F231M99-L227 HydrophobicContact CE-CD1 3.91Å; I223-L227 HydrophobicContact CG2-CD1 4.18Å; I223-L227 WeakPolarHBondContact O-CG 3.3Å; I223-L227 PolarHBondContact O-N 3.48Å; L224-L227 HydrophobicContact CD1-CB 4.48Å; L224-L227 CarbonylContact O-C 3.49Å; L224-L227 WeakPolarHBondContact O-CA 3.28Å; L224-L227 WeakPolarHBondContact O-CB 3.34Å; L224-L227 PolarHBondContact O-N 3.38Å; L227-I229 PolarHBondContact O-N 3.18Å; L227-P230 HydrophobicContact CD2-CG 4.4Å; L227-P230 WeakPolarHBondContact O-CD 3.38Å; L227-P230 VanDerWaalsContact O-CG 3.22Å; L227-P230 WeakPolarHBondContact O-CG 3.49Å; L227-F231 HydrophobicContact CB-CE1 4.32Å; L227-F231 HydrophobicContact CB-CE2 4.17Å; L227-F231 HydrophobicContact CB-CZ 4.05Å; L227-F231 HydrophobicContact CD1-CZ 4.43Å; L227-F231 WeakPolarHBondContact O-CB 3.44Å; L227-F231 VanDerWaalsContact O-CD1 3.28Å; L227-F231 WeakPolarHBondContact O-CD1 3.09Å; L227-F231 WeakPolarHBondContact O-CG 3.47Å; L227-F231 PolarHBondContact O-N 3.4Å
228L90.4Very high89.3Confident24 Ų2462.2 Ų62.213%0.12633%0.333CS..Hα-helixtrans-58.6-29172.1-68.1-172.9000112.5F48 V49 V52 L224 S225 L226 F231 F232 E248 A250F48-L228 HydrophobicContact CB-CD2 3.64Å; V49-L228 HydrophobicContact CG2-CD1 4.38Å; V52-L228 HydrophobicContact CG2-CD1 3.77Å; V52-L228 HydrophobicContact CG2-CG 4.16Å; L224-L228 PolarHBondContact O-N 3Å; S225-L228 PolarHBondContact O-N 2.99Å; L226-L228 VanDerWaalsContact C-N 3.32Å; L228-F231 PolarHBondContact O-N 3.47Å; L228-F232 PolarHBondContact O-N 2.87Å; L228-F232 VanDerWaalsContact O-N 3.14Å; L228-E248 HydrophobicContact CD2-CG 4.06Å; L228-A250 HydrophobicContact CD1-CB 4.29Å
229I91.7Very high88Confident105 Ų10562.7 Ų62.754%0.53834%0.335SS..Hα-helixtrans-64.2-57.7178.7-56.5171.4000111.3L226 L227 F231 F232 Y233L226-I229 WeakPolarHBondContact O-CB 3.17Å; L226-I229 PolarHBondContact O-N 3.39Å; L227-I229 PolarHBondContact O-N 3.18Å; I229-F231 VanDerWaalsContact C-N 3.33Å; I229-F231 PolarHBondContact O-N 3.01Å; I229-F232 WeakPolarHBondContact O-CB 3.21Å; I229-F232 PolarHBondContact O-N 2.96Å; I229-Y233 WeakPolarHBondContact O-CD2 3.46Å
230P91Very high87Confident56 Ų5661.7 Ų61.736%0.36433%0.332SS..Hα-helixtrans-65.2-33.6174.723.8-32.6000112.7L226 L227 F232 Y233 I234L226-P230 WeakPolarHBondContact O-CD 3.44Å; L227-P230 HydrophobicContact CD2-CG 4.4Å; L227-P230 WeakPolarHBondContact O-CD 3.38Å; L227-P230 VanDerWaalsContact O-CG 3.22Å; L227-P230 WeakPolarHBondContact O-CG 3.49Å; P230-F232 PolarHBondContact O-N 3.37Å; P230-Y233 PolarHBondContact O-N 2.97Å; P230-I234 WeakPolarHBondContact O-CG1 3.36Å; P230-I234 PolarHBondContact O-N 3.2Å
231F89.4Confident86.1Confident29 Ų2966.3 Ų66.313%0.12736%0.356CS..Hα-helixtrans-61.3-30.5179.7-69.5-0.8000113.1F48 L224 L227 L228 I229 Y233 I234 L247 E248F48-F231 HydrophobicContact CB-CD2 4.43Å; F48-F231 AromaticContact CD1-CD2 3.98Å; F48-F231 HydrophobicContact CD1-CD2 3.98Å; F48-F231 AromaticContact CD1-CE2 3.55Å; F48-F231 HydrophobicContact CD1-CE2 3.55Å; F48-F231 HydrophobicContact CD2-CD2 4.27Å; F48-F231 HydrophobicContact CE1-CD2 4.24Å; F48-F231 AromaticContact CE1-CE2 3.58Å; F48-F231 HydrophobicContact CE1-CE2 3.58Å; F48-F231 HydrophobicContact CE1-CZ 4.35Å; F48-F231 AromaticContact CG-CD2 3.97Å; F48-F231 HydrophobicContact CG-CD2 3.97Å; F48-F231 HydrophobicContact CG-CE2 4.04Å; F48-F231 HydrophobicContact CZ-CE2 4.12Å; L224-F231 HydrophobicContact CD1-CE2 4.43Å; L227-F231 HydrophobicContact CB-CE1 4.32Å; L227-F231 HydrophobicContact CB-CE2 4.17Å; L227-F231 HydrophobicContact CB-CZ 4.05Å; L227-F231 HydrophobicContact CD1-CZ 4.43Å; L227-F231 WeakPolarHBondContact O-CB 3.44Å; L227-F231 VanDerWaalsContact O-CD1 3.28Å; L227-F231 WeakPolarHBondContact O-CD1 3.09Å; L227-F231 WeakPolarHBondContact O-CG 3.47Å; L227-F231 PolarHBondContact O-N 3.4Å; L228-F231 PolarHBondContact O-N 3.47Å; I229-F231 VanDerWaalsContact C-N 3.33Å; I229-F231 PolarHBondContact O-N 3.01Å; F231-Y233 PolarHBondContact O-N 2.93Å; F231-I234 HydrophobicContact CD1-CD1 4.22Å; F231-I234 PolarHBondContact O-N 3.18Å; F231-L247 HydrophobicContact CB-CB 4.27Å; F231-L247 HydrophobicContact CB-CD2 4.17Å; F231-L247 HydrophobicContact CB-CG 4.38Å; F231-L247 HydrophobicContact CD1-CD2 3.47Å; F231-L247 VanDerWaalsContact CD1-CD2 3.47Å; F231-L247 HydrophobicContact CD2-CD2 3.98Å; F231-L247 HydrophobicContact CD2-CG 4.43Å; F231-L247 HydrophobicContact CE1-CD2 3.69Å; F231-L247 HydrophobicContact CE2-CD2 4.19Å; F231-L247 HydrophobicContact CG-CD2 3.61Å; F231-L247 HydrophobicContact CG-CG 4.22Å; F231-L247 HydrophobicContact CZ-CD2 4.05Å; F231-E248 HydrophobicContact CB-CB 4.06Å; F231-E248 PolarHBondContact O-N 3.06Å
232F88.3Confident85.3Confident38 Ų3864.1 Ų64.117%0.16735%0.347CS..THydrogen-bonded Turntrans-62.2-24.2172.7-178.8-90.9000114.6L228 I229 P230 R244 E248 D249 L251L228-F232 PolarHBondContact O-N 2.87Å; L228-F232 VanDerWaalsContact O-N 3.14Å; I229-F232 WeakPolarHBondContact O-CB 3.21Å; I229-F232 PolarHBondContact O-N 2.96Å; P230-F232 PolarHBondContact O-N 3.37Å; F232-R244 PolarHBondContact O-NH2 2.97Å; F232-E248 VanDerWaalsContact CA-O 3.25Å; F232-E248 WeakPolarHBondContact CA-O 3.5Å; F232-D249 WeakPolarHBondContact CE2-OD1 3.48Å; F232-L251 HydrophobicContact CE2-CB 4.31Å; F232-L251 HydrophobicContact CE2-CD1 3.74Å; F232-L251 HydrophobicContact CE2-CG 3.99Å; F232-L251 HydrophobicContact CZ-CD1 3.93Å
233Y88.1Confident84.6Confident166 Ų16662.2 Ų62.265%0.65135%0.345SS*.THydrogen-bonded Turntrans-104.8-11.3-177.1-64.5-74.7000113.9I229 P230 F231 P235I229-Y233 WeakPolarHBondContact O-CD2 3.46Å; P230-Y233 PolarHBondContact O-N 2.97Å; F231-Y233 PolarHBondContact O-N 2.93Å; Y233-P235 VanDerWaalsContact O-CD 3.23Å; Y233-P235 WeakPolarHBondContact O-CD 3.38Å
234I86.4Confident84Confident74 Ų7465.1 Ų65.138%0.37935%0.352SS..  trans-86.5112.3-177.9-65.7166.4000109.2P230 F231 V236 V246 L247P230-I234 WeakPolarHBondContact O-CG1 3.36Å; P230-I234 PolarHBondContact O-N 3.2Å; F231-I234 HydrophobicContact CD1-CD1 4.22Å; F231-I234 PolarHBondContact O-N 3.18Å; I234-V236 HydrophobicContact CG2-CG1 3.97Å; I234-V246 CarbonylContact O-C 3.5Å; I234-V246 VanDerWaalsContact O-CA 3.23Å; I234-V246 WeakPolarHBondContact O-CA 3.46Å; I234-V246 WeakPolarHBondContact O-CB 3.47Å; I234-L247 HydrophobicContact CB-CB 4.43Å; I234-L247 PolarHBondContact O-N 2.96Å
235P84.9Confident83.7Confident105 Ų10569.6 Ų69.668%0.68237%0.373SS*.BIsolated β-bridgetrans-76132.4172.832.1-32.8000109.9Y233 H245Y233-P235 VanDerWaalsContact O-CD 3.23Å; Y233-P235 WeakPolarHBondContact O-CD 3.38Å; P235-H245 WeakPolarHBondContact CA-O 3.45Å
236V79.5Confident83.4Confident31 Ų3168.3 Ų68.319%0.18836%0.364CS..  trans-122.54.9-179.4-58.80000113.1I234 S238 F239 S240 H245 L247I234-V236 HydrophobicContact CG2-CG1 3.97Å; V236-S238 PolarHBondContact O-N 3.18Å; V236-F239 HydrophobicContact CB-CB 4.09Å; V236-F239 HydrophobicContact CG2-CB 4.09Å; V236-F239 VanDerWaalsContact O-CD2 3.25Å; V236-F239 WeakPolarHBondContact O-CD2 3.34Å; V236-F239 PolarHBondContact O-N 3.31Å; V236-S240 VanDerWaalsContact CG2-CB 3.45Å; V236-H245 PolarHBondContact N-O 3.12Å; V236-L247 HydrophobicContact CG1-CB 3.77Å; V236-L247 HydrophobicContact CG1-CD1 3.96Å; V236-L247 HydrophobicContact CG1-CG 4.39Å
237G78.7Confident82.9Confident38 Ų3864.3 Ų64.339%0.39234%0.343SS..G310 helixtrans57.9-126.6175.500000111.5F239 S240 H245G237-F239 PolarHBondContact O-N 3.4Å; G237-F239 VanDerWaalsContact O-N 3.17Å; G237-S240 PolarHBondContact O-N 3.23Å; G237-H245 PolarHBondContact N-O 3.47Å; G237-H245 PolarHBondContact O-ND1 2.8Å
238S70.1Confident82.7Confident109 Ų10961.4 Ų61.476%0.76233%0.328SS*.G310 helixtrans-67.3-10.7-177-49.20000115.1V236 S240V236-S238 PolarHBondContact O-N 3.18Å; S238-S240 PolarHBondContact O-N 3.44Å
239F68.4Low82.7Confident97 Ų9760.9 Ų60.943%0.42533%0.325SS..G310 helixtrans-76.5-4.6178.6-65.2-65.1000113.8N110 M111 V236 G237N110-F239 PolarHBondContact ND2-O 2.68Å; M111-F239 HydrophobicContact CE-CE1 3.74Å; M111-F239 HydrophobicContact CG-CD1 3.98Å; M111-F239 HydrophobicContact CG-CE1 3.92Å; M111-F239 HydrophobicContact SD-CD1 3.93Å; M111-F239 HydrophobicContact SD-CE1 3.52Å; M111-F239 VanDerWaalsContact SD-CE1 3.52Å; V236-F239 HydrophobicContact CB-CB 4.09Å; V236-F239 HydrophobicContact CG2-CB 4.09Å; V236-F239 VanDerWaalsContact O-CD2 3.25Å; V236-F239 WeakPolarHBondContact O-CD2 3.34Å; V236-F239 PolarHBondContact O-N 3.31Å; G237-F239 PolarHBondContact O-N 3.4Å; G237-F239 VanDerWaalsContact O-N 3.17Å
240S73.8Confident82.7Confident8 Ų856.5 Ų56.56%0.05630%0.304CS..  trans-132.1137.3178177.80000111.5V236 G237 S238 N242 H245 V246V236-S240 VanDerWaalsContact CG2-CB 3.45Å; G237-S240 PolarHBondContact O-N 3.23Å; S238-S240 PolarHBondContact O-N 3.44Å; S240-N242 VanDerWaalsContact C-N 3.35Å; S240-N242 PolarHBondContact OG-N 3.13Å; S240-N242 PolarHBondContact OG-ND2 3.15Å; S240-H245 PolarHBondContact O-ND1 3.05Å; S240-V246 WeakPolarHBondContact CB-O 3.27Å; S240-V246 PolarHBondContact OG-O 3.23Å
241N71.9Confident82.6Confident97 Ų9758.8 Ų58.852%0.51931%0.313SS..  trans-90.11.9177.4-67.1-40.2000113
242N78.9Confident82.6Confident2 Ų257.7 Ų57.71%0.01131%0.308CS..SBendtrans-76.1152.2177.470.246.5000111.7S240 R244 H245 V246S240-N242 VanDerWaalsContact C-N 3.35Å; S240-N242 PolarHBondContact OG-N 3.13Å; S240-N242 PolarHBondContact OG-ND2 3.15Å; N242-R244 PolarHBondContact O-N 3.24Å; N242-R244 PolarHBondContact OD1-N 3.14Å; N242-H245 PolarHBondContact O-N 3.14Å; N242-H245 WeakPolarHBondContact OD1-CA 3.38Å; N242-H245 PolarHBondContact OD1-N 3.1Å; N242-V246 PolarHBondContact ND2-O 3.04Å; N242-V246 PolarHBondContact OD1-N 3.19Å
243P79.9Confident82.7Confident60 Ų6055.9 Ų55.939%0.3930%0.301SS..THydrogen-bonded Turntrans-60-19.8-174.5-26.134.5000115.1H42H42-P243 WeakPolarHBondContact NE2-CD 3.31Å
244R82.3Confident82.9Confident109 Ų10954.1 Ų54.141%0.41130%0.296SS..THydrogen-bonded Turntrans-96.4-4.1-180-77.2-179.553.6-143-4.4113.4F232 N242 V246 D249F232-R244 PolarHBondContact O-NH2 2.97Å; N242-R244 PolarHBondContact O-N 3.24Å; N242-R244 PolarHBondContact OD1-N 3.14Å; R244-V246 HydrophobicContact CB-CG1 4.19Å; R244-V246 HydrophobicContact CB-CG2 4.09Å; R244-V246 PolarHBondContact O-N 2.99Å; R244-V246 VanDerWaalsContact O-N 3.13Å; R244-D249 VanDerWaalsContact CD-OD2 3.31Å; R244-D249 WeakPolarHBondContact CD-OD2 3.33Å; R244-D249 IonicContact CZ-OD2 3.14Å; R244-D249 IonicContact NE-OD2 3.17Å; R244-D249 IonicContact NH1-OD1 3.68Å; R244-D249 IonicContact NH1-OD2 3.96Å; R244-D249 PolarHBondContact NH1-OD2 3.23Å
245H84.3Confident83.1Confident97 Ų9752.5 Ų52.545%0.44929%0.291SS..  trans47.936.3-174.3-62.7-69.9000113.3P235 V236 G237 S240 N242P235-H245 WeakPolarHBondContact CA-O 3.45Å; V236-H245 PolarHBondContact N-O 3.12Å; G237-H245 PolarHBondContact N-O 3.47Å; G237-H245 PolarHBondContact O-ND1 2.8Å; S240-H245 PolarHBondContact O-ND1 3.05Å; N242-H245 PolarHBondContact O-N 3.14Å; N242-H245 WeakPolarHBondContact OD1-CA 3.38Å; N242-H245 PolarHBondContact OD1-N 3.1Å
246V87.6Confident83.3Confident9 Ų947.5 Ų47.56%0.05526%0.259CS..BIsolated β-bridgetrans-95.6162.2173.3-65.30000110.1I234 S240 N242 R244 E248 D249I234-V246 CarbonylContact O-C 3.5Å; I234-V246 VanDerWaalsContact O-CA 3.23Å; I234-V246 WeakPolarHBondContact O-CA 3.46Å; I234-V246 WeakPolarHBondContact O-CB 3.47Å; S240-V246 WeakPolarHBondContact CB-O 3.27Å; S240-V246 PolarHBondContact OG-O 3.23Å; N242-V246 PolarHBondContact ND2-O 3.04Å; N242-V246 PolarHBondContact OD1-N 3.19Å; R244-V246 HydrophobicContact CB-CG1 4.19Å; R244-V246 HydrophobicContact CB-CG2 4.09Å; R244-V246 PolarHBondContact O-N 2.99Å; R244-V246 VanDerWaalsContact O-N 3.13Å; V246-E248 VanDerWaalsContact C-N 3.28Å; V246-E248 PolarHBondContact O-N 3.42Å; V246-D249 HydrophobicContact CG2-CB 4.06Å
247L83.8Confident83.9Confident34 Ų3447.3 Ų47.318%0.17826%0.256CS..SBendtrans-59.4-40-177.4-174.662000112.2F48 F231 I234 V236F48-L247 HydrophobicContact CD2-CG 4.46Å; F48-L247 HydrophobicContact CE2-CD1 3.71Å; F48-L247 HydrophobicContact CE2-CD2 4.41Å; F48-L247 HydrophobicContact CE2-CG 3.73Å; F48-L247 HydrophobicContact CZ-CD1 4.05Å; F48-L247 HydrophobicContact CZ-CD2 4.41Å; F48-L247 HydrophobicContact CZ-CG 4.18Å; F231-L247 HydrophobicContact CB-CB 4.27Å; F231-L247 HydrophobicContact CB-CD2 4.17Å; F231-L247 HydrophobicContact CB-CG 4.38Å; F231-L247 HydrophobicContact CD1-CD2 3.47Å; F231-L247 VanDerWaalsContact CD1-CD2 3.47Å; F231-L247 HydrophobicContact CD2-CD2 3.98Å; F231-L247 HydrophobicContact CD2-CG 4.43Å; F231-L247 HydrophobicContact CE1-CD2 3.69Å; F231-L247 HydrophobicContact CE2-CD2 4.19Å; F231-L247 HydrophobicContact CG-CD2 3.61Å; F231-L247 HydrophobicContact CG-CG 4.22Å; F231-L247 HydrophobicContact CZ-CD2 4.05Å; I234-L247 HydrophobicContact CB-CB 4.43Å; I234-L247 PolarHBondContact O-N 2.96Å; V236-L247 HydrophobicContact CG1-CB 3.77Å; V236-L247 HydrophobicContact CG1-CD1 3.96Å; V236-L247 HydrophobicContact CG1-CG 4.39Å
248E88.5Confident84.4Confident2 Ų248.5 Ų48.51%0.00927%0.269CS..  trans-152.9132.8171.7-172.476165.700110.4H46 P47 F48 V49 L228 F231 F232 V246H46-E248 WeakPolarHBondContact CA-OE1 3.43Å; H46-E248 VanDerWaalsContact CB-OE1 3.29Å; H46-E248 WeakPolarHBondContact CB-OE1 3.26Å; P47-E248 WeakPolarHBondContact CD-OE2 3.38Å; F48-E248 HydrophobicContact CB-CB 4.22Å; F48-E248 HydrophobicContact CB-CG 3.9Å; F48-E248 HydrophobicContact CD2-CB 3.98Å; F48-E248 HydrophobicContact CD2-CG 4.39Å; F48-E248 WeakPolarHBondContact CD2-OE2 3.42Å; F48-E248 HydrophobicContact CG-CB 4.48Å; F48-E248 PolarHBondContact N-OE1 3.05Å; V49-E248 WeakPolarHBondContact CB-OE1 3.31Å; V49-E248 HydrophobicContact CG2-CG 4.17Å; V49-E248 WeakPolarHBondContact CG2-OE1 3.48Å; V49-E248 PolarHBondContact N-OE1 2.9Å; L228-E248 HydrophobicContact CD2-CG 4.06Å; F231-E248 HydrophobicContact CB-CB 4.06Å; F231-E248 PolarHBondContact O-N 3.06Å; F232-E248 VanDerWaalsContact CA-O 3.25Å; F232-E248 WeakPolarHBondContact CA-O 3.5Å; V246-E248 VanDerWaalsContact C-N 3.28Å; V246-E248 PolarHBondContact O-N 3.42Å
249D90Very high85.4Confident13 Ų1348.8 Ų48.87%0.0726%0.258CS..  trans-108.181.7169.6-164.1-26.1000110.8H46 F232 R244 V246 L251 D252 A253H46-D249 PolarHBondContact CE1-O 2.87Å; H46-D249 PolarHBondContact ND1-O 3.31Å; F232-D249 WeakPolarHBondContact CE2-OD1 3.48Å; R244-D249 VanDerWaalsContact CD-OD2 3.31Å; R244-D249 WeakPolarHBondContact CD-OD2 3.33Å; R244-D249 IonicContact CZ-OD2 3.14Å; R244-D249 IonicContact NE-OD2 3.17Å; R244-D249 IonicContact NH1-OD1 3.68Å; R244-D249 IonicContact NH1-OD2 3.96Å; R244-D249 PolarHBondContact NH1-OD2 3.23Å; V246-D249 HydrophobicContact CG2-CB 4.06Å; D249-L251 PolarHBondContact O-N 3.46Å; D249-L251 PolarHBondContact OD1-N 2.82Å; D249-D252 HydrophobicContact CB-CB 3.9Å; D249-D252 PolarHBondContact O-N 3.02Å; D249-D252 VanDerWaalsContact O-N 3.14Å; D249-D252 PolarHBondContact OD1-N 3.24Å; D249-D252 VanDerWaalsContact OD1-N 3.08Å; D249-A253 PolarHBondContact O-N 3Å; D249-A253 VanDerWaalsContact O-N 3.09Å
250A90.2Very high86.4Confident13 Ų1346 Ų4611%0.10725%0.247CC..Hα-helixtrans-60.3-30.2-178.400000113.3V49 L228 A253 F254V49-A250 HydrophobicContact CG2-CB 3.75Å; L228-A250 HydrophobicContact CD1-CB 4.29Å; A250-A253 WeakPolarHBondContact O-CB 3.42Å; A250-A253 PolarHBondContact O-N 2.03Å; A250-F254 HydrophobicContact CB-CE2 4.46Å; A250-F254 WeakPolarHBondContact O-CD2 3.47Å; A250-F254 WeakPolarHBondContact O-CE2 3.38Å; A250-F254 PolarHBondContact O-N 3.38Å
251L90.2Very high87.1Confident103 Ų10349.9 Ų49.954%0.53927%0.272SS..Hα-helixtrans-68.6-43177.9-65.2-178.8000110.8C36 F232 D249 A253 F254 C255C36-L251 VanDerWaalsContact SG-C 3.59Å; C36-L251 PolarHBondContact SG-O 3.11Å; F232-L251 HydrophobicContact CE2-CB 4.31Å; F232-L251 HydrophobicContact CE2-CD1 3.74Å; F232-L251 HydrophobicContact CE2-CG 3.99Å; F232-L251 HydrophobicContact CZ-CD1 3.93Å; D249-L251 PolarHBondContact O-N 3.46Å; D249-L251 PolarHBondContact OD1-N 2.82Å; L251-A253 VanDerWaalsContact C-N 3.32Å; L251-A253 PolarHBondContact O-N 3.3Å; L251-F254 PolarHBondContact O-N 2.92Å; L251-C255 PolarHBondContact O-N 3.37Å; L251-C255 VanDerWaalsContact O-N 3.08Å
252D89.8Confident88.1Confident7 Ų749.3 Ų49.34%0.03727%0.268CS..Hα-helixtrans-62-40.9176.3-167.574.2000111.8G35 C36 H42 H46 D249 F254 C255 Q256G35-D252 WeakPolarHBondContact CA-OD1 3.14Å; C36-D252 PolarHBondContact N-OD1 3.23Å; H42-D252 IonicContact CE1-OD1 2.88Å; H42-D252 IonicContact CE1-OD2 2.71Å; H42-D252 PolarHBondContact CE1-OD2 3.37Å; H42-D252 IonicContact NE2-OD2 2.75Å; H42-D252 PolarHBondContact NE2-OD2 3.3Å; H46-D252 IonicContact CE1-OD2 3.89Å; H46-D252 IonicContact NE2-OD2 2.77Å; H46-D252 PolarHBondContact NE2-OD2 2.98Å; D249-D252 HydrophobicContact CB-CB 3.9Å; D249-D252 PolarHBondContact O-N 3.02Å; D249-D252 VanDerWaalsContact O-N 3.14Å; D249-D252 PolarHBondContact OD1-N 3.24Å; D249-D252 VanDerWaalsContact OD1-N 3.08Å; D252-F254 VanDerWaalsContact C-N 3.33Å; D252-F254 PolarHBondContact O-N 3.01Å; D252-C255 WeakPolarHBondContact O-CB 3.16Å; D252-C255 PolarHBondContact O-N 3.18Å; D252-C255 VanDerWaalsContact O-N 3.11Å; D252-Q256 PolarHBondContact O-N 3.2Å
253A90.1Very high88.6Confident0 Ų049.2 Ų49.20%027%0.267CS..Hα-helixtrans-54.8-46.8172.500000111.9F44 H46 V49 D249 A250 L251 C255 Q256 I257F44-A253 HydrophobicContact CE2-CB 4.15Å; F44-A253 HydrophobicContact CZ-CB 4.47Å; H46-A253 HydrophobicContact CB-CB 3.89Å; H46-A253 VanDerWaalsContact CG-CB 3.49Å; V49-A253 HydrophobicContact CB-CB 4.36Å; V49-A253 HydrophobicContact CG1-CB 4.15Å; V49-A253 HydrophobicContact CG2-CB 3.98Å; D249-A253 PolarHBondContact O-N 3Å; D249-A253 VanDerWaalsContact O-N 3.09Å; A250-A253 WeakPolarHBondContact O-CB 3.42Å; A250-A253 PolarHBondContact O-N 2.03Å; L251-A253 VanDerWaalsContact C-N 3.32Å; L251-A253 PolarHBondContact O-N 3.3Å; A253-C255 PolarHBondContact O-N 3.31Å; A253-Q256 PolarHBondContact O-N 3.46Å; A253-I257 WeakPolarHBondContact O-CB 3.38Å; A253-I257 WeakPolarHBondContact O-CD1 3.33Å; A253-I257 WeakPolarHBondContact O-CG1 3.46Å; A253-I257 PolarHBondContact O-N 3.31Å
254F91.8Very high89.2Confident129 Ų12949.9 Ų49.957%0.56627%0.267SS*.Hα-helixtrans-65-35.7178-68.8-58.8000113A250 L251 D252 I257 G258A250-F254 HydrophobicContact CB-CE2 4.46Å; A250-F254 WeakPolarHBondContact O-CD2 3.47Å; A250-F254 WeakPolarHBondContact O-CE2 3.38Å; A250-F254 PolarHBondContact O-N 3.38Å; L251-F254 PolarHBondContact O-N 2.92Å; D252-F254 VanDerWaalsContact C-N 3.33Å; D252-F254 PolarHBondContact O-N 3.01Å; F254-I257 HydrophobicContact CD1-CD1 4.49Å; F254-G258 PolarHBondContact O-N 3.44Å; F254-G258 VanDerWaalsContact O-N 3.08Å
255C91Very high89.7Confident40 Ų4049.2 Ų49.227%0.2727%0.271SS..Hα-helixtrans-64.6-47172.7-77.20000111.7C36 L251 D252 A253 I257 G258 H259C36-C255 WeakPolarHBondContact CA-SG 3.26Å; C36-C255 HydrophobicContact CB-CB 3.98Å; C36-C255 WeakPolarHBondContact CB-SG 3.23Å; C36-C255 WeakPolarHBondContact SG-CB 3.4Å; C36-C255 CovalentContact SG-SG 2.03Å; C36-C255 PolarHBondContact SG-SG 3.37Å; L251-C255 PolarHBondContact O-N 3.37Å; L251-C255 VanDerWaalsContact O-N 3.08Å; D252-C255 WeakPolarHBondContact O-CB 3.16Å; D252-C255 PolarHBondContact O-N 3.18Å; D252-C255 VanDerWaalsContact O-N 3.11Å; A253-C255 PolarHBondContact O-N 3.31Å; C255-I257 VanDerWaalsContact C-N 3.32Å; C255-I257 PolarHBondContact O-N 2.68Å; C255-G258 PolarHBondContact O-N 2.78Å; C255-G258 VanDerWaalsContact O-N 3.12Å; C255-H259 PolarHBondContact O-N 3.08Å; C255-H259 PolarHBondContact O-ND1 2.77Å
256Q89.7Confident90.1Very high0 Ų044.6 Ų44.60%025%0.249CC..Hα-helixtrans-60.1-43.1178.4-73.4-173.1-40.400111.8A33 H42 F44 H46 D252 A253 G258 H259 N260 I263A33-Q256 HydrophobicContact CB-CB 3.92Å; A33-Q256 HydrophobicContact CB-CG 4.03Å; A33-Q256 PolarHBondContact O-NE2 3.42Å; A33-Q256 VanDerWaalsContact O-NE2 3.16Å; H42-Q256 PolarHBondContact CD2-NE2 3.14Å; H42-Q256 PolarHBondContact CE1-NE2 3.09Å; H42-Q256 VanDerWaalsContact CE1-NE2 3.35Å; H42-Q256 PolarHBondContact NE2-NE2 3.47Å; H42-Q256 VanDerWaalsContact NE2-NE2 3.18Å; H42-Q256 PolarHBondContact O-NE2 3.08Å; H42-Q256 VanDerWaalsContact O-NE2 3.16Å; F44-Q256 HydrophobicContact CD2-CB 4.09Å; F44-Q256 VanDerWaalsContact CD2-OE1 3.26Å; F44-Q256 HydrophobicContact CE2-CB 4.47Å; H46-Q256 PolarHBondContact CD2-OE1 2.97Å; H46-Q256 VanDerWaalsContact CD2-OE1 3.3Å; H46-Q256 PolarHBondContact NE2-OE1 3.19Å; H46-Q256 VanDerWaalsContact NE2-OE1 3.11Å; D252-Q256 PolarHBondContact O-N 3.2Å; A253-Q256 PolarHBondContact O-N 3.46Å; Q256-G258 VanDerWaalsContact C-N 3.3Å; Q256-G258 PolarHBondContact O-N 3.01Å; Q256-H259 PolarHBondContact O-N 3Å; Q256-N260 PolarHBondContact O-N 3.05Å; Q256-I263 HydrophobicContact CB-CD1 4.3Å
257I91.6Very high90.3Very high26 Ų2645.5 Ų45.513%0.13325%0.254CS..Hα-helixtrans-59-40.6174.7-71.8167.1000111.4F44 A253 F254 C255 N260 I263 I264 L267F44-I257 HydrophobicContact CE2-CD1 4.22Å; F44-I257 HydrophobicContact CE2-CG1 3.92Å; F44-I257 HydrophobicContact CZ-CD1 4.26Å; F44-I257 HydrophobicContact CZ-CG1 4.32Å; A253-I257 WeakPolarHBondContact O-CB 3.38Å; A253-I257 WeakPolarHBondContact O-CD1 3.33Å; A253-I257 WeakPolarHBondContact O-CG1 3.46Å; A253-I257 PolarHBondContact O-N 3.31Å; F254-I257 HydrophobicContact CD1-CD1 4.49Å; C255-I257 VanDerWaalsContact C-N 3.32Å; C255-I257 PolarHBondContact O-N 2.68Å; I257-N260 CarbonylContact O-C 3.56Å; I257-I263 HydrophobicContact CG1-CB 4.49Å; I257-I263 HydrophobicContact CG1-CG2 3.83Å; I257-I264 HydrophobicContact CG2-CD1 3.81Å; I257-I264 HydrophobicContact CG2-CG1 3.38Å; I257-L267 HydrophobicContact CD1-CD1 3.59Å; I257-L267 HydrophobicContact CG1-CD1 3.98Å
258G89.4Confident90.7Very high64 Ų6448.4 Ų48.466%0.6627%0.269SS*.Hα-helixtrans-68.1-34.9177.500000113.8F254 C255 Q256F254-G258 PolarHBondContact O-N 3.44Å; F254-G258 VanDerWaalsContact O-N 3.08Å; C255-G258 PolarHBondContact O-N 2.78Å; C255-G258 VanDerWaalsContact O-N 3.12Å; Q256-G258 VanDerWaalsContact C-N 3.3Å; Q256-G258 PolarHBondContact O-N 3.01Å
259H90.3Very high90.9Very high115 Ų11549.6 Ų49.653%0.53228%0.282SS..Hα-helixtrans-79.4-35.4179.3-66.8127.8000113.4K34 C255 Q256K34-H259 PolarHBondContact O-ND1 3.04Å; C255-H259 PolarHBondContact O-N 3.08Å; C255-H259 PolarHBondContact O-ND1 2.77Å; Q256-H259 PolarHBondContact O-N 3Å
260N89.4Confident90.9Very high38 Ų3849.1 Ų49.120%0.20328%0.279CS..  trans-124.396.6179.9-171.1-10.7000111.3A33 Q256 I257 M262 I263A33-N260 HydrophobicContact CB-CB 4.05Å; Q256-N260 PolarHBondContact O-N 3.05Å; I257-N260 CarbonylContact O-C 3.56Å; N260-M262 PolarHBondContact O-N 2.88Å; N260-M262 VanDerWaalsContact O-N 3.1Å; N260-M262 WeakPolarHBondContact OD1-CB 3.32Å; N260-M262 PolarHBondContact OD1-N 3.45Å; N260-M262 VanDerWaalsContact OD1-N 3.14Å; N260-I263 HydrophobicContact CB-CD1 3.98Å; N260-I263 HydrophobicContact CB-CG1 4.17Å; N260-I263 WeakPolarHBondContact O-CB 3.49Å; N260-I263 WeakPolarHBondContact O-CG1 3.46Å; N260-I263 PolarHBondContact O-N 3.02Å
261P88.9Confident91.1Very high89 Ų8949.7 Ų49.758%0.57828%0.281SS*.Hα-helixtrans-68-12.2-17728.3-35.1000113.6I263 I264 L265P261-I263 PolarHBondContact O-N 2.78Å; P261-I264 WeakPolarHBondContact O-CB 3.16Å; P261-I264 PolarHBondContact O-N 2.88Å; P261-I264 VanDerWaalsContact O-N 3.13Å; P261-L265 PolarHBondContact O-N 3.33Å
262M91.5Very high91.3Very high86 Ų8648.6 Ų48.642%0.42428%0.279SS..Hα-helixtrans-64.5-27.1172.3-65.5-68-79.500111.8W27 F31 N260 I264 L265 A266W27-M262 HydrophobicContact CH2-CE 4.25Å; W27-M262 HydrophobicContact CZ2-CE 4.17Å; F31-M262 HydrophobicContact CE1-CB 3.93Å; F31-M262 HydrophobicContact CE2-CB 4.26Å; F31-M262 HydrophobicContact CZ-CB 3.74Å; N260-M262 PolarHBondContact O-N 2.88Å; N260-M262 VanDerWaalsContact O-N 3.1Å; N260-M262 WeakPolarHBondContact OD1-CB 3.32Å; N260-M262 PolarHBondContact OD1-N 3.45Å; N260-M262 VanDerWaalsContact OD1-N 3.14Å; M262-I264 VanDerWaalsContact C-N 3.31Å; M262-I264 PolarHBondContact O-N 3.29Å; M262-L265 WeakPolarHBondContact O-CB 3.47Å; M262-L265 PolarHBondContact O-N 3.23Å; M262-A266 PolarHBondContact O-N 3.42Å; M262-A266 VanDerWaalsContact O-N 3.12Å
263I91.5Very high91.5Very high0 Ų048.6 Ų48.60%028%0.279CS..Hα-helixtrans-62.8-40.8173.5-58.7175.4000109.8F31 A33 F44 Q256 I257 N260 P261 L265 A266 L267F31-I263 HydrophobicContact CB-CD1 4.12Å; F31-I263 HydrophobicContact CB-CG1 3.73Å; F31-I263 HydrophobicContact CD2-CG1 4.02Å; F31-I263 HydrophobicContact CG-CG1 4.02Å; A33-I263 HydrophobicContact CB-CD1 4.16Å; F44-I263 HydrophobicContact CB-CD1 4.47Å; F44-I263 HydrophobicContact CD1-CG2 4.28Å; F44-I263 HydrophobicContact CD2-CD1 3.97Å; F44-I263 HydrophobicContact CD2-CG2 3.94Å; F44-I263 HydrophobicContact CE1-CG2 4.17Å; F44-I263 HydrophobicContact CE2-CG2 3.84Å; F44-I263 HydrophobicContact CG-CD1 4.37Å; F44-I263 HydrophobicContact CG-CG2 4.18Å; F44-I263 HydrophobicContact CZ-CG2 3.96Å; Q256-I263 HydrophobicContact CB-CD1 4.3Å; I257-I263 HydrophobicContact CG1-CB 4.49Å; I257-I263 HydrophobicContact CG1-CG2 3.83Å; N260-I263 HydrophobicContact CB-CD1 3.98Å; N260-I263 HydrophobicContact CB-CG1 4.17Å; N260-I263 WeakPolarHBondContact O-CB 3.49Å; N260-I263 WeakPolarHBondContact O-CG1 3.46Å; N260-I263 PolarHBondContact O-N 3.02Å; P261-I263 PolarHBondContact O-N 2.78Å; I263-L265 VanDerWaalsContact C-N 3.29Å; I263-L265 PolarHBondContact O-N 2.96Å; I263-A266 PolarHBondContact O-N 3.27Å; I263-L267 HydrophobicContact CG2-CD1 3.92Å; I263-L267 HydrophobicContact CG2-CG 4.14Å; I263-L267 WeakPolarHBondContact O-CB 3.32Å; I263-L267 VanDerWaalsContact O-CG 3.27Å; I263-L267 WeakPolarHBondContact O-CG 3.01Å; I263-L267 PolarHBondContact O-N 3.38Å
264I91.6Very high91.6Very high73 Ų7348.8 Ų48.837%0.37428%0.28SS..Hα-helixtrans-59-43176-61.3174.3000110.6I257 P261 M262 A266 L267 L268I257-I264 HydrophobicContact CG2-CD1 3.81Å; I257-I264 HydrophobicContact CG2-CG1 3.38Å; P261-I264 WeakPolarHBondContact O-CB 3.16Å; P261-I264 PolarHBondContact O-N 2.88Å; P261-I264 VanDerWaalsContact O-N 3.13Å; M262-I264 VanDerWaalsContact C-N 3.31Å; M262-I264 PolarHBondContact O-N 3.29Å; I264-A266 PolarHBondContact O-N 2.86Å; I264-L267 PolarHBondContact O-N 3.33Å; I264-L268 HydrophobicContact CG2-CD1 3.81Å; I264-L268 HydrophobicContact CG2-CG 4.09Å; I264-L268 WeakPolarHBondContact O-CB 3.48Å; I264-L268 VanDerWaalsContact O-CG 3.28Å; I264-L268 WeakPolarHBondContact O-CG 3.35Å; I264-L268 PolarHBondContact O-N 2.94Å
265L92.5Very high91.8Very high96 Ų9643.1 Ų43.150%0.50326%0.257SS..Hα-helixtrans-62.7-43.4179.3-178.561.9000111.6W27 P261 M262 I263 L268 G269W27-L265 HydrophobicContact CH2-CD2 4.3Å; P261-L265 PolarHBondContact O-N 3.33Å; M262-L265 WeakPolarHBondContact O-CB 3.47Å; M262-L265 PolarHBondContact O-N 3.23Å; I263-L265 VanDerWaalsContact C-N 3.29Å; I263-L265 PolarHBondContact O-N 2.96Å; L265-L268 PolarHBondContact O-N 2.89Å; L265-G269 PolarHBondContact O-N 3.17Å
266A92Very high92Very high0 Ų046.2 Ų46.20%027%0.266CS..Hα-helixtrans-64.2-43.8175.900000111.9W27 A28 F31 M262 I263 I264 G269 N270W27-A266 HydrophobicContact CD2-CB 4.42Å; W27-A266 HydrophobicContact CE3-CB 3.88Å; W27-A266 HydrophobicContact CZ3-CB 4.42Å; A28-A266 HydrophobicContact CB-CB 3.85Å; F31-A266 HydrophobicContact CE2-CB 4.17Å; M262-A266 PolarHBondContact O-N 3.42Å; M262-A266 VanDerWaalsContact O-N 3.12Å; I263-A266 PolarHBondContact O-N 3.27Å; I264-A266 PolarHBondContact O-N 2.86Å; A266-G269 PolarHBondContact O-N 3.45Å; A266-N270 PolarHBondContact O-N 3.34Å
267L91.9Very high92.2Very high27 Ų2746.9 Ų46.914%0.14127%0.269CS..Hα-helixtrans-64-41.5176.5-68.3177.8000112.3A28 F44 Q50 I257 I263 I264 N270 T271A28-L267 HydrophobicContact CB-CD2 4.39Å; F44-L267 HydrophobicContact CE1-CD2 4.13Å; F44-L267 HydrophobicContact CZ-CD1 4.19Å; F44-L267 HydrophobicContact CZ-CD2 4.43Å; Q50-L267 HydrophobicContact CG-CD2 3.8Å; I257-L267 HydrophobicContact CD1-CD1 3.59Å; I257-L267 HydrophobicContact CG1-CD1 3.98Å; I263-L267 HydrophobicContact CG2-CD1 3.92Å; I263-L267 HydrophobicContact CG2-CG 4.14Å; I263-L267 WeakPolarHBondContact O-CB 3.32Å; I263-L267 VanDerWaalsContact O-CG 3.27Å; I263-L267 WeakPolarHBondContact O-CG 3.01Å; I263-L267 PolarHBondContact O-N 3.38Å; I264-L267 PolarHBondContact O-N 3.33Å; L267-N270 WeakPolarHBondContact O-CB 3.48Å; L267-N270 PolarHBondContact O-N 2.86Å; L267-T271 WeakPolarHBondContact O-CB 3.41Å; L267-T271 PolarHBondContact O-N 3.5Å; L267-T271 PolarHBondContact O-OG1 3.37Å; L267-T271 VanDerWaalsContact O-OG1 3.12Å
268L92.8Very high92.3Very high96 Ų9646.3 Ų46.350%0.50327%0.266SS..Hα-helixtrans-64.1-41.7174.4-76.3175.2000111.6I264 L265 N270 T271 V272I264-L268 HydrophobicContact CG2-CD1 3.81Å; I264-L268 HydrophobicContact CG2-CG 4.09Å; I264-L268 WeakPolarHBondContact O-CB 3.48Å; I264-L268 VanDerWaalsContact O-CG 3.28Å; I264-L268 WeakPolarHBondContact O-CG 3.35Å; I264-L268 PolarHBondContact O-N 2.94Å; L265-L268 PolarHBondContact O-N 2.89Å; L268-N270 VanDerWaalsContact C-N 3.31Å; L268-N270 PolarHBondContact O-N 3.45Å; L268-T271 PolarHBondContact O-N 3.34Å; L268-V272 WeakPolarHBondContact O-CB 3.31Å; L268-V272 WeakPolarHBondContact O-CG2 3.13Å; L268-V272 PolarHBondContact O-N 3.1Å
269G92.3Very high92.5Very high27 Ų2745.2 Ų45.228%0.27824%0.243SC..Hα-helixtrans-56.4-47173.100000111.5L265 A266 S273L265-G269 PolarHBondContact O-N 3.17Å; A266-G269 PolarHBondContact O-N 3.45Å; G269-S273 WeakPolarHBondContact O-CB 3.36Å; G269-S273 PolarHBondContact O-N 3.29Å; G269-S273 PolarHBondContact O-OG 2.93Å
270N91.3Very high92.7Very high2 Ų239.7 Ų39.71%0.01122%0.218CC..Hα-helixtrans-59.4-55.4174.6-166.251.4000111.5N21 M54 A266 L267 L268 V272 S273 I274N21-N270 VanDerWaalsContact CG-OD1 3.32Å; N21-N270 PolarHBondContact O-OD1 3.45Å; N21-N270 PolarHBondContact OD1-O 3.47Å; N21-N270 PolarHBondContact OD1-OD1 2.87Å; M54-N270 WeakPolarHBondContact CG-ND2 3.32Å; A266-N270 PolarHBondContact O-N 3.34Å; L267-N270 WeakPolarHBondContact O-CB 3.48Å; L267-N270 PolarHBondContact O-N 2.86Å; L268-N270 VanDerWaalsContact C-N 3.31Å; L268-N270 PolarHBondContact O-N 3.45Å; N270-V272 PolarHBondContact O-N 2.97Å; N270-S273 PolarHBondContact O-N 2.96Å; N270-S273 PolarHBondContact O-OG 2.95Å; N270-I274 PolarHBondContact O-N 3.17Å
271T93.1Very high92.9Very high25 Ų2537.9 Ų37.915%0.15321%0.208CC..Hα-helixtrans-59.6-37.8-179-65.40000114.1G53 G57 L267 L268 I274G53-T271 WeakPolarHBondContact O-CG2 3.28Å; G53-T271 PolarHBondContact O-OG1 3.33Å; G57-T271 WeakPolarHBondContact CA-O 3.19Å; L267-T271 WeakPolarHBondContact O-CB 3.41Å; L267-T271 PolarHBondContact O-N 3.5Å; L267-T271 PolarHBondContact O-OG1 3.37Å; L267-T271 VanDerWaalsContact O-OG1 3.12Å; L268-T271 PolarHBondContact O-N 3.34Å; T271-I274 VanDerWaalsContact O-CG2 3.26Å; T271-I274 WeakPolarHBondContact O-CG2 3.44Å
272V94.4Very high93.1Very high81 Ų8133.7 Ų33.749%0.49118%0.181SC..Hα-helixtrans-75.1-44.4177.6173.40000110.5L268 N270 I274 A275 F276L268-V272 WeakPolarHBondContact O-CB 3.31Å; L268-V272 WeakPolarHBondContact O-CG2 3.13Å; L268-V272 PolarHBondContact O-N 3.1Å; N270-V272 PolarHBondContact O-N 2.97Å; V272-I274 PolarHBondContact O-N 2.69Å; V272-A275 WeakPolarHBondContact O-CB 3.25Å; V272-A275 PolarHBondContact O-N 3.19Å; V272-F276 HydrophobicContact CG1-CD2 4.06Å; V272-F276 HydrophobicContact CG1-CE2 3.76Å; V272-F276 VanDerWaalsContact O-CD2 3.28Å; V272-F276 WeakPolarHBondContact O-CD2 3.28Å; V272-F276 PolarHBondContact O-N 3.44Å
273S94.3Very high93.1Very high6 Ų629.7 Ų29.74%0.04216%0.161CC..Hα-helixtrans-64.6-37.3-177.6670000112.8T17 N21 G269 N270 A275 F276 F277T17-S273 WeakPolarHBondContact O-CB 3.34Å; N21-S273 WeakPolarHBondContact CA-OG 3.38Å; N21-S273 WeakPolarHBondContact CB-OG 3.25Å; N21-S273 PolarHBondContact N-OG 3.5Å; N21-S273 PolarHBondContact OD1-OG 3.33Å; G269-S273 WeakPolarHBondContact O-CB 3.36Å; G269-S273 PolarHBondContact O-N 3.29Å; G269-S273 PolarHBondContact O-OG 2.93Å; N270-S273 PolarHBondContact O-N 2.96Å; N270-S273 PolarHBondContact O-OG 2.95Å; S273-A275 VanDerWaalsContact C-N 3.32Å; S273-A275 PolarHBondContact O-N 3.26Å; S273-F276 PolarHBondContact O-N 3.28Å; S273-F277 WeakPolarHBondContact O-CB 3.47Å; S273-F277 PolarHBondContact O-N 2.97Å
274I93.1Very high93.1Very high5 Ų529.7 Ų29.73%0.02616%0.162CC..Hα-helixtrans-65.1-35.2177.6-162.459.6000112.6N21 M54 N270 T271 V272 F276 F277 N278N21-I274 WeakPolarHBondContact OD1-CB 3.38Å; M54-I274 HydrophobicContact CB-CG1 4.17Å; M54-I274 HydrophobicContact CB-CG2 4.35Å; M54-I274 HydrophobicContact CE-CD1 3.69Å; M54-I274 HydrophobicContact CE-CG1 4Å; M54-I274 HydrophobicContact CG-CG1 4.35Å; M54-I274 WeakPolarHBondContact O-CG2 3.23Å; N270-I274 PolarHBondContact O-N 3.17Å; T271-I274 VanDerWaalsContact O-CG2 3.26Å; T271-I274 WeakPolarHBondContact O-CG2 3.44Å; V272-I274 PolarHBondContact O-N 2.69Å; I274-F276 PolarHBondContact O-N 2.89Å; I274-F277 HydrophobicContact CD1-CD1 3.86Å; I274-F277 PolarHBondContact O-N 2.91Å; I274-N278 WeakPolarHBondContact CD1-ND2 3.33Å; I274-N278 WeakPolarHBondContact CG1-ND2 3.23Å; I274-N278 WeakPolarHBondContact O-CB 3.49Å; I274-N278 PolarHBondContact O-N 3.48Å; I274-N278 PolarHBondContact O-ND2 3.47Å
275A94.6Very high93Very high10 Ų1026.2 Ų26.28%0.08314%0.144CC..Hα-helixtrans-61.4-47.717800000110.5G57 V272 S273 F279G57-A275 VanDerWaalsContact O-CB 3.31Å; G57-A275 WeakPolarHBondContact O-CB 3.47Å; V272-A275 WeakPolarHBondContact O-CB 3.25Å; V272-A275 PolarHBondContact O-N 3.19Å; S273-A275 VanDerWaalsContact C-N 3.32Å; S273-A275 PolarHBondContact O-N 3.26Å; A275-F279 VanDerWaalsContact O-CB 3.28Å; A275-F279 WeakPolarHBondContact O-CB 3.23Å; A275-F279 PolarHBondContact O-N 2.97Å
276F95.5Very high92.7Very high104 Ų10423.6 Ų23.646%0.45613%0.128SC..Hα-helixtrans-68.6-39.5175.5-71.6-75.7000112.6T17 V272 S273 I274 F279 A280T17-F276 HydrophobicContact CG2-CB 3.67Å; T17-F276 HydrophobicContact CG2-CG 4.42Å; V272-F276 HydrophobicContact CG1-CD2 4.06Å; V272-F276 HydrophobicContact CG1-CE2 3.76Å; V272-F276 VanDerWaalsContact O-CD2 3.28Å; V272-F276 WeakPolarHBondContact O-CD2 3.28Å; V272-F276 PolarHBondContact O-N 3.44Å; S273-F276 PolarHBondContact O-N 3.28Å; I274-F276 PolarHBondContact O-N 2.89Å; F276-F279 PolarHBondContact O-N 3.46Å; F276-A280 VanDerWaalsContact O-CB 3.24Å; F276-A280 WeakPolarHBondContact O-CB 3.38Å; F276-A280 PolarHBondContact O-N 3.08Å
277F94.1Very high92.5Very high15 Ų1527.7 Ų27.77%0.06615%0.147CC..Hα-helixtrans-60-50.7178.7172.9-101.3000111.4M14 T17 S273 I274 A280 G281 D297M14-F277 HydrophobicContact CE-CE2 3.62Å; M14-F277 HydrophobicContact CE-CZ 3.8Å; M14-F277 HydrophobicContact CG-CD2 3.81Å; M14-F277 HydrophobicContact CG-CE2 3.66Å; M14-F277 WeakPolarHBondContact O-CD2 3.32Å; T17-F277 WeakPolarHBondContact OG1-CA 3.11Å; T17-F277 PolarHBondContact OG1-N 3.36Å; S273-F277 WeakPolarHBondContact O-CB 3.47Å; S273-F277 PolarHBondContact O-N 2.97Å; I274-F277 HydrophobicContact CD1-CD1 3.86Å; I274-F277 PolarHBondContact O-N 2.91Å; F277-A280 PolarHBondContact O-N 2.96Å; F277-G281 PolarHBondContact O-N 2.99Å; F277-D297 WeakPolarHBondContact CZ-OD1 3.48Å
278N93.3Very high92.1Very high13 Ų1328.3 Ų28.37%0.0715%0.151CC..Hα-helixtrans-70.1-37.8-180-81.7-54.8000112.3E58 V213 I274 A280 G281 I282 R293E58-N278 HydrophobicContact CG-CB 4.34Å; E58-N278 PolarHBondContact OE1-ND2 3.47Å; V213-N278 HydrophobicContact CG1-CB 3.68Å; V213-N278 HydrophobicContact CG2-CB 4.05Å; V213-N278 WeakPolarHBondContact CG2-O 3.47Å; I274-N278 WeakPolarHBondContact CD1-ND2 3.33Å; I274-N278 WeakPolarHBondContact CG1-ND2 3.23Å; I274-N278 WeakPolarHBondContact O-CB 3.49Å; I274-N278 PolarHBondContact O-N 3.48Å; I274-N278 PolarHBondContact O-ND2 3.47Å; N278-A280 PolarHBondContact O-N 3.46Å; N278-G281 PolarHBondContact O-N 2.75Å; N278-I282 WeakPolarHBondContact O-CG1 3.42Å; N278-I282 PolarHBondContact O-N 3.44Å; N278-R293 PolarHBondContact OD1-NH2 3.27Å
279F95.1Very high91.7Very high41 Ų4124.3 Ų24.318%0.1813%0.13CC..Hα-helixtrans-58.3-49.3171.9166.3-106.8000111.7P209 L210 A275 F276 G281 S283P209-F279 HydrophobicContact CB-CD2 3.94Å; P209-F279 HydrophobicContact CB-CE2 3.94Å; L210-F279 HydrophobicContact CD2-CB 4.25Å; L210-F279 HydrophobicContact CD2-CD2 3.38Å; L210-F279 HydrophobicContact CD2-CE2 3.91Å; L210-F279 HydrophobicContact CD2-CG 3.89Å; L210-F279 HydrophobicContact CG-CD2 3.61Å; L210-F279 HydrophobicContact CG-CE2 3.71Å; A275-F279 VanDerWaalsContact O-CB 3.28Å; A275-F279 WeakPolarHBondContact O-CB 3.23Å; A275-F279 PolarHBondContact O-N 2.97Å; F276-F279 PolarHBondContact O-N 3.46Å; F279-G281 VanDerWaalsContact C-N 3.34Å; F279-S283 VanDerWaalsContact O-CB 3.29Å; F279-S283 WeakPolarHBondContact O-CB 3.31Å; F279-S283 PolarHBondContact O-N 2.96Å; F279-S283 PolarHBondContact O-OG 3.29Å
280A94.6Very high91.2Very high0 Ų023 Ų230%012%0.117CC..Hα-helixtrans-64.7-40.1177.800000111.1L13 M14 F276 F277 N278 S283 V284L13-A280 HydrophobicContact CB-CB 4.3Å; L13-A280 HydrophobicContact CD2-CB 4.03Å; L13-A280 HydrophobicContact CG-CB 4.08Å; M14-A280 HydrophobicContact CB-CB 3.79Å; F276-A280 VanDerWaalsContact O-CB 3.24Å; F276-A280 WeakPolarHBondContact O-CB 3.38Å; F276-A280 PolarHBondContact O-N 3.08Å; F277-A280 PolarHBondContact O-N 2.96Å; N278-A280 PolarHBondContact O-N 3.46Å; A280-S283 PolarHBondContact O-N 2.93Å; A280-V284 WeakPolarHBondContact O-CG2 3.47Å; A280-V284 PolarHBondContact O-N 3.46Å
281G92.6Very high90.5Very high0 Ų023.4 Ų23.40%012%0.12CC..Hα-helixtrans-58.7-55.2177.400000112.7F277 N278 F279 S283 V284 T285 R293F277-G281 PolarHBondContact O-N 2.99Å; N278-G281 PolarHBondContact O-N 2.75Å; F279-G281 VanDerWaalsContact C-N 3.34Å; G281-S283 VanDerWaalsContact C-N 3.26Å; G281-S283 PolarHBondContact O-N 3.19Å; G281-V284 PolarHBondContact O-N 3Å; G281-T285 PolarHBondContact O-N 3.16Å; G281-T285 PolarHBondContact O-OG1 3.12Å; G281-R293 WeakPolarHBondContact O-CD 3.39Å
282I92.5Very high90Very high1 Ų122.6 Ų22.61%0.00511%0.114CC..Hα-helixtrans-61.9-37176.3-64.6-69.3000111.1E198 V202 P209 A212 V213 N278 T285 K286E198-I282 HydrophobicContact CB-CD1 4.19Å; E198-I282 HydrophobicContact CG-CD1 4.16Å; E198-I282 WeakPolarHBondContact OE2-CD1 3.32Å; V202-I282 HydrophobicContact CG1-CG2 4.46Å; V202-I282 HydrophobicContact CG2-CG2 4.02Å; P209-I282 HydrophobicContact CB-CB 4.23Å; P209-I282 HydrophobicContact CB-CG2 3.81Å; P209-I282 HydrophobicContact CG-CG2 4.29Å; A212-I282 HydrophobicContact CB-CG2 4.28Å; V213-I282 HydrophobicContact CG2-CB 4.16Å; V213-I282 HydrophobicContact CG2-CG1 3.56Å; N278-I282 WeakPolarHBondContact O-CG1 3.42Å; N278-I282 PolarHBondContact O-N 3.44Å; I282-T285 PolarHBondContact O-N 3.26Å; I282-K286 WeakPolarHBondContact O-CB 3.46Å; I282-K286 PolarHBondContact O-N 2.8Å
283S92.2Very high89.7Confident1 Ų118.9 Ų18.91%0.0079%0.092CC..Hα-helixtrans-64.7-41.8176.5-57.90000111.9P209 F279 A280 G281 K286 E287P209-S283 WeakPolarHBondContact CB-OG 3.4Å; P209-S283 WeakPolarHBondContact CG-OG 3.16Å; F279-S283 VanDerWaalsContact O-CB 3.29Å; F279-S283 WeakPolarHBondContact O-CB 3.31Å; F279-S283 PolarHBondContact O-N 2.96Å; F279-S283 PolarHBondContact O-OG 3.29Å; A280-S283 PolarHBondContact O-N 2.93Å; G281-S283 VanDerWaalsContact C-N 3.26Å; G281-S283 PolarHBondContact O-N 3.19Å; S283-K286 PolarHBondContact O-N 3.43Å; S283-E287 WeakPolarHBondContact O-CB 3.32Å; S283-E287 VanDerWaalsContact O-CG 3.25Å; S283-E287 WeakPolarHBondContact O-CG 3.28Å; S283-E287 PolarHBondContact O-N 3.41Å
284V91.1Very high89.3Confident1 Ų118.9 Ų18.91%0.0069%0.091CC..Hα-helixtrans-63.7-41.5172.9169.40000110.9L10 A280 G281 K286 E287 I288 S289 T292 R293 L296L10-V284 HydrophobicContact CB-CG2 3.87Å; A280-V284 WeakPolarHBondContact O-CG2 3.47Å; A280-V284 PolarHBondContact O-N 3.46Å; G281-V284 PolarHBondContact O-N 3Å; V284-K286 VanDerWaalsContact C-N 3.28Å; V284-K286 PolarHBondContact O-N 2.99Å; V284-E287 PolarHBondContact O-N 3.43Å; V284-I288 HydrophobicContact CG1-CD1 4.37Å; V284-I288 WeakPolarHBondContact O-CA 3.47Å; V284-I288 PolarHBondContact O-N 3.16Å; V284-S289 PolarHBondContact O-N 3.48Å; V284-T292 HydrophobicContact CG1-CG2 4.15Å; V284-R293 HydrophobicContact CG1-CB 4.22Å; V284-L296 HydrophobicContact CG1-CD1 3.95Å; V284-L296 HydrophobicContact CG2-CD1 3.97Å
285T89.1Confident88.6Confident0 Ų018.9 Ų18.90%09%0.091CC..Hα-helixtrans-60.1-40.9175.9-67.90000111.4E199 Y203 G281 I282 S289 A290 R293E199-T285 HydrophobicContact CB-CG2 3.65Å; E199-T285 HydrophobicContact CG-CG2 3.7Å; Y203-T285 WeakPolarHBondContact CE2-O 3.42Å; Y203-T285 PolarHBondContact OH-O 3.44Å; Y203-T285 VanDerWaalsContact OH-O 3.12Å; G281-T285 PolarHBondContact O-N 3.16Å; G281-T285 PolarHBondContact O-OG1 3.12Å; I282-T285 PolarHBondContact O-N 3.26Å; T285-S289 WeakPolarHBondContact O-CA 3.05Å; T285-S289 PolarHBondContact O-N 3.17Å; T285-A290 HydrophobicContact CG2-CB 4.01Å; T285-R293 VanDerWaalsContact OG1-CD 3.3Å; T285-R293 WeakPolarHBondContact OG1-CD 3.43Å
286K87.6Confident88.2Confident41 Ų4119 Ų1918%0.1789%0.09CC..Hα-helixtrans-71.4-42.6178.9-170.8173.5-176.7171.20113V202 Y203 D206 V207 P209 I282 S283 V284V202-K286 HydrophobicContact CG1-CB 3.88Å; V202-K286 HydrophobicContact CG1-CD 3.85Å; V202-K286 HydrophobicContact CG1-CG 3.87Å; Y203-K286 WeakPolarHBondContact CE1-O 3.49Å; Y203-K286 VanDerWaalsContact CZ-O 3.3Å; Y203-K286 PolarHBondContact OH-O 3.12Å; D206-K286 WeakPolarHBondContact OD1-CE 3.06Å; D206-K286 IonicContact OD1-NZ 2.69Å; D206-K286 PolarHBondContact OD1-NZ 3.36Å; V207-K286 PolarHBondContact O-NZ 3.32Å; P209-K286 HydrophobicContact CG-CD 4.24Å; I282-K286 WeakPolarHBondContact O-CB 3.46Å; I282-K286 PolarHBondContact O-N 2.8Å; S283-K286 PolarHBondContact O-N 3.43Å; V284-K286 VanDerWaalsContact C-N 3.28Å; V284-K286 PolarHBondContact O-N 2.99Å
287E86.3Confident87.6Confident85 Ų8514.7 Ų14.740%0.3977%0.072SC..Hα-helixtrans-86.2-22.9-173.9-67.7-66.4148.500114Y6 Q7 L10 S283 V284Y6-E287 HydrophobicContact CD1-CG 4.47Å; Y6-E287 HydrophobicContact CE1-CG 4.01Å; Q7-E287 HydrophobicContact CG-CB 4.29Å; Q7-E287 PolarHBondContact NE2-O 3.35Å; Q7-E287 VanDerWaalsContact NE2-O 3.16Å; L10-E287 HydrophobicContact CD1-CG 4.17Å; S283-E287 WeakPolarHBondContact O-CB 3.32Å; S283-E287 VanDerWaalsContact O-CG 3.25Å; S283-E287 WeakPolarHBondContact O-CG 3.28Å; S283-E287 PolarHBondContact O-N 3.41Å; V284-E287 PolarHBondContact O-N 3.43Å
288I84.9Confident87Confident41 Ų4114.5 Ų14.521%0.217%0.073CC..THydrogen-bonded Turntrans-131.4-74.7-176.6-46.3178.6000110.7W3 Q7 V284 T292W3-I288 HydrophobicContact CD2-CD1 4.43Å; W3-I288 HydrophobicContact CZ2-CD1 4.39Å; Q7-I288 HydrophobicContact CB-CD1 4.04Å; Q7-I288 HydrophobicContact CG-CD1 4Å; Q7-I288 HydrophobicContact CG-CG1 3.95Å; V284-I288 HydrophobicContact CG1-CD1 4.37Å; V284-I288 WeakPolarHBondContact O-CA 3.47Å; V284-I288 PolarHBondContact O-N 3.16Å; I288-T292 HydrophobicContact CB-CG2 4.4Å; I288-T292 HydrophobicContact CD1-CG2 4.11Å; I288-T292 HydrophobicContact CG2-CG2 4.02Å; I288-T292 VanDerWaalsContact CG2-OG1 3.26Å; I288-T292 WeakPolarHBondContact CG2-OG1 3.49Å
289S82.8Confident86.4Confident11 Ų1117.7 Ų17.78%0.0779%0.09CC..  trans177.8160.4176.660.90000112E199 V284 T285 T291 T292 R293E199-S289 WeakPolarHBondContact OE1-CA 3.32Å; V284-S289 PolarHBondContact O-N 3.48Å; T285-S289 WeakPolarHBondContact O-CA 3.05Å; T285-S289 PolarHBondContact O-N 3.17Å; S289-T291 PolarHBondContact O-N 3.18Å; S289-T291 PolarHBondContact OG-OG1 3.14Å; S289-T292 PolarHBondContact O-N 3.47Å; S289-T292 PolarHBondContact OG-N 2.93Å; S289-T292 VanDerWaalsContact OG-N 3.09Å; S289-T292 PolarHBondContact OG-OG1 3.46Å; S289-R293 PolarHBondContact O-N 3.16Å
290A82.3Confident85.9Confident0 Ų016.5 Ų16.50%08%0.084CC..Hα-helixtrans-62.2-31.8170.700000112.7T128 E199 T285 R293 M294T128-A290 HydrophobicContact CG2-CB 4.31Å; E199-A290 HydrophobicContact CB-CB 4.04Å; E199-A290 VanDerWaalsContact CD-CB 3.48Å; E199-A290 HydrophobicContact CG-CB 4.25Å; E199-A290 PolarHBondContact OE1-N 2.87Å; E199-A290 WeakPolarHBondContact OE2-CB 3.21Å; T285-A290 HydrophobicContact CG2-CB 4.01Å; A290-R293 WeakPolarHBondContact O-CB 3.36Å; A290-R293 PolarHBondContact O-N 2.9Å; A290-M294 WeakPolarHBondContact O-CG 3.28Å; A290-M294 PolarHBondContact O-N 3.44Å; A290-M294 VanDerWaalsContact O-N 3.07Å
291T77.9Confident85.2Confident11 Ų1117 Ų177%0.0679%0.087CC..Hα-helixtrans-69.9-37.9179.359.40000111.6T128 S289 M294 V295 Y334T128-T291 HydrophobicContact CG2-CG2 4.27Å; S289-T291 PolarHBondContact O-N 3.18Å; S289-T291 PolarHBondContact OG-OG1 3.14Å; T291-M294 PolarHBondContact O-N 2.93Å; T291-V295 WeakPolarHBondContact O-CG2 3.37Å; T291-V295 PolarHBondContact O-N 3.2Å; T291-Y334 HydrophobicContact CG2-CE1 4.18Å; T291-Y334 WeakPolarHBondContact CG2-OH 3.33Å
292T81.9Confident84.5Confident7 Ų718.7 Ų18.74%0.04310%0.097CC..Hα-helixtrans-63.2-40171.2-56.50000111.9W3 V284 I288 S289 M294 V295 L296W3-T292 HydrophobicContact CH2-CG2 3.97Å; W3-T292 HydrophobicContact CZ2-CG2 3.9Å; V284-T292 HydrophobicContact CG1-CG2 4.15Å; I288-T292 HydrophobicContact CB-CG2 4.4Å; I288-T292 HydrophobicContact CD1-CG2 4.11Å; I288-T292 HydrophobicContact CG2-CG2 4.02Å; I288-T292 VanDerWaalsContact CG2-OG1 3.26Å; I288-T292 WeakPolarHBondContact CG2-OG1 3.49Å; S289-T292 PolarHBondContact O-N 3.47Å; S289-T292 PolarHBondContact OG-N 2.93Å; S289-T292 VanDerWaalsContact OG-N 3.09Å; S289-T292 PolarHBondContact OG-OG1 3.46Å; T292-M294 VanDerWaalsContact C-N 3.29Å; T292-M294 PolarHBondContact O-N 3.17Å; T292-V295 PolarHBondContact O-N 2.82Å; T292-L296 WeakPolarHBondContact O-CG 3.31Å; T292-L296 PolarHBondContact O-N 2.92Å
293R88Confident84.1Confident4 Ų421.1 Ų21.12%0.01511%0.112CC..Hα-helixtrans-55.6-45.5172.6-178.4-173.6175.3177.6-6.7110.9M14 M195 E198 N278 G281 V284 T285 S289 A290 V295 L296 D297M14-R293 HydrophobicContact CE-CG 3.56Å; M14-R293 WeakPolarHBondContact CE-O 3.24Å; M14-R293 HydrophobicContact SD-CG 3.95Å; M195-R293 VanDerWaalsContact SD-CZ 3.51Å; E198-R293 IonicContact OE2-CZ 3.69Å; E198-R293 IonicContact OE2-NH1 2.68Å; E198-R293 PolarHBondContact OE2-NH1 3.28Å; E198-R293 IonicContact OE2-NH2 3.93Å; N278-R293 PolarHBondContact OD1-NH2 3.27Å; G281-R293 WeakPolarHBondContact O-CD 3.39Å; V284-R293 HydrophobicContact CG1-CB 4.22Å; T285-R293 VanDerWaalsContact OG1-CD 3.3Å; T285-R293 WeakPolarHBondContact OG1-CD 3.43Å; S289-R293 PolarHBondContact O-N 3.16Å; A290-R293 WeakPolarHBondContact O-CB 3.36Å; A290-R293 PolarHBondContact O-N 2.9Å; R293-V295 VanDerWaalsContact C-N 3.35Å; R293-V295 PolarHBondContact O-N 3.48Å; R293-L296 PolarHBondContact O-N 3.13Å; R293-D297 PolarHBondContact O-N 3.33Å
294M84.9Confident83.6Confident5 Ų521.2 Ų21.23%0.02511%0.112CC..Hα-helixtrans-65.4-35.1177.8-63.9-58.288.800113.3V124 T128 M195 A290 T291 T292 D297 S298V124-M294 HydrophobicContact CB-SD 4.26Å; V124-M294 HydrophobicContact CG1-CB 4.34Å; V124-M294 HydrophobicContact CG1-CG 4.2Å; V124-M294 HydrophobicContact CG1-SD 3.51Å; V124-M294 VanDerWaalsContact CG1-SD 3.51Å; V124-M294 HydrophobicContact CG2-SD 3.7Å; T128-M294 HydrophobicContact CG2-CG 4.11Å; M195-M294 HydrophobicContact CE-CE 3.95Å; M195-M294 HydrophobicContact CG-CE 3.93Å; M195-M294 HydrophobicContact CG-SD 3.94Å; M195-M294 HydrophobicContact SD-CE 3.47Å; M195-M294 WeakPolarHBondContact SD-CE 3.23Å; M195-M294 HydrophobicContact SD-SD 4.29Å; A290-M294 WeakPolarHBondContact O-CG 3.28Å; A290-M294 PolarHBondContact O-N 3.44Å; A290-M294 VanDerWaalsContact O-N 3.07Å; T291-M294 PolarHBondContact O-N 2.93Å; T292-M294 VanDerWaalsContact C-N 3.29Å; T292-M294 PolarHBondContact O-N 3.17Å; M294-D297 HydrophobicContact CE-CB 4.49Å; M294-D297 WeakPolarHBondContact O-CB 3.44Å; M294-D297 PolarHBondContact O-N 2.99Å; M294-S298 PolarHBondContact O-N 3.04Å; M294-S298 PolarHBondContact O-OG 3.38Å
295V80.4Confident83Confident6 Ų623.4 Ų23.44%0.03612%0.121CC..Hα-helixtrans-65.3-43.6173.7174.60000111.2I125 T291 T292 R293 D297 S298 L299 Y334 N335I125-V295 HydrophobicContact CD1-CG2 3.64Å; T291-V295 WeakPolarHBondContact O-CG2 3.37Å; T291-V295 PolarHBondContact O-N 3.2Å; T292-V295 PolarHBondContact O-N 2.82Å; R293-V295 VanDerWaalsContact C-N 3.35Å; R293-V295 PolarHBondContact O-N 3.48Å; V295-D297 PolarHBondContact O-N 2.87Å; V295-S298 PolarHBondContact O-N 3.27Å; V295-L299 WeakPolarHBondContact O-CG 3.47Å; V295-L299 PolarHBondContact O-N 2.86Å; V295-Y334 HydrophobicContact CG2-CD1 4.44Å; V295-N335 HydrophobicContact CB-CB 4.49Å; V295-N335 HydrophobicContact CG1-CB 3.97Å; V295-N335 HydrophobicContact CG2-CB 4.01Å
296L85.9Confident82.7Confident11 Ų1127.1 Ų27.16%0.05814%0.143CC..Hα-helixtrans-61.8-33.9174.2-66176.3000111.5W3 A11 M14 V284 T292 R293 L299 R300W3-L296 HydrophobicContact CH2-CD2 4.45Å; A11-L296 HydrophobicContact CB-CD1 3.7Å; A11-L296 HydrophobicContact CB-CD2 3.84Å; A11-L296 HydrophobicContact CB-CG 4.45Å; M14-L296 HydrophobicContact CE-CB 4.18Å; M14-L296 HydrophobicContact SD-CB 3.86Å; M14-L296 HydrophobicContact SD-CD1 3.88Å; V284-L296 HydrophobicContact CG1-CD1 3.95Å; V284-L296 HydrophobicContact CG2-CD1 3.97Å; T292-L296 WeakPolarHBondContact O-CG 3.31Å; T292-L296 PolarHBondContact O-N 2.92Å; R293-L296 PolarHBondContact O-N 3.13Å; L296-L299 HydrophobicContact CD2-CD1 4.26Å; L296-L299 PolarHBondContact O-N 3.26Å; L296-R300 PolarHBondContact O-N 3.42Å
297D82.9Confident82.5Confident15 Ų1527.4 Ų27.48%0.0815%0.148CC..Hα-helixtrans-65.5-40.9174.2-150.158.2000112.8M14 F277 R293 M294 V295 L299 R300 T301M14-D297 HydrophobicContact CE-CB 4.31Å; F277-D297 WeakPolarHBondContact CZ-OD1 3.48Å; R293-D297 PolarHBondContact O-N 3.33Å; M294-D297 HydrophobicContact CE-CB 4.49Å; M294-D297 WeakPolarHBondContact O-CB 3.44Å; M294-D297 PolarHBondContact O-N 2.99Å; V295-D297 PolarHBondContact O-N 2.87Å; D297-L299 VanDerWaalsContact C-N 3.29Å; D297-L299 PolarHBondContact O-N 3.28Å; D297-R300 VanDerWaalsContact O-CB 3.32Å; D297-R300 WeakPolarHBondContact O-CB 3.3Å; D297-R300 PolarHBondContact O-N 3.24Å; D297-R300 IonicContact OD1-CZ 3.13Å; D297-R300 IonicContact OD1-NE 3.77Å; D297-R300 PolarHBondContact OD1-NE 3.46Å; D297-R300 IonicContact OD1-NH1 2.88Å; D297-R300 IonicContact OD1-NH2 3.66Å; D297-R300 PolarHBondContact OD1-NH2 3.24Å; D297-R300 IonicContact OD2-CZ 2.76Å; D297-R300 IonicContact OD2-NH2 2.85Å; D297-R300 PolarHBondContact OD2-NH2 3.13Å; D297-T301 PolarHBondContact O-N 2.96Å
298S80.3Confident82.1Confident11 Ų1123.4 Ų23.48%0.07713%0.129CC..Hα-helixtrans-66.1-29.3172.1-61.50000112.9M294 V295 T301M294-S298 PolarHBondContact O-N 3.04Å; M294-S298 PolarHBondContact O-OG 3.38Å; V295-S298 PolarHBondContact O-N 3.27Å; S298-T301 PolarHBondContact O-OG1 2.85Å
299L82.1Confident81.8Confident80 Ų8023.9 Ų23.942%0.41913%0.132SC..Hα-helixtrans-72.2-34.3173.7-70.8173.9000111.8L15 V295 L296 D297 T301 V302 V303L15-L299 HydrophobicContact CD1-CB 3.99Å; V295-L299 WeakPolarHBondContact O-CG 3.47Å; V295-L299 PolarHBondContact O-N 2.86Å; L296-L299 HydrophobicContact CD2-CD1 4.26Å; L296-L299 PolarHBondContact O-N 3.26Å; D297-L299 VanDerWaalsContact C-N 3.29Å; D297-L299 PolarHBondContact O-N 3.28Å; L299-T301 VanDerWaalsContact C-N 3.3Å; L299-T301 PolarHBondContact O-N 2.92Å; L299-V302 WeakPolarHBondContact O-CB 3.35Å; L299-V302 PolarHBondContact O-N 3.38Å; L299-V303 PolarHBondContact O-N 3.35Å
300R84.6Confident81.8Confident16 Ų1627.4 Ų27.46%0.0616%0.162CC..Hα-helixtrans-59-40.2175.4173.9-173.167.2162.30.2111.9L15 G18 L296 D297 V302 V303 I304L15-R300 VanDerWaalsContact CD1-CA 3.4Å; L15-R300 HydrophobicContact CD1-CB 3.88Å; L15-R300 VanDerWaalsContact CD1-N 3.31Å; G18-R300 VanDerWaalsContact CA-CD 3.48Å; G18-R300 WeakPolarHBondContact O-CD 3.33Å; L296-R300 PolarHBondContact O-N 3.42Å; D297-R300 VanDerWaalsContact O-CB 3.32Å; D297-R300 WeakPolarHBondContact O-CB 3.3Å; D297-R300 PolarHBondContact O-N 3.24Å; D297-R300 IonicContact OD1-CZ 3.13Å; D297-R300 IonicContact OD1-NE 3.77Å; D297-R300 PolarHBondContact OD1-NE 3.46Å; D297-R300 IonicContact OD1-NH1 2.88Å; D297-R300 IonicContact OD1-NH2 3.66Å; D297-R300 PolarHBondContact OD1-NH2 3.24Å; D297-R300 IonicContact OD2-CZ 2.76Å; D297-R300 IonicContact OD2-NH2 2.85Å; D297-R300 PolarHBondContact OD2-NH2 3.13Å; R300-V302 VanDerWaalsContact C-N 3.27Å; R300-V302 PolarHBondContact O-N 3.03Å; R300-V303 PolarHBondContact O-N 2.94Å; R300-I304 HydrophobicContact CG-CD1 3.73Å; R300-I304 HydrophobicContact CG-CG1 4.45Å; R300-I304 WeakPolarHBondContact O-CD1 3.45Å; R300-I304 WeakPolarHBondContact O-CG1 3.39Å; R300-I304 PolarHBondContact O-N 3.43Å
301T79.1Confident81.8Confident9 Ų932 Ų326%0.05519%0.186CC..Hα-helixtrans-62.5-35178.363.10000111.8D297 S298 L299 I304 W305D297-T301 PolarHBondContact O-N 2.96Å; S298-T301 PolarHBondContact O-OG1 2.85Å; L299-T301 VanDerWaalsContact C-N 3.3Å; L299-T301 PolarHBondContact O-N 2.92Å; T301-I304 PolarHBondContact O-N 3.28Å; T301-W305 WeakPolarHBondContact O-CB 3.32Å; T301-W305 PolarHBondContact O-N 2.96Å
302V78.1Confident81.8Confident36 Ų3634.1 Ų34.122%0.21821%0.21CC..Hα-helixtrans-61.3-47.6173.8-171.50000111L299 R300 I304 W305 V306 F324 L328L299-V302 WeakPolarHBondContact O-CB 3.35Å; L299-V302 PolarHBondContact O-N 3.38Å; R300-V302 VanDerWaalsContact C-N 3.27Å; R300-V302 PolarHBondContact O-N 3.03Å; V302-I304 VanDerWaalsContact C-N 3.32Å; V302-I304 PolarHBondContact O-N 3.22Å; V302-W305 PolarHBondContact O-N 3.38Å; V302-V306 HydrophobicContact CG1-CG2 4.41Å; V302-V306 WeakPolarHBondContact O-CG2 3.49Å; V302-V306 PolarHBondContact O-N 3.08Å; V302-F324 HydrophobicContact CB-CE1 4.29Å; V302-F324 HydrophobicContact CB-CZ 4.15Å; V302-F324 HydrophobicContact CG1-CE1 4.34Å; V302-F324 HydrophobicContact CG2-CE1 3.89Å; V302-F324 HydrophobicContact CG2-CZ 3.59Å; V302-L328 HydrophobicContact CG2-CD1 3.53Å; V302-L328 HydrophobicContact CG2-CD2 3.25Å; V302-L328 HydrophobicContact CG2-CG 3.99Å
303V83.6Confident81.4Confident53 Ų5337.1 Ų37.132%0.32122%0.22SC..Hα-helixtrans-61.4-44.9-179.5177.70000110.2L15 S19 L299 R300 W305 V306 V307L15-V303 HydrophobicContact CD1-CG2 4.05Å; L15-V303 HydrophobicContact CD2-CG2 4.37Å; L15-V303 HydrophobicContact CG-CG2 4.32Å; S19-V303 WeakPolarHBondContact OG-CB 3.47Å; S19-V303 WeakPolarHBondContact OG-CG1 3.22Å; L299-V303 PolarHBondContact O-N 3.35Å; R300-V303 PolarHBondContact O-N 2.94Å; V303-W305 VanDerWaalsContact C-N 3.35Å; V303-W305 PolarHBondContact O-N 3.3Å; V303-V306 PolarHBondContact O-N 3.3Å; V303-V307 HydrophobicContact CG1-CG2 4.47Å; V303-V307 WeakPolarHBondContact O-CB 3.18Å; V303-V307 VanDerWaalsContact O-CG2 3.28Å; V303-V307 WeakPolarHBondContact O-CG2 3.38Å; V303-V307 PolarHBondContact O-N 3.28Å
304I82.6Confident80.4Confident3 Ų338.2 Ų38.22%0.01523%0.225CC..Hα-helixtrans-62.2-43.2178.2-65.9158.5000111T22 L23 R300 T301 V302 V307 S308T22-I304 VanDerWaalsContact CB-CD1 3.46Å; T22-I304 HydrophobicContact CG2-CD1 3.73Å; T22-I304 HydrophobicContact CG2-CG1 4.4Å; T22-I304 HydrophobicContact CG2-CG2 4.13Å; L23-I304 HydrophobicContact CD2-CG2 4.4Å; R300-I304 HydrophobicContact CG-CD1 3.73Å; R300-I304 HydrophobicContact CG-CG1 4.45Å; R300-I304 WeakPolarHBondContact O-CD1 3.45Å; R300-I304 WeakPolarHBondContact O-CG1 3.39Å; R300-I304 PolarHBondContact O-N 3.43Å; T301-I304 PolarHBondContact O-N 3.28Å; V302-I304 VanDerWaalsContact C-N 3.32Å; V302-I304 PolarHBondContact O-N 3.22Å; I304-V307 PolarHBondContact O-N 2.81Å; I304-S308 WeakPolarHBondContact O-CB 3.39Å; I304-S308 PolarHBondContact O-N 2.97Å; I304-S308 PolarHBondContact O-OG 3.24Å
305W78.8Confident79.5Confident47 Ų4745.3 Ų45.318%0.17826%0.259CS..Hα-helixtrans-63.5-48178.7177.375.2000111.9T301 V302 V303 V307 S308 L309 F316 V321 F324T301-W305 WeakPolarHBondContact O-CB 3.32Å; T301-W305 PolarHBondContact O-N 2.96Å; V302-W305 PolarHBondContact O-N 3.38Å; V303-W305 VanDerWaalsContact C-N 3.35Å; V303-W305 PolarHBondContact O-N 3.3Å; W305-V307 VanDerWaalsContact C-N 3.34Å; W305-V307 PolarHBondContact O-N 3.32Å; W305-S308 PolarHBondContact O-N 2.97Å; W305-L309 HydrophobicContact CD2-CD1 3.92Å; W305-L309 HydrophobicContact CE3-CD1 4.22Å; W305-L309 HydrophobicContact CH2-CD1 3.6Å; W305-L309 HydrophobicContact CZ2-CD1 3.23Å; W305-L309 HydrophobicContact CZ2-CG 4.38Å; W305-L309 HydrophobicContact CZ3-CD1 4.07Å; W305-L309 PolarHBondContact O-N 3.18Å; W305-F316 HydrophobicContact CZ2-CD2 4.42Å; W305-F316 HydrophobicContact CZ2-CE2 4.3Å; W305-V321 HydrophobicContact CH2-CG1 4.44Å; W305-V321 HydrophobicContact CH2-CG2 4.36Å; W305-V321 HydrophobicContact CZ2-CG1 4.47Å; W305-V321 HydrophobicContact CZ2-CG2 3.64Å; W305-F324 HydrophobicContact CE3-CE1 4.47Å
306V81.1Confident78.8Confident77 Ų7751.5 Ų51.547%0.46729%0.285SS..Hα-helixtrans-59.1-45.6177170.80000111.1V302 V303 L309 A310V302-V306 HydrophobicContact CG1-CG2 4.41Å; V302-V306 WeakPolarHBondContact O-CG2 3.49Å; V302-V306 PolarHBondContact O-N 3.08Å; V303-V306 PolarHBondContact O-N 3.3Å; V306-L309 PolarHBondContact O-N 2.94Å; V306-A310 WeakPolarHBondContact O-CB 3.5Å; V306-A310 PolarHBondContact O-N 3.13Å
307V84Confident77.9Confident48 Ų4855.6 Ų55.629%0.29130%0.304SS..Hα-helixtrans-67.6-41.2178.8174.10000111.1L23 V303 I304 W305 L309 A310 L311L23-V307 HydrophobicContact CD1-CB 4.27Å; L23-V307 HydrophobicContact CD1-CG1 3.77Å; L23-V307 HydrophobicContact CD2-CB 4.35Å; L23-V307 HydrophobicContact CD2-CG1 3.89Å; V303-V307 HydrophobicContact CG1-CG2 4.47Å; V303-V307 WeakPolarHBondContact O-CB 3.18Å; V303-V307 VanDerWaalsContact O-CG2 3.28Å; V303-V307 WeakPolarHBondContact O-CG2 3.38Å; V303-V307 PolarHBondContact O-N 3.28Å; I304-V307 PolarHBondContact O-N 2.81Å; W305-V307 VanDerWaalsContact C-N 3.34Å; W305-V307 PolarHBondContact O-N 3.32Å; V307-L309 VanDerWaalsContact C-N 3.33Å; V307-L309 PolarHBondContact O-N 3.42Å; V307-A310 PolarHBondContact O-N 3.47Å; V307-L311 HydrophobicContact CG1-CD1 3.77Å; V307-L311 HydrophobicContact CG1-CG 4.25Å; V307-L311 WeakPolarHBondContact O-CB 3.46Å; V307-L311 WeakPolarHBondContact O-CG 3.47Å; V307-L311 PolarHBondContact O-N 2.95Å
308S77.8Confident77.3Confident0 Ų057 Ų570%032%0.323CS..Hα-helixtrans-62.4-39.7177.9-66.90000111.8I304 W305 G312 W313I304-S308 WeakPolarHBondContact O-CB 3.39Å; I304-S308 PolarHBondContact O-N 2.97Å; I304-S308 PolarHBondContact O-OG 3.24Å; W305-S308 PolarHBondContact O-N 2.97Å; S308-G312 PolarHBondContact O-N 3Å; S308-W313 PolarHBondContact O-N 3.28Å
309L78.6Confident76.9Confident51 Ų5160.3 Ų60.327%0.26734%0.339SS..Hα-helixtrans-66.1-43.7172.6-75.6-179.7000112.2W305 V306 V307 L311 G312 E314W305-L309 HydrophobicContact CD2-CD1 3.92Å; W305-L309 HydrophobicContact CE3-CD1 4.22Å; W305-L309 HydrophobicContact CH2-CD1 3.6Å; W305-L309 HydrophobicContact CZ2-CD1 3.23Å; W305-L309 HydrophobicContact CZ2-CG 4.38Å; W305-L309 HydrophobicContact CZ3-CD1 4.07Å; W305-L309 PolarHBondContact O-N 3.18Å; V306-L309 PolarHBondContact O-N 2.94Å; V307-L309 VanDerWaalsContact C-N 3.33Å; V307-L309 PolarHBondContact O-N 3.42Å; L309-L311 VanDerWaalsContact C-N 3.26Å; L309-L311 PolarHBondContact O-N 3.42Å; L309-G312 PolarHBondContact O-N 3.44Å; L309-E314 HydrophobicContact CD2-CB 4.32Å
310A82.9Confident76.4Confident86 Ų8657.2 Ų57.271%0.71132%0.322SS*.Hα-helixtrans-62.8-33.1178.900000112.7V306 V307 G312V306-A310 WeakPolarHBondContact O-CB 3.5Å; V306-A310 PolarHBondContact O-N 3.13Å; V307-A310 PolarHBondContact O-N 3.47Å; A310-G312 VanDerWaalsContact C-N 3.33Å
311L82.2Confident76.1Confident97 Ų9757.4 Ų57.451%0.50833%0.325SS..THydrogen-bonded Turntrans-84.3-4.6175.6-65175.5000113.6V307 L309 W313V307-L311 HydrophobicContact CG1-CD1 3.77Å; V307-L311 HydrophobicContact CG1-CG 4.25Å; V307-L311 WeakPolarHBondContact O-CB 3.46Å; V307-L311 WeakPolarHBondContact O-CG 3.47Å; V307-L311 PolarHBondContact O-N 2.95Å; L309-L311 VanDerWaalsContact C-N 3.26Å; L309-L311 PolarHBondContact O-N 3.42Å; L311-W313 VanDerWaalsContact C-N 3.3Å; L311-W313 HydrophobicContact CB-CD2 4.03Å; L311-W313 HydrophobicContact CB-CG 4.04Å; L311-W313 HydrophobicContact CD1-CD2 4.11Å; L311-W313 HydrophobicContact CD1-CE3 4.12Å; L311-W313 HydrophobicContact CD1-CH2 3.84Å; L311-W313 HydrophobicContact CD1-CZ2 3.77Å; L311-W313 HydrophobicContact CD1-CZ3 4.01Å; L311-W313 PolarHBondContact O-N 3.19Å
312G77.5Confident76.2Confident54 Ų5461 Ų6156%0.55734%0.343SS*.THydrogen-bonded Turntrans71.520.3-177.700000114.5S308 L309 A310S308-G312 PolarHBondContact O-N 3Å; L309-G312 PolarHBondContact O-N 3.44Å; A310-G312 VanDerWaalsContact C-N 3.33Å
313W73.6Confident76.4Confident71 Ų7159.3 Ų59.327%0.26933%0.333SS..  trans-82.1-11.2-179.1-66.3-6.6000114L23 K26 W27 M30 S308 L311L23-W313 HydrophobicContact CD2-CE3 4.42Å; L23-W313 HydrophobicContact CD2-CZ3 3.83Å; K26-W313 HydrophobicContact CB-CZ3 4.38Å; K26-W313 HydrophobicContact CD-CE3 3.65Å; K26-W313 HydrophobicContact CD-CZ3 4.03Å; K26-W313 HydrophobicContact CG-CE3 4.09Å; K26-W313 HydrophobicContact CG-CZ3 4.11Å; W27-W313 HydrophobicContact CB-CH2 4.32Å; M30-W313 HydrophobicContact SD-CD2 4.04Å; M30-W313 HydrophobicContact SD-CG 4.34Å; M30-W313 HydrophobicContact SD-CZ2 4.03Å; S308-W313 PolarHBondContact O-N 3.28Å; L311-W313 VanDerWaalsContact C-N 3.3Å; L311-W313 HydrophobicContact CB-CD2 4.03Å; L311-W313 HydrophobicContact CB-CG 4.04Å; L311-W313 HydrophobicContact CD1-CD2 4.11Å; L311-W313 HydrophobicContact CD1-CE3 4.12Å; L311-W313 HydrophobicContact CD1-CH2 3.84Å; L311-W313 HydrophobicContact CD1-CZ2 3.77Å; L311-W313 HydrophobicContact CD1-CZ3 4.01Å; L311-W313 PolarHBondContact O-N 3.19Å
314E67.6Low76.1Confident26 Ų2657.3 Ų57.312%0.12132%0.32CS..SBendtrans-137148.9-179.9-71.6-172.5-170.200112K26 Q118 L309K26-E314 IonicContact NZ-OE1 3.66Å; K26-E314 PolarHBondContact NZ-OE1 3.08Å; K26-E314 VanDerWaalsContact NZ-OE1 3.17Å; Q118-E314 PolarHBondContact NE2-OE1 3.11Å; L309-E314 HydrophobicContact CD2-CB 4.32Å
315Q65.8Low76.1Confident155 Ų15561.5 Ų61.572%0.72434%0.342SS*.  trans-96.3138.2177.2-64.9-65.5-38.100110.6H317Q315-H317 PolarHBondContact O-N 2.97Å; Q315-H317 PolarHBondContact O-ND1 3.01Å
316F66Low76.5Confident136 Ų13660.5 Ų60.560%0.59634%0.341SS*.  trans-76112.3-174.3-174-92.2000112.2W305 V321W305-F316 HydrophobicContact CZ2-CD2 4.42Å; W305-F316 HydrophobicContact CZ2-CE2 4.3Å; F316-V321 HydrophobicContact CD2-CG2 4.17Å; F316-V321 HydrophobicContact CE2-CG1 4.48Å; F316-V321 HydrophobicContact CE2-CG2 3.68Å; F316-V321 HydrophobicContact CZ-CB 4.45Å; F316-V321 HydrophobicContact CZ-CG1 4.48Å; F316-V321 HydrophobicContact CZ-CG2 3.97Å
317H67.4Low76.6Confident96 Ų9657.4 Ų57.444%0.44432%0.321SS..  trans-109.8106.8173.8-68.382.6000110.6Q315 L319 Q320 V321Q315-H317 PolarHBondContact O-N 2.97Å; Q315-H317 PolarHBondContact O-ND1 3.01Å; H317-L319 VanDerWaalsContact C-N 3.3Å; H317-L319 PolarHBondContact O-N 3.44Å; H317-Q320 HydrophobicContact CB-CB 4.18Å; H317-Q320 HydrophobicContact CB-CG 4.13Å; H317-Q320 PolarHBondContact O-N 3.41Å; H317-V321 WeakPolarHBondContact O-CG2 3.26Å; H317-V321 PolarHBondContact O-N 3.26Å; H317-V321 VanDerWaalsContact O-N 3.14Å
318G70.7Confident76.4Confident46 Ų4657.2 Ų57.247%0.47432%0.318SS..Hα-helixtrans-59.2-32.4-170.900000115.5L322G318-L322 PolarHBondContact O-N 3.05Å; G318-L322 VanDerWaalsContact O-N 3.16Å
319L71.5Confident76.7Confident79 Ų7960.7 Ų60.741%0.41434%0.34SS..Hα-helixtrans-75.3-36.9179.8-165.163.5000112.3A161 H317 V321 L322 G323A161-L319 HydrophobicContact CB-CB 4.07Å; A161-L319 HydrophobicContact CB-CD2 3.53Å; A161-L319 HydrophobicContact CB-CG 3.64Å; H317-L319 VanDerWaalsContact C-N 3.3Å; H317-L319 PolarHBondContact O-N 3.44Å; L319-V321 VanDerWaalsContact C-N 3.33Å; L319-L322 PolarHBondContact O-N 3.18Å; L319-G323 PolarHBondContact O-N 3.35Å; L319-G323 VanDerWaalsContact O-N 3.1Å
320Q71.6Confident76.9Confident15 Ų1558.2 Ų58.27%0.0733%0.327CS..Hα-helixtrans-64.7-39.2173-69.3-176-19.700110.8S115 M119 A161 D162 H317 L322 G323 F324S115-Q320 PolarHBondContact OG-NE2 3.38Å; S115-Q320 PolarHBondContact OG-OE1 2.96Å; M119-Q320 HydrophobicContact CE-CB 3.87Å; M119-Q320 HydrophobicContact SD-CB 4.07Å; A161-Q320 HydrophobicContact CB-CG 4.38Å; D162-Q320 PolarHBondContact OD1-NE2 3.01Å; H317-Q320 HydrophobicContact CB-CB 4.18Å; H317-Q320 HydrophobicContact CB-CG 4.13Å; H317-Q320 PolarHBondContact O-N 3.41Å; Q320-L322 VanDerWaalsContact C-N 3.35Å; Q320-L322 PolarHBondContact O-N 3.35Å; Q320-G323 PolarHBondContact O-N 2.93Å; Q320-F324 WeakPolarHBondContact O-CB 3.47Å; Q320-F324 PolarHBondContact O-N 3.08Å
321V76.8Confident76.8Confident20 Ų2054.4 Ų54.412%0.12130%0.295CS..Hα-helixtrans-62.5-40.9175.4176.40000111.9W305 F316 H317 L319 F324 I325W305-V321 HydrophobicContact CH2-CG1 4.44Å; W305-V321 HydrophobicContact CH2-CG2 4.36Å; W305-V321 HydrophobicContact CZ2-CG1 4.47Å; W305-V321 HydrophobicContact CZ2-CG2 3.64Å; F316-V321 HydrophobicContact CD2-CG2 4.17Å; F316-V321 HydrophobicContact CE2-CG1 4.48Å; F316-V321 HydrophobicContact CE2-CG2 3.68Å; F316-V321 HydrophobicContact CZ-CB 4.45Å; F316-V321 HydrophobicContact CZ-CG1 4.48Å; F316-V321 HydrophobicContact CZ-CG2 3.97Å; H317-V321 WeakPolarHBondContact O-CG2 3.26Å; H317-V321 PolarHBondContact O-N 3.26Å; H317-V321 VanDerWaalsContact O-N 3.14Å; L319-V321 VanDerWaalsContact C-N 3.33Å; V321-F324 PolarHBondContact O-N 3.47Å; V321-I325 HydrophobicContact CG1-CD1 4.04Å; V321-I325 WeakPolarHBondContact O-CG1 3.25Å; V321-I325 PolarHBondContact O-N 2.84Å
322L82.7Confident76.6Confident85 Ų8551.2 Ų51.245%0.44528%0.283SS..Hα-helixtrans-62.5-47.3175.6-176.765.5000111.3M157 G318 L319 Q320 F324 I325 V326M157-L322 HydrophobicContact CE-CB 4.45Å; M157-L322 HydrophobicContact CE-CD2 3.45Å; M157-L322 VanDerWaalsContact CE-CD2 3.45Å; M157-L322 HydrophobicContact CE-CG 3.61Å; G318-L322 PolarHBondContact O-N 3.05Å; G318-L322 VanDerWaalsContact O-N 3.16Å; L319-L322 PolarHBondContact O-N 3.18Å; Q320-L322 VanDerWaalsContact C-N 3.35Å; Q320-L322 PolarHBondContact O-N 3.35Å; L322-F324 VanDerWaalsContact C-N 3.28Å; L322-F324 PolarHBondContact O-N 2.92Å; L322-I325 PolarHBondContact O-N 3.3Å; L322-V326 WeakPolarHBondContact O-CG2 3.49Å; L322-V326 PolarHBondContact O-N 3.24Å; L322-V326 VanDerWaalsContact O-N 3.08Å
323G80.6Confident76.8Confident0 Ų050.6 Ų50.60%027%0.267CS..Hα-helixtrans-58.4-41.1175.100000112.3L319 Q320 V326 L327L319-G323 PolarHBondContact O-N 3.35Å; L319-G323 VanDerWaalsContact O-N 3.1Å; Q320-G323 PolarHBondContact O-N 2.93Å; G323-V326 PolarHBondContact O-N 3.14Å; G323-L327 WeakPolarHBondContact O-CG 3.43Å; G323-L327 PolarHBondContact O-N 3.32Å
324F78.4Confident76.9Confident12 Ų1247.5 Ų47.55%0.05326%0.255CS..Hα-helixtrans-63.4-44.6176-170.9-123.9000113.2M119 V302 W305 Q320 V321 L322 V326 L327 L328M119-F324 HydrophobicContact CE-CB 3.85Å; M119-F324 HydrophobicContact CE-CD2 4.45Å; M119-F324 HydrophobicContact CE-CG 4.22Å; M119-F324 HydrophobicContact CG-CB 4.35Å; M119-F324 HydrophobicContact CG-CD2 3.8Å; M119-F324 HydrophobicContact CG-CG 4.4Å; M119-F324 HydrophobicContact SD-CB 4.03Å; V302-F324 HydrophobicContact CB-CE1 4.29Å; V302-F324 HydrophobicContact CB-CZ 4.15Å; V302-F324 HydrophobicContact CG1-CE1 4.34Å; V302-F324 HydrophobicContact CG2-CE1 3.89Å; V302-F324 HydrophobicContact CG2-CZ 3.59Å; W305-F324 HydrophobicContact CE3-CE1 4.47Å; Q320-F324 WeakPolarHBondContact O-CB 3.47Å; Q320-F324 PolarHBondContact O-N 3.08Å; V321-F324 PolarHBondContact O-N 3.47Å; L322-F324 VanDerWaalsContact C-N 3.28Å; L322-F324 PolarHBondContact O-N 2.92Å; F324-V326 VanDerWaalsContact C-N 3.29Å; F324-V326 PolarHBondContact O-N 2.91Å; F324-L327 WeakPolarHBondContact O-CB 3.49Å; F324-L327 PolarHBondContact O-N 3.24Å; F324-L328 HydrophobicContact CD1-CD1 3.96Å; F324-L328 HydrophobicContact CE1-CD1 3.72Å; F324-L328 HydrophobicContact CE1-CG 4.36Å; F324-L328 HydrophobicContact CE2-CD2 4.37Å; F324-L328 HydrophobicContact CE2-CG 4.42Å; F324-L328 HydrophobicContact CZ-CD1 4.09Å; F324-L328 HydrophobicContact CZ-CD2 4.22Å; F324-L328 HydrophobicContact CZ-CG 4.3Å; F324-L328 VanDerWaalsContact O-CG 3.31Å; F324-L328 WeakPolarHBondContact O-CG 3.33Å; F324-L328 PolarHBondContact O-N 3.14Å
325I83.3Confident77Confident90 Ų9048.5 Ų48.546%0.46226%0.261SS..Hα-helixtrans-59.3-42.8175.4-69.4166.8000110.5V321 L322 L328 V329V321-I325 HydrophobicContact CG1-CD1 4.04Å; V321-I325 WeakPolarHBondContact O-CG1 3.25Å; V321-I325 PolarHBondContact O-N 2.84Å; L322-I325 PolarHBondContact O-N 3.3Å; I325-L328 PolarHBondContact O-N 3.01Å; I325-V329 HydrophobicContact CG2-CG2 4.44Å; I325-V329 VanDerWaalsContact O-CG2 3.32Å; I325-V329 WeakPolarHBondContact O-CG2 3.43Å; I325-V329 PolarHBondContact O-N 3.12Å
326V86.4Confident77.2Confident27 Ų2742 Ų4216%0.16424%0.235CC..Hα-helixtrans-63-43.7177.7175.40000111.2V150 M157 L322 G323 F324 L328 V329 G330V150-V326 HydrophobicContact CG1-CG1 3.93Å; V150-V326 WeakPolarHBondContact CG1-O 3.29Å; V150-V326 WeakPolarHBondContact O-CG1 3.47Å; M157-V326 HydrophobicContact SD-CG2 4.11Å; L322-V326 WeakPolarHBondContact O-CG2 3.49Å; L322-V326 PolarHBondContact O-N 3.24Å; L322-V326 VanDerWaalsContact O-N 3.08Å; G323-V326 PolarHBondContact O-N 3.14Å; F324-V326 VanDerWaalsContact C-N 3.29Å; F324-V326 PolarHBondContact O-N 2.91Å; V326-L328 VanDerWaalsContact C-N 3.33Å; V326-L328 PolarHBondContact O-N 3.22Å; V326-V329 PolarHBondContact O-N 2.55Å; V326-G330 PolarHBondContact O-N 2.77Å
327L82.4Confident77.3Confident11 Ų1140 Ų406%0.05823%0.231CC..Hα-helixtrans-58.1-44.1174.3-73.7169.4000112.2M119 T151 L155 V158 G323 F324 G330 A331M119-L327 HydrophobicContact CB-CD1 4.05Å; T151-L327 HydrophobicContact CG2-CD2 3.65Å; T151-L327 VanDerWaalsContact O-CD2 3.26Å; T151-L327 WeakPolarHBondContact O-CD2 3.39Å; L155-L327 HydrophobicContact CD2-CD1 4.41Å; L155-L327 HydrophobicContact CD2-CD2 3.82Å; L155-L327 HydrophobicContact CG-CD2 3.8Å; V158-L327 HydrophobicContact CG2-CD1 4.08Å; G323-L327 WeakPolarHBondContact O-CG 3.43Å; G323-L327 PolarHBondContact O-N 3.32Å; F324-L327 WeakPolarHBondContact O-CB 3.49Å; F324-L327 PolarHBondContact O-N 3.24Å; L327-G330 PolarHBondContact O-N 3.18Å; L327-A331 PolarHBondContact O-N 2.74Å
328L79.8Confident77.4Confident44 Ų4437.1 Ų37.123%0.2322%0.217CC..Hα-helixtrans-65.7-40.8178.5-67.6174.9000112.5V302 F324 I325 V326 G330 A331 A332V302-L328 HydrophobicContact CG2-CD1 3.53Å; V302-L328 HydrophobicContact CG2-CD2 3.25Å; V302-L328 HydrophobicContact CG2-CG 3.99Å; F324-L328 HydrophobicContact CD1-CD1 3.96Å; F324-L328 HydrophobicContact CE1-CD1 3.72Å; F324-L328 HydrophobicContact CE1-CG 4.36Å; F324-L328 HydrophobicContact CE2-CD2 4.37Å; F324-L328 HydrophobicContact CE2-CG 4.42Å; F324-L328 HydrophobicContact CZ-CD1 4.09Å; F324-L328 HydrophobicContact CZ-CD2 4.22Å; F324-L328 HydrophobicContact CZ-CG 4.3Å; F324-L328 VanDerWaalsContact O-CG 3.31Å; F324-L328 WeakPolarHBondContact O-CG 3.33Å; F324-L328 PolarHBondContact O-N 3.14Å; I325-L328 PolarHBondContact O-N 3.01Å; V326-L328 VanDerWaalsContact C-N 3.33Å; V326-L328 PolarHBondContact O-N 3.22Å; L328-G330 VanDerWaalsContact C-N 3.32Å; L328-A331 PolarHBondContact O-N 3.41Å; L328-A332 VanDerWaalsContact O-CB 3.28Å; L328-A332 WeakPolarHBondContact O-CB 3.38Å; L328-A332 PolarHBondContact O-N 2.87Å
329V84.5Confident77.1Confident73 Ų7338.7 Ų38.744%0.44221%0.209SC..Hα-helixtrans-62.2-42.8174.5171.80000110.1V150 I325 V326 A332 L333V150-V329 HydrophobicContact CG1-CG1 4.36Å; I325-V329 HydrophobicContact CG2-CG2 4.44Å; I325-V329 VanDerWaalsContact O-CG2 3.32Å; I325-V329 WeakPolarHBondContact O-CG2 3.43Å; I325-V329 PolarHBondContact O-N 3.12Å; V326-V329 PolarHBondContact O-N 2.55Å; V329-A332 PolarHBondContact O-N 3.3Å; V329-L333 HydrophobicContact CG1-CD1 3.93Å; V329-L333 HydrophobicContact CG1-CG 4.31Å; V329-L333 WeakPolarHBondContact O-CB 3.41Å; V329-L333 VanDerWaalsContact O-CG 3.25Å; V329-L333 WeakPolarHBondContact O-CG 3.17Å; V329-L333 PolarHBondContact O-N 3.1Å
330G84.2Confident76.7Confident0 Ų038.6 Ų38.60%021%0.213CC..Hα-helixtrans-58.5-47.9174.800000112.9G147 V326 L327 L328 A332 L333 Y334G147-G330 VanDerWaalsContact CA-O 3.23Å; G147-G330 WeakPolarHBondContact CA-O 3.39Å; V326-G330 PolarHBondContact O-N 2.77Å; L327-G330 PolarHBondContact O-N 3.18Å; L328-G330 VanDerWaalsContact C-N 3.32Å; G330-A332 PolarHBondContact O-N 3.45Å; G330-L333 PolarHBondContact O-N 3.16Å; G330-Y334 WeakPolarHBondContact O-CB 3.44Å; G330-Y334 PolarHBondContact O-N 3.33Å
331A79.4Confident76.3Confident5 Ų543.1 Ų43.14%0.04124%0.237CC..Hα-helixtrans-64.3-39.8176.800000112.7I125 L327 L328 Y334 N335I125-A331 HydrophobicContact CD1-CB 4.16Å; L327-A331 PolarHBondContact O-N 2.74Å; L328-A331 PolarHBondContact O-N 3.41Å; A331-Y334 WeakPolarHBondContact O-CB 3.4Å; A331-Y334 PolarHBondContact O-N 3.17Å; A331-N335 PolarHBondContact O-N 3.21Å; A331-N335 VanDerWaalsContact O-N 3.12Å
332A78.4Confident75.6Confident31 Ų3144.7 Ų44.726%0.25625%0.245SC..Hα-helixtrans-67.4-39.417700000112.3L328 V329 G330 N335 G336 L337L328-A332 VanDerWaalsContact O-CB 3.28Å; L328-A332 WeakPolarHBondContact O-CB 3.38Å; L328-A332 PolarHBondContact O-N 2.87Å; V329-A332 PolarHBondContact O-N 3.3Å; G330-A332 PolarHBondContact O-N 3.45Å; A332-N335 PolarHBondContact O-N 3.27Å; A332-G336 PolarHBondContact O-N 3.27Å; A332-L337 HydrophobicContact CB-CB 4.25Å; A332-L337 HydrophobicContact CB-CD2 4.24Å; A332-L337 WeakPolarHBondContact O-CB 3.36Å; A332-L337 PolarHBondContact O-N 3.4Å
333L81.1Confident74.5Confident41 Ų4143.4 Ų43.422%0.21525%0.246CC..Hα-helixtrans-61.6-46.3173.1-76.2170.5000110.7T146 V150 V329 G330 N335 G336 H338T146-L333 HydrophobicContact CG2-CD1 4.41Å; V150-L333 HydrophobicContact CB-CD1 4.43Å; V150-L333 HydrophobicContact CG2-CD1 3.98Å; V329-L333 HydrophobicContact CG1-CD1 3.93Å; V329-L333 HydrophobicContact CG1-CG 4.31Å; V329-L333 WeakPolarHBondContact O-CB 3.41Å; V329-L333 VanDerWaalsContact O-CG 3.25Å; V329-L333 WeakPolarHBondContact O-CG 3.17Å; V329-L333 PolarHBondContact O-N 3.1Å; G330-L333 PolarHBondContact O-N 3.16Å; L333-N335 VanDerWaalsContact C-N 3.29Å; L333-N335 PolarHBondContact O-N 2.71Å; L333-G336 PolarHBondContact O-N 3.47Å; L333-H338 HydrophobicContact CD2-CB 3.95Å; L333-H338 PolarHBondContact O-CE1 3.44Å; L333-H338 VanDerWaalsContact O-CE1 3.31Å; L333-H338 PolarHBondContact O-ND1 3Å
334Y75.4Confident73.5Confident5 Ų551.9 Ų51.92%0.0228%0.283CS..Hα-helixtrans-57.2-41.2178.3-171.3-81.8000112.6I125 L140 Q144 I148 T291 V295 G330 A331 G336I125-Y334 HydrophobicContact CD1-CD1 3.99Å; I125-Y334 HydrophobicContact CD1-CG 3.95Å; I125-Y334 HydrophobicContact CG1-CD1 4.41Å; I125-Y334 HydrophobicContact CG1-CG 4.46Å; L140-Y334 HydrophobicContact CD2-CE2 4.26Å; L140-Y334 VanDerWaalsContact CD2-OH 3.23Å; L140-Y334 WeakPolarHBondContact CD2-OH 3.32Å; Q144-Y334 HydrophobicContact CB-CD2 3.77Å; Q144-Y334 HydrophobicContact CB-CE2 3.63Å; Q144-Y334 HydrophobicContact CB-CG 4.41Å; Q144-Y334 HydrophobicContact CG-CD1 4.21Å; Q144-Y334 HydrophobicContact CG-CD2 3.94Å; Q144-Y334 HydrophobicContact CG-CE1 4.08Å; Q144-Y334 HydrophobicContact CG-CE2 3.85Å; Q144-Y334 HydrophobicContact CG-CG 4.12Å; Q144-Y334 VanDerWaalsContact CG-O 3.24Å; Q144-Y334 WeakPolarHBondContact CG-O 3.42Å; Q144-Y334 VanDerWaalsContact O-CD2 3.31Å; Q144-Y334 WeakPolarHBondContact O-CD2 3.39Å; I148-Y334 HydrophobicContact CD1-CD2 4.46Å; I148-Y334 HydrophobicContact CD1-CE2 3.93Å; I148-Y334 HydrophobicContact CG1-CD2 3.9Å; I148-Y334 HydrophobicContact CG1-CE2 3.85Å; T291-Y334 HydrophobicContact CG2-CE1 4.18Å; T291-Y334 WeakPolarHBondContact CG2-OH 3.33Å; V295-Y334 HydrophobicContact CG2-CD1 4.44Å; G330-Y334 WeakPolarHBondContact O-CB 3.44Å; G330-Y334 PolarHBondContact O-N 3.33Å; A331-Y334 WeakPolarHBondContact O-CB 3.4Å; A331-Y334 PolarHBondContact O-N 3.17Å; Y334-G336 PolarHBondContact O-N 3.04Å
335N70.3Confident73.1Confident47 Ų4755.4 Ų55.425%0.25130%0.301SS..THydrogen-bonded Turntrans-82.15.9-179.1-156.527.7000114.2V295 A331 A332 L333 L337V295-N335 HydrophobicContact CB-CB 4.49Å; V295-N335 HydrophobicContact CG1-CB 3.97Å; V295-N335 HydrophobicContact CG2-CB 4.01Å; A331-N335 PolarHBondContact O-N 3.21Å; A331-N335 VanDerWaalsContact O-N 3.12Å; A332-N335 PolarHBondContact O-N 3.27Å; L333-N335 VanDerWaalsContact C-N 3.29Å; L333-N335 PolarHBondContact O-N 2.71Å; N335-L337 PolarHBondContact O-N 2.97Å
336G70.2Confident71.8Confident18 Ų1856.7 Ų56.719%0.18632%0.316CS..THydrogen-bonded Turntrans71.912-178.800000114.4A332 L333 Y334 H338 R339A332-G336 PolarHBondContact O-N 3.27Å; L333-G336 PolarHBondContact O-N 3.47Å; Y334-G336 PolarHBondContact O-N 3.04Å; G336-H338 PolarHBondContact O-N 3.08Å; G336-H338 VanDerWaalsContact O-N 3.15Å; G336-R339 WeakPolarHBondContact O-CB 3.31Å; G336-R339 PolarHBondContact O-N 3.49Å
337L68.7Low70.4Confident95 Ų9560.6 Ų60.650%0.49734%0.343SS..THydrogen-bonded Turntrans-65.3-20.9-176.4-157.978.1000112.3A332 N335 R339 P340A332-L337 HydrophobicContact CB-CB 4.25Å; A332-L337 HydrophobicContact CB-CD2 4.24Å; A332-L337 WeakPolarHBondContact O-CB 3.36Å; A332-L337 PolarHBondContact O-N 3.4Å; N335-L337 PolarHBondContact O-N 2.97Å; L337-R339 VanDerWaalsContact C-N 3.29Å; L337-R339 PolarHBondContact O-N 3.36Å; L337-P340 WeakPolarHBondContact O-CD 3.36Å; L337-P340 WeakPolarHBondContact O-CG 3.24Å
338H68.5Low68.9Low35 Ų3561.8 Ų61.816%0.16235%0.352CS..Hα-helixtrans-63.2-31.3171.862.3-80.3000112.6S143 L333 G336 L341 L342S143-H338 VanDerWaalsContact CB-CE1 3.44Å; S143-H338 WeakPolarHBondContact CB-CE1 3.38Å; L333-H338 HydrophobicContact CD2-CB 3.95Å; L333-H338 PolarHBondContact O-CE1 3.44Å; L333-H338 VanDerWaalsContact O-CE1 3.31Å; L333-H338 PolarHBondContact O-ND1 3Å; G336-H338 PolarHBondContact O-N 3.08Å; G336-H338 VanDerWaalsContact O-N 3.15Å; H338-L341 PolarHBondContact O-N 2.89Å; H338-L342 HydrophobicContact CB-CD1 3.79Å; H338-L342 VanDerWaalsContact O-CB 3.28Å; H338-L342 WeakPolarHBondContact O-CB 3.44Å; H338-L342 WeakPolarHBondContact O-CD1 3.25Å; H338-L342 WeakPolarHBondContact O-CG 3.34Å; H338-L342 PolarHBondContact O-N 3.27Å
339R65.5Low67.6Low79 Ų7961 Ų6130%0.29835%0.352SS..Hα-helixtrans-60.3-52.2-175.2-65.7-173.5168.5-146-7.5114.1G336 L337 L341 L342 A343 E355G336-R339 WeakPolarHBondContact O-CB 3.31Å; G336-R339 PolarHBondContact O-N 3.49Å; L337-R339 VanDerWaalsContact C-N 3.29Å; L337-R339 PolarHBondContact O-N 3.36Å; R339-L341 VanDerWaalsContact C-N 3.29Å; R339-L341 PolarHBondContact O-N 3.12Å; R339-L342 PolarHBondContact O-N 3.25Å; R339-A343 VanDerWaalsContact O-CB 3.3Å; R339-A343 WeakPolarHBondContact O-CB 3.46Å; R339-A343 PolarHBondContact O-N 2.99Å; R339-E355 IonicContact CZ-OE2 3.78Å; R339-E355 IonicContact NH2-OE2 2.95Å; R339-E355 PolarHBondContact NH2-OE2 3.36Å
340P62.4Low65.9Low78 Ų7862.7 Ų62.751%0.50636%0.358SS..Hα-helixtrans-68.5-25.6176.225.9-34.9000113.5L337L337-P340 WeakPolarHBondContact O-CD 3.36Å; L337-P340 WeakPolarHBondContact O-CG 3.24Å
341L62.5Low64.3Low109 Ų10969.1 Ų69.157%0.57139%0.39SS*.Hα-helixtrans-74-43.8175-73.5167.8000111.5H338 R339 K344H338-L341 PolarHBondContact O-N 2.89Å; R339-L341 VanDerWaalsContact C-N 3.29Å; R339-L341 PolarHBondContact O-N 3.12Å; L341-K344 PolarHBondContact O-N 3.14Å
342L62.1Low63.1Low54 Ų5470 Ų7028%0.28340%0.395SS..Hα-helixtrans-68.4-34.8176.2-76.9154.3000111.9H338 R339 K344 I345 C348 V352H338-L342 HydrophobicContact CB-CD1 3.79Å; H338-L342 VanDerWaalsContact O-CB 3.28Å; H338-L342 WeakPolarHBondContact O-CB 3.44Å; H338-L342 WeakPolarHBondContact O-CD1 3.25Å; H338-L342 WeakPolarHBondContact O-CG 3.34Å; H338-L342 PolarHBondContact O-N 3.27Å; R339-L342 PolarHBondContact O-N 3.25Å; L342-K344 PolarHBondContact O-N 3.39Å; L342-I345 PolarHBondContact O-N 3.22Å; L342-I345 VanDerWaalsContact O-O 3.1Å; L342-C348 HydrophobicContact CB-CB 4.16Å; L342-C348 HydrophobicContact CD2-CB 3.45Å; L342-C348 VanDerWaalsContact CD2-CB 3.45Å; L342-C348 HydrophobicContact CG-CB 4.43Å; L342-V352 HydrophobicContact CB-CG2 4.01Å
343A60.2Low61.6Low58 Ų5874.5 Ų74.548%0.47941%0.411SS..THydrogen-bonded Turntrans-64.2-22.517300000113.2R339R339-A343 VanDerWaalsContact O-CB 3.3Å; R339-A343 WeakPolarHBondContact O-CB 3.46Å; R339-A343 PolarHBondContact O-N 2.99Å
344K60.9Low60Low178 Ų17879.6 Ų79.677%0.77443%0.433SS*.THydrogen-bonded Turntrans-84.4-10.5172.4-74.4-175.1177.5-175.90113.5L341 L342L341-K344 PolarHBondContact O-N 3.14Å; L342-K344 PolarHBondContact O-N 3.39Å
345I69.8Low58.6Low85 Ų8584.3 Ų84.344%0.43646%0.456SS..SBendtrans-97.2114.6178-61.6171.6000108L342 C347 C348 A349L342-I345 PolarHBondContact O-N 3.22Å; L342-I345 VanDerWaalsContact O-O 3.1Å; I345-C347 PolarHBondContact O-N 3.49Å; I345-C348 HydrophobicContact CB-CB 4.31Å; I345-C348 HydrophobicContact CG2-CB 4.35Å; I345-C348 PolarHBondContact O-N 2.66Å; I345-A349 PolarHBondContact O-N 3.05Å; I345-A349 VanDerWaalsContact O-N 3.08Å
346P55.5Low57.4Low118 Ų11889 Ų8977%0.76648%0.476SS*.THydrogen-bonded Turntrans-56.8-30-171.7-20.425.7000114.5
347C57.3Low55.9Low109 Ų10997.9 Ų97.974%0.73650%0.504SS*.THydrogen-bonded Turntrans-81.4-20.4-178.2-147.30000113.5I345I345-C347 PolarHBondContact O-N 3.49Å
348C50.2Low54.6Low36 Ų3697.8 Ų97.824%0.24350%0.504CS..THydrogen-bonded Turntrans-105.8-14.1-177.6-65.80000113.2L342 I345 N350 M351 V352L342-C348 HydrophobicContact CB-CB 4.16Å; L342-C348 HydrophobicContact CD2-CB 3.45Å; L342-C348 VanDerWaalsContact CD2-CB 3.45Å; L342-C348 HydrophobicContact CG-CB 4.43Å; I345-C348 HydrophobicContact CB-CB 4.31Å; I345-C348 HydrophobicContact CG2-CB 4.35Å; I345-C348 PolarHBondContact O-N 2.66Å; C348-N350 VanDerWaalsContact C-N 3.28Å; C348-N350 PolarHBondContact O-N 3.36Å; C348-M351 PolarHBondContact O-N 2.92Å; C348-V352 PolarHBondContact O-N 3.3Å
349A51.5Low53.5Low27 Ų27100.8 Ų100.822%0.22353%0.526CS..Hα-helixtrans-56.6-40.1175.300000112.4I345 M351 V352 E353I345-A349 PolarHBondContact O-N 3.05Å; I345-A349 VanDerWaalsContact O-N 3.08Å; A349-M351 VanDerWaalsContact C-N 3.32Å; A349-M351 PolarHBondContact O-N 3.05Å; A349-V352 PolarHBondContact O-N 3.19Å; A349-E353 PolarHBondContact O-N 3.05Å
350N50Low52.7Low109 Ų10999.5 Ų99.558%0.58353%0.533SS*.Hα-helixtrans-65.3-31.4178.5-71.1-0.6000113.4C348 E354C348-N350 VanDerWaalsContact C-N 3.28Å; C348-N350 PolarHBondContact O-N 3.36Å; N350-E354 PolarHBondContact O-N 3.03Å
351M51Low52.1Low134 Ų134102.1 Ų102.166%0.6654%0.538SS*.Hα-helixtrans-75-33.7177.7-66.7-169.2-178.700112.1C348 A349 E354 E355C348-M351 PolarHBondContact O-N 2.92Å; A349-M351 VanDerWaalsContact C-N 3.32Å; A349-M351 PolarHBondContact O-N 3.05Å; M351-E354 PolarHBondContact O-N 2.95Å; M351-E355 PolarHBondContact O-N 3.48Å; M351-E355 VanDerWaalsContact O-N 3.13Å
352V52.6Low51Low23 Ų23106.4 Ų106.414%0.13955%0.547CS..Hα-helixtrans-71-38.1175.6179.90000110.5L342 C348 A349 E355 E356L342-V352 HydrophobicContact CB-CG2 4.01Å; C348-V352 PolarHBondContact O-N 3.3Å; A349-V352 PolarHBondContact O-N 3.19Å; V352-E355 PolarHBondContact O-N 3.18Å; V352-E356 PolarHBondContact O-N 2.84Å; V352-E356 VanDerWaalsContact O-N 3.12Å
353E48.9Very low50.3Low127 Ų127106.6 Ų106.659%0.59356%0.556SS**Hα-helixtrans-66.1-37.5172.7-76.7-173161.500112.6A349 E356 R357A349-E353 PolarHBondContact O-N 3.05Å; E353-E356 PolarHBondContact O-N 3.43Å; E353-R357 WeakPolarHBondContact O-CB 3.24Å; E353-R357 PolarHBondContact O-N 3.44Å
354E46.6Very low49.8Very low147 Ų147113 Ų11369%0.68757%0.568SS**Hα-helixtrans-66.1-38174.1-85.1-173.2154.600113.1N350 M351 R357 N358N350-E354 PolarHBondContact O-N 3.03Å; M351-E354 PolarHBondContact O-N 2.95Å; E354-R357 PolarHBondContact O-N 2.94Å; E354-N358 PolarHBondContact O-N 2.94Å
355E45.4Very low49.1Very low105 Ų105110.6 Ų110.649%0.49156%0.563SS.*Hα-helixtrans-65.1-40.6174.9-117.4-170.1-170.200112.1R339 M351 V352 R357R339-E355 IonicContact CZ-OE2 3.78Å; R339-E355 IonicContact NH2-OE2 2.95Å; R339-E355 PolarHBondContact NH2-OE2 3.36Å; M351-E355 PolarHBondContact O-N 3.48Å; M351-E355 VanDerWaalsContact O-N 3.13Å; V352-E355 PolarHBondContact O-N 3.18Å; E355-R357 VanDerWaalsContact C-N 3.35Å
356E46.6Very low48Very low146 Ų146112.5 Ų112.568%0.68257%0.573SS**Hα-helixtrans-74.1-24.5175.4-75.6-169.8162.300113.2V352 E353V352-E356 PolarHBondContact O-N 2.84Å; V352-E356 VanDerWaalsContact O-N 3.12Å; E353-E356 PolarHBondContact O-N 3.43Å
357R38.6Very low47.5Very low203 Ų203112.2 Ų112.277%0.76657%0.565SS**THydrogen-bonded Turntrans-89.2-1.9-176.8-162174.1-167.7-134.93.6113.9E353 E354 E355 P359E353-R357 WeakPolarHBondContact O-CB 3.24Å; E353-R357 PolarHBondContact O-N 3.44Å; E354-R357 PolarHBondContact O-N 2.94Å; E355-R357 VanDerWaalsContact C-N 3.35Å; R357-P359 WeakPolarHBondContact O-CD 3.48Å; R357-P359 WeakPolarHBondContact O-CG 3.26Å
358N41.2Very low46.9Very low94 Ų94113.7 Ų113.750%0.50356%0.561SS.*  trans-64.898.5178.5-163.8-8.8000110.9E354 A360 E361E354-N358 PolarHBondContact O-N 2.94Å; N358-A360 PolarHBondContact O-N 2.93Å; N358-A360 VanDerWaalsContact O-N 3.14Å; N358-E361 PolarHBondContact O-N 3.45Å
359P44.7Very low46.6Very low97 Ų97114.2 Ų114.263%0.6357%0.573SS**Hα-helixtrans-72.5-15.1-167.8-9.927.8000112R357 A363R357-P359 WeakPolarHBondContact O-CD 3.48Å; R357-P359 WeakPolarHBondContact O-CG 3.26Å; P359-A363 WeakPolarHBondContact O-CB 3.42Å; P359-A363 PolarHBondContact O-N 3.33Å
360A48.7Very low46.2Very low53 Ų53122 Ų12244%0.43860%0.596SS.*Hα-helixtrans-69.9-29.4-177.100000113.2N358 R364N358-A360 PolarHBondContact O-N 2.93Å; N358-A360 VanDerWaalsContact O-N 3.14Å; A360-R364 VanDerWaalsContact O-CG 3.29Å; A360-R364 WeakPolarHBondContact O-CG 3.48Å; A360-R364 PolarHBondContact O-N 3.47Å
361E49Very low45.8Very low133 Ų133121.6 Ų121.662%0.62160%0.597SS**Hα-helixtrans-83.2-36.3179.6-161.9169.5-169.700111.6N358 L365N358-E361 PolarHBondContact O-N 3.45Å; E361-L365 PolarHBondContact O-N 3.33Å
362R40.5Very low45.5Very low199 Ų199123.5 Ų123.575%0.75161%0.605SS**Hα-helixtrans-72.8-33.5175.2-151.9178.3-176.6-176.50.6112.7
363A47.4Very low45.1Very low57 Ų57131 Ų13147%0.47164%0.638SS.*Hα-helixtrans-69.3-38.817500000112.5P359 L365 L366 D367P359-A363 WeakPolarHBondContact O-CB 3.42Å; P359-A363 PolarHBondContact O-N 3.33Å; A363-L365 VanDerWaalsContact C-N 3.33Å; A363-L365 PolarHBondContact O-N 3.38Å; A363-L366 PolarHBondContact O-N 2.72Å; A363-D367 PolarHBondContact O-N 3.3Å
364R49.4Very low44.8Very low192 Ų192133.5 Ų133.573%0.72565%0.65SS**Hα-helixtrans-64.7-33.6177-77.7176177.1-179.9-0.2113.5A360 L366A360-R364 VanDerWaalsContact O-CG 3.29Å; A360-R364 WeakPolarHBondContact O-CG 3.48Å; A360-R364 PolarHBondContact O-N 3.47Å; R364-L366 VanDerWaalsContact C-N 3.34Å
365L46Very low44.3Very low128 Ų128135.5 Ų135.567%0.6767%0.672SS**Hα-helixtrans-73.4-22.6176.4-73.1166.5000113.8E361 A363E361-L365 PolarHBondContact O-N 3.33Å; A363-L365 VanDerWaalsContact C-N 3.33Å; A363-L365 PolarHBondContact O-N 3.38Å
366L46.5Very low44.3Very low125 Ų125137 Ų13765%0.65468%0.682SS**Hα-helixtrans-89.8-27178.6-71.5168.7000112.6A363 R364A363-L366 PolarHBondContact O-N 2.72Å; R364-L366 VanDerWaalsContact C-N 3.34Å
367D45.3Very low44.1Very low112 Ų112136.5 Ų136.560%0.59968%0.681SS**Hα-helixtrans-78.6-37.2-179.2-13025.1000112.4A363 G369 R370 V371A363-D367 PolarHBondContact O-N 3.3Å; D367-G369 PolarHBondContact O-N 3.38Å; D367-R370 PolarHBondContact O-N 3.21Å; D367-R370 VanDerWaalsContact O-N 3.15Å; D367-V371 PolarHBondContact O-N 2.95Å
368E45.8Very low44.4Very low141 Ų141132.8 Ų132.866%0.65968%0.677SS**THydrogen-bonded Turntrans-64.7-22.3174.9-81.5-175.9160.600113.2
369G43.8Very low44.6Very low47 Ų47135.1 Ų135.149%0.48569%0.687SS.*THydrogen-bonded Turntrans-79.8-21.917500000114.5D367D367-G369 PolarHBondContact O-N 3.38Å
370R42.8Very low44.6Very low190 Ų190137.5 Ų137.572%0.71769%0.691SS**THydrogen-bonded Turntrans-90-24-179.5-68.1-177.179.2160.83.1113.1D367 Q372D367-R370 PolarHBondContact O-N 3.21Å; D367-R370 VanDerWaalsContact O-N 3.15Å; R370-Q372 VanDerWaalsContact C-N 3.3Å; R370-Q372 PolarHBondContact O-N 2.92Å
371V42.1Very low44.4Very low100 Ų100143.1 Ų143.161%0.60671%0.707SS**THydrogen-bonded Turntrans-74.6-20179.3-179.10000112.2D367 T375D367-V371 PolarHBondContact O-N 2.95Å; V371-T375 PolarHBondContact O-OG1 2.98Å
372Q43.4Very low44Very low174 Ų174143.9 Ų143.981%0.81371%0.714SS**THydrogen-bonded Turntrans-91.3-4.7178.8-78-174.8-15.100115.4R370R370-Q372 VanDerWaalsContact C-N 3.3Å; R370-Q372 PolarHBondContact O-N 2.92Å
373E43.6Very low44.3Very low180 Ų180139.6 Ų139.684%0.84171%0.711SS**SBendtrans-96.2-5.1173.1-80.7-173.6160.100113.8
374E42.8Very low44.1Very low181 Ų181146.5 Ų146.585%0.84673%0.731SS**  trans-121.622.5-178-77.9-168.9165.400115.3
375T37.1Very low43.6Very low188 Ų188142.4 Ų142.4100%1.15373%0.731SS**  trans-131.10169.2-7.80000114.5V371V371-T375 PolarHBondContact O-OG1 2.98Å

Retrieved 375 of 375 residues in 2387.3 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).