G4VE75_SCHMA Loading...

Epididymal membrane protein E9-related

AlphaFold DB , UniProt , Accession G4VE75, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 337 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M60.8Low87Confident71 Ų7135.5 Ų35.535%0.3523%0.232SC..  0142.40-81.6-83.7137.600111.1T3 G109 H113M1-T3 PolarHBondContact O-N 3.29Å; M1-G109 VanDerWaalsContact CE-CA 3.47Å; M1-G109 WeakPolarHBondContact CE-O 3.48Å; M1-G109 WeakPolarHBondContact SD-CA 3.4Å; M1-H113 HydrophobicContact CE-CB 4.16Å; M1-H113 WeakPolarHBondContact CE-CD2 3.1Å; M1-H113 WeakPolarHBondContact CE-CE1 3.33Å; M1-H113 WeakPolarHBondContact CE-ND1 3.45Å; M1-H113 WeakPolarHBondContact CE-NE2 3.44Å
2G76.3Confident87.8Confident36 Ų3635.3 Ų35.337%0.37123%0.233SC..  trans60.943.7168.600000116.1Y221G2-Y221 VanDerWaalsContact C-CE1 3.44Å; G2-Y221 VanDerWaalsContact CA-OH 3.23Å; G2-Y221 WeakPolarHBondContact CA-OH 3.46Å; G2-Y221 WeakPolarHBondContact O-CD1 3.41Å; G2-Y221 WeakPolarHBondContact O-CE1 2.91Å
3T87.5Confident88.2Confident66 Ų6637.7 Ų37.741%0.40524%0.237SC..SBendtrans-139.7162.9174.365.90000110.2M1 G5 G6 H7 Y221M1-T3 PolarHBondContact O-N 3.29Å; T3-G5 VanDerWaalsContact C-N 3.27Å; T3-G5 PolarHBondContact O-N 3.41Å; T3-G6 PolarHBondContact O-N 3.08Å; T3-G6 VanDerWaalsContact O-N 3.16Å; T3-G6 PolarHBondContact OG1-N 3.44Å; T3-G6 VanDerWaalsContact OG1-N 3.12Å; T3-H7 PolarHBondContact O-N 3.09Å; T3-H7 PolarHBondContact O-ND1 3.18Å; T3-Y221 VanDerWaalsContact C-CD2 3.46Å
4F91.8Very high88.8Confident28 Ų2837 Ų3712%0.12323%0.229CC..Hα-helixtrans-52.7-46170.1-179.8-88.3000112G6 H7 A8 W214 G217 A218 Y221 K223 M227F4-G6 VanDerWaalsContact C-N 3.29Å; F4-G6 PolarHBondContact O-N 2.91Å; F4-H7 PolarHBondContact O-N 3.06Å; F4-H7 VanDerWaalsContact O-N 3.08Å; F4-A8 HydrophobicContact CD1-CB 4.04Å; F4-A8 HydrophobicContact CE1-CB 3.74Å; F4-A8 HydrophobicContact CZ-CB 4.3Å; F4-A8 WeakPolarHBondContact O-CB 2.97Å; F4-A8 PolarHBondContact O-N 3.34Å; F4-W214 HydrophobicContact CE1-CE3 4.26Å; F4-W214 HydrophobicContact CE1-CH2 4.44Å; F4-W214 AromaticContact CE1-CZ3 3.83Å; F4-W214 HydrophobicContact CE1-CZ3 3.83Å; F4-W214 AromaticContact CZ-CE3 3.65Å; F4-W214 HydrophobicContact CZ-CE3 3.65Å; F4-W214 AromaticContact CZ-CZ3 3.51Å; F4-W214 HydrophobicContact CZ-CZ3 3.51Å; F4-G217 VanDerWaalsContact CD2-C 3.45Å; F4-G217 WeakPolarHBondContact CD2-O 3.44Å; F4-A218 HydrophobicContact CE2-CB 4.15Å; F4-Y221 VanDerWaalsContact N-CB 3.33Å; F4-K223 HydrophobicContact CB-CD 4.13Å; F4-K223 HydrophobicContact CB-CG 3.7Å; F4-K223 HydrophobicContact CD1-CD 4.29Å; F4-K223 HydrophobicContact CD1-CG 4.32Å; F4-K223 HydrophobicContact CD2-CG 4.47Å; F4-K223 HydrophobicContact CG-CD 4.34Å; F4-K223 HydrophobicContact CG-CG 3.93Å; F4-M227 HydrophobicContact CE2-CE 4.11Å
5G89.1Confident89.4Confident34 Ų3437.2 Ų37.235%0.35123%0.227SC..Hα-helixtrans-63.5-35.6-179.600000112.7T3 H7 L9T3-G5 VanDerWaalsContact C-N 3.27Å; T3-G5 PolarHBondContact O-N 3.41Å; G5-H7 PolarHBondContact O-N 3.47Å; G5-L9 VanDerWaalsContact O-CB 3.29Å; G5-L9 WeakPolarHBondContact O-CB 2.99Å; G5-L9 PolarHBondContact O-N 2.89Å
6G87Confident89.9Confident21 Ų2141.9 Ų41.922%0.21625%0.249CC..Hα-helixtrans-64-20.2175.100000114.4T3 F4 P10T3-G6 PolarHBondContact O-N 3.08Å; T3-G6 VanDerWaalsContact O-N 3.16Å; T3-G6 PolarHBondContact OG1-N 3.44Å; T3-G6 VanDerWaalsContact OG1-N 3.12Å; F4-G6 VanDerWaalsContact C-N 3.29Å; F4-G6 PolarHBondContact O-N 2.91Å; G6-P10 VanDerWaalsContact O-CD 3.24Å; G6-P10 WeakPolarHBondContact O-CD 3.42Å; G6-P10 VanDerWaalsContact O-CG 3.26Å; G6-P10 WeakPolarHBondContact O-CG 3.33Å
7H92.8Very high90.2Very high16 Ų1641.3 Ų41.37%0.07424%0.242CC..Hα-helixtrans-101.1-43.9174.7-64.375.5000111.8T3 F4 G5 L9 P10 G11 H172 F213 V216 Y221T3-H7 PolarHBondContact O-N 3.09Å; T3-H7 PolarHBondContact O-ND1 3.18Å; F4-H7 PolarHBondContact O-N 3.06Å; F4-H7 VanDerWaalsContact O-N 3.08Å; G5-H7 PolarHBondContact O-N 3.47Å; H7-L9 VanDerWaalsContact C-N 3.28Å; H7-L9 PolarHBondContact O-N 3.08Å; H7-P10 VanDerWaalsContact O-CD 3.3Å; H7-P10 WeakPolarHBondContact O-CD 3.46Å; H7-P10 WeakPolarHBondContact O-CG 3.36Å; H7-G11 PolarHBondContact O-N 3.38Å; H7-H172 AromaticContact NE2-NE2 3.75Å; H7-F213 HydrophobicContact CB-CD1 4.47Å; H7-F213 VanDerWaalsContact CB-O 3.27Å; H7-F213 WeakPolarHBondContact CB-O 3.41Å; H7-F213 WeakPolarHBondContact O-CB 3.48Å; H7-V216 VanDerWaalsContact CD2-CG1 3.48Å; H7-V216 WeakPolarHBondContact CD2-CG1 3.37Å; H7-Y221 AromaticContact CE1-CE2 3.51Å; H7-Y221 AromaticContact ND1-CE2 3.93Å
8A93.4Very high90.6Very high7 Ų739 Ų396%0.05823%0.228CC..Hα-helixtrans-61-36.3-179.100000112.3F4 G11 S12 W214F4-A8 HydrophobicContact CD1-CB 4.04Å; F4-A8 HydrophobicContact CE1-CB 3.74Å; F4-A8 HydrophobicContact CZ-CB 4.3Å; F4-A8 WeakPolarHBondContact O-CB 2.97Å; F4-A8 PolarHBondContact O-N 3.34Å; A8-G11 PolarHBondContact O-N 3.4Å; A8-S12 WeakPolarHBondContact O-CB 3.4Å; A8-S12 PolarHBondContact O-N 3.4Å; A8-S12 PolarHBondContact O-OG 3.2Å; A8-W214 HydrophobicContact CB-CD2 3.9Å; A8-W214 HydrophobicContact CB-CE3 4.09Å; A8-W214 HydrophobicContact CB-CH2 4.04Å; A8-W214 HydrophobicContact CB-CZ2 3.84Å; A8-W214 HydrophobicContact CB-CZ3 4.17Å; A8-W214 PolarHBondContact O-NE1 2.91Å; A8-W214 VanDerWaalsContact O-NE1 3.16Å
9L91.2Very high90.9Very high92 Ų9240.2 Ų40.248%0.48223%0.233SC..Hα-helixtrans-64.3-59.7179.6-177.965.2000113G5 H7 G11 S12 F13G5-L9 VanDerWaalsContact O-CB 3.29Å; G5-L9 WeakPolarHBondContact O-CB 2.99Å; G5-L9 PolarHBondContact O-N 2.89Å; H7-L9 VanDerWaalsContact C-N 3.28Å; H7-L9 PolarHBondContact O-N 3.08Å; L9-G11 PolarHBondContact O-N 3.08Å; L9-S12 WeakPolarHBondContact O-CB 3.27Å; L9-S12 PolarHBondContact O-N 2.82Å; L9-S12 VanDerWaalsContact O-N 3.14Å; L9-F13 HydrophobicContact CD1-CE1 4.36Å; L9-F13 HydrophobicContact CD1-CE2 4.09Å; L9-F13 HydrophobicContact CD1-CZ 3.74Å; L9-F13 HydrophobicContact CG-CE2 3.97Å; L9-F13 HydrophobicContact CG-CZ 4.14Å; L9-F13 PolarHBondContact O-N 3.3Å
10P91.6Very high91.2Very high19 Ų1941.3 Ų41.312%0.12323%0.233CC..Hα-helixtrans-59.9-37174.522.9-32.1000111.5G6 H7 S12 F13 F14G6-P10 VanDerWaalsContact O-CD 3.24Å; G6-P10 WeakPolarHBondContact O-CD 3.42Å; G6-P10 VanDerWaalsContact O-CG 3.26Å; G6-P10 WeakPolarHBondContact O-CG 3.33Å; H7-P10 VanDerWaalsContact O-CD 3.3Å; H7-P10 WeakPolarHBondContact O-CD 3.46Å; H7-P10 WeakPolarHBondContact O-CG 3.36Å; P10-S12 VanDerWaalsContact C-N 3.27Å; P10-S12 PolarHBondContact O-N 3.45Å; P10-F13 PolarHBondContact O-N 3.32Å; P10-F13 VanDerWaalsContact O-N 3.11Å; P10-F14 VanDerWaalsContact O-CD2 3.3Å; P10-F14 WeakPolarHBondContact O-CD2 3.35Å; P10-F14 PolarHBondContact O-N 3.33Å
11G95.5Very high91.5Very high0 Ų039.3 Ų39.30%022%0.222CC..Hα-helixtrans-55.3-42175.300000113.2H7 A8 L9 F14 I15 G210H7-G11 PolarHBondContact O-N 3.38Å; A8-G11 PolarHBondContact O-N 3.4Å; L9-G11 PolarHBondContact O-N 3.08Å; G11-F14 PolarHBondContact O-N 3.15Å; G11-I15 VanDerWaalsContact O-CG1 3.28Å; G11-I15 WeakPolarHBondContact O-CG1 3.36Å; G11-I15 PolarHBondContact O-N 2.95Å; G11-G210 WeakPolarHBondContact CA-O 3.22Å; G11-G210 CarbonylContact O-C 3.2Å; G11-G210 WeakPolarHBondContact O-CA 3.47Å
12S96.2Very high93.2Very high34 Ų3436 Ų3624%0.23821%0.206CC..Hα-helixtrans-65.1-40.2177.8-57.40000112.3A8 L9 P10 I15 I16 W214A8-S12 WeakPolarHBondContact O-CB 3.4Å; A8-S12 PolarHBondContact O-N 3.4Å; A8-S12 PolarHBondContact O-OG 3.2Å; L9-S12 WeakPolarHBondContact O-CB 3.27Å; L9-S12 PolarHBondContact O-N 2.82Å; L9-S12 VanDerWaalsContact O-N 3.14Å; P10-S12 VanDerWaalsContact C-N 3.27Å; P10-S12 PolarHBondContact O-N 3.45Å; S12-I15 PolarHBondContact O-N 3.15Å; S12-I16 VanDerWaalsContact O-CG1 3.27Å; S12-I16 WeakPolarHBondContact O-CG1 3.36Å; S12-I16 PolarHBondContact O-N 3.3Å; S12-W214 WeakPolarHBondContact OG-CZ2 3.32Å; S12-W214 PolarHBondContact OG-NE1 3.27Å; S12-W214 VanDerWaalsContact OG-NE1 3.09Å
13F93.9Very high94.2Very high66 Ų6638 Ų3829%0.28920%0.202SC..Hα-helixtrans-63.3-44.8176.2-61.7-36.4000111.8L9 P10 I15 I16 Y17 C86L9-F13 HydrophobicContact CD1-CE1 4.36Å; L9-F13 HydrophobicContact CD1-CE2 4.09Å; L9-F13 HydrophobicContact CD1-CZ 3.74Å; L9-F13 HydrophobicContact CG-CE2 3.97Å; L9-F13 HydrophobicContact CG-CZ 4.14Å; L9-F13 PolarHBondContact O-N 3.3Å; P10-F13 PolarHBondContact O-N 3.32Å; P10-F13 VanDerWaalsContact O-N 3.11Å; F13-I15 PolarHBondContact O-N 2.9Å; F13-I16 PolarHBondContact O-N 3.4Å; F13-Y17 VanDerWaalsContact O-CB 3.29Å; F13-Y17 WeakPolarHBondContact O-CB 3.43Å; F13-Y17 PolarHBondContact O-N 2.94Å; F13-C86 HydrophobicContact CD1-CB 4.33Å; F13-C86 HydrophobicContact CE1-CB 3.93Å; F13-C86 VanDerWaalsContact CE1-SG 3.53Å; F13-C86 HydrophobicContact CE2-CB 4.16Å; F13-C86 HydrophobicContact CZ-CB 3.83Å
14F95.9Very high94.5Very high28 Ų2836.1 Ų36.112%0.12319%0.189CC..Hα-helixtrans-63.7-39.3176.3-83.4-67.5000113P10 G11 G18 F120 E153 Y206 Q209 G210 F213P10-F14 VanDerWaalsContact O-CD2 3.3Å; P10-F14 WeakPolarHBondContact O-CD2 3.35Å; P10-F14 PolarHBondContact O-N 3.33Å; G11-F14 PolarHBondContact O-N 3.15Å; F14-G18 PolarHBondContact O-N 3.36Å; F14-F120 HydrophobicContact CZ-CZ 4.48Å; F14-E153 WeakPolarHBondContact CZ-OE1 3.38Å; F14-Y206 WeakPolarHBondContact CB-O 3.47Å; F14-Y206 HydrophobicContact CD1-CD1 4.26Å; F14-Y206 HydrophobicContact CD1-CG 4.49Å; F14-Y206 HydrophobicContact CE1-CD1 4.29Å; F14-Q209 HydrophobicContact CD1-CB 4.25Å; F14-Q209 HydrophobicContact CD2-CB 4.49Å; F14-Q209 HydrophobicContact CG-CB 4.19Å; F14-G210 VanDerWaalsContact CB-CA 3.42Å; F14-F213 AromaticContact CD2-CD2 3.94Å; F14-F213 HydrophobicContact CD2-CD2 3.94Å; F14-F213 AromaticContact CD2-CE2 3.74Å; F14-F213 HydrophobicContact CD2-CE2 3.74Å; F14-F213 HydrophobicContact CE2-CD2 4.32Å; F14-F213 AromaticContact CE2-CE2 3.64Å; F14-F213 HydrophobicContact CE2-CE2 3.64Å
15I98Very high94.7Very high40 Ų4034.8 Ų34.821%0.20518%0.183CC..Hα-helixtrans-61.6-52.3174-69.3166.3000110.3G11 S12 F13 Y17 G18 L19 L207 T211G11-I15 VanDerWaalsContact O-CG1 3.28Å; G11-I15 WeakPolarHBondContact O-CG1 3.36Å; G11-I15 PolarHBondContact O-N 2.95Å; S12-I15 PolarHBondContact O-N 3.15Å; F13-I15 PolarHBondContact O-N 2.9Å; I15-Y17 PolarHBondContact O-N 3.44Å; I15-G18 PolarHBondContact O-N 3.26Å; I15-L19 HydrophobicContact CG2-CD1 3.78Å; I15-L19 HydrophobicContact CG2-CG 4.34Å; I15-L19 WeakPolarHBondContact O-CB 3.45Å; I15-L19 VanDerWaalsContact O-CG 3.29Å; I15-L19 WeakPolarHBondContact O-CG 3.38Å; I15-L19 PolarHBondContact O-N 2.95Å; I15-L207 HydrophobicContact CB-CD1 4.42Å; I15-L207 HydrophobicContact CG1-CD1 4.36Å; I15-L207 HydrophobicContact CG2-CD1 4.12Å; I15-T211 HydrophobicContact CD1-CG2 4.11Å; I15-T211 HydrophobicContact CG1-CG2 4.03Å
16I96.7Very high95Very high112 Ų11233.4 Ų33.457%0.57417%0.167SC*.Hα-helixtrans-60.6-46.8-177.8-67.8165.9000110.2S12 F13 L19 W20S12-I16 VanDerWaalsContact O-CG1 3.27Å; S12-I16 WeakPolarHBondContact O-CG1 3.36Å; S12-I16 PolarHBondContact O-N 3.3Å; F13-I16 PolarHBondContact O-N 3.4Å; I16-L19 PolarHBondContact O-N 3.48Å; I16-W20 WeakPolarHBondContact O-CB 3.27Å; I16-W20 PolarHBondContact O-N 2.7Å
17Y95.3Very high95.4Very high32 Ų3233.6 Ų33.613%0.12516%0.163CC..Hα-helixtrans-66.1-40.7179.5-164.9-92.2000112.3F13 I15 W20 S21 I51 D79 K83 Y206F13-Y17 VanDerWaalsContact O-CB 3.29Å; F13-Y17 WeakPolarHBondContact O-CB 3.43Å; F13-Y17 PolarHBondContact O-N 2.94Å; I15-Y17 PolarHBondContact O-N 3.44Å; Y17-W20 PolarHBondContact O-N 3.11Å; Y17-S21 VanDerWaalsContact O-CB 3.26Å; Y17-S21 WeakPolarHBondContact O-CB 3.48Å; Y17-S21 PolarHBondContact O-N 3.01Å; Y17-I51 PolarHBondContact OH-O 3.04Å; Y17-D79 HydrophobicContact CD2-CB 4.5Å; Y17-D79 HydrophobicContact CE2-CB 4.03Å; Y17-K83 PolarHBondContact OH-NZ 3.19Å; Y17-Y206 AromaticContact CD1-CD2 3.54Å; Y17-Y206 HydrophobicContact CD1-CD2 3.54Å; Y17-Y206 AromaticContact CD1-CE2 3.78Å; Y17-Y206 HydrophobicContact CD1-CE2 3.78Å; Y17-Y206 HydrophobicContact CD1-CG 4.35Å; Y17-Y206 AromaticContact CE1-CD2 3.86Å; Y17-Y206 HydrophobicContact CE1-CD2 3.86Å; Y17-Y206 AromaticContact CE1-CE2 3.57Å; Y17-Y206 HydrophobicContact CE1-CE2 3.57Å
18G97.1Very high95.4Very high0 Ų035.7 Ų35.70%017%0.172CC..Hα-helixtrans-60.2-51.3175.300000111.9F14 I15 S21 I22F14-G18 PolarHBondContact O-N 3.36Å; I15-G18 PolarHBondContact O-N 3.26Å; G18-S21 PolarHBondContact O-N 2.88Å; G18-I22 WeakPolarHBondContact O-CB 3.25Å; G18-I22 WeakPolarHBondContact O-CD1 3.26Å; G18-I22 WeakPolarHBondContact O-CG1 3.45Å; G18-I22 PolarHBondContact O-N 2.85Å
19L97.8Very high95.4Very high61 Ų6138.3 Ų38.332%0.31918%0.182SC..Hα-helixtrans-63.1-42.7177.9-67.1174.6000112.2I15 I16 I22 W23 L207 V255 I259I15-L19 HydrophobicContact CG2-CD1 3.78Å; I15-L19 HydrophobicContact CG2-CG 4.34Å; I15-L19 WeakPolarHBondContact O-CB 3.45Å; I15-L19 VanDerWaalsContact O-CG 3.29Å; I15-L19 WeakPolarHBondContact O-CG 3.38Å; I15-L19 PolarHBondContact O-N 2.95Å; I16-L19 PolarHBondContact O-N 3.48Å; L19-I22 PolarHBondContact O-N 3.4Å; L19-W23 WeakPolarHBondContact O-CB 3.27Å; L19-W23 PolarHBondContact O-N 3.47Å; L19-L207 HydrophobicContact CD2-CD1 4.09Å; L19-L207 HydrophobicContact CD2-CD2 4.29Å; L19-L207 HydrophobicContact CG-CD1 4.09Å; L19-V255 HydrophobicContact CD2-CG1 3.66Å; L19-I259 HydrophobicContact CD2-CD1 3.86Å
20W96.5Very high95.5Very high63 Ų6335.3 Ų35.324%0.23916%0.164CC..Hα-helixtrans-56.8-51.6175.3178.5-87.9000111.7I16 Y17 W23 H24 I55 L78 D79I16-W20 WeakPolarHBondContact O-CB 3.27Å; I16-W20 PolarHBondContact O-N 2.7Å; Y17-W20 PolarHBondContact O-N 3.11Å; W20-W23 PolarHBondContact O-N 3.33Å; W20-H24 AromaticContact CD1-CD2 3.79Å; W20-H24 AromaticContact CD2-CD2 3.72Å; W20-H24 AromaticContact CD2-NE2 3.78Å; W20-H24 AromaticContact CE2-CD2 3.34Å; W20-H24 AromaticContact CE2-NE2 3.34Å; W20-H24 VanDerWaalsContact CE2-NE2 3.34Å; W20-H24 AromaticContact CG-CD2 3.98Å; W20-H24 AromaticContact CH2-NE2 3.49Å; W20-H24 WeakPolarHBondContact CH2-NE2 3.49Å; W20-H24 AromaticContact CZ2-CD2 3.72Å; W20-H24 AromaticContact CZ2-NE2 3.2Å; W20-H24 WeakPolarHBondContact CZ2-NE2 3.27Å; W20-H24 AromaticContact CZ3-NE2 3.95Å; W20-H24 AromaticContact NE1-CD2 3.4Å; W20-H24 PolarHBondContact NE1-CD2 3.47Å; W20-H24 AromaticContact NE1-NE2 3.88Å; W20-H24 PolarHBondContact O-CD2 2.92Å; W20-H24 VanDerWaalsContact O-CD2 3.28Å; W20-H24 PolarHBondContact O-N 3.34Å; W20-I55 HydrophobicContact CH2-CD1 3.55Å; W20-I55 HydrophobicContact CH2-CG1 3.81Å; W20-I55 HydrophobicContact CZ2-CD1 4.1Å; W20-I55 HydrophobicContact CZ2-CG1 3.89Å; W20-L78 HydrophobicContact CH2-CB 4.29Å; W20-L78 HydrophobicContact CH2-CD2 3.84Å; W20-L78 HydrophobicContact CZ2-CB 4.25Å; W20-L78 HydrophobicContact CZ3-CD2 4.2Å; W20-D79 PolarHBondContact NE1-OD2 3.22Å
21S96.1Very high95.5Very high0 Ų038.3 Ų38.30%018%0.177CC..Hα-helixtrans-63.7-45.9-179.3-174.10000111.2Y17 G18 W23 H24 I25 R202 S203Y17-S21 VanDerWaalsContact O-CB 3.26Å; Y17-S21 WeakPolarHBondContact O-CB 3.48Å; Y17-S21 PolarHBondContact O-N 3.01Å; G18-S21 PolarHBondContact O-N 2.88Å; S21-W23 PolarHBondContact O-N 3.38Å; S21-H24 PolarHBondContact O-N 3.03Å; S21-I25 WeakPolarHBondContact O-CB 3.23Å; S21-I25 WeakPolarHBondContact O-CD1 3.17Å; S21-I25 WeakPolarHBondContact O-CG1 3.26Å; S21-I25 PolarHBondContact O-N 2.9Å; S21-R202 PolarHBondContact OG-NH1 3.28Å; S21-S203 VanDerWaalsContact CB-OG 3.26Å; S21-S203 WeakPolarHBondContact CB-OG 3.46Å; S21-S203 PolarHBondContact OG-OG 2.86Å
22I97.5Very high95.3Very high0 Ų041.3 Ų41.30%019%0.188CC..Hα-helixtrans-55.5-50.4175.5-69.1159.1000110.6G18 L19 H24 I25 L26 L200 L207 I256 I259G18-I22 WeakPolarHBondContact O-CB 3.25Å; G18-I22 WeakPolarHBondContact O-CD1 3.26Å; G18-I22 WeakPolarHBondContact O-CG1 3.45Å; G18-I22 PolarHBondContact O-N 2.85Å; L19-I22 PolarHBondContact O-N 3.4Å; I22-H24 PolarHBondContact O-N 3.35Å; I22-I25 PolarHBondContact O-N 3.25Å; I22-L26 HydrophobicContact CG2-CD1 3.62Å; I22-L26 HydrophobicContact CG2-CG 4.5Å; I22-L26 WeakPolarHBondContact O-CB 3.47Å; I22-L26 WeakPolarHBondContact O-CD1 3.18Å; I22-L26 VanDerWaalsContact O-CG 3.26Å; I22-L26 WeakPolarHBondContact O-CG 2.9Å; I22-L26 PolarHBondContact O-N 2.93Å; I22-L26 VanDerWaalsContact O-N 3.11Å; I22-L200 HydrophobicContact CG2-CD2 4.37Å; I22-L207 HydrophobicContact CD1-CD2 4.08Å; I22-I256 HydrophobicContact CD1-CD1 4.27Å; I22-I256 HydrophobicContact CD1-CG1 3.75Å; I22-I256 HydrophobicContact CG1-CG1 4.43Å; I22-I259 HydrophobicContact CB-CD1 4.48Å; I22-I259 HydrophobicContact CG2-CB 4.28Å; I22-I259 HydrophobicContact CG2-CD1 3.87Å; I22-I259 HydrophobicContact CG2-CG2 4.03Å
23W96.8Very high95Very high80 Ų8042 Ų4230%0.30319%0.187SC..Hα-helixtrans-57.4-51.7-179.1179-83.2000111.7L19 W20 S21 L26 E27 I259 T262 V263L19-W23 WeakPolarHBondContact O-CB 3.27Å; L19-W23 PolarHBondContact O-N 3.47Å; W20-W23 PolarHBondContact O-N 3.33Å; S21-W23 PolarHBondContact O-N 3.38Å; W23-L26 PolarHBondContact O-N 2.68Å; W23-E27 PolarHBondContact NE1-OE2 3Å; W23-E27 VanDerWaalsContact O-CB 3.3Å; W23-E27 WeakPolarHBondContact O-CB 3.15Å; W23-E27 PolarHBondContact O-N 2.87Å; W23-I259 HydrophobicContact CE3-CG2 3.89Å; W23-T262 HydrophobicContact CH2-CG2 4.17Å; W23-T262 HydrophobicContact CZ3-CG2 4.06Å; W23-V263 HydrophobicContact CD2-CG2 4.33Å; W23-V263 HydrophobicContact CE3-CG2 4.16Å; W23-V263 HydrophobicContact CH2-CG2 4.42Å; W23-V263 HydrophobicContact CZ3-CG2 4.2Å
24H95.1Very high94.8Very high25 Ų2539.2 Ų39.212%0.11618%0.175CC..Hα-helixtrans-72.6-31.3-175.1-76.6-62.5000114W20 S21 I22 E27 K28 Y53W20-H24 AromaticContact CD1-CD2 3.79Å; W20-H24 AromaticContact CD2-CD2 3.72Å; W20-H24 AromaticContact CD2-NE2 3.78Å; W20-H24 AromaticContact CE2-CD2 3.34Å; W20-H24 AromaticContact CE2-NE2 3.34Å; W20-H24 VanDerWaalsContact CE2-NE2 3.34Å; W20-H24 AromaticContact CG-CD2 3.98Å; W20-H24 AromaticContact CH2-NE2 3.49Å; W20-H24 WeakPolarHBondContact CH2-NE2 3.49Å; W20-H24 AromaticContact CZ2-CD2 3.72Å; W20-H24 AromaticContact CZ2-NE2 3.2Å; W20-H24 WeakPolarHBondContact CZ2-NE2 3.27Å; W20-H24 AromaticContact CZ3-NE2 3.95Å; W20-H24 AromaticContact NE1-CD2 3.4Å; W20-H24 PolarHBondContact NE1-CD2 3.47Å; W20-H24 AromaticContact NE1-NE2 3.88Å; W20-H24 PolarHBondContact O-CD2 2.92Å; W20-H24 VanDerWaalsContact O-CD2 3.28Å; W20-H24 PolarHBondContact O-N 3.34Å; S21-H24 PolarHBondContact O-N 3.03Å; I22-H24 PolarHBondContact O-N 3.35Å; H24-E27 IonicContact ND1-OE2 3.67Å; H24-K28 WeakPolarHBondContact O-CB 3.48Å; H24-K28 WeakPolarHBondContact O-CG 3.26Å; H24-K28 PolarHBondContact O-N 3.37Å; H24-Y53 HydrophobicContact CB-CD1 3.67Å; H24-Y53 HydrophobicContact CB-CD2 4.12Å; H24-Y53 HydrophobicContact CB-CE1 4.46Å; H24-Y53 HydrophobicContact CB-CG 3.5Å; H24-Y53 VanDerWaalsContact CB-CG 3.5Å
25I95.5Very high94.5Very high0 Ų041 Ų410%018%0.182CC..Hα-helixtrans-59.2-53.6170.4-73.4162.3000109.9S21 I22 F29 Y47 Y53 P196 G199 L200 S203S21-I25 WeakPolarHBondContact O-CB 3.23Å; S21-I25 WeakPolarHBondContact O-CD1 3.17Å; S21-I25 WeakPolarHBondContact O-CG1 3.26Å; S21-I25 PolarHBondContact O-N 2.9Å; I22-I25 PolarHBondContact O-N 3.25Å; I25-F29 VanDerWaalsContact O-CB 3.28Å; I25-F29 WeakPolarHBondContact O-CB 3.07Å; I25-F29 PolarHBondContact O-N 2.95Å; I25-Y47 HydrophobicContact CG2-CE2 4.11Å; I25-Y47 WeakPolarHBondContact CG2-OH 3.36Å; I25-Y53 HydrophobicContact CD1-CE2 4.47Å; I25-Y53 HydrophobicContact CG1-CE1 4.07Å; I25-Y53 HydrophobicContact CG1-CE2 4.05Å; I25-Y53 VanDerWaalsContact CG1-CZ 3.46Å; I25-Y53 WeakPolarHBondContact CG1-OH 3.31Å; I25-P196 HydrophobicContact CG2-CB 4.12Å; I25-G199 VanDerWaalsContact CD1-O 3.3Å; I25-G199 WeakPolarHBondContact CD1-O 3.43Å; I25-L200 HydrophobicContact CB-CD2 4.3Å; I25-L200 HydrophobicContact CG2-CD2 3.82Å; I25-L200 HydrophobicContact CG2-CG 3.85Å; I25-S203 WeakPolarHBondContact CD1-OG 3.24Å
26L96Very high94Very high6 Ų641.5 Ų41.53%0.03118%0.183CC..Hα-helixtrans-64.7-43.7-178-65.9166.9000110.7I22 W23 F29 Y30 L200 I259 T260 V263I22-L26 HydrophobicContact CG2-CD1 3.62Å; I22-L26 HydrophobicContact CG2-CG 4.5Å; I22-L26 WeakPolarHBondContact O-CB 3.47Å; I22-L26 WeakPolarHBondContact O-CD1 3.18Å; I22-L26 VanDerWaalsContact O-CG 3.26Å; I22-L26 WeakPolarHBondContact O-CG 2.9Å; I22-L26 PolarHBondContact O-N 2.93Å; I22-L26 VanDerWaalsContact O-N 3.11Å; W23-L26 PolarHBondContact O-N 2.68Å; L26-F29 PolarHBondContact O-N 2.9Å; L26-Y30 HydrophobicContact CB-CD2 4.25Å; L26-Y30 HydrophobicContact CB-CE2 4.44Å; L26-Y30 HydrophobicContact CD2-CE2 3.96Å; L26-Y30 WeakPolarHBondContact O-CB 3.21Å; L26-Y30 WeakPolarHBondContact O-CD2 3.25Å; L26-Y30 PolarHBondContact O-N 2.83Å; L26-L200 HydrophobicContact CD1-CD2 4.43Å; L26-L200 HydrophobicContact CD2-CD1 4.1Å; L26-L200 HydrophobicContact CD2-CD2 4Å; L26-L200 HydrophobicContact CG-CD2 3.99Å; L26-I259 HydrophobicContact CD1-CB 4.32Å; L26-I259 HydrophobicContact CD1-CG2 3.73Å; L26-T260 HydrophobicContact CD2-CG2 4.45Å; L26-V263 HydrophobicContact CB-CB 4.22Å; L26-V263 HydrophobicContact CB-CG1 4.03Å; L26-V263 HydrophobicContact CB-CG2 4.11Å
27E94.1Very high93.4Very high25 Ų2536.4 Ų36.412%0.11716%0.157CC..Hα-helixtrans-60.2-49.8-179.5-179.3167.6-136.400111.2W23 H24 Y30 Q31 V263 R266W23-E27 PolarHBondContact NE1-OE2 3Å; W23-E27 VanDerWaalsContact O-CB 3.3Å; W23-E27 WeakPolarHBondContact O-CB 3.15Å; W23-E27 PolarHBondContact O-N 2.87Å; H24-E27 IonicContact ND1-OE2 3.67Å; E27-Y30 PolarHBondContact O-N 3.45Å; E27-Q31 HydrophobicContact CG-CG 4.28Å; E27-Q31 VanDerWaalsContact O-CB 3.23Å; E27-Q31 WeakPolarHBondContact O-CB 3.31Å; E27-Q31 WeakPolarHBondContact O-CG 3.46Å; E27-Q31 PolarHBondContact O-N 3.43Å; E27-Q31 PolarHBondContact OE1-NE2 2.86Å; E27-V263 HydrophobicContact CB-CG1 4.42Å; E27-R266 IonicContact OE1-NE 2.77Å; E27-R266 PolarHBondContact OE1-NE 3.03Å; E27-R266 IonicContact OE1-NH2 3.68Å
28K93.3Very high92.9Very high60 Ų6040.7 Ų40.726%0.26118%0.182SC..Hα-helixtrans-62.7-45.8177.8-73.6-175.8176.5-173.40112H24 Q31 R32 Y47 Y53H24-K28 WeakPolarHBondContact O-CB 3.48Å; H24-K28 WeakPolarHBondContact O-CG 3.26Å; H24-K28 PolarHBondContact O-N 3.37Å; K28-Q31 PolarHBondContact O-N 3.38Å; K28-R32 PolarHBondContact O-N 2.67Å; K28-Y47 HydrophobicContact CB-CD2 4.08Å; K28-Y53 HydrophobicContact CD-CD1 4.02Å; K28-Y53 HydrophobicContact CD-CE1 4.27Å
29F93.8Very high92.2Very high61 Ų6144 Ų4427%0.26820%0.197SC..Hα-helixtrans-59.9-49.3179176-104.7000111.9I25 L26 R32 K33 Y47 P196I25-F29 VanDerWaalsContact O-CB 3.28Å; I25-F29 WeakPolarHBondContact O-CB 3.07Å; I25-F29 PolarHBondContact O-N 2.95Å; L26-F29 PolarHBondContact O-N 2.9Å; F29-R32 PolarHBondContact O-N 2.92Å; F29-K33 HydrophobicContact CE1-CD 4.46Å; F29-K33 PolarHBondContact O-N 3Å; F29-Y47 HydrophobicContact CB-CD2 3.97Å; F29-Y47 HydrophobicContact CB-CE2 4.32Å; F29-Y47 HydrophobicContact CB-CG 4.48Å; F29-Y47 HydrophobicContact CD2-CG 4.46Å; F29-P196 HydrophobicContact CD2-CB 4.16Å; F29-P196 HydrophobicContact CD2-CG 3.68Å; F29-P196 HydrophobicContact CE2-CG 3.74Å; F29-P196 HydrophobicContact CG-CB 4.37Å; F29-P196 HydrophobicContact CG-CG 4.2Å; F29-P196 HydrophobicContact CZ-CG 4.31Å
30Y93.4Very high91.6Very high29 Ų2942.7 Ų42.711%0.11419%0.193CC..Hα-helixtrans-75.9-28-178.7-75.6-65.9000113.7L26 E27 K33 S34 T260 V263 M264 T267 V269L26-Y30 HydrophobicContact CB-CD2 4.25Å; L26-Y30 HydrophobicContact CB-CE2 4.44Å; L26-Y30 HydrophobicContact CD2-CE2 3.96Å; L26-Y30 WeakPolarHBondContact O-CB 3.21Å; L26-Y30 WeakPolarHBondContact O-CD2 3.25Å; L26-Y30 PolarHBondContact O-N 2.83Å; E27-Y30 PolarHBondContact O-N 3.45Å; Y30-K33 HydrophobicContact CD1-CD 4.44Å; Y30-K33 PolarHBondContact O-N 3.49Å; Y30-S34 VanDerWaalsContact O-CB 3.26Å; Y30-S34 WeakPolarHBondContact O-CB 3.22Å; Y30-S34 PolarHBondContact O-N 3.03Å; Y30-T260 HydrophobicContact CE2-CG2 4.07Å; Y30-T260 WeakPolarHBondContact OH-CG2 3.46Å; Y30-V263 HydrophobicContact CD2-CB 4.4Å; Y30-V263 HydrophobicContact CD2-CG1 3.7Å; Y30-V263 HydrophobicContact CG-CG1 4.32Å; Y30-M264 HydrophobicContact CD1-CG 4.04Å; Y30-M264 HydrophobicContact CD2-CG 4.21Å; Y30-M264 HydrophobicContact CE1-CG 3.5Å; Y30-M264 HydrophobicContact CE1-SD 4.14Å; Y30-M264 HydrophobicContact CE2-CG 3.71Å; Y30-M264 HydrophobicContact CG-CG 4.37Å; Y30-M264 PolarHBondContact OH-SD 2.8Å; Y30-M264 VanDerWaalsContact OH-SD 3.4Å; Y30-T267 WeakPolarHBondContact CB-OG1 3.49Å; Y30-V269 HydrophobicContact CD1-CB 4.03Å; Y30-V269 HydrophobicContact CD1-CG1 3.86Å; Y30-V269 HydrophobicContact CD1-CG2 4.26Å; Y30-V269 HydrophobicContact CE1-CG1 4.19Å; Y30-V269 WeakPolarHBondContact O-CG2 3.4Å
31Q91.9Very high91Very high83 Ų8345.2 Ų45.239%0.38822%0.22SC..Hα-helixtrans-61.8-46.2169.4-79.3173.8-100110.8E27 K28 K33 S34 Y35 A44 T267E27-Q31 HydrophobicContact CG-CG 4.28Å; E27-Q31 VanDerWaalsContact O-CB 3.23Å; E27-Q31 WeakPolarHBondContact O-CB 3.31Å; E27-Q31 WeakPolarHBondContact O-CG 3.46Å; E27-Q31 PolarHBondContact O-N 3.43Å; E27-Q31 PolarHBondContact OE1-NE2 2.86Å; K28-Q31 PolarHBondContact O-N 3.38Å; Q31-K33 PolarHBondContact O-N 3.16Å; Q31-S34 WeakPolarHBondContact O-CB 3.46Å; Q31-S34 PolarHBondContact O-N 3.08Å; Q31-Y35 PolarHBondContact O-N 3.15Å; Q31-A44 HydrophobicContact CB-CB 4.42Å; Q31-T267 HydrophobicContact CG-CG2 4.13Å
32R90.9Very high90.4Very high63 Ų6351.2 Ų51.224%0.23825%0.248CC..Hα-helixtrans-59-47.8174.5178.557.9-171.6-166.9-1.4111.8K28 F29 S34 Y35 E36 A44K28-R32 PolarHBondContact O-N 2.67Å; F29-R32 PolarHBondContact O-N 2.92Å; R32-S34 VanDerWaalsContact C-N 3.31Å; R32-S34 PolarHBondContact O-N 3.32Å; R32-Y35 WeakPolarHBondContact O-CB 3.44Å; R32-Y35 PolarHBondContact O-N 2.92Å; R32-E36 IonicContact CZ-OE1 3.98Å; R32-E36 IonicContact NE-OE1 3.72Å; R32-E36 PolarHBondContact NE-OE1 2.94Å; R32-E36 IonicContact NH2-OE1 2.82Å; R32-E36 PolarHBondContact NH2-OE1 3.45Å; R32-E36 WeakPolarHBondContact O-CG 3.29Å; R32-E36 PolarHBondContact O-N 3.45Å; R32-A44 HydrophobicContact CB-CB 4.44Å; R32-A44 WeakPolarHBondContact CD-O 3.33Å; R32-A44 PolarHBondContact NH1-O 3.4Å
33K90.2Very high89.8Confident48 Ų4856.1 Ų56.121%0.20928%0.28CS..Hα-helixtrans-61.8-36.4176.3-168.9163.1-175.5166.60113.1F29 Y30 Q31 E36 L37 V269 M277F29-K33 HydrophobicContact CE1-CD 4.46Å; F29-K33 PolarHBondContact O-N 3Å; Y30-K33 HydrophobicContact CD1-CD 4.44Å; Y30-K33 PolarHBondContact O-N 3.49Å; Q31-K33 PolarHBondContact O-N 3.16Å; K33-E36 PolarHBondContact O-N 3.47Å; K33-L37 HydrophobicContact CG-CD1 4Å; K33-L37 HydrophobicContact CG-CG 4.48Å; K33-L37 WeakPolarHBondContact O-CB 3.46Å; K33-L37 WeakPolarHBondContact O-CG 3.39Å; K33-L37 PolarHBondContact O-N 3.09Å; K33-V269 HydrophobicContact CD-CG1 4.02Å; K33-V269 HydrophobicContact CG-CG1 4.1Å; K33-M277 WeakPolarHBondContact CE-SD 3.36Å; K33-M277 PolarHBondContact NZ-SD 3.43Å
34S89.3Confident89.3Confident8 Ų853 Ų536%0.05627%0.271CS..Hα-helixtrans-65.5-41.3176.6-165.50000111.7Y30 Q31 R32 L37 N38 K39 S40 T267Y30-S34 VanDerWaalsContact O-CB 3.26Å; Y30-S34 WeakPolarHBondContact O-CB 3.22Å; Y30-S34 PolarHBondContact O-N 3.03Å; Q31-S34 WeakPolarHBondContact O-CB 3.46Å; Q31-S34 PolarHBondContact O-N 3.08Å; R32-S34 VanDerWaalsContact C-N 3.31Å; R32-S34 PolarHBondContact O-N 3.32Å; S34-L37 PolarHBondContact O-N 3.41Å; S34-N38 PolarHBondContact O-N 3.46Å; S34-K39 PolarHBondContact O-N 3.3Å; S34-K39 WeakPolarHBondContact OG-CB 3.36Å; S34-S40 PolarHBondContact O-N 2.9Å; S34-T267 WeakPolarHBondContact CB-O 3.29Å; S34-T267 PolarHBondContact OG-O 2.98Å
35Y88.9Confident88.9Confident65 Ų6556.7 Ų56.726%0.25530%0.297SS..Hα-helixtrans-63.4-45.1172.1175.9-109.4000111.8Q31 R32 L37 N38 E42 P43 R284Q31-Y35 PolarHBondContact O-N 3.15Å; R32-Y35 WeakPolarHBondContact O-CB 3.44Å; R32-Y35 PolarHBondContact O-N 2.92Å; Y35-L37 VanDerWaalsContact C-N 3.28Å; Y35-L37 PolarHBondContact O-N 3.14Å; Y35-N38 PolarHBondContact O-N 3.37Å; Y35-E42 WeakPolarHBondContact CD2-O 3.45Å; Y35-P43 HydrophobicContact CE2-CB 4.16Å; Y35-R284 PolarHBondContact O-NH2 3.35Å
36E87.1Confident88.6Confident51 Ų5162.9 Ų62.924%0.23833%0.326CS..Hα-helixtrans-61.4-34.6177.7-73.4169.2175.200113.8R32 K33 N38 L281 R284R32-E36 IonicContact CZ-OE1 3.98Å; R32-E36 IonicContact NE-OE1 3.72Å; R32-E36 PolarHBondContact NE-OE1 2.94Å; R32-E36 IonicContact NH2-OE1 2.82Å; R32-E36 PolarHBondContact NH2-OE1 3.45Å; R32-E36 WeakPolarHBondContact O-CG 3.29Å; R32-E36 PolarHBondContact O-N 3.45Å; K33-E36 PolarHBondContact O-N 3.47Å; E36-N38 PolarHBondContact O-N 2.72Å; E36-L281 HydrophobicContact CB-CD2 4.47Å; E36-R284 PolarHBondContact O-NE 3.42Å
37L85.2Confident88.3Confident4 Ų463.2 Ų63.22%0.02133%0.327CS..THydrogen-bonded Turntrans-83.78177.3-66.1172.9000113.7K33 S34 Y35 K39 V269 M272 M277 R280K33-L37 HydrophobicContact CG-CD1 4Å; K33-L37 HydrophobicContact CG-CG 4.48Å; K33-L37 WeakPolarHBondContact O-CB 3.46Å; K33-L37 WeakPolarHBondContact O-CG 3.39Å; K33-L37 PolarHBondContact O-N 3.09Å; S34-L37 PolarHBondContact O-N 3.41Å; Y35-L37 VanDerWaalsContact C-N 3.28Å; Y35-L37 PolarHBondContact O-N 3.14Å; L37-K39 HydrophobicContact CB-CG 4.16Å; L37-K39 PolarHBondContact O-N 3.25Å; L37-V269 HydrophobicContact CD1-CG1 4.29Å; L37-M272 HydrophobicContact CD2-CE 3.9Å; L37-M277 HydrophobicContact CD2-CG 4.46Å; L37-R280 HydrophobicContact CD2-CB 4.05Å; L37-R280 PolarHBondContact O-NH1 2.89Å; L37-R280 VanDerWaalsContact O-NH1 3.15Å
38N84.1Confident88.2Confident123 Ų12364.7 Ų64.766%0.65834%0.338SS*.THydrogen-bonded Turntrans53.432.3-174.5-59.3-34.6000113S34 Y35 E36 R284S34-N38 PolarHBondContact O-N 3.46Å; Y35-N38 PolarHBondContact O-N 3.37Å; E36-N38 PolarHBondContact O-N 2.72Å; N38-R284 PolarHBondContact OD1-NH2 2.83Å
39K83.6Confident88.2Confident69 Ų6961.9 Ų61.930%0.333%0.326SS..SBendtrans-91.7-22.4174.5-65.1-166.2-174.8-1730112.5S34 L37 K268S34-K39 PolarHBondContact O-N 3.3Å; S34-K39 WeakPolarHBondContact OG-CB 3.36Å; L37-K39 HydrophobicContact CB-CG 4.16Å; L37-K39 PolarHBondContact O-N 3.25Å; K39-K268 WeakPolarHBondContact CD-O 3.38Å; K39-K268 WeakPolarHBondContact CE-O 3.45Å; K39-K268 PolarHBondContact NZ-O 2.72Å
40S84.1Confident88Confident34 Ų3460.5 Ų60.524%0.23832%0.319CS..  trans-115.2134.2170-177.50000109.2S34 E42S34-S40 PolarHBondContact O-N 2.9Å; S40-E42 VanDerWaalsContact C-N 3.34Å; S40-E42 PolarHBondContact OG-N 3.36Å; S40-E42 PolarHBondContact OG-O 3.3Å
41S83.3Confident88Confident116 Ų11659.2 Ų59.281%0.81131%0.314SS*.SBendtrans-81-18.7168.750.30000112.3
42E84.1Confident87.9Confident125 Ų12555.4 Ų55.458%0.58430%0.297SS*.SBendtrans-74.9123.7179.1-64.7-178.1175.200109.9Y35 S40 A44Y35-E42 WeakPolarHBondContact CD2-O 3.45Å; S40-E42 VanDerWaalsContact C-N 3.34Å; S40-E42 PolarHBondContact OG-N 3.36Å; S40-E42 PolarHBondContact OG-O 3.3Å; E42-A44 PolarHBondContact O-N 2.91Å
43P84.8Confident87.9Confident104 Ų10452.4 Ų52.468%0.67529%0.285SS*.  trans-63.5126.1175.226.1-32.5000110Y35Y35-P43 HydrophobicContact CE2-CB 4.16Å
44A86.8Confident87.7Confident13 Ų1351.1 Ų51.111%0.10728%0.282CS..  trans-105.5132.9175.600000109.9Q31 R32 E42Q31-A44 HydrophobicContact CB-CB 4.42Å; R32-A44 HydrophobicContact CB-CB 4.44Å; R32-A44 WeakPolarHBondContact CD-O 3.33Å; R32-A44 PolarHBondContact NH1-O 3.4Å; E42-A44 PolarHBondContact O-N 2.91Å
45P87.1Confident87.5Confident103 Ų10354 Ų5467%0.66930%0.296SS*.PPolyproline II helixtrans-61.6156.4177.228.1-34.5000110.6
46E88.9Confident86.9Confident131 Ų13158 Ų5861%0.61232%0.317SS*.PPolyproline II helixtrans-58.6140.7173.1-172.5173.1-170.600110.5T48 H194E46-T48 PolarHBondContact O-N 2.97Å; E46-H194 IonicContact OE1-CE1 3.99Å; E46-H194 IonicContact OE1-ND1 3.75Å
47Y90.2Very high85.6Confident12 Ų1265 Ų655%0.04734%0.341CS..PPolyproline II helixtrans-67131.1176.8175.6-92.9000109.8I25 K28 F29 C49 H194 P196I25-Y47 HydrophobicContact CG2-CE2 4.11Å; I25-Y47 WeakPolarHBondContact CG2-OH 3.36Å; K28-Y47 HydrophobicContact CB-CD2 4.08Å; F29-Y47 HydrophobicContact CB-CD2 3.97Å; F29-Y47 HydrophobicContact CB-CE2 4.32Å; F29-Y47 HydrophobicContact CB-CG 4.48Å; F29-Y47 HydrophobicContact CD2-CG 4.46Å; Y47-C49 PolarHBondContact OH-SG 3.35Å; Y47-H194 WeakPolarHBondContact CD1-O 3.3Å; Y47-H194 PolarHBondContact O-ND1 2.7Å; Y47-P196 HydrophobicContact CD1-CB 4.29Å; Y47-P196 VanDerWaalsContact CE1-CA 3.45Å; Y47-P196 HydrophobicContact CE1-CB 3.64Å; Y47-P196 HydrophobicContact CE1-CG 4.44Å; Y47-P196 HydrophobicContact CE2-CB 4.3Å; Y47-P196 WeakPolarHBondContact OH-CA 3.34Å
48T92Very high84.3Confident56 Ų5673.3 Ų73.334%0.34438%0.377SS..  trans-138.9134167.9-171.30000108.9E46 R50 P193E46-T48 PolarHBondContact O-N 2.97Å; T48-R50 HydrophobicContact CG2-CG 4.2Å; T48-P193 CarbonylContact C-O 3.49Å; T48-P193 VanDerWaalsContact CA-O 3.31Å; T48-P193 WeakPolarHBondContact CA-O 3.4Å
49C91.6Very high82.7Confident2 Ų275 Ų751%0.01438%0.379CS..  trans-59.3137.6171.8-76.70000109.6Y47 Y143 E189 P193 E195Y47-C49 PolarHBondContact OH-SG 3.35Å; C49-Y143 WeakPolarHBondContact CB-OH 3.36Å; C49-Y143 PolarHBondContact O-OH 3.47Å; C49-E189 HydrophobicContact CB-CG 3.57Å; C49-E189 WeakPolarHBondContact CB-OE1 3.46Å; C49-P193 WeakPolarHBondContact CB-O 3.39Å; C49-P193 PolarHBondContact N-O 2.9Å; C49-E195 PolarHBondContact SG-O 3.36Å; C49-E195 VanDerWaalsContact SG-O 3.34Å
50R91.3Very high80.9Confident32 Ų3278.6 Ų78.612%0.12140%0.4CS..  trans-145.5149.1-178-63-63-57.1-68.8-14.7109.7T48 S52 Y53 L139 E142 Y143 R202T48-R50 HydrophobicContact CG2-CG 4.2Å; R50-S52 VanDerWaalsContact CB-O 3.32Å; R50-S52 WeakPolarHBondContact CB-O 3.47Å; R50-Y53 HydrophobicContact CB-CE1 4.22Å; R50-Y53 PolarHBondContact N-OH 3.23Å; R50-Y53 VanDerWaalsContact O-CE2 3.23Å; R50-Y53 WeakPolarHBondContact O-CE2 3.14Å; R50-Y53 VanDerWaalsContact O-CZ 3.27Å; R50-Y53 PolarHBondContact O-OH 2.96Å; R50-L139 VanDerWaalsContact NH2-CG 3.3Å; R50-E142 VanDerWaalsContact CA-OE1 3.22Å; R50-E142 WeakPolarHBondContact CA-OE1 3.5Å; R50-E142 WeakPolarHBondContact CD-OE1 3.23Å; R50-E142 IonicContact CZ-OE1 3.54Å; R50-E142 IonicContact CZ-OE2 3.42Å; R50-E142 IonicContact NE-OE1 3.4Å; R50-E142 PolarHBondContact NE-OE1 3.38Å; R50-E142 IonicContact NE-OE2 3.5Å; R50-E142 PolarHBondContact NE-OE2 3.36Å; R50-E142 IonicContact NH2-OE1 2.8Å; R50-E142 IonicContact NH2-OE2 3.09Å; R50-E142 PolarHBondContact NH2-OE2 3.26Å; R50-Y143 PolarHBondContact N-OH 2.74Å; R50-R202 PolarHBondContact O-NH2 3.38Å
51I91.8Very high79Confident1 Ų182 Ų821%0.00542%0.424CS..SBendtrans-73.4-38.8169.1-63.1-60.3000110.4Y17 E142 Y143 H146Y17-I51 PolarHBondContact OH-O 3.04Å; I51-E142 HydrophobicContact CB-CB 4.25Å; I51-E142 HydrophobicContact CB-CG 3.85Å; I51-E142 HydrophobicContact CG1-CB 4.37Å; I51-E142 HydrophobicContact CG1-CG 3.79Å; I51-E142 PolarHBondContact N-OE1 2.72Å; I51-Y143 HydrophobicContact CD1-CD1 3.85Å; I51-Y143 HydrophobicContact CD1-CE1 3.75Å; I51-Y143 HydrophobicContact CD1-CG 4.46Å; I51-Y143 HydrophobicContact CG1-CD1 4.07Å; I51-Y143 HydrophobicContact CG1-CD2 4.36Å; I51-Y143 HydrophobicContact CG1-CE1 4.1Å; I51-Y143 HydrophobicContact CG1-CE2 4.4Å; I51-Y143 HydrophobicContact CG1-CG 4.18Å; I51-H146 HydrophobicContact CD1-CB 4.36Å; I51-H146 HydrophobicContact CG1-CB 4.24Å; I51-H146 HydrophobicContact CG2-CB 3.98Å
52S91.4Very high77.4Confident4 Ų484.9 Ų84.93%0.02843%0.425CS..  trans-112.7137.9177.4171.40000113.3R50 P54 P77 D79 S80R50-S52 VanDerWaalsContact CB-O 3.32Å; R50-S52 WeakPolarHBondContact CB-O 3.47Å; S52-P54 WeakPolarHBondContact O-CD 3.39Å; S52-P77 WeakPolarHBondContact OG-CB 3.45Å; S52-D79 WeakPolarHBondContact CA-OD2 3.5Å; S52-D79 PolarHBondContact OG-OD1 3.14Å; S52-D79 PolarHBondContact OG-OD2 2.86Å; S52-S80 VanDerWaalsContact CB-OG 3.28Å; S52-S80 WeakPolarHBondContact CB-OG 3.31Å; S52-S80 PolarHBondContact OG-OG 3.5Å
53Y89.3Confident75.9Confident0 Ų082.3 Ų82.30%043%0.432CS..  trans-113.289.8177.2-64.4-83.9000110.3H24 I25 K28 R50 I55 D79H24-Y53 HydrophobicContact CB-CD1 3.67Å; H24-Y53 HydrophobicContact CB-CD2 4.12Å; H24-Y53 HydrophobicContact CB-CE1 4.46Å; H24-Y53 HydrophobicContact CB-CG 3.5Å; H24-Y53 VanDerWaalsContact CB-CG 3.5Å; I25-Y53 HydrophobicContact CD1-CE2 4.47Å; I25-Y53 HydrophobicContact CG1-CE1 4.07Å; I25-Y53 HydrophobicContact CG1-CE2 4.05Å; I25-Y53 VanDerWaalsContact CG1-CZ 3.46Å; I25-Y53 WeakPolarHBondContact CG1-OH 3.31Å; K28-Y53 HydrophobicContact CD-CD1 4.02Å; K28-Y53 HydrophobicContact CD-CE1 4.27Å; R50-Y53 HydrophobicContact CB-CE1 4.22Å; R50-Y53 PolarHBondContact N-OH 3.23Å; R50-Y53 VanDerWaalsContact O-CE2 3.23Å; R50-Y53 WeakPolarHBondContact O-CE2 3.14Å; R50-Y53 VanDerWaalsContact O-CZ 3.27Å; R50-Y53 PolarHBondContact O-OH 2.96Å; Y53-I55 PolarHBondContact O-N 3.39Å; Y53-D79 PolarHBondContact N-OD2 3.15Å
54P87.2Confident74.3Confident20 Ų2083.8 Ų83.813%0.1343%0.434CS..PPolyproline II helixtrans-65136.4178.227.7-35.7000111.5S52 E56 P77 F131S52-P54 WeakPolarHBondContact O-CD 3.39Å; P54-E56 PolarHBondContact O-N 3.04Å; P54-P77 HydrophobicContact CB-CB 4.33Å; P54-F131 HydrophobicContact CB-CD2 4.34Å; P54-F131 HydrophobicContact CB-CE2 3.46Å; P54-F131 VanDerWaalsContact CB-CE2 3.46Å; P54-F131 HydrophobicContact CB-CZ 3.89Å; P54-F131 HydrophobicContact CG-CE2 3.77Å
55I83.9Confident72Confident70 Ų7090 Ų9036%0.35947%0.471SS..EExtended strand (participates in β ladder)trans-78.7119.8172.9-51.6173000107.7W20 Y53 S75 V76 L78W20-I55 HydrophobicContact CH2-CD1 3.55Å; W20-I55 HydrophobicContact CH2-CG1 3.81Å; W20-I55 HydrophobicContact CZ2-CD1 4.1Å; W20-I55 HydrophobicContact CZ2-CG1 3.89Å; Y53-I55 PolarHBondContact O-N 3.39Å; I55-S75 VanDerWaalsContact O-CA 3.26Å; I55-S75 WeakPolarHBondContact O-CA 3.49Å; I55-V76 PolarHBondContact N-O 3.08Å; I55-V76 PolarHBondContact O-N 3.24Å; I55-L78 HydrophobicContact CD1-CB 3.87Å; I55-L78 HydrophobicContact CD1-CD2 3.74Å; I55-L78 HydrophobicContact CD1-CG 4.45Å; I55-L78 HydrophobicContact CG1-CB 4.39Å
56E76.5Confident69.9Low147 Ų14787.5 Ų87.569%0.68746%0.464SS*.EExtended strand (participates in β ladder)trans-81.9120.3169.4-64.2-179.3-170.700109.1P54 K58P54-E56 PolarHBondContact O-N 3.04Å; E56-K58 PolarHBondContact O-N 2.95Å
57R60.7Low67.9Low199 Ų19991.6 Ų91.675%0.75148%0.48SS*.PPolyproline II helixtrans-70.6117.2166.2-73.8-168.5-159.9-177.16.5107.8K59 K74R57-K59 PolarHBondContact O-N 3.46Å; R57-K74 PolarHBondContact N-O 3.24Å
58K57.6Low65.8Low179 Ų17996.7 Ų96.778%0.77852%0.516SS*.PPolyproline II helixtrans-49.9131.5166.8-75.9-168.7172.4-161.90108.4E56 L60E56-K58 PolarHBondContact O-N 2.95Å; K58-L60 PolarHBondContact O-N 3.31Å
59K49.9Very low63.6Low159 Ų159101.7 Ų101.769%0.69153%0.533SS*.  trans-48.9109.3176.3-74.1-176.7178.1-175.20108R57 S61R57-K59 PolarHBondContact O-N 3.46Å; K59-S61 PolarHBondContact O-N 2.9Å
60L46.1Very low61.4Low144 Ų144106.9 Ų106.975%0.75457%0.57SS**  trans-62.7128157.5-166.470.8000105K58 E62K58-L60 PolarHBondContact O-N 3.31Å; L60-E62 PolarHBondContact O-N 2.93Å
61S44.1Very low59.4Low106 Ų106116.9 Ų116.974%0.74161%0.607SS**  trans-41.6130-175.5-138.40000110.6K59 G63K59-S61 PolarHBondContact O-N 2.9Å; S61-G63 VanDerWaalsContact C-N 3.3Å; S61-G63 PolarHBondContact O-N 3.25Å
62E49.5Very low57.6Low175 Ų175124.1 Ų124.182%0.81864%0.639SS**THydrogen-bonded Turntrans-56.595.2173.6-78.4168.3170.200108.4L60L60-E62 PolarHBondContact O-N 2.93Å
63G53.8Low56Low72 Ų72129.3 Ų129.374%0.74266%0.661SS**THydrogen-bonded Turntrans-174.6-21.9-17300000113.6S61S61-G63 VanDerWaalsContact C-N 3.3Å; S61-G63 PolarHBondContact O-N 3.25Å
64D50.4Low55.1Low135 Ų135136.1 Ų136.172%0.72269%0.69SS**SBendtrans-99.9108.5-179.6-134.6-10.9000112.7G66D64-G66 PolarHBondContact O-N 2.92Å; D64-G66 VanDerWaalsContact O-N 3.16Å
65T38.6Very low54.9Low142 Ų142136.5 Ų136.587%0.87169%0.694SS**  trans-41.8103.4173.115.90000114
66G42.5Very low55.1Low51 Ų51135.3 Ų135.353%0.52669%0.69SS.*  trans-159.459.7174.400000113.4D64 C68 F69D64-G66 PolarHBondContact O-N 2.92Å; D64-G66 VanDerWaalsContact O-N 3.16Å; G66-C68 PolarHBondContact O-N 2.99Å; G66-F69 PolarHBondContact O-N 3.32Å
67K48.5Very low55.8Low217 Ų217128.3 Ų128.394%0.94366%0.657SS**THydrogen-bonded Turntrans-56.31179-88.8179.6175.8175.80115.9
68C45.4Very low57.3Low119 Ų119122.4 Ų122.480%0.80464%0.64SS**THydrogen-bonded Turntrans-102.5-14.9-175.5-137.70000115.1G66G66-C68 PolarHBondContact O-N 2.99Å
69F46.4Very low59Low161 Ų161114.3 Ų114.371%0.70661%0.605SS**SBendtrans-107.57.8-175.2-85.3-80000115.5G66 R71 F72G66-F69 PolarHBondContact O-N 3.32Å; F69-R71 PolarHBondContact O-N 3.29Å; F69-F72 HydrophobicContact CD1-CD2 4.26Å; F69-F72 PolarHBondContact O-N 3.19Å
70S45.4Very low61.2Low112 Ų112106.7 Ų106.778%0.78357%0.572SS**THydrogen-bonded Turntrans-71.20.2-174.181.60000115.7
71R48.1Very low63.5Low242 Ų242103.1 Ų103.191%0.91355%0.553SS**THydrogen-bonded Turntrans-89.9-19.3179.6-110.3-175.1-152.9176.47.5114.7F69F69-R71 PolarHBondContact O-N 3.29Å
72F54.2Low65.9Low152 Ų152100.1 Ų100.167%0.66754%0.535SS*.SBendtrans-85.2121.2176.7-71.6-82.8000108.9F69 K74F69-F72 HydrophobicContact CD1-CD2 4.26Å; F69-F72 PolarHBondContact O-N 3.19Å; F72-K74 PolarHBondContact O-N 3.18Å
73K58.6Low68.1Low113 Ų11392.9 Ų92.949%0.49150%0.501SS..  trans-43.9135.5170.4-94.5175.3168.4170.80108.9S75 F131K73-S75 PolarHBondContact O-N 3.46Å; K73-F131 HydrophobicContact CD-CE1 4.49Å; K73-F131 PolarHBondContact NZ-O 3.45Å
74K69Low70.2Confident143 Ų14391.3 Ų91.362%0.62248%0.475SS*.SBendtrans-64.71.1-174.5-68.9-176.7177.4179.20114.6R57 F72R57-K74 PolarHBondContact N-O 3.24Å; F72-K74 PolarHBondContact O-N 3.18Å
75S83.2Confident72.4Confident28 Ų2888 Ų8820%0.19646%0.46CS..EExtended strand (participates in β ladder)trans-130.5141.8-174.947.20000110I55 K73 F131I55-S75 VanDerWaalsContact O-CA 3.26Å; I55-S75 WeakPolarHBondContact O-CA 3.49Å; K73-S75 PolarHBondContact O-N 3.46Å; S75-F131 WeakPolarHBondContact O-CE1 3.36Å; S75-F131 VanDerWaalsContact O-CZ 3.24Å; S75-F131 WeakPolarHBondContact O-CZ 3.38Å; S75-F131 VanDerWaalsContact OG-CZ 3.25Å; S75-F131 WeakPolarHBondContact OG-CZ 3.4Å
76V87.9Confident75.1Confident46 Ų4682.9 Ų82.928%0.27943%0.429SS..EExtended strand (participates in β ladder)trans-127.2126.1179.8179.80000109.4I55 L78I55-V76 PolarHBondContact N-O 3.08Å; I55-V76 PolarHBondContact O-N 3.24Å; V76-L78 PolarHBondContact O-N 2.98Å
77P91.8Very high77.6Confident0 Ų080.9 Ų80.90%041%0.407CS..  trans-78.177.8173.534.4-33.7000108.8S52 P54 D79 S80 L81 L128 F131S52-P77 WeakPolarHBondContact OG-CB 3.45Å; P54-P77 HydrophobicContact CB-CB 4.33Å; P77-D79 PolarHBondContact O-N 3.22Å; P77-S80 PolarHBondContact O-N 3.11Å; P77-L81 PolarHBondContact O-N 3.18Å; P77-L128 HydrophobicContact CG-CD2 3.6Å; P77-F131 HydrophobicContact CB-CD2 4.36Å; P77-F131 HydrophobicContact CB-CG 4.38Å; P77-F131 VanDerWaalsContact CD-CE1 3.45Å; P77-F131 HydrophobicContact CG-CB 4.18Å; P77-F131 HydrophobicContact CG-CD1 3.76Å; P77-F131 HydrophobicContact CG-CD2 4.2Å; P77-F131 HydrophobicContact CG-CE1 4.16Å; P77-F131 HydrophobicContact CG-CG 3.76Å; P77-F131 HydrophobicContact CG-CZ 4.48Å
78L92.6Very high79.9Confident75 Ų7574.8 Ų74.839%0.39338%0.384SS..Hα-helixtrans-59.3-33.5-173.4-177.364000111.7W20 I55 V76 A82W20-L78 HydrophobicContact CH2-CB 4.29Å; W20-L78 HydrophobicContact CH2-CD2 3.84Å; W20-L78 HydrophobicContact CZ2-CB 4.25Å; W20-L78 HydrophobicContact CZ3-CD2 4.2Å; I55-L78 HydrophobicContact CD1-CB 3.87Å; I55-L78 HydrophobicContact CD1-CD2 3.74Å; I55-L78 HydrophobicContact CD1-CG 4.45Å; I55-L78 HydrophobicContact CG1-CB 4.39Å; V76-L78 PolarHBondContact O-N 2.98Å; L78-A82 WeakPolarHBondContact O-CB 3.49Å; L78-A82 PolarHBondContact O-N 2.98Å
79D93.4Very high82.2Confident8 Ų874.4 Ų74.44%0.04337%0.373CS..Hα-helixtrans-67.1-47176.451.6-7.7000113.2Y17 W20 S52 Y53 P77 L81 A82 K83Y17-D79 HydrophobicContact CD2-CB 4.5Å; Y17-D79 HydrophobicContact CE2-CB 4.03Å; W20-D79 PolarHBondContact NE1-OD2 3.22Å; S52-D79 WeakPolarHBondContact CA-OD2 3.5Å; S52-D79 PolarHBondContact OG-OD1 3.14Å; S52-D79 PolarHBondContact OG-OD2 2.86Å; Y53-D79 PolarHBondContact N-OD2 3.15Å; P77-D79 PolarHBondContact O-N 3.22Å; D79-L81 VanDerWaalsContact C-N 3.31Å; D79-L81 PolarHBondContact O-N 3.04Å; D79-A82 PolarHBondContact O-N 3.06Å; D79-K83 VanDerWaalsContact O-CB 3.24Å; D79-K83 WeakPolarHBondContact O-CB 3.45Å; D79-K83 PolarHBondContact O-N 3.38Å
80S95Very high84.4Confident0 Ų067.1 Ų67.10%034%0.343CS..Hα-helixtrans-65-37.2174.6-56.90000111.7S52 P77 L84 E127S52-S80 VanDerWaalsContact CB-OG 3.28Å; S52-S80 WeakPolarHBondContact CB-OG 3.31Å; S52-S80 PolarHBondContact OG-OG 3.5Å; P77-S80 PolarHBondContact O-N 3.11Å; S80-L84 PolarHBondContact O-N 3.35Å; S80-E127 WeakPolarHBondContact CB-OE2 3.39Å; S80-E127 WeakPolarHBondContact OG-CB 3.43Å; S80-E127 PolarHBondContact OG-OE2 3.47Å
81L95.1Very high86.7Confident69 Ų6963.9 Ų63.936%0.36132%0.317SS..Hα-helixtrans-64.6-47.7173.6-178.761.7000111.8P77 D79 K83 L84 V85 L128P77-L81 PolarHBondContact O-N 3.18Å; D79-L81 VanDerWaalsContact C-N 3.31Å; D79-L81 PolarHBondContact O-N 3.04Å; L81-K83 VanDerWaalsContact C-N 3.35Å; L81-L84 PolarHBondContact O-N 2.89Å; L81-V85 HydrophobicContact CD1-CG2 4.14Å; L81-V85 HydrophobicContact CG-CG2 4.48Å; L81-V85 WeakPolarHBondContact O-CG2 3.39Å; L81-V85 PolarHBondContact O-N 2.8Å; L81-L128 HydrophobicContact CB-CD2 4.27Å; L81-L128 HydrophobicContact CD1-CD1 4.41Å
82A95.1Very high88.9Confident43 Ų4355.8 Ų55.836%0.35529%0.294SS..Hα-helixtrans-61.6-4417700000110.9L78 D79 L84 V85 C86L78-A82 WeakPolarHBondContact O-CB 3.49Å; L78-A82 PolarHBondContact O-N 2.98Å; D79-A82 PolarHBondContact O-N 3.06Å; A82-L84 PolarHBondContact O-N 3.49Å; A82-V85 PolarHBondContact O-N 3.4Å; A82-C86 WeakPolarHBondContact O-CB 3.4Å; A82-C86 PolarHBondContact O-N 3.4Å; A82-C86 PolarHBondContact O-SG 3.03Å
83K95.8Very high90.6Very high22 Ų2250.1 Ų50.110%0.09628%0.279CS..Hα-helixtrans-53.7-51.8174.4-174-173.6-57.5176.20111Y17 D79 L81 C87 F120 E127 H146Y17-K83 PolarHBondContact OH-NZ 3.19Å; D79-K83 VanDerWaalsContact O-CB 3.24Å; D79-K83 WeakPolarHBondContact O-CB 3.45Å; D79-K83 PolarHBondContact O-N 3.38Å; L81-K83 VanDerWaalsContact C-N 3.35Å; K83-C87 WeakPolarHBondContact O-CB 3.23Å; K83-C87 PolarHBondContact O-N 2.72Å; K83-C87 PolarHBondContact O-SG 3.04Å; K83-F120 WeakPolarHBondContact CD-O 3.02Å; K83-E127 VanDerWaalsContact NZ-CD 3.29Å; K83-E127 IonicContact NZ-OE1 2.91Å; K83-E127 PolarHBondContact NZ-OE1 3.4Å; K83-E127 IonicContact NZ-OE2 3.16Å; K83-E127 PolarHBondContact NZ-OE2 3.02Å; K83-H146 PolarHBondContact NZ-ND1 3.46Å
84L97Very high92.2Very high39 Ų3945.9 Ų45.920%0.20426%0.261CS..Hα-helixtrans-60.9-51.8178.4176.458.7000112S80 L81 A82 C87 I88 G121 A125 L128S80-L84 PolarHBondContact O-N 3.35Å; L81-L84 PolarHBondContact O-N 2.89Å; A82-L84 PolarHBondContact O-N 3.49Å; L84-C87 PolarHBondContact O-N 3.35Å; L84-I88 HydrophobicContact CD1-CD1 3.8Å; L84-I88 HydrophobicContact CD1-CG1 4.16Å; L84-I88 HydrophobicContact CG-CD1 3.92Å; L84-I88 WeakPolarHBondContact O-CG1 3.2Å; L84-I88 PolarHBondContact O-N 3.11Å; L84-G121 WeakPolarHBondContact CD1-O 3.36Å; L84-A125 HydrophobicContact CD1-CB 4.08Å; L84-A125 HydrophobicContact CD2-CB 4.27Å; L84-L128 HydrophobicContact CB-CD1 4.24Å; L84-L128 HydrophobicContact CD2-CD1 3.61Å
85V96.4Very high93.3Very high67 Ų6741.8 Ų41.841%0.40625%0.248SC..Hα-helixtrans-62.7-46.6-177171.90000111.4L81 A82 C87 I88 I89L81-V85 HydrophobicContact CD1-CG2 4.14Å; L81-V85 HydrophobicContact CG-CG2 4.48Å; L81-V85 WeakPolarHBondContact O-CG2 3.39Å; L81-V85 PolarHBondContact O-N 2.8Å; A82-V85 PolarHBondContact O-N 3.4Å; V85-C87 VanDerWaalsContact C-N 3.31Å; V85-C87 PolarHBondContact O-N 3.26Å; V85-I88 PolarHBondContact O-N 3.21Å; V85-I89 HydrophobicContact CG1-CD1 3.98Å; V85-I89 WeakPolarHBondContact O-CG1 3.47Å; V85-I89 PolarHBondContact O-N 2.77Å
86C95.1Very high93.6Very high33 Ų3346.3 Ų46.322%0.22327%0.268CS..Hα-helixtrans-61.3-39.9177.4-710000111.8F13 A82 I89 G90F13-C86 HydrophobicContact CD1-CB 4.33Å; F13-C86 HydrophobicContact CE1-CB 3.93Å; F13-C86 VanDerWaalsContact CE1-SG 3.53Å; F13-C86 HydrophobicContact CE2-CB 4.16Å; F13-C86 HydrophobicContact CZ-CB 3.83Å; A82-C86 WeakPolarHBondContact O-CB 3.4Å; A82-C86 PolarHBondContact O-N 3.4Å; A82-C86 PolarHBondContact O-SG 3.03Å; C86-I89 PolarHBondContact O-N 3.4Å; C86-G90 PolarHBondContact O-N 3.25Å
87C96.3Very high93.6Very high10 Ų1048.1 Ų48.17%0.06828%0.279CS..Hα-helixtrans-67.2-40176.5-70.80000112.4K83 L84 V85 I89 G90 I91 F117 G121K83-C87 WeakPolarHBondContact O-CB 3.23Å; K83-C87 PolarHBondContact O-N 2.72Å; K83-C87 PolarHBondContact O-SG 3.04Å; L84-C87 PolarHBondContact O-N 3.35Å; V85-C87 VanDerWaalsContact C-N 3.31Å; V85-C87 PolarHBondContact O-N 3.26Å; C87-I89 VanDerWaalsContact C-N 3.32Å; C87-I89 PolarHBondContact O-N 3.33Å; C87-G90 PolarHBondContact O-N 2.89Å; C87-I91 WeakPolarHBondContact O-CB 3.29Å; C87-I91 WeakPolarHBondContact O-CD1 3.43Å; C87-I91 WeakPolarHBondContact O-CG1 3.46Å; C87-I91 PolarHBondContact O-N 3.37Å; C87-F117 HydrophobicContact CB-CB 4.29Å; C87-F117 VanDerWaalsContact CB-O 3.26Å; C87-F117 WeakPolarHBondContact CB-O 3.49Å; C87-F117 PolarHBondContact SG-O 3.24Å; C87-F117 VanDerWaalsContact SG-O 3.4Å; C87-G121 PolarHBondContact SG-N 3.15Å; C87-G121 VanDerWaalsContact SG-N 3.42Å
88I96.5Very high93.5Very high89 Ų8948.1 Ų48.146%0.45628%0.279SS..Hα-helixtrans-60.8-43.7174.7-69.1166.8000110.7L84 V85 T92L84-I88 HydrophobicContact CD1-CD1 3.8Å; L84-I88 HydrophobicContact CD1-CG1 4.16Å; L84-I88 HydrophobicContact CG-CD1 3.92Å; L84-I88 WeakPolarHBondContact O-CG1 3.2Å; L84-I88 PolarHBondContact O-N 3.11Å; V85-I88 PolarHBondContact O-N 3.21Å; I88-T92 WeakPolarHBondContact O-CB 3.22Å; I88-T92 PolarHBondContact O-N 3.06Å; I88-T92 PolarHBondContact O-OG1 3.48Å
89I94.3Very high93.3Very high111 Ų11148.1 Ų48.157%0.56928%0.276SS*.Hα-helixtrans-62.3-44.9175.4-66.1166.6000110.3V85 C86 C87 T92 G93V85-I89 HydrophobicContact CG1-CD1 3.98Å; V85-I89 WeakPolarHBondContact O-CG1 3.47Å; V85-I89 PolarHBondContact O-N 2.77Å; C86-I89 PolarHBondContact O-N 3.4Å; C87-I89 VanDerWaalsContact C-N 3.32Å; C87-I89 PolarHBondContact O-N 3.33Å; I89-T92 PolarHBondContact O-N 3.49Å; I89-G93 PolarHBondContact O-N 3.33Å
90G92.5Very high93Very high8 Ų849.5 Ų49.58%0.08229%0.287CS..Hα-helixtrans-58.3-52.1176.700000112.4C86 C87 T92 G93 E94C86-G90 PolarHBondContact O-N 3.25Å; C87-G90 PolarHBondContact O-N 2.89Å; G90-T92 VanDerWaalsContact C-N 3.31Å; G90-T92 PolarHBondContact O-N 3.22Å; G90-G93 PolarHBondContact O-N 2.72Å; G90-E94 VanDerWaalsContact O-CG 3.31Å; G90-E94 WeakPolarHBondContact O-CG 3.38Å; G90-E94 PolarHBondContact O-N 3.47Å
91I93.9Very high92.5Very high44 Ų4459.4 Ų59.423%0.22633%0.33CS..Hα-helixtrans-55.8-47.5175.8-67.1161.3000110.3C87 G93 E94 V95 F117 S118C87-I91 WeakPolarHBondContact O-CB 3.29Å; C87-I91 WeakPolarHBondContact O-CD1 3.43Å; C87-I91 WeakPolarHBondContact O-CG1 3.46Å; C87-I91 PolarHBondContact O-N 3.37Å; I91-G93 VanDerWaalsContact C-N 3.34Å; I91-G93 PolarHBondContact O-N 2.94Å; I91-E94 PolarHBondContact O-N 3.22Å; I91-V95 HydrophobicContact CG2-CG2 4.22Å; I91-V95 WeakPolarHBondContact O-CB 3.48Å; I91-V95 VanDerWaalsContact O-CG2 3.27Å; I91-V95 WeakPolarHBondContact O-CG2 3.44Å; I91-V95 PolarHBondContact O-N 3.4Å; I91-F117 HydrophobicContact CD1-CB 4.29Å; I91-F117 HydrophobicContact CG1-CB 3.61Å; I91-S118 WeakPolarHBondContact CD1-OG 3.39Å
92T93.2Very high92.1Very high71 Ų7162.4 Ų62.444%0.43635%0.346SS..Hα-helixtrans-60.2-45179.7-55.40000111I88 I89 G90 V95 I96I88-T92 WeakPolarHBondContact O-CB 3.22Å; I88-T92 PolarHBondContact O-N 3.06Å; I88-T92 PolarHBondContact O-OG1 3.48Å; I89-T92 PolarHBondContact O-N 3.49Å; G90-T92 VanDerWaalsContact C-N 3.31Å; G90-T92 PolarHBondContact O-N 3.22Å; T92-V95 PolarHBondContact O-N 3.05Å; T92-I96 HydrophobicContact CG2-CD1 3.75Å; T92-I96 HydrophobicContact CG2-CG1 4.48Å; T92-I96 WeakPolarHBondContact O-CB 3.34Å; T92-I96 VanDerWaalsContact O-CG1 3.25Å; T92-I96 WeakPolarHBondContact O-CG1 3.43Å; T92-I96 PolarHBondContact O-N 3.03Å
93G91Very high91.6Very high34 Ų3469.5 Ų69.535%0.35136%0.364SS..Hα-helixtrans-63.4-42.4176.300000113.2I89 G90 I91 T97I89-G93 PolarHBondContact O-N 3.33Å; G90-G93 PolarHBondContact O-N 2.72Å; I91-G93 VanDerWaalsContact C-N 3.34Å; I91-G93 PolarHBondContact O-N 2.94Å; G93-T97 WeakPolarHBondContact O-CB 3.22Å; G93-T97 WeakPolarHBondContact O-CG2 3.23Å; G93-T97 PolarHBondContact O-N 3.15Å; G93-T97 PolarHBondContact O-OG1 2.99Å
94E91.3Very high91.1Very high24 Ų2473.5 Ų73.511%0.11239%0.385CS..Hα-helixtrans-68.3-37.8178.1-67.1-63.816800112.2G90 I91 G98 N110 H113 F117G90-E94 VanDerWaalsContact O-CG 3.31Å; G90-E94 WeakPolarHBondContact O-CG 3.38Å; G90-E94 PolarHBondContact O-N 3.47Å; I91-E94 PolarHBondContact O-N 3.22Å; E94-G98 WeakPolarHBondContact O-CA 3.32Å; E94-G98 PolarHBondContact O-N 3.38Å; E94-N110 VanDerWaalsContact OE2-CA 3.29Å; E94-N110 WeakPolarHBondContact OE2-CA 3.41Å; E94-N110 WeakPolarHBondContact OE2-CB 3.34Å; E94-N110 PolarHBondContact OE2-ND2 3.3Å; E94-H113 HydrophobicContact CG-CB 3.69Å; E94-H113 WeakPolarHBondContact OE1-CB 3.32Å; E94-H113 IonicContact OE1-CE1 3.47Å; E94-H113 IonicContact OE1-CG 3.57Å; E94-H113 IonicContact OE1-ND1 3.61Å; E94-H113 PolarHBondContact OE1-ND1 2.9Å; E94-F117 HydrophobicContact CG-CD2 3.97Å; E94-F117 HydrophobicContact CG-CE2 3.74Å
95V91.3Very high90.7Very high57 Ų5775.7 Ų75.735%0.34539%0.393SS..Hα-helixtrans-67.7-47.6175171.80000110.5I91 T92 T97 G98 F99I91-V95 HydrophobicContact CG2-CG2 4.22Å; I91-V95 WeakPolarHBondContact O-CB 3.48Å; I91-V95 VanDerWaalsContact O-CG2 3.27Å; I91-V95 WeakPolarHBondContact O-CG2 3.44Å; I91-V95 PolarHBondContact O-N 3.4Å; T92-V95 PolarHBondContact O-N 3.05Å; V95-T97 VanDerWaalsContact C-N 3.28Å; V95-T97 PolarHBondContact O-N 3.36Å; V95-G98 PolarHBondContact O-N 3.45Å; V95-F99 HydrophobicContact CG1-CD2 4.33Å; V95-F99 HydrophobicContact CG1-CE2 4.27Å; V95-F99 VanDerWaalsContact O-CD2 3.25Å; V95-F99 WeakPolarHBondContact O-CD2 3.28Å
96I89.5Confident90.1Very high123 Ų12376 Ų7663%0.63140%0.396SS*.Hα-helixtrans-62-37.8-179.8-69.6169.3000111.5T92T92-I96 HydrophobicContact CG2-CD1 3.75Å; T92-I96 HydrophobicContact CG2-CG1 4.48Å; T92-I96 WeakPolarHBondContact O-CB 3.34Å; T92-I96 VanDerWaalsContact O-CG1 3.25Å; T92-I96 WeakPolarHBondContact O-CG1 3.43Å; T92-I96 PolarHBondContact O-N 3.03Å
97T89.2Confident89.4Confident83 Ų8380.9 Ų80.951%0.50941%0.41SS..Hα-helixtrans-90.3-16.2-177.6590000114.4G93 V95 N110G93-T97 WeakPolarHBondContact O-CB 3.22Å; G93-T97 WeakPolarHBondContact O-CG2 3.23Å; G93-T97 PolarHBondContact O-N 3.15Å; G93-T97 PolarHBondContact O-OG1 2.99Å; V95-T97 VanDerWaalsContact C-N 3.28Å; V95-T97 PolarHBondContact O-N 3.36Å; T97-N110 PolarHBondContact OG1-ND2 3.08Å
98G88.5Confident89Confident0 Ų086.1 Ų86.10%044%0.436CS..Hα-helixtrans-81.9-17.5179.700000114.5E94 V95 V106E94-G98 WeakPolarHBondContact O-CA 3.32Å; E94-G98 PolarHBondContact O-N 3.38Å; V95-G98 PolarHBondContact O-N 3.45Å; G98-V106 PolarHBondContact O-N 3.48Å
99F89.7Confident88.5Confident75 Ų7582.2 Ų82.233%0.32942%0.418SS..BIsolated β-bridgetrans-104.2140.3-179.5-75-99.8000111.5V95 W103 I104 F105V95-F99 HydrophobicContact CG1-CD2 4.33Å; V95-F99 HydrophobicContact CG1-CE2 4.27Å; V95-F99 VanDerWaalsContact O-CD2 3.25Å; V95-F99 WeakPolarHBondContact O-CD2 3.28Å; F99-W103 HydrophobicContact CB-CE3 4.34Å; F99-W103 AromaticContact CD1-CE3 4Å; F99-W103 HydrophobicContact CD1-CE3 4Å; F99-W103 WeakPolarHBondContact CD1-O 3.2Å; F99-W103 HydrophobicContact CG-CE3 4.17Å; F99-I104 WeakPolarHBondContact CA-O 3.39Å; F99-F105 HydrophobicContact CD1-CB 4.39Å; F99-F105 HydrophobicContact CD2-CD2 4.41Å; F99-F105 HydrophobicContact CE1-CB 4.06Å; F99-F105 HydrophobicContact CE2-CD2 4.08Å; F99-F105 HydrophobicContact CZ-CB 4.28Å; F99-F105 HydrophobicContact CZ-CD2 4.28Å
100S85.9Confident88.2Confident38 Ų3877.3 Ų77.327%0.26639%0.393SS..  trans-68.8172.4168.973.90000111D102 W103 I104S100-D102 PolarHBondContact O-N 3.25Å; S100-D102 VanDerWaalsContact O-N 3.13Å; S100-D102 PolarHBondContact OG-N 2.95Å; S100-W103 PolarHBondContact O-N 3.24Å; S100-I104 PolarHBondContact N-O 2.99Å; S100-I104 PolarHBondContact OG-N 3.24Å
101K85Confident88.1Confident207 Ų20778.3 Ų78.390%0.940%0.401SS*.THydrogen-bonded Turntrans-57.1-25.4172.6-69.4-176.3178.7179.30113.1W103K101-W103 VanDerWaalsContact C-N 3.31Å
102D87.2Confident87.9Confident132 Ų13278.2 Ų78.271%0.70640%0.399SS*.THydrogen-bonded Turntrans-92.214179.4-52.3-47.6000112.7S100 I104S100-D102 PolarHBondContact O-N 3.25Å; S100-D102 VanDerWaalsContact O-N 3.13Å; S100-D102 PolarHBondContact OG-N 2.95Å; D102-I104 HydrophobicContact CB-CD1 4.4Å; D102-I104 HydrophobicContact CB-CG1 4.35Å; D102-I104 PolarHBondContact O-N 2.99Å
103W83.3Confident87.7Confident192 Ų19276.5 Ų76.573%0.72739%0.386SS*.SBendtrans57.230.9-176.8-6992.1000114.3F99 S100 K101F99-W103 HydrophobicContact CB-CE3 4.34Å; F99-W103 AromaticContact CD1-CE3 4Å; F99-W103 HydrophobicContact CD1-CE3 4Å; F99-W103 WeakPolarHBondContact CD1-O 3.2Å; F99-W103 HydrophobicContact CG-CE3 4.17Å; S100-W103 PolarHBondContact O-N 3.24Å; K101-W103 VanDerWaalsContact C-N 3.31Å
104I86.2Confident87.8Confident107 Ų10776 Ų7655%0.54938%0.377SS..  trans-92.1127.8169.8-57.5176.7000107.8F99 S100 D102 V106F99-I104 WeakPolarHBondContact CA-O 3.39Å; S100-I104 PolarHBondContact N-O 2.99Å; S100-I104 PolarHBondContact OG-N 3.24Å; D102-I104 HydrophobicContact CB-CD1 4.4Å; D102-I104 HydrophobicContact CB-CG1 4.35Å; D102-I104 PolarHBondContact O-N 2.99Å; I104-V106 VanDerWaalsContact O-CG2 3.3Å; I104-V106 WeakPolarHBondContact O-CG2 3Å; I104-V106 PolarHBondContact O-N 3.49Å
105F87.5Confident88Confident84 Ų8478.1 Ų78.137%0.36839%0.392SS..BIsolated β-bridgetrans-68.5119.1173.8179.8-103.6000109.9F99 Y107 I108 A111F99-F105 HydrophobicContact CD1-CB 4.39Å; F99-F105 HydrophobicContact CD2-CD2 4.41Å; F99-F105 HydrophobicContact CE1-CB 4.06Å; F99-F105 HydrophobicContact CE2-CD2 4.08Å; F99-F105 HydrophobicContact CZ-CB 4.28Å; F99-F105 HydrophobicContact CZ-CD2 4.28Å; F105-Y107 WeakPolarHBondContact CE2-O 3.43Å; F105-Y107 VanDerWaalsContact CZ-C 3.41Å; F105-Y107 WeakPolarHBondContact CZ-O 3.28Å; F105-I108 HydrophobicContact CE1-CD1 4.39Å; F105-A111 HydrophobicContact CE1-CB 4.29Å; F105-A111 HydrophobicContact CE2-CB 3.85Å; F105-A111 HydrophobicContact CZ-CB 3.36Å
106V83.9Confident88Confident75 Ų7576.5 Ų76.546%0.45538%0.381SS..  trans-107.2-30.6-172.1-175.20000112.4G98 I104G98-V106 PolarHBondContact O-N 3.48Å; I104-V106 VanDerWaalsContact O-CG2 3.3Å; I104-V106 WeakPolarHBondContact O-CG2 3Å; I104-V106 PolarHBondContact O-N 3.49Å
107Y82.3Confident88.3Confident135 Ų13571.7 Ų71.753%0.52936%0.356SS..  trans-124.898.2-164.2-62.2-67.2000112.2F105 G109 N110F105-Y107 WeakPolarHBondContact CE2-O 3.43Å; F105-Y107 VanDerWaalsContact CZ-C 3.41Å; F105-Y107 WeakPolarHBondContact CZ-O 3.28Å; Y107-G109 PolarHBondContact O-N 3.28Å; Y107-N110 WeakPolarHBondContact CB-OD1 3.4Å; Y107-N110 WeakPolarHBondContact O-CB 3.22Å; Y107-N110 PolarHBondContact O-N 2.88Å
108I86.6Confident88.6Confident119 Ų11970.2 Ų70.261%0.6135%0.348SS*.Hα-helixtrans-50.5-35.3178.6-173.557.2000113.3F105 N110 A111 Q112F105-I108 HydrophobicContact CE1-CD1 4.39Å; I108-N110 VanDerWaalsContact C-N 3.33Å; I108-N110 PolarHBondContact O-N 2.91Å; I108-A111 WeakPolarHBondContact O-CB 3.24Å; I108-A111 PolarHBondContact O-N 3.43Å; I108-A111 VanDerWaalsContact O-N 3.11Å; I108-Q112 PolarHBondContact O-N 3.08Å
109G85.3Confident89Confident8 Ų872.6 Ų72.68%0.08236%0.361CS..Hα-helixtrans-60.5-40.2177.500000113M1 Y107 A111 Q112 H113M1-G109 VanDerWaalsContact CE-CA 3.47Å; M1-G109 WeakPolarHBondContact CE-O 3.48Å; M1-G109 WeakPolarHBondContact SD-CA 3.4Å; Y107-G109 PolarHBondContact O-N 3.28Å; G109-A111 PolarHBondContact O-N 3.28Å; G109-Q112 WeakPolarHBondContact O-CB 3.21Å; G109-Q112 PolarHBondContact O-N 3.08Å; G109-H113 PolarHBondContact O-N 3.37Å
110N88.7Confident89.4Confident7 Ų770.2 Ų70.24%0.03735%0.35CS..Hα-helixtrans-60.7-35.8176-68.782.1000111.6E94 T97 Y107 I108 S114E94-N110 VanDerWaalsContact OE2-CA 3.29Å; E94-N110 WeakPolarHBondContact OE2-CA 3.41Å; E94-N110 WeakPolarHBondContact OE2-CB 3.34Å; E94-N110 PolarHBondContact OE2-ND2 3.3Å; T97-N110 PolarHBondContact OG1-ND2 3.08Å; Y107-N110 WeakPolarHBondContact CB-OD1 3.4Å; Y107-N110 WeakPolarHBondContact O-CB 3.22Å; Y107-N110 PolarHBondContact O-N 2.88Å; I108-N110 VanDerWaalsContact C-N 3.33Å; I108-N110 PolarHBondContact O-N 2.91Å; N110-S114 VanDerWaalsContact O-CB 3.23Å; N110-S114 WeakPolarHBondContact O-CB 3.2Å; N110-S114 PolarHBondContact O-N 3.23Å
111A90Very high89.9Confident30 Ų3068.7 Ų68.725%0.24834%0.34CS..Hα-helixtrans-68-38.6172.200000112.7F105 I108 G109 S114 T115F105-A111 HydrophobicContact CE1-CB 4.29Å; F105-A111 HydrophobicContact CE2-CB 3.85Å; F105-A111 HydrophobicContact CZ-CB 3.36Å; I108-A111 WeakPolarHBondContact O-CB 3.24Å; I108-A111 PolarHBondContact O-N 3.43Å; I108-A111 VanDerWaalsContact O-N 3.11Å; G109-A111 PolarHBondContact O-N 3.28Å; A111-S114 PolarHBondContact O-N 3.16Å; A111-T115 WeakPolarHBondContact O-CB 3.49Å; A111-T115 PolarHBondContact O-N 3.01Å; A111-T115 PolarHBondContact O-OG1 3.48Å
112Q90.9Very high90.5Very high41 Ų4163.8 Ų63.819%0.19232%0.324CS..Hα-helixtrans-60.6-46.8174.9-68.1-179.6-33.600111.2I108 G109 T115 M116 L156 H160I108-Q112 PolarHBondContact O-N 3.08Å; G109-Q112 WeakPolarHBondContact O-CB 3.21Å; G109-Q112 PolarHBondContact O-N 3.08Å; Q112-T115 WeakPolarHBondContact O-CB 3.3Å; Q112-T115 PolarHBondContact O-N 3.33Å; Q112-M116 PolarHBondContact O-N 3Å; Q112-L156 HydrophobicContact CB-CD2 4.08Å; Q112-L156 HydrophobicContact CG-CD2 4.08Å; Q112-L156 WeakPolarHBondContact O-CD1 3.32Å; Q112-H160 PolarHBondContact OE1-ND1 2.73Å
113H89.4Confident90.9Very high36 Ų3657.6 Ų57.617%0.16729%0.291CS..Hα-helixtrans-64.2-44.9174.9-79.7-164.7000112.8M1 E94 G109 T115 M116 F117M1-H113 HydrophobicContact CE-CB 4.16Å; M1-H113 WeakPolarHBondContact CE-CD2 3.1Å; M1-H113 WeakPolarHBondContact CE-CE1 3.33Å; M1-H113 WeakPolarHBondContact CE-ND1 3.45Å; M1-H113 WeakPolarHBondContact CE-NE2 3.44Å; E94-H113 HydrophobicContact CG-CB 3.69Å; E94-H113 WeakPolarHBondContact OE1-CB 3.32Å; E94-H113 IonicContact OE1-CE1 3.47Å; E94-H113 IonicContact OE1-CG 3.57Å; E94-H113 IonicContact OE1-ND1 3.61Å; E94-H113 PolarHBondContact OE1-ND1 2.9Å; G109-H113 PolarHBondContact O-N 3.37Å; H113-T115 PolarHBondContact O-N 2.93Å; H113-M116 WeakPolarHBondContact O-CB 3.39Å; H113-M116 PolarHBondContact O-N 3.21Å; H113-M116 VanDerWaalsContact O-N 3.13Å; H113-F117 HydrophobicContact CB-CD2 4.46Å; H113-F117 HydrophobicContact CB-CE2 4.23Å; H113-F117 WeakPolarHBondContact O-CD2 3.17Å; H113-F117 PolarHBondContact O-N 2.75Å
114S92.8Very high91.5Very high22 Ų2248.5 Ų48.515%0.15426%0.256CS..Hα-helixtrans-57.8-40.1175.7-172.30000111.3N110 A111 S118N110-S114 VanDerWaalsContact O-CB 3.23Å; N110-S114 WeakPolarHBondContact O-CB 3.2Å; N110-S114 PolarHBondContact O-N 3.23Å; A111-S114 PolarHBondContact O-N 3.16Å; S114-S118 VanDerWaalsContact O-CB 3.31Å; S114-S118 WeakPolarHBondContact O-CB 3.26Å; S114-S118 PolarHBondContact O-N 3.28Å; S114-S118 PolarHBondContact O-OG 2.66Å
115T94Very high92Very high69 Ų6944.7 Ų44.742%0.42324%0.241SC..Hα-helixtrans-63.7-46.6174.6-56.80000111.3A111 Q112 H113 S118 L119 L156A111-T115 WeakPolarHBondContact O-CB 3.49Å; A111-T115 PolarHBondContact O-N 3.01Å; A111-T115 PolarHBondContact O-OG1 3.48Å; Q112-T115 WeakPolarHBondContact O-CB 3.3Å; Q112-T115 PolarHBondContact O-N 3.33Å; H113-T115 PolarHBondContact O-N 2.93Å; T115-S118 WeakPolarHBondContact O-CB 3.43Å; T115-S118 PolarHBondContact O-N 3.3Å; T115-S118 VanDerWaalsContact O-N 3.16Å; T115-L119 WeakPolarHBondContact O-CG 3.44Å; T115-L119 PolarHBondContact O-N 2.81Å; T115-L156 HydrophobicContact CG2-CD1 4.3Å
116M93.2Very high92.3Very high23 Ų2341.8 Ų41.811%0.11323%0.229CC..Hα-helixtrans-58.8-50.9176.9-169.3-174.2-61.100111.6Q112 H113 S118 L119 F120 E153 L156 F157Q112-M116 PolarHBondContact O-N 3Å; H113-M116 WeakPolarHBondContact O-CB 3.39Å; H113-M116 PolarHBondContact O-N 3.21Å; H113-M116 VanDerWaalsContact O-N 3.13Å; M116-S118 VanDerWaalsContact C-N 3.26Å; M116-S118 PolarHBondContact O-N 3.24Å; M116-L119 PolarHBondContact O-N 2.88Å; M116-F120 HydrophobicContact CG-CD2 4.13Å; M116-F120 HydrophobicContact CG-CE2 4.01Å; M116-F120 WeakPolarHBondContact O-CD2 3.42Å; M116-F120 PolarHBondContact O-N 3.04Å; M116-F120 VanDerWaalsContact O-N 3.16Å; M116-E153 HydrophobicContact CE-CG 4.3Å; M116-E153 HydrophobicContact CG-CG 4.48Å; M116-E153 HydrophobicContact SD-CG 4.16Å; M116-L156 HydrophobicContact CB-CD1 3.82Å; M116-L156 HydrophobicContact CE-CB 4.33Å; M116-L156 HydrophobicContact CE-CD1 4.25Å; M116-L156 HydrophobicContact CG-CD1 4.5Å; M116-F157 HydrophobicContact CE-CD2 4Å; M116-F157 HydrophobicContact CE-CE2 3.7Å; M116-F157 HydrophobicContact SD-CE2 4.48Å
117F94.7Very high92.8Very high23 Ų2338.5 Ų38.510%0.10121%0.208CC..Hα-helixtrans-59.6-37.3174.9-69.6-54.1000111.9C87 I91 E94 H113 L119 G121C87-F117 HydrophobicContact CB-CB 4.29Å; C87-F117 VanDerWaalsContact CB-O 3.26Å; C87-F117 WeakPolarHBondContact CB-O 3.49Å; C87-F117 PolarHBondContact SG-O 3.24Å; C87-F117 VanDerWaalsContact SG-O 3.4Å; I91-F117 HydrophobicContact CD1-CB 4.29Å; I91-F117 HydrophobicContact CG1-CB 3.61Å; E94-F117 HydrophobicContact CG-CD2 3.97Å; E94-F117 HydrophobicContact CG-CE2 3.74Å; H113-F117 HydrophobicContact CB-CD2 4.46Å; H113-F117 HydrophobicContact CB-CE2 4.23Å; H113-F117 WeakPolarHBondContact O-CD2 3.17Å; H113-F117 PolarHBondContact O-N 2.75Å; F117-L119 PolarHBondContact O-N 2.99Å; F117-G121 WeakPolarHBondContact O-CA 3.41Å; F117-G121 PolarHBondContact O-N 3.41Å
118S96.3Very high93.4Very high51 Ų5133 Ų3336%0.35719%0.188SC..Hα-helixtrans-63.9-41177.8-61.80000112.1I91 S114 T115 M116 L122I91-S118 WeakPolarHBondContact CD1-OG 3.39Å; S114-S118 VanDerWaalsContact O-CB 3.31Å; S114-S118 WeakPolarHBondContact O-CB 3.26Å; S114-S118 PolarHBondContact O-N 3.28Å; S114-S118 PolarHBondContact O-OG 2.66Å; T115-S118 WeakPolarHBondContact O-CB 3.43Å; T115-S118 PolarHBondContact O-N 3.3Å; T115-S118 VanDerWaalsContact O-N 3.16Å; M116-S118 VanDerWaalsContact C-N 3.26Å; M116-S118 PolarHBondContact O-N 3.24Å; S118-L122 VanDerWaalsContact O-CB 3.23Å; S118-L122 WeakPolarHBondContact O-CB 3.4Å; S118-L122 PolarHBondContact O-N 3.33Å
119L97.2Very high93.7Very high50 Ų5028.9 Ų28.926%0.26217%0.17SC..Hα-helixtrans-66.2-48.1178.2-68.4172.2000112.1T115 M116 F117 L122 S123 I148 A149T115-L119 WeakPolarHBondContact O-CG 3.44Å; T115-L119 PolarHBondContact O-N 2.81Å; M116-L119 PolarHBondContact O-N 2.88Å; F117-L119 PolarHBondContact O-N 2.99Å; L119-L122 PolarHBondContact O-N 3.4Å; L119-S123 PolarHBondContact O-N 2.86Å; L119-I148 HydrophobicContact CD2-CG2 4.44Å; L119-A149 HydrophobicContact CB-CB 4.13Å
120F96.6Very high94Very high26 Ų2629.3 Ų29.311%0.11417%0.17CC..Hα-helixtrans-67-38.2176.2-76.8-72.4000112.4F14 K83 M116 S123 G124 A149 L150 E153F14-F120 HydrophobicContact CZ-CZ 4.48Å; K83-F120 WeakPolarHBondContact CD-O 3.02Å; M116-F120 HydrophobicContact CG-CD2 4.13Å; M116-F120 HydrophobicContact CG-CE2 4.01Å; M116-F120 WeakPolarHBondContact O-CD2 3.42Å; M116-F120 PolarHBondContact O-N 3.04Å; M116-F120 VanDerWaalsContact O-N 3.16Å; F120-S123 WeakPolarHBondContact O-CB 3.48Å; F120-S123 PolarHBondContact O-N 3.26Å; F120-G124 PolarHBondContact O-N 3.29Å; F120-A149 HydrophobicContact CD1-CB 3.63Å; F120-A149 HydrophobicContact CD2-CB 4.42Å; F120-A149 HydrophobicContact CE1-CB 3.76Å; F120-A149 HydrophobicContact CG-CB 3.98Å; F120-A149 HydrophobicContact CZ-CB 4.22Å; F120-L150 HydrophobicContact CE1-CD2 4.27Å; F120-L150 HydrophobicContact CZ-CD2 4.14Å; F120-E153 HydrophobicContact CE2-CB 4.1Å; F120-E153 HydrophobicContact CE2-CG 4.41Å; F120-E153 HydrophobicContact CZ-CB 4.28Å; F120-E153 WeakPolarHBondContact CZ-OE2 3.48Å
121G97.1Very high94.1Very high5 Ų530.4 Ų30.45%0.05217%0.174CC..Hα-helixtrans-62.8-43.6175.900000111.8L84 C87 F117 G124 A125L84-G121 WeakPolarHBondContact CD1-O 3.36Å; C87-G121 PolarHBondContact SG-N 3.15Å; C87-G121 VanDerWaalsContact SG-N 3.42Å; F117-G121 WeakPolarHBondContact O-CA 3.41Å; F117-G121 PolarHBondContact O-N 3.41Å; G121-G124 PolarHBondContact O-N 3.4Å; G121-A125 PolarHBondContact O-N 2.76Å
122L96.5Very high94.1Very high105 Ų10533.2 Ų33.255%0.5518%0.179SC..Hα-helixtrans-65.6-39.4175.6-174.161.3000111.8S118 L119 G124 A125 I126S118-L122 VanDerWaalsContact O-CB 3.23Å; S118-L122 WeakPolarHBondContact O-CB 3.4Å; S118-L122 PolarHBondContact O-N 3.33Å; L119-L122 PolarHBondContact O-N 3.4Å; L122-G124 PolarHBondContact O-N 3.22Å; L122-A125 PolarHBondContact O-N 2.92Å; L122-I126 HydrophobicContact CD1-CD1 4.18Å; L122-I126 HydrophobicContact CD1-CG1 4.32Å; L122-I126 HydrophobicContact CG-CD1 3.96Å; L122-I126 HydrophobicContact CG-CG1 4.5Å; L122-I126 VanDerWaalsContact O-CG1 3.31Å; L122-I126 WeakPolarHBondContact O-CG1 3.4Å; L122-I126 PolarHBondContact O-N 3.02Å
123S96.3Very high94Very high2 Ų233 Ų331%0.01419%0.188CC..Hα-helixtrans-55.9-50.2170.9-170.80000111L119 F120 A125 I126 E127 H146L119-S123 PolarHBondContact O-N 2.86Å; F120-S123 WeakPolarHBondContact O-CB 3.48Å; F120-S123 PolarHBondContact O-N 3.26Å; S123-A125 PolarHBondContact O-N 2.97Å; S123-I126 PolarHBondContact O-N 3Å; S123-E127 WeakPolarHBondContact O-CB 3.43Å; S123-E127 WeakPolarHBondContact O-CG 3.42Å; S123-E127 PolarHBondContact O-N 3.05Å; S123-E127 PolarHBondContact OG-OE1 2.63Å; S123-H146 VanDerWaalsContact OG-CA 3.29Å; S123-H146 WeakPolarHBondContact OG-CA 3.47Å; S123-H146 PolarHBondContact OG-N 3.08Å
124G96.2Very high94.2Very high0 Ų037.4 Ų37.40%021%0.211CC..Hα-helixtrans-61-40.3177.900000113.4F120 G121 L122 E127 L128F120-G124 PolarHBondContact O-N 3.29Å; G121-G124 PolarHBondContact O-N 3.4Å; L122-G124 PolarHBondContact O-N 3.22Å; G124-E127 PolarHBondContact O-N 3.01Å; G124-L128 WeakPolarHBondContact O-CD1 3.37Å; G124-L128 VanDerWaalsContact O-CG 3.29Å; G124-L128 WeakPolarHBondContact O-CG 3.4Å; G124-L128 PolarHBondContact O-N 3.44Å
125A96.1Very high94.1Very high27 Ų2739.5 Ų39.522%0.22322%0.22CC..Hα-helixtrans-63.3-43.8175.400000112.2L84 G121 L122 S123 L128 C129L84-A125 HydrophobicContact CD1-CB 4.08Å; L84-A125 HydrophobicContact CD2-CB 4.27Å; G121-A125 PolarHBondContact O-N 2.76Å; L122-A125 PolarHBondContact O-N 2.92Å; S123-A125 PolarHBondContact O-N 2.97Å; A125-L128 WeakPolarHBondContact O-CB 3.27Å; A125-L128 PolarHBondContact O-N 3.18Å; A125-C129 PolarHBondContact O-N 3.5Å; A125-C129 PolarHBondContact O-SG 3.34Å
126I95Very high93.9Very high23 Ų2345.9 Ų45.912%0.11824%0.242CC..Hα-helixtrans-68.4-42179-66.1169.9000110.7L122 S123 L128 C129 I130 F145L122-I126 HydrophobicContact CD1-CD1 4.18Å; L122-I126 HydrophobicContact CD1-CG1 4.32Å; L122-I126 HydrophobicContact CG-CD1 3.96Å; L122-I126 HydrophobicContact CG-CG1 4.5Å; L122-I126 VanDerWaalsContact O-CG1 3.31Å; L122-I126 WeakPolarHBondContact O-CG1 3.4Å; L122-I126 PolarHBondContact O-N 3.02Å; S123-I126 PolarHBondContact O-N 3Å; I126-L128 VanDerWaalsContact C-N 3.28Å; I126-L128 PolarHBondContact O-N 2.82Å; I126-C129 WeakPolarHBondContact O-CB 3.35Å; I126-C129 PolarHBondContact O-N 2.78Å; I126-C129 VanDerWaalsContact O-N 3.11Å; I126-I130 HydrophobicContact CG2-CD1 3.84Å; I126-I130 HydrophobicContact CG2-CG1 4.2Å; I126-I130 VanDerWaalsContact O-CG1 3.27Å; I126-I130 WeakPolarHBondContact O-CG1 3.31Å; I126-I130 PolarHBondContact O-N 2.94Å; I126-F145 HydrophobicContact CB-CD2 4.25Å; I126-F145 HydrophobicContact CB-CG 4.32Å; I126-F145 HydrophobicContact CD1-CB 4.48Å; I126-F145 HydrophobicContact CD1-CD1 3.42Å; I126-F145 VanDerWaalsContact CD1-CD1 3.42Å; I126-F145 HydrophobicContact CD1-CD2 4.36Å; I126-F145 HydrophobicContact CD1-CE1 3.62Å; I126-F145 HydrophobicContact CD1-CG 3.83Å; I126-F145 HydrophobicContact CD1-CZ 4.17Å; I126-F145 HydrophobicContact CG2-CD1 4.41Å; I126-F145 HydrophobicContact CG2-CD2 3.4Å; I126-F145 HydrophobicContact CG2-CE1 4.43Å; I126-F145 HydrophobicContact CG2-CE2 3.44Å; I126-F145 VanDerWaalsContact CG2-CE2 3.44Å; I126-F145 HydrophobicContact CG2-CG 3.92Å; I126-F145 HydrophobicContact CG2-CZ 3.98Å
127E94.3Very high93.8Very high6 Ų647.7 Ų47.73%0.02825%0.252CS..Hα-helixtrans-53.9-44.9172.5-71.1158.8-146.100111.3S80 K83 S123 G124 F131 E142S80-E127 WeakPolarHBondContact CB-OE2 3.39Å; S80-E127 WeakPolarHBondContact OG-CB 3.43Å; S80-E127 PolarHBondContact OG-OE2 3.47Å; K83-E127 VanDerWaalsContact NZ-CD 3.29Å; K83-E127 IonicContact NZ-OE1 2.91Å; K83-E127 PolarHBondContact NZ-OE1 3.4Å; K83-E127 IonicContact NZ-OE2 3.16Å; K83-E127 PolarHBondContact NZ-OE2 3.02Å; S123-E127 WeakPolarHBondContact O-CB 3.43Å; S123-E127 WeakPolarHBondContact O-CG 3.42Å; S123-E127 PolarHBondContact O-N 3.05Å; S123-E127 PolarHBondContact OG-OE1 2.63Å; G124-E127 PolarHBondContact O-N 3.01Å; E127-F131 VanDerWaalsContact O-CB 3.26Å; E127-F131 WeakPolarHBondContact O-CB 3.32Å; E127-F131 PolarHBondContact O-N 3.33Å; E127-E142 HydrophobicContact CG-CB 4.24Å
128L94Very high93.6Very high19 Ų1950.6 Ų50.610%0.09927%0.273CS..Hα-helixtrans-63.3-44.9174.5-72.5161.8000112.3P77 L81 L84 G124 A125 I126 I130 F131 Y132P77-L128 HydrophobicContact CG-CD2 3.6Å; L81-L128 HydrophobicContact CB-CD2 4.27Å; L81-L128 HydrophobicContact CD1-CD1 4.41Å; L84-L128 HydrophobicContact CB-CD1 4.24Å; L84-L128 HydrophobicContact CD2-CD1 3.61Å; G124-L128 WeakPolarHBondContact O-CD1 3.37Å; G124-L128 VanDerWaalsContact O-CG 3.29Å; G124-L128 WeakPolarHBondContact O-CG 3.4Å; G124-L128 PolarHBondContact O-N 3.44Å; A125-L128 WeakPolarHBondContact O-CB 3.27Å; A125-L128 PolarHBondContact O-N 3.18Å; I126-L128 VanDerWaalsContact C-N 3.28Å; I126-L128 PolarHBondContact O-N 2.82Å; L128-I130 PolarHBondContact O-N 3.28Å; L128-F131 PolarHBondContact O-N 2.86Å; L128-Y132 HydrophobicContact CD2-CE2 3.89Å; L128-Y132 VanDerWaalsContact O-CD2 3.23Å; L128-Y132 WeakPolarHBondContact O-CD2 3.43Å; L128-Y132 PolarHBondContact O-N 3.01Å
129C93.8Very high93Very high34 Ų3451.4 Ų51.423%0.2327%0.273CS..Hα-helixtrans-62.3-41.3178.7-750000112.5A125 I126 G133 I134 I135A125-C129 PolarHBondContact O-N 3.5Å; A125-C129 PolarHBondContact O-SG 3.34Å; I126-C129 WeakPolarHBondContact O-CB 3.35Å; I126-C129 PolarHBondContact O-N 2.78Å; I126-C129 VanDerWaalsContact O-N 3.11Å; C129-G133 PolarHBondContact O-N 2.82Å; C129-G133 VanDerWaalsContact O-N 3.15Å; C129-I134 HydrophobicContact CB-CB 4.28Å; C129-I134 PolarHBondContact O-N 3.25Å; C129-I135 HydrophobicContact CB-CB 4.4Å; C129-I135 HydrophobicContact CB-CD1 3.66Å; C129-I135 HydrophobicContact CB-CG1 3.9Å; C129-I135 PolarHBondContact O-N 2.84Å
130I91.8Very high92.5Very high16 Ų1654.5 Ų54.58%0.08229%0.286CS..Hα-helixtrans-62.9-49.9172.9-64.3167000109.2I126 L128 Y132 G133 I137 L139I126-I130 HydrophobicContact CG2-CD1 3.84Å; I126-I130 HydrophobicContact CG2-CG1 4.2Å; I126-I130 VanDerWaalsContact O-CG1 3.27Å; I126-I130 WeakPolarHBondContact O-CG1 3.31Å; I126-I130 PolarHBondContact O-N 2.94Å; L128-I130 PolarHBondContact O-N 3.28Å; I130-Y132 PolarHBondContact O-N 2.95Å; I130-G133 PolarHBondContact O-N 3.43Å; I130-I137 HydrophobicContact CD1-CD1 3.79Å; I130-I137 HydrophobicContact CD1-CG1 3.99Å; I130-I137 HydrophobicContact CG1-CD1 3.86Å; I130-I137 HydrophobicContact CG1-CG1 3.74Å; I130-L139 HydrophobicContact CG2-CD1 3.71Å
131F90.5Very high92.2Very high31 Ų3154.6 Ų54.614%0.13629%0.29CS..Hα-helixtrans-59.9-44.2-176.7-179.5-89.9000113.2P54 K73 S75 P77 E127 L128 G133P54-F131 HydrophobicContact CB-CD2 4.34Å; P54-F131 HydrophobicContact CB-CE2 3.46Å; P54-F131 VanDerWaalsContact CB-CE2 3.46Å; P54-F131 HydrophobicContact CB-CZ 3.89Å; P54-F131 HydrophobicContact CG-CE2 3.77Å; K73-F131 HydrophobicContact CD-CE1 4.49Å; K73-F131 PolarHBondContact NZ-O 3.45Å; S75-F131 WeakPolarHBondContact O-CE1 3.36Å; S75-F131 VanDerWaalsContact O-CZ 3.24Å; S75-F131 WeakPolarHBondContact O-CZ 3.38Å; S75-F131 VanDerWaalsContact OG-CZ 3.25Å; S75-F131 WeakPolarHBondContact OG-CZ 3.4Å; P77-F131 HydrophobicContact CB-CD2 4.36Å; P77-F131 HydrophobicContact CB-CG 4.38Å; P77-F131 VanDerWaalsContact CD-CE1 3.45Å; P77-F131 HydrophobicContact CG-CB 4.18Å; P77-F131 HydrophobicContact CG-CD1 3.76Å; P77-F131 HydrophobicContact CG-CD2 4.2Å; P77-F131 HydrophobicContact CG-CE1 4.16Å; P77-F131 HydrophobicContact CG-CG 3.76Å; P77-F131 HydrophobicContact CG-CZ 4.48Å; E127-F131 VanDerWaalsContact O-CB 3.26Å; E127-F131 WeakPolarHBondContact O-CB 3.32Å; E127-F131 PolarHBondContact O-N 3.33Å; L128-F131 PolarHBondContact O-N 2.86Å; F131-G133 VanDerWaalsContact C-N 3.27Å; F131-G133 PolarHBondContact O-N 2.81Å
132Y90Very high91.9Very high89 Ų8954.6 Ų54.635%0.34929%0.288SS..Hα-helixtrans-80.7-5177.5-69.5-63.5000113.5L128 I130 I134L128-Y132 HydrophobicContact CD2-CE2 3.89Å; L128-Y132 VanDerWaalsContact O-CD2 3.23Å; L128-Y132 WeakPolarHBondContact O-CD2 3.43Å; L128-Y132 PolarHBondContact O-N 3.01Å; I130-Y132 PolarHBondContact O-N 2.95Å; Y132-I134 VanDerWaalsContact C-N 3.34Å
133G88.3Confident91.8Very high37 Ų3750.4 Ų50.438%0.38127%0.265SS..THydrogen-bonded Turntrans75.620.5177.700000114.1C129 I130 F131C129-G133 PolarHBondContact O-N 2.82Å; C129-G133 VanDerWaalsContact O-N 3.15Å; I130-G133 PolarHBondContact O-N 3.43Å; F131-G133 VanDerWaalsContact C-N 3.27Å; F131-G133 PolarHBondContact O-N 2.81Å
134I92.6Very high91.6Very high127 Ų12755.2 Ų55.265%0.65129%0.29SS*.SBendtrans-67.9-42.3172.2-59.7174.3000109.1C129 Y132C129-I134 HydrophobicContact CB-CB 4.28Å; C129-I134 PolarHBondContact O-N 3.25Å; Y132-I134 VanDerWaalsContact C-N 3.34Å
135I90.9Very high91.5Very high67 Ų6757.8 Ų57.834%0.34430%0.302SS..SBendtrans-108.7123173.6-59.6173.2000107.9C129 I137C129-I135 HydrophobicContact CB-CB 4.4Å; C129-I135 HydrophobicContact CB-CD1 3.66Å; C129-I135 HydrophobicContact CB-CG1 3.9Å; C129-I135 PolarHBondContact O-N 2.84Å; I135-I137 HydrophobicContact CG2-CB 4.38Å; I135-I137 HydrophobicContact CG2-CD1 3.88Å; I135-I137 HydrophobicContact CG2-CG1 3.86Å; I135-I137 HydrophobicContact CG2-CG2 3.87Å; I135-I137 PolarHBondContact O-N 3.36Å
136K90.4Very high91.4Very high203 Ų20356.7 Ų56.788%0.88329%0.292SS*.  trans-94.976.6-179.4-62.4-176-176.6178.40110.8
137I91.5Very high91.4Very high61 Ų6156.3 Ų56.331%0.31329%0.294SS..SBendtrans-124.8161.8174.359.7-178.7000110.3I130 I135 F145I130-I137 HydrophobicContact CD1-CD1 3.79Å; I130-I137 HydrophobicContact CD1-CG1 3.99Å; I130-I137 HydrophobicContact CG1-CD1 3.86Å; I130-I137 HydrophobicContact CG1-CG1 3.74Å; I135-I137 HydrophobicContact CG2-CB 4.38Å; I135-I137 HydrophobicContact CG2-CD1 3.88Å; I135-I137 HydrophobicContact CG2-CG1 3.86Å; I135-I137 HydrophobicContact CG2-CG2 3.87Å; I135-I137 PolarHBondContact O-N 3.36Å; I137-F145 HydrophobicContact CD1-CE2 3.87Å; I137-F145 HydrophobicContact CD1-CZ 4.35Å
138P89.2Confident91.4Very high83 Ų8360 Ų6054%0.53931%0.313SS..  trans-55.4143.5176.5-24.735000111.6Q140 S141P138-Q140 PolarHBondContact O-N 2.79Å; P138-S141 WeakPolarHBondContact O-CB 3.23Å; P138-S141 PolarHBondContact O-N 3.48Å; P138-S141 PolarHBondContact O-OG 3.28Å; P138-S141 VanDerWaalsContact O-OG 3.08Å
139L85.2Confident91.5Very high69 Ų6959.2 Ų59.236%0.36131%0.309SS..THydrogen-bonded Turntrans-63-30.3-176.4-165.854.2000112.3R50 I130 S141 E142R50-L139 VanDerWaalsContact NH2-CG 3.3Å; I130-L139 HydrophobicContact CG2-CD1 3.71Å; L139-S141 PolarHBondContact O-N 3.41Å; L139-E142 WeakPolarHBondContact O-CG 3.48Å; L139-E142 PolarHBondContact O-N 2.85Å
140Q86.6Confident91.6Very high114 Ų11457.6 Ų57.653%0.53330%0.298SS..THydrogen-bonded Turntrans-63-17175.7-60.681.8-4.600112.8P138 E142 Y143 L190P138-Q140 PolarHBondContact O-N 2.79Å; Q140-E142 PolarHBondContact O-N 2.83Å; Q140-E142 VanDerWaalsContact O-N 3.11Å; Q140-Y143 WeakPolarHBondContact O-CB 3.31Å; Q140-Y143 WeakPolarHBondContact O-CD2 3.26Å; Q140-Y143 PolarHBondContact O-N 2.98Å; Q140-Y143 VanDerWaalsContact O-N 3.08Å; Q140-L190 HydrophobicContact CB-CD1 4.21Å
141S90Very high91.7Very high28 Ų2864.2 Ų64.220%0.19632%0.322CS..Hα-helixtrans-61.2-17.4174.1-60.60000112.8P138 L139 Y143 L144 F145P138-S141 WeakPolarHBondContact O-CB 3.23Å; P138-S141 PolarHBondContact O-N 3.48Å; P138-S141 PolarHBondContact O-OG 3.28Å; P138-S141 VanDerWaalsContact O-OG 3.08Å; L139-S141 PolarHBondContact O-N 3.41Å; S141-Y143 PolarHBondContact O-N 3.4Å; S141-L144 WeakPolarHBondContact O-CB 3.26Å; S141-L144 PolarHBondContact O-N 3.03Å; S141-L144 VanDerWaalsContact O-N 3.08Å; S141-F145 WeakPolarHBondContact O-CD2 3.35Å; S141-F145 PolarHBondContact O-N 3.33Å
142E91.7Very high92Very high5 Ų563.5 Ų63.52%0.02332%0.323CS..Hα-helixtrans-56.4-34.1170.969.6-172.6-167.400112.9R50 I51 E127 L139 Q140 L144 H146R50-E142 VanDerWaalsContact CA-OE1 3.22Å; R50-E142 WeakPolarHBondContact CA-OE1 3.5Å; R50-E142 WeakPolarHBondContact CD-OE1 3.23Å; R50-E142 IonicContact CZ-OE1 3.54Å; R50-E142 IonicContact CZ-OE2 3.42Å; R50-E142 IonicContact NE-OE1 3.4Å; R50-E142 PolarHBondContact NE-OE1 3.38Å; R50-E142 IonicContact NE-OE2 3.5Å; R50-E142 PolarHBondContact NE-OE2 3.36Å; R50-E142 IonicContact NH2-OE1 2.8Å; R50-E142 IonicContact NH2-OE2 3.09Å; R50-E142 PolarHBondContact NH2-OE2 3.26Å; I51-E142 HydrophobicContact CB-CB 4.25Å; I51-E142 HydrophobicContact CB-CG 3.85Å; I51-E142 HydrophobicContact CG1-CB 4.37Å; I51-E142 HydrophobicContact CG1-CG 3.79Å; I51-E142 PolarHBondContact N-OE1 2.72Å; E127-E142 HydrophobicContact CG-CB 4.24Å; L139-E142 WeakPolarHBondContact O-CG 3.48Å; L139-E142 PolarHBondContact O-N 2.85Å; Q140-E142 PolarHBondContact O-N 2.83Å; Q140-E142 VanDerWaalsContact O-N 3.11Å; E142-L144 VanDerWaalsContact C-N 3.31Å; E142-L144 PolarHBondContact O-N 3.18Å; E142-H146 VanDerWaalsContact O-CB 3.22Å; E142-H146 WeakPolarHBondContact O-CB 3.48Å; E142-H146 PolarHBondContact O-N 3.17Å
143Y92.4Very high92.2Very high17 Ų1759.3 Ų59.37%0.06731%0.307CS..Hα-helixtrans-65.7-33.7176.4-74.9-89.3000112.4C49 R50 I51 Q140 S141 G147 E189 L190C49-Y143 WeakPolarHBondContact CB-OH 3.36Å; C49-Y143 PolarHBondContact O-OH 3.47Å; R50-Y143 PolarHBondContact N-OH 2.74Å; I51-Y143 HydrophobicContact CD1-CD1 3.85Å; I51-Y143 HydrophobicContact CD1-CE1 3.75Å; I51-Y143 HydrophobicContact CD1-CG 4.46Å; I51-Y143 HydrophobicContact CG1-CD1 4.07Å; I51-Y143 HydrophobicContact CG1-CD2 4.36Å; I51-Y143 HydrophobicContact CG1-CE1 4.1Å; I51-Y143 HydrophobicContact CG1-CE2 4.4Å; I51-Y143 HydrophobicContact CG1-CG 4.18Å; Q140-Y143 WeakPolarHBondContact O-CB 3.31Å; Q140-Y143 WeakPolarHBondContact O-CD2 3.26Å; Q140-Y143 PolarHBondContact O-N 2.98Å; Q140-Y143 VanDerWaalsContact O-N 3.08Å; S141-Y143 PolarHBondContact O-N 3.4Å; Y143-G147 WeakPolarHBondContact O-CA 3.33Å; Y143-G147 PolarHBondContact O-N 3.13Å; Y143-E189 HydrophobicContact CE1-CB 4.17Å; Y143-E189 HydrophobicContact CE1-CG 3.87Å; Y143-E189 PolarHBondContact OH-OE1 2.79Å; Y143-L190 HydrophobicContact CD1-CB 4.39Å; Y143-L190 HydrophobicContact CD2-CD1 3.94Å; Y143-L190 HydrophobicContact CG-CB 4.44Å; Y143-L190 HydrophobicContact CG-CD1 4.08Å
144L92.9Very high92.5Very high104 Ų10458.4 Ų58.455%0.54529%0.293SS..Hα-helixtrans-66.6-52.8177.8174.763.7000110.7S141 E142 G147 I148S141-L144 WeakPolarHBondContact O-CB 3.26Å; S141-L144 PolarHBondContact O-N 3.03Å; S141-L144 VanDerWaalsContact O-N 3.08Å; E142-L144 VanDerWaalsContact C-N 3.31Å; E142-L144 PolarHBondContact O-N 3.18Å; L144-G147 PolarHBondContact O-N 3.45Å; L144-I148 HydrophobicContact CD1-CD1 4.11Å; L144-I148 HydrophobicContact CD1-CG1 4.47Å; L144-I148 HydrophobicContact CG-CD1 4.15Å; L144-I148 VanDerWaalsContact O-CG1 3.31Å; L144-I148 WeakPolarHBondContact O-CG1 3.26Å; L144-I148 PolarHBondContact O-N 2.88Å
145F94.1Very high92.5Very high53 Ų5358.5 Ų58.523%0.23229%0.289CS..Hα-helixtrans-68.6-39.6-176.1-60.2-67.2000112.1I126 I137 S141 I148 A149I126-F145 HydrophobicContact CB-CD2 4.25Å; I126-F145 HydrophobicContact CB-CG 4.32Å; I126-F145 HydrophobicContact CD1-CB 4.48Å; I126-F145 HydrophobicContact CD1-CD1 3.42Å; I126-F145 VanDerWaalsContact CD1-CD1 3.42Å; I126-F145 HydrophobicContact CD1-CD2 4.36Å; I126-F145 HydrophobicContact CD1-CE1 3.62Å; I126-F145 HydrophobicContact CD1-CG 3.83Å; I126-F145 HydrophobicContact CD1-CZ 4.17Å; I126-F145 HydrophobicContact CG2-CD1 4.41Å; I126-F145 HydrophobicContact CG2-CD2 3.4Å; I126-F145 HydrophobicContact CG2-CE1 4.43Å; I126-F145 HydrophobicContact CG2-CE2 3.44Å; I126-F145 VanDerWaalsContact CG2-CE2 3.44Å; I126-F145 HydrophobicContact CG2-CG 3.92Å; I126-F145 HydrophobicContact CG2-CZ 3.98Å; I137-F145 HydrophobicContact CD1-CE2 3.87Å; I137-F145 HydrophobicContact CD1-CZ 4.35Å; S141-F145 WeakPolarHBondContact O-CD2 3.35Å; S141-F145 PolarHBondContact O-N 3.33Å; F145-I148 PolarHBondContact O-N 3.45Å; F145-A149 PolarHBondContact O-N 3.45Å
146H94.7Very high92.6Very high5 Ų556.4 Ų56.42%0.02328%0.278CS..Hα-helixtrans-67.4-39.1174-172.783.4000111.6I51 K83 S123 E142 I148 A149 L150 Y206I51-H146 HydrophobicContact CD1-CB 4.36Å; I51-H146 HydrophobicContact CG1-CB 4.24Å; I51-H146 HydrophobicContact CG2-CB 3.98Å; K83-H146 PolarHBondContact NZ-ND1 3.46Å; S123-H146 VanDerWaalsContact OG-CA 3.29Å; S123-H146 WeakPolarHBondContact OG-CA 3.47Å; S123-H146 PolarHBondContact OG-N 3.08Å; E142-H146 VanDerWaalsContact O-CB 3.22Å; E142-H146 WeakPolarHBondContact O-CB 3.48Å; E142-H146 PolarHBondContact O-N 3.17Å; H146-I148 PolarHBondContact O-N 3.42Å; H146-A149 WeakPolarHBondContact O-CB 3.38Å; H146-A149 PolarHBondContact O-N 2.92Å; H146-A149 VanDerWaalsContact O-N 3.16Å; H146-L150 PolarHBondContact O-N 3.21Å; H146-Y206 AromaticContact NE2-CZ 3.66Å; H146-Y206 PolarHBondContact NE2-OH 2.85Å
147G94.2Very high92.6Very high15 Ų1547.3 Ų47.316%0.15524%0.239CC..Hα-helixtrans-60.8-42.5174.300000112.7Y143 L144 A149 L150 W151Y143-G147 WeakPolarHBondContact O-CA 3.33Å; Y143-G147 PolarHBondContact O-N 3.13Å; L144-G147 PolarHBondContact O-N 3.45Å; G147-A149 VanDerWaalsContact C-N 3.27Å; G147-A149 PolarHBondContact O-N 3.11Å; G147-L150 PolarHBondContact O-N 3.21Å; G147-W151 WeakPolarHBondContact O-CB 3.19Å; G147-W151 VanDerWaalsContact O-CD1 3.23Å; G147-W151 PolarHBondContact O-N 3.24Å
148I94.9Very high92.5Very high84 Ų8447.6 Ų47.643%0.43124%0.243SC..Hα-helixtrans-59.9-39.8174.1-70.1164.9000110.9L119 L144 F145 H146 W151 G152L119-I148 HydrophobicContact CD2-CG2 4.44Å; L144-I148 HydrophobicContact CD1-CD1 4.11Å; L144-I148 HydrophobicContact CD1-CG1 4.47Å; L144-I148 HydrophobicContact CG-CD1 4.15Å; L144-I148 VanDerWaalsContact O-CG1 3.31Å; L144-I148 WeakPolarHBondContact O-CG1 3.26Å; L144-I148 PolarHBondContact O-N 2.88Å; F145-I148 PolarHBondContact O-N 3.45Å; H146-I148 PolarHBondContact O-N 3.42Å; I148-W151 PolarHBondContact O-N 2.96Å; I148-G152 PolarHBondContact O-N 3.29Å
149A96.4Very high92.3Very high1 Ų148.8 Ų48.81%0.00824%0.24CC..Hα-helixtrans-63.9-45.9176.800000112.4L119 F120 F145 H146 G147 W151 G152 E153L119-A149 HydrophobicContact CB-CB 4.13Å; F120-A149 HydrophobicContact CD1-CB 3.63Å; F120-A149 HydrophobicContact CD2-CB 4.42Å; F120-A149 HydrophobicContact CE1-CB 3.76Å; F120-A149 HydrophobicContact CG-CB 3.98Å; F120-A149 HydrophobicContact CZ-CB 4.22Å; F145-A149 PolarHBondContact O-N 3.45Å; H146-A149 WeakPolarHBondContact O-CB 3.38Å; H146-A149 PolarHBondContact O-N 2.92Å; H146-A149 VanDerWaalsContact O-N 3.16Å; G147-A149 VanDerWaalsContact C-N 3.27Å; G147-A149 PolarHBondContact O-N 3.11Å; A149-W151 VanDerWaalsContact C-N 3.34Å; A149-W151 PolarHBondContact O-N 3.41Å; A149-G152 PolarHBondContact O-N 3.4Å; A149-E153 PolarHBondContact O-N 2.86Å
150L95.2Very high92.3Very high0 Ų047 Ų470%023%0.23CC..Hα-helixtrans-63.3-37.6174.7-69.3173.8000112.6F120 H146 G147 E153 L154 V183 Y206F120-L150 HydrophobicContact CE1-CD2 4.27Å; F120-L150 HydrophobicContact CZ-CD2 4.14Å; H146-L150 PolarHBondContact O-N 3.21Å; G147-L150 PolarHBondContact O-N 3.21Å; L150-E153 WeakPolarHBondContact O-CB 3.42Å; L150-E153 PolarHBondContact O-N 3.37Å; L150-L154 WeakPolarHBondContact O-CB 3.46Å; L150-L154 PolarHBondContact O-N 3.49Å; L150-V183 HydrophobicContact CB-CG2 3.67Å; L150-V183 HydrophobicContact CD1-CG2 4.38Å; L150-Y206 HydrophobicContact CD2-CE1 4.21Å
151W94.6Very high92.2Very high156 Ų15642.9 Ų42.959%0.59121%0.211SC*.Hα-helixtrans-65.4-41.4175-90.2108.7000112.5G147 I148 A149 L154 F155 V183G147-W151 WeakPolarHBondContact O-CB 3.19Å; G147-W151 VanDerWaalsContact O-CD1 3.23Å; G147-W151 PolarHBondContact O-N 3.24Å; I148-W151 PolarHBondContact O-N 2.96Å; A149-W151 VanDerWaalsContact C-N 3.34Å; A149-W151 PolarHBondContact O-N 3.41Å; W151-L154 HydrophobicContact CE3-CD2 3.91Å; W151-L154 HydrophobicContact CZ3-CD2 3.79Å; W151-L154 WeakPolarHBondContact O-CB 3.48Å; W151-L154 PolarHBondContact O-N 2.89Å; W151-F155 PolarHBondContact O-N 3.29Å; W151-V183 HydrophobicContact CZ2-CG1 3.98Å
152G95.5Very high91.7Very high16 Ų1647.4 Ų47.417%0.16523%0.229CC..Hα-helixtrans-67.4-38.3174.800000112.5I148 A149 F155 L156I148-G152 PolarHBondContact O-N 3.29Å; A149-G152 PolarHBondContact O-N 3.4Å; G152-F155 PolarHBondContact O-N 3.16Å; G152-L156 WeakPolarHBondContact O-CB 3.27Å; G152-L156 VanDerWaalsContact O-CG 3.23Å; G152-L156 WeakPolarHBondContact O-CG 3.45Å; G152-L156 PolarHBondContact O-N 3.13Å
153E94.6Very high91.1Very high0 Ų056.6 Ų56.60%027%0.272CS..Hα-helixtrans-57.2-50.8170.2-172.6-175.2-161.900110.9F14 M116 F120 A149 L150 F155 L156 F157 I179 Q209F14-E153 WeakPolarHBondContact CZ-OE1 3.38Å; M116-E153 HydrophobicContact CE-CG 4.3Å; M116-E153 HydrophobicContact CG-CG 4.48Å; M116-E153 HydrophobicContact SD-CG 4.16Å; F120-E153 HydrophobicContact CE2-CB 4.1Å; F120-E153 HydrophobicContact CE2-CG 4.41Å; F120-E153 HydrophobicContact CZ-CB 4.28Å; F120-E153 WeakPolarHBondContact CZ-OE2 3.48Å; A149-E153 PolarHBondContact O-N 2.86Å; L150-E153 WeakPolarHBondContact O-CB 3.42Å; L150-E153 PolarHBondContact O-N 3.37Å; E153-F155 PolarHBondContact O-N 2.78Å; E153-L156 PolarHBondContact O-N 2.85Å; E153-F157 HydrophobicContact CG-CD2 3.91Å; E153-F157 HydrophobicContact CG-CE2 4.11Å; E153-F157 WeakPolarHBondContact O-CB 3.5Å; E153-F157 WeakPolarHBondContact O-CD2 3.17Å; E153-F157 PolarHBondContact O-N 3Å; E153-I179 HydrophobicContact CG-CD1 3.81Å; E153-I179 HydrophobicContact CG-CG1 4.47Å; E153-Q209 PolarHBondContact OE1-OE1 3.39Å
154L95Very high90.8Very high19 Ų1959.1 Ų59.110%0.09928%0.281CS..Hα-helixtrans-55-49.4177.317757.5000111.9L150 W151 F157 V158 T176 I179 I180L150-L154 WeakPolarHBondContact O-CB 3.46Å; L150-L154 PolarHBondContact O-N 3.49Å; W151-L154 HydrophobicContact CE3-CD2 3.91Å; W151-L154 HydrophobicContact CZ3-CD2 3.79Å; W151-L154 WeakPolarHBondContact O-CB 3.48Å; W151-L154 PolarHBondContact O-N 2.89Å; L154-F157 PolarHBondContact O-N 3.18Å; L154-V158 HydrophobicContact CD1-CG2 4.13Å; L154-V158 WeakPolarHBondContact O-CG2 3.22Å; L154-V158 PolarHBondContact O-N 3.38Å; L154-T176 HydrophobicContact CD1-CG2 3.58Å; L154-I179 HydrophobicContact CB-CG2 3.8Å; L154-I179 HydrophobicContact CD1-CG2 4.45Å; L154-I180 HydrophobicContact CD1-CD1 4.27Å; L154-I180 HydrophobicContact CD1-CG1 3.73Å; L154-I180 HydrophobicContact CD2-CG1 4.05Å
155F93.2Very high90.7Very high128 Ų12857.1 Ų57.156%0.56127%0.271SS*.Hα-helixtrans-61.1-47.4-179.8-173.5-93.5000111.3W151 G152 E153 F157 V158 F159W151-F155 PolarHBondContact O-N 3.29Å; G152-F155 PolarHBondContact O-N 3.16Å; E153-F155 PolarHBondContact O-N 2.78Å; F155-F157 VanDerWaalsContact C-N 3.32Å; F155-F157 PolarHBondContact O-N 3.41Å; F155-V158 PolarHBondContact O-N 3.34Å; F155-F159 HydrophobicContact CD1-CD2 4.2Å; F155-F159 HydrophobicContact CD2-CD2 4.11Å; F155-F159 AromaticContact CD2-CE2 3.8Å; F155-F159 HydrophobicContact CD2-CE2 3.8Å; F155-F159 AromaticContact CE1-CD2 3.93Å; F155-F159 HydrophobicContact CE1-CD2 3.93Å; F155-F159 HydrophobicContact CE1-CE2 4.22Å; F155-F159 AromaticContact CE2-CD2 3.85Å; F155-F159 HydrophobicContact CE2-CD2 3.85Å; F155-F159 AromaticContact CE2-CE2 3.32Å; F155-F159 HydrophobicContact CE2-CE2 3.32Å; F155-F159 HydrophobicContact CE2-CZ 4.26Å; F155-F159 HydrophobicContact CG-CD2 4.28Å; F155-F159 HydrophobicContact CG-CE2 4.43Å; F155-F159 AromaticContact CZ-CD2 3.74Å; F155-F159 HydrophobicContact CZ-CD2 3.74Å; F155-F159 AromaticContact CZ-CE2 3.56Å; F155-F159 HydrophobicContact CZ-CE2 3.56Å; F155-F159 HydrophobicContact CZ-CZ 4.4Å; F155-F159 WeakPolarHBondContact O-CD2 3.39Å; F155-F159 PolarHBondContact O-N 3.1Å
156L92.3Very high90.7Very high23 Ų2356.9 Ų56.912%0.1228%0.275CS..Hα-helixtrans-60.8-42.7177.9-70.8170.9000111.4Q112 T115 M116 G152 E153 F159 H160Q112-L156 HydrophobicContact CB-CD2 4.08Å; Q112-L156 HydrophobicContact CG-CD2 4.08Å; Q112-L156 WeakPolarHBondContact O-CD1 3.32Å; T115-L156 HydrophobicContact CG2-CD1 4.3Å; M116-L156 HydrophobicContact CB-CD1 3.82Å; M116-L156 HydrophobicContact CE-CB 4.33Å; M116-L156 HydrophobicContact CE-CD1 4.25Å; M116-L156 HydrophobicContact CG-CD1 4.5Å; G152-L156 WeakPolarHBondContact O-CB 3.27Å; G152-L156 VanDerWaalsContact O-CG 3.23Å; G152-L156 WeakPolarHBondContact O-CG 3.45Å; G152-L156 PolarHBondContact O-N 3.13Å; E153-L156 PolarHBondContact O-N 2.85Å; L156-F159 PolarHBondContact O-N 3.49Å; L156-H160 VanDerWaalsContact O-CB 3.23Å; L156-H160 WeakPolarHBondContact O-CB 3.41Å; L156-H160 PolarHBondContact O-N 3.16Å
157F89.7Confident90.6Very high12 Ų1256.7 Ų56.75%0.05327%0.274CS..Hα-helixtrans-61.9-45.8178.1-99.7-96.5000112.9M116 E153 L154 F155 F159 H160 L161 H172 L175 I179 F213M116-F157 HydrophobicContact CE-CD2 4Å; M116-F157 HydrophobicContact CE-CE2 3.7Å; M116-F157 HydrophobicContact SD-CE2 4.48Å; E153-F157 HydrophobicContact CG-CD2 3.91Å; E153-F157 HydrophobicContact CG-CE2 4.11Å; E153-F157 WeakPolarHBondContact O-CB 3.5Å; E153-F157 WeakPolarHBondContact O-CD2 3.17Å; E153-F157 PolarHBondContact O-N 3Å; L154-F157 PolarHBondContact O-N 3.18Å; F155-F157 VanDerWaalsContact C-N 3.32Å; F155-F157 PolarHBondContact O-N 3.41Å; F157-F159 VanDerWaalsContact C-N 3.33Å; F157-F159 PolarHBondContact O-N 3.21Å; F157-H160 PolarHBondContact O-N 3.16Å; F157-L161 WeakPolarHBondContact O-CG 3.29Å; F157-H172 AromaticContact CE1-CD2 3.73Å; F157-L175 HydrophobicContact CD1-CD2 4.29Å; F157-L175 HydrophobicContact CE1-CB 4.4Å; F157-L175 HydrophobicContact CE1-CD2 3.29Å; F157-L175 HydrophobicContact CE1-CG 4.03Å; F157-L175 HydrophobicContact CZ-CD2 3.47Å; F157-L175 VanDerWaalsContact CZ-CD2 3.47Å; F157-L175 HydrophobicContact CZ-CG 4.39Å; F157-I179 HydrophobicContact CB-CD1 4.37Å; F157-I179 HydrophobicContact CD1-CD1 4.39Å; F157-I179 HydrophobicContact CD2-CD1 3.92Å; F157-I179 HydrophobicContact CE2-CD1 4.37Å; F157-I179 HydrophobicContact CG-CD1 3.94Å; F157-F213 HydrophobicContact CE1-CZ 4.5Å; F157-F213 HydrophobicContact CE2-CZ 4.12Å; F157-F213 AromaticContact CZ-CE1 3.74Å; F157-F213 HydrophobicContact CZ-CE1 3.74Å; F157-F213 AromaticContact CZ-CZ 3.53Å; F157-F213 HydrophobicContact CZ-CZ 3.53Å
158V89.2Confident90.6Very high67 Ų6756.6 Ų56.641%0.40627%0.27SS..Hα-helixtrans-59.1-44.5-179.5168.60000111.5L154 F155 T176L154-V158 HydrophobicContact CD1-CG2 4.13Å; L154-V158 WeakPolarHBondContact O-CG2 3.22Å; L154-V158 PolarHBondContact O-N 3.38Å; F155-V158 PolarHBondContact O-N 3.34Å; V158-T176 HydrophobicContact CG2-CG2 4.2Å
159F86.9Confident90.5Very high108 Ų10854.5 Ų54.547%0.47426%0.261SS..Hα-helixtrans-86.9-2.2-177.6-69.7-78.5000114F155 L156 F157 H162F155-F159 HydrophobicContact CD1-CD2 4.2Å; F155-F159 HydrophobicContact CD2-CD2 4.11Å; F155-F159 AromaticContact CD2-CE2 3.8Å; F155-F159 HydrophobicContact CD2-CE2 3.8Å; F155-F159 AromaticContact CE1-CD2 3.93Å; F155-F159 HydrophobicContact CE1-CD2 3.93Å; F155-F159 HydrophobicContact CE1-CE2 4.22Å; F155-F159 AromaticContact CE2-CD2 3.85Å; F155-F159 HydrophobicContact CE2-CD2 3.85Å; F155-F159 AromaticContact CE2-CE2 3.32Å; F155-F159 HydrophobicContact CE2-CE2 3.32Å; F155-F159 HydrophobicContact CE2-CZ 4.26Å; F155-F159 HydrophobicContact CG-CD2 4.28Å; F155-F159 HydrophobicContact CG-CE2 4.43Å; F155-F159 AromaticContact CZ-CD2 3.74Å; F155-F159 HydrophobicContact CZ-CD2 3.74Å; F155-F159 AromaticContact CZ-CE2 3.56Å; F155-F159 HydrophobicContact CZ-CE2 3.56Å; F155-F159 HydrophobicContact CZ-CZ 4.4Å; F155-F159 WeakPolarHBondContact O-CD2 3.39Å; F155-F159 PolarHBondContact O-N 3.1Å; L156-F159 PolarHBondContact O-N 3.49Å; F157-F159 VanDerWaalsContact C-N 3.33Å; F157-F159 PolarHBondContact O-N 3.21Å; F159-H162 AromaticContact CD1-NE2 3.83Å; F159-H162 PolarHBondContact O-CD2 2.67Å
160H84.6Confident90.4Very high33 Ų3359.9 Ų59.915%0.15328%0.282CS..THydrogen-bonded Turntrans-83-13.2176.1-169.871.7000113.6Q112 L156 F157 R164Q112-H160 PolarHBondContact OE1-ND1 2.73Å; L156-H160 VanDerWaalsContact O-CB 3.23Å; L156-H160 WeakPolarHBondContact O-CB 3.41Å; L156-H160 PolarHBondContact O-N 3.16Å; F157-H160 PolarHBondContact O-N 3.16Å; H160-R164 VanDerWaalsContact CD2-CZ 3.48Å; H160-R164 PolarHBondContact CD2-NH2 3.49Å; H160-R164 PolarHBondContact CE1-NH2 3.04Å; H160-R164 PolarHBondContact NE2-NH2 2.71Å; H160-R164 PolarHBondContact O-NE 3.18Å; H160-R164 VanDerWaalsContact O-NE 3.15Å; H160-R164 PolarHBondContact O-NH2 3.45Å
161L83.5Confident90.4Very high26 Ų2659.9 Ų59.914%0.13628%0.282CS..  trans-86.4-8.5-169.5-56.4178.1000114.9F157 V169 H172F157-L161 WeakPolarHBondContact O-CG 3.29Å; L161-V169 HydrophobicContact CB-CG1 4.48Å; L161-V169 HydrophobicContact CD1-CG1 4.46Å; L161-H172 HydrophobicContact CD2-CB 3.29Å
162H79.5Confident90.4Very high123 Ų12352.6 Ų52.657%0.56925%0.254SS*.THydrogen-bonded Turntrans-63.5139.2-177-66.5-71.3000111.8F159 R164F159-H162 AromaticContact CD1-NE2 3.83Å; F159-H162 PolarHBondContact O-CD2 2.67Å; H162-R164 PolarHBondContact O-N 2.78Å
163H80Confident90.4Very high198 Ų19856.1 Ų56.192%0.91727%0.269SS*.THydrogen-bonded Turntrans6230.3175.9-55.3-71.3000116.5
164R85.5Confident90.5Very high70 Ų7058.4 Ų58.426%0.26428%0.281SS..  trans-102.9163.9175.4-57-160.2178.3-171.5-7.7113.3H160 H162 D168 V169 H172H160-R164 VanDerWaalsContact CD2-CZ 3.48Å; H160-R164 PolarHBondContact CD2-NH2 3.49Å; H160-R164 PolarHBondContact CE1-NH2 3.04Å; H160-R164 PolarHBondContact NE2-NH2 2.71Å; H160-R164 PolarHBondContact O-NE 3.18Å; H160-R164 VanDerWaalsContact O-NE 3.15Å; H160-R164 PolarHBondContact O-NH2 3.45Å; H162-R164 PolarHBondContact O-N 2.78Å; R164-D168 HydrophobicContact CB-CB 4.11Å; R164-D168 VanDerWaalsContact CD-CG 3.42Å; R164-D168 VanDerWaalsContact CD-OD1 3.32Å; R164-D168 WeakPolarHBondContact CD-OD1 3.45Å; R164-D168 WeakPolarHBondContact CD-OD2 3.26Å; R164-D168 IonicContact NH1-OD1 2.78Å; R164-D168 PolarHBondContact NH1-OD1 3.25Å; R164-D168 VanDerWaalsContact NH1-OD1 3.16Å; R164-D168 IonicContact NH1-OD2 2.88Å; R164-V169 HydrophobicContact CB-CG2 3.89Å; R164-H172 PolarHBondContact NH1-CE1 3.33Å; R164-H172 PolarHBondContact NH1-NE2 2.93Å
165N91.4Very high90.5Very high63 Ų6357.5 Ų57.534%0.33728%0.276SS..  trans-61150172.1-67.2-33.8000110.6L167 D168 V169 Q232 Q233N165-L167 VanDerWaalsContact C-N 3.31Å; N165-L167 PolarHBondContact O-N 2.95Å; N165-D168 WeakPolarHBondContact O-CB 3.26Å; N165-D168 PolarHBondContact O-N 3.35Å; N165-D168 VanDerWaalsContact O-N 3.12Å; N165-V169 PolarHBondContact O-N 3.01Å; N165-V169 VanDerWaalsContact O-N 3.16Å; N165-Q232 HydrophobicContact CB-CB 3.74Å; N165-Q232 PolarHBondContact ND2-OE1 3.28Å; N165-Q233 PolarHBondContact OD1-NE2 3.27Å
166P93Very high90.6Very high48 Ų4851.7 Ų51.731%0.31225%0.251SS..Hα-helixtrans-51-48.4-179.5-2834.4000112.9D168 V169 Y170 Q232 I238P166-D168 PolarHBondContact O-N 3.21Å; P166-V169 PolarHBondContact O-N 3.34Å; P166-Y170 VanDerWaalsContact O-CD2 3.24Å; P166-Y170 WeakPolarHBondContact O-CD2 3.49Å; P166-Y170 PolarHBondContact O-N 2.87Å; P166-Y170 VanDerWaalsContact O-N 3.09Å; P166-Q232 WeakPolarHBondContact CD-O 3.32Å; P166-I238 HydrophobicContact CB-CD1 4.46Å
167L94.3Very high90.8Very high1 Ų152.3 Ų52.31%0.00526%0.263CS..Hα-helixtrans-58.2-46.8-179.8-177.359.8000112.3N165 V169 Y170 L171 I219 W230 Q232 A241N165-L167 VanDerWaalsContact C-N 3.31Å; N165-L167 PolarHBondContact O-N 2.95Å; L167-V169 VanDerWaalsContact C-N 3.32Å; L167-V169 PolarHBondContact O-N 3.49Å; L167-Y170 PolarHBondContact O-N 3.34Å; L167-L171 HydrophobicContact CD1-CD2 4.42Å; L167-L171 HydrophobicContact CD1-CG 4.18Å; L167-L171 HydrophobicContact CG-CD1 4.11Å; L167-L171 HydrophobicContact CG-CG 4.24Å; L167-L171 VanDerWaalsContact O-CG 3.26Å; L167-L171 WeakPolarHBondContact O-CG 3.2Å; L167-L171 PolarHBondContact O-N 2.88Å; L167-I219 HydrophobicContact CD2-CG2 3.81Å; L167-I219 HydrophobicContact CG-CG2 4.5Å; L167-W230 HydrophobicContact CD2-CB 3.82Å; L167-W230 HydrophobicContact CD2-CE3 4.1Å; L167-W230 HydrophobicContact CD2-CG 4.45Å; L167-Q232 HydrophobicContact CB-CB 4.02Å; L167-Q232 HydrophobicContact CB-CG 4.49Å; L167-Q232 WeakPolarHBondContact CB-O 3.24Å; L167-Q232 HydrophobicContact CD2-CB 4.44Å; L167-Q232 HydrophobicContact CD2-CG 4.18Å; L167-Q232 PolarHBondContact N-O 3.32Å; L167-A241 HydrophobicContact CD1-CB 3.97Å
168D93.3Very high91.1Very high12 Ų1252.3 Ų52.36%0.06426%0.263CS..Hα-helixtrans-57.3-45.4179.3-172.8-28.2000111.3R164 N165 P166 Y170 L171 H172 L220R164-D168 HydrophobicContact CB-CB 4.11Å; R164-D168 VanDerWaalsContact CD-CG 3.42Å; R164-D168 VanDerWaalsContact CD-OD1 3.32Å; R164-D168 WeakPolarHBondContact CD-OD1 3.45Å; R164-D168 WeakPolarHBondContact CD-OD2 3.26Å; R164-D168 IonicContact NH1-OD1 2.78Å; R164-D168 PolarHBondContact NH1-OD1 3.25Å; R164-D168 VanDerWaalsContact NH1-OD1 3.16Å; R164-D168 IonicContact NH1-OD2 2.88Å; N165-D168 WeakPolarHBondContact O-CB 3.26Å; N165-D168 PolarHBondContact O-N 3.35Å; N165-D168 VanDerWaalsContact O-N 3.12Å; P166-D168 PolarHBondContact O-N 3.21Å; D168-Y170 PolarHBondContact O-N 3.4Å; D168-L171 PolarHBondContact O-N 3.41Å; D168-H172 PolarHBondContact O-N 3.2Å; D168-H172 VanDerWaalsContact O-N 3.13Å; D168-H172 PolarHBondContact O-ND1 3.16Å; D168-H172 IonicContact OD1-CE1 2.67Å; D168-H172 PolarHBondContact OD1-CE1 2.66Å; D168-H172 IonicContact OD1-ND1 3.25Å; D168-H172 PolarHBondContact OD1-ND1 3.28Å; D168-L220 HydrophobicContact CB-CD1 4.25Å; D168-L220 HydrophobicContact CB-CD2 4.01Å
169V93.9Very high91.5Very high41 Ų4149.1 Ų49.125%0.24824%0.244CC..Hα-helixtrans-58.8-48.5176.2177.50000111.4L161 R164 N165 P166 L167 H172 L173L161-V169 HydrophobicContact CB-CG1 4.48Å; L161-V169 HydrophobicContact CD1-CG1 4.46Å; R164-V169 HydrophobicContact CB-CG2 3.89Å; N165-V169 PolarHBondContact O-N 3.01Å; N165-V169 VanDerWaalsContact O-N 3.16Å; P166-V169 PolarHBondContact O-N 3.34Å; L167-V169 VanDerWaalsContact C-N 3.32Å; L167-V169 PolarHBondContact O-N 3.49Å; V169-H172 PolarHBondContact O-N 2.89Å; V169-L173 WeakPolarHBondContact O-CB 3.42Å; V169-L173 PolarHBondContact O-N 2.7Å
170Y93.8Very high91.9Very high113 Ų11347.6 Ų47.644%0.44324%0.24SC..Hα-helixtrans-68.2-36.8-178.3-82.2-80.3000113P166 L167 D168 H172 L173 L174 I238P166-Y170 VanDerWaalsContact O-CD2 3.24Å; P166-Y170 WeakPolarHBondContact O-CD2 3.49Å; P166-Y170 PolarHBondContact O-N 2.87Å; P166-Y170 VanDerWaalsContact O-N 3.09Å; L167-Y170 PolarHBondContact O-N 3.34Å; D168-Y170 PolarHBondContact O-N 3.4Å; Y170-H172 VanDerWaalsContact C-N 3.33Å; Y170-H172 PolarHBondContact O-N 2.78Å; Y170-L173 HydrophobicContact CD1-CD2 4.4Å; Y170-L173 PolarHBondContact O-N 3.49Å; Y170-L174 WeakPolarHBondContact O-CG 3.25Å; Y170-L174 PolarHBondContact O-N 3.36Å; Y170-L174 VanDerWaalsContact O-N 3.09Å; Y170-I238 HydrophobicContact CD1-CG2 3.89Å; Y170-I238 HydrophobicContact CD2-CD1 3.6Å; Y170-I238 HydrophobicContact CD2-CG1 3.76Å; Y170-I238 HydrophobicContact CD2-CG2 4.02Å; Y170-I238 HydrophobicContact CE1-CG2 4.2Å; Y170-I238 HydrophobicContact CE2-CD1 3.54Å; Y170-I238 HydrophobicContact CE2-CG1 4.21Å; Y170-I238 HydrophobicContact CE2-CG2 4.35Å; Y170-I238 HydrophobicContact CG-CD1 4.46Å; Y170-I238 HydrophobicContact CG-CG1 4.25Å; Y170-I238 HydrophobicContact CG-CG2 3.8Å
171L95.6Very high92.5Very high0 Ų048.8 Ų48.80%025%0.247CC..Hα-helixtrans-58.5-46.2174.4-72.5178.5000111.4L167 D168 W212 V216 I219 L220 A241L167-L171 HydrophobicContact CD1-CD2 4.42Å; L167-L171 HydrophobicContact CD1-CG 4.18Å; L167-L171 HydrophobicContact CG-CD1 4.11Å; L167-L171 HydrophobicContact CG-CG 4.24Å; L167-L171 VanDerWaalsContact O-CG 3.26Å; L167-L171 WeakPolarHBondContact O-CG 3.2Å; L167-L171 PolarHBondContact O-N 2.88Å; D168-L171 PolarHBondContact O-N 3.41Å; L171-W212 HydrophobicContact CD2-CH2 4.09Å; L171-W212 HydrophobicContact CD2-CZ2 3.51Å; L171-W212 PolarHBondContact O-NE1 2.89Å; L171-V216 HydrophobicContact CB-CG1 4.42Å; L171-V216 HydrophobicContact CB-CG2 4Å; L171-V216 HydrophobicContact CD1-CG1 4.36Å; L171-I219 HydrophobicContact CD1-CB 4.08Å; L171-I219 HydrophobicContact CD1-CD1 4.36Å; L171-I219 HydrophobicContact CD1-CG2 3.7Å; L171-I219 HydrophobicContact CD2-CD1 3.78Å; L171-L220 HydrophobicContact CD1-CD1 4.27Å; L171-L220 HydrophobicContact CD1-CD2 3.83Å; L171-L220 HydrophobicContact CD1-CG 3.83Å; L171-A241 HydrophobicContact CD2-CB 3.74Å
172H94.4Very high93.2Very high3 Ų347.6 Ų47.61%0.01424%0.241CC..Hα-helixtrans-75-30.6177.9-69.477.9000112.4H7 F157 L161 R164 D168 V169 Y170 L174 L175 T176H7-H172 AromaticContact NE2-NE2 3.75Å; F157-H172 AromaticContact CE1-CD2 3.73Å; L161-H172 HydrophobicContact CD2-CB 3.29Å; R164-H172 PolarHBondContact NH1-CE1 3.33Å; R164-H172 PolarHBondContact NH1-NE2 2.93Å; D168-H172 PolarHBondContact O-N 3.2Å; D168-H172 VanDerWaalsContact O-N 3.13Å; D168-H172 PolarHBondContact O-ND1 3.16Å; D168-H172 IonicContact OD1-CE1 2.67Å; D168-H172 PolarHBondContact OD1-CE1 2.66Å; D168-H172 IonicContact OD1-ND1 3.25Å; D168-H172 PolarHBondContact OD1-ND1 3.28Å; V169-H172 PolarHBondContact O-N 2.89Å; Y170-H172 VanDerWaalsContact C-N 3.33Å; Y170-H172 PolarHBondContact O-N 2.78Å; H172-L174 VanDerWaalsContact C-N 3.32Å; H172-L174 PolarHBondContact O-N 3.42Å; H172-L175 CarbonylContact O-C 3.51Å; H172-L175 WeakPolarHBondContact O-CA 3.46Å; H172-L175 VanDerWaalsContact O-CB 3.29Å; H172-L175 WeakPolarHBondContact O-CB 3.44Å; H172-L175 PolarHBondContact O-N 3.41Å; H172-L175 VanDerWaalsContact O-N 3.09Å; H172-T176 PolarHBondContact O-N 3.4Å; H172-T176 PolarHBondContact O-OG1 2.85Å
173L94.5Very high93.9Very high90 Ų9042.2 Ų42.247%0.47122%0.217SC..Hα-helixtrans-62.9-38.2175.2-175.963.9000112.2V169 Y170 L175 T176 G177V169-L173 WeakPolarHBondContact O-CB 3.42Å; V169-L173 PolarHBondContact O-N 2.7Å; Y170-L173 HydrophobicContact CD1-CD2 4.4Å; Y170-L173 PolarHBondContact O-N 3.49Å; L173-L175 VanDerWaalsContact C-N 3.26Å; L173-L175 PolarHBondContact O-N 3.37Å; L173-T176 WeakPolarHBondContact O-CB 3.43Å; L173-T176 PolarHBondContact O-N 3.37Å; L173-G177 PolarHBondContact O-N 3.27Å
174L96Very high94.7Very high48 Ų4837.8 Ų37.825%0.25120%0.199SC..Hα-helixtrans-59.7-39.6172.5-71.4166.5000111.3Y170 H172 G177 M178 W212 F245Y170-L174 WeakPolarHBondContact O-CG 3.25Å; Y170-L174 PolarHBondContact O-N 3.36Å; Y170-L174 VanDerWaalsContact O-N 3.09Å; H172-L174 VanDerWaalsContact C-N 3.32Å; H172-L174 PolarHBondContact O-N 3.42Å; L174-G177 PolarHBondContact O-N 3.44Å; L174-M178 PolarHBondContact O-N 2.74Å; L174-W212 HydrophobicContact CB-CZ2 4.43Å; L174-W212 HydrophobicContact CD1-CH2 4.17Å; L174-W212 HydrophobicContact CD1-CZ2 3.51Å; L174-F245 HydrophobicContact CB-CD2 4.03Å; L174-F245 HydrophobicContact CB-CE2 4.02Å; L174-F245 HydrophobicContact CB-CG 4.47Å; L174-F245 HydrophobicContact CB-CZ 4.45Å; L174-F245 HydrophobicContact CD1-CB 4.03Å; L174-F245 HydrophobicContact CD1-CD2 4.26Å; L174-F245 HydrophobicContact CD1-CG 4.16Å; L174-F245 HydrophobicContact CD2-CD1 4.1Å; L174-F245 HydrophobicContact CD2-CE1 4.4Å; L174-F245 HydrophobicContact CD2-CG 4.17Å
175L95.4Very high95.2Very high1 Ų135 Ų351%0.00519%0.19CC..Hα-helixtrans-67.1-44.8174.9-170.460.3000111.9F157 H172 L173 G177 M178 I179 Q209 F213F157-L175 HydrophobicContact CD1-CD2 4.29Å; F157-L175 HydrophobicContact CE1-CB 4.4Å; F157-L175 HydrophobicContact CE1-CD2 3.29Å; F157-L175 HydrophobicContact CE1-CG 4.03Å; F157-L175 HydrophobicContact CZ-CD2 3.47Å; F157-L175 VanDerWaalsContact CZ-CD2 3.47Å; F157-L175 HydrophobicContact CZ-CG 4.39Å; H172-L175 CarbonylContact O-C 3.51Å; H172-L175 WeakPolarHBondContact O-CA 3.46Å; H172-L175 VanDerWaalsContact O-CB 3.29Å; H172-L175 WeakPolarHBondContact O-CB 3.44Å; H172-L175 PolarHBondContact O-N 3.41Å; H172-L175 VanDerWaalsContact O-N 3.09Å; L173-L175 VanDerWaalsContact C-N 3.26Å; L173-L175 PolarHBondContact O-N 3.37Å; L175-G177 PolarHBondContact O-N 2.81Å; L175-M178 WeakPolarHBondContact O-CA 3.48Å; L175-M178 WeakPolarHBondContact O-CB 3.46Å; L175-M178 PolarHBondContact O-N 3.11Å; L175-I179 PolarHBondContact O-N 3.26Å; L175-Q209 VanDerWaalsContact CD1-CA 3.48Å; L175-Q209 HydrophobicContact CD1-CB 3.68Å; L175-Q209 HydrophobicContact CD1-CG 3.64Å; L175-F213 HydrophobicContact CD1-CD2 4.35Å; L175-F213 HydrophobicContact CD1-CE2 4.21Å; L175-F213 HydrophobicContact CD2-CD1 3.83Å; L175-F213 HydrophobicContact CD2-CD2 4.13Å; L175-F213 HydrophobicContact CD2-CE1 3.36Å; L175-F213 HydrophobicContact CD2-CE2 3.68Å; L175-F213 HydrophobicContact CD2-CG 4.2Å; L175-F213 HydrophobicContact CD2-CZ 3.3Å; L175-F213 HydrophobicContact CG-CE2 4.49Å; L175-F213 HydrophobicContact CG-CZ 4.43Å
176T95.3Very high95.3Very high6 Ų632.5 Ų32.54%0.03718%0.177CC..Hα-helixtrans-54.7-40.9173.7-57.50000111.7L154 V158 H172 L173 M178 I179 I180L154-T176 HydrophobicContact CD1-CG2 3.58Å; V158-T176 HydrophobicContact CG2-CG2 4.2Å; H172-T176 PolarHBondContact O-N 3.4Å; H172-T176 PolarHBondContact O-OG1 2.85Å; L173-T176 WeakPolarHBondContact O-CB 3.43Å; L173-T176 PolarHBondContact O-N 3.37Å; T176-M178 VanDerWaalsContact C-N 3.31Å; T176-M178 PolarHBondContact O-N 3.31Å; T176-I179 PolarHBondContact O-N 2.96Å; T176-I180 HydrophobicContact CG2-CD1 4.23Å; T176-I180 WeakPolarHBondContact O-CG1 3.48Å; T176-I180 PolarHBondContact O-N 3.21Å
177G96.1Very high95.4Very high35 Ų3534.1 Ų34.136%0.36119%0.186SC..Hα-helixtrans-58.8-39.8174.100000113.2L173 L174 L175 I180 L181L173-G177 PolarHBondContact O-N 3.27Å; L174-G177 PolarHBondContact O-N 3.44Å; L175-G177 PolarHBondContact O-N 2.81Å; G177-I180 PolarHBondContact O-N 3.45Å; G177-L181 PolarHBondContact O-N 3.11Å
178M97.2Very high95.4Very high12 Ų1236.5 Ų36.56%0.05920%0.201CC..Hα-helixtrans-70.3-33.2176.2-62.9-50.2-52.100113L174 L175 T176 L181 G182 W204 T205 M208 Q209 F245L174-M178 PolarHBondContact O-N 2.74Å; L175-M178 WeakPolarHBondContact O-CA 3.48Å; L175-M178 WeakPolarHBondContact O-CB 3.46Å; L175-M178 PolarHBondContact O-N 3.11Å; T176-M178 VanDerWaalsContact C-N 3.31Å; T176-M178 PolarHBondContact O-N 3.31Å; M178-L181 HydrophobicContact CE-CD2 4.09Å; M178-G182 PolarHBondContact O-N 3.41Å; M178-W204 HydrophobicContact CE-CE3 4.04Å; M178-W204 HydrophobicContact CE-CH2 3.91Å; M178-W204 HydrophobicContact CE-CZ3 3.64Å; M178-T205 HydrophobicContact CE-CG2 3.78Å; M178-M208 HydrophobicContact CE-CB 3.72Å; M178-M208 HydrophobicContact CE-CG 3.84Å; M178-M208 HydrophobicContact CG-CB 4.11Å; M178-M208 HydrophobicContact SD-CB 4.3Å; M178-M208 HydrophobicContact SD-CG 4.49Å; M178-Q209 HydrophobicContact CB-CG 3.91Å; M178-F245 HydrophobicContact CG-CE2 4.32Å; M178-F245 HydrophobicContact CG-CZ 3.74Å; M178-F245 HydrophobicContact SD-CE1 4.42Å; M178-F245 HydrophobicContact SD-CZ 3.79Å
179I96.6Very high95.5Very high0 Ų036 Ų360%020%0.198CC..Hα-helixtrans-66-47.1174.1-60.9163.5000109.8E153 L154 F157 L175 T176 L181 G182 V183E153-I179 HydrophobicContact CG-CD1 3.81Å; E153-I179 HydrophobicContact CG-CG1 4.47Å; L154-I179 HydrophobicContact CB-CG2 3.8Å; L154-I179 HydrophobicContact CD1-CG2 4.45Å; F157-I179 HydrophobicContact CB-CD1 4.37Å; F157-I179 HydrophobicContact CD1-CD1 4.39Å; F157-I179 HydrophobicContact CD2-CD1 3.92Å; F157-I179 HydrophobicContact CE2-CD1 4.37Å; F157-I179 HydrophobicContact CG-CD1 3.94Å; L175-I179 PolarHBondContact O-N 3.26Å; T176-I179 PolarHBondContact O-N 2.96Å; I179-L181 VanDerWaalsContact C-N 3.34Å; I179-L181 PolarHBondContact O-N 3.03Å; I179-G182 PolarHBondContact O-N 2.86Å; I179-G182 VanDerWaalsContact O-N 3.11Å; I179-V183 WeakPolarHBondContact O-CG2 3.22Å; I179-V183 PolarHBondContact O-N 2.9Å
180I97Very high95.4Very high76 Ų7637.9 Ų37.939%0.3921%0.206SC..Hα-helixtrans-57.1-48.3176.6-67.6167.7000110.5L154 T176 G177 G182 V183 L184L154-I180 HydrophobicContact CD1-CD1 4.27Å; L154-I180 HydrophobicContact CD1-CG1 3.73Å; L154-I180 HydrophobicContact CD2-CG1 4.05Å; T176-I180 HydrophobicContact CG2-CD1 4.23Å; T176-I180 WeakPolarHBondContact O-CG1 3.48Å; T176-I180 PolarHBondContact O-N 3.21Å; G177-I180 PolarHBondContact O-N 3.45Å; I180-G182 VanDerWaalsContact C-N 3.31Å; I180-G182 PolarHBondContact O-N 3.39Å; I180-V183 PolarHBondContact O-N 2.92Å; I180-L184 HydrophobicContact CG2-CD1 4.04Å; I180-L184 HydrophobicContact CG2-CG 4.44Å; I180-L184 WeakPolarHBondContact O-CG 3.15Å; I180-L184 PolarHBondContact O-N 3.49Å
181L97Very high95.4Very high59 Ų5938.2 Ų38.231%0.30922%0.215SC..Hα-helixtrans-60.6-41.3177.1-177.761.2000111.8G177 M178 I179 V183 L184 V185 W204 T205G177-L181 PolarHBondContact O-N 3.11Å; M178-L181 HydrophobicContact CE-CD2 4.09Å; I179-L181 VanDerWaalsContact C-N 3.34Å; I179-L181 PolarHBondContact O-N 3.03Å; L181-V183 PolarHBondContact O-N 3.39Å; L181-L184 PolarHBondContact O-N 2.96Å; L181-V185 HydrophobicContact CD1-CG2 3.83Å; L181-V185 HydrophobicContact CG-CG2 4.19Å; L181-V185 WeakPolarHBondContact O-CB 3.36Å; L181-V185 VanDerWaalsContact O-CG2 3.22Å; L181-V185 WeakPolarHBondContact O-CG2 3.46Å; L181-V185 PolarHBondContact O-N 2.94Å; L181-W204 HydrophobicContact CD2-CE3 4.44Å; L181-W204 HydrophobicContact CD2-CZ3 3.7Å; L181-T205 HydrophobicContact CB-CG2 4.25Å; L181-T205 HydrophobicContact CD2-CG2 3.97Å; L181-T205 HydrophobicContact CG-CG2 3.91Å
182G96.5Very high95.4Very high0 Ų042.6 Ų42.60%024%0.235CC..Hα-helixtrans-60.4-41.9176.600000112.9M178 I179 I180 S186M178-G182 PolarHBondContact O-N 3.41Å; I179-G182 PolarHBondContact O-N 2.86Å; I179-G182 VanDerWaalsContact O-N 3.11Å; I180-G182 VanDerWaalsContact C-N 3.31Å; I180-G182 PolarHBondContact O-N 3.39Å; G182-S186 WeakPolarHBondContact O-CB 3.4Å; G182-S186 PolarHBondContact O-N 3.49Å; G182-S186 PolarHBondContact O-OG 2.89Å
183V95.5Very high95.3Very high10 Ų1044.4 Ų44.46%0.06125%0.248CC..Hα-helixtrans-63.4-51174.71740000110.8L150 W151 I179 I180 L181 V185 S186 V187L150-V183 HydrophobicContact CB-CG2 3.67Å; L150-V183 HydrophobicContact CD1-CG2 4.38Å; W151-V183 HydrophobicContact CZ2-CG1 3.98Å; I179-V183 WeakPolarHBondContact O-CG2 3.22Å; I179-V183 PolarHBondContact O-N 2.9Å; I180-V183 PolarHBondContact O-N 2.92Å; L181-V183 PolarHBondContact O-N 3.39Å; V183-V185 PolarHBondContact O-N 3.06Å; V183-S186 PolarHBondContact O-N 3.35Å; V183-V187 PolarHBondContact O-N 3.28Å
184L96.3Very high95.2Very high106 Ų10644.8 Ų44.856%0.55525%0.246SC*.Hα-helixtrans-59.9-46.2-178.5-68.5175.3000111.7I180 L181 S186 V187 V188I180-L184 HydrophobicContact CG2-CD1 4.04Å; I180-L184 HydrophobicContact CG2-CG 4.44Å; I180-L184 WeakPolarHBondContact O-CG 3.15Å; I180-L184 PolarHBondContact O-N 3.49Å; L181-L184 PolarHBondContact O-N 2.96Å; L184-S186 VanDerWaalsContact C-N 3.31Å; L184-S186 PolarHBondContact O-N 3.47Å; L184-V187 WeakPolarHBondContact O-CB 3.23Å; L184-V187 PolarHBondContact O-N 3.47Å; L184-V188 WeakPolarHBondContact O-CG2 3.42Å; L184-V188 PolarHBondContact O-N 3.42Å; L184-V188 VanDerWaalsContact O-N 3.11Å
185V96Very high95.1Very high12 Ų1247.4 Ų47.47%0.07326%0.258CS..Hα-helixtrans-66.4-35.1179.51720000111.3L181 V183 V187 V188 E189 F198 I201 R202L181-V185 HydrophobicContact CD1-CG2 3.83Å; L181-V185 HydrophobicContact CG-CG2 4.19Å; L181-V185 WeakPolarHBondContact O-CB 3.36Å; L181-V185 VanDerWaalsContact O-CG2 3.22Å; L181-V185 WeakPolarHBondContact O-CG2 3.46Å; L181-V185 PolarHBondContact O-N 2.94Å; V183-V185 PolarHBondContact O-N 3.06Å; V185-V187 VanDerWaalsContact C-N 3.27Å; V185-V187 PolarHBondContact O-N 2.88Å; V185-V188 PolarHBondContact O-N 3.26Å; V185-E189 VanDerWaalsContact O-CB 3.27Å; V185-E189 WeakPolarHBondContact O-CB 3.49Å; V185-E189 PolarHBondContact O-N 3.43Å; V185-F198 HydrophobicContact CG1-CB 4.35Å; V185-F198 WeakPolarHBondContact CG1-O 3.37Å; V185-I201 HydrophobicContact CB-CG2 4.34Å; V185-I201 HydrophobicContact CG1-CB 3.94Å; V185-I201 HydrophobicContact CG1-CG2 3.98Å; V185-I201 HydrophobicContact CG2-CB 4.39Å; V185-I201 HydrophobicContact CG2-CG2 3.58Å; V185-R202 HydrophobicContact CG1-CB 4.02Å
186S93.6Very high95.1Very high9 Ų948.3 Ų48.36%0.06326%0.263CS..Hα-helixtrans-63.5-33.7175.4-59.90000112.3G182 V183 L184 L190G182-S186 WeakPolarHBondContact O-CB 3.4Å; G182-S186 PolarHBondContact O-N 3.49Å; G182-S186 PolarHBondContact O-OG 2.89Å; V183-S186 PolarHBondContact O-N 3.35Å; L184-S186 VanDerWaalsContact C-N 3.31Å; L184-S186 PolarHBondContact O-N 3.47Å; S186-L190 PolarHBondContact O-N 3.41Å; S186-L190 VanDerWaalsContact O-N 3.16Å
187V94.2Very high95.1Very high82 Ų8252 Ų5250%0.49728%0.282SS..Hα-helixtrans-68.6-45.8173176.10000110.7V183 L184 V185 E189 L190 L191V183-V187 PolarHBondContact O-N 3.28Å; L184-V187 WeakPolarHBondContact O-CB 3.23Å; L184-V187 PolarHBondContact O-N 3.47Å; V185-V187 VanDerWaalsContact C-N 3.27Å; V185-V187 PolarHBondContact O-N 2.88Å; V187-E189 VanDerWaalsContact C-N 3.32Å; V187-E189 PolarHBondContact O-N 2.9Å; V187-L190 WeakPolarHBondContact O-CB 3.49Å; V187-L190 PolarHBondContact O-N 2.95Å; V187-L191 WeakPolarHBondContact O-CG 3.47Å; V187-L191 PolarHBondContact O-N 2.98Å
188V95.3Very high95.1Very high52 Ų5252.5 Ų52.532%0.31527%0.274SS..Hα-helixtrans-64.6-38.1178.3-178.20000111.5L184 V185 L190 L191 H192 F198L184-V188 WeakPolarHBondContact O-CG2 3.42Å; L184-V188 PolarHBondContact O-N 3.42Å; L184-V188 VanDerWaalsContact O-N 3.11Å; V185-V188 PolarHBondContact O-N 3.26Å; V188-L190 VanDerWaalsContact C-N 3.32Å; V188-L190 PolarHBondContact O-N 2.97Å; V188-L191 PolarHBondContact O-N 3.44Å; V188-L191 VanDerWaalsContact O-N 3.13Å; V188-H192 PolarHBondContact O-CD2 3.46Å; V188-H192 PolarHBondContact O-N 3.29Å; V188-F198 HydrophobicContact CB-CD1 4.2Å; V188-F198 HydrophobicContact CB-CE1 4.35Å; V188-F198 HydrophobicContact CG1-CD1 3.53Å; V188-F198 HydrophobicContact CG1-CD2 4.23Å; V188-F198 HydrophobicContact CG1-CE1 3.28Å; V188-F198 HydrophobicContact CG1-CE2 4.02Å; V188-F198 HydrophobicContact CG1-CG 4.01Å; V188-F198 HydrophobicContact CG1-CZ 3.54Å
189E94.8Very high95.1Very high0 Ų052 Ų520%027%0.272CS..Hα-helixtrans-61.4-39.1175-172.1-179.9154.700112.1C49 Y143 V185 V187 L191 H192 P193 F198 R202C49-E189 HydrophobicContact CB-CG 3.57Å; C49-E189 WeakPolarHBondContact CB-OE1 3.46Å; Y143-E189 HydrophobicContact CE1-CB 4.17Å; Y143-E189 HydrophobicContact CE1-CG 3.87Å; Y143-E189 PolarHBondContact OH-OE1 2.79Å; V185-E189 VanDerWaalsContact O-CB 3.27Å; V185-E189 WeakPolarHBondContact O-CB 3.49Å; V185-E189 PolarHBondContact O-N 3.43Å; V187-E189 VanDerWaalsContact C-N 3.32Å; V187-E189 PolarHBondContact O-N 2.9Å; E189-L191 VanDerWaalsContact C-N 3.29Å; E189-L191 PolarHBondContact O-N 3.19Å; E189-H192 CarbonylContact O-C 3.59Å; E189-H192 PolarHBondContact O-N 2.97Å; E189-P193 WeakPolarHBondContact O-CA 3.33Å; E189-F198 HydrophobicContact CB-CB 3.74Å; E189-F198 HydrophobicContact CG-CB 4.07Å; E189-R202 IonicContact OE1-CZ 3Å; E189-R202 IonicContact OE1-NE 3.45Å; E189-R202 PolarHBondContact OE1-NE 2.67Å; E189-R202 IonicContact OE1-NH2 3.68Å; E189-R202 PolarHBondContact OE1-NH2 2.89Å; E189-R202 WeakPolarHBondContact OE2-CD 3.31Å; E189-R202 IonicContact OE2-CZ 2.72Å; E189-R202 IonicContact OE2-NE 3.77Å; E189-R202 PolarHBondContact OE2-NE 2.94Å; E189-R202 IonicContact OE2-NH2 2.76Å
190L93Very high95.1Very high81 Ų8153.4 Ų53.442%0.42428%0.279SS..Hα-helixtrans-64.5-34.6174.5-179.465.7000112.1Q140 Y143 S186 V187 V188Q140-L190 HydrophobicContact CB-CD1 4.21Å; Y143-L190 HydrophobicContact CD1-CB 4.39Å; Y143-L190 HydrophobicContact CD2-CD1 3.94Å; Y143-L190 HydrophobicContact CG-CB 4.44Å; Y143-L190 HydrophobicContact CG-CD1 4.08Å; S186-L190 PolarHBondContact O-N 3.41Å; S186-L190 VanDerWaalsContact O-N 3.16Å; V187-L190 WeakPolarHBondContact O-CB 3.49Å; V187-L190 PolarHBondContact O-N 2.95Å; V188-L190 VanDerWaalsContact C-N 3.32Å; V188-L190 PolarHBondContact O-N 2.97Å
191L93.9Very high95.1Very high120 Ų12052.4 Ų52.463%0.62827%0.274SS*.Hα-helixtrans-77.3-24.9177.2-62.4174.8000112.8V187 V188 E189 P193V187-L191 WeakPolarHBondContact O-CG 3.47Å; V187-L191 PolarHBondContact O-N 2.98Å; V188-L191 PolarHBondContact O-N 3.44Å; V188-L191 VanDerWaalsContact O-N 3.13Å; E189-L191 VanDerWaalsContact C-N 3.29Å; E189-L191 PolarHBondContact O-N 3.19Å; L191-P193 VanDerWaalsContact C-CD 3.49Å
192H94.2Very high95.1Very high92 Ų9249.6 Ų49.643%0.42626%0.26SS..  trans-129.763.8-178.1-59-68.9000111.6V188 E189 H194 E195 F198V188-H192 PolarHBondContact O-CD2 3.46Å; V188-H192 PolarHBondContact O-N 3.29Å; E189-H192 CarbonylContact O-C 3.59Å; E189-H192 PolarHBondContact O-N 2.97Å; H192-H194 PolarHBondContact O-N 3.42Å; H192-H194 VanDerWaalsContact O-N 3.08Å; H192-E195 HydrophobicContact CB-CB 4.22Å; H192-E195 HydrophobicContact CB-CG 4.19Å; H192-E195 PolarHBondContact O-N 3.38Å; H192-E195 VanDerWaalsContact O-N 3.13Å; H192-F198 HydrophobicContact CB-CD2 3.74Å; H192-F198 HydrophobicContact CB-CE2 3.5Å; H192-F198 VanDerWaalsContact CB-CE2 3.5Å; H192-F198 AromaticContact CD2-CE2 3.9Å; H192-F198 AromaticContact CG-CE2 3.87Å
193P92.5Very high95.1Very high42 Ų4249.6 Ų49.627%0.27326%0.26SS..THydrogen-bonded Turntrans-68.1-13.6-17028-36.4000113.9T48 C49 E189 L191T48-P193 CarbonylContact C-O 3.49Å; T48-P193 VanDerWaalsContact CA-O 3.31Å; T48-P193 WeakPolarHBondContact CA-O 3.4Å; C49-P193 WeakPolarHBondContact CB-O 3.39Å; C49-P193 PolarHBondContact N-O 2.9Å; E189-P193 WeakPolarHBondContact O-CA 3.33Å; L191-P193 VanDerWaalsContact C-CD 3.49Å
194H93.6Very high95.2Very high97 Ų9751.2 Ų51.245%0.44927%0.265SS..THydrogen-bonded Turntrans-95.4-3.4179.3-59.9-69000113.3E46 Y47 H192 P196E46-H194 IonicContact OE1-CE1 3.99Å; E46-H194 IonicContact OE1-ND1 3.75Å; Y47-H194 WeakPolarHBondContact CD1-O 3.3Å; Y47-H194 PolarHBondContact O-ND1 2.7Å; H192-H194 PolarHBondContact O-N 3.42Å; H192-H194 VanDerWaalsContact O-N 3.08Å; H194-P196 WeakPolarHBondContact O-CD 3.27Å
195E94.2Very high95.3Very high104 Ų10446.2 Ų46.249%0.48624%0.238SC..  trans-97.8107-177.4-69.9-60.6157.400111C49 H192 I197 F198C49-E195 PolarHBondContact SG-O 3.36Å; C49-E195 VanDerWaalsContact SG-O 3.34Å; H192-E195 HydrophobicContact CB-CB 4.22Å; H192-E195 HydrophobicContact CB-CG 4.19Å; H192-E195 PolarHBondContact O-N 3.38Å; H192-E195 VanDerWaalsContact O-N 3.13Å; E195-I197 HydrophobicContact CB-CG2 4.3Å; E195-I197 PolarHBondContact O-N 3.01Å; E195-I197 VanDerWaalsContact O-N 3.1Å; E195-F198 HydrophobicContact CB-CD2 3.7Å; E195-F198 HydrophobicContact CB-CE2 3.74Å; E195-F198 HydrophobicContact CG-CE2 4.28Å; E195-F198 PolarHBondContact O-N 3.22Å
196P94.4Very high95.3Very high19 Ų1945.7 Ų45.712%0.12324%0.235CC..Hα-helixtrans-65.3-20.8-173.428.5-38.2000113.5I25 F29 Y47 H194 F198 G199 L200I25-P196 HydrophobicContact CG2-CB 4.12Å; F29-P196 HydrophobicContact CD2-CB 4.16Å; F29-P196 HydrophobicContact CD2-CG 3.68Å; F29-P196 HydrophobicContact CE2-CG 3.74Å; F29-P196 HydrophobicContact CG-CB 4.37Å; F29-P196 HydrophobicContact CG-CG 4.2Å; F29-P196 HydrophobicContact CZ-CG 4.31Å; Y47-P196 HydrophobicContact CD1-CB 4.29Å; Y47-P196 VanDerWaalsContact CE1-CA 3.45Å; Y47-P196 HydrophobicContact CE1-CB 3.64Å; Y47-P196 HydrophobicContact CE1-CG 4.44Å; Y47-P196 HydrophobicContact CE2-CB 4.3Å; Y47-P196 WeakPolarHBondContact OH-CA 3.34Å; H194-P196 WeakPolarHBondContact O-CD 3.27Å; P196-F198 VanDerWaalsContact C-N 3.29Å; P196-F198 PolarHBondContact O-N 3.43Å; P196-G199 PolarHBondContact O-N 3.27Å; P196-L200 WeakPolarHBondContact O-CG 3.45Å; P196-L200 PolarHBondContact O-N 3.48Å
197I95.9Very high95.5Very high84 Ų8445.5 Ų45.543%0.43123%0.233SC..Hα-helixtrans-60.3-38.2-177.4-172.158000112.1E195 L200 I201E195-I197 HydrophobicContact CB-CG2 4.3Å; E195-I197 PolarHBondContact O-N 3.01Å; E195-I197 VanDerWaalsContact O-N 3.1Å; I197-L200 PolarHBondContact O-N 2.91Å; I197-I201 HydrophobicContact CD1-CD1 4.38Å; I197-I201 HydrophobicContact CD1-CG1 4.37Å; I197-I201 HydrophobicContact CG1-CD1 4Å; I197-I201 HydrophobicContact CG1-CG1 4.44Å; I197-I201 VanDerWaalsContact O-CG1 3.27Å; I197-I201 WeakPolarHBondContact O-CG1 3.23Å; I197-I201 PolarHBondContact O-N 2.75Å
198F96.5Very high95.7Very high46 Ų4641.6 Ų41.620%0.20221%0.209CC..Hα-helixtrans-70.4-42.1-179.4-58.4-61.4000111.4V185 V188 E189 H192 E195 P196 L200 I201 R202V185-F198 HydrophobicContact CG1-CB 4.35Å; V185-F198 WeakPolarHBondContact CG1-O 3.37Å; V188-F198 HydrophobicContact CB-CD1 4.2Å; V188-F198 HydrophobicContact CB-CE1 4.35Å; V188-F198 HydrophobicContact CG1-CD1 3.53Å; V188-F198 HydrophobicContact CG1-CD2 4.23Å; V188-F198 HydrophobicContact CG1-CE1 3.28Å; V188-F198 HydrophobicContact CG1-CE2 4.02Å; V188-F198 HydrophobicContact CG1-CG 4.01Å; V188-F198 HydrophobicContact CG1-CZ 3.54Å; E189-F198 HydrophobicContact CB-CB 3.74Å; E189-F198 HydrophobicContact CG-CB 4.07Å; H192-F198 HydrophobicContact CB-CD2 3.74Å; H192-F198 HydrophobicContact CB-CE2 3.5Å; H192-F198 VanDerWaalsContact CB-CE2 3.5Å; H192-F198 AromaticContact CD2-CE2 3.9Å; H192-F198 AromaticContact CG-CE2 3.87Å; E195-F198 HydrophobicContact CB-CD2 3.7Å; E195-F198 HydrophobicContact CB-CE2 3.74Å; E195-F198 HydrophobicContact CG-CE2 4.28Å; E195-F198 PolarHBondContact O-N 3.22Å; P196-F198 VanDerWaalsContact C-N 3.29Å; P196-F198 PolarHBondContact O-N 3.43Å; F198-L200 VanDerWaalsContact C-N 3.29Å; F198-L200 PolarHBondContact O-N 3.09Å; F198-I201 PolarHBondContact O-N 2.91Å; F198-R202 WeakPolarHBondContact O-CB 3.43Å; F198-R202 PolarHBondContact O-N 3.24Å
199G95.8Very high95.8Very high0 Ų039.1 Ų39.10%019%0.194CC..Hα-helixtrans-60.2-38.2171.500000112.5I25 P196 S203I25-G199 VanDerWaalsContact CD1-O 3.3Å; I25-G199 WeakPolarHBondContact CD1-O 3.43Å; P196-G199 PolarHBondContact O-N 3.27Å; G199-S203 WeakPolarHBondContact O-CB 3.13Å; G199-S203 PolarHBondContact O-N 2.94Å; G199-S203 PolarHBondContact O-OG 3.03Å
200L96.9Very high96Very high30 Ų3039.1 Ų39.116%0.15719%0.194CC..Hα-helixtrans-66.4-44.9176-73.5173.4000112I22 I25 L26 P196 I197 F198 S203 W204I22-L200 HydrophobicContact CG2-CD2 4.37Å; I25-L200 HydrophobicContact CB-CD2 4.3Å; I25-L200 HydrophobicContact CG2-CD2 3.82Å; I25-L200 HydrophobicContact CG2-CG 3.85Å; L26-L200 HydrophobicContact CD1-CD2 4.43Å; L26-L200 HydrophobicContact CD2-CD1 4.1Å; L26-L200 HydrophobicContact CD2-CD2 4Å; L26-L200 HydrophobicContact CG-CD2 3.99Å; P196-L200 WeakPolarHBondContact O-CG 3.45Å; P196-L200 PolarHBondContact O-N 3.48Å; I197-L200 PolarHBondContact O-N 2.91Å; F198-L200 VanDerWaalsContact C-N 3.29Å; F198-L200 PolarHBondContact O-N 3.09Å; L200-S203 PolarHBondContact O-N 3.37Å; L200-W204 WeakPolarHBondContact O-CB 3.35Å; L200-W204 PolarHBondContact O-N 2.86Å
201I97.1Very high96.2Very high56 Ų5636.3 Ų36.329%0.28718%0.181SC..Hα-helixtrans-62.6-45.2176.5-64.1164.4000109.8V185 I197 F198 S203 W204 T205V185-I201 HydrophobicContact CB-CG2 4.34Å; V185-I201 HydrophobicContact CG1-CB 3.94Å; V185-I201 HydrophobicContact CG1-CG2 3.98Å; V185-I201 HydrophobicContact CG2-CB 4.39Å; V185-I201 HydrophobicContact CG2-CG2 3.58Å; I197-I201 HydrophobicContact CD1-CD1 4.38Å; I197-I201 HydrophobicContact CD1-CG1 4.37Å; I197-I201 HydrophobicContact CG1-CD1 4Å; I197-I201 HydrophobicContact CG1-CG1 4.44Å; I197-I201 VanDerWaalsContact O-CG1 3.27Å; I197-I201 WeakPolarHBondContact O-CG1 3.23Å; I197-I201 PolarHBondContact O-N 2.75Å; F198-I201 PolarHBondContact O-N 2.91Å; I201-S203 VanDerWaalsContact C-N 3.32Å; I201-S203 PolarHBondContact O-N 3.08Å; I201-W204 WeakPolarHBondContact O-CB 3.42Å; I201-W204 PolarHBondContact O-N 3.41Å; I201-T205 WeakPolarHBondContact O-CG2 3.36Å; I201-T205 PolarHBondContact O-N 2.62Å
202R96.6Very high96.4Very high0 Ų030.6 Ų30.60%015%0.151CC..Hα-helixtrans-55.5-48.4174.5174.4177.854.474.1-9.1111S21 R50 V185 E189 F198 W204 T205 Y206S21-R202 PolarHBondContact OG-NH1 3.28Å; R50-R202 PolarHBondContact O-NH2 3.38Å; V185-R202 HydrophobicContact CG1-CB 4.02Å; E189-R202 IonicContact OE1-CZ 3Å; E189-R202 IonicContact OE1-NE 3.45Å; E189-R202 PolarHBondContact OE1-NE 2.67Å; E189-R202 IonicContact OE1-NH2 3.68Å; E189-R202 PolarHBondContact OE1-NH2 2.89Å; E189-R202 WeakPolarHBondContact OE2-CD 3.31Å; E189-R202 IonicContact OE2-CZ 2.72Å; E189-R202 IonicContact OE2-NE 3.77Å; E189-R202 PolarHBondContact OE2-NE 2.94Å; E189-R202 IonicContact OE2-NH2 2.76Å; F198-R202 WeakPolarHBondContact O-CB 3.43Å; F198-R202 PolarHBondContact O-N 3.24Å; R202-W204 VanDerWaalsContact C-N 3.31Å; R202-W204 PolarHBondContact O-N 2.89Å; R202-T205 WeakPolarHBondContact O-CB 3.25Å; R202-T205 PolarHBondContact O-N 2.93Å; R202-T205 VanDerWaalsContact O-N 3.08Å; R202-T205 PolarHBondContact O-OG1 3.18Å; R202-Y206 VanDerWaalsContact CD-OH 3.31Å; R202-Y206 WeakPolarHBondContact CD-OH 3.2Å; R202-Y206 HydrophobicContact CG-CE1 4.35Å; R202-Y206 HydrophobicContact CG-CE2 3.75Å; R202-Y206 WeakPolarHBondContact CG-OH 3.36Å; R202-Y206 PolarHBondContact O-N 3.38Å
203S97Very high96.6Very high0 Ų026.7 Ų26.70%013%0.133CC..Hα-helixtrans-66.5-34.1-179.4-49.60000112.6S21 I25 G199 L200 I201 T205 Y206 L207S21-S203 VanDerWaalsContact CB-OG 3.26Å; S21-S203 WeakPolarHBondContact CB-OG 3.46Å; S21-S203 PolarHBondContact OG-OG 2.86Å; I25-S203 WeakPolarHBondContact CD1-OG 3.24Å; G199-S203 WeakPolarHBondContact O-CB 3.13Å; G199-S203 PolarHBondContact O-N 2.94Å; G199-S203 PolarHBondContact O-OG 3.03Å; L200-S203 PolarHBondContact O-N 3.37Å; I201-S203 VanDerWaalsContact C-N 3.32Å; I201-S203 PolarHBondContact O-N 3.08Å; S203-T205 VanDerWaalsContact C-N 3.33Å; S203-Y206 PolarHBondContact O-N 3.27Å; S203-L207 PolarHBondContact O-N 3.08Å
204W97.5Very high96.8Very high44 Ų4429.8 Ų29.817%0.16714%0.139CC..Hα-helixtrans-63.2-38.4170.7174.572000111.7M178 L181 L200 I201 R202 Y206 L207 M208 M249 I256M178-W204 HydrophobicContact CE-CE3 4.04Å; M178-W204 HydrophobicContact CE-CH2 3.91Å; M178-W204 HydrophobicContact CE-CZ3 3.64Å; L181-W204 HydrophobicContact CD2-CE3 4.44Å; L181-W204 HydrophobicContact CD2-CZ3 3.7Å; L200-W204 WeakPolarHBondContact O-CB 3.35Å; L200-W204 PolarHBondContact O-N 2.86Å; I201-W204 WeakPolarHBondContact O-CB 3.42Å; I201-W204 PolarHBondContact O-N 3.41Å; R202-W204 VanDerWaalsContact C-N 3.31Å; R202-W204 PolarHBondContact O-N 2.89Å; W204-Y206 VanDerWaalsContact C-N 3.31Å; W204-Y206 PolarHBondContact O-N 3.33Å; W204-L207 PolarHBondContact O-N 3.13Å; W204-M208 HydrophobicContact CD2-CG 4.02Å; W204-M208 HydrophobicContact CG-CG 4.43Å; W204-M208 HydrophobicContact CH2-CG 4.37Å; W204-M208 HydrophobicContact CZ2-CG 3.71Å; W204-M208 HydrophobicContact CZ2-SD 4.06Å; W204-M208 WeakPolarHBondContact O-CB 3.4Å; W204-M208 WeakPolarHBondContact O-CG 3.29Å; W204-M208 PolarHBondContact O-N 2.84Å; W204-M249 HydrophobicContact CH2-CE 4Å; W204-M249 HydrophobicContact CZ2-CB 4.37Å; W204-M249 HydrophobicContact CZ2-CE 4.01Å; W204-M249 HydrophobicContact CZ2-CG 4.1Å; W204-I256 HydrophobicContact CB-CD1 3.77Å; W204-I256 HydrophobicContact CG-CD1 3.95Å
205T97.6Very high96.9Very high0 Ų027.3 Ų27.30%013%0.128CC..Hα-helixtrans-61-40.1174.471.40000112.1M178 L181 I201 R202 S203 M208 Q209M178-T205 HydrophobicContact CE-CG2 3.78Å; L181-T205 HydrophobicContact CB-CG2 4.25Å; L181-T205 HydrophobicContact CD2-CG2 3.97Å; L181-T205 HydrophobicContact CG-CG2 3.91Å; I201-T205 WeakPolarHBondContact O-CG2 3.36Å; I201-T205 PolarHBondContact O-N 2.62Å; R202-T205 WeakPolarHBondContact O-CB 3.25Å; R202-T205 PolarHBondContact O-N 2.93Å; R202-T205 VanDerWaalsContact O-N 3.08Å; R202-T205 PolarHBondContact O-OG1 3.18Å; S203-T205 VanDerWaalsContact C-N 3.33Å; T205-M208 PolarHBondContact O-N 3.33Å; T205-Q209 VanDerWaalsContact O-CG 3.26Å; T205-Q209 WeakPolarHBondContact O-CG 3.43Å; T205-Q209 PolarHBondContact O-N 3.4Å
206Y97.1Very high97Very high2 Ų222.4 Ų22.41%0.00811%0.105CC..Hα-helixtrans-64.2-45.2174-56.3-29.9000112.2F14 Y17 H146 L150 R202 S203 W204 M208 Q209 G210F14-Y206 WeakPolarHBondContact CB-O 3.47Å; F14-Y206 HydrophobicContact CD1-CD1 4.26Å; F14-Y206 HydrophobicContact CD1-CG 4.49Å; F14-Y206 HydrophobicContact CE1-CD1 4.29Å; Y17-Y206 AromaticContact CD1-CD2 3.54Å; Y17-Y206 HydrophobicContact CD1-CD2 3.54Å; Y17-Y206 AromaticContact CD1-CE2 3.78Å; Y17-Y206 HydrophobicContact CD1-CE2 3.78Å; Y17-Y206 HydrophobicContact CD1-CG 4.35Å; Y17-Y206 AromaticContact CE1-CD2 3.86Å; Y17-Y206 HydrophobicContact CE1-CD2 3.86Å; Y17-Y206 AromaticContact CE1-CE2 3.57Å; Y17-Y206 HydrophobicContact CE1-CE2 3.57Å; H146-Y206 AromaticContact NE2-CZ 3.66Å; H146-Y206 PolarHBondContact NE2-OH 2.85Å; L150-Y206 HydrophobicContact CD2-CE1 4.21Å; R202-Y206 VanDerWaalsContact CD-OH 3.31Å; R202-Y206 WeakPolarHBondContact CD-OH 3.2Å; R202-Y206 HydrophobicContact CG-CE1 4.35Å; R202-Y206 HydrophobicContact CG-CE2 3.75Å; R202-Y206 WeakPolarHBondContact CG-OH 3.36Å; R202-Y206 PolarHBondContact O-N 3.38Å; S203-Y206 PolarHBondContact O-N 3.27Å; W204-Y206 VanDerWaalsContact C-N 3.31Å; W204-Y206 PolarHBondContact O-N 3.33Å; Y206-M208 VanDerWaalsContact C-N 3.3Å; Y206-M208 PolarHBondContact O-N 3.39Å; Y206-Q209 PolarHBondContact O-N 3.24Å; Y206-G210 PolarHBondContact O-N 2.86Å
207L98Very high97Very high4 Ų421.5 Ų21.52%0.02110%0.099CC..Hα-helixtrans-61.7-40.7177.8-172.761.1000111.6I15 L19 I22 S203 W204 G210 T211 N252 V255I15-L207 HydrophobicContact CB-CD1 4.42Å; I15-L207 HydrophobicContact CG1-CD1 4.36Å; I15-L207 HydrophobicContact CG2-CD1 4.12Å; L19-L207 HydrophobicContact CD2-CD1 4.09Å; L19-L207 HydrophobicContact CD2-CD2 4.29Å; L19-L207 HydrophobicContact CG-CD1 4.09Å; I22-L207 HydrophobicContact CD1-CD2 4.08Å; S203-L207 PolarHBondContact O-N 3.08Å; W204-L207 PolarHBondContact O-N 3.13Å; L207-G210 PolarHBondContact O-N 3.32Å; L207-T211 HydrophobicContact CD1-CG2 4.26Å; L207-T211 WeakPolarHBondContact O-CG2 3.5Å; L207-T211 PolarHBondContact O-N 3.18Å; L207-T211 PolarHBondContact O-OG1 2.96Å; L207-N252 HydrophobicContact CD2-CB 3.91Å; L207-N252 HydrophobicContact CG-CB 4.26Å; L207-V255 HydrophobicContact CD2-CG1 4.2Å
208M98.2Very high97Very high0 Ų018.5 Ų18.50%09%0.086CC..Hα-helixtrans-60.8-50.2173-78.3-59.9-55.700111.9M178 W204 T205 Y206 G210 T211 W212 F245 H248 M249 N252M178-M208 HydrophobicContact CE-CB 3.72Å; M178-M208 HydrophobicContact CE-CG 3.84Å; M178-M208 HydrophobicContact CG-CB 4.11Å; M178-M208 HydrophobicContact SD-CB 4.3Å; M178-M208 HydrophobicContact SD-CG 4.49Å; W204-M208 HydrophobicContact CD2-CG 4.02Å; W204-M208 HydrophobicContact CG-CG 4.43Å; W204-M208 HydrophobicContact CH2-CG 4.37Å; W204-M208 HydrophobicContact CZ2-CG 3.71Å; W204-M208 HydrophobicContact CZ2-SD 4.06Å; W204-M208 WeakPolarHBondContact O-CB 3.4Å; W204-M208 WeakPolarHBondContact O-CG 3.29Å; W204-M208 PolarHBondContact O-N 2.84Å; T205-M208 PolarHBondContact O-N 3.33Å; Y206-M208 VanDerWaalsContact C-N 3.3Å; Y206-M208 PolarHBondContact O-N 3.39Å; M208-G210 VanDerWaalsContact C-N 3.27Å; M208-G210 PolarHBondContact O-N 3.04Å; M208-T211 PolarHBondContact O-OG1 3.3Å; M208-W212 WeakPolarHBondContact O-CB 3.44Å; M208-W212 PolarHBondContact O-N 3.27Å; M208-F245 HydrophobicContact CE-CD1 4.39Å; M208-F245 HydrophobicContact CE-CD2 4.09Å; M208-F245 HydrophobicContact CE-CE1 3.87Å; M208-F245 HydrophobicContact CE-CE2 3.53Å; M208-F245 HydrophobicContact CE-CZ 3.41Å; M208-F245 VanDerWaalsContact CE-CZ 3.41Å; M208-H248 HydrophobicContact CE-CB 4.05Å; M208-H248 HydrophobicContact SD-CB 4.44Å; M208-M249 HydrophobicContact CE-CB 4.44Å; M208-M249 HydrophobicContact CE-CG 3.52Å; M208-M249 HydrophobicContact SD-CB 4.32Å; M208-M249 HydrophobicContact SD-CG 3.91Å; M208-N252 WeakPolarHBondContact CA-ND2 3.34Å; M208-N252 HydrophobicContact SD-CB 4.13Å; M208-N252 PolarHBondContact SD-ND2 3.46Å
209Q97.7Very high97Very high0 Ų016.4 Ų16.40%08%0.077CC..Hα-helixtrans-55.6-47.2176.4-70.7178.939.700110.7F14 E153 L175 M178 T205 Y206 W212 F213F14-Q209 HydrophobicContact CD1-CB 4.25Å; F14-Q209 HydrophobicContact CD2-CB 4.49Å; F14-Q209 HydrophobicContact CG-CB 4.19Å; E153-Q209 PolarHBondContact OE1-OE1 3.39Å; L175-Q209 VanDerWaalsContact CD1-CA 3.48Å; L175-Q209 HydrophobicContact CD1-CB 3.68Å; L175-Q209 HydrophobicContact CD1-CG 3.64Å; M178-Q209 HydrophobicContact CB-CG 3.91Å; T205-Q209 VanDerWaalsContact O-CG 3.26Å; T205-Q209 WeakPolarHBondContact O-CG 3.43Å; T205-Q209 PolarHBondContact O-N 3.4Å; Y206-Q209 PolarHBondContact O-N 3.24Å; Q209-W212 PolarHBondContact O-N 3.27Å; Q209-F213 WeakPolarHBondContact O-CB 3.33Å; Q209-F213 WeakPolarHBondContact O-CD2 3.39Å; Q209-F213 PolarHBondContact O-N 2.92Å
210G97.8Very high96.9Very high0 Ų017 Ų170%08%0.08CC..Hα-helixtrans-64.7-50.8-176.700000114.2G11 F14 Y206 L207 M208 W212 F213 W214G11-G210 WeakPolarHBondContact CA-O 3.22Å; G11-G210 CarbonylContact O-C 3.2Å; G11-G210 WeakPolarHBondContact O-CA 3.47Å; F14-G210 VanDerWaalsContact CB-CA 3.42Å; Y206-G210 PolarHBondContact O-N 2.86Å; L207-G210 PolarHBondContact O-N 3.32Å; M208-G210 VanDerWaalsContact C-N 3.27Å; M208-G210 PolarHBondContact O-N 3.04Å; G210-W212 VanDerWaalsContact C-N 3.3Å; G210-W212 PolarHBondContact O-N 3.45Å; G210-F213 PolarHBondContact O-N 2.84Å; G210-W214 PolarHBondContact O-N 2.87Å
211T98.4Very high96.7Very high22 Ų2218.9 Ų18.914%0.1359%0.086CC..Hα-helixtrans-65.4-35.4177.257.90000112I15 L207 M208 W214 Q215 H248 N252I15-T211 HydrophobicContact CD1-CG2 4.11Å; I15-T211 HydrophobicContact CG1-CG2 4.03Å; L207-T211 HydrophobicContact CD1-CG2 4.26Å; L207-T211 WeakPolarHBondContact O-CG2 3.5Å; L207-T211 PolarHBondContact O-N 3.18Å; L207-T211 PolarHBondContact O-OG1 2.96Å; M208-T211 PolarHBondContact O-OG1 3.3Å; T211-W214 WeakPolarHBondContact O-CB 3.4Å; T211-W214 PolarHBondContact O-N 3.38Å; T211-Q215 PolarHBondContact O-N 3.39Å; T211-H248 WeakPolarHBondContact CB-ND1 3.11Å; T211-H248 PolarHBondContact O-CE1 3.07Å; T211-H248 VanDerWaalsContact O-CE1 3.26Å; T211-H248 PolarHBondContact OG1-ND1 3.39Å; T211-N252 PolarHBondContact OG1-ND2 3.32Å
212W98.1Very high96.5Very high0 Ų018.7 Ų18.70%09%0.088CC..Hα-helixtrans-71.9-38.9178.1-168.9-116.2000112.4L171 L174 M208 Q209 G210 W214 Q215 V216 A241 L244 F245 H248L171-W212 HydrophobicContact CD2-CH2 4.09Å; L171-W212 HydrophobicContact CD2-CZ2 3.51Å; L171-W212 PolarHBondContact O-NE1 2.89Å; L174-W212 HydrophobicContact CB-CZ2 4.43Å; L174-W212 HydrophobicContact CD1-CH2 4.17Å; L174-W212 HydrophobicContact CD1-CZ2 3.51Å; M208-W212 WeakPolarHBondContact O-CB 3.44Å; M208-W212 PolarHBondContact O-N 3.27Å; Q209-W212 PolarHBondContact O-N 3.27Å; G210-W212 VanDerWaalsContact C-N 3.3Å; G210-W212 PolarHBondContact O-N 3.45Å; W212-W214 VanDerWaalsContact C-N 3.26Å; W212-W214 PolarHBondContact O-N 2.73Å; W212-Q215 HydrophobicContact CD2-CB 4.41Å; W212-Q215 HydrophobicContact CE3-CB 3.82Å; W212-Q215 HydrophobicContact CE3-CG 3.96Å; W212-Q215 HydrophobicContact CH2-CG 4.38Å; W212-Q215 HydrophobicContact CZ3-CB 4.13Å; W212-Q215 HydrophobicContact CZ3-CG 3.72Å; W212-Q215 CarbonylContact O-C 3.59Å; W212-Q215 WeakPolarHBondContact O-CA 3.27Å; W212-Q215 WeakPolarHBondContact O-CB 3.29Å; W212-Q215 PolarHBondContact O-N 2.84Å; W212-V216 HydrophobicContact CD2-CG2 4.42Å; W212-V216 HydrophobicContact CG-CG2 4.28Å; W212-V216 WeakPolarHBondContact O-CG2 3.37Å; W212-V216 PolarHBondContact O-N 3.44Å; W212-A241 WeakPolarHBondContact CH2-O 3.33Å; W212-L244 HydrophobicContact CZ3-CG 4.34Å; W212-F245 HydrophobicContact CB-CE2 4.4Å; W212-F245 AromaticContact CD2-CD2 3.48Å; W212-F245 HydrophobicContact CD2-CD2 3.48Å; W212-F245 VanDerWaalsContact CD2-CD2 3.48Å; W212-F245 HydrophobicContact CD2-CE2 4.02Å; W212-F245 AromaticContact CE2-CD2 3.69Å; W212-F245 HydrophobicContact CE3-CB 4.3Å; W212-F245 AromaticContact CE3-CD2 3.58Å; W212-F245 HydrophobicContact CE3-CD2 3.58Å; W212-F245 HydrophobicContact CE3-CE2 4.42Å; W212-F245 HydrophobicContact CE3-CG 4.42Å; W212-F245 AromaticContact CG-CD2 3.96Å; W212-F245 HydrophobicContact CG-CD2 3.96Å; W212-F245 AromaticContact CG-CE2 3.99Å; W212-F245 HydrophobicContact CG-CE2 3.99Å; W212-F245 HydrophobicContact CH2-CB 3.72Å; W212-F245 HydrophobicContact CH2-CD2 4.09Å; W212-F245 HydrophobicContact CH2-CG 4.42Å; W212-F245 HydrophobicContact CZ2-CB 4.24Å; W212-F245 AromaticContact CZ2-CD2 3.99Å; W212-F245 HydrophobicContact CZ2-CD2 3.99Å; W212-F245 HydrophobicContact CZ3-CB 3.74Å; W212-F245 AromaticContact CZ3-CD2 3.88Å; W212-F245 HydrophobicContact CZ3-CD2 3.88Å; W212-F245 HydrophobicContact CZ3-CG 4.33Å; W212-H248 AromaticContact CE3-CD2 3.82Å; W212-H248 AromaticContact CZ3-CD2 3.88Å
213F96.6Very high96.1Very high11 Ų1125.7 Ų25.75%0.04812%0.119CC..Hα-helixtrans-53.4-44.6172-92.5-59.5000112.1H7 F14 F157 L175 Q209 G210 Q215 V216 G217H7-F213 HydrophobicContact CB-CD1 4.47Å; H7-F213 VanDerWaalsContact CB-O 3.27Å; H7-F213 WeakPolarHBondContact CB-O 3.41Å; H7-F213 WeakPolarHBondContact O-CB 3.48Å; F14-F213 AromaticContact CD2-CD2 3.94Å; F14-F213 HydrophobicContact CD2-CD2 3.94Å; F14-F213 AromaticContact CD2-CE2 3.74Å; F14-F213 HydrophobicContact CD2-CE2 3.74Å; F14-F213 HydrophobicContact CE2-CD2 4.32Å; F14-F213 AromaticContact CE2-CE2 3.64Å; F14-F213 HydrophobicContact CE2-CE2 3.64Å; F157-F213 HydrophobicContact CE1-CZ 4.5Å; F157-F213 HydrophobicContact CE2-CZ 4.12Å; F157-F213 AromaticContact CZ-CE1 3.74Å; F157-F213 HydrophobicContact CZ-CE1 3.74Å; F157-F213 AromaticContact CZ-CZ 3.53Å; F157-F213 HydrophobicContact CZ-CZ 3.53Å; L175-F213 HydrophobicContact CD1-CD2 4.35Å; L175-F213 HydrophobicContact CD1-CE2 4.21Å; L175-F213 HydrophobicContact CD2-CD1 3.83Å; L175-F213 HydrophobicContact CD2-CD2 4.13Å; L175-F213 HydrophobicContact CD2-CE1 3.36Å; L175-F213 HydrophobicContact CD2-CE2 3.68Å; L175-F213 HydrophobicContact CD2-CG 4.2Å; L175-F213 HydrophobicContact CD2-CZ 3.3Å; L175-F213 HydrophobicContact CG-CE2 4.49Å; L175-F213 HydrophobicContact CG-CZ 4.43Å; Q209-F213 WeakPolarHBondContact O-CB 3.33Å; Q209-F213 WeakPolarHBondContact O-CD2 3.39Å; Q209-F213 PolarHBondContact O-N 2.92Å; G210-F213 PolarHBondContact O-N 2.84Å; F213-Q215 VanDerWaalsContact C-N 3.31Å; F213-Q215 PolarHBondContact O-N 3.5Å; F213-V216 PolarHBondContact O-N 3.39Å; F213-G217 PolarHBondContact O-N 2.97Å
214W97.2Very high95.7Very high106 Ų10628.3 Ų28.340%0.40213%0.134SC..Hα-helixtrans-58.2-44.2172.9-88.686.6000112.2F4 A8 S12 G210 T211 W212 G217 A218F4-W214 HydrophobicContact CE1-CE3 4.26Å; F4-W214 HydrophobicContact CE1-CH2 4.44Å; F4-W214 AromaticContact CE1-CZ3 3.83Å; F4-W214 HydrophobicContact CE1-CZ3 3.83Å; F4-W214 AromaticContact CZ-CE3 3.65Å; F4-W214 HydrophobicContact CZ-CE3 3.65Å; F4-W214 AromaticContact CZ-CZ3 3.51Å; F4-W214 HydrophobicContact CZ-CZ3 3.51Å; A8-W214 HydrophobicContact CB-CD2 3.9Å; A8-W214 HydrophobicContact CB-CE3 4.09Å; A8-W214 HydrophobicContact CB-CH2 4.04Å; A8-W214 HydrophobicContact CB-CZ2 3.84Å; A8-W214 HydrophobicContact CB-CZ3 4.17Å; A8-W214 PolarHBondContact O-NE1 2.91Å; A8-W214 VanDerWaalsContact O-NE1 3.16Å; S12-W214 WeakPolarHBondContact OG-CZ2 3.32Å; S12-W214 PolarHBondContact OG-NE1 3.27Å; S12-W214 VanDerWaalsContact OG-NE1 3.09Å; G210-W214 PolarHBondContact O-N 2.87Å; T211-W214 WeakPolarHBondContact O-CB 3.4Å; T211-W214 PolarHBondContact O-N 3.38Å; W212-W214 VanDerWaalsContact C-N 3.26Å; W212-W214 PolarHBondContact O-N 2.73Å; W214-G217 PolarHBondContact O-N 2.93Å; W214-A218 PolarHBondContact O-N 3.29Å
215Q96.9Very high95.3Very high46 Ų4632.5 Ų32.522%0.21517%0.17CC..Hα-helixtrans-66.1-41.1178.5-168.357.456.100112.8T211 W212 F213 G217 A218 I219 L244 H248T211-Q215 PolarHBondContact O-N 3.39Å; W212-Q215 HydrophobicContact CD2-CB 4.41Å; W212-Q215 HydrophobicContact CE3-CB 3.82Å; W212-Q215 HydrophobicContact CE3-CG 3.96Å; W212-Q215 HydrophobicContact CH2-CG 4.38Å; W212-Q215 HydrophobicContact CZ3-CB 4.13Å; W212-Q215 HydrophobicContact CZ3-CG 3.72Å; W212-Q215 CarbonylContact O-C 3.59Å; W212-Q215 WeakPolarHBondContact O-CA 3.27Å; W212-Q215 WeakPolarHBondContact O-CB 3.29Å; W212-Q215 PolarHBondContact O-N 2.84Å; F213-Q215 VanDerWaalsContact C-N 3.31Å; F213-Q215 PolarHBondContact O-N 3.5Å; Q215-G217 VanDerWaalsContact C-N 3.34Å; Q215-A218 PolarHBondContact O-N 3.42Å; Q215-I219 HydrophobicContact CG-CD1 3.95Å; Q215-I219 VanDerWaalsContact O-CG1 3.31Å; Q215-I219 WeakPolarHBondContact O-CG1 3.39Å; Q215-I219 PolarHBondContact O-N 2.87Å; Q215-L244 HydrophobicContact CG-CD2 3.66Å; Q215-L244 HydrophobicContact CG-CG 4.16Å; Q215-L244 VanDerWaalsContact NE2-CD2 3.35Å; Q215-H248 PolarHBondContact OE1-NE2 2.85Å
216V95.8Very high95Very high1 Ų141.6 Ų41.61%0.00621%0.205CC..Hα-helixtrans-60.9-45.4174176.40000110.2H7 L171 W212 F213 A218 I219 L220H7-V216 VanDerWaalsContact CD2-CG1 3.48Å; H7-V216 WeakPolarHBondContact CD2-CG1 3.37Å; L171-V216 HydrophobicContact CB-CG1 4.42Å; L171-V216 HydrophobicContact CB-CG2 4Å; L171-V216 HydrophobicContact CD1-CG1 4.36Å; W212-V216 HydrophobicContact CD2-CG2 4.42Å; W212-V216 HydrophobicContact CG-CG2 4.28Å; W212-V216 WeakPolarHBondContact O-CG2 3.37Å; W212-V216 PolarHBondContact O-N 3.44Å; F213-V216 PolarHBondContact O-N 3.39Å; V216-A218 VanDerWaalsContact C-N 3.31Å; V216-A218 PolarHBondContact O-N 3.25Å; V216-I219 PolarHBondContact O-N 3.46Å; V216-L220 HydrophobicContact CG1-CD1 3.66Å; V216-L220 HydrophobicContact CG1-CG 4.23Å; V216-L220 WeakPolarHBondContact O-CB 3Å; V216-L220 PolarHBondContact O-N 3.45Å
217G95.1Very high94.6Very high0 Ų042.8 Ų42.80%021%0.211CC..Hα-helixtrans-56.3-44.817400000112.3F4 F213 W214 Q215 Y221F4-G217 VanDerWaalsContact CD2-C 3.45Å; F4-G217 WeakPolarHBondContact CD2-O 3.44Å; F213-G217 PolarHBondContact O-N 2.97Å; W214-G217 PolarHBondContact O-N 2.93Å; Q215-G217 VanDerWaalsContact C-N 3.34Å; G217-Y221 CarbonylContact O-C 3.36Å; G217-Y221 WeakPolarHBondContact O-CA 3.47Å; G217-Y221 WeakPolarHBondContact O-CB 3.39Å; G217-Y221 PolarHBondContact O-N 3.48Å
218A95.3Very high94.2Very high20 Ų2046.8 Ų46.817%0.16524%0.237CC..Hα-helixtrans-67.8-38.5179.300000113.4F4 W214 Q215 V216 M227F4-A218 HydrophobicContact CE2-CB 4.15Å; W214-A218 PolarHBondContact O-N 3.29Å; Q215-A218 PolarHBondContact O-N 3.42Å; V216-A218 VanDerWaalsContact C-N 3.31Å; V216-A218 PolarHBondContact O-N 3.25Å; A218-M227 HydrophobicContact CB-SD 4.3Å
219I95.5Very high93.9Very high3 Ų355.2 Ų55.22%0.01528%0.277CS..Hα-helixtrans-72.9-47.4-179.9-69.1169000111.3L167 L171 Q215 V216 W230 L244L167-I219 HydrophobicContact CD2-CG2 3.81Å; L167-I219 HydrophobicContact CG-CG2 4.5Å; L171-I219 HydrophobicContact CD1-CB 4.08Å; L171-I219 HydrophobicContact CD1-CD1 4.36Å; L171-I219 HydrophobicContact CD1-CG2 3.7Å; L171-I219 HydrophobicContact CD2-CD1 3.78Å; Q215-I219 HydrophobicContact CG-CD1 3.95Å; Q215-I219 VanDerWaalsContact O-CG1 3.31Å; Q215-I219 WeakPolarHBondContact O-CG1 3.39Å; Q215-I219 PolarHBondContact O-N 2.87Å; V216-I219 PolarHBondContact O-N 3.46Å; I219-W230 HydrophobicContact CD1-CZ2 4.44Å; I219-W230 HydrophobicContact CG1-CD2 4.46Å; I219-W230 HydrophobicContact CG1-CZ2 4.43Å; I219-W230 HydrophobicContact CG2-CB 3.99Å; I219-W230 HydrophobicContact CG2-CD2 4.01Å; I219-W230 HydrophobicContact CG2-CG 3.71Å; I219-L244 HydrophobicContact CD1-CD2 4.2Å
220L94.1Very high93.8Very high11 Ų1158.2 Ų58.26%0.05829%0.288CS..Hα-helixtrans-82.4-27.5-174.4-64.2-178.5000112.9D168 L171 V216D168-L220 HydrophobicContact CB-CD1 4.25Å; D168-L220 HydrophobicContact CB-CD2 4.01Å; L171-L220 HydrophobicContact CD1-CD1 4.27Å; L171-L220 HydrophobicContact CD1-CD2 3.83Å; L171-L220 HydrophobicContact CD1-CG 3.83Å; V216-L220 HydrophobicContact CG1-CD1 3.66Å; V216-L220 HydrophobicContact CG1-CG 4.23Å; V216-L220 WeakPolarHBondContact O-CB 3Å; V216-L220 PolarHBondContact O-N 3.45Å
221Y93.4Very high93.6Very high71 Ų7162.8 Ų62.828%0.27831%0.313SS..SBendtrans-138.763.3-172.7-51.8-72.7000111.7G2 T3 F4 H7 G217 K223G2-Y221 VanDerWaalsContact C-CE1 3.44Å; G2-Y221 VanDerWaalsContact CA-OH 3.23Å; G2-Y221 WeakPolarHBondContact CA-OH 3.46Å; G2-Y221 WeakPolarHBondContact O-CD1 3.41Å; G2-Y221 WeakPolarHBondContact O-CE1 2.91Å; T3-Y221 VanDerWaalsContact C-CD2 3.46Å; F4-Y221 VanDerWaalsContact N-CB 3.33Å; H7-Y221 AromaticContact CE1-CE2 3.51Å; H7-Y221 AromaticContact ND1-CE2 3.93Å; G217-Y221 CarbonylContact O-C 3.36Å; G217-Y221 WeakPolarHBondContact O-CA 3.47Å; G217-Y221 WeakPolarHBondContact O-CB 3.39Å; G217-Y221 PolarHBondContact O-N 3.48Å; Y221-K223 PolarHBondContact O-N 3.34Å
222P92Very high93.3Very high51 Ų5164 Ų6433%0.33132%0.317SS..  trans-56.7123.9178.325-34000110.2M227P222-M227 HydrophobicContact CB-CB 3.72Å; P222-M227 HydrophobicContact CB-SD 4.32Å
223K88.3Confident93.1Very high148 Ų14869.4 Ų69.464%0.64334%0.342SS*.  trans-97.4-11.3-177.7-81.9-138.4175.8-166.70114.2F4 Y221F4-K223 HydrophobicContact CB-CD 4.13Å; F4-K223 HydrophobicContact CB-CG 3.7Å; F4-K223 HydrophobicContact CD1-CD 4.29Å; F4-K223 HydrophobicContact CD1-CG 4.32Å; F4-K223 HydrophobicContact CD2-CG 4.47Å; F4-K223 HydrophobicContact CG-CD 4.34Å; F4-K223 HydrophobicContact CG-CG 3.93Å; Y221-K223 PolarHBondContact O-N 3.34Å
224T88.9Confident92.9Very high54 Ų5470.3 Ų70.333%0.33135%0.351SS..SBendtrans-139.3145.9-170.550.10000109.7W226 M227T224-W226 VanDerWaalsContact CB-NE1 3.27Å; T224-W226 PolarHBondContact O-N 3Å; T224-W226 PolarHBondContact OG1-NE1 3.13Å; T224-M227 WeakPolarHBondContact O-CB 3.34Å; T224-M227 PolarHBondContact O-N 3.26Å; T224-M227 WeakPolarHBondContact OG1-CG 3.24Å
225S88.9Confident92.6Very high132 Ų13274 Ų7492%0.92337%0.37SS*.THydrogen-bonded Turntrans-61.2-18-176.551.50000115.3
226W91Very high92.4Very high192 Ų19279 Ų7973%0.72739%0.393SS*.THydrogen-bonded Turntrans-84.5-12.9176.361.8-99.5000113.6T224T224-W226 VanDerWaalsContact CB-NE1 3.27Å; T224-W226 PolarHBondContact O-N 3Å; T224-W226 PolarHBondContact OG1-NE1 3.13Å
227M89.5Confident92.4Very high26 Ų2679.5 Ų79.513%0.12840%0.397CS..SBendtrans-78127.7175.2-72.7176.1-17700108.9F4 A218 P222 T224F4-M227 HydrophobicContact CE2-CE 4.11Å; A218-M227 HydrophobicContact CB-SD 4.3Å; P222-M227 HydrophobicContact CB-CB 3.72Å; P222-M227 HydrophobicContact CB-SD 4.32Å; T224-M227 WeakPolarHBondContact O-CB 3.34Å; T224-M227 PolarHBondContact O-N 3.26Å; T224-M227 WeakPolarHBondContact OG1-CG 3.24Å
228P90Very high92.3Very high88 Ų8881.7 Ų81.757%0.57141%0.408SS*.PPolyproline II helixtrans-65.7139.7179.226.8-33.5000110.8W230P228-W230 VanDerWaalsContact O-CD1 3.26Å
229E91.9Very high92.4Very high178 Ų17884 Ų8483%0.83242%0.422SS*.PPolyproline II helixtrans-80.9129.9170-67.4-174.217400109.9
230W94.3Very high92.4Very high62 Ų6285.8 Ų85.824%0.23544%0.437CS..PPolyproline II helixtrans-101.6128.6-179.5-71.769.6000110.4L167 I219 P228 Q232 A240 L244L167-W230 HydrophobicContact CD2-CB 3.82Å; L167-W230 HydrophobicContact CD2-CE3 4.1Å; L167-W230 HydrophobicContact CD2-CG 4.45Å; I219-W230 HydrophobicContact CD1-CZ2 4.44Å; I219-W230 HydrophobicContact CG1-CD2 4.46Å; I219-W230 HydrophobicContact CG1-CZ2 4.43Å; I219-W230 HydrophobicContact CG2-CB 3.99Å; I219-W230 HydrophobicContact CG2-CD2 4.01Å; I219-W230 HydrophobicContact CG2-CG 3.71Å; P228-W230 VanDerWaalsContact O-CD1 3.26Å; W230-Q232 PolarHBondContact O-N 2.74Å; W230-Q232 VanDerWaalsContact O-N 3.11Å; W230-A240 HydrophobicContact CH2-CB 3.88Å; W230-A240 HydrophobicContact CZ3-CB 3.66Å; W230-L244 HydrophobicContact CZ2-CD2 4.46Å
231D93.8Very high92.5Very high97 Ų9785.3 Ų85.352%0.51944%0.435SS..  trans-70.4106.8167.1-178.9-10.8000108.9Q233 A234 S237D231-Q233 PolarHBondContact O-N 2.98Å; D231-Q233 WeakPolarHBondContact OD1-CA 3.14Å; D231-Q233 WeakPolarHBondContact OD1-CB 3.15Å; D231-Q233 PolarHBondContact OD1-N 3.04Å; D231-A234 HydrophobicContact CB-CB 3.71Å; D231-A234 VanDerWaalsContact CG-CB 3.49Å; D231-A234 PolarHBondContact O-N 2.96Å; D231-A234 PolarHBondContact OD1-N 3.29Å; D231-A234 WeakPolarHBondContact OD2-CB 3.38Å; D231-S237 WeakPolarHBondContact O-CB 3.45Å; D231-S237 PolarHBondContact O-OG 3.04Å
232Q92.7Very high92.6Very high47 Ų4784.2 Ų84.222%0.2244%0.44CS..SBendtrans-73.3-10.9-176.6-55.2-171.822.800113.7N165 P166 L167 W230N165-Q232 HydrophobicContact CB-CB 3.74Å; N165-Q232 PolarHBondContact ND2-OE1 3.28Å; P166-Q232 WeakPolarHBondContact CD-O 3.32Å; L167-Q232 HydrophobicContact CB-CB 4.02Å; L167-Q232 HydrophobicContact CB-CG 4.49Å; L167-Q232 WeakPolarHBondContact CB-O 3.24Å; L167-Q232 HydrophobicContact CD2-CB 4.44Å; L167-Q232 HydrophobicContact CD2-CG 4.18Å; L167-Q232 PolarHBondContact N-O 3.32Å; W230-Q232 PolarHBondContact O-N 2.74Å; W230-Q232 VanDerWaalsContact O-N 3.11Å
233Q93.3Very high92.9Very high114 Ų11485.8 Ų85.853%0.53345%0.446SS..SBendtrans-103-20.1178.2-65.1-67.6-19.200112.1N165 D231 K235N165-Q233 PolarHBondContact OD1-NE2 3.27Å; D231-Q233 PolarHBondContact O-N 2.98Å; D231-Q233 WeakPolarHBondContact OD1-CA 3.14Å; D231-Q233 WeakPolarHBondContact OD1-CB 3.15Å; D231-Q233 PolarHBondContact OD1-N 3.04Å; Q233-K235 PolarHBondContact O-N 2.94Å
234A92.4Very high93.3Very high30 Ų3080.7 Ų80.725%0.24843%0.425CS..  trans-62.8127.8176.200000111.9D231 Q236 S237D231-A234 HydrophobicContact CB-CB 3.71Å; D231-A234 VanDerWaalsContact CG-CB 3.49Å; D231-A234 PolarHBondContact O-N 2.96Å; D231-A234 PolarHBondContact OD1-N 3.29Å; D231-A234 WeakPolarHBondContact OD2-CB 3.38Å; A234-Q236 PolarHBondContact O-N 3.42Å; A234-Q236 VanDerWaalsContact O-N 3.15Å; A234-S237 WeakPolarHBondContact O-CB 3.39Å; A234-S237 PolarHBondContact O-N 3.39Å; A234-S237 VanDerWaalsContact O-N 3.08Å; A234-S237 PolarHBondContact O-OG 3.37Å
235K91.1Very high93.8Very high182 Ų18279 Ų7979%0.79141%0.413SS*.THydrogen-bonded Turntrans-57.3-30.6175.7-66.3-178.2179.5179.10113Q233 S237 P239Q233-K235 PolarHBondContact O-N 2.94Å; K235-S237 VanDerWaalsContact C-N 3.29Å; K235-S237 PolarHBondContact O-N 3.4Å; K235-P239 WeakPolarHBondContact O-CD 2.98Å
236Q94Very high94.2Very high151 Ų15175 Ų7571%0.70639%0.388SS*.THydrogen-bonded Turntrans-72.5-21.1-178.9-61.1-57.9-24.700113.2A234 I238 P239 A240A234-Q236 PolarHBondContact O-N 3.42Å; A234-Q236 VanDerWaalsContact O-N 3.15Å; Q236-I238 VanDerWaalsContact C-N 3.25Å; Q236-I238 PolarHBondContact O-N 3Å; Q236-P239 VanDerWaalsContact O-CD 3.3Å; Q236-P239 WeakPolarHBondContact O-CD 3.44Å; Q236-P239 WeakPolarHBondContact O-CG 3.3Å; Q236-A240 WeakPolarHBondContact O-CB 3.26Å; Q236-A240 PolarHBondContact O-N 3.3Å
237S94.7Very high94.5Very high12 Ų1272.6 Ų72.68%0.08438%0.38CS..Hα-helixtrans-66.2-29.5179.2-59.10000112.3D231 A234 K235 A241D231-S237 WeakPolarHBondContact O-CB 3.45Å; D231-S237 PolarHBondContact O-OG 3.04Å; A234-S237 WeakPolarHBondContact O-CB 3.39Å; A234-S237 PolarHBondContact O-N 3.39Å; A234-S237 VanDerWaalsContact O-N 3.08Å; A234-S237 PolarHBondContact O-OG 3.37Å; K235-S237 VanDerWaalsContact C-N 3.29Å; K235-S237 PolarHBondContact O-N 3.4Å; S237-A241 VanDerWaalsContact O-CB 3.32Å; S237-A241 WeakPolarHBondContact O-CB 3.29Å; S237-A241 PolarHBondContact O-N 3.11Å
238I94.2Very high94.9Very high46 Ų4673 Ų7324%0.23638%0.381CS..Hα-helixtrans-67.3-57.6-180-60.6165.6000112.1P166 Y170 Q236 A240 A241 A242P166-I238 HydrophobicContact CB-CD1 4.46Å; Y170-I238 HydrophobicContact CD1-CG2 3.89Å; Y170-I238 HydrophobicContact CD2-CD1 3.6Å; Y170-I238 HydrophobicContact CD2-CG1 3.76Å; Y170-I238 HydrophobicContact CD2-CG2 4.02Å; Y170-I238 HydrophobicContact CE1-CG2 4.2Å; Y170-I238 HydrophobicContact CE2-CD1 3.54Å; Y170-I238 HydrophobicContact CE2-CG1 4.21Å; Y170-I238 HydrophobicContact CE2-CG2 4.35Å; Y170-I238 HydrophobicContact CG-CD1 4.46Å; Y170-I238 HydrophobicContact CG-CG1 4.25Å; Y170-I238 HydrophobicContact CG-CG2 3.8Å; Q236-I238 VanDerWaalsContact C-N 3.25Å; Q236-I238 PolarHBondContact O-N 3Å; I238-A240 VanDerWaalsContact C-N 3.26Å; I238-A240 PolarHBondContact O-N 2.97Å; I238-A241 PolarHBondContact O-N 2.94Å; I238-A242 PolarHBondContact O-N 2.88Å
239P95.9Very high95.3Very high69 Ų6972.3 Ų72.345%0.44837%0.372SS..Hα-helixtrans-64-31.817724.6-33.7000112.4K235 Q236 A242 N243K235-P239 WeakPolarHBondContact O-CD 2.98Å; Q236-P239 VanDerWaalsContact O-CD 3.3Å; Q236-P239 WeakPolarHBondContact O-CD 3.44Å; Q236-P239 WeakPolarHBondContact O-CG 3.3Å; P239-A242 PolarHBondContact O-N 3.06Å; P239-N243 WeakPolarHBondContact O-CB 3.43Å; P239-N243 PolarHBondContact O-N 2.9Å
240A96Very high95.5Very high41 Ų4168.3 Ų68.334%0.33936%0.356SS..Hα-helixtrans-64-42.6173.800000112.2W230 Q236 I238 N243 L244W230-A240 HydrophobicContact CH2-CB 3.88Å; W230-A240 HydrophobicContact CZ3-CB 3.66Å; Q236-A240 WeakPolarHBondContact O-CB 3.26Å; Q236-A240 PolarHBondContact O-N 3.3Å; I238-A240 VanDerWaalsContact C-N 3.26Å; I238-A240 PolarHBondContact O-N 2.97Å; A240-N243 PolarHBondContact O-N 3.46Å; A240-L244 PolarHBondContact O-N 3.41Å
241A96.3Very high95.7Very high1 Ų166.9 Ų66.91%0.00836%0.36CS..Hα-helixtrans-63.8-41.7173.300000112.2L167 L171 W212 S237 I238 N243 L244 F245L167-A241 HydrophobicContact CD1-CB 3.97Å; L171-A241 HydrophobicContact CD2-CB 3.74Å; W212-A241 WeakPolarHBondContact CH2-O 3.33Å; S237-A241 VanDerWaalsContact O-CB 3.32Å; S237-A241 WeakPolarHBondContact O-CB 3.29Å; S237-A241 PolarHBondContact O-N 3.11Å; I238-A241 PolarHBondContact O-N 2.94Å; A241-N243 PolarHBondContact O-N 3.41Å; A241-L244 PolarHBondContact O-N 3.03Å; A241-F245 PolarHBondContact O-N 3.04Å
242A96.3Very high95.9Very high47 Ų4762.7 Ų62.739%0.38834%0.338SS..Hα-helixtrans-62.8-40.6175.800000112.4I238 P239 L244 F245 A246I238-A242 PolarHBondContact O-N 2.88Å; P239-A242 PolarHBondContact O-N 3.06Å; A242-L244 VanDerWaalsContact C-N 3.35Å; A242-F245 WeakPolarHBondContact O-CB 3.3Å; A242-F245 PolarHBondContact O-N 3.06Å; A242-A246 PolarHBondContact O-N 2.94Å; A242-A246 VanDerWaalsContact O-N 3.08Å
243N97.4Very high96.1Very high85 Ų8567.4 Ų67.446%0.45535%0.354SS..Hα-helixtrans-64.2-40.8174.5-173.662.6000111.7P239 A240 A241 F245 A246 Y247P239-N243 WeakPolarHBondContact O-CB 3.43Å; P239-N243 PolarHBondContact O-N 2.9Å; A240-N243 PolarHBondContact O-N 3.46Å; A241-N243 PolarHBondContact O-N 3.41Å; N243-F245 VanDerWaalsContact C-N 3.33Å; N243-F245 PolarHBondContact O-N 3.31Å; N243-A246 WeakPolarHBondContact O-CB 3.34Å; N243-A246 PolarHBondContact O-N 3.43Å; N243-Y247 VanDerWaalsContact ND2-CE2 3.28Å; N243-Y247 WeakPolarHBondContact ND2-CE2 3.49Å; N243-Y247 PolarHBondContact O-N 3.04Å; N243-Y247 VanDerWaalsContact O-N 3.14Å
244L97.3Very high96.3Very high40 Ų4066 Ų6621%0.20935%0.349CS..Hα-helixtrans-63.1-40.8174.9-173.156.1000111.8W212 Q215 I219 W230 A240 A241 A242 A246 Y247 H248W212-L244 HydrophobicContact CZ3-CG 4.34Å; Q215-L244 HydrophobicContact CG-CD2 3.66Å; Q215-L244 HydrophobicContact CG-CG 4.16Å; Q215-L244 VanDerWaalsContact NE2-CD2 3.35Å; I219-L244 HydrophobicContact CD1-CD2 4.2Å; W230-L244 HydrophobicContact CZ2-CD2 4.46Å; A240-L244 PolarHBondContact O-N 3.41Å; A241-L244 PolarHBondContact O-N 3.03Å; A242-L244 VanDerWaalsContact C-N 3.35Å; L244-A246 VanDerWaalsContact C-N 3.28Å; L244-A246 PolarHBondContact O-N 3.25Å; L244-Y247 HydrophobicContact CD1-CD2 4.37Å; L244-Y247 WeakPolarHBondContact O-CB 3.26Å; L244-Y247 PolarHBondContact O-N 2.89Å; L244-H248 PolarHBondContact O-CD2 3.41Å; L244-H248 PolarHBondContact O-N 3.24Å
245F97.8Very high96.6Very high18 Ų1866.9 Ų66.98%0.07935%0.352CS..Hα-helixtrans-57.7-40172.8-172.2-98.2000112.2L174 M178 M208 W212 A241 A242 N243 Y247 H248 M249L174-F245 HydrophobicContact CB-CD2 4.03Å; L174-F245 HydrophobicContact CB-CE2 4.02Å; L174-F245 HydrophobicContact CB-CG 4.47Å; L174-F245 HydrophobicContact CB-CZ 4.45Å; L174-F245 HydrophobicContact CD1-CB 4.03Å; L174-F245 HydrophobicContact CD1-CD2 4.26Å; L174-F245 HydrophobicContact CD1-CG 4.16Å; L174-F245 HydrophobicContact CD2-CD1 4.1Å; L174-F245 HydrophobicContact CD2-CE1 4.4Å; L174-F245 HydrophobicContact CD2-CG 4.17Å; M178-F245 HydrophobicContact CG-CE2 4.32Å; M178-F245 HydrophobicContact CG-CZ 3.74Å; M178-F245 HydrophobicContact SD-CE1 4.42Å; M178-F245 HydrophobicContact SD-CZ 3.79Å; M208-F245 HydrophobicContact CE-CD1 4.39Å; M208-F245 HydrophobicContact CE-CD2 4.09Å; M208-F245 HydrophobicContact CE-CE1 3.87Å; M208-F245 HydrophobicContact CE-CE2 3.53Å; M208-F245 HydrophobicContact CE-CZ 3.41Å; M208-F245 VanDerWaalsContact CE-CZ 3.41Å; W212-F245 HydrophobicContact CB-CE2 4.4Å; W212-F245 AromaticContact CD2-CD2 3.48Å; W212-F245 HydrophobicContact CD2-CD2 3.48Å; W212-F245 VanDerWaalsContact CD2-CD2 3.48Å; W212-F245 HydrophobicContact CD2-CE2 4.02Å; W212-F245 AromaticContact CE2-CD2 3.69Å; W212-F245 HydrophobicContact CE3-CB 4.3Å; W212-F245 AromaticContact CE3-CD2 3.58Å; W212-F245 HydrophobicContact CE3-CD2 3.58Å; W212-F245 HydrophobicContact CE3-CE2 4.42Å; W212-F245 HydrophobicContact CE3-CG 4.42Å; W212-F245 AromaticContact CG-CD2 3.96Å; W212-F245 HydrophobicContact CG-CD2 3.96Å; W212-F245 AromaticContact CG-CE2 3.99Å; W212-F245 HydrophobicContact CG-CE2 3.99Å; W212-F245 HydrophobicContact CH2-CB 3.72Å; W212-F245 HydrophobicContact CH2-CD2 4.09Å; W212-F245 HydrophobicContact CH2-CG 4.42Å; W212-F245 HydrophobicContact CZ2-CB 4.24Å; W212-F245 AromaticContact CZ2-CD2 3.99Å; W212-F245 HydrophobicContact CZ2-CD2 3.99Å; W212-F245 HydrophobicContact CZ3-CB 3.74Å; W212-F245 AromaticContact CZ3-CD2 3.88Å; W212-F245 HydrophobicContact CZ3-CD2 3.88Å; W212-F245 HydrophobicContact CZ3-CG 4.33Å; A241-F245 PolarHBondContact O-N 3.04Å; A242-F245 WeakPolarHBondContact O-CB 3.3Å; A242-F245 PolarHBondContact O-N 3.06Å; N243-F245 VanDerWaalsContact C-N 3.33Å; N243-F245 PolarHBondContact O-N 3.31Å; F245-Y247 VanDerWaalsContact C-N 3.33Å; F245-Y247 PolarHBondContact O-N 3.11Å; F245-H248 WeakPolarHBondContact O-CB 3.24Å; F245-H248 PolarHBondContact O-N 3.39Å; F245-H248 VanDerWaalsContact O-N 3.13Å; F245-M249 HydrophobicContact CD1-CG 4.25Å; F245-M249 HydrophobicContact CD1-SD 4Å; F245-M249 HydrophobicContact CE1-CG 4.11Å; F245-M249 HydrophobicContact CE1-SD 3.88Å; F245-M249 WeakPolarHBondContact O-CG 3.28Å; F245-M249 PolarHBondContact O-N 3.32Å
246A97.8Very high96.9Very high48 Ų4859.6 Ų59.640%0.39732%0.321SS..Hα-helixtrans-63.5-35.7174.200000112.6A242 N243 L244 M249 L250A242-A246 PolarHBondContact O-N 2.94Å; A242-A246 VanDerWaalsContact O-N 3.08Å; N243-A246 WeakPolarHBondContact O-CB 3.34Å; N243-A246 PolarHBondContact O-N 3.43Å; L244-A246 VanDerWaalsContact C-N 3.28Å; L244-A246 PolarHBondContact O-N 3.25Å; A246-M249 WeakPolarHBondContact O-CB 3.3Å; A246-M249 PolarHBondContact O-N 2.98Å; A246-L250 PolarHBondContact O-N 2.98Å
247Y98Very high97Very high142 Ų14254.9 Ų54.956%0.55730%0.303SS*.Hα-helixtrans-65.9-35.9171.3-68.1-47.9000112.8N243 L244 F245 M249 L250 G251N243-Y247 VanDerWaalsContact ND2-CE2 3.28Å; N243-Y247 WeakPolarHBondContact ND2-CE2 3.49Å; N243-Y247 PolarHBondContact O-N 3.04Å; N243-Y247 VanDerWaalsContact O-N 3.14Å; L244-Y247 HydrophobicContact CD1-CD2 4.37Å; L244-Y247 WeakPolarHBondContact O-CB 3.26Å; L244-Y247 PolarHBondContact O-N 2.89Å; F245-Y247 VanDerWaalsContact C-N 3.33Å; F245-Y247 PolarHBondContact O-N 3.11Å; Y247-M249 VanDerWaalsContact C-N 3.35Å; Y247-L250 PolarHBondContact O-N 2.82Å; Y247-G251 PolarHBondContact O-N 3.33Å
248H98.2Very high97.2Very high34 Ų3459 Ų5916%0.15732%0.323CS..Hα-helixtrans-61.7-42.4170.2-82-100.1000111.8M208 T211 W212 Q215 L244 F245 L250 G251 N252M208-H248 HydrophobicContact CE-CB 4.05Å; M208-H248 HydrophobicContact SD-CB 4.44Å; T211-H248 WeakPolarHBondContact CB-ND1 3.11Å; T211-H248 PolarHBondContact O-CE1 3.07Å; T211-H248 VanDerWaalsContact O-CE1 3.26Å; T211-H248 PolarHBondContact OG1-ND1 3.39Å; W212-H248 AromaticContact CE3-CD2 3.82Å; W212-H248 AromaticContact CZ3-CD2 3.88Å; Q215-H248 PolarHBondContact OE1-NE2 2.85Å; L244-H248 PolarHBondContact O-CD2 3.41Å; L244-H248 PolarHBondContact O-N 3.24Å; F245-H248 WeakPolarHBondContact O-CB 3.24Å; F245-H248 PolarHBondContact O-N 3.39Å; F245-H248 VanDerWaalsContact O-N 3.13Å; H248-L250 PolarHBondContact O-N 3.31Å; H248-G251 PolarHBondContact O-N 2.86Å; H248-N252 WeakPolarHBondContact O-CB 3.37Å; H248-N252 VanDerWaalsContact O-CG 3.29Å; H248-N252 PolarHBondContact O-N 3.39Å; H248-N252 PolarHBondContact O-ND2 3.28Å
249M97.2Very high97.3Very high75 Ų7558 Ų5837%0.36932%0.318SS..Hα-helixtrans-58.5-47.3174.7-64.71766400111.5W204 M208 F245 A246 Y247 N252 Y253W204-M249 HydrophobicContact CH2-CE 4Å; W204-M249 HydrophobicContact CZ2-CB 4.37Å; W204-M249 HydrophobicContact CZ2-CE 4.01Å; W204-M249 HydrophobicContact CZ2-CG 4.1Å; M208-M249 HydrophobicContact CE-CB 4.44Å; M208-M249 HydrophobicContact CE-CG 3.52Å; M208-M249 HydrophobicContact SD-CB 4.32Å; M208-M249 HydrophobicContact SD-CG 3.91Å; F245-M249 HydrophobicContact CD1-CG 4.25Å; F245-M249 HydrophobicContact CD1-SD 4Å; F245-M249 HydrophobicContact CE1-CG 4.11Å; F245-M249 HydrophobicContact CE1-SD 3.88Å; F245-M249 WeakPolarHBondContact O-CG 3.28Å; F245-M249 PolarHBondContact O-N 3.32Å; A246-M249 WeakPolarHBondContact O-CB 3.3Å; A246-M249 PolarHBondContact O-N 2.98Å; Y247-M249 VanDerWaalsContact C-N 3.35Å; M249-N252 PolarHBondContact O-N 2.87Å; M249-Y253 WeakPolarHBondContact O-CB 3.4Å; M249-Y253 PolarHBondContact O-N 2.69Å
250L97.6Very high97.3Very high94 Ų9456 Ų5649%0.49231%0.305SS..Hα-helixtrans-62.7-46.2177.8179.361.7000112.1A246 Y247 H248 Y253 I254A246-L250 PolarHBondContact O-N 2.98Å; Y247-L250 PolarHBondContact O-N 2.82Å; H248-L250 PolarHBondContact O-N 3.31Å; L250-Y253 WeakPolarHBondContact O-CB 3.32Å; L250-Y253 PolarHBondContact O-N 3.11Å; L250-I254 HydrophobicContact CD1-CD1 4.34Å; L250-I254 HydrophobicContact CG-CD1 4.21Å; L250-I254 WeakPolarHBondContact O-CG1 3.14Å; L250-I254 PolarHBondContact O-N 2.97Å
251G98Very high97.3Very high31 Ų3158 Ų5832%0.3231%0.309SS..Hα-helixtrans-60.4-47177.900000112.1Y247 H248 Y253 I254 V255Y247-G251 PolarHBondContact O-N 3.33Å; H248-G251 PolarHBondContact O-N 2.86Å; G251-Y253 VanDerWaalsContact C-N 3.33Å; G251-Y253 PolarHBondContact O-N 2.92Å; G251-I254 PolarHBondContact O-N 3.49Å; G251-V255 WeakPolarHBondContact O-CG2 3.38Å; G251-V255 PolarHBondContact O-N 3.45Å
252N98Very high97.3Very high10 Ų1061.5 Ų61.55%0.05333%0.33CS..Hα-helixtrans-66.3-34.7178.4-71.5-16.4000112.4L207 M208 T211 H248 M249 V255 I256L207-N252 HydrophobicContact CD2-CB 3.91Å; L207-N252 HydrophobicContact CG-CB 4.26Å; M208-N252 WeakPolarHBondContact CA-ND2 3.34Å; M208-N252 HydrophobicContact SD-CB 4.13Å; M208-N252 PolarHBondContact SD-ND2 3.46Å; T211-N252 PolarHBondContact OG1-ND2 3.32Å; H248-N252 WeakPolarHBondContact O-CB 3.37Å; H248-N252 VanDerWaalsContact O-CG 3.29Å; H248-N252 PolarHBondContact O-N 3.39Å; H248-N252 PolarHBondContact O-ND2 3.28Å; M249-N252 PolarHBondContact O-N 2.87Å; N252-V255 PolarHBondContact O-N 3.37Å; N252-I256 WeakPolarHBondContact O-CG1 3.33Å; N252-I256 PolarHBondContact O-N 3.43Å
253Y96.3Very high97.2Very high146 Ų14659.2 Ų59.257%0.57331%0.311SS*.Hα-helixtrans-60.7-47.4170.8170-103.1000111.8M249 L250 G251 V255 I256 V257M249-Y253 WeakPolarHBondContact O-CB 3.4Å; M249-Y253 PolarHBondContact O-N 2.69Å; L250-Y253 WeakPolarHBondContact O-CB 3.32Å; L250-Y253 PolarHBondContact O-N 3.11Å; G251-Y253 VanDerWaalsContact C-N 3.33Å; G251-Y253 PolarHBondContact O-N 2.92Å; Y253-V255 VanDerWaalsContact C-N 3.31Å; Y253-V255 PolarHBondContact O-N 3.44Å; Y253-I256 PolarHBondContact O-N 3.2Å; Y253-V257 HydrophobicContact CD2-CG2 4.48Å; Y253-V257 HydrophobicContact CE1-CG2 4.08Å; Y253-V257 HydrophobicContact CE2-CG2 4.02Å; Y253-V257 WeakPolarHBondContact O-CG2 3.47Å; Y253-V257 PolarHBondContact O-N 3.46Å
254I97.9Very high97Very high83 Ų8357.1 Ų57.143%0.42630%0.299SS..Hα-helixtrans-59.9-42.5176.8-67165.5000110.8L250 G251 I256 V257 L258L250-I254 HydrophobicContact CD1-CD1 4.34Å; L250-I254 HydrophobicContact CG-CD1 4.21Å; L250-I254 WeakPolarHBondContact O-CG1 3.14Å; L250-I254 PolarHBondContact O-N 2.97Å; G251-I254 PolarHBondContact O-N 3.49Å; I254-I256 PolarHBondContact O-N 2.97Å; I254-V257 PolarHBondContact O-N 3.38Å; I254-L258 HydrophobicContact CG2-CD1 4Å; I254-L258 HydrophobicContact CG2-CG 4.25Å; I254-L258 WeakPolarHBondContact O-CG 3.45Å; I254-L258 PolarHBondContact O-N 2.98Å
255V98.2Very high96.7Very high50 Ų5060.6 Ų60.630%0.30332%0.317SS..Hα-helixtrans-58.2-45.6176.2170.60000111.5L19 L207 G251 N252 Y253 V257 L258 I259L19-V255 HydrophobicContact CD2-CG1 3.66Å; L207-V255 HydrophobicContact CD2-CG1 4.2Å; G251-V255 WeakPolarHBondContact O-CG2 3.38Å; G251-V255 PolarHBondContact O-N 3.45Å; N252-V255 PolarHBondContact O-N 3.37Å; Y253-V255 VanDerWaalsContact C-N 3.31Å; Y253-V255 PolarHBondContact O-N 3.44Å; V255-V257 VanDerWaalsContact C-N 3.35Å; V255-V257 PolarHBondContact O-N 3.38Å; V255-L258 PolarHBondContact O-N 2.97Å; V255-I259 HydrophobicContact CG1-CD1 3.84Å; V255-I259 HydrophobicContact CG1-CG1 4.48Å; V255-I259 WeakPolarHBondContact O-CG1 3.33Å; V255-I259 PolarHBondContact O-N 3.07Å
256I97.6Very high96.4Very high28 Ų2867.5 Ų67.514%0.14434%0.343CS..Hα-helixtrans-62-42.4177.2-68.6165.6000111.3I22 W204 N252 Y253 I254 I259 T260I22-I256 HydrophobicContact CD1-CD1 4.27Å; I22-I256 HydrophobicContact CD1-CG1 3.75Å; I22-I256 HydrophobicContact CG1-CG1 4.43Å; W204-I256 HydrophobicContact CB-CD1 3.77Å; W204-I256 HydrophobicContact CG-CD1 3.95Å; N252-I256 WeakPolarHBondContact O-CG1 3.33Å; N252-I256 PolarHBondContact O-N 3.43Å; Y253-I256 PolarHBondContact O-N 3.2Å; I254-I256 PolarHBondContact O-N 2.97Å; I256-I259 PolarHBondContact O-N 3.29Å; I256-T260 WeakPolarHBondContact O-CB 3.44Å; I256-T260 PolarHBondContact O-N 3.05Å; I256-T260 PolarHBondContact O-OG1 3.14Å
257V96.8Very high96Very high53 Ų5365.9 Ų65.932%0.32133%0.328SS..Hα-helixtrans-61.4-45.6176.4171.50000111.1Y253 I254 V255 T260 I261Y253-V257 HydrophobicContact CD2-CG2 4.48Å; Y253-V257 HydrophobicContact CE1-CG2 4.08Å; Y253-V257 HydrophobicContact CE2-CG2 4.02Å; Y253-V257 WeakPolarHBondContact O-CG2 3.47Å; Y253-V257 PolarHBondContact O-N 3.46Å; I254-V257 PolarHBondContact O-N 3.38Å; V255-V257 VanDerWaalsContact C-N 3.35Å; V255-V257 PolarHBondContact O-N 3.38Å; V257-T260 WeakPolarHBondContact O-CB 3.41Å; V257-T260 PolarHBondContact O-N 3.25Å; V257-I261 HydrophobicContact CG1-CD1 3.84Å; V257-I261 HydrophobicContact CG1-CG1 4.49Å; V257-I261 WeakPolarHBondContact O-CG1 3.29Å; V257-I261 PolarHBondContact O-N 2.88Å
258L97.6Very high95.5Very high99 Ų9966.2 Ų66.252%0.51833%0.332SS..Hα-helixtrans-62-46.5178.5-69.1175000111.7I254 V255 T260 I261 T262I254-L258 HydrophobicContact CG2-CD1 4Å; I254-L258 HydrophobicContact CG2-CG 4.25Å; I254-L258 WeakPolarHBondContact O-CG 3.45Å; I254-L258 PolarHBondContact O-N 2.98Å; V255-L258 PolarHBondContact O-N 2.97Å; L258-T260 VanDerWaalsContact C-N 3.31Å; L258-T260 PolarHBondContact O-N 3.09Å; L258-I261 PolarHBondContact O-N 3.48Å; L258-T262 PolarHBondContact O-N 3.39Å; L258-T262 PolarHBondContact O-OG1 3.39Å
259I97.7Very high94.7Very high24 Ų2465 Ų6512%0.12333%0.327CS..Hα-helixtrans-61.1-42.6176.2-62.9166.2000110.5L19 I22 W23 L26 V255 I256 I261 T262 V263L19-I259 HydrophobicContact CD2-CD1 3.86Å; I22-I259 HydrophobicContact CB-CD1 4.48Å; I22-I259 HydrophobicContact CG2-CB 4.28Å; I22-I259 HydrophobicContact CG2-CD1 3.87Å; I22-I259 HydrophobicContact CG2-CG2 4.03Å; W23-I259 HydrophobicContact CE3-CG2 3.89Å; L26-I259 HydrophobicContact CD1-CB 4.32Å; L26-I259 HydrophobicContact CD1-CG2 3.73Å; V255-I259 HydrophobicContact CG1-CD1 3.84Å; V255-I259 HydrophobicContact CG1-CG1 4.48Å; V255-I259 WeakPolarHBondContact O-CG1 3.33Å; V255-I259 PolarHBondContact O-N 3.07Å; I256-I259 PolarHBondContact O-N 3.29Å; I259-I261 PolarHBondContact O-N 2.9Å; I259-T262 PolarHBondContact O-N 3.21Å; I259-V263 HydrophobicContact CG2-CG2 4.15Å; I259-V263 WeakPolarHBondContact O-CG2 3.39Å; I259-V263 PolarHBondContact O-N 3.02Å
260T95.9Very high93.5Very high28 Ų2864.4 Ų64.417%0.17233%0.33CS..Hα-helixtrans-57.7-49.2177-59.70000111.3L26 Y30 I256 V257 L258 T262 V263 M264L26-T260 HydrophobicContact CD2-CG2 4.45Å; Y30-T260 HydrophobicContact CE2-CG2 4.07Å; Y30-T260 WeakPolarHBondContact OH-CG2 3.46Å; I256-T260 WeakPolarHBondContact O-CB 3.44Å; I256-T260 PolarHBondContact O-N 3.05Å; I256-T260 PolarHBondContact O-OG1 3.14Å; V257-T260 WeakPolarHBondContact O-CB 3.41Å; V257-T260 PolarHBondContact O-N 3.25Å; L258-T260 VanDerWaalsContact C-N 3.31Å; L258-T260 PolarHBondContact O-N 3.09Å; T260-T262 PolarHBondContact O-N 3.16Å; T260-V263 PolarHBondContact O-N 2.68Å; T260-M264 HydrophobicContact CG2-CG 4.47Å; T260-M264 HydrophobicContact CG2-SD 4.05Å; T260-M264 WeakPolarHBondContact O-CB 3.43Å; T260-M264 VanDerWaalsContact O-CG 3.26Å; T260-M264 WeakPolarHBondContact O-CG 3.42Å; T260-M264 PolarHBondContact O-N 3.19Å
261I95.2Very high91.7Very high83 Ų8367.6 Ų67.643%0.42635%0.347SS..Hα-helixtrans-59.8-47.7176.8-67.5165.9000110.5V257 L258 I259 V263 M264 I265V257-I261 HydrophobicContact CG1-CD1 3.84Å; V257-I261 HydrophobicContact CG1-CG1 4.49Å; V257-I261 WeakPolarHBondContact O-CG1 3.29Å; V257-I261 PolarHBondContact O-N 2.88Å; L258-I261 PolarHBondContact O-N 3.48Å; I259-I261 PolarHBondContact O-N 2.9Å; I261-V263 PolarHBondContact O-N 3.4Å; I261-M264 PolarHBondContact O-N 2.9Å; I261-I265 HydrophobicContact CG2-CD1 3.8Å; I261-I265 HydrophobicContact CG2-CG1 4.48Å; I261-I265 VanDerWaalsContact O-CG1 3.29Å; I261-I265 WeakPolarHBondContact O-CG1 3.23Å; I261-I265 PolarHBondContact O-N 3.06Å
262T96.1Very high90Very high73 Ų7368.4 Ų68.445%0.44834%0.343SS..Hα-helixtrans-57.9-46.1178.3-59.90000111.9W23 L258 I259 T260 I265 R266W23-T262 HydrophobicContact CH2-CG2 4.17Å; W23-T262 HydrophobicContact CZ3-CG2 4.06Å; L258-T262 PolarHBondContact O-N 3.39Å; L258-T262 PolarHBondContact O-OG1 3.39Å; I259-T262 PolarHBondContact O-N 3.21Å; T260-T262 PolarHBondContact O-N 3.16Å; T262-I265 PolarHBondContact O-N 3.24Å; T262-R266 WeakPolarHBondContact O-CB 3.49Å; T262-R266 PolarHBondContact O-N 2.93Å
263V94.9Very high88.3Confident0 Ų071.1 Ų71.10%036%0.363CS..Hα-helixtrans-68-39.9179174.80000111.5W23 L26 E27 Y30 I259 T260 I261 I265 R266 T267W23-V263 HydrophobicContact CD2-CG2 4.33Å; W23-V263 HydrophobicContact CE3-CG2 4.16Å; W23-V263 HydrophobicContact CH2-CG2 4.42Å; W23-V263 HydrophobicContact CZ3-CG2 4.2Å; L26-V263 HydrophobicContact CB-CB 4.22Å; L26-V263 HydrophobicContact CB-CG1 4.03Å; L26-V263 HydrophobicContact CB-CG2 4.11Å; E27-V263 HydrophobicContact CB-CG1 4.42Å; Y30-V263 HydrophobicContact CD2-CB 4.4Å; Y30-V263 HydrophobicContact CD2-CG1 3.7Å; Y30-V263 HydrophobicContact CG-CG1 4.32Å; I259-V263 HydrophobicContact CG2-CG2 4.15Å; I259-V263 WeakPolarHBondContact O-CG2 3.39Å; I259-V263 PolarHBondContact O-N 3.02Å; T260-V263 PolarHBondContact O-N 2.68Å; I261-V263 PolarHBondContact O-N 3.4Å; V263-I265 VanDerWaalsContact C-N 3.32Å; V263-I265 PolarHBondContact O-N 3.3Å; V263-R266 PolarHBondContact O-N 3.42Å; V263-T267 HydrophobicContact CG1-CG2 4.14Å; V263-T267 WeakPolarHBondContact O-CB 3.46Å; V263-T267 WeakPolarHBondContact O-CG2 3.13Å; V263-T267 PolarHBondContact O-N 2.84Å; V263-T267 PolarHBondContact O-OG1 3.09Å
264M92.6Very high86.9Confident40 Ų4067.8 Ų67.820%0.19736%0.355CS..Hα-helixtrans-60.9-40.2175.5-76.9178.463.700112.5Y30 T260 I261 T267 K268 V269Y30-M264 HydrophobicContact CD1-CG 4.04Å; Y30-M264 HydrophobicContact CD2-CG 4.21Å; Y30-M264 HydrophobicContact CE1-CG 3.5Å; Y30-M264 HydrophobicContact CE1-SD 4.14Å; Y30-M264 HydrophobicContact CE2-CG 3.71Å; Y30-M264 HydrophobicContact CG-CG 4.37Å; Y30-M264 PolarHBondContact OH-SD 2.8Å; Y30-M264 VanDerWaalsContact OH-SD 3.4Å; T260-M264 HydrophobicContact CG2-CG 4.47Å; T260-M264 HydrophobicContact CG2-SD 4.05Å; T260-M264 WeakPolarHBondContact O-CB 3.43Å; T260-M264 VanDerWaalsContact O-CG 3.26Å; T260-M264 WeakPolarHBondContact O-CG 3.42Å; T260-M264 PolarHBondContact O-N 3.19Å; I261-M264 PolarHBondContact O-N 2.9Å; M264-T267 PolarHBondContact O-OG1 3.42Å; M264-K268 PolarHBondContact O-N 3.43Å; M264-K268 VanDerWaalsContact O-N 3.17Å; M264-V269 PolarHBondContact O-N 3.05Å
265I91.6Very high85.5Confident114 Ų11471.7 Ų71.759%0.58537%0.369SS*.Hα-helixtrans-65-50.3174.8-67.2167.1000109.5I261 T262 V263 T267 K268I261-I265 HydrophobicContact CG2-CD1 3.8Å; I261-I265 HydrophobicContact CG2-CG1 4.48Å; I261-I265 VanDerWaalsContact O-CG1 3.29Å; I261-I265 WeakPolarHBondContact O-CG1 3.23Å; I261-I265 PolarHBondContact O-N 3.06Å; T262-I265 PolarHBondContact O-N 3.24Å; V263-I265 VanDerWaalsContact C-N 3.32Å; V263-I265 PolarHBondContact O-N 3.3Å; I265-T267 VanDerWaalsContact C-N 3.31Å; I265-T267 PolarHBondContact O-N 3.26Å; I265-K268 PolarHBondContact O-N 3.37Å; I265-K268 VanDerWaalsContact O-N 3.08Å
266R91.9Very high84.2Confident163 Ų16372.2 Ų72.262%0.61537%0.372SS*.Hα-helixtrans-58.8-38.9-179.2-178.6179.9169.288.3-3.2113.1E27 T262 V263 K268E27-R266 IonicContact OE1-NE 2.77Å; E27-R266 PolarHBondContact OE1-NE 3.03Å; E27-R266 IonicContact OE1-NH2 3.68Å; T262-R266 WeakPolarHBondContact O-CB 3.49Å; T262-R266 PolarHBondContact O-N 2.93Å; V263-R266 PolarHBondContact O-N 3.42Å; R266-K268 VanDerWaalsContact C-N 3.33Å
267T89.3Confident82.7Confident13 Ų1372.9 Ų72.98%0.0838%0.375CS..THydrogen-bonded Turntrans-88.20.5-18056.40000113.6Y30 Q31 S34 V263 M264 I265 V269Y30-T267 WeakPolarHBondContact CB-OG1 3.49Å; Q31-T267 HydrophobicContact CG-CG2 4.13Å; S34-T267 WeakPolarHBondContact CB-O 3.29Å; S34-T267 PolarHBondContact OG-O 2.98Å; V263-T267 HydrophobicContact CG1-CG2 4.14Å; V263-T267 WeakPolarHBondContact O-CB 3.46Å; V263-T267 WeakPolarHBondContact O-CG2 3.13Å; V263-T267 PolarHBondContact O-N 2.84Å; V263-T267 PolarHBondContact O-OG1 3.09Å; M264-T267 PolarHBondContact O-OG1 3.42Å; I265-T267 VanDerWaalsContact C-N 3.31Å; I265-T267 PolarHBondContact O-N 3.26Å; T267-V269 PolarHBondContact O-N 3.48Å
268K86.5Confident81.5Confident150 Ų15078.2 Ų78.265%0.65239%0.389SS*.THydrogen-bonded Turntrans60.921.2-178.3-53178.8-178.9175.90114.2K39 M264 I265 R266 S270K39-K268 WeakPolarHBondContact CD-O 3.38Å; K39-K268 WeakPolarHBondContact CE-O 3.45Å; K39-K268 PolarHBondContact NZ-O 2.72Å; M264-K268 PolarHBondContact O-N 3.43Å; M264-K268 VanDerWaalsContact O-N 3.17Å; I265-K268 PolarHBondContact O-N 3.37Å; I265-K268 VanDerWaalsContact O-N 3.08Å; R266-K268 VanDerWaalsContact C-N 3.33Å; K268-S270 VanDerWaalsContact C-N 3.31Å; K268-S270 PolarHBondContact O-N 3.05Å
269V82.5Confident80.4Confident8 Ų877.3 Ų77.35%0.04839%0.388CS..  trans-81.5-8.6-178.2178.70000112.9Y30 K33 L37 M264 T267Y30-V269 HydrophobicContact CD1-CB 4.03Å; Y30-V269 HydrophobicContact CD1-CG1 3.86Å; Y30-V269 HydrophobicContact CD1-CG2 4.26Å; Y30-V269 HydrophobicContact CE1-CG1 4.19Å; Y30-V269 WeakPolarHBondContact O-CG2 3.4Å; K33-V269 HydrophobicContact CD-CG1 4.02Å; K33-V269 HydrophobicContact CG-CG1 4.1Å; L37-V269 HydrophobicContact CD1-CG1 4.29Å; M264-V269 PolarHBondContact O-N 3.05Å; T267-V269 PolarHBondContact O-N 3.48Å
270S71.8Confident79.1Confident63 Ų6381.6 Ų81.644%0.44140%0.403SS..THydrogen-bonded Turntrans-39.1132.8-171.5-167.10000117.7K268 M272K268-S270 VanDerWaalsContact C-N 3.31Å; K268-S270 PolarHBondContact O-N 3.05Å; S270-M272 PolarHBondContact O-N 2.92Å
271L59.8Low77.8Confident160 Ų16083.1 Ų83.184%0.83841%0.409SS*.THydrogen-bonded Turntrans30.838.9162.1-88.1146.4000118S273L271-S273 PolarHBondContact O-N 3.27Å
272M61.9Low76.8Confident48 Ų4882 Ų8224%0.23641%0.409CS..  trans-66.9130.9166.8-131.8172.860.500108.6L37 S270 D274 T276 M277L37-M272 HydrophobicContact CD2-CE 3.9Å; S270-M272 PolarHBondContact O-N 2.92Å; M272-D274 PolarHBondContact O-N 3.35Å; M272-T276 HydrophobicContact CE-CG2 3.65Å; M272-T276 WeakPolarHBondContact CE-O 3.23Å; M272-T276 HydrophobicContact CG-CG2 3.85Å; M272-T276 HydrophobicContact SD-CG2 3.76Å; M272-M277 HydrophobicContact CE-CB 4.13Å
273S63.2Low75.7Confident68 Ų6887.1 Ų87.148%0.47642%0.42SS..  trans-51.6139.4173.9179.90000110.1L271 K275 T276 M277L271-S273 PolarHBondContact O-N 3.27Å; S273-K275 PolarHBondContact O-N 2.94Å; S273-K275 VanDerWaalsContact O-N 3.08Å; S273-T276 WeakPolarHBondContact O-CA 3.48Å; S273-T276 WeakPolarHBondContact O-CB 3.27Å; S273-T276 PolarHBondContact O-N 3.49Å; S273-M277 PolarHBondContact O-N 3.44Å
274D66.4Low74.3Confident76 Ų7689.3 Ų89.341%0.40643%0.429SS..Hα-helixtrans-50.6-36.7178.7-171.240.2000111.5M272 T276 M277 R278M272-D274 PolarHBondContact O-N 3.35Å; D274-T276 PolarHBondContact O-N 3.11Å; D274-M277 WeakPolarHBondContact O-CB 3.43Å; D274-M277 PolarHBondContact O-N 2.92Å; D274-M277 VanDerWaalsContact OD1-CE 3.23Å; D274-M277 WeakPolarHBondContact OD1-CE 3.4Å; D274-R278 WeakPolarHBondContact O-CG 3.38Å; D274-R278 PolarHBondContact O-N 2.93Å; D274-R278 IonicContact OD1-NE 3.25Å; D274-R278 IonicContact OD2-CZ 2.85Å; D274-R278 IonicContact OD2-NE 3.4Å; D274-R278 PolarHBondContact OD2-NE 2.77Å; D274-R278 IonicContact OD2-NH2 3.53Å; D274-R278 PolarHBondContact OD2-NH2 2.94Å; D274-R278 VanDerWaalsContact OD2-NH2 3.09Å
275K68.6Low72.9Confident165 Ų16593.3 Ų93.372%0.71745%0.447SS*.Hα-helixtrans-56.6-52.9173.8-69.4-175.6178.7-1780111.8S273 M277 R278 T279S273-K275 PolarHBondContact O-N 2.94Å; S273-K275 VanDerWaalsContact O-N 3.08Å; K275-M277 PolarHBondContact O-N 3.29Å; K275-R278 PolarHBondContact O-N 2.86Å; K275-T279 PolarHBondContact O-N 3.4Å; K275-T279 PolarHBondContact O-OG1 3.31Å
276T69.4Low71.7Confident60 Ų6094.1 Ų94.137%0.36845%0.448SS..Hα-helixtrans-63.3-34.6179.4-46.50000111.4M272 S273 D274 R280M272-T276 HydrophobicContact CE-CG2 3.65Å; M272-T276 WeakPolarHBondContact CE-O 3.23Å; M272-T276 HydrophobicContact CG-CG2 3.85Å; M272-T276 HydrophobicContact SD-CG2 3.76Å; S273-T276 WeakPolarHBondContact O-CA 3.48Å; S273-T276 WeakPolarHBondContact O-CB 3.27Å; S273-T276 PolarHBondContact O-N 3.49Å; D274-T276 PolarHBondContact O-N 3.11Å; T276-R280 WeakPolarHBondContact O-CG 3.4Å; T276-R280 PolarHBondContact O-N 3.04Å
277M67.3Low70.2Confident42 Ų4290.4 Ų90.421%0.20745%0.446CS..Hα-helixtrans-66.5-53.1178-173.8179.270.600111K33 L37 M272 S273 D274 K275 T279 R280 L281K33-M277 WeakPolarHBondContact CE-SD 3.36Å; K33-M277 PolarHBondContact NZ-SD 3.43Å; L37-M277 HydrophobicContact CD2-CG 4.46Å; M272-M277 HydrophobicContact CE-CB 4.13Å; S273-M277 PolarHBondContact O-N 3.44Å; D274-M277 WeakPolarHBondContact O-CB 3.43Å; D274-M277 PolarHBondContact O-N 2.92Å; D274-M277 VanDerWaalsContact OD1-CE 3.23Å; D274-M277 WeakPolarHBondContact OD1-CE 3.4Å; K275-M277 PolarHBondContact O-N 3.29Å; M277-T279 VanDerWaalsContact C-N 3.33Å; M277-T279 PolarHBondContact O-N 3.46Å; M277-R280 PolarHBondContact O-N 3.36Å; M277-R280 VanDerWaalsContact O-N 3.15Å; M277-L281 HydrophobicContact CG-CD1 4.08Å; M277-L281 WeakPolarHBondContact O-CG 3.33Å; M277-L281 PolarHBondContact O-N 3.23Å
278R70.3Confident68.7Low166 Ų16694.6 Ų94.663%0.62647%0.465SS*.Hα-helixtrans-57.9-44.6178.3-70.2-178.7-168.7-118.63.2111.8D274 K275 R280 L281 S282D274-R278 WeakPolarHBondContact O-CG 3.38Å; D274-R278 PolarHBondContact O-N 2.93Å; D274-R278 IonicContact OD1-NE 3.25Å; D274-R278 IonicContact OD2-CZ 2.85Å; D274-R278 IonicContact OD2-NE 3.4Å; D274-R278 PolarHBondContact OD2-NE 2.77Å; D274-R278 IonicContact OD2-NH2 3.53Å; D274-R278 PolarHBondContact OD2-NH2 2.94Å; D274-R278 VanDerWaalsContact OD2-NH2 3.09Å; K275-R278 PolarHBondContact O-N 2.86Å; R278-R280 VanDerWaalsContact C-N 3.29Å; R278-R280 PolarHBondContact O-N 3.26Å; R278-L281 PolarHBondContact O-N 3.45Å; R278-S282 WeakPolarHBondContact O-CB 3.4Å; R278-S282 PolarHBondContact O-N 3.44Å; R278-S282 PolarHBondContact O-OG 3.2Å
279T74.6Confident67.3Low79 Ų7993 Ų9349%0.48546%0.459SS..Hα-helixtrans-62.2-34.3178.8-54.10000112.9K275 M277 S282 R283K275-T279 PolarHBondContact O-N 3.4Å; K275-T279 PolarHBondContact O-OG1 3.31Å; M277-T279 VanDerWaalsContact C-N 3.33Å; M277-T279 PolarHBondContact O-N 3.46Å; T279-S282 PolarHBondContact O-OG 2.87Å; T279-R283 WeakPolarHBondContact O-CB 3.37Å; T279-R283 PolarHBondContact O-N 3.01Å
280R70.5Confident66.1Low114 Ų11495.6 Ų95.643%0.4348%0.476SS..Hα-helixtrans-76-39.1177.3-73.8-166.2-171.6-168.9-1112.4L37 T276 M277 R278 R284L37-R280 HydrophobicContact CD2-CB 4.05Å; L37-R280 PolarHBondContact O-NH1 2.89Å; L37-R280 VanDerWaalsContact O-NH1 3.15Å; T276-R280 WeakPolarHBondContact O-CG 3.4Å; T276-R280 PolarHBondContact O-N 3.04Å; M277-R280 PolarHBondContact O-N 3.36Å; M277-R280 VanDerWaalsContact O-N 3.15Å; R278-R280 VanDerWaalsContact C-N 3.29Å; R278-R280 PolarHBondContact O-N 3.26Å; R280-R284 PolarHBondContact O-N 3.12Å
281L70.2Confident65.4Low60 Ų6098.7 Ų98.731%0.31448%0.484SS..Hα-helixtrans-64.2-48.6176.1-69.5171.6000110.8E36 M277 R278 R283 R284 E285E36-L281 HydrophobicContact CB-CD2 4.47Å; M277-L281 HydrophobicContact CG-CD1 4.08Å; M277-L281 WeakPolarHBondContact O-CG 3.33Å; M277-L281 PolarHBondContact O-N 3.23Å; R278-L281 PolarHBondContact O-N 3.45Å; L281-R283 VanDerWaalsContact C-N 3.35Å; L281-R283 PolarHBondContact O-N 2.91Å; L281-R284 WeakPolarHBondContact O-CB 3.5Å; L281-R284 PolarHBondContact O-N 3.38Å; L281-E285 PolarHBondContact O-N 3.08Å
282S73.9Confident65.3Low61 Ų6196.9 Ų96.943%0.42747%0.471SS..Hα-helixtrans-64-36.9179.165.80000113.1R278 T279 R284 E285 H286R278-S282 WeakPolarHBondContact O-CB 3.4Å; R278-S282 PolarHBondContact O-N 3.44Å; R278-S282 PolarHBondContact O-OG 3.2Å; T279-S282 PolarHBondContact O-OG 2.87Å; S282-R284 PolarHBondContact O-N 3.32Å; S282-E285 PolarHBondContact O-N 3.45Å; S282-H286 WeakPolarHBondContact O-CB 3.35Å; S282-H286 PolarHBondContact O-N 3.41Å
283R71.5Confident65.2Low180 Ų180101.2 Ų101.268%0.67949%0.49SS*.Hα-helixtrans-62.2-33.2174.1-171.9-177.1-69.7-168.5-3.9111.7T279 L281 C287T279-R283 WeakPolarHBondContact O-CB 3.37Å; T279-R283 PolarHBondContact O-N 3.01Å; L281-R283 VanDerWaalsContact C-N 3.35Å; L281-R283 PolarHBondContact O-N 2.91Å; R283-C287 PolarHBondContact O-N 3.15Å; R283-C287 VanDerWaalsContact O-N 3.14Å
284R66Low65.1Low46 Ų46104.1 Ų104.117%0.17450%0.497CS..Hα-helixtrans-73.8-44.5178.3-140.1-175.5-158.7-148.59.8111.4Y35 E36 N38 R280 L281 S282 H286 C287 Q288Y35-R284 PolarHBondContact O-NH2 3.35Å; E36-R284 PolarHBondContact O-NE 3.42Å; N38-R284 PolarHBondContact OD1-NH2 2.83Å; R280-R284 PolarHBondContact O-N 3.12Å; L281-R284 WeakPolarHBondContact O-CB 3.5Å; L281-R284 PolarHBondContact O-N 3.38Å; S282-R284 PolarHBondContact O-N 3.32Å; R284-H286 VanDerWaalsContact C-N 3.27Å; R284-H286 PolarHBondContact O-N 3.16Å; R284-C287 PolarHBondContact O-N 3.37Å; R284-Q288 WeakPolarHBondContact O-CG 3.38Å; R284-Q288 PolarHBondContact O-N 3.38Å
285E64.5Low64.8Low123 Ų123106.7 Ų106.758%0.57551%0.506SS*.Hα-helixtrans-56.2-43.9173.2-69.5172.8166.300111L281 S282 C287 Q288 Q289L281-E285 PolarHBondContact O-N 3.08Å; S282-E285 PolarHBondContact O-N 3.45Å; E285-C287 VanDerWaalsContact C-N 3.3Å; E285-C287 PolarHBondContact O-N 3.41Å; E285-Q288 PolarHBondContact O-N 2.87Å; E285-Q289 PolarHBondContact O-N 3.09Å
286H64.9Low64.9Low132 Ų132103.7 Ų103.761%0.61150%0.498SS*.Hα-helixtrans-71-19.9177.2-160.763.5000114.2S282 R284 P290S282-H286 WeakPolarHBondContact O-CB 3.35Å; S282-H286 PolarHBondContact O-N 3.41Å; R284-H286 VanDerWaalsContact C-N 3.27Å; R284-H286 PolarHBondContact O-N 3.16Å; H286-P290 WeakPolarHBondContact O-CD 3.33Å; H286-P290 WeakPolarHBondContact O-CG 3.43Å
287C60.5Low65Low84 Ų84104 Ų10457%0.56850%0.503SS*.Hα-helixtrans-85.5-25.1171-84.50000112.8R283 R284 E285R283-C287 PolarHBondContact O-N 3.15Å; R283-C287 VanDerWaalsContact O-N 3.14Å; R284-C287 PolarHBondContact O-N 3.37Å; E285-C287 VanDerWaalsContact C-N 3.3Å; E285-C287 PolarHBondContact O-N 3.41Å
288Q59.1Low65.2Low102 Ų102107.8 Ų107.848%0.47752%0.52SS..Hα-helixtrans-82.8-36.9177.2-71.4-179.8-54.600112.4R284 E285 Q291 E292R284-Q288 WeakPolarHBondContact O-CG 3.38Å; R284-Q288 PolarHBondContact O-N 3.38Å; E285-Q288 PolarHBondContact O-N 2.87Å; Q288-Q291 PolarHBondContact O-N 3.29Å; Q288-Q291 VanDerWaalsContact O-N 3.14Å; Q288-E292 PolarHBondContact O-N 3.41Å; Q288-E292 VanDerWaalsContact O-N 3.09Å
289Q56.1Low65.3Low117 Ų117102.4 Ų102.455%0.54751%0.507SS..Hα-helixtrans-54.5-43.3176.4-84.1-177.3-1800114.7E285 Q291 E292 H293E285-Q289 PolarHBondContact O-N 3.09Å; Q289-Q291 VanDerWaalsContact C-N 3.31Å; Q289-Q291 PolarHBondContact O-N 3.47Å; Q289-E292 PolarHBondContact O-N 3.16Å; Q289-H293 WeakPolarHBondContact O-CB 3.32Å; Q289-H293 PolarHBondContact O-N 2.91Å
290P56.9Low65.5Low62 Ų62103.8 Ų103.840%0.40351%0.511SS..Hα-helixtrans-62.5-35.9177-23.832.6000113.1H286 Q294H286-P290 WeakPolarHBondContact O-CD 3.33Å; H286-P290 WeakPolarHBondContact O-CG 3.43Å; P290-Q294 WeakPolarHBondContact O-CB 3.39Å; P290-Q294 PolarHBondContact O-N 2.88Å
291Q57.2Low65.9Low128 Ų128104 Ų10460%0.59852%0.517SS*.Hα-helixtrans-72.4-42.2179.2-72.2-173.5-4000111.6Q288 Q289 Q294 Q295Q288-Q291 PolarHBondContact O-N 3.29Å; Q288-Q291 VanDerWaalsContact O-N 3.14Å; Q289-Q291 VanDerWaalsContact C-N 3.31Å; Q289-Q291 PolarHBondContact O-N 3.47Å; Q291-Q294 PolarHBondContact O-N 2.86Å; Q291-Q295 WeakPolarHBondContact O-CB 3.36Å; Q291-Q295 PolarHBondContact O-N 3.38Å
292E57.8Low66.2Low121 Ų121105.6 Ų105.657%0.56552%0.523SS*.Hα-helixtrans-65.9-39.5174.2-74.5-173.7163.500111.9Q288 Q289 Q295 N296Q288-E292 PolarHBondContact O-N 3.41Å; Q288-E292 VanDerWaalsContact O-N 3.09Å; Q289-E292 PolarHBondContact O-N 3.16Å; E292-Q295 PolarHBondContact O-N 3.13Å; E292-N296 VanDerWaalsContact O-CB 3.26Å; E292-N296 WeakPolarHBondContact O-CB 3.46Å; E292-N296 PolarHBondContact O-N 2.85Å; E292-N296 PolarHBondContact O-ND2 2.97Å
293H60.1Low66.5Low139 Ų139108.4 Ų108.464%0.64453%0.53SS*.Hα-helixtrans-65.8-38.7175.1-104.9-27.2000112.5Q289 S297Q289-H293 WeakPolarHBondContact O-CB 3.32Å; Q289-H293 PolarHBondContact O-N 2.91Å; H293-S297 VanDerWaalsContact O-CB 3.27Å; H293-S297 WeakPolarHBondContact O-CB 3.41Å; H293-S297 PolarHBondContact O-N 3.25Å; H293-S297 PolarHBondContact O-OG 3.08Å
294Q60.5Low66.9Low130 Ų130103.1 Ų103.161%0.60752%0.517SS*.Hα-helixtrans-66-45.7173.8-94.7178-32.800112P290 Q291 S297 Q298P290-Q294 WeakPolarHBondContact O-CB 3.39Å; P290-Q294 PolarHBondContact O-N 2.88Å; Q291-Q294 PolarHBondContact O-N 2.86Å; Q294-S297 PolarHBondContact O-N 3.17Å; Q294-Q298 WeakPolarHBondContact O-CB 3.34Å; Q294-Q298 WeakPolarHBondContact O-CG 3.44Å; Q294-Q298 PolarHBondContact O-N 3.36Å
295Q60.3Low67.6Low130 Ų130103.5 Ų103.561%0.60752%0.52SS*.Hα-helixtrans-64.9-40.4177.9-83.9-176.8-40.900112.7Q291 E292 S299Q291-Q295 WeakPolarHBondContact O-CB 3.36Å; Q291-Q295 PolarHBondContact O-N 3.38Å; E292-Q295 PolarHBondContact O-N 3.13Å; Q295-S299 WeakPolarHBondContact O-CB 3.31Å; Q295-S299 PolarHBondContact O-N 3.13Å; Q295-S299 PolarHBondContact O-OG 3.44Å
296N70.4Confident68.2Low101 Ų101100.4 Ų100.454%0.5451%0.512SS..Hα-helixtrans-69.3-35.2175.5-76.3-20.5000112.3E292 S299 L300E292-N296 VanDerWaalsContact O-CB 3.26Å; E292-N296 WeakPolarHBondContact O-CB 3.46Å; E292-N296 PolarHBondContact O-N 2.85Å; E292-N296 PolarHBondContact O-ND2 2.97Å; N296-S299 WeakPolarHBondContact CA-OG 3.42Å; N296-S299 PolarHBondContact O-OG 2.98Å; N296-S299 VanDerWaalsContact O-OG 3.08Å; N296-L300 VanDerWaalsContact O-CB 3.25Å; N296-L300 WeakPolarHBondContact O-CB 2.98Å; N296-L300 PolarHBondContact O-N 3.35Å
297S71.6Confident69Low68 Ų68101 Ų10148%0.47652%0.519SS..Hα-helixtrans-68.6-44.3175.7-57.10000111H293 Q294 L300 E301H293-S297 VanDerWaalsContact O-CB 3.27Å; H293-S297 WeakPolarHBondContact O-CB 3.41Å; H293-S297 PolarHBondContact O-N 3.25Å; H293-S297 PolarHBondContact O-OG 3.08Å; Q294-S297 PolarHBondContact O-N 3.17Å; S297-L300 PolarHBondContact O-N 3.47Å; S297-E301 VanDerWaalsContact O-CB 3.27Å; S297-E301 WeakPolarHBondContact O-CB 3.39Å; S297-E301 PolarHBondContact O-N 3.35Å
298Q71.7Confident70.1Confident121 Ų121102.7 Ų102.757%0.56552%0.522SS*.Hα-helixtrans-63.3-41.7176.4-75.6179.3-14.700112.2Q294 E301 Q302Q294-Q298 WeakPolarHBondContact O-CB 3.34Å; Q294-Q298 WeakPolarHBondContact O-CG 3.44Å; Q294-Q298 PolarHBondContact O-N 3.36Å; Q298-E301 PolarHBondContact O-N 2.93Å; Q298-Q302 VanDerWaalsContact O-CB 3.32Å; Q298-Q302 WeakPolarHBondContact O-CB 3.41Å; Q298-Q302 PolarHBondContact O-N 3.31Å
299S72.4Confident71.2Confident52 Ų5299.9 Ų99.936%0.36451%0.511SS..Hα-helixtrans-68.8-37.9178.1670000112.4Q295 N296 Q302 Q303Q295-S299 WeakPolarHBondContact O-CB 3.31Å; Q295-S299 PolarHBondContact O-N 3.13Å; Q295-S299 PolarHBondContact O-OG 3.44Å; N296-S299 WeakPolarHBondContact CA-OG 3.42Å; N296-S299 PolarHBondContact O-OG 2.98Å; N296-S299 VanDerWaalsContact O-OG 3.08Å; S299-Q302 PolarHBondContact O-N 3.39Å; S299-Q303 WeakPolarHBondContact O-CB 3.36Å; S299-Q303 WeakPolarHBondContact O-CG 3.45Å; S299-Q303 PolarHBondContact O-N 2.9Å
300L79.2Confident72.5Confident109 Ų109100.3 Ų100.357%0.57152%0.517SS*.Hα-helixtrans-66.9-40.4174.1-162.980.3000111.5N296 S297 Q303 T304N296-L300 VanDerWaalsContact O-CB 3.25Å; N296-L300 WeakPolarHBondContact O-CB 2.98Å; N296-L300 PolarHBondContact O-N 3.35Å; S297-L300 PolarHBondContact O-N 3.47Å; L300-Q303 PolarHBondContact O-N 3.21Å; L300-T304 WeakPolarHBondContact O-CB 3.24Å; L300-T304 PolarHBondContact O-N 3.41Å; L300-T304 PolarHBondContact O-OG1 3.05Å
301E79.6Confident73.7Confident117 Ų117101.8 Ų101.855%0.54753%0.528SS..Hα-helixtrans-64.1-43175.9-165.9170.6-166.700111S297 Q298 T304 F305S297-E301 VanDerWaalsContact O-CB 3.27Å; S297-E301 WeakPolarHBondContact O-CB 3.39Å; S297-E301 PolarHBondContact O-N 3.35Å; Q298-E301 PolarHBondContact O-N 2.93Å; E301-T304 PolarHBondContact O-N 3.33Å; E301-F305 VanDerWaalsContact O-CB 3.27Å; E301-F305 WeakPolarHBondContact O-CB 3.47Å; E301-F305 PolarHBondContact O-N 3.18Å
302Q76.7Confident74.9Confident95 Ų95102.9 Ų102.944%0.44453%0.534SS..Hα-helixtrans-65.6-38.3175-168.6165.714.800112.7Q298 S299 S306 W317Q298-Q302 VanDerWaalsContact O-CB 3.32Å; Q298-Q302 WeakPolarHBondContact O-CB 3.41Å; Q298-Q302 PolarHBondContact O-N 3.31Å; S299-Q302 PolarHBondContact O-N 3.39Å; Q302-S306 WeakPolarHBondContact O-CB 3.26Å; Q302-S306 PolarHBondContact O-N 2.95Å; Q302-S306 PolarHBondContact O-OG 3Å; Q302-W317 HydrophobicContact CB-CH2 3.65Å; Q302-W317 HydrophobicContact CB-CZ2 4.45Å; Q302-W317 HydrophobicContact CB-CZ3 4.09Å; Q302-W317 HydrophobicContact CG-CE3 4.49Å; Q302-W317 HydrophobicContact CG-CH2 3.64Å; Q302-W317 HydrophobicContact CG-CZ3 3.51Å
303Q79.2Confident76Confident120 Ų120101.7 Ų101.756%0.56153%0.528SS*.Hα-helixtrans-67.3-43.7173.5-79.5-178.9-7.600112S299 L300 F305 S306 L307S299-Q303 WeakPolarHBondContact O-CB 3.36Å; S299-Q303 WeakPolarHBondContact O-CG 3.45Å; S299-Q303 PolarHBondContact O-N 2.9Å; L300-Q303 PolarHBondContact O-N 3.21Å; Q303-F305 VanDerWaalsContact C-N 3.35Å; Q303-S306 WeakPolarHBondContact CA-OG 3.32Å; Q303-S306 PolarHBondContact O-N 2.96Å; Q303-S306 PolarHBondContact O-OG 3.09Å; Q303-L307 WeakPolarHBondContact O-CG 3.4Å; Q303-L307 PolarHBondContact O-N 3.19Å; Q303-L307 VanDerWaalsContact O-N 3.11Å
304T80.5Confident77Confident68 Ų6897.2 Ų97.242%0.41751%0.508SS..Hα-helixtrans-67.5-38.8-179.4-50.70000110.9L300 E301 L307 N308L300-T304 WeakPolarHBondContact O-CB 3.24Å; L300-T304 PolarHBondContact O-N 3.41Å; L300-T304 PolarHBondContact O-OG1 3.05Å; E301-T304 PolarHBondContact O-N 3.33Å; T304-L307 PolarHBondContact O-N 3.46Å; T304-N308 PolarHBondContact O-N 3.39Å; T304-N308 PolarHBondContact O-ND2 3.04Å
305F80.9Confident77.9Confident55 Ų5598 Ų9824%0.24151%0.512CS..Hα-helixtrans-65.3-44.5175.2-166.3-86.6000111.6E301 Q303 L307 N308 N309 E313 I314 W317E301-F305 VanDerWaalsContact O-CB 3.27Å; E301-F305 WeakPolarHBondContact O-CB 3.47Å; E301-F305 PolarHBondContact O-N 3.18Å; Q303-F305 VanDerWaalsContact C-N 3.35Å; F305-L307 VanDerWaalsContact C-N 3.28Å; F305-L307 PolarHBondContact O-N 3.26Å; F305-N308 PolarHBondContact O-N 3.16Å; F305-N309 HydrophobicContact CD1-CB 4.41Å; F305-N309 WeakPolarHBondContact CD2-ND2 3.38Å; F305-N309 HydrophobicContact CE1-CB 4.13Å; F305-N309 VanDerWaalsContact CE1-ND2 3.33Å; F305-N309 WeakPolarHBondContact CE1-ND2 3.5Å; F305-N309 WeakPolarHBondContact CE2-ND2 3.48Å; F305-N309 HydrophobicContact CZ-CB 4.47Å; F305-N309 WeakPolarHBondContact CZ-ND2 3.37Å; F305-N309 WeakPolarHBondContact O-CB 3.28Å; F305-N309 PolarHBondContact O-N 3.39Å; F305-E313 HydrophobicContact CE1-CB 4.5Å; F305-E313 WeakPolarHBondContact CE1-O 3.18Å; F305-I314 HydrophobicContact CD1-CG1 4.48Å; F305-W317 HydrophobicContact CD1-CB 3.84Å; F305-W317 AromaticContact CD1-CD1 3.86Å; F305-W317 HydrophobicContact CD1-CD2 4.07Å; F305-W317 AromaticContact CD1-CG 3.65Å; F305-W317 HydrophobicContact CD1-CG 3.65Å; F305-W317 AromaticContact CD2-CD1 3.54Å; F305-W317 HydrophobicContact CD2-CG 4.19Å; F305-W317 AromaticContact CD2-NE1 3.73Å; F305-W317 HydrophobicContact CE1-CB 3.22Å; F305-W317 AromaticContact CE1-CD1 3.68Å; F305-W317 HydrophobicContact CE1-CD2 4.34Å; F305-W317 AromaticContact CE1-CG 3.47Å; F305-W317 HydrophobicContact CE1-CG 3.47Å; F305-W317 VanDerWaalsContact CE1-CG 3.47Å; F305-W317 HydrophobicContact CE2-CB 4.34Å; F305-W317 AromaticContact CE2-CD1 3.32Å; F305-W317 AromaticContact CE2-CG 4Å; F305-W317 HydrophobicContact CE2-CG 4Å; F305-W317 AromaticContact CE2-NE1 3.96Å; F305-W317 AromaticContact CG-CD1 3.8Å; F305-W317 HydrophobicContact CG-CD2 4.29Å; F305-W317 HydrophobicContact CG-CG 4.02Å; F305-W317 AromaticContact CG-NE1 3.92Å; F305-W317 HydrophobicContact CZ-CB 3.5Å; F305-W317 AromaticContact CZ-CD1 3.4Å; F305-W317 AromaticContact CZ-CG 3.63Å; F305-W317 HydrophobicContact CZ-CG 3.63Å
306S77.1Confident78.9Confident58 Ų5897 Ų9741%0.40651%0.51SS..Hα-helixtrans-69.7-20.1179.656.60000114.6Q302 Q303Q302-S306 WeakPolarHBondContact O-CB 3.26Å; Q302-S306 PolarHBondContact O-N 2.95Å; Q302-S306 PolarHBondContact O-OG 3Å; Q303-S306 WeakPolarHBondContact CA-OG 3.32Å; Q303-S306 PolarHBondContact O-N 2.96Å; Q303-S306 PolarHBondContact O-OG 3.09Å
307L81.7Confident79.4Confident144 Ų14493.9 Ų93.975%0.75449%0.491SS*.Hα-helixtrans-81.3-27.9174.6-77.4166.9000113.9Q303 T304 F305Q303-L307 WeakPolarHBondContact O-CG 3.4Å; Q303-L307 PolarHBondContact O-N 3.19Å; Q303-L307 VanDerWaalsContact O-N 3.11Å; T304-L307 PolarHBondContact O-N 3.46Å; F305-L307 VanDerWaalsContact C-N 3.28Å; F305-L307 PolarHBondContact O-N 3.26Å
308N83.4Confident79.7Confident119 Ų11993.6 Ų93.664%0.63648%0.484SS*.Hα-helixtrans-101.4-13.4-170.6-71.7-22.8000114.1T304 F305T304-N308 PolarHBondContact O-N 3.39Å; T304-N308 PolarHBondContact O-ND2 3.04Å; F305-N308 PolarHBondContact O-N 3.16Å
309N81.6Confident80Confident44 Ų4495.9 Ų95.924%0.23549%0.489CS..SBendtrans-127151.6-166-70-2.7000112.2F305 E313 I314F305-N309 HydrophobicContact CD1-CB 4.41Å; F305-N309 WeakPolarHBondContact CD2-ND2 3.38Å; F305-N309 HydrophobicContact CE1-CB 4.13Å; F305-N309 VanDerWaalsContact CE1-ND2 3.33Å; F305-N309 WeakPolarHBondContact CE1-ND2 3.5Å; F305-N309 WeakPolarHBondContact CE2-ND2 3.48Å; F305-N309 HydrophobicContact CZ-CB 4.47Å; F305-N309 WeakPolarHBondContact CZ-ND2 3.37Å; F305-N309 WeakPolarHBondContact O-CB 3.28Å; F305-N309 PolarHBondContact O-N 3.39Å; N309-E313 HydrophobicContact CB-CB 3.89Å; N309-E313 WeakPolarHBondContact CB-OE2 3.46Å; N309-E313 PolarHBondContact ND2-OE2 3.25Å; N309-E313 PolarHBondContact OD1-OE2 3.48Å; N309-I314 WeakPolarHBondContact O-CD1 3.48Å
310D83.8Confident80.3Confident125 Ų12598 Ų9867%0.66850%0.496SS*.  trans-75.8166.7-176.6-59.7-1.5000111E312 E313 I314D310-E312 VanDerWaalsContact C-N 3.27Å; D310-E312 PolarHBondContact O-N 2.91Å; D310-E313 PolarHBondContact O-N 3.31Å; D310-I314 WeakPolarHBondContact O-CG1 3.34Å; D310-I314 PolarHBondContact O-N 3.22Å; D310-I314 VanDerWaalsContact O-N 3.08Å
311S81.9Confident80Confident93 Ų9397.3 Ų97.365%0.6549%0.49SS*.Hα-helixtrans-57.4-35.8-174.354.70000114.2I314 E315S311-I314 PolarHBondContact O-N 3.24Å; S311-E315 PolarHBondContact O-N 3.12Å; S311-E315 VanDerWaalsContact O-N 3.09Å
312E82.4Confident79.2Confident152 Ų15296 Ų9671%0.7149%0.494SS*.Hα-helixtrans-66.8-39.8177.3-68.2-171.9167.300112.1D310 E315 L316D310-E312 VanDerWaalsContact C-N 3.27Å; D310-E312 PolarHBondContact O-N 2.91Å; E312-E315 PolarHBondContact O-N 2.89Å; E312-L316 WeakPolarHBondContact O-CG 3.3Å; E312-L316 PolarHBondContact O-N 3.48Å; E312-L316 VanDerWaalsContact O-N 3.08Å
313E81.7Confident78Confident95 Ų9594.7 Ų94.744%0.44450%0.495SS..Hα-helixtrans-68.9-36.9178.1-69.9-171.7164.800111.4F305 N309 D310 L316 W317F305-E313 HydrophobicContact CE1-CB 4.5Å; F305-E313 WeakPolarHBondContact CE1-O 3.18Å; N309-E313 HydrophobicContact CB-CB 3.89Å; N309-E313 WeakPolarHBondContact CB-OE2 3.46Å; N309-E313 PolarHBondContact ND2-OE2 3.25Å; N309-E313 PolarHBondContact OD1-OE2 3.48Å; D310-E313 PolarHBondContact O-N 3.31Å; E313-L316 PolarHBondContact O-N 3.36Å; E313-W317 WeakPolarHBondContact O-CB 3.37Å; E313-W317 PolarHBondContact O-N 2.99Å
314I79.5Confident76.5Confident45 Ų4594.9 Ų94.923%0.23151%0.505CS..Hα-helixtrans-63.1-43174.3-64.9170.2000111F305 N309 D310 S311 W317 N318F305-I314 HydrophobicContact CD1-CG1 4.48Å; N309-I314 WeakPolarHBondContact O-CD1 3.48Å; D310-I314 WeakPolarHBondContact O-CG1 3.34Å; D310-I314 PolarHBondContact O-N 3.22Å; D310-I314 VanDerWaalsContact O-N 3.08Å; S311-I314 PolarHBondContact O-N 3.24Å; I314-W317 PolarHBondContact O-N 3.07Å; I314-N318 WeakPolarHBondContact O-CB 3.36Å; I314-N318 VanDerWaalsContact O-CG 3.31Å; I314-N318 PolarHBondContact O-N 2.86Å; I314-N318 PolarHBondContact O-ND2 3.46Å; I314-N318 VanDerWaalsContact O-ND2 3.15Å
315E80.1Confident74.6Confident146 Ų14695 Ų9568%0.68252%0.519SS*.Hα-helixtrans-62.9-45.8176.4-78.8-169.916900112.1S311 E312 W317 N318 Y319S311-E315 PolarHBondContact O-N 3.12Å; S311-E315 VanDerWaalsContact O-N 3.09Å; E312-E315 PolarHBondContact O-N 2.89Å; E315-W317 VanDerWaalsContact C-N 3.33Å; E315-W317 PolarHBondContact O-N 2.92Å; E315-N318 PolarHBondContact O-N 2.99Å; E315-Y319 WeakPolarHBondContact O-CB 3.5Å; E315-Y319 PolarHBondContact O-N 3.39Å
316L81.3Confident72.6Confident110 Ų11098.8 Ų98.858%0.57654%0.54SS*.Hα-helixtrans-61.4-41.4176.2-73.9169.4000112E312 E313 Y319 N320E312-L316 WeakPolarHBondContact O-CG 3.3Å; E312-L316 PolarHBondContact O-N 3.48Å; E312-L316 VanDerWaalsContact O-N 3.08Å; E313-L316 PolarHBondContact O-N 3.36Å; L316-Y319 PolarHBondContact O-N 3.14Å; L316-N320 PolarHBondContact O-N 2.91Å; L316-N320 VanDerWaalsContact O-N 3.08Å; L316-N320 PolarHBondContact O-ND2 3.11Å
317W80.3Confident70.5Confident35 Ų35102.7 Ų102.713%0.13356%0.557CS.*Hα-helixtrans-64.5-45177.4-173.194.2000111.9Q302 F305 E313 I314 E315 Y319 N320 H321Q302-W317 HydrophobicContact CB-CH2 3.65Å; Q302-W317 HydrophobicContact CB-CZ2 4.45Å; Q302-W317 HydrophobicContact CB-CZ3 4.09Å; Q302-W317 HydrophobicContact CG-CE3 4.49Å; Q302-W317 HydrophobicContact CG-CH2 3.64Å; Q302-W317 HydrophobicContact CG-CZ3 3.51Å; F305-W317 HydrophobicContact CD1-CB 3.84Å; F305-W317 AromaticContact CD1-CD1 3.86Å; F305-W317 HydrophobicContact CD1-CD2 4.07Å; F305-W317 AromaticContact CD1-CG 3.65Å; F305-W317 HydrophobicContact CD1-CG 3.65Å; F305-W317 AromaticContact CD2-CD1 3.54Å; F305-W317 HydrophobicContact CD2-CG 4.19Å; F305-W317 AromaticContact CD2-NE1 3.73Å; F305-W317 HydrophobicContact CE1-CB 3.22Å; F305-W317 AromaticContact CE1-CD1 3.68Å; F305-W317 HydrophobicContact CE1-CD2 4.34Å; F305-W317 AromaticContact CE1-CG 3.47Å; F305-W317 HydrophobicContact CE1-CG 3.47Å; F305-W317 VanDerWaalsContact CE1-CG 3.47Å; F305-W317 HydrophobicContact CE2-CB 4.34Å; F305-W317 AromaticContact CE2-CD1 3.32Å; F305-W317 AromaticContact CE2-CG 4Å; F305-W317 HydrophobicContact CE2-CG 4Å; F305-W317 AromaticContact CE2-NE1 3.96Å; F305-W317 AromaticContact CG-CD1 3.8Å; F305-W317 HydrophobicContact CG-CD2 4.29Å; F305-W317 HydrophobicContact CG-CG 4.02Å; F305-W317 AromaticContact CG-NE1 3.92Å; F305-W317 HydrophobicContact CZ-CB 3.5Å; F305-W317 AromaticContact CZ-CD1 3.4Å; F305-W317 AromaticContact CZ-CG 3.63Å; F305-W317 HydrophobicContact CZ-CG 3.63Å; E313-W317 WeakPolarHBondContact O-CB 3.37Å; E313-W317 PolarHBondContact O-N 2.99Å; I314-W317 PolarHBondContact O-N 3.07Å; E315-W317 VanDerWaalsContact C-N 3.33Å; E315-W317 PolarHBondContact O-N 2.92Å; W317-Y319 VanDerWaalsContact C-N 3.34Å; W317-Y319 PolarHBondContact O-N 2.99Å; W317-N320 PolarHBondContact O-N 2.8Å; W317-H321 AromaticContact CD1-CE1 3.59Å; W317-H321 AromaticContact CD1-ND1 3.79Å; W317-H321 AromaticContact CD2-CE1 3.91Å; W317-H321 AromaticContact CD2-ND1 3.53Å; W317-H321 AromaticContact CE2-CE1 3.35Å; W317-H321 AromaticContact CE2-CG 3.91Å; W317-H321 AromaticContact CE2-ND1 3.41Å; W317-H321 AromaticContact CE2-NE2 3.82Å; W317-H321 HydrophobicContact CE3-CB 4.45Å; W317-H321 AromaticContact CG-ND1 3.78Å; W317-H321 HydrophobicContact CH2-CB 4.4Å; W317-H321 AromaticContact CZ2-CD2 3.82Å; W317-H321 AromaticContact CZ2-CE1 3.8Å; W317-H321 AromaticContact CZ2-CG 3.89Å; W317-H321 AromaticContact CZ2-ND1 3.87Å; W317-H321 AromaticContact CZ2-NE2 3.79Å; W317-H321 HydrophobicContact CZ3-CB 4.26Å; W317-H321 AromaticContact NE1-CE1 3.15Å; W317-H321 PolarHBondContact NE1-CE1 3.4Å; W317-H321 AromaticContact NE1-ND1 3.59Å; W317-H321 AromaticContact NE1-NE2 3.82Å; W317-H321 WeakPolarHBondContact O-CB 3.41Å; W317-H321 PolarHBondContact O-N 2.82Å; W317-H321 PolarHBondContact O-ND1 3.05Å
318N78.8Confident68.3Low62 Ų62104.9 Ų104.933%0.33256%0.563SS.*Hα-helixtrans-64.4-37.5176.3-74.7-35.3000112.1I314 E315 H321 S322I314-N318 WeakPolarHBondContact O-CB 3.36Å; I314-N318 VanDerWaalsContact O-CG 3.31Å; I314-N318 PolarHBondContact O-N 2.86Å; I314-N318 PolarHBondContact O-ND2 3.46Å; I314-N318 VanDerWaalsContact O-ND2 3.15Å; E315-N318 PolarHBondContact O-N 2.99Å; N318-H321 PolarHBondContact O-N 3.29Å; N318-S322 WeakPolarHBondContact O-CB 3.47Å; N318-S322 PolarHBondContact O-N 3.19Å; N318-S322 PolarHBondContact O-OG 3.35Å
319Y78.3Confident66.1Low169 Ų169104.8 Ų104.866%0.66357%0.567SS**Hα-helixtrans-62-43.3175.4-177-96.9000111.8E315 L316 W317 S322 S323E315-Y319 WeakPolarHBondContact O-CB 3.5Å; E315-Y319 PolarHBondContact O-N 3.39Å; L316-Y319 PolarHBondContact O-N 3.14Å; W317-Y319 VanDerWaalsContact C-N 3.34Å; W317-Y319 PolarHBondContact O-N 2.99Å; Y319-S322 PolarHBondContact O-OG 3.08Å; Y319-S323 PolarHBondContact O-OG 3.36Å
320N78.3Confident64Low97 Ų97109.7 Ų109.752%0.51959%0.593SS.*Hα-helixtrans-72.5-33.1178.7-69-23.6000113.1L316 W317 S323L316-N320 PolarHBondContact O-N 2.91Å; L316-N320 VanDerWaalsContact O-N 3.08Å; L316-N320 PolarHBondContact O-ND2 3.11Å; W317-N320 PolarHBondContact O-N 2.8Å; N320-S323 PolarHBondContact O-OG 3.26Å
321H72.3Confident61.7Low95 Ų95112.7 Ų112.744%0.4460%0.603SS.*Hα-helixtrans-88.3-14.4-178.9-73.278000114.1W317 N318 T324W317-H321 AromaticContact CD1-CE1 3.59Å; W317-H321 AromaticContact CD1-ND1 3.79Å; W317-H321 AromaticContact CD2-CE1 3.91Å; W317-H321 AromaticContact CD2-ND1 3.53Å; W317-H321 AromaticContact CE2-CE1 3.35Å; W317-H321 AromaticContact CE2-CG 3.91Å; W317-H321 AromaticContact CE2-ND1 3.41Å; W317-H321 AromaticContact CE2-NE2 3.82Å; W317-H321 HydrophobicContact CE3-CB 4.45Å; W317-H321 AromaticContact CG-ND1 3.78Å; W317-H321 HydrophobicContact CH2-CB 4.4Å; W317-H321 AromaticContact CZ2-CD2 3.82Å; W317-H321 AromaticContact CZ2-CE1 3.8Å; W317-H321 AromaticContact CZ2-CG 3.89Å; W317-H321 AromaticContact CZ2-ND1 3.87Å; W317-H321 AromaticContact CZ2-NE2 3.79Å; W317-H321 HydrophobicContact CZ3-CB 4.26Å; W317-H321 AromaticContact NE1-CE1 3.15Å; W317-H321 PolarHBondContact NE1-CE1 3.4Å; W317-H321 AromaticContact NE1-ND1 3.59Å; W317-H321 AromaticContact NE1-NE2 3.82Å; W317-H321 WeakPolarHBondContact O-CB 3.41Å; W317-H321 PolarHBondContact O-N 2.82Å; W317-H321 PolarHBondContact O-ND1 3.05Å; N318-H321 PolarHBondContact O-N 3.29Å; H321-T324 PolarHBondContact O-OG1 2.61Å
322S63.7Low59.7Low90 Ų90112.4 Ų112.463%0.62960%0.601SS**Hα-helixtrans-85.8-14.3174.754.90000113.6N318 Y319N318-S322 WeakPolarHBondContact O-CB 3.47Å; N318-S322 PolarHBondContact O-N 3.19Å; N318-S322 PolarHBondContact O-OG 3.35Å; Y319-S322 PolarHBondContact O-OG 3.08Å
323S50.8Low57.7Low66 Ų66112 Ų11246%0.46260%0.604SS.*SBendtrans-95.2-3.2-174.935.90000114.8Y319 N320 G325Y319-S323 PolarHBondContact O-OG 3.36Å; N320-S323 PolarHBondContact O-OG 3.26Å; S323-G325 VanDerWaalsContact C-N 3.3Å; S323-G325 PolarHBondContact O-N 3.35Å
324T47.9Very low55.7Low125 Ų125118 Ų11877%0.76762%0.622SS**THydrogen-bonded Turntrans-84.38.3176.342.10000114.8H321H321-T324 PolarHBondContact O-OG1 2.61Å
325G40.7Very low53.8Low71 Ų71121.9 Ų121.973%0.73265%0.648SS**THydrogen-bonded Turntrans-96.91.9175.900000115.9S323S323-G325 VanDerWaalsContact C-N 3.3Å; S323-G325 PolarHBondContact O-N 3.35Å
326I38.1Very low51.9Low133 Ų133120.8 Ų120.868%0.68266%0.656SS**SBendtrans-133.8104.7-177.5-51.6177000107.4
327N33.5Very low50.3Low141 Ų141126 Ų12675%0.75469%0.692SS**  trans127.471.3165.5-62.3-31.1000114.4
328E35.2Very low48.8Very low189 Ų189130.6 Ų130.688%0.88372%0.72SS**  trans-105.585.8141.7-84.2-17016000107.8N330E328-N330 PolarHBondContact O-N 3.15Å
329V38.2Very low47.2Very low117 Ų117134.2 Ų134.271%0.70974%0.74SS**  trans-70.4105.2160.5171.80000106.2Q331V329-Q331 PolarHBondContact O-N 3.46Å
330N37.1Very low45.5Very low148 Ų148132.3 Ų132.379%0.79174%0.744SS**  trans-61.397.3165.7-89.5-28.9000109.3E328E328-N330 PolarHBondContact O-N 3.15Å
331Q35.5Very low43.6Very low188 Ų188134.4 Ų134.488%0.87976%0.758SS**  trans-8697.4151.2-92.4-177.5-10.800107.9V329V329-Q331 PolarHBondContact O-N 3.46Å
332S40.5Very low41.8Very low87 Ų87136.8 Ų136.861%0.60878%0.777SS**  trans-148.6135159.763.40000110.1
333D39.2Very low40.3Very low142 Ų142139.9 Ų139.976%0.75979%0.787SS**  trans8592.3169.2-55.1-29.1000116.4
334R40.1Very low39.6Very low222 Ų222145.2 Ų145.284%0.83881%0.81SS**  65.1104.281.5-73.2-174.7176.8-175.61.8113.5
335T40.5Very low38.9Very low126 Ų126146.8 Ų146.877%0.77381%0.814SS**  trans50.3109.413854.30000118.8
336C40.6Very low38.8Very low124 Ų124153.1 Ų153.184%0.83882%0.821SS**  173.9125.1112.1-97.10000111.4
337V46.9Very low38.8Very low220 Ų220154.9 Ų154.9100%1.33383%0.833SS**  trans63.70171-167.50000117.4

Retrieved 337 of 337 residues in 1048.7 ms (Link to these results)

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