A0A5K4F1P4_SCHMA Loading...

MFS domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1P4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 474 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
1M38Very low53.3Low121 Ų121100.4 Ų100.460%0.59648%0.48SS*.  0-61.30-145.9174.7-144.100111.3V3 R4 C5 L340 I344M1-V3 VanDerWaalsContact C-N 3.31Å; M1-V3 PolarHBondContact O-N 2.89Å; M1-R4 WeakPolarHBondContact O-CA 3.2Å; M1-R4 WeakPolarHBondContact O-CB 3.34Å; M1-R4 PolarHBondContact O-N 3.13Å; M1-C5 PolarHBondContact O-N 2.99Å; M1-L340 HydrophobicContact CE-CD1 3.75Å; M1-L340 HydrophobicContact SD-CD1 3.31Å; M1-L340 WeakPolarHBondContact SD-CD1 3.17Å; M1-I344 HydrophobicContact CE-CG1 4.31Å
2F38.3Very low53.7Low180 Ų18093.8 Ų93.879%0.78945%0.449SS*.Hα-helixtrans-52-43.3173.9-82.5-81.1000114.2R4 C5 F6F2-R4 VanDerWaalsContact C-N 3.32Å; F2-R4 PolarHBondContact O-N 3.13Å; F2-C5 PolarHBondContact O-N 3.26Å; F2-F6 WeakPolarHBondContact O-CB 3.45Å; F2-F6 PolarHBondContact O-N 3.33Å
3V49.5Very low53.9Low102 Ų10295.6 Ų95.662%0.61846%0.459SS*.Hα-helixtrans-61.7-38.3176.3175.90000112M1 F6 H7M1-V3 VanDerWaalsContact C-N 3.31Å; M1-V3 PolarHBondContact O-N 2.89Å; V3-F6 PolarHBondContact O-N 3.44Å; V3-H7 PolarHBondContact O-CD2 3.42Å; V3-H7 PolarHBondContact O-N 3.47Å
4R50.2Low54.1Low177 Ų177100.3 Ų100.367%0.66848%0.48SS*.Hα-helixtrans-69.1-41.4174.5-80.9-172178.2179.7-1.5111.9M1 F2 F6 H7 I8M1-R4 WeakPolarHBondContact O-CA 3.2Å; M1-R4 WeakPolarHBondContact O-CB 3.34Å; M1-R4 PolarHBondContact O-N 3.13Å; F2-R4 VanDerWaalsContact C-N 3.32Å; F2-R4 PolarHBondContact O-N 3.13Å; R4-F6 VanDerWaalsContact C-N 3.26Å; R4-F6 PolarHBondContact O-N 2.59Å; R4-H7 PolarHBondContact O-N 3.4Å; R4-I8 VanDerWaalsContact O-CG1 3.22Å; R4-I8 WeakPolarHBondContact O-CG1 3.42Å; R4-I8 PolarHBondContact O-N 3.36Å
5C49.7Very low54.3Low22 Ų2296 Ų9615%0.14947%0.473CS..Hα-helixtrans-59.5-42.4173.1-64.70000110.9M1 F2 I8 V9M1-C5 PolarHBondContact O-N 2.99Å; F2-C5 PolarHBondContact O-N 3.26Å; C5-I8 PolarHBondContact O-N 2.88Å; C5-V9 WeakPolarHBondContact O-CB 2.99Å; C5-V9 WeakPolarHBondContact O-CG2 3.23Å; C5-V9 PolarHBondContact O-N 3.38Å
6F61.6Low54.2Low143 Ų143101.3 Ų101.363%0.62750%0.504SS*.Hα-helixtrans-62.5-44.7175.7-168.1-94.3000111.4F2 V3 R4 V9 T10F2-F6 WeakPolarHBondContact O-CB 3.45Å; F2-F6 PolarHBondContact O-N 3.33Å; V3-F6 PolarHBondContact O-N 3.44Å; R4-F6 VanDerWaalsContact C-N 3.26Å; R4-F6 PolarHBondContact O-N 2.59Å; F6-V9 PolarHBondContact O-N 3.39Å; F6-T10 HydrophobicContact CD1-CG2 4.1Å; F6-T10 HydrophobicContact CE1-CG2 3.79Å; F6-T10 HydrophobicContact CZ-CG2 4.31Å; F6-T10 WeakPolarHBondContact O-CG2 3.26Å; F6-T10 PolarHBondContact O-N 3.17Å; F6-T10 PolarHBondContact O-OG1 3.11Å
7H57.7Low54.8Low105 Ų10598.4 Ų98.449%0.48651%0.505SS..Hα-helixtrans-61.3-44.5175.1-87.6-71.6000113.1V3 R4 V9 T10 E11V3-H7 PolarHBondContact O-CD2 3.42Å; V3-H7 PolarHBondContact O-N 3.47Å; R4-H7 PolarHBondContact O-N 3.4Å; H7-V9 VanDerWaalsContact C-N 3.32Å; H7-V9 PolarHBondContact O-N 2.89Å; H7-T10 VanDerWaalsContact CA-OG1 3.25Å; H7-T10 WeakPolarHBondContact CA-OG1 2.93Å; H7-T10 CarbonylContact O-C 3.59Å; H7-T10 PolarHBondContact O-N 2.77Å; H7-T10 VanDerWaalsContact O-N 3.13Å; H7-T10 PolarHBondContact O-OG1 3.06Å; H7-E11 WeakPolarHBondContact O-CG 3.22Å; H7-E11 PolarHBondContact O-N 3.1Å
8I59.5Low55.7Low44 Ų4494.1 Ų94.123%0.22648%0.484CS..Hα-helixtrans-64.3-40.7177.3-64.3161.6000110R4 C5 T10 E11 I12 L166R4-I8 VanDerWaalsContact O-CG1 3.22Å; R4-I8 WeakPolarHBondContact O-CG1 3.42Å; R4-I8 PolarHBondContact O-N 3.36Å; C5-I8 PolarHBondContact O-N 2.88Å; I8-T10 VanDerWaalsContact C-N 3.31Å; I8-T10 PolarHBondContact O-N 2.8Å; I8-E11 PolarHBondContact O-N 3.18Å; I8-I12 HydrophobicContact CG2-CD1 3.85Å; I8-I12 HydrophobicContact CG2-CG1 4.34Å; I8-I12 VanDerWaalsContact O-CB 3.26Å; I8-I12 WeakPolarHBondContact O-CB 3.45Å; I8-I12 WeakPolarHBondContact O-CG1 3.45Å; I8-I12 PolarHBondContact O-N 2.83Å; I8-L166 HydrophobicContact CB-CD2 4.05Å; I8-L166 HydrophobicContact CG2-CD2 3.37Å
9V61.3Low57.1Low53 Ų5395.5 Ų95.532%0.32149%0.492SS..Hα-helixtrans-61.9-40.5173.7170.80000110.8C5 F6 H7 I12 M13C5-V9 WeakPolarHBondContact O-CB 2.99Å; C5-V9 WeakPolarHBondContact O-CG2 3.23Å; C5-V9 PolarHBondContact O-N 3.38Å; F6-V9 PolarHBondContact O-N 3.39Å; H7-V9 VanDerWaalsContact C-N 3.32Å; H7-V9 PolarHBondContact O-N 2.89Å; V9-I12 WeakPolarHBondContact O-CB 3.47Å; V9-I12 PolarHBondContact O-N 3.46Å; V9-M13 HydrophobicContact CG1-SD 4.39Å; V9-M13 VanDerWaalsContact O-CG 3.26Å; V9-M13 WeakPolarHBondContact O-CG 3.47Å; V9-M13 PolarHBondContact O-N 3.21Å; V9-M13 VanDerWaalsContact O-N 3.1Å
10T60.6Low58.3Low42 Ų4292.5 Ų92.526%0.25848%0.481SS..Hα-helixtrans-69.1-37.2175.9540000113F6 H7 I8 M13 Q14F6-T10 HydrophobicContact CD1-CG2 4.1Å; F6-T10 HydrophobicContact CE1-CG2 3.79Å; F6-T10 HydrophobicContact CZ-CG2 4.31Å; F6-T10 WeakPolarHBondContact O-CG2 3.26Å; F6-T10 PolarHBondContact O-N 3.17Å; F6-T10 PolarHBondContact O-OG1 3.11Å; H7-T10 VanDerWaalsContact CA-OG1 3.25Å; H7-T10 WeakPolarHBondContact CA-OG1 2.93Å; H7-T10 CarbonylContact O-C 3.59Å; H7-T10 PolarHBondContact O-N 2.77Å; H7-T10 VanDerWaalsContact O-N 3.13Å; H7-T10 PolarHBondContact O-OG1 3.06Å; I8-T10 VanDerWaalsContact C-N 3.31Å; I8-T10 PolarHBondContact O-N 2.8Å; T10-M13 WeakPolarHBondContact O-CB 3.41Å; T10-M13 PolarHBondContact O-N 3.32Å; T10-M13 VanDerWaalsContact O-N 3.11Å; T10-Q14 WeakPolarHBondContact O-CG 3.32Å; T10-Q14 PolarHBondContact O-N 3.36Å
11E59.9Low59.6Low115 Ų11588 Ų8854%0.53746%0.458SS..Hα-helixtrans-64.4-43.4173.9-76.2173.6178.600110.7H7 I8 M13 Q14H7-E11 WeakPolarHBondContact O-CG 3.22Å; H7-E11 PolarHBondContact O-N 3.1Å; I8-E11 PolarHBondContact O-N 3.18Å; E11-M13 PolarHBondContact O-N 3.48Å; E11-Q14 PolarHBondContact O-N 2.78Å
12I57.7Low61.9Low22 Ų2284.2 Ų84.211%0.11344%0.443CS..Hα-helixtrans-56.2-30.8171.5-78170.8000111.7I8 V9 T18 F160 H163 L166I8-I12 HydrophobicContact CG2-CD1 3.85Å; I8-I12 HydrophobicContact CG2-CG1 4.34Å; I8-I12 VanDerWaalsContact O-CB 3.26Å; I8-I12 WeakPolarHBondContact O-CB 3.45Å; I8-I12 WeakPolarHBondContact O-CG1 3.45Å; I8-I12 PolarHBondContact O-N 2.83Å; V9-I12 WeakPolarHBondContact O-CB 3.47Å; V9-I12 PolarHBondContact O-N 3.46Å; I12-T18 VanDerWaalsContact O-CB 3.22Å; I12-T18 WeakPolarHBondContact O-CB 3.39Å; I12-T18 WeakPolarHBondContact O-CG2 3.14Å; I12-F160 HydrophobicContact CB-CE1 4.4Å; I12-F160 HydrophobicContact CG1-CD1 4.28Å; I12-F160 HydrophobicContact CG2-CD1 3.95Å; I12-F160 HydrophobicContact CG2-CE1 3.48Å; I12-F160 VanDerWaalsContact CG2-CE1 3.48Å; I12-F160 HydrophobicContact CG2-CE2 4.06Å; I12-F160 HydrophobicContact CG2-CG 4.45Å; I12-F160 HydrophobicContact CG2-CZ 3.52Å; I12-H163 HydrophobicContact CD1-CB 4.34Å; I12-L166 HydrophobicContact CD1-CD2 4.26Å
13M56.5Low64.4Low117 Ų11780.4 Ų80.458%0.57643%0.426SS*.THydrogen-bonded Turntrans-84-9.3179.6-71.9-179.674.900114.4V9 T10 E11 T18V9-M13 HydrophobicContact CG1-SD 4.39Å; V9-M13 VanDerWaalsContact O-CG 3.26Å; V9-M13 WeakPolarHBondContact O-CG 3.47Å; V9-M13 PolarHBondContact O-N 3.21Å; V9-M13 VanDerWaalsContact O-N 3.1Å; T10-M13 WeakPolarHBondContact O-CB 3.41Å; T10-M13 PolarHBondContact O-N 3.32Å; T10-M13 VanDerWaalsContact O-N 3.11Å; E11-M13 PolarHBondContact O-N 3.48Å; M13-T18 PolarHBondContact O-OG1 3.28Å
14Q56.7Low66.3Low161 Ų16175.5 Ų75.575%0.75240%0.397SS*.SBendtrans-95.9-10.1-172.1-77.9177.9-500115.4T10 E11T10-Q14 WeakPolarHBondContact O-CG 3.32Å; T10-Q14 PolarHBondContact O-N 3.36Å; E11-Q14 PolarHBondContact O-N 2.78Å
15G57.1Low68.2Low36 Ų3667.8 Ų67.837%0.37137%0.369SS..SBendtrans-83.1162.1179.900000115.6T18G15-T18 VanDerWaalsContact C-CG2 3.4Å; G15-T18 VanDerWaalsContact CA-CG2 3.44Å; G15-T18 VanDerWaalsContact O-CB 3.23Å; G15-T18 WeakPolarHBondContact O-CB 3.36Å; G15-T18 WeakPolarHBondContact O-CG2 3.25Å; G15-T18 PolarHBondContact O-N 3.33Å; G15-T18 PolarHBondContact O-OG1 3.07Å
16D53.2Low70.3Confident181 Ų18170.5 Ų70.597%0.96838%0.381SS*.THydrogen-bonded Turntrans-69.2129.9174.3-73.7-37.6000111.7T18D16-T18 VanDerWaalsContact C-N 3.33Å
17G63.6Low71.6Confident52 Ų5263.7 Ų63.754%0.53635%0.352SS..THydrogen-bonded Turntrans83.10.4-17500000115.4I19 A20 G21 W159G17-I19 PolarHBondContact O-N 3.48Å; G17-A20 PolarHBondContact O-N 3.35Å; G17-G21 PolarHBondContact O-N 2.92Å; G17-W159 WeakPolarHBondContact O-CZ3 3.43Å
18T71.5Confident73.3Confident20 Ų2058.7 Ų58.712%0.12333%0.328CS..Hα-helixtrans-65.3-33.3-175.851.90000114.2I12 M13 G15 D16 A20 G21 C22 F160I12-T18 VanDerWaalsContact O-CB 3.22Å; I12-T18 WeakPolarHBondContact O-CB 3.39Å; I12-T18 WeakPolarHBondContact O-CG2 3.14Å; M13-T18 PolarHBondContact O-OG1 3.28Å; G15-T18 VanDerWaalsContact C-CG2 3.4Å; G15-T18 VanDerWaalsContact CA-CG2 3.44Å; G15-T18 VanDerWaalsContact O-CB 3.23Å; G15-T18 WeakPolarHBondContact O-CB 3.36Å; G15-T18 WeakPolarHBondContact O-CG2 3.25Å; G15-T18 PolarHBondContact O-N 3.33Å; G15-T18 PolarHBondContact O-OG1 3.07Å; D16-T18 VanDerWaalsContact C-N 3.33Å; T18-A20 VanDerWaalsContact C-N 3.31Å; T18-A20 PolarHBondContact O-N 3.47Å; T18-G21 CarbonylContact O-C 3.57Å; T18-G21 WeakPolarHBondContact O-CA 3.46Å; T18-G21 PolarHBondContact O-N 3.17Å; T18-C22 PolarHBondContact O-N 3.47Å; T18-C22 PolarHBondContact O-SG 3.3Å; T18-F160 HydrophobicContact CG2-CE1 4.41Å
19I81.6Confident74.9Confident122 Ų12258.6 Ų58.663%0.62633%0.325SS*.Hα-helixtrans-58.1-45.2178.2-62.8174.7000110.9G17 G21 C22 F23G17-I19 PolarHBondContact O-N 3.48Å; I19-G21 VanDerWaalsContact C-N 3.32Å; I19-G21 PolarHBondContact O-N 2.95Å; I19-C22 PolarHBondContact O-N 2.74Å; I19-F23 HydrophobicContact CG2-CD2 3.67Å; I19-F23 HydrophobicContact CG2-CE2 3.38Å; I19-F23 HydrophobicContact CG2-CZ 4.49Å; I19-F23 WeakPolarHBondContact O-CD2 3.26Å; I19-F23 PolarHBondContact O-N 3.38Å
20A82.6Confident76.4Confident34 Ų3457.7 Ų57.728%0.28132%0.319SS..Hα-helixtrans-65.6-37177.300000111.9G17 T18 F23 S24 W159G17-A20 PolarHBondContact O-N 3.35Å; T18-A20 VanDerWaalsContact C-N 3.31Å; T18-A20 PolarHBondContact O-N 3.47Å; A20-F23 PolarHBondContact O-N 3.08Å; A20-S24 WeakPolarHBondContact O-CB 3.2Å; A20-S24 PolarHBondContact O-N 3.2Å; A20-W159 HydrophobicContact CB-CH2 3.51Å; A20-W159 HydrophobicContact CB-CZ2 4.24Å; A20-W159 HydrophobicContact CB-CZ3 3.99Å
21G84.7Confident77.8Confident0 Ų055.7 Ų55.70%031%0.306CS..Hα-helixtrans-64.6-43.917300000113.2G17 T18 I19 S24 V25G17-G21 PolarHBondContact O-N 2.92Å; T18-G21 CarbonylContact O-C 3.57Å; T18-G21 WeakPolarHBondContact O-CA 3.46Å; T18-G21 PolarHBondContact O-N 3.17Å; I19-G21 VanDerWaalsContact C-N 3.32Å; I19-G21 PolarHBondContact O-N 2.95Å; G21-S24 WeakPolarHBondContact O-CB 3.31Å; G21-S24 PolarHBondContact O-N 3.32Å; G21-S24 VanDerWaalsContact O-N 3.17Å; G21-V25 WeakPolarHBondContact O-CG2 3.35Å; G21-V25 PolarHBondContact O-N 3.19Å
22C86.9Confident79.4Confident40 Ų4050.2 Ų50.227%0.2728%0.281SS..Hα-helixtrans-61.9-43.4175.1-67.40000111.6T18 I19 S24 V25 L26T18-C22 PolarHBondContact O-N 3.47Å; T18-C22 PolarHBondContact O-SG 3.3Å; I19-C22 PolarHBondContact O-N 2.74Å; C22-S24 VanDerWaalsContact C-N 3.32Å; C22-S24 PolarHBondContact O-N 3.11Å; C22-V25 PolarHBondContact O-N 3.31Å; C22-L26 WeakPolarHBondContact O-CB 3.28Å; C22-L26 PolarHBondContact O-N 2.7Å
23F90Very high81Confident100 Ų10050 Ų5044%0.43928%0.28SS..Hα-helixtrans-62.4-39.5173.2-78.6-58.4000112I19 A20 L26 G27 L234I19-F23 HydrophobicContact CG2-CD2 3.67Å; I19-F23 HydrophobicContact CG2-CE2 3.38Å; I19-F23 HydrophobicContact CG2-CZ 4.49Å; I19-F23 WeakPolarHBondContact O-CD2 3.26Å; I19-F23 PolarHBondContact O-N 3.38Å; A20-F23 PolarHBondContact O-N 3.08Å; F23-L26 PolarHBondContact O-N 3.27Å; F23-G27 PolarHBondContact O-N 3.46Å; F23-L234 CarbonylContact C-O 3.2Å; F23-L234 HydrophobicContact CB-CD2 4.46Å; F23-L234 HydrophobicContact CD1-CD2 3.78Å; F23-L234 HydrophobicContact CE1-CD2 4.43Å; F23-L234 HydrophobicContact CG-CD2 4.4Å
24S89.2Confident82.7Confident0 Ų044.5 Ų44.50%025%0.253CS..Hα-helixtrans-63.3-45.8176-172.10000112A20 G21 C22 L26 G27 G28 W159 L235 R236A20-S24 WeakPolarHBondContact O-CB 3.2Å; A20-S24 PolarHBondContact O-N 3.2Å; G21-S24 WeakPolarHBondContact O-CB 3.31Å; G21-S24 PolarHBondContact O-N 3.32Å; G21-S24 VanDerWaalsContact O-N 3.17Å; C22-S24 VanDerWaalsContact C-N 3.32Å; C22-S24 PolarHBondContact O-N 3.11Å; S24-L26 VanDerWaalsContact C-N 3.34Å; S24-L26 PolarHBondContact O-N 3.13Å; S24-G27 PolarHBondContact O-N 3.46Å; S24-G27 VanDerWaalsContact O-N 3.17Å; S24-G28 PolarHBondContact O-N 2.64Å; S24-W159 PolarHBondContact OG-NE1 3.49Å; S24-L235 VanDerWaalsContact O-CD1 3.28Å; S24-L235 WeakPolarHBondContact O-CD1 3.38Å; S24-R236 WeakPolarHBondContact CB-O 3.27Å; S24-R236 PolarHBondContact OG-N 3.43Å; S24-R236 PolarHBondContact OG-O 3.45Å
25V90.8Very high84.3Confident15 Ų1536.8 Ų36.89%0.09122%0.217CC..Hα-helixtrans-61.1-42.1175.4170.70000111.3G21 C22 G28 Y29 F160 V167 L170 V171G21-V25 WeakPolarHBondContact O-CG2 3.35Å; G21-V25 PolarHBondContact O-N 3.19Å; C22-V25 PolarHBondContact O-N 3.31Å; V25-G28 PolarHBondContact O-N 3.19Å; V25-Y29 WeakPolarHBondContact O-CB 3.41Å; V25-Y29 PolarHBondContact O-N 3.41Å; V25-F160 HydrophobicContact CG2-CD2 4.09Å; V25-F160 HydrophobicContact CG2-CE2 3.83Å; V25-V167 HydrophobicContact CG2-CG1 3.79Å; V25-L170 HydrophobicContact CG1-CD2 3.44Å; V25-L170 VanDerWaalsContact CG1-CD2 3.44Å; V25-V171 HydrophobicContact CG1-CG2 4.05Å
26L92.9Very high85.8Confident78 Ų7835.1 Ų35.141%0.40820%0.199SC..Hα-helixtrans-63.3-41.4174.1-179.461.5000111.9C22 F23 S24 Y29 L30 L234C22-L26 WeakPolarHBondContact O-CB 3.28Å; C22-L26 PolarHBondContact O-N 2.7Å; F23-L26 PolarHBondContact O-N 3.27Å; S24-L26 VanDerWaalsContact C-N 3.34Å; S24-L26 PolarHBondContact O-N 3.13Å; L26-Y29 WeakPolarHBondContact O-CB 3.34Å; L26-Y29 PolarHBondContact O-N 2.83Å; L26-L30 WeakPolarHBondContact O-CG 3.44Å; L26-L30 PolarHBondContact O-N 2.86Å; L26-L234 HydrophobicContact CD2-CD1 4.06Å; L26-L234 HydrophobicContact CG-CD1 4.15Å
27G90.7Very high87.6Confident0 Ų026.6 Ų26.60%015%0.154CC..Hα-helixtrans-60.9-45.5175.100000112F23 S24 Y29 L30 I31 G231F23-G27 PolarHBondContact O-N 3.46Å; S24-G27 PolarHBondContact O-N 3.46Å; S24-G27 VanDerWaalsContact O-N 3.17Å; G27-Y29 VanDerWaalsContact C-N 3.34Å; G27-Y29 PolarHBondContact O-N 3.22Å; G27-L30 PolarHBondContact O-N 3.38Å; G27-I31 WeakPolarHBondContact O-CD1 3.37Å; G27-I31 WeakPolarHBondContact O-CG1 3.34Å; G27-I31 PolarHBondContact O-N 3.34Å; G27-I31 VanDerWaalsContact O-N 3.08Å; G27-G231 WeakPolarHBondContact CA-O 3.43Å
28G91.4Very high88.8Confident0 Ų024.2 Ų24.20%013%0.129CC..Hα-helixtrans-62.2-40.6174.700000112.7S24 V25 I31 H32 T152S24-G28 PolarHBondContact O-N 2.64Å; V25-G28 PolarHBondContact O-N 3.19Å; G28-I31 PolarHBondContact O-N 3.44Å; G28-H32 WeakPolarHBondContact O-CB 3.32Å; G28-H32 PolarHBondContact O-N 3.28Å; G28-H32 PolarHBondContact O-ND1 2.89Å; G28-T152 VanDerWaalsContact CA-CG2 3.49Å
29Y93.5Very high89.5Confident42 Ų4223.6 Ų23.617%0.16512%0.124CC..Hα-helixtrans-60.9-46.9174.9177.2-82.9000111.9V25 L26 G27 H32 L33 L170 S173 G174 M177V25-Y29 WeakPolarHBondContact O-CB 3.41Å; V25-Y29 PolarHBondContact O-N 3.41Å; L26-Y29 WeakPolarHBondContact O-CB 3.34Å; L26-Y29 PolarHBondContact O-N 2.83Å; G27-Y29 VanDerWaalsContact C-N 3.34Å; G27-Y29 PolarHBondContact O-N 3.22Å; Y29-H32 CarbonylContact O-C 3.54Å; Y29-H32 PolarHBondContact O-N 3.28Å; Y29-L33 WeakPolarHBondContact O-CB 3.18Å; Y29-L33 PolarHBondContact O-N 3.28Å; Y29-L170 HydrophobicContact CD2-CD2 4.34Å; Y29-L170 VanDerWaalsContact CD2-O 3.32Å; Y29-L170 WeakPolarHBondContact CD2-O 3.45Å; Y29-S173 WeakPolarHBondContact CE2-OG 3.47Å; Y29-G174 VanDerWaalsContact CE2-CA 3.4Å; Y29-G174 VanDerWaalsContact CE2-N 3.34Å; Y29-M177 WeakPolarHBondContact OH-CE 3.47Å; Y29-M177 PolarHBondContact OH-SD 2.75Å
30L92.5Very high89.9Confident34 Ų3417.8 Ų17.818%0.1789%0.094CC..Hα-helixtrans-64.5-40.8179.6-70.6175.4000112.2L26 G27 H32 L33 S34 T227 I230 L234L26-L30 WeakPolarHBondContact O-CG 3.44Å; L26-L30 PolarHBondContact O-N 2.86Å; G27-L30 PolarHBondContact O-N 3.38Å; L30-H32 VanDerWaalsContact C-N 3.34Å; L30-L33 HydrophobicContact CD2-CD2 4.43Å; L30-L33 WeakPolarHBondContact O-CB 3.28Å; L30-L33 PolarHBondContact O-N 3.36Å; L30-S34 PolarHBondContact O-N 2.81Å; L30-S34 VanDerWaalsContact O-N 3.07Å; L30-S34 PolarHBondContact O-OG 3.17Å; L30-T227 HydrophobicContact CB-CG2 4.05Å; L30-T227 HydrophobicContact CD2-CG2 4.14Å; L30-T227 WeakPolarHBondContact O-CG2 3.43Å; L30-I230 HydrophobicContact CD1-CB 4.37Å; L30-I230 HydrophobicContact CD1-CG2 3.71Å; L30-L234 HydrophobicContact CD1-CD1 3.98Å
31I91.8Very high90.3Very high0 Ų016.4 Ų16.40%08%0.082CC..Hα-helixtrans-61.7-45.1173.9-73.5157.5000110.6G27 G28 L33 S34 Y35 L96 T152 L235G27-I31 WeakPolarHBondContact O-CD1 3.37Å; G27-I31 WeakPolarHBondContact O-CG1 3.34Å; G27-I31 PolarHBondContact O-N 3.34Å; G27-I31 VanDerWaalsContact O-N 3.08Å; G28-I31 PolarHBondContact O-N 3.44Å; I31-L33 VanDerWaalsContact C-N 3.32Å; I31-L33 PolarHBondContact O-N 2.87Å; I31-S34 WeakPolarHBondContact O-CB 3.48Å; I31-S34 PolarHBondContact O-N 3.25Å; I31-Y35 HydrophobicContact CG2-CD2 4.02Å; I31-Y35 HydrophobicContact CG2-CE1 4.09Å; I31-Y35 HydrophobicContact CG2-CE2 3.34Å; I31-Y35 WeakPolarHBondContact CG2-OH 3.42Å; I31-Y35 PolarHBondContact O-N 2.88Å; I31-L96 HydrophobicContact CD1-CD1 4.19Å; I31-L96 HydrophobicContact CD1-CD2 3.65Å; I31-L96 HydrophobicContact CD1-CG 4.24Å; I31-L96 HydrophobicContact CG2-CD1 4.2Å; I31-T152 HydrophobicContact CB-CG2 4.28Å; I31-T152 HydrophobicContact CD1-CG2 4.25Å; I31-T152 HydrophobicContact CG2-CG2 4.15Å; I31-L235 HydrophobicContact CD1-CB 4.44Å; I31-L235 HydrophobicContact CD1-CD2 4.29Å
32H91.9Very high90.5Very high0 Ų016.4 Ų16.40%08%0.082CC..Hα-helixtrans-65.7-34.6176.5-80.874.6000112.1G28 Y29 L30 S34 Y35 G36 F149 V171 Y175G28-H32 WeakPolarHBondContact O-CB 3.32Å; G28-H32 PolarHBondContact O-N 3.28Å; G28-H32 PolarHBondContact O-ND1 2.89Å; Y29-H32 CarbonylContact O-C 3.54Å; Y29-H32 PolarHBondContact O-N 3.28Å; L30-H32 VanDerWaalsContact C-N 3.34Å; H32-S34 VanDerWaalsContact C-N 3.31Å; H32-S34 PolarHBondContact O-N 3.41Å; H32-Y35 CarbonylContact O-C 3.57Å; H32-Y35 PolarHBondContact O-N 3.36Å; H32-G36 PolarHBondContact O-N 2.87Å; H32-F149 AromaticContact CD2-CE2 3.65Å; H32-F149 AromaticContact NE2-CD2 3.86Å; H32-F149 AromaticContact NE2-CE2 3.78Å; H32-F149 AromaticContact NE2-CZ 3.91Å; H32-V171 HydrophobicContact CB-CG1 4.49Å; H32-V171 VanDerWaalsContact CB-O 3.26Å; H32-V171 WeakPolarHBondContact CB-O 3.19Å; H32-V171 VanDerWaalsContact CE1-CG1 3.46Å; H32-V171 WeakPolarHBondContact CE1-CG1 3.42Å; H32-V171 VanDerWaalsContact ND1-CG1 3.29Å; H32-V171 WeakPolarHBondContact ND1-CG1 3.28Å; H32-Y175 WeakPolarHBondContact O-CA 3.48Å; H32-Y175 PolarHBondContact O-N 2.99Å
33L92.5Very high90.8Very high19 Ų1914.5 Ų14.510%0.0997%0.069CC..Hα-helixtrans-57.3-44.9171.7-175.772.8000111.3Y29 L30 I31 G36 G174 M177 V181 T227Y29-L33 WeakPolarHBondContact O-CB 3.18Å; Y29-L33 PolarHBondContact O-N 3.28Å; L30-L33 HydrophobicContact CD2-CD2 4.43Å; L30-L33 WeakPolarHBondContact O-CB 3.28Å; L30-L33 PolarHBondContact O-N 3.36Å; I31-L33 VanDerWaalsContact C-N 3.32Å; I31-L33 PolarHBondContact O-N 2.87Å; L33-G36 WeakPolarHBondContact O-CA 3.35Å; L33-G36 PolarHBondContact O-N 3.3Å; L33-G36 VanDerWaalsContact O-N 3.15Å; L33-G174 VanDerWaalsContact CA-O 3.28Å; L33-G174 WeakPolarHBondContact CA-O 3.28Å; L33-G174 WeakPolarHBondContact CD1-O 3.33Å; L33-M177 HydrophobicContact CD1-CB 3.77Å; L33-V181 HydrophobicContact CD1-CG2 4.31Å; L33-T227 HydrophobicContact CD2-CG2 4.36Å
34S91.3Very high91Very high0 Ų09.8 Ų9.80%05%0.048CC..Hα-helixtrans-65.1-41.7174.6-58.80000112.7L30 I31 H32 G36 Y37 L224 T227 Q228L30-S34 PolarHBondContact O-N 2.81Å; L30-S34 VanDerWaalsContact O-N 3.07Å; L30-S34 PolarHBondContact O-OG 3.17Å; I31-S34 WeakPolarHBondContact O-CB 3.48Å; I31-S34 PolarHBondContact O-N 3.25Å; H32-S34 VanDerWaalsContact C-N 3.31Å; H32-S34 PolarHBondContact O-N 3.41Å; S34-G36 PolarHBondContact O-N 2.89Å; S34-Y37 WeakPolarHBondContact O-CB 3.39Å; S34-Y37 PolarHBondContact O-N 3.48Å; S34-Y37 VanDerWaalsContact O-N 3.17Å; S34-L224 WeakPolarHBondContact O-CD2 3.14Å; S34-T227 WeakPolarHBondContact OG-CB 3.39Å; S34-T227 WeakPolarHBondContact OG-CG2 3.38Å; S34-Q228 WeakPolarHBondContact OG-CG 3.25Å
35Y90.5Very high91.2Very high0 Ų09.8 Ų9.80%05%0.048CC..Hα-helixtrans-63.2-30.8172.8-61.8-23.1000111.8I31 H32 Y37 L38 S99 L103 V145 G148 F149 Y175I31-Y35 HydrophobicContact CG2-CD2 4.02Å; I31-Y35 HydrophobicContact CG2-CE1 4.09Å; I31-Y35 HydrophobicContact CG2-CE2 3.34Å; I31-Y35 WeakPolarHBondContact CG2-OH 3.42Å; I31-Y35 PolarHBondContact O-N 2.88Å; H32-Y35 CarbonylContact O-C 3.57Å; H32-Y35 PolarHBondContact O-N 3.36Å; Y35-Y37 PolarHBondContact O-N 3.24Å; Y35-Y37 VanDerWaalsContact O-N 3.15Å; Y35-L38 WeakPolarHBondContact O-CB 3.39Å; Y35-L38 PolarHBondContact O-N 3.22Å; Y35-L38 VanDerWaalsContact O-N 3.11Å; Y35-S99 PolarHBondContact OH-OG 3.27Å; Y35-L103 HydrophobicContact CD1-CD1 3.84Å; Y35-L103 HydrophobicContact CE1-CD1 3.49Å; Y35-L103 VanDerWaalsContact CE1-CD1 3.49Å; Y35-V145 HydrophobicContact CD1-CB 4.4Å; Y35-V145 HydrophobicContact CD1-CG2 3.77Å; Y35-V145 HydrophobicContact CD2-CG1 4.48Å; Y35-V145 HydrophobicContact CG-CG1 4.25Å; Y35-V145 HydrophobicContact CG-CG2 4.03Å; Y35-G148 WeakPolarHBondContact OH-CA 3.31Å; Y35-F149 HydrophobicContact CD2-CD2 4.15Å; Y35-F149 HydrophobicContact CE2-CB 4.45Å; Y35-Y175 VanDerWaalsContact C-CD2 3.45Å; Y35-Y175 WeakPolarHBondContact O-CE2 3.34Å
36G89.2Confident91.3Very high0 Ų09.3 Ų9.30%05%0.046CC..G310 helixtrans-63.9-11.3175.300000114.5H32 L33 S34 L38 Y39 Y175H32-G36 PolarHBondContact O-N 2.87Å; L33-G36 WeakPolarHBondContact O-CA 3.35Å; L33-G36 PolarHBondContact O-N 3.3Å; L33-G36 VanDerWaalsContact O-N 3.15Å; S34-G36 PolarHBondContact O-N 2.89Å; G36-L38 PolarHBondContact O-N 3.34Å; G36-L38 VanDerWaalsContact O-N 3.07Å; G36-Y39 PolarHBondContact O-N 2.94Å; G36-Y175 WeakPolarHBondContact CA-O 3.12Å; G36-Y175 VanDerWaalsContact N-CD2 3.34Å
37Y90.7Very high91.3Very high3 Ų35.6 Ų5.61%0.0123%0.026CC..G310 helixtrans-49.5-29164.6178.2-109.5000112.3S34 Y35 Y39 S40 V119 Y137 F141 F182 I220 L224S34-Y37 WeakPolarHBondContact O-CB 3.39Å; S34-Y37 PolarHBondContact O-N 3.48Å; S34-Y37 VanDerWaalsContact O-N 3.17Å; Y35-Y37 PolarHBondContact O-N 3.24Å; Y35-Y37 VanDerWaalsContact O-N 3.15Å; Y37-Y39 PolarHBondContact O-N 3.41Å; Y37-S40 WeakPolarHBondContact CD2-OG 3.22Å; Y37-S40 WeakPolarHBondContact CE2-OG 3.37Å; Y37-S40 WeakPolarHBondContact O-CA 3.48Å; Y37-S40 VanDerWaalsContact O-CB 3.31Å; Y37-S40 WeakPolarHBondContact O-CB 3.48Å; Y37-S40 PolarHBondContact O-N 2.59Å; Y37-S40 PolarHBondContact O-OG 2.84Å; Y37-V119 HydrophobicContact CD1-CG2 4.23Å; Y37-V119 HydrophobicContact CE1-CG1 4.36Å; Y37-V119 HydrophobicContact CE1-CG2 3.69Å; Y37-Y137 AromaticContact CE1-CE2 3.69Å; Y37-Y137 HydrophobicContact CE1-CE2 3.69Å; Y37-Y137 AromaticContact CE1-CZ 3.92Å; Y37-Y137 AromaticContact CZ-CE2 3.89Å; Y37-Y137 VanDerWaalsContact OH-CE2 3.25Å; Y37-Y137 WeakPolarHBondContact OH-CE2 3.1Å; Y37-Y137 PolarHBondContact OH-OH 3.44Å; Y37-F141 HydrophobicContact CD1-CD2 4.14Å; Y37-F141 AromaticContact CD1-CE2 3.51Å; Y37-F141 HydrophobicContact CD1-CE2 3.51Å; Y37-F141 AromaticContact CD1-CZ 3.83Å; Y37-F141 HydrophobicContact CD1-CZ 3.83Å; Y37-F141 HydrophobicContact CE1-CE2 4.41Å; Y37-F141 HydrophobicContact CG-CE2 4.28Å; Y37-F141 HydrophobicContact CG-CZ 4.4Å; Y37-F182 HydrophobicContact CD2-CB 4.04Å; Y37-F182 HydrophobicContact CD2-CD1 4.33Å; Y37-F182 AromaticContact CD2-CD2 3.83Å; Y37-F182 HydrophobicContact CD2-CD2 3.83Å; Y37-F182 HydrophobicContact CD2-CE2 4.45Å; Y37-F182 AromaticContact CD2-CG 3.8Å; Y37-F182 HydrophobicContact CD2-CG 3.8Å; Y37-F182 HydrophobicContact CE2-CB 4.48Å; Y37-F182 HydrophobicContact CG-CD2 4.42Å; Y37-I220 HydrophobicContact CD2-CG2 3.81Å; Y37-I220 HydrophobicContact CE2-CB 4.45Å; Y37-I220 HydrophobicContact CE2-CG2 3.33Å; Y37-L224 HydrophobicContact CD1-CD1 4.05Å; Y37-L224 HydrophobicContact CD2-CD1 4.18Å; Y37-L224 HydrophobicContact CE1-CD1 4.38Å; Y37-L224 HydrophobicContact CG-CD1 3.9Å; Y37-L224 HydrophobicContact CG-CD2 4.26Å
38L88.2Confident91.5Very high2 Ų25.6 Ų5.61%0.013%0.026CC..G310 helixtrans-52.8-38.9175.5-167.667.4000113.4Y35 G36 S40 L41 T72 F73 F141 Y175Y35-L38 WeakPolarHBondContact O-CB 3.39Å; Y35-L38 PolarHBondContact O-N 3.22Å; Y35-L38 VanDerWaalsContact O-N 3.11Å; G36-L38 PolarHBondContact O-N 3.34Å; G36-L38 VanDerWaalsContact O-N 3.07Å; L38-S40 PolarHBondContact O-N 3.09Å; L38-L41 HydrophobicContact CD1-CD1 3.4Å; L38-L41 VanDerWaalsContact CD1-CD1 3.4Å; L38-L41 HydrophobicContact CD1-CG 4.12Å; L38-L41 HydrophobicContact CG-CD1 4.19Å; L38-L41 WeakPolarHBondContact O-CB 3.01Å; L38-L41 WeakPolarHBondContact O-CG 3.28Å; L38-L41 PolarHBondContact O-N 3.41Å; L38-L41 VanDerWaalsContact O-N 3.09Å; L38-T72 HydrophobicContact CD1-CG2 3.27Å; L38-T72 HydrophobicContact CD2-CG2 4.3Å; L38-T72 HydrophobicContact CG-CG2 4.46Å; L38-F73 HydrophobicContact CD2-CD1 4.15Å; L38-F73 HydrophobicContact CD2-CE1 3.37Å; L38-F73 HydrophobicContact CD2-CE2 4.07Å; L38-F73 HydrophobicContact CD2-CZ 3.31Å; L38-F73 HydrophobicContact CG-CZ 4.27Å; L38-F141 HydrophobicContact CB-CE1 3.93Å; L38-F141 HydrophobicContact CB-CZ 4.49Å; L38-F141 HydrophobicContact CD1-CD1 4.07Å; L38-F141 HydrophobicContact CD1-CE1 3.84Å; L38-F141 HydrophobicContact CG-CE1 4.46Å; L38-Y175 WeakPolarHBondContact CD2-OH 3.44Å
39Y87.3Confident91.6Very high7 Ų75.7 Ų5.73%0.0273%0.027CC..G310 helixtrans-71-23.5178.9-73.1-59.3000112.7G36 Y37 L41 T42 Y175 L302 T306 R338 F391 L394G36-Y39 PolarHBondContact O-N 2.94Å; Y37-Y39 PolarHBondContact O-N 3.41Å; Y39-L41 PolarHBondContact O-N 3.44Å; Y39-T42 WeakPolarHBondContact O-CB 3.49Å; Y39-T42 PolarHBondContact O-N 3.1Å; Y39-T42 PolarHBondContact O-OG1 2.68Å; Y39-Y175 HydrophobicContact CD2-CD1 4.1Å; Y39-Y175 AromaticContact CD2-CE1 3.99Å; Y39-Y175 HydrophobicContact CD2-CE1 3.99Å; Y39-Y175 WeakPolarHBondContact CD2-O 3.41Å; Y39-Y175 AromaticContact CE2-CD1 3.33Å; Y39-Y175 HydrophobicContact CE2-CD1 3.33Å; Y39-Y175 AromaticContact CE2-CE1 3.22Å; Y39-Y175 HydrophobicContact CE2-CE1 3.22Å; Y39-Y175 HydrophobicContact CE2-CG 4.41Å; Y39-Y175 AromaticContact CZ-CE1 3.66Å; Y39-L302 HydrophobicContact CE1-CD1 3.98Å; Y39-T306 HydrophobicContact CD1-CG2 3.73Å; Y39-T306 HydrophobicContact CE1-CG2 3.8Å; Y39-R338 PolarHBondContact OH-NH2 3.21Å; Y39-F391 HydrophobicContact CD1-CE1 4.05Å; Y39-F391 HydrophobicContact CE1-CE1 4.39Å; Y39-L394 HydrophobicContact CE1-CD2 4.31Å
40S89.9Confident91.6Very high0 Ų03.7 Ų3.70%02%0.019CC..G310 helixtrans-71.3-9.617282.70000113Y37 L38 T42 N43 M44 Q186Y37-S40 WeakPolarHBondContact CD2-OG 3.22Å; Y37-S40 WeakPolarHBondContact CE2-OG 3.37Å; Y37-S40 WeakPolarHBondContact O-CA 3.48Å; Y37-S40 VanDerWaalsContact O-CB 3.31Å; Y37-S40 WeakPolarHBondContact O-CB 3.48Å; Y37-S40 PolarHBondContact O-N 2.59Å; Y37-S40 PolarHBondContact O-OG 2.84Å; L38-S40 PolarHBondContact O-N 3.09Å; S40-T42 PolarHBondContact O-N 3.06Å; S40-N43 WeakPolarHBondContact O-CA 3.2Å; S40-N43 WeakPolarHBondContact O-CB 3.42Å; S40-N43 PolarHBondContact O-N 3.31Å; S40-M44 PolarHBondContact O-N 2.85Å; S40-Q186 PolarHBondContact OG-NE2 3.27Å
41L89.9Confident91.7Very high4 Ų43 Ų32%0.0211%0.014CC..Hα-helixtrans-52.1-37168.5-74.4-176.2000111.3L38 Y39 N43 M44 V45 Y137L38-L41 HydrophobicContact CD1-CD1 3.4Å; L38-L41 VanDerWaalsContact CD1-CD1 3.4Å; L38-L41 HydrophobicContact CD1-CG 4.12Å; L38-L41 HydrophobicContact CG-CD1 4.19Å; L38-L41 WeakPolarHBondContact O-CB 3.01Å; L38-L41 WeakPolarHBondContact O-CG 3.28Å; L38-L41 PolarHBondContact O-N 3.41Å; L38-L41 VanDerWaalsContact O-N 3.09Å; Y39-L41 PolarHBondContact O-N 3.44Å; L41-N43 PolarHBondContact O-N 3.03Å; L41-M44 PolarHBondContact O-N 3Å; L41-M44 VanDerWaalsContact O-N 3.15Å; L41-V45 HydrophobicContact CB-CG2 4.48Å; L41-V45 WeakPolarHBondContact O-CB 3.4Å; L41-V45 WeakPolarHBondContact O-CG2 3.14Å; L41-V45 PolarHBondContact O-N 3.37Å; L41-Y137 HydrophobicContact CD2-CD1 3.87Å; L41-Y137 HydrophobicContact CD2-CE1 3.03Å; L41-Y137 WeakPolarHBondContact CD2-OH 3.46Å
42T90.4Very high91.8Very high1 Ų13 Ų31%0.0061%0.014CC..Hα-helixtrans-55.6-36.6176.7-60.20000111.8Y39 S40 T306 Y309 K310 V327Y39-T42 WeakPolarHBondContact O-CB 3.49Å; Y39-T42 PolarHBondContact O-N 3.1Å; Y39-T42 PolarHBondContact O-OG1 2.68Å; S40-T42 PolarHBondContact O-N 3.06Å; T42-T306 WeakPolarHBondContact CA-O 3.25Å; T42-T306 WeakPolarHBondContact CB-O 3.3Å; T42-T306 PolarHBondContact N-O 2.95Å; T42-T306 VanDerWaalsContact OG1-C 3.31Å; T42-T306 WeakPolarHBondContact OG1-CA 3.42Å; T42-T306 PolarHBondContact OG1-O 3.16Å; T42-Y309 HydrophobicContact CG2-CD1 3.91Å; T42-Y309 HydrophobicContact CG2-CG 4.33Å; T42-K310 HydrophobicContact CG2-CB 3.96Å; T42-K310 WeakPolarHBondContact O-CB 3.44Å; T42-V327 HydrophobicContact CG2-CG1 4.38Å; T42-V327 HydrophobicContact CG2-CG2 3.9Å
43N93.1Very high91.9Very high0 Ų04.1 Ų4.10%02%0.02CC..Hα-helixtrans-82.5-37.1178.7-165.956.4000112.7S40 L41 Y47 S183 Q186 T187 K310 T324S40-N43 WeakPolarHBondContact O-CA 3.2Å; S40-N43 WeakPolarHBondContact O-CB 3.42Å; S40-N43 PolarHBondContact O-N 3.31Å; L41-N43 PolarHBondContact O-N 3.03Å; N43-Y47 VanDerWaalsContact O-CD2 3.23Å; N43-Y47 WeakPolarHBondContact O-CD2 3.36Å; N43-Y47 WeakPolarHBondContact O-CE2 3.44Å; N43-S183 WeakPolarHBondContact CB-OG 3.49Å; N43-S183 PolarHBondContact ND2-O 3.15Å; N43-S183 VanDerWaalsContact ND2-O 3.08Å; N43-Q186 PolarHBondContact ND2-OE1 2.92Å; N43-T187 PolarHBondContact ND2-OG1 3.46Å; N43-T187 PolarHBondContact OD1-OG1 2.88Å; N43-K310 WeakPolarHBondContact OD1-CD 3.39Å; N43-K310 PolarHBondContact OD1-NZ 2.9Å; N43-T324 PolarHBondContact OD1-OG1 3.35Å
44M92.8Very high91.9Very high0 Ų05.9 Ų5.90%03%0.032CC..Hα-helixtrans-76.7-36.8-176.4-74.1-64.9-68.500114.3S40 L41 Y47 I48 Q186 I190 L213 V216 F217S40-M44 PolarHBondContact O-N 2.85Å; L41-M44 PolarHBondContact O-N 3Å; L41-M44 VanDerWaalsContact O-N 3.15Å; M44-Y47 PolarHBondContact O-N 2.98Å; M44-I48 HydrophobicContact CB-CD1 4.07Å; M44-I48 HydrophobicContact CE-CD1 4.44Å; M44-I48 WeakPolarHBondContact O-CG1 3.46Å; M44-I48 PolarHBondContact O-N 3.41Å; M44-Q186 HydrophobicContact CG-CG 4.14Å; M44-Q186 HydrophobicContact SD-CB 3.85Å; M44-Q186 HydrophobicContact SD-CG 3.5Å; M44-Q186 VanDerWaalsContact SD-CG 3.5Å; M44-I190 HydrophobicContact CE-CD1 4.33Å; M44-I190 HydrophobicContact SD-CD1 3.88Å; M44-L213 HydrophobicContact CE-CD1 3.61Å; M44-V216 HydrophobicContact CE-CG1 4.46Å; M44-F217 HydrophobicContact CE-CD1 4.29Å; M44-F217 HydrophobicContact CE-CE1 3.75Å; M44-F217 HydrophobicContact CE-CZ 4.15Å
45V93.1Very high92Very high0 Ų09.6 Ų9.60%05%0.048CC..Hα-helixtrans-54.6-45.3-172.9161.20000112.9L41 Y47 I48 M49 F68 S307L41-V45 HydrophobicContact CB-CG2 4.48Å; L41-V45 WeakPolarHBondContact O-CB 3.4Å; L41-V45 WeakPolarHBondContact O-CG2 3.14Å; L41-V45 PolarHBondContact O-N 3.37Å; V45-Y47 VanDerWaalsContact C-N 3.31Å; V45-Y47 PolarHBondContact O-N 2.85Å; V45-I48 PolarHBondContact O-N 2.86Å; V45-M49 HydrophobicContact CG1-CG 4.15Å; V45-M49 WeakPolarHBondContact O-CB 3.29Å; V45-M49 WeakPolarHBondContact O-CG 3.36Å; V45-M49 PolarHBondContact O-N 3.27Å; V45-F68 HydrophobicContact CG2-CB 4.21Å; V45-F68 HydrophobicContact CG2-CD2 4.14Å; V45-F68 HydrophobicContact CG2-CG 4.26Å; V45-S307 WeakPolarHBondContact CG1-O 3.45Å
46P93.1Very high92.1Very high5 Ų512.1 Ų12.13%0.0326%0.061CC..Hα-helixtrans-56.5-39.9175.3-31.238.9000114.7G50 F204 K310 Q314P46-G50 PolarHBondContact O-N 3.42Å; P46-F204 HydrophobicContact CB-CD2 4.23Å; P46-F204 HydrophobicContact CB-CE2 4.09Å; P46-K310 HydrophobicContact CG-CB 4.13Å; P46-K310 HydrophobicContact CG-CD 4.05Å; P46-K310 HydrophobicContact CG-CG 4.02Å; P46-Q314 VanDerWaalsContact CB-OE1 3.26Å
47Y94.6Very high92.1Very high0 Ų015.1 Ų15.10%08%0.077CC..Hα-helixtrans-73.4-39.6178.3-52.9-66.1000111.6N43 M44 V45 G50 Y51 T187 I190 N191 F204 I209 K310 D320N43-Y47 VanDerWaalsContact O-CD2 3.23Å; N43-Y47 WeakPolarHBondContact O-CD2 3.36Å; N43-Y47 WeakPolarHBondContact O-CE2 3.44Å; M44-Y47 PolarHBondContact O-N 2.98Å; V45-Y47 VanDerWaalsContact C-N 3.31Å; V45-Y47 PolarHBondContact O-N 2.85Å; Y47-G50 PolarHBondContact O-N 3.23Å; Y47-Y51 WeakPolarHBondContact O-CB 3.48Å; Y47-Y51 PolarHBondContact O-N 3.39Å; Y47-T187 PolarHBondContact OH-OG1 3.35Å; Y47-I190 HydrophobicContact CD1-CG2 3.51Å; Y47-I190 HydrophobicContact CD2-CD1 3.6Å; Y47-I190 HydrophobicContact CD2-CG2 4.3Å; Y47-I190 HydrophobicContact CE1-CB 4.5Å; Y47-I190 HydrophobicContact CE1-CG2 3.76Å; Y47-I190 HydrophobicContact CE2-CD1 4.06Å; Y47-I190 HydrophobicContact CG-CD1 3.94Å; Y47-I190 HydrophobicContact CG-CG2 3.82Å; Y47-N191 HydrophobicContact CE1-CB 4.32Å; Y47-F204 AromaticContact CD1-CD2 3.48Å; Y47-F204 HydrophobicContact CD1-CD2 3.48Å; Y47-F204 VanDerWaalsContact CD1-CD2 3.48Å; Y47-F204 AromaticContact CD1-CE2 3.56Å; Y47-F204 HydrophobicContact CD1-CE2 3.56Å; Y47-F204 HydrophobicContact CD1-CG 4.13Å; Y47-F204 HydrophobicContact CD1-CZ 4.31Å; Y47-F204 AromaticContact CE1-CD2 3.69Å; Y47-F204 HydrophobicContact CE1-CD2 3.69Å; Y47-F204 HydrophobicContact CE1-CE1 4.28Å; Y47-F204 AromaticContact CE1-CE2 3.27Å; Y47-F204 HydrophobicContact CE1-CE2 3.27Å; Y47-F204 HydrophobicContact CE1-CG 4.33Å; Y47-F204 AromaticContact CE1-CZ 3.64Å; Y47-F204 HydrophobicContact CE1-CZ 3.64Å; Y47-F204 HydrophobicContact CG-CD2 4.42Å; Y47-I209 HydrophobicContact CD1-CG2 4.43Å; Y47-K310 PolarHBondContact OH-NZ 2.97Å; Y47-D320 PolarHBondContact OH-OD1 2.88Å; Y47-D320 VanDerWaalsContact OH-OD1 3.09Å; Y47-D320 PolarHBondContact OH-OD2 2.77Å
48I94.2Very high92.1Very high0 Ų019.6 Ų19.60%011%0.106CC..Hα-helixtrans-62.3-47.1176.8-66.6172.6000110.7M44 V45 Y51 L52 F68 I126 V133 Y137 L213 F217M44-I48 HydrophobicContact CB-CD1 4.07Å; M44-I48 HydrophobicContact CE-CD1 4.44Å; M44-I48 WeakPolarHBondContact O-CG1 3.46Å; M44-I48 PolarHBondContact O-N 3.41Å; V45-I48 PolarHBondContact O-N 2.86Å; I48-Y51 PolarHBondContact O-N 3.13Å; I48-L52 HydrophobicContact CG2-CD1 3.83Å; I48-L52 HydrophobicContact CG2-CG 4.46Å; I48-L52 WeakPolarHBondContact O-CB 3.36Å; I48-L52 VanDerWaalsContact O-CG 3.27Å; I48-L52 WeakPolarHBondContact O-CG 3.45Å; I48-L52 PolarHBondContact O-N 3.32Å; I48-F68 HydrophobicContact CG2-CE1 4.12Å; I48-F68 HydrophobicContact CG2-CE2 4.01Å; I48-F68 HydrophobicContact CG2-CZ 3.43Å; I48-F68 VanDerWaalsContact CG2-CZ 3.43Å; I48-I126 HydrophobicContact CG2-CD1 3.91Å; I48-V133 HydrophobicContact CG2-CG1 4.33Å; I48-Y137 HydrophobicContact CD1-CD1 3.99Å; I48-Y137 HydrophobicContact CD1-CE1 3.49Å; I48-Y137 VanDerWaalsContact CD1-CE1 3.49Å; I48-L213 HydrophobicContact CG1-CD1 4.38Å; I48-L213 HydrophobicContact CG1-CD2 4.18Å; I48-F217 HydrophobicContact CD1-CE1 4.17Å; I48-F217 HydrophobicContact CD1-CZ 3.87Å; I48-F217 HydrophobicContact CG1-CZ 3.92Å
49M93.2Very high92.1Very high2 Ų227.3 Ų27.31%0.0114%0.142CC..Hα-helixtrans-65.2-43.3177.7-68.7-55.5-51.100111.6V45 Y51 L52 I53 I60 F68V45-M49 HydrophobicContact CG1-CG 4.15Å; V45-M49 WeakPolarHBondContact O-CB 3.29Å; V45-M49 WeakPolarHBondContact O-CG 3.36Å; V45-M49 PolarHBondContact O-N 3.27Å; M49-Y51 VanDerWaalsContact C-N 3.34Å; M49-Y51 PolarHBondContact O-N 2.78Å; M49-L52 PolarHBondContact O-N 2.93Å; M49-I53 HydrophobicContact CE-CD1 4.09Å; M49-I53 HydrophobicContact CE-CG1 4.46Å; M49-I53 WeakPolarHBondContact O-CB 3.47Å; M49-I53 VanDerWaalsContact O-CG1 3.23Å; M49-I53 WeakPolarHBondContact O-CG1 3.35Å; M49-I53 PolarHBondContact O-N 3.02Å; M49-I60 HydrophobicContact CE-CG2 3.5Å; M49-F68 HydrophobicContact SD-CE2 3.91Å
50G93Very high92.1Very high0 Ų027.9 Ų27.90%015%0.145CC..Hα-helixtrans-56.5-47.2174.100000112.2P46 Y47 L52 I53 T54 F204P46-G50 PolarHBondContact O-N 3.42Å; Y47-G50 PolarHBondContact O-N 3.23Å; G50-L52 PolarHBondContact O-N 3.33Å; G50-I53 PolarHBondContact O-N 3.32Å; G50-T54 VanDerWaalsContact O-CB 3.29Å; G50-T54 WeakPolarHBondContact O-CB 3.47Å; G50-T54 PolarHBondContact O-N 2.82Å; G50-T54 PolarHBondContact O-OG1 3.31Å; G50-T54 VanDerWaalsContact O-OG1 3.07Å; G50-F204 VanDerWaalsContact CA-O 3.29Å; G50-F204 WeakPolarHBondContact CA-O 3.23Å
51Y95.3Very high92Very high19 Ų1930.4 Ų30.48%0.07516%0.162CC..Hα-helixtrans-60.5-47.6177.8-172.8-81.2000112.6Y47 I48 M49 F55 I56 I126 L210 L213 P214Y47-Y51 WeakPolarHBondContact O-CB 3.48Å; Y47-Y51 PolarHBondContact O-N 3.39Å; I48-Y51 PolarHBondContact O-N 3.13Å; M49-Y51 VanDerWaalsContact C-N 3.34Å; M49-Y51 PolarHBondContact O-N 2.78Å; Y51-F55 HydrophobicContact CD1-CD2 4.27Å; Y51-F55 AromaticContact CD2-CD2 3.56Å; Y51-F55 HydrophobicContact CD2-CD2 3.56Å; Y51-F55 AromaticContact CD2-CE2 3.87Å; Y51-F55 HydrophobicContact CD2-CE2 3.87Å; Y51-F55 HydrophobicContact CE1-CB 4.34Å; Y51-F55 HydrophobicContact CE1-CD2 4.23Å; Y51-F55 AromaticContact CE2-CD2 3.5Å; Y51-F55 HydrophobicContact CE2-CD2 3.5Å; Y51-F55 AromaticContact CE2-CE2 3.82Å; Y51-F55 HydrophobicContact CE2-CE2 3.82Å; Y51-F55 AromaticContact CG-CD2 3.96Å; Y51-F55 HydrophobicContact CG-CD2 3.96Å; Y51-F55 AromaticContact CZ-CD2 3.86Å; Y51-F55 WeakPolarHBondContact O-CB 3.4Å; Y51-F55 PolarHBondContact O-N 3.24Å; Y51-I56 HydrophobicContact CD1-CG1 4.43Å; Y51-I56 HydrophobicContact CE1-CD1 4.32Å; Y51-I56 HydrophobicContact CE1-CG1 4.24Å; Y51-I126 HydrophobicContact CD1-CD1 3.99Å; Y51-I126 HydrophobicContact CD1-CG1 3.58Å; Y51-I126 HydrophobicContact CE1-CG1 3.87Å; Y51-I126 VanDerWaalsContact CE1-O 3.31Å; Y51-I126 WeakPolarHBondContact CE1-O 3.28Å; Y51-I126 HydrophobicContact CG-CG1 4.16Å; Y51-L210 HydrophobicContact CD2-CB 4.05Å; Y51-L210 WeakPolarHBondContact CD2-O 3.46Å; Y51-L210 WeakPolarHBondContact CE2-O 3.46Å; Y51-L213 HydrophobicContact CD2-CB 4.31Å; Y51-L213 HydrophobicContact CD2-CD2 4.14Å; Y51-L213 HydrophobicContact CG-CD2 3.91Å; Y51-P214 HydrophobicContact CE2-CG 3.97Å
52L94.2Very high91.8Very high0 Ų031.4 Ų31.40%017%0.169CC..Hα-helixtrans-65.6-42.6-177.3-73.5170.2000112.1I48 M49 G50 I56 D57 I60 I126 Y130 V133I48-L52 HydrophobicContact CG2-CD1 3.83Å; I48-L52 HydrophobicContact CG2-CG 4.46Å; I48-L52 WeakPolarHBondContact O-CB 3.36Å; I48-L52 VanDerWaalsContact O-CG 3.27Å; I48-L52 WeakPolarHBondContact O-CG 3.45Å; I48-L52 PolarHBondContact O-N 3.32Å; M49-L52 PolarHBondContact O-N 2.93Å; G50-L52 PolarHBondContact O-N 3.33Å; L52-I56 HydrophobicContact CD2-CB 4.3Å; L52-I56 HydrophobicContact CD2-CG1 4.03Å; L52-I56 WeakPolarHBondContact O-CA 3.46Å; L52-I56 WeakPolarHBondContact O-CB 3.37Å; L52-I56 PolarHBondContact O-N 3.47Å; L52-D57 PolarHBondContact O-N 3.27Å; L52-I60 HydrophobicContact CB-CD1 4.03Å; L52-I126 HydrophobicContact CD1-CD1 4.4Å; L52-I126 HydrophobicContact CD2-CD1 3.92Å; L52-I126 HydrophobicContact CG-CD1 3.88Å; L52-Y130 HydrophobicContact CD1-CD2 3.72Å; L52-V133 HydrophobicContact CD2-CG2 4.24Å
53I93Very high91.6Very high25 Ų2538.4 Ų38.413%0.12820%0.201CC..Hα-helixtrans-68.9-41.9179.7-67.1168.5000110.5M49 G50 P58 I60 V62 Q203M49-I53 HydrophobicContact CE-CD1 4.09Å; M49-I53 HydrophobicContact CE-CG1 4.46Å; M49-I53 WeakPolarHBondContact O-CB 3.47Å; M49-I53 VanDerWaalsContact O-CG1 3.23Å; M49-I53 WeakPolarHBondContact O-CG1 3.35Å; M49-I53 PolarHBondContact O-N 3.02Å; G50-I53 PolarHBondContact O-N 3.32Å; I53-P58 WeakPolarHBondContact O-CA 3.41Å; I53-I60 HydrophobicContact CG1-CB 4.16Å; I53-I60 HydrophobicContact CG1-CG2 4.42Å; I53-I60 WeakPolarHBondContact CG1-O 3.32Å; I53-V62 HydrophobicContact CD1-CG2 3.8Å; I53-Q203 VanDerWaalsContact CD1-OE1 3.28Å
54T92.7Very high91.3Very high56 Ų5638.9 Ų38.934%0.34420%0.204SC..Hα-helixtrans-75.7-40.8-176.9-62.50000113.3G50 L210G50-T54 VanDerWaalsContact O-CB 3.29Å; G50-T54 WeakPolarHBondContact O-CB 3.47Å; G50-T54 PolarHBondContact O-N 2.82Å; G50-T54 PolarHBondContact O-OG1 3.31Å; G50-T54 VanDerWaalsContact O-OG1 3.07Å; T54-L210 HydrophobicContact CG2-CD1 4.09Å
55F93.5Very high91Very high78 Ų7839 Ų3934%0.34221%0.205SC..Hα-helixtrans-109.9-22.4-169.8-64.3-56.3000115.8Y51 P207 L210Y51-F55 HydrophobicContact CD1-CD2 4.27Å; Y51-F55 AromaticContact CD2-CD2 3.56Å; Y51-F55 HydrophobicContact CD2-CD2 3.56Å; Y51-F55 AromaticContact CD2-CE2 3.87Å; Y51-F55 HydrophobicContact CD2-CE2 3.87Å; Y51-F55 HydrophobicContact CE1-CB 4.34Å; Y51-F55 HydrophobicContact CE1-CD2 4.23Å; Y51-F55 AromaticContact CE2-CD2 3.5Å; Y51-F55 HydrophobicContact CE2-CD2 3.5Å; Y51-F55 AromaticContact CE2-CE2 3.82Å; Y51-F55 HydrophobicContact CE2-CE2 3.82Å; Y51-F55 AromaticContact CG-CD2 3.96Å; Y51-F55 HydrophobicContact CG-CD2 3.96Å; Y51-F55 AromaticContact CZ-CD2 3.86Å; Y51-F55 WeakPolarHBondContact O-CB 3.4Å; Y51-F55 PolarHBondContact O-N 3.24Å; F55-P207 HydrophobicContact CZ-CB 4.05Å; F55-L210 HydrophobicContact CD2-CB 4.31Å; F55-L210 HydrophobicContact CE2-CB 3.48Å; F55-L210 VanDerWaalsContact CE2-CB 3.48Å; F55-L210 HydrophobicContact CE2-CD1 4.2Å; F55-L210 HydrophobicContact CZ-CB 4.26Å
56I92.7Very high90.7Very high53 Ų5340.1 Ų40.127%0.27221%0.212SC..THydrogen-bonded Turntrans-110.8-59.5-170.3-54.8-58.5000111.4Y51 L52 Q127Y51-I56 HydrophobicContact CD1-CG1 4.43Å; Y51-I56 HydrophobicContact CE1-CD1 4.32Å; Y51-I56 HydrophobicContact CE1-CG1 4.24Å; L52-I56 HydrophobicContact CD2-CB 4.3Å; L52-I56 HydrophobicContact CD2-CG1 4.03Å; L52-I56 WeakPolarHBondContact O-CA 3.46Å; L52-I56 WeakPolarHBondContact O-CB 3.37Å; L52-I56 PolarHBondContact O-N 3.47Å; I56-Q127 VanDerWaalsContact CD1-C 3.49Å; I56-Q127 WeakPolarHBondContact CD1-O 3.4Å
57D90Very high90.5Very high62 Ų6242.2 Ų42.233%0.33222%0.219SC..  trans-150.2104.3-177.2-179.23.7000110.6L52 H59 I60L52-D57 PolarHBondContact O-N 3.27Å; D57-H59 PolarHBondContact O-N 2.86Å; D57-H59 VanDerWaalsContact O-N 3.12Å; D57-H59 VanDerWaalsContact OD1-CB 3.28Å; D57-H59 WeakPolarHBondContact OD1-CB 3.38Å; D57-H59 IonicContact OD1-CD2 3.36Å; D57-H59 PolarHBondContact OD1-CD2 2.93Å; D57-H59 IonicContact OD1-CG 3.65Å; D57-H59 PolarHBondContact OD1-N 3.41Å; D57-I60 HydrophobicContact CB-CD1 3.75Å; D57-I60 HydrophobicContact CB-CG1 3.87Å; D57-I60 WeakPolarHBondContact O-CG1 3.45Å; D57-I60 PolarHBondContact O-N 3.36Å
58P89.2Confident90.2Very high98 Ų9842.2 Ų42.264%0.63622%0.219SC*.THydrogen-bonded Turntrans-61.9-15177.1-23.534.4000114.6I53 I60I53-P58 WeakPolarHBondContact O-CA 3.41Å; P58-I60 VanDerWaalsContact C-N 3.32Å
59H89.2Confident90Very high163 Ų16342.2 Ų42.276%0.75522%0.219SC*.THydrogen-bonded Turntrans-83.5-6.9179.5-58.8-66.7000113.4D57 C61D57-H59 PolarHBondContact O-N 2.86Å; D57-H59 VanDerWaalsContact O-N 3.12Å; D57-H59 VanDerWaalsContact OD1-CB 3.28Å; D57-H59 WeakPolarHBondContact OD1-CB 3.38Å; D57-H59 IonicContact OD1-CD2 3.36Å; D57-H59 PolarHBondContact OD1-CD2 2.93Å; D57-H59 IonicContact OD1-CG 3.65Å; D57-H59 PolarHBondContact OD1-N 3.41Å; H59-C61 PolarHBondContact O-N 3Å
60I87.8Confident89.7Confident20 Ų2042.5 Ų42.510%0.10322%0.221CC..  trans-66.2121.9176.9-64.8168.3000109.7M49 L52 I53 D57 P58 Y130M49-I60 HydrophobicContact CE-CG2 3.5Å; L52-I60 HydrophobicContact CB-CD1 4.03Å; I53-I60 HydrophobicContact CG1-CB 4.16Å; I53-I60 HydrophobicContact CG1-CG2 4.42Å; I53-I60 WeakPolarHBondContact CG1-O 3.32Å; D57-I60 HydrophobicContact CB-CD1 3.75Å; D57-I60 HydrophobicContact CB-CG1 3.87Å; D57-I60 WeakPolarHBondContact O-CG1 3.45Å; D57-I60 PolarHBondContact O-N 3.36Å; P58-I60 VanDerWaalsContact C-N 3.32Å; I60-Y130 HydrophobicContact CD1-CG 4.42Å
61C87.6Confident89.6Confident52 Ų5243.2 Ų43.235%0.35123%0.226SC..  trans-81.7141.9175-52.80000111.4H59 Q63 T64 C442H59-C61 PolarHBondContact O-N 3Å; C61-Q63 VanDerWaalsContact CB-OE1 3.31Å; C61-Q63 PolarHBondContact O-N 2.91Å; C61-T64 WeakPolarHBondContact O-CB 3.19Å; C61-T64 WeakPolarHBondContact O-CG2 3.48Å; C61-T64 PolarHBondContact O-N 3.46Å; C61-T64 PolarHBondContact O-OG1 3.08Å; C61-C442 WeakPolarHBondContact CB-SG 3.16Å; C61-C442 PolarHBondContact SG-SG 3.34Å
62V86Confident89.3Confident26 Ų2642.3 Ų42.316%0.15822%0.223CC..G310 helixtrans-59.8-29.4179.3179.30000113.1I53 T64 S65 Q203 L311I53-V62 HydrophobicContact CD1-CG2 3.8Å; V62-T64 PolarHBondContact O-N 3.08Å; V62-T64 VanDerWaalsContact O-N 3.15Å; V62-S65 WeakPolarHBondContact O-CB 3.44Å; V62-S65 PolarHBondContact O-N 3.12Å; V62-S65 PolarHBondContact O-OG 3.33Å; V62-Q203 HydrophobicContact CG2-CG 4.25Å; V62-L311 HydrophobicContact CG1-CD1 3.75Å; V62-L311 HydrophobicContact CG1-CD2 3.24Å; V62-L311 HydrophobicContact CG1-CG 4.01Å
63Q84.6Confident89Confident147 Ų14742.6 Ų42.669%0.68722%0.224SC*.G310 helixtrans-59.7-25177.5-6486.3-21.700112.4C61 S65 V66C61-Q63 VanDerWaalsContact CB-OE1 3.31Å; C61-Q63 PolarHBondContact O-N 2.91Å; Q63-S65 PolarHBondContact O-N 3.5Å; Q63-V66 PolarHBondContact O-N 3.33Å
64T86.8Confident88.8Confident11 Ų1141.5 Ų41.57%0.06722%0.218CC..G310 helixtrans-66.4-17175.965.10000112.8C61 V62 V66 W67 Y130 C442C61-T64 WeakPolarHBondContact O-CB 3.19Å; C61-T64 WeakPolarHBondContact O-CG2 3.48Å; C61-T64 PolarHBondContact O-N 3.46Å; C61-T64 PolarHBondContact O-OG1 3.08Å; V62-T64 PolarHBondContact O-N 3.08Å; V62-T64 VanDerWaalsContact O-N 3.15Å; T64-V66 PolarHBondContact O-N 2.88Å; T64-W67 VanDerWaalsContact O-CB 3.31Å; T64-W67 WeakPolarHBondContact O-CB 2.95Å; T64-W67 PolarHBondContact O-N 3.47Å; T64-Y130 PolarHBondContact O-OH 3.09Å; T64-C442 HydrophobicContact CG2-CB 3.72Å; T64-C442 WeakPolarHBondContact CG2-SG 3.22Å
65S87Confident88.6Confident1 Ų139.2 Ų39.21%0.00720%0.204CC..G310 helixtrans-54.5-25.6175.661.10000114.7V62 Q63 W67 F68V62-S65 WeakPolarHBondContact O-CB 3.44Å; V62-S65 PolarHBondContact O-N 3.12Å; V62-S65 PolarHBondContact O-OG 3.33Å; Q63-S65 PolarHBondContact O-N 3.5Å; S65-W67 PolarHBondContact O-N 3.07Å; S65-F68 WeakPolarHBondContact O-CB 3.43Å; S65-F68 WeakPolarHBondContact O-CD2 3.48Å; S65-F68 PolarHBondContact O-N 3.26Å; S65-F68 VanDerWaalsContact O-N 3.14Å
66V86.5Confident88.4Confident25 Ų2535.9 Ų35.915%0.15219%0.19CC..Hα-helixtrans-59.7-28.9176.4179.40000111.8Q63 T64 F68 S69 A70 T303 F432Q63-V66 PolarHBondContact O-N 3.33Å; T64-V66 PolarHBondContact O-N 2.88Å; V66-F68 PolarHBondContact O-N 2.99Å; V66-S69 PolarHBondContact O-N 3.28Å; V66-A70 WeakPolarHBondContact O-CB 3.35Å; V66-A70 PolarHBondContact O-N 3.23Å; V66-T303 HydrophobicContact CG1-CG2 4.46Å; V66-F432 HydrophobicContact CG1-CE1 4.32Å; V66-F432 HydrophobicContact CG1-CE2 4.26Å; V66-F432 HydrophobicContact CG1-CZ 3.84Å
67W88.4Confident88.1Confident49 Ų4933.4 Ų33.419%0.18618%0.177CC..Hα-helixtrans-62.1-27.8178.3-72.7109.3000113.4T64 S65 S69 A70 V71 Y130 I134 F429 F432 L433 S436T64-W67 VanDerWaalsContact O-CB 3.31Å; T64-W67 WeakPolarHBondContact O-CB 2.95Å; T64-W67 PolarHBondContact O-N 3.47Å; S65-W67 PolarHBondContact O-N 3.07Å; W67-S69 PolarHBondContact O-N 3.14Å; W67-A70 HydrophobicContact CE3-CB 4.49Å; W67-A70 PolarHBondContact O-N 3.21Å; W67-V71 HydrophobicContact CE3-CG2 4.06Å; W67-V71 WeakPolarHBondContact O-CB 3.4Å; W67-V71 VanDerWaalsContact O-CG2 3.3Å; W67-V71 WeakPolarHBondContact O-CG2 3.41Å; W67-V71 PolarHBondContact O-N 3.01Å; W67-Y130 WeakPolarHBondContact CB-OH 3.44Å; W67-I134 HydrophobicContact CB-CD1 4.02Å; W67-F429 HydrophobicContact CE3-CD2 4.48Å; W67-F429 HydrophobicContact CE3-CE2 4.21Å; W67-F429 AromaticContact CZ3-CD2 3.86Å; W67-F429 HydrophobicContact CZ3-CD2 3.86Å; W67-F429 AromaticContact CZ3-CE2 3.63Å; W67-F429 HydrophobicContact CZ3-CE2 3.63Å; W67-F432 HydrophobicContact CH2-CB 4.21Å; W67-F432 HydrophobicContact CZ3-CB 4.48Å; W67-L433 HydrophobicContact CH2-CD2 3.69Å; W67-L433 HydrophobicContact CH2-CG 4.04Å; W67-L433 HydrophobicContact CZ3-CD2 4.1Å; W67-L433 HydrophobicContact CZ3-CG 4.34Å; W67-S436 VanDerWaalsContact CZ2-OG 3.27Å; W67-S436 WeakPolarHBondContact CZ2-OG 3.34Å
68F89.8Confident88.1Confident0 Ų033.7 Ų33.70%018%0.178CC..Hα-helixtrans-56.8-52.3176.1-77.5-74.6000111.3V45 I48 M49 S65 V66 T72 Y130 V133 I134 Y137 S138V45-F68 HydrophobicContact CG2-CB 4.21Å; V45-F68 HydrophobicContact CG2-CD2 4.14Å; V45-F68 HydrophobicContact CG2-CG 4.26Å; I48-F68 HydrophobicContact CG2-CE1 4.12Å; I48-F68 HydrophobicContact CG2-CE2 4.01Å; I48-F68 HydrophobicContact CG2-CZ 3.43Å; I48-F68 VanDerWaalsContact CG2-CZ 3.43Å; M49-F68 HydrophobicContact SD-CE2 3.91Å; S65-F68 WeakPolarHBondContact O-CB 3.43Å; S65-F68 WeakPolarHBondContact O-CD2 3.48Å; S65-F68 PolarHBondContact O-N 3.26Å; S65-F68 VanDerWaalsContact O-N 3.14Å; V66-F68 PolarHBondContact O-N 2.99Å; F68-T72 WeakPolarHBondContact O-CB 3.35Å; F68-T72 PolarHBondContact O-N 3.02Å; F68-T72 PolarHBondContact O-OG1 2.94Å; F68-Y130 HydrophobicContact CE2-CE2 4.04Å; F68-Y130 HydrophobicContact CZ-CE2 4.21Å; F68-V133 HydrophobicContact CE1-CB 4.38Å; F68-V133 HydrophobicContact CE1-CG1 3.73Å; F68-V133 HydrophobicContact CZ-CG1 4.12Å; F68-I134 HydrophobicContact CD1-CD1 3.61Å; F68-I134 HydrophobicContact CD2-CD1 4.05Å; F68-I134 HydrophobicContact CE1-CD1 3.63Å; F68-I134 HydrophobicContact CE1-CG1 4.46Å; F68-I134 HydrophobicContact CE2-CD1 4.06Å; F68-I134 HydrophobicContact CG-CD1 3.81Å; F68-I134 HydrophobicContact CZ-CD1 3.84Å; F68-Y137 AromaticContact CD1-CD1 3.77Å; F68-Y137 HydrophobicContact CD1-CD1 3.77Å; F68-Y137 HydrophobicContact CD1-CE1 4.43Å; F68-Y137 AromaticContact CE1-CD1 3.96Å; F68-Y137 HydrophobicContact CE1-CD1 3.96Å; F68-S138 WeakPolarHBondContact CA-OG 3.36Å; F68-S138 WeakPolarHBondContact CD1-OG 3.36Å; F68-S138 WeakPolarHBondContact O-CB 3.43Å; F68-S138 PolarHBondContact O-OG 3.15Å
69S88.7Confident88.1Confident0 Ų031.4 Ų31.40%016%0.158CC..Hα-helixtrans-75.2-39.4178.1-68.70000111.6V66 W67 T72 F73 T303 T306 S307V66-S69 PolarHBondContact O-N 3.28Å; W67-S69 PolarHBondContact O-N 3.14Å; S69-T72 PolarHBondContact O-N 3.39Å; S69-F73 WeakPolarHBondContact O-CD2 3.41Å; S69-F73 PolarHBondContact O-N 3.35Å; S69-T303 VanDerWaalsContact C-CG2 3.48Å; S69-T306 WeakPolarHBondContact CB-OG1 3.33Å; S69-T306 WeakPolarHBondContact OG-CB 3.27Å; S69-T306 PolarHBondContact OG-OG1 3.42Å; S69-S307 PolarHBondContact OG-N 3.15Å
70A88.2Confident88.2Confident7 Ų723.6 Ų23.66%0.05812%0.122CC..Hα-helixtrans-63.9-47.1-174.300000112.2V66 W67 T72 A74 T303 F432V66-A70 WeakPolarHBondContact O-CB 3.35Å; V66-A70 PolarHBondContact O-N 3.23Å; W67-A70 HydrophobicContact CE3-CB 4.49Å; W67-A70 PolarHBondContact O-N 3.21Å; A70-T72 VanDerWaalsContact C-N 3.34Å; A70-A74 VanDerWaalsContact O-CB 3.26Å; A70-A74 WeakPolarHBondContact O-CB 3.37Å; A70-A74 PolarHBondContact O-N 3.15Å; A70-T303 VanDerWaalsContact CA-CG2 3.46Å; A70-T303 HydrophobicContact CB-CG2 3.83Å; A70-F432 HydrophobicContact CB-CD2 4.36Å
71V89.6Confident88.3Confident15 Ų1523.4 Ų23.49%0.09112%0.122CC..Hα-helixtrans-61.4-46.1175.3173.30000109.9W67 F73 A74 V75 I134 F139 F429W67-V71 HydrophobicContact CE3-CG2 4.06Å; W67-V71 WeakPolarHBondContact O-CB 3.4Å; W67-V71 VanDerWaalsContact O-CG2 3.3Å; W67-V71 WeakPolarHBondContact O-CG2 3.41Å; W67-V71 PolarHBondContact O-N 3.01Å; V71-F73 PolarHBondContact O-N 3.4Å; V71-A74 PolarHBondContact O-N 2.83Å; V71-V75 HydrophobicContact CG1-CG2 4.08Å; V71-V75 WeakPolarHBondContact O-CB 3.25Å; V71-V75 VanDerWaalsContact O-CG2 3.23Å; V71-V75 WeakPolarHBondContact O-CG2 3.2Å; V71-V75 PolarHBondContact O-N 3.22Å; V71-I134 HydrophobicContact CB-CG2 4.26Å; V71-I134 HydrophobicContact CG1-CG2 4.28Å; V71-I134 HydrophobicContact CG2-CG2 3.78Å; V71-F139 HydrophobicContact CG1-CB 3.93Å; V71-F139 HydrophobicContact CG1-CD2 4.49Å; V71-F429 HydrophobicContact CG2-CE2 3.93Å
72T89.1Confident88.4Confident1 Ų125.1 Ų25.11%0.00613%0.127CC..Hα-helixtrans-60.1-48.2-177.8-53.80000112.2L38 F68 S69 A70 A74 Y76 S138 F141L38-T72 HydrophobicContact CD1-CG2 3.27Å; L38-T72 HydrophobicContact CD2-CG2 4.3Å; L38-T72 HydrophobicContact CG-CG2 4.46Å; F68-T72 WeakPolarHBondContact O-CB 3.35Å; F68-T72 PolarHBondContact O-N 3.02Å; F68-T72 PolarHBondContact O-OG1 2.94Å; S69-T72 PolarHBondContact O-N 3.39Å; A70-T72 VanDerWaalsContact C-N 3.34Å; T72-A74 PolarHBondContact O-N 2.9Å; T72-Y76 WeakPolarHBondContact O-CB 3.45Å; T72-Y76 PolarHBondContact O-N 3.49Å; T72-S138 WeakPolarHBondContact OG1-CA 3.44Å; T72-S138 VanDerWaalsContact OG1-CB 3.23Å; T72-S138 WeakPolarHBondContact OG1-CB 3.25Å; T72-S138 PolarHBondContact OG1-O 2.72Å; T72-F141 HydrophobicContact CG2-CD1 3.9Å
73F88.1Confident88.4Confident6 Ų623.9 Ų23.93%0.02612%0.119CC..Hα-helixtrans-69.6-31.5179.6-75.9-62.8000113.4L38 S69 V71 Y76 G77 L302 T303 T306L38-F73 HydrophobicContact CD2-CD1 4.15Å; L38-F73 HydrophobicContact CD2-CE1 3.37Å; L38-F73 HydrophobicContact CD2-CE2 4.07Å; L38-F73 HydrophobicContact CD2-CZ 3.31Å; L38-F73 HydrophobicContact CG-CZ 4.27Å; S69-F73 WeakPolarHBondContact O-CD2 3.41Å; S69-F73 PolarHBondContact O-N 3.35Å; V71-F73 PolarHBondContact O-N 3.4Å; F73-Y76 HydrophobicContact CD1-CD1 4.01Å; F73-G77 PolarHBondContact O-N 3.14Å; F73-L302 HydrophobicContact CD1-CD2 4.24Å; F73-L302 HydrophobicContact CE1-CD1 4.47Å; F73-L302 HydrophobicContact CE1-CD2 3.71Å; F73-L302 HydrophobicContact CE1-CG 4.17Å; F73-L302 HydrophobicContact CE2-CD1 4.25Å; F73-L302 HydrophobicContact CE2-CD2 4.33Å; F73-L302 HydrophobicContact CE2-CG 3.92Å; F73-L302 HydrophobicContact CZ-CD1 3.76Å; F73-L302 HydrophobicContact CZ-CD2 3.76Å; F73-L302 HydrophobicContact CZ-CG 3.68Å; F73-T303 HydrophobicContact CD2-CG2 4.34Å; F73-T306 HydrophobicContact CE2-CG2 4.25Å; F73-T306 HydrophobicContact CZ-CG2 4.28Å
74A88.5Confident88.5Confident2 Ų216.9 Ų16.92%0.0179%0.087CC..Hα-helixtrans-70.1-48.9176.800000111.7A70 V71 T72 Y76 G77 I78 F429A70-A74 VanDerWaalsContact O-CB 3.26Å; A70-A74 WeakPolarHBondContact O-CB 3.37Å; A70-A74 PolarHBondContact O-N 3.15Å; V71-A74 PolarHBondContact O-N 2.83Å; T72-A74 PolarHBondContact O-N 2.9Å; A74-Y76 VanDerWaalsContact C-N 3.32Å; A74-G77 PolarHBondContact O-N 3.35Å; A74-I78 WeakPolarHBondContact O-CG1 3.43Å; A74-I78 PolarHBondContact O-N 3Å; A74-F429 HydrophobicContact CB-CB 3.4Å; A74-F429 VanDerWaalsContact CB-CB 3.4Å; A74-F429 HydrophobicContact CB-CD1 4.29Å; A74-F429 HydrophobicContact CB-CD2 4.07Å; A74-F429 HydrophobicContact CB-CG 3.69Å
75V89.9Confident88.5Confident8 Ų821.3 Ų21.35%0.04811%0.105CC..Hα-helixtrans-63-43.3176.2179.20000109.8V71 G77 I78 F79 F139 T143V71-V75 HydrophobicContact CG1-CG2 4.08Å; V71-V75 WeakPolarHBondContact O-CB 3.25Å; V71-V75 VanDerWaalsContact O-CG2 3.23Å; V71-V75 WeakPolarHBondContact O-CG2 3.2Å; V71-V75 PolarHBondContact O-N 3.22Å; V75-G77 PolarHBondContact O-N 3.44Å; V75-I78 PolarHBondContact O-N 3.48Å; V75-F79 HydrophobicContact CG1-CD2 3.52Å; V75-F79 HydrophobicContact CG1-CE2 3.75Å; V75-F79 WeakPolarHBondContact O-CD2 3.43Å; V75-F79 PolarHBondContact O-N 3.04Å; V75-F139 HydrophobicContact CG1-CD2 4.36Å; V75-F139 HydrophobicContact CG1-CE2 4.41Å; V75-F139 HydrophobicContact CG2-CB 4.39Å; V75-F139 HydrophobicContact CG2-CD2 3.34Å; V75-F139 HydrophobicContact CG2-CE2 3.75Å; V75-F139 HydrophobicContact CG2-CG 4Å; V75-T143 WeakPolarHBondContact CG1-OG1 3.43Å
76Y88Confident88.6Confident8 Ų823.5 Ų23.53%0.03112%0.116CC..Hα-helixtrans-51.4-53.9170.8170.2-156.1000111.1T72 F73 A74 I78 F79 M80 G142 V145 F149T72-Y76 WeakPolarHBondContact O-CB 3.45Å; T72-Y76 PolarHBondContact O-N 3.49Å; F73-Y76 HydrophobicContact CD1-CD1 4.01Å; A74-Y76 VanDerWaalsContact C-N 3.32Å; Y76-I78 VanDerWaalsContact C-N 3.29Å; Y76-I78 PolarHBondContact O-N 3.01Å; Y76-F79 PolarHBondContact O-N 2.76Å; Y76-M80 HydrophobicContact CD2-CB 4.26Å; Y76-M80 HydrophobicContact CD2-SD 4.29Å; Y76-M80 HydrophobicContact CE2-CB 4.12Å; Y76-M80 HydrophobicContact CE2-CG 4Å; Y76-M80 HydrophobicContact CE2-SD 3.39Å; Y76-M80 WeakPolarHBondContact CE2-SD 3.32Å; Y76-M80 VanDerWaalsContact O-CB 3.29Å; Y76-M80 WeakPolarHBondContact O-CB 3.28Å; Y76-M80 PolarHBondContact O-N 2.92Å; Y76-G142 WeakPolarHBondContact CA-O 3.14Å; Y76-V145 HydrophobicContact CD2-CG1 4.16Å; Y76-V145 HydrophobicContact CE2-CG1 4.26Å; Y76-V145 HydrophobicContact CG-CG1 4.33Å; Y76-F149 HydrophobicContact CE2-CB 4.04Å; Y76-F149 HydrophobicContact CE2-CG 4.21Å; Y76-F149 VanDerWaalsContact OH-CD1 3.27Å; Y76-F149 WeakPolarHBondContact OH-CD1 3.27Å; Y76-F149 WeakPolarHBondContact OH-CG 3.45Å
77G87Confident88.6Confident0 Ų023.5 Ų23.50%012%0.118CC..Hα-helixtrans-57.3-37.7179.500000114F73 A74 V75 P81 C423F73-G77 PolarHBondContact O-N 3.14Å; A74-G77 PolarHBondContact O-N 3.35Å; V75-G77 PolarHBondContact O-N 3.44Å; G77-P81 WeakPolarHBondContact O-CD 3.13Å; G77-C423 PolarHBondContact O-SG 3.07Å
78I89.7Confident88.3Confident69 Ų6927 Ų2735%0.35413%0.131SC..Hα-helixtrans-72.9-44.6179.4-65.4163.1000112A74 V75 Y76 P81 M426A74-I78 WeakPolarHBondContact O-CG1 3.43Å; A74-I78 PolarHBondContact O-N 3Å; V75-I78 PolarHBondContact O-N 3.48Å; Y76-I78 VanDerWaalsContact C-N 3.29Å; Y76-I78 PolarHBondContact O-N 3.01Å; I78-P81 VanDerWaalsContact O-CD 3.28Å; I78-P81 WeakPolarHBondContact O-CD 3.26Å; I78-P81 WeakPolarHBondContact O-CG 3.28Å; I78-M426 HydrophobicContact CD1-CE 3.85Å; I78-M426 HydrophobicContact CD1-CG 3.99Å; I78-M426 HydrophobicContact CD1-SD 3.69Å; I78-M426 HydrophobicContact CG1-CB 4.34Å; I78-M426 HydrophobicContact CG1-CE 4.34Å; I78-M426 HydrophobicContact CG1-CG 4Å; I78-M426 HydrophobicContact CG1-SD 3.54Å; I78-M426 VanDerWaalsContact CG1-SD 3.54Å
79F90.6Very high88.1Confident49 Ų4935.7 Ų35.722%0.21517%0.169CC..Hα-helixtrans-82.2-15.5-173.4-81.9-92.9000113.3V75 Y76 L82 G83 T143 L147V75-F79 HydrophobicContact CG1-CD2 3.52Å; V75-F79 HydrophobicContact CG1-CE2 3.75Å; V75-F79 WeakPolarHBondContact O-CD2 3.43Å; V75-F79 PolarHBondContact O-N 3.04Å; Y76-F79 PolarHBondContact O-N 2.76Å; F79-L82 HydrophobicContact CD1-CD2 3.83Å; F79-L82 HydrophobicContact CE1-CD2 3.98Å; F79-L82 WeakPolarHBondContact O-CB 3.37Å; F79-L82 PolarHBondContact O-N 3.49Å; F79-G83 PolarHBondContact O-N 2.81Å; F79-T143 HydrophobicContact CD1-CG2 3.73Å; F79-T143 HydrophobicContact CD2-CG2 4.47Å; F79-T143 HydrophobicContact CE1-CG2 3.72Å; F79-T143 HydrophobicContact CE2-CG2 4.45Å; F79-T143 HydrophobicContact CG-CG2 4.11Å; F79-T143 HydrophobicContact CZ-CG2 4.09Å; F79-L147 HydrophobicContact CB-CG 4.41Å; F79-L147 HydrophobicContact CD1-CD2 4.01Å; F79-L147 HydrophobicContact CD1-CG 4.12Å
80M89.6Confident87.9Confident0 Ų038.9 Ų38.90%019%0.185CC..Hα-helixtrans-63.7-47.8178.2-165.1178.8160.300115.9Y76 L82 G83 G84 G146 F149 S150 Y418 A422Y76-M80 HydrophobicContact CD2-CB 4.26Å; Y76-M80 HydrophobicContact CD2-SD 4.29Å; Y76-M80 HydrophobicContact CE2-CB 4.12Å; Y76-M80 HydrophobicContact CE2-CG 4Å; Y76-M80 HydrophobicContact CE2-SD 3.39Å; Y76-M80 WeakPolarHBondContact CE2-SD 3.32Å; Y76-M80 VanDerWaalsContact O-CB 3.29Å; Y76-M80 WeakPolarHBondContact O-CB 3.28Å; Y76-M80 PolarHBondContact O-N 2.92Å; M80-L82 VanDerWaalsContact C-N 3.28Å; M80-L82 PolarHBondContact O-N 2.61Å; M80-G83 PolarHBondContact O-N 2.99Å; M80-G84 PolarHBondContact O-N 3.37Å; M80-G146 VanDerWaalsContact CA-O 3.24Å; M80-G146 WeakPolarHBondContact CA-O 3.39Å; M80-F149 HydrophobicContact CE-CD1 4.34Å; M80-S150 PolarHBondContact O-OG 2.87Å; M80-Y418 HydrophobicContact CE-CD1 2.95Å; M80-Y418 HydrophobicContact CE-CD2 3.9Å; M80-Y418 HydrophobicContact CE-CE1 3.08Å; M80-Y418 HydrophobicContact CE-CE2 4.04Å; M80-Y418 HydrophobicContact CE-CG 3.37Å; M80-A422 HydrophobicContact CE-CB 3.98Å; M80-A422 HydrophobicContact SD-CB 3.26Å; M80-A422 WeakPolarHBondContact SD-CB 3.39Å
81P89.7Confident87.6Confident16 Ų1640 Ų4010%0.10420%0.198CC..Hα-helixtrans-64.6-36.7171.126.8-35.6000111.1G77 I78 G83 G84 F85 G419 I420G77-P81 WeakPolarHBondContact O-CD 3.13Å; I78-P81 VanDerWaalsContact O-CD 3.28Å; I78-P81 WeakPolarHBondContact O-CD 3.26Å; I78-P81 WeakPolarHBondContact O-CG 3.28Å; P81-G83 VanDerWaalsContact C-N 3.35Å; P81-G83 PolarHBondContact O-N 3.28Å; P81-G84 PolarHBondContact O-N 3.47Å; P81-G84 VanDerWaalsContact O-N 3.16Å; P81-F85 WeakPolarHBondContact O-CD2 3.45Å; P81-F85 PolarHBondContact O-N 3.32Å; P81-G419 WeakPolarHBondContact CD-O 3.43Å; P81-I420 HydrophobicContact CB-CG1 4.17Å
82L90.1Very high87.3Confident87 Ų8740.5 Ų40.546%0.45520%0.198SC..Hα-helixtrans-61.9-41.8178.5-174.663.3000111.7F79 M80 G84 F85 L86 L147F79-L82 HydrophobicContact CD1-CD2 3.83Å; F79-L82 HydrophobicContact CE1-CD2 3.98Å; F79-L82 WeakPolarHBondContact O-CB 3.37Å; F79-L82 PolarHBondContact O-N 3.49Å; M80-L82 VanDerWaalsContact C-N 3.28Å; M80-L82 PolarHBondContact O-N 2.61Å; L82-G84 VanDerWaalsContact C-N 3.34Å; L82-G84 PolarHBondContact O-N 2.86Å; L82-F85 PolarHBondContact O-N 2.83Å; L82-L86 VanDerWaalsContact O-CB 3.25Å; L82-L86 WeakPolarHBondContact O-CB 3.14Å; L82-L86 PolarHBondContact O-N 3.46Å; L82-L147 HydrophobicContact CD2-CD2 4.47Å; L82-L147 HydrophobicContact CG-CD2 4.4Å
83G86.6Confident87.1Confident0 Ų045.5 Ų45.50%022%0.216CC..Hα-helixtrans-59.4-43.9172.900000112.2F79 M80 P81 L86 S87 L147 V151F79-G83 PolarHBondContact O-N 2.81Å; M80-G83 PolarHBondContact O-N 2.99Å; P81-G83 VanDerWaalsContact C-N 3.35Å; P81-G83 PolarHBondContact O-N 3.28Å; G83-L86 PolarHBondContact O-N 3.46Å; G83-S87 WeakPolarHBondContact O-CB 3.37Å; G83-S87 PolarHBondContact O-N 3.31Å; G83-L147 WeakPolarHBondContact CA-O 3.2Å; G83-V151 WeakPolarHBondContact O-CG2 3.38Å
84G85.9Confident87Confident0 Ų047.9 Ų47.90%023%0.233CC..Hα-helixtrans-60.8-47.2174.100000113M80 P81 L82 S87 I416M80-G84 PolarHBondContact O-N 3.37Å; P81-G84 PolarHBondContact O-N 3.47Å; P81-G84 VanDerWaalsContact O-N 3.16Å; L82-G84 VanDerWaalsContact C-N 3.34Å; L82-G84 PolarHBondContact O-N 2.86Å; G84-S87 PolarHBondContact O-N 3.25Å; G84-S87 PolarHBondContact O-OG 2.71Å; G84-I416 VanDerWaalsContact C-CG1 3.48Å
85F88.2Confident86.9Confident104 Ų10447.8 Ų47.846%0.45623%0.232SC..Hα-helixtrans-62.7-46.1176.8-82.3-69.5000112.1P81 L82 S87 R88 I416P81-F85 WeakPolarHBondContact O-CD2 3.45Å; P81-F85 PolarHBondContact O-N 3.32Å; L82-F85 PolarHBondContact O-N 2.83Å; F85-S87 VanDerWaalsContact C-N 3.27Å; F85-S87 PolarHBondContact O-N 3.17Å; F85-R88 PolarHBondContact O-N 3.38Å; F85-I416 HydrophobicContact CB-CD1 4.42Å; F85-I416 HydrophobicContact CD1-CD1 3.54Å; F85-I416 HydrophobicContact CD2-CD1 4.39Å; F85-I416 HydrophobicContact CD2-CG2 4.09Å; F85-I416 HydrophobicContact CE1-CD1 3.76Å; F85-I416 HydrophobicContact CE1-CG2 4.1Å; F85-I416 HydrophobicContact CE2-CG2 3.57Å; F85-I416 HydrophobicContact CG-CD1 3.86Å; F85-I416 HydrophobicContact CZ-CD1 4.28Å; F85-I416 HydrophobicContact CZ-CG2 3.58Å
86L88Confident86.6Confident47 Ų4747.5 Ų47.525%0.24623%0.23CC..Hα-helixtrans-62.9-38-179.5-167.660.9000110.7L82 G83 R88 K89 I90 V95 L98L82-L86 VanDerWaalsContact O-CB 3.25Å; L82-L86 WeakPolarHBondContact O-CB 3.14Å; L82-L86 PolarHBondContact O-N 3.46Å; G83-L86 PolarHBondContact O-N 3.46Å; L86-R88 PolarHBondContact O-N 3.41Å; L86-R88 VanDerWaalsContact O-N 3.17Å; L86-K89 PolarHBondContact O-N 3.45Å; L86-I90 HydrophobicContact CD1-CD1 3.83Å; L86-I90 HydrophobicContact CD1-CG1 4Å; L86-I90 HydrophobicContact CD1-CG2 4.42Å; L86-I90 HydrophobicContact CD2-CD1 4.01Å; L86-I90 HydrophobicContact CG-CD1 3.62Å; L86-I90 HydrophobicContact CG-CG1 3.85Å; L86-I90 VanDerWaalsContact O-CG1 3.28Å; L86-I90 WeakPolarHBondContact O-CG1 3.43Å; L86-I90 PolarHBondContact O-N 2.85Å; L86-V95 HydrophobicContact CB-CG2 3.85Å; L86-V95 HydrophobicContact CD2-CG2 3.87Å; L86-V95 HydrophobicContact CG-CG2 3.59Å; L86-L98 HydrophobicContact CD2-CD2 4.19Å
87S86.1Confident86.5Confident25 Ų2548.9 Ų48.918%0.17524%0.243CC..Hα-helixtrans-63.1-24.8-179.473.70000114G83 G84 F85 G91G83-S87 WeakPolarHBondContact O-CB 3.37Å; G83-S87 PolarHBondContact O-N 3.31Å; G84-S87 PolarHBondContact O-N 3.25Å; G84-S87 PolarHBondContact O-OG 2.71Å; F85-S87 VanDerWaalsContact C-N 3.27Å; F85-S87 PolarHBondContact O-N 3.17Å; S87-G91 CarbonylContact O-C 3.28Å; S87-G91 WeakPolarHBondContact O-CA 3.44Å; S87-G91 PolarHBondContact O-N 2.75Å; S87-G91 VanDerWaalsContact O-N 3.16Å
88R82.9Confident86.4Confident122 Ų12251.8 Ų51.846%0.4626%0.258SS..Hα-helixtrans-77.9-32.6173.6-66-169.9-170.5-174.48.6113.3F85 L86 N413 I416F85-R88 PolarHBondContact O-N 3.38Å; L86-R88 PolarHBondContact O-N 3.41Å; L86-R88 VanDerWaalsContact O-N 3.17Å; R88-N413 PolarHBondContact NH1-OD1 2.85Å; R88-N413 PolarHBondContact NH2-OD1 2.94Å; R88-I416 HydrophobicContact CG-CD1 4.49Å; R88-I416 VanDerWaalsContact NH2-CD1 3.31Å
89K85.3Confident86.1Confident184 Ų18448.5 Ų48.580%0.824%0.242SC*.Hα-helixtrans-85.5-40.6-172.8-169.2177.9-179.8-1800112.4L86L86-K89 PolarHBondContact O-N 3.45Å
90I85.6Confident85.5Confident67 Ų6746.3 Ų46.334%0.34423%0.232SC..Hα-helixtrans-115.42.2-176.364166.7000113L86 P94 V95L86-I90 HydrophobicContact CD1-CD1 3.83Å; L86-I90 HydrophobicContact CD1-CG1 4Å; L86-I90 HydrophobicContact CD1-CG2 4.42Å; L86-I90 HydrophobicContact CD2-CD1 4.01Å; L86-I90 HydrophobicContact CG-CD1 3.62Å; L86-I90 HydrophobicContact CG-CG1 3.85Å; L86-I90 VanDerWaalsContact O-CG1 3.28Å; L86-I90 WeakPolarHBondContact O-CG1 3.43Å; L86-I90 PolarHBondContact O-N 2.85Å; I90-P94 HydrophobicContact CB-CG 4.07Å; I90-P94 HydrophobicContact CD1-CB 3.93Å; I90-P94 HydrophobicContact CD1-CG 3.73Å; I90-P94 HydrophobicContact CG1-CG 3.82Å; I90-P94 WeakPolarHBondContact O-CG 3.38Å; I90-V95 HydrophobicContact CD1-CG2 3.76Å; I90-V95 HydrophobicContact CG1-CG2 3.78Å
91G81.3Confident84.7Confident31 Ų3150.5 Ų50.532%0.3225%0.254SS..  trans83168-172.500000113.7S87 V95S87-G91 CarbonylContact O-C 3.28Å; S87-G91 WeakPolarHBondContact O-CA 3.44Å; S87-G91 PolarHBondContact O-N 2.75Å; S87-G91 VanDerWaalsContact O-N 3.16Å; G91-V95 WeakPolarHBondContact O-CG2 3.41Å
92Y83.5Confident83.6Confident25 Ų2552.4 Ų52.410%0.09826%0.261CS..Hα-helixtrans-75.9-33.5-174.471.8-84.3000113.4V95 L96 V155 S237Y92-V95 PolarHBondContact O-N 3.11Å; Y92-L96 WeakPolarHBondContact O-CB 3.27Å; Y92-L96 PolarHBondContact O-N 3.15Å; Y92-V155 HydrophobicContact CD1-CG2 4.47Å; Y92-V155 HydrophobicContact CD2-CG2 3.89Å; Y92-V155 HydrophobicContact CE2-CG1 4.45Å; Y92-V155 HydrophobicContact CG-CG2 3.85Å; Y92-S237 WeakPolarHBondContact CE1-OG 3.47Å; Y92-S237 PolarHBondContact OH-N 3.03Å; Y92-S237 VanDerWaalsContact OH-N 3.11Å; Y92-S237 PolarHBondContact OH-OG 2.88Å
93R84.9Confident82Confident105 Ų10548.4 Ų48.440%0.39624%0.24SC..Hα-helixtrans-61.1-54.1-175.9-75.8179.8156.2160.2-7.3113.6V95 L96 A97 D252R93-V95 VanDerWaalsContact C-N 3.3Å; R93-V95 PolarHBondContact O-N 2.82Å; R93-L96 PolarHBondContact O-N 2.97Å; R93-A97 WeakPolarHBondContact O-CB 3.26Å; R93-A97 PolarHBondContact O-N 2.7Å; R93-D252 IonicContact NH1-OD1 3.17Å; R93-D252 PolarHBondContact NH1-OD1 3.48Å; R93-D252 IonicContact NH1-OD2 2.72Å; R93-D252 PolarHBondContact NH1-OD2 2.92Å; R93-D252 VanDerWaalsContact NH1-OD2 3.17Å
94P84.9Confident80.4Confident57 Ų5751.1 Ų51.137%0.3725%0.25SC..Hα-helixtrans-67.8-30.818025.3-33.7000112.3I90 A97 L98I90-P94 HydrophobicContact CB-CG 4.07Å; I90-P94 HydrophobicContact CD1-CB 3.93Å; I90-P94 HydrophobicContact CD1-CG 3.73Å; I90-P94 HydrophobicContact CG1-CG 3.82Å; I90-P94 WeakPolarHBondContact O-CG 3.38Å; P94-A97 PolarHBondContact O-N 3.5Å; P94-L98 VanDerWaalsContact O-CB 3.25Å; P94-L98 WeakPolarHBondContact O-CB 3.43Å; P94-L98 PolarHBondContact O-N 3.21Å
95V86.2Confident78.4Confident0 Ų055 Ų550%027%0.27CS..Hα-helixtrans-64.2-44.4173.5178.50000111.4L86 I90 G91 Y92 R93 L98 S99 L147 V151L86-V95 HydrophobicContact CB-CG2 3.85Å; L86-V95 HydrophobicContact CD2-CG2 3.87Å; L86-V95 HydrophobicContact CG-CG2 3.59Å; I90-V95 HydrophobicContact CD1-CG2 3.76Å; I90-V95 HydrophobicContact CG1-CG2 3.78Å; G91-V95 WeakPolarHBondContact O-CG2 3.41Å; Y92-V95 PolarHBondContact O-N 3.11Å; R93-V95 VanDerWaalsContact C-N 3.3Å; R93-V95 PolarHBondContact O-N 2.82Å; V95-L98 PolarHBondContact O-N 3.35Å; V95-S99 WeakPolarHBondContact O-CB 3.2Å; V95-S99 PolarHBondContact O-N 3.4Å; V95-L147 WeakPolarHBondContact CG1-O 3.45Å; V95-V151 HydrophobicContact CG1-CG2 4.1Å
96L85Confident76.4Confident2 Ų254.5 Ų54.51%0.0127%0.272CS..Hα-helixtrans-70-38.6178.4-17157.3000111.6I31 Y92 R93 L98 S99 C100 T152 L232 L235I31-L96 HydrophobicContact CD1-CD1 4.19Å; I31-L96 HydrophobicContact CD1-CD2 3.65Å; I31-L96 HydrophobicContact CD1-CG 4.24Å; I31-L96 HydrophobicContact CG2-CD1 4.2Å; Y92-L96 WeakPolarHBondContact O-CB 3.27Å; Y92-L96 PolarHBondContact O-N 3.15Å; R93-L96 PolarHBondContact O-N 2.97Å; L96-L98 VanDerWaalsContact C-N 3.31Å; L96-L98 PolarHBondContact O-N 3.07Å; L96-S99 WeakPolarHBondContact O-CB 3.37Å; L96-S99 PolarHBondContact O-N 3Å; L96-C100 WeakPolarHBondContact O-CB 3.36Å; L96-C100 PolarHBondContact O-N 3.22Å; L96-C100 PolarHBondContact O-SG 2.93Å; L96-T152 WeakPolarHBondContact CD1-OG1 3.18Å; L96-L232 HydrophobicContact CB-CD2 3.93Å; L96-L232 HydrophobicContact CD2-CD2 3.56Å; L96-L232 HydrophobicContact CD2-CG 4.49Å; L96-L232 HydrophobicContact CG-CD2 3.45Å; L96-L232 VanDerWaalsContact CG-CD2 3.45Å; L96-L232 HydrophobicContact CG-CG 4.36Å; L96-L235 HydrophobicContact CD2-CD2 3.27Å
97A84.7Confident74.1Confident36 Ų3661.2 Ų61.230%0.29830%0.299SS..Hα-helixtrans-60.6-42171.200000111.1R93 P94 C100 L101R93-A97 WeakPolarHBondContact O-CB 3.26Å; R93-A97 PolarHBondContact O-N 2.7Å; P94-A97 PolarHBondContact O-N 3.5Å; A97-C100 CarbonylContact O-C 3.53Å; A97-C100 PolarHBondContact O-N 3.46Å; A97-L101 WeakPolarHBondContact O-CB 3.45Å; A97-L101 WeakPolarHBondContact O-CG 3.38Å; A97-L101 PolarHBondContact O-N 2.59Å
98L85.3Confident71.8Confident62 Ų6265.5 Ų65.533%0.32532%0.324SS..Hα-helixtrans-65-43.8175.4-177.962.7000111.9L86 P94 V95 L96 C100 L101 F102 L147L86-L98 HydrophobicContact CD2-CD2 4.19Å; P94-L98 VanDerWaalsContact O-CB 3.25Å; P94-L98 WeakPolarHBondContact O-CB 3.43Å; P94-L98 PolarHBondContact O-N 3.21Å; V95-L98 PolarHBondContact O-N 3.35Å; L96-L98 VanDerWaalsContact C-N 3.31Å; L96-L98 PolarHBondContact O-N 3.07Å; L98-C100 VanDerWaalsContact C-N 3.33Å; L98-C100 PolarHBondContact O-N 3.35Å; L98-L101 PolarHBondContact O-N 3.15Å; L98-L101 VanDerWaalsContact O-N 3.15Å; L98-F102 HydrophobicContact CD1-CD2 3.93Å; L98-F102 HydrophobicContact CD1-CE2 3.54Å; L98-F102 HydrophobicContact CD1-CZ 4.42Å; L98-F102 HydrophobicContact CD2-CE2 4.17Å; L98-F102 HydrophobicContact CG-CD2 3.9Å; L98-F102 HydrophobicContact CG-CE2 3.67Å; L98-F102 VanDerWaalsContact O-CD2 3.24Å; L98-F102 WeakPolarHBondContact O-CD2 3.44Å; L98-F102 PolarHBondContact O-N 3.44Å; L98-L147 HydrophobicContact CD2-CD1 4.09Å; L98-L147 HydrophobicContact CG-CD1 4.14Å
99S83Confident69.9Low0 Ų065.8 Ų65.80%034%0.339CS..Hα-helixtrans-55.4-49.1172.6164.70000111.2Y35 V95 L96 F102 L103 G144Y35-S99 PolarHBondContact OH-OG 3.27Å; V95-S99 WeakPolarHBondContact O-CB 3.2Å; V95-S99 PolarHBondContact O-N 3.4Å; L96-S99 WeakPolarHBondContact O-CB 3.37Å; L96-S99 PolarHBondContact O-N 3Å; S99-F102 PolarHBondContact O-N 3.37Å; S99-L103 WeakPolarHBondContact O-CD1 3.43Å; S99-L103 WeakPolarHBondContact O-CG 3.37Å; S99-L103 PolarHBondContact O-N 2.84Å; S99-G144 VanDerWaalsContact CB-O 3.32Å; S99-G144 WeakPolarHBondContact CB-O 3.26Å; S99-G144 WeakPolarHBondContact O-CA 3.48Å; S99-G144 PolarHBondContact OG-O 2.94Å
100C79.8Confident67.6Low2 Ų265.1 Ų65.11%0.01434%0.339CS..Hα-helixtrans-65.1-38175-670000111.5L96 A97 L98 L103 R104 Q228 L232L96-C100 WeakPolarHBondContact O-CB 3.36Å; L96-C100 PolarHBondContact O-N 3.22Å; L96-C100 PolarHBondContact O-SG 2.93Å; A97-C100 CarbonylContact O-C 3.53Å; A97-C100 PolarHBondContact O-N 3.46Å; L98-C100 VanDerWaalsContact C-N 3.33Å; L98-C100 PolarHBondContact O-N 3.35Å; C100-L103 CarbonylContact O-C 3.16Å; C100-L103 VanDerWaalsContact O-CA 3.23Å; C100-L103 WeakPolarHBondContact O-CA 3.42Å; C100-L103 VanDerWaalsContact O-CB 3.26Å; C100-L103 WeakPolarHBondContact O-CB 3.47Å; C100-L103 PolarHBondContact O-N 2.81Å; C100-R104 WeakPolarHBondContact O-CA 3.21Å; C100-R104 WeakPolarHBondContact O-CB 3.38Å; C100-R104 PolarHBondContact O-N 3.45Å; C100-Q228 HydrophobicContact CB-CB 4.42Å; C100-L232 HydrophobicContact CB-CD1 3.92Å
101L72.2Confident65.4Low88 Ų8868.6 Ų68.646%0.46136%0.357SS..Hα-helixtrans-65.9-39.3176.9-77.1168.5000112.4A97 L98 L103 R104A97-L101 WeakPolarHBondContact O-CB 3.45Å; A97-L101 WeakPolarHBondContact O-CG 3.38Å; A97-L101 PolarHBondContact O-N 2.59Å; L98-L101 PolarHBondContact O-N 3.15Å; L98-L101 VanDerWaalsContact O-N 3.15Å; L101-L103 PolarHBondContact O-N 3.46Å; L101-L103 VanDerWaalsContact O-N 3.07Å; L101-R104 CarbonylContact O-C 3.6Å; L101-R104 PolarHBondContact O-N 2.73Å
102F66.1Low63.3Low56 Ų5673.3 Ų73.325%0.24638%0.375CS..Hα-helixtrans-59.2-21.9169.5-81.9-70.5000112.3L98 S99 G118 L140 T143 L147L98-F102 HydrophobicContact CD1-CD2 3.93Å; L98-F102 HydrophobicContact CD1-CE2 3.54Å; L98-F102 HydrophobicContact CD1-CZ 4.42Å; L98-F102 HydrophobicContact CD2-CE2 4.17Å; L98-F102 HydrophobicContact CG-CD2 3.9Å; L98-F102 HydrophobicContact CG-CE2 3.67Å; L98-F102 VanDerWaalsContact O-CD2 3.24Å; L98-F102 WeakPolarHBondContact O-CD2 3.44Å; L98-F102 PolarHBondContact O-N 3.44Å; S99-F102 PolarHBondContact O-N 3.37Å; F102-G118 PolarHBondContact O-N 3.39Å; F102-L140 HydrophobicContact CD1-CD2 4.21Å; F102-T143 HydrophobicContact CD1-CG2 4.02Å; F102-T143 HydrophobicContact CD2-CG2 3.91Å; F102-T143 HydrophobicContact CE1-CG2 4.13Å; F102-T143 HydrophobicContact CE2-CG2 4.01Å; F102-T143 HydrophobicContact CG-CG2 3.92Å; F102-T143 HydrophobicContact CZ-CG2 4.13Å; F102-L147 HydrophobicContact CD2-CD1 3.73Å; F102-L147 HydrophobicContact CE2-CD1 3.76Å
103L57.6Low60.6Low3 Ų378 Ų782%0.01641%0.41CS..Hα-helixtrans-96.4-16.8173.2-63.5157.4000113.5Y35 S99 C100 L101 G117 F141 Q228Y35-L103 HydrophobicContact CD1-CD1 3.84Å; Y35-L103 HydrophobicContact CE1-CD1 3.49Å; Y35-L103 VanDerWaalsContact CE1-CD1 3.49Å; S99-L103 WeakPolarHBondContact O-CD1 3.43Å; S99-L103 WeakPolarHBondContact O-CG 3.37Å; S99-L103 PolarHBondContact O-N 2.84Å; C100-L103 CarbonylContact O-C 3.16Å; C100-L103 VanDerWaalsContact O-CA 3.23Å; C100-L103 WeakPolarHBondContact O-CA 3.42Å; C100-L103 VanDerWaalsContact O-CB 3.26Å; C100-L103 WeakPolarHBondContact O-CB 3.47Å; C100-L103 PolarHBondContact O-N 2.81Å; L101-L103 PolarHBondContact O-N 3.46Å; L101-L103 VanDerWaalsContact O-N 3.07Å; L103-G117 VanDerWaalsContact C-CA 3.43Å; L103-G117 WeakPolarHBondContact O-CA 3.34Å; L103-F141 HydrophobicContact CD2-CB 4.39Å; L103-F141 HydrophobicContact CD2-CD2 3.16Å; L103-F141 HydrophobicContact CD2-CE2 3.42Å; L103-F141 VanDerWaalsContact CD2-CE2 3.42Å; L103-F141 HydrophobicContact CD2-CG 3.9Å; L103-F141 HydrophobicContact CD2-CZ 4.35Å; L103-Q228 VanDerWaalsContact CD1-NE2 3.29Å
104R52.5Low58.3Low57 Ų5781.2 Ų81.222%0.21543%0.427CS..  trans-134133.5-162.4176.9-179.3174.5-157.30.7113.2C100 L101 S116C100-R104 WeakPolarHBondContact O-CA 3.21Å; C100-R104 WeakPolarHBondContact O-CB 3.38Å; C100-R104 PolarHBondContact O-N 3.45Å; L101-R104 CarbonylContact O-C 3.6Å; L101-R104 PolarHBondContact O-N 2.73Å; R104-S116 CarbonylContact C-O 3.57Å; R104-S116 VanDerWaalsContact C-O 3.28Å
105L43.3Very low55.7Low81 Ų8183.2 Ų83.242%0.42443%0.433SS..  trans-120105158.7-158.4151.2000109.9L120L105-L120 HydrophobicContact CB-CD1 4.18Å
106I46.6Very low53.8Low95 Ų9584.6 Ų84.649%0.48744%0.443SS..  trans-144.3103147.8-59.5-178000106.3
107K39.2Very low52.7Low187 Ų18784.5 Ų84.581%0.81344%0.443SS*.  trans-104.6117.5163.1-149.9-170.4-176.2-167.50107.2
108T38.6Very low52Low115 Ų11582.8 Ų82.871%0.70643%0.429SS*.  trans-72140.9166-54.10000108.3
109T42.8Very low51.9Low128 Ų12879.9 Ų79.979%0.78541%0.413SS*.SBendtrans83.9138.2170.5-2.30000117.6
110Q37.5Very low52Low171 Ų17181.3 Ų81.380%0.79942%0.421SS*.SBendtrans-43.5143.7-158.8-77.6-168-45.600119
111I38.1Very low52.2Low139 Ų13982.3 Ų82.371%0.71343%0.426SS*.SBendtrans67.888.1157.9-55154.2000114.3
112D37.6Very low53Low131 Ų13178.1 Ų78.170%0.70140%0.404SS*.  trans171.5108.2130.4-86.1-23.3000109.9K114D112-K114 PolarHBondContact O-N 3.45Å
113C27.4Very low54.1Low123 Ų12377.8 Ų77.883%0.83140%0.401SS*.  trans-61.7100.1171.3-175.10000109.5
114K35.4Very low55.7Low173 Ų17383.1 Ų83.175%0.75242%0.424SS*.  trans-131.790.1164.5-69.9-174.8-175.7172.40109.7D112 S116D112-K114 PolarHBondContact O-N 3.45Å; K114-S116 PolarHBondContact O-N 3.04Å
115I31.6Very low57.4Low99 Ų9981.4 Ų81.451%0.50842%0.421SS..  trans-29.5113.3156.5-72.5164.6000112.2L121I115-L121 HydrophobicContact CB-CD1 4.21Å; I115-L121 HydrophobicContact CD1-CD1 4.03Å; I115-L121 HydrophobicContact CG1-CD1 3.98Å; I115-L121 HydrophobicContact CG2-CB 4.27Å; I115-L121 HydrophobicContact CG2-CD1 3.21Å; I115-L121 HydrophobicContact CG2-CD2 3.1Å; I115-L121 HydrophobicContact CG2-CG 3.62Å
116S46.2Very low59.7Low28 Ų2877.6 Ų77.620%0.19640%0.4CS..  trans-172.899.5140.5-169.30000108.4R104 K114R104-S116 CarbonylContact C-O 3.57Å; R104-S116 VanDerWaalsContact C-O 3.28Å; K114-S116 PolarHBondContact O-N 3.04Å
117G60.6Low61.7Low1 Ų177 Ų771%0.0140%0.396CS..  trans-136.1111.814000000103.2L103 V119 L120 L121L103-G117 VanDerWaalsContact C-CA 3.43Å; L103-G117 WeakPolarHBondContact O-CA 3.34Å; G117-V119 PolarHBondContact O-N 3.41Å; G117-V119 VanDerWaalsContact O-N 3.1Å; G117-L120 PolarHBondContact O-N 3.34Å; G117-L121 PolarHBondContact O-N 3.15Å
118G70.8Confident64.1Low0 Ų075.7 Ų75.70%039%0.39CS..Hα-helixtrans-48.3-46.4-163.400000113.8F102 L121 S122 T136F102-G118 PolarHBondContact O-N 3.39Å; G118-L121 PolarHBondContact O-N 3.33Å; G118-S122 PolarHBondContact O-N 3.35Å; G118-S122 PolarHBondContact O-OG 3.33Å; G118-T136 CarbonylContact C-O 3.23Å; G118-T136 WeakPolarHBondContact CA-O 3.49Å; G118-T136 CarbonylContact O-C 3.6Å; G118-T136 VanDerWaalsContact O-O 3.06Å
119V82.8Confident66.7Low1 Ų173.4 Ų73.41%0.00638%0.376CS..Hα-helixtrans-68.1-43.4178.3-176.50000112.5Y37 G117 L121 S122 Y137 F141 F217 L224Y37-V119 HydrophobicContact CD1-CG2 4.23Å; Y37-V119 HydrophobicContact CE1-CG1 4.36Å; Y37-V119 HydrophobicContact CE1-CG2 3.69Å; G117-V119 PolarHBondContact O-N 3.41Å; G117-V119 VanDerWaalsContact O-N 3.1Å; V119-L121 VanDerWaalsContact C-N 3.29Å; V119-L121 PolarHBondContact O-N 2.87Å; V119-S122 VanDerWaalsContact O-CB 3.23Å; V119-S122 WeakPolarHBondContact O-CB 3.26Å; V119-S122 PolarHBondContact O-N 3.02Å; V119-S122 VanDerWaalsContact O-N 3.13Å; V119-S122 PolarHBondContact O-OG 3.06Å; V119-Y137 HydrophobicContact CG1-CE2 4.31Å; V119-Y137 HydrophobicContact CG2-CD2 4.41Å; V119-Y137 HydrophobicContact CG2-CE2 4.33Å; V119-F141 HydrophobicContact CG2-CD2 3.92Å; V119-F141 HydrophobicContact CG2-CE2 4.45Å; V119-F217 HydrophobicContact CG1-CD1 4.15Å; V119-F217 WeakPolarHBondContact O-CB 3.45Å; V119-L224 HydrophobicContact CG2-CD1 4.05Å
120L85.1Confident69Low29 Ų2968.3 Ų68.315%0.15234%0.342CS..Hα-helixtrans-63.1-39.5178.2-70.2174.2000111.5L105 G117 S122 Y123 L218L105-L120 HydrophobicContact CB-CD1 4.18Å; G117-L120 PolarHBondContact O-N 3.34Å; L120-S122 PolarHBondContact O-N 3.19Å; L120-Y123 VanDerWaalsContact O-CB 3.26Å; L120-Y123 WeakPolarHBondContact O-CB 3.32Å; L120-Y123 PolarHBondContact O-N 3.31Å; L120-L218 HydrophobicContact CD2-CD2 4.1Å
121L84.7Confident71.5Confident23 Ų2362.4 Ų62.412%0.1232%0.318CS..Hα-helixtrans-67.5-25178-176.757.7000112.4I115 G117 G118 V119 Y123 F124 T125 T136 L140I115-L121 HydrophobicContact CB-CD1 4.21Å; I115-L121 HydrophobicContact CD1-CD1 4.03Å; I115-L121 HydrophobicContact CG1-CD1 3.98Å; I115-L121 HydrophobicContact CG2-CB 4.27Å; I115-L121 HydrophobicContact CG2-CD1 3.21Å; I115-L121 HydrophobicContact CG2-CD2 3.1Å; I115-L121 HydrophobicContact CG2-CG 3.62Å; G117-L121 PolarHBondContact O-N 3.15Å; G118-L121 PolarHBondContact O-N 3.33Å; V119-L121 VanDerWaalsContact C-N 3.29Å; V119-L121 PolarHBondContact O-N 2.87Å; L121-Y123 PolarHBondContact O-N 3.49Å; L121-Y123 VanDerWaalsContact O-N 3.16Å; L121-F124 HydrophobicContact CD1-CD2 4.22Å; L121-F124 PolarHBondContact O-N 3.38Å; L121-T125 PolarHBondContact O-N 3.35Å; L121-T136 HydrophobicContact CB-CG2 4.41Å; L121-T136 HydrophobicContact CD2-CG2 3.28Å; L121-T136 HydrophobicContact CG-CG2 3.64Å; L121-L140 HydrophobicContact CD2-CD1 3.84Å
122S87.8Confident74Confident0 Ų056.3 Ų56.30%029%0.29CS..Hα-helixtrans-59.4-23.4174.6-53.30000113.3G118 V119 L120 F124 T125 I126 Y137G118-S122 PolarHBondContact O-N 3.35Å; G118-S122 PolarHBondContact O-OG 3.33Å; V119-S122 VanDerWaalsContact O-CB 3.23Å; V119-S122 WeakPolarHBondContact O-CB 3.26Å; V119-S122 PolarHBondContact O-N 3.02Å; V119-S122 VanDerWaalsContact O-N 3.13Å; V119-S122 PolarHBondContact O-OG 3.06Å; L120-S122 PolarHBondContact O-N 3.19Å; S122-F124 VanDerWaalsContact C-N 3.28Å; S122-F124 PolarHBondContact O-N 2.91Å; S122-T125 WeakPolarHBondContact CA-OG1 3.23Å; S122-T125 PolarHBondContact O-N 3.42Å; S122-T125 PolarHBondContact O-OG1 3.24Å; S122-I126 VanDerWaalsContact O-CB 3.27Å; S122-I126 WeakPolarHBondContact O-CB 3.39Å; S122-I126 WeakPolarHBondContact O-CG2 3.44Å; S122-I126 PolarHBondContact O-N 3.4Å; S122-Y137 WeakPolarHBondContact OG-CA 3.48Å; S122-Y137 WeakPolarHBondContact OG-CB 3.35Å; S122-Y137 WeakPolarHBondContact OG-CD2 3.4Å; S122-Y137 PolarHBondContact OG-N 3.34Å
123Y90.7Very high76.6Confident50 Ų5050.1 Ų50.120%0.19626%0.256CS..Hα-helixtrans-54.5-42.9170.5174.6-94.7000112.6L120 L121 I126 P214 L218L120-Y123 VanDerWaalsContact O-CB 3.26Å; L120-Y123 WeakPolarHBondContact O-CB 3.32Å; L120-Y123 PolarHBondContact O-N 3.31Å; L121-Y123 PolarHBondContact O-N 3.49Å; L121-Y123 VanDerWaalsContact O-N 3.16Å; Y123-I126 WeakPolarHBondContact O-CG2 3.41Å; Y123-P214 HydrophobicContact CD2-CB 3.71Å; Y123-P214 WeakPolarHBondContact CD2-O 3.22Å; Y123-P214 HydrophobicContact CE2-CB 3.77Å; Y123-L218 HydrophobicContact CD2-CD1 3.64Å; Y123-L218 HydrophobicContact CD2-CD2 4.29Å; Y123-L218 HydrophobicContact CD2-CG 3.74Å; Y123-L218 HydrophobicContact CE2-CD1 3.83Å; Y123-L218 HydrophobicContact CE2-CG 4.43Å; Y123-L218 HydrophobicContact CG-CD1 4.11Å; Y123-L218 HydrophobicContact CG-CD2 4.03Å; Y123-L218 HydrophobicContact CG-CG 4Å
124F89.4Confident79.6Confident114 Ų11445 Ų4550%0.522%0.221SC..Hα-helixtrans-85.1-31.1-177-65.7-72000112.8L121 S122L121-F124 HydrophobicContact CD1-CD2 4.22Å; L121-F124 PolarHBondContact O-N 3.38Å; S122-F124 VanDerWaalsContact C-N 3.28Å; S122-F124 PolarHBondContact O-N 2.91Å
125T89.6Confident82.2Confident22 Ų2241.3 Ų41.314%0.13521%0.208CC..Hα-helixtrans-83.5-30.7-176.2580000113.1L121 S122 Q127 K128 T129 G132 T136L121-T125 PolarHBondContact O-N 3.35Å; S122-T125 WeakPolarHBondContact CA-OG1 3.23Å; S122-T125 PolarHBondContact O-N 3.42Å; S122-T125 PolarHBondContact O-OG1 3.24Å; T125-Q127 PolarHBondContact O-N 2.95Å; T125-K128 PolarHBondContact O-N 3.15Å; T125-T129 PolarHBondContact O-N 3.44Å; T125-T129 VanDerWaalsContact O-N 3.12Å; T125-G132 VanDerWaalsContact CB-C 3.44Å; T125-G132 PolarHBondContact OG1-O 2.91Å; T125-T136 HydrophobicContact CG2-CG2 3.54Å; T125-T136 PolarHBondContact OG1-OG1 3.21Å
126I91.2Very high85Confident0 Ų037 Ų370%019%0.187CC..Hα-helixtrans-59.1-32176.2-16863.7000112I48 Y51 L52 S122 Y123 K128 V133 L213 P214 F217I48-I126 HydrophobicContact CG2-CD1 3.91Å; Y51-I126 HydrophobicContact CD1-CD1 3.99Å; Y51-I126 HydrophobicContact CD1-CG1 3.58Å; Y51-I126 HydrophobicContact CE1-CG1 3.87Å; Y51-I126 VanDerWaalsContact CE1-O 3.31Å; Y51-I126 WeakPolarHBondContact CE1-O 3.28Å; Y51-I126 HydrophobicContact CG-CG1 4.16Å; L52-I126 HydrophobicContact CD1-CD1 4.4Å; L52-I126 HydrophobicContact CD2-CD1 3.92Å; L52-I126 HydrophobicContact CG-CD1 3.88Å; S122-I126 VanDerWaalsContact O-CB 3.27Å; S122-I126 WeakPolarHBondContact O-CB 3.39Å; S122-I126 WeakPolarHBondContact O-CG2 3.44Å; S122-I126 PolarHBondContact O-N 3.4Å; Y123-I126 WeakPolarHBondContact O-CG2 3.41Å; I126-K128 VanDerWaalsContact C-N 3.28Å; I126-K128 PolarHBondContact O-N 3.36Å; I126-V133 VanDerWaalsContact CA-CG2 3.46Å; I126-V133 HydrophobicContact CB-CG2 4.12Å; I126-V133 HydrophobicContact CD1-CG1 4.3Å; I126-V133 HydrophobicContact CD1-CG2 3.72Å; I126-L213 HydrophobicContact CD1-CD2 4.3Å; I126-L213 HydrophobicContact CG1-CD2 4.15Å; I126-P214 HydrophobicContact CG2-CB 4.16Å; I126-P214 HydrophobicContact CG2-CG 4.04Å; I126-F217 HydrophobicContact CB-CE2 3.99Å; I126-F217 HydrophobicContact CG1-CE2 4.04Å; I126-F217 HydrophobicContact CG2-CD2 4.3Å; I126-F217 HydrophobicContact CG2-CE2 4.06Å
127Q89.5Confident87.1Confident82 Ų8235.9 Ų35.938%0.38318%0.178SC..THydrogen-bonded Turntrans-79.9-3.5179.4-62.7176.7-14.600113.9I56 T125I56-Q127 VanDerWaalsContact CD1-C 3.49Å; I56-Q127 WeakPolarHBondContact CD1-O 3.4Å; T125-Q127 PolarHBondContact O-N 2.95Å
128K89.6Confident88.5Confident161 Ų16135.8 Ų35.870%0.718%0.178SC*.THydrogen-bonded Turntrans-123.8-52.4-171.2-67.1-172.9178-174.30114.1T125 I126T125-K128 PolarHBondContact O-N 3.15Å; I126-K128 VanDerWaalsContact C-N 3.28Å; I126-K128 PolarHBondContact O-N 3.36Å
129T91.8Very high89.5Confident66 Ų6639.7 Ų39.741%0.40520%0.195SC..  trans-163142-172.3174.20000112.4T125 V131 G132 V133T125-T129 PolarHBondContact O-N 3.44Å; T125-T129 VanDerWaalsContact O-N 3.12Å; T129-V131 VanDerWaalsContact C-N 3.31Å; T129-V131 PolarHBondContact O-N 3.2Å; T129-V131 PolarHBondContact OG1-N 2.78Å; T129-G132 PolarHBondContact O-N 3.2Å; T129-V133 WeakPolarHBondContact O-CG2 3.25Å; T129-V133 PolarHBondContact O-N 2.98Å
130Y91.2Very high89.8Confident21 Ų2141.1 Ų41.18%0.08220%0.202CC..Hα-helixtrans-51.9-45.4172.7168.3-108000113.2L52 I60 T64 W67 F68 G132 V133 I134L52-Y130 HydrophobicContact CD1-CD2 3.72Å; I60-Y130 HydrophobicContact CD1-CG 4.42Å; T64-Y130 PolarHBondContact O-OH 3.09Å; W67-Y130 WeakPolarHBondContact CB-OH 3.44Å; F68-Y130 HydrophobicContact CE2-CE2 4.04Å; F68-Y130 HydrophobicContact CZ-CE2 4.21Å; Y130-G132 VanDerWaalsContact C-N 3.28Å; Y130-G132 PolarHBondContact O-N 3.46Å; Y130-V133 WeakPolarHBondContact O-CB 3.24Å; Y130-V133 PolarHBondContact O-N 3.46Å; Y130-V133 VanDerWaalsContact O-N 3.08Å; Y130-I134 HydrophobicContact CD2-CG1 4.26Å; Y130-I134 HydrophobicContact CE1-CG1 4.03Å; Y130-I134 HydrophobicContact CE2-CD1 3.89Å; Y130-I134 HydrophobicContact CE2-CG1 3.78Å; Y130-I134 PolarHBondContact O-N 3.42Å
131V91.1Very high90Very high48 Ų4839.8 Ų39.829%0.29120%0.195SC..Hα-helixtrans-63.2-38.8-178.2179.70000110.9T129 V133 I134 L135 I444T129-V131 VanDerWaalsContact C-N 3.31Å; T129-V131 PolarHBondContact O-N 3.2Å; T129-V131 PolarHBondContact OG1-N 2.78Å; V131-V133 VanDerWaalsContact C-N 3.33Å; V131-V133 PolarHBondContact O-N 2.87Å; V131-I134 PolarHBondContact O-N 3.32Å; V131-L135 HydrophobicContact CG1-CD1 4.22Å; V131-L135 HydrophobicContact CG1-CG 4.47Å; V131-L135 WeakPolarHBondContact O-CG 3.24Å; V131-L135 PolarHBondContact O-N 3.14Å; V131-I444 HydrophobicContact CG2-CG2 3.55Å
132G90Very high90.3Very high11 Ų1138.7 Ų38.711%0.11319%0.19CC..Hα-helixtrans-61.8-40.4174.700000111.9T125 T129 Y130 L135 T136T125-G132 VanDerWaalsContact CB-C 3.44Å; T125-G132 PolarHBondContact OG1-O 2.91Å; T129-G132 PolarHBondContact O-N 3.2Å; Y130-G132 VanDerWaalsContact C-N 3.28Å; Y130-G132 PolarHBondContact O-N 3.46Å; G132-L135 PolarHBondContact O-N 3.34Å; G132-T136 WeakPolarHBondContact O-CB 3.31Å; G132-T136 VanDerWaalsContact O-CG2 3.25Å; G132-T136 WeakPolarHBondContact O-CG2 3.34Å; G132-T136 PolarHBondContact O-N 3.09Å; G132-T136 PolarHBondContact O-OG1 3.34Å
133V91.2Very high90.4Very high0 Ų038.8 Ų38.80%019%0.19CC..Hα-helixtrans-64.1-46.4175.2-167.30000110.3I48 L52 F68 I126 T129 Y130 V131 L135 T136 Y137I48-V133 HydrophobicContact CG2-CG1 4.33Å; L52-V133 HydrophobicContact CD2-CG2 4.24Å; F68-V133 HydrophobicContact CE1-CB 4.38Å; F68-V133 HydrophobicContact CE1-CG1 3.73Å; F68-V133 HydrophobicContact CZ-CG1 4.12Å; I126-V133 VanDerWaalsContact CA-CG2 3.46Å; I126-V133 HydrophobicContact CB-CG2 4.12Å; I126-V133 HydrophobicContact CD1-CG1 4.3Å; I126-V133 HydrophobicContact CD1-CG2 3.72Å; T129-V133 WeakPolarHBondContact O-CG2 3.25Å; T129-V133 PolarHBondContact O-N 2.98Å; Y130-V133 WeakPolarHBondContact O-CB 3.24Å; Y130-V133 PolarHBondContact O-N 3.46Å; Y130-V133 VanDerWaalsContact O-N 3.08Å; V131-V133 VanDerWaalsContact C-N 3.33Å; V131-V133 PolarHBondContact O-N 2.87Å; V133-L135 VanDerWaalsContact C-N 3.33Å; V133-L135 PolarHBondContact O-N 3.33Å; V133-T136 PolarHBondContact O-N 2.86Å; V133-T136 PolarHBondContact O-OG1 3.02Å; V133-Y137 WeakPolarHBondContact O-CA 3.38Å; V133-Y137 WeakPolarHBondContact O-CB 3.34Å; V133-Y137 PolarHBondContact O-N 3.46Å
134I91.5Very high90.3Very high17 Ų1736.4 Ų36.49%0.08718%0.181CC..Iπ-helixtrans-58.6-43.7177.9-65.4-67.9000111.7W67 F68 V71 Y130 V131 T136 S138 F139W67-I134 HydrophobicContact CB-CD1 4.02Å; F68-I134 HydrophobicContact CD1-CD1 3.61Å; F68-I134 HydrophobicContact CD2-CD1 4.05Å; F68-I134 HydrophobicContact CE1-CD1 3.63Å; F68-I134 HydrophobicContact CE1-CG1 4.46Å; F68-I134 HydrophobicContact CE2-CD1 4.06Å; F68-I134 HydrophobicContact CG-CD1 3.81Å; F68-I134 HydrophobicContact CZ-CD1 3.84Å; V71-I134 HydrophobicContact CB-CG2 4.26Å; V71-I134 HydrophobicContact CG1-CG2 4.28Å; V71-I134 HydrophobicContact CG2-CG2 3.78Å; Y130-I134 HydrophobicContact CD2-CG1 4.26Å; Y130-I134 HydrophobicContact CE1-CG1 4.03Å; Y130-I134 HydrophobicContact CE2-CD1 3.89Å; Y130-I134 HydrophobicContact CE2-CG1 3.78Å; Y130-I134 PolarHBondContact O-N 3.42Å; V131-I134 PolarHBondContact O-N 3.32Å; I134-T136 VanDerWaalsContact C-N 3.34Å; I134-T136 PolarHBondContact O-N 3.44Å; I134-S138 WeakPolarHBondContact O-CA 3.3Å; I134-S138 WeakPolarHBondContact O-CB 3.32Å; I134-S138 PolarHBondContact O-N 2.91Å; I134-S138 PolarHBondContact O-OG 3.26Å; I134-F139 PolarHBondContact O-N 3.36Å
135L90.6Very high90.3Very high94 Ų9431 Ų3149%0.49216%0.157SC..Iπ-helixtrans-64.9-38.9178.6-71174000112.5V131 G132 V133 F139 L140V131-L135 HydrophobicContact CG1-CD1 4.22Å; V131-L135 HydrophobicContact CG1-CG 4.47Å; V131-L135 WeakPolarHBondContact O-CG 3.24Å; V131-L135 PolarHBondContact O-N 3.14Å; G132-L135 PolarHBondContact O-N 3.34Å; V133-L135 VanDerWaalsContact C-N 3.33Å; V133-L135 PolarHBondContact O-N 3.33Å; L135-F139 VanDerWaalsContact O-CB 3.3Å; L135-F139 WeakPolarHBondContact O-CB 3.17Å; L135-L140 PolarHBondContact O-N 2.98Å; L135-L140 VanDerWaalsContact O-N 3.08Å
136T89.7Confident90.3Very high10 Ų1030 Ų306%0.06115%0.151CC..Iπ-helixtrans-89.8-43.6-171.956.60000112.3G118 L121 T125 G132 V133 I134 L140G118-T136 CarbonylContact C-O 3.23Å; G118-T136 WeakPolarHBondContact CA-O 3.49Å; G118-T136 CarbonylContact O-C 3.6Å; G118-T136 VanDerWaalsContact O-O 3.06Å; L121-T136 HydrophobicContact CB-CG2 4.41Å; L121-T136 HydrophobicContact CD2-CG2 3.28Å; L121-T136 HydrophobicContact CG-CG2 3.64Å; T125-T136 HydrophobicContact CG2-CG2 3.54Å; T125-T136 PolarHBondContact OG1-OG1 3.21Å; G132-T136 WeakPolarHBondContact O-CB 3.31Å; G132-T136 VanDerWaalsContact O-CG2 3.25Å; G132-T136 WeakPolarHBondContact O-CG2 3.34Å; G132-T136 PolarHBondContact O-N 3.09Å; G132-T136 PolarHBondContact O-OG1 3.34Å; V133-T136 PolarHBondContact O-N 2.86Å; V133-T136 PolarHBondContact O-OG1 3.02Å; I134-T136 VanDerWaalsContact C-N 3.34Å; I134-T136 PolarHBondContact O-N 3.44Å; T136-L140 HydrophobicContact CG2-CD1 4.45Å; T136-L140 WeakPolarHBondContact O-CB 3.42Å
137Y90.1Very high90.2Very high3 Ų330.2 Ų30.21%0.01215%0.152CC..Iπ-helixtrans-82-35.1-178.2-163.7-122.7000113.2Y37 L41 I48 F68 V119 S122 V133 F141 F217Y37-Y137 AromaticContact CE1-CE2 3.69Å; Y37-Y137 HydrophobicContact CE1-CE2 3.69Å; Y37-Y137 AromaticContact CE1-CZ 3.92Å; Y37-Y137 AromaticContact CZ-CE2 3.89Å; Y37-Y137 VanDerWaalsContact OH-CE2 3.25Å; Y37-Y137 WeakPolarHBondContact OH-CE2 3.1Å; Y37-Y137 PolarHBondContact OH-OH 3.44Å; L41-Y137 HydrophobicContact CD2-CD1 3.87Å; L41-Y137 HydrophobicContact CD2-CE1 3.03Å; L41-Y137 WeakPolarHBondContact CD2-OH 3.46Å; I48-Y137 HydrophobicContact CD1-CD1 3.99Å; I48-Y137 HydrophobicContact CD1-CE1 3.49Å; I48-Y137 VanDerWaalsContact CD1-CE1 3.49Å; F68-Y137 AromaticContact CD1-CD1 3.77Å; F68-Y137 HydrophobicContact CD1-CD1 3.77Å; F68-Y137 HydrophobicContact CD1-CE1 4.43Å; F68-Y137 AromaticContact CE1-CD1 3.96Å; F68-Y137 HydrophobicContact CE1-CD1 3.96Å; V119-Y137 HydrophobicContact CG1-CE2 4.31Å; V119-Y137 HydrophobicContact CG2-CD2 4.41Å; V119-Y137 HydrophobicContact CG2-CE2 4.33Å; S122-Y137 WeakPolarHBondContact OG-CA 3.48Å; S122-Y137 WeakPolarHBondContact OG-CB 3.35Å; S122-Y137 WeakPolarHBondContact OG-CD2 3.4Å; S122-Y137 PolarHBondContact OG-N 3.34Å; V133-Y137 WeakPolarHBondContact O-CA 3.38Å; V133-Y137 WeakPolarHBondContact O-CB 3.34Å; V133-Y137 PolarHBondContact O-N 3.46Å; Y137-F141 WeakPolarHBondContact O-CB 3.5Å; Y137-F217 HydrophobicContact CD2-CD1 4.24Å; Y137-F217 AromaticContact CD2-CE1 3.79Å; Y137-F217 HydrophobicContact CD2-CE1 3.79Å; Y137-F217 AromaticContact CE2-CD1 3.94Å; Y137-F217 HydrophobicContact CE2-CD1 3.94Å; Y137-F217 AromaticContact CE2-CE1 3.5Å; Y137-F217 HydrophobicContact CE2-CE1 3.5Å; Y137-F217 VanDerWaalsContact CE2-CE1 3.5Å; Y137-F217 AromaticContact CZ-CE1 3.96Å
138S90.1Very high90.2Very high0 Ų026.3 Ų26.30%013%0.134CC..Iπ-helixtrans-102.9-52.9-175.6-45.10000112.5F68 T72 I134 G142F68-S138 WeakPolarHBondContact CA-OG 3.36Å; F68-S138 WeakPolarHBondContact CD1-OG 3.36Å; F68-S138 WeakPolarHBondContact O-CB 3.43Å; F68-S138 PolarHBondContact O-OG 3.15Å; T72-S138 WeakPolarHBondContact OG1-CA 3.44Å; T72-S138 VanDerWaalsContact OG1-CB 3.23Å; T72-S138 WeakPolarHBondContact OG1-CB 3.25Å; T72-S138 PolarHBondContact OG1-O 2.72Å; I134-S138 WeakPolarHBondContact O-CA 3.3Å; I134-S138 WeakPolarHBondContact O-CB 3.32Å; I134-S138 PolarHBondContact O-N 2.91Å; I134-S138 PolarHBondContact O-OG 3.26Å; S138-G142 PolarHBondContact O-N 3.3Å
139F91.1Very high90.2Very high81 Ų8118.7 Ų18.736%0.35510%0.101SC..Iπ-helixtrans-69.3-55.5-175.4179.6-77.1000111.6V71 V75 I134 L135 F141 G142 T143V71-F139 HydrophobicContact CG1-CB 3.93Å; V71-F139 HydrophobicContact CG1-CD2 4.49Å; V75-F139 HydrophobicContact CG1-CD2 4.36Å; V75-F139 HydrophobicContact CG1-CE2 4.41Å; V75-F139 HydrophobicContact CG2-CB 4.39Å; V75-F139 HydrophobicContact CG2-CD2 3.34Å; V75-F139 HydrophobicContact CG2-CE2 3.75Å; V75-F139 HydrophobicContact CG2-CG 4Å; I134-F139 PolarHBondContact O-N 3.36Å; L135-F139 VanDerWaalsContact O-CB 3.3Å; L135-F139 WeakPolarHBondContact O-CB 3.17Å; F139-F141 VanDerWaalsContact C-N 3.32Å; F139-F141 PolarHBondContact O-N 2.87Å; F139-G142 PolarHBondContact O-N 2.88Å; F139-G142 VanDerWaalsContact O-N 3.16Å; F139-T143 PolarHBondContact O-N 3.43Å; F139-T143 PolarHBondContact O-OG1 3.01Å
140L90.7Very high89.9Confident31 Ų3115.7 Ų15.716%0.1628%0.082CC..Hα-helixtrans-61.9-40179.7-65.5177.9000112.4F102 L121 L135 T136 T143 G144F102-L140 HydrophobicContact CD1-CD2 4.21Å; L121-L140 HydrophobicContact CD2-CD1 3.84Å; L135-L140 PolarHBondContact O-N 2.98Å; L135-L140 VanDerWaalsContact O-N 3.08Å; T136-L140 HydrophobicContact CG2-CD1 4.45Å; T136-L140 WeakPolarHBondContact O-CB 3.42Å; L140-T143 PolarHBondContact O-N 3.31Å; L140-G144 PolarHBondContact O-N 2.73Å
141F89.6Confident89.8Confident2 Ų214.9 Ų14.91%0.0098%0.079CC..Hα-helixtrans-61.9-45.6174.8-172.8-88.3000111.3Y37 L38 T72 L103 V119 Y137 F139 T143 G144 V145Y37-F141 HydrophobicContact CD1-CD2 4.14Å; Y37-F141 AromaticContact CD1-CE2 3.51Å; Y37-F141 HydrophobicContact CD1-CE2 3.51Å; Y37-F141 AromaticContact CD1-CZ 3.83Å; Y37-F141 HydrophobicContact CD1-CZ 3.83Å; Y37-F141 HydrophobicContact CE1-CE2 4.41Å; Y37-F141 HydrophobicContact CG-CE2 4.28Å; Y37-F141 HydrophobicContact CG-CZ 4.4Å; L38-F141 HydrophobicContact CB-CE1 3.93Å; L38-F141 HydrophobicContact CB-CZ 4.49Å; L38-F141 HydrophobicContact CD1-CD1 4.07Å; L38-F141 HydrophobicContact CD1-CE1 3.84Å; L38-F141 HydrophobicContact CG-CE1 4.46Å; T72-F141 HydrophobicContact CG2-CD1 3.9Å; L103-F141 HydrophobicContact CD2-CB 4.39Å; L103-F141 HydrophobicContact CD2-CD2 3.16Å; L103-F141 HydrophobicContact CD2-CE2 3.42Å; L103-F141 VanDerWaalsContact CD2-CE2 3.42Å; L103-F141 HydrophobicContact CD2-CG 3.9Å; L103-F141 HydrophobicContact CD2-CZ 4.35Å; V119-F141 HydrophobicContact CG2-CD2 3.92Å; V119-F141 HydrophobicContact CG2-CE2 4.45Å; Y137-F141 WeakPolarHBondContact O-CB 3.5Å; F139-F141 VanDerWaalsContact C-N 3.32Å; F139-F141 PolarHBondContact O-N 2.87Å; F141-T143 VanDerWaalsContact C-N 3.35Å; F141-T143 PolarHBondContact O-N 3.04Å; F141-G144 PolarHBondContact O-N 3.15Å; F141-V145 HydrophobicContact CD1-CG2 3.91Å; F141-V145 HydrophobicContact CE1-CG2 3.45Å; F141-V145 VanDerWaalsContact CE1-CG2 3.45Å; F141-V145 HydrophobicContact CZ-CG2 3.86Å; F141-V145 WeakPolarHBondContact O-CG2 3.38Å; F141-V145 PolarHBondContact O-N 3.06Å
142G89.1Confident89.7Confident0 Ų012.6 Ų12.60%07%0.066CC..Hα-helixtrans-60.7-39.3175.700000113.4Y76 S138 F139 G146Y76-G142 WeakPolarHBondContact CA-O 3.14Å; S138-G142 PolarHBondContact O-N 3.3Å; F139-G142 PolarHBondContact O-N 2.88Å; F139-G142 VanDerWaalsContact O-N 3.16Å; G142-G146 PolarHBondContact O-N 3.46Å
143T90.9Very high89.6Confident2 Ų212.1 Ų12.11%0.0126%0.061CC..Hα-helixtrans-62-47.5173.4-63.50000111V75 F79 F102 F139 L140 F141 G146 L147V75-T143 WeakPolarHBondContact CG1-OG1 3.43Å; F79-T143 HydrophobicContact CD1-CG2 3.73Å; F79-T143 HydrophobicContact CD2-CG2 4.47Å; F79-T143 HydrophobicContact CE1-CG2 3.72Å; F79-T143 HydrophobicContact CE2-CG2 4.45Å; F79-T143 HydrophobicContact CG-CG2 4.11Å; F79-T143 HydrophobicContact CZ-CG2 4.09Å; F102-T143 HydrophobicContact CD1-CG2 4.02Å; F102-T143 HydrophobicContact CD2-CG2 3.91Å; F102-T143 HydrophobicContact CE1-CG2 4.13Å; F102-T143 HydrophobicContact CE2-CG2 4.01Å; F102-T143 HydrophobicContact CG-CG2 3.92Å; F102-T143 HydrophobicContact CZ-CG2 4.13Å; F139-T143 PolarHBondContact O-N 3.43Å; F139-T143 PolarHBondContact O-OG1 3.01Å; L140-T143 PolarHBondContact O-N 3.31Å; F141-T143 VanDerWaalsContact C-N 3.35Å; F141-T143 PolarHBondContact O-N 3.04Å; T143-G146 PolarHBondContact O-N 3.49Å; T143-L147 HydrophobicContact CG2-CD1 4.02Å; T143-L147 WeakPolarHBondContact O-CG 3.24Å; T143-L147 PolarHBondContact O-N 3.26Å
144G88.2Confident89.3Confident0 Ų013.2 Ų13.20%07%0.07CC..Hα-helixtrans-57.8-53.6177.300000111.9S99 L140 F141 G146 L147 G148S99-G144 VanDerWaalsContact CB-O 3.32Å; S99-G144 WeakPolarHBondContact CB-O 3.26Å; S99-G144 WeakPolarHBondContact O-CA 3.48Å; S99-G144 PolarHBondContact OG-O 2.94Å; L140-G144 PolarHBondContact O-N 2.73Å; F141-G144 PolarHBondContact O-N 3.15Å; G144-G146 PolarHBondContact O-N 3.39Å; G144-L147 PolarHBondContact O-N 3.07Å; G144-G148 PolarHBondContact O-N 2.69Å
145V89.7Confident89.1Confident1 Ų113.1 Ų13.11%0.0067%0.07CC..Hα-helixtrans-59.3-46.2177.81770000111Y35 Y76 F141 L147 G148 F149Y35-V145 HydrophobicContact CD1-CB 4.4Å; Y35-V145 HydrophobicContact CD1-CG2 3.77Å; Y35-V145 HydrophobicContact CD2-CG1 4.48Å; Y35-V145 HydrophobicContact CG-CG1 4.25Å; Y35-V145 HydrophobicContact CG-CG2 4.03Å; Y76-V145 HydrophobicContact CD2-CG1 4.16Å; Y76-V145 HydrophobicContact CE2-CG1 4.26Å; Y76-V145 HydrophobicContact CG-CG1 4.33Å; F141-V145 HydrophobicContact CD1-CG2 3.91Å; F141-V145 HydrophobicContact CE1-CG2 3.45Å; F141-V145 VanDerWaalsContact CE1-CG2 3.45Å; F141-V145 HydrophobicContact CZ-CG2 3.86Å; F141-V145 WeakPolarHBondContact O-CG2 3.38Å; F141-V145 PolarHBondContact O-N 3.06Å; V145-L147 PolarHBondContact O-N 3.45Å; V145-G148 PolarHBondContact O-N 2.55Å; V145-F149 HydrophobicContact CG1-CB 4.38Å; V145-F149 HydrophobicContact CG1-CD2 4.2Å; V145-F149 WeakPolarHBondContact O-CB 3.45Å; V145-F149 PolarHBondContact O-N 3.43Å
146G88.7Confident88.9Confident0 Ų08.6 Ų8.60%05%0.046CC..Hα-helixtrans-59.8-47.5-178.500000113.9M80 G142 T143 G144 G148M80-G146 VanDerWaalsContact CA-O 3.24Å; M80-G146 WeakPolarHBondContact CA-O 3.39Å; G142-G146 PolarHBondContact O-N 3.46Å; T143-G146 PolarHBondContact O-N 3.49Å; G144-G146 PolarHBondContact O-N 3.39Å; G146-G148 VanDerWaalsContact C-N 3.28Å; G146-G148 PolarHBondContact O-N 3.03Å
147L90.4Very high88.5Confident4 Ų48.6 Ų8.62%0.0215%0.047CC..Hα-helixtrans-61.5-34.8-178.7-72173.4000113.4F79 L82 G83 V95 L98 F102 T143 G144 V145F79-L147 HydrophobicContact CB-CG 4.41Å; F79-L147 HydrophobicContact CD1-CD2 4.01Å; F79-L147 HydrophobicContact CD1-CG 4.12Å; L82-L147 HydrophobicContact CD2-CD2 4.47Å; L82-L147 HydrophobicContact CG-CD2 4.4Å; G83-L147 WeakPolarHBondContact CA-O 3.2Å; V95-L147 WeakPolarHBondContact CG1-O 3.45Å; L98-L147 HydrophobicContact CD2-CD1 4.09Å; L98-L147 HydrophobicContact CG-CD1 4.14Å; F102-L147 HydrophobicContact CD2-CD1 3.73Å; F102-L147 HydrophobicContact CE2-CD1 3.76Å; T143-L147 HydrophobicContact CG2-CD1 4.02Å; T143-L147 WeakPolarHBondContact O-CG 3.24Å; T143-L147 PolarHBondContact O-N 3.26Å; G144-L147 PolarHBondContact O-N 3.07Å; V145-L147 PolarHBondContact O-N 3.45Å
148G88.2Confident88.1Confident0 Ų011.7 Ų11.70%07%0.066CC..Hα-helixtrans-105.5-20.8-170.500000116.2Y35 G144 V145 G146 V151 T152Y35-G148 WeakPolarHBondContact OH-CA 3.31Å; G144-G148 PolarHBondContact O-N 2.69Å; V145-G148 PolarHBondContact O-N 2.55Å; G146-G148 VanDerWaalsContact C-N 3.28Å; G146-G148 PolarHBondContact O-N 3.03Å; G148-V151 PolarHBondContact O-N 3.49Å; G148-T152 VanDerWaalsContact O-CB 3.28Å; G148-T152 WeakPolarHBondContact O-CB 3.05Å; G148-T152 PolarHBondContact O-N 3.16Å; G148-T152 PolarHBondContact O-OG1 3.23Å
149F89.6Confident87.7Confident2 Ų212.9 Ų12.91%0.0097%0.071CC..Hα-helixtrans-58.9-57-174.4-170-78.9000112.2H32 Y35 Y76 M80 V145 V151 L153 V172 Y175 Y418H32-F149 AromaticContact CD2-CE2 3.65Å; H32-F149 AromaticContact NE2-CD2 3.86Å; H32-F149 AromaticContact NE2-CE2 3.78Å; H32-F149 AromaticContact NE2-CZ 3.91Å; Y35-F149 HydrophobicContact CD2-CD2 4.15Å; Y35-F149 HydrophobicContact CE2-CB 4.45Å; Y76-F149 HydrophobicContact CE2-CB 4.04Å; Y76-F149 HydrophobicContact CE2-CG 4.21Å; Y76-F149 VanDerWaalsContact OH-CD1 3.27Å; Y76-F149 WeakPolarHBondContact OH-CD1 3.27Å; Y76-F149 WeakPolarHBondContact OH-CG 3.45Å; M80-F149 HydrophobicContact CE-CD1 4.34Å; V145-F149 HydrophobicContact CG1-CB 4.38Å; V145-F149 HydrophobicContact CG1-CD2 4.2Å; V145-F149 WeakPolarHBondContact O-CB 3.45Å; V145-F149 PolarHBondContact O-N 3.43Å; F149-V151 VanDerWaalsContact C-N 3.35Å; F149-V151 PolarHBondContact O-N 3.32Å; F149-L153 HydrophobicContact CE1-CD2 4.49Å; F149-L153 WeakPolarHBondContact O-CB 3.23Å; F149-L153 PolarHBondContact O-N 3.46Å; F149-L153 VanDerWaalsContact O-N 3.14Å; F149-V172 HydrophobicContact CZ-CG2 4.46Å; F149-Y175 AromaticContact CE2-CD2 3.98Å; F149-Y175 HydrophobicContact CE2-CD2 3.98Å; F149-Y175 HydrophobicContact CE2-CE2 4.19Å; F149-Y175 HydrophobicContact CE2-CG 4.23Å; F149-Y418 HydrophobicContact CD1-CE1 4.13Å; F149-Y418 AromaticContact CE1-CE1 3.84Å; F149-Y418 HydrophobicContact CE1-CE1 3.84Å
150S87.2Confident87.3Confident2 Ų210.2 Ų10.21%0.0146%0.059CC..Hα-helixtrans-66.8-36.7-176.7610000112.4M80 A154 A415M80-S150 PolarHBondContact O-OG 2.87Å; S150-A154 WeakPolarHBondContact O-CB 3.49Å; S150-A154 PolarHBondContact O-N 2.83Å; S150-A415 WeakPolarHBondContact CB-O 3.47Å
151V88Confident86.5Confident4 Ų411.2 Ų11.22%0.0247%0.067CC..Hα-helixtrans-67.7-49.6-179.9-179.60000110.9G83 V95 G148 F149 L153 A154 V155G83-V151 WeakPolarHBondContact O-CG2 3.38Å; V95-V151 HydrophobicContact CG1-CG2 4.1Å; G148-V151 PolarHBondContact O-N 3.49Å; F149-V151 VanDerWaalsContact C-N 3.35Å; F149-V151 PolarHBondContact O-N 3.32Å; V151-L153 VanDerWaalsContact C-N 3.29Å; V151-L153 PolarHBondContact O-N 3.47Å; V151-A154 PolarHBondContact O-N 3.5Å; V151-V155 WeakPolarHBondContact O-CG2 3.15Å; V151-V155 PolarHBondContact O-N 3.3Å
152T89.8Confident85.8Confident0 Ų019.3 Ų19.30%011%0.105CC..Hα-helixtrans-60-43.1178.7-57.10000110.9G28 I31 L96 G148 V155 A156 L235G28-T152 VanDerWaalsContact CA-CG2 3.49Å; I31-T152 HydrophobicContact CB-CG2 4.28Å; I31-T152 HydrophobicContact CD1-CG2 4.25Å; I31-T152 HydrophobicContact CG2-CG2 4.15Å; L96-T152 WeakPolarHBondContact CD1-OG1 3.18Å; G148-T152 VanDerWaalsContact O-CB 3.28Å; G148-T152 WeakPolarHBondContact O-CB 3.05Å; G148-T152 PolarHBondContact O-N 3.16Å; G148-T152 PolarHBondContact O-OG1 3.23Å; T152-V155 PolarHBondContact O-N 2.96Å; T152-A156 PolarHBondContact O-N 2.86Å; T152-A156 VanDerWaalsContact O-N 3.1Å; T152-L235 HydrophobicContact CG2-CD1 4.37Å; T152-L235 HydrophobicContact CG2-CD2 4.17Å
153L88Confident85.1Confident2 Ų222 Ų221%0.0112%0.118CC..Hα-helixtrans-63.4-45.6178.9-170.760.5000112.1F149 V151 A156 A157 V168 V171 V172 P402 M414 Y418F149-L153 HydrophobicContact CE1-CD2 4.49Å; F149-L153 WeakPolarHBondContact O-CB 3.23Å; F149-L153 PolarHBondContact O-N 3.46Å; F149-L153 VanDerWaalsContact O-N 3.14Å; V151-L153 VanDerWaalsContact C-N 3.29Å; V151-L153 PolarHBondContact O-N 3.47Å; L153-A156 PolarHBondContact O-N 3.29Å; L153-A157 WeakPolarHBondContact O-CB 3.34Å; L153-A157 PolarHBondContact O-N 3.28Å; L153-V168 HydrophobicContact CD1-CB 4.08Å; L153-V168 HydrophobicContact CD1-CG1 4.01Å; L153-V168 HydrophobicContact CD1-CG2 3.86Å; L153-V168 HydrophobicContact CD2-CG1 4.2Å; L153-V168 HydrophobicContact CG-CG2 4.17Å; L153-V171 HydrophobicContact CD1-CB 4.32Å; L153-V171 HydrophobicContact CD1-CG1 4.15Å; L153-V172 HydrophobicContact CD1-CG2 3.67Å; L153-V172 HydrophobicContact CD2-CG2 4.22Å; L153-P402 HydrophobicContact CD2-CB 3.79Å; L153-P402 HydrophobicContact CD2-CG 4.13Å; L153-M414 HydrophobicContact CD2-CE 4.4Å; L153-Y418 HydrophobicContact CD2-CE1 4.35Å
154A85.1Confident84.3Confident23 Ų2325.8 Ų25.819%0.1913%0.132CC..Hα-helixtrans-62.3-44.3178.700000111.7S150 V151 A157 T158 A415S150-A154 WeakPolarHBondContact O-CB 3.49Å; S150-A154 PolarHBondContact O-N 2.83Å; V151-A154 PolarHBondContact O-N 3.5Å; A154-A157 PolarHBondContact O-N 3.18Å; A154-T158 WeakPolarHBondContact O-CG2 3.24Å; A154-T158 PolarHBondContact O-N 3.36Å; A154-A415 HydrophobicContact CB-CB 4.1Å
155V86.2Confident83.7Confident14 Ų1425.9 Ų25.99%0.08513%0.133CC..Hα-helixtrans-60.3-48177.9173.20000111.2Y92 V151 T152 A157 T158 L235Y92-V155 HydrophobicContact CD1-CG2 4.47Å; Y92-V155 HydrophobicContact CD2-CG2 3.89Å; Y92-V155 HydrophobicContact CE2-CG1 4.45Å; Y92-V155 HydrophobicContact CG-CG2 3.85Å; V151-V155 WeakPolarHBondContact O-CG2 3.15Å; V151-V155 PolarHBondContact O-N 3.3Å; T152-V155 PolarHBondContact O-N 2.96Å; V155-A157 PolarHBondContact O-N 2.9Å; V155-T158 PolarHBondContact O-N 2.78Å; V155-T158 PolarHBondContact O-OG1 3.01Å; V155-L235 HydrophobicContact CB-CD2 4.49Å; V155-L235 HydrophobicContact CG1-CD1 4.05Å; V155-L235 HydrophobicContact CG1-CD2 4.27Å; V155-L235 HydrophobicContact CG1-CG 4.03Å
156A86.1Confident83.3Confident0 Ų026.3 Ų26.30%014%0.135CC..Hα-helixtrans-64.1-40179.200000112.3T152 L153 T158 W159 V167 V171T152-A156 PolarHBondContact O-N 2.86Å; T152-A156 VanDerWaalsContact O-N 3.1Å; L153-A156 PolarHBondContact O-N 3.29Å; A156-T158 PolarHBondContact O-N 2.81Å; A156-W159 PolarHBondContact O-N 3.17Å; A156-V167 HydrophobicContact CB-CG1 4.4Å; A156-V171 HydrophobicContact CB-CG2 3.74Å
157A81.8Confident83Confident9 Ų926.6 Ų26.67%0.07414%0.137CC..Hα-helixtrans-65.3-22178.900000113.7L153 A154 V155 W159 V168L153-A157 WeakPolarHBondContact O-CB 3.34Å; L153-A157 PolarHBondContact O-N 3.28Å; A154-A157 PolarHBondContact O-N 3.18Å; V155-A157 PolarHBondContact O-N 2.9Å; A157-W159 VanDerWaalsContact C-N 3.29Å; A157-W159 PolarHBondContact O-N 3.43Å; A157-V168 HydrophobicContact CB-CG2 4.17Å
158T82.6Confident82.7Confident69 Ų6926.6 Ų26.642%0.42314%0.137SC..THydrogen-bonded Turntrans-69.6-22.4177.966.50000114.2A154 V155 A156A154-T158 WeakPolarHBondContact O-CG2 3.24Å; A154-T158 PolarHBondContact O-N 3.36Å; V155-T158 PolarHBondContact O-N 2.78Å; V155-T158 PolarHBondContact O-OG1 3.01Å; A156-T158 PolarHBondContact O-N 2.81Å
159W81.4Confident82.6Confident25 Ų2526.6 Ų26.610%0.09514%0.137CC..THydrogen-bonded Turntrans-71-39.5-177.2-80.992000113G17 A20 S24 A156 A157 P161 R236 S237 K238G17-W159 WeakPolarHBondContact O-CZ3 3.43Å; A20-W159 HydrophobicContact CB-CH2 3.51Å; A20-W159 HydrophobicContact CB-CZ2 4.24Å; A20-W159 HydrophobicContact CB-CZ3 3.99Å; S24-W159 PolarHBondContact OG-NE1 3.49Å; A156-W159 PolarHBondContact O-N 3.17Å; A157-W159 VanDerWaalsContact C-N 3.29Å; A157-W159 PolarHBondContact O-N 3.43Å; W159-P161 WeakPolarHBondContact O-CD 3.32Å; W159-R236 HydrophobicContact CZ2-CB 4.46Å; W159-R236 PolarHBondContact NE1-O 2.84Å; W159-S237 WeakPolarHBondContact CZ2-O 3.16Å; W159-K238 HydrophobicContact CD2-CB 3.86Å; W159-K238 HydrophobicContact CD2-CG 4.29Å; W159-K238 HydrophobicContact CE3-CB 4.2Å; W159-K238 HydrophobicContact CE3-CD 4.42Å; W159-K238 HydrophobicContact CE3-CG 4.12Å; W159-K238 HydrophobicContact CG-CB 4.25Å; W159-K238 HydrophobicContact CZ2-CB 4.23Å; W159-K238 HydrophobicContact CZ3-CG 4.3Å
160F81.7Confident82.6Confident25 Ų2529.1 Ų29.111%0.1115%0.15CC..  trans-126.876-173-56-72000110.7I12 T18 V25 E162 H163 R164 V167I12-F160 HydrophobicContact CB-CE1 4.4Å; I12-F160 HydrophobicContact CG1-CD1 4.28Å; I12-F160 HydrophobicContact CG2-CD1 3.95Å; I12-F160 HydrophobicContact CG2-CE1 3.48Å; I12-F160 VanDerWaalsContact CG2-CE1 3.48Å; I12-F160 HydrophobicContact CG2-CE2 4.06Å; I12-F160 HydrophobicContact CG2-CG 4.45Å; I12-F160 HydrophobicContact CG2-CZ 3.52Å; T18-F160 HydrophobicContact CG2-CE1 4.41Å; V25-F160 HydrophobicContact CG2-CD2 4.09Å; V25-F160 HydrophobicContact CG2-CE2 3.83Å; F160-E162 VanDerWaalsContact C-N 3.25Å; F160-E162 PolarHBondContact O-N 3.45Å; F160-H163 CarbonylContact O-C 3.54Å; F160-H163 PolarHBondContact O-N 2.94Å; F160-R164 PolarHBondContact O-N 3.32Å; F160-V167 HydrophobicContact CB-CG2 3.82Å; F160-V167 HydrophobicContact CD2-CG2 3.79Å; F160-V167 HydrophobicContact CG-CG2 4.13Å
161P74.4Confident82.8Confident51 Ų5129 Ų2933%0.33115%0.15SC..G310 helixtrans-64.8-25.4-175.425.8-34.7000114.2W159 R164W159-P161 WeakPolarHBondContact O-CD 3.32Å; P161-R164 VanDerWaalsContact O-CD 3.31Å; P161-R164 WeakPolarHBondContact O-CD 3.11Å; P161-R164 VanDerWaalsContact O-CG 3.27Å; P161-R164 WeakPolarHBondContact O-CG 3.46Å; P161-R164 PolarHBondContact O-NE 3.49Å
162E75.6Confident82.9Confident172 Ų17228.9 Ų28.980%0.80415%0.148SC*.G310 helixtrans-79.3-22.3179.6-62.1-173.616500113.3F160F160-E162 VanDerWaalsContact C-N 3.25Å; F160-E162 PolarHBondContact O-N 3.45Å
163H74.5Confident83Confident57 Ų5729 Ų2926%0.26415%0.15SC..G310 helixtrans-125.140.7-177.8-59.7-44.1000111.6I12 F160 G165 L166 V167I12-H163 HydrophobicContact CD1-CB 4.34Å; F160-H163 CarbonylContact O-C 3.54Å; F160-H163 PolarHBondContact O-N 2.94Å; H163-G165 PolarHBondContact O-N 3.01Å; H163-L166 HydrophobicContact CB-CB 4.41Å; H163-L166 PolarHBondContact O-N 3.29Å; H163-V167 PolarHBondContact O-N 2.88Å
164R73.4Confident83.1Confident82 Ų8229 Ų2931%0.30915%0.149SC..Hα-helixtrans-56.9-46.2-174.8-77.7168.5178.6162.73.7112.8F160 P161 V167 V168 C411F160-R164 PolarHBondContact O-N 3.32Å; P161-R164 VanDerWaalsContact O-CD 3.31Å; P161-R164 WeakPolarHBondContact O-CD 3.11Å; P161-R164 VanDerWaalsContact O-CG 3.27Å; P161-R164 WeakPolarHBondContact O-CG 3.46Å; P161-R164 PolarHBondContact O-NE 3.49Å; R164-V167 PolarHBondContact O-N 3.25Å; R164-V168 VanDerWaalsContact O-CB 3.3Å; R164-V168 WeakPolarHBondContact O-CB 3.17Å; R164-V168 VanDerWaalsContact O-CG2 3.25Å; R164-V168 WeakPolarHBondContact O-CG2 3.35Å; R164-V168 PolarHBondContact O-N 3.37Å; R164-C411 PolarHBondContact NH1-SG 3.2Å
165G76.3Confident83.3Confident2 Ų228.1 Ų28.12%0.02114%0.141CC..Hα-helixtrans-63.7-42.6-178.900000112.3H163 G169 D346H163-G165 PolarHBondContact O-N 3.01Å; G165-G169 PolarHBondContact O-N 3.35Å; G165-D346 VanDerWaalsContact CA-OD1 3.25Å; G165-D346 WeakPolarHBondContact CA-OD1 3.38Å; G165-D346 WeakPolarHBondContact CA-OD2 3.11Å; G165-D346 PolarHBondContact N-OD1 3.25Å
166L79.5Confident83.4Confident10 Ų1027.5 Ų27.55%0.05214%0.137CC..Hα-helixtrans-60.2-46.7173.1-17866.2000112.7I8 I12 H163 G169 L170 T343 D346I8-L166 HydrophobicContact CB-CD2 4.05Å; I8-L166 HydrophobicContact CG2-CD2 3.37Å; I12-L166 HydrophobicContact CD1-CD2 4.26Å; H163-L166 HydrophobicContact CB-CB 4.41Å; H163-L166 PolarHBondContact O-N 3.29Å; L166-G169 PolarHBondContact O-N 2.97Å; L166-L170 WeakPolarHBondContact O-CB 2.96Å; L166-L170 PolarHBondContact O-N 3.3Å; L166-T343 HydrophobicContact CD1-CG2 3.83Å; L166-D346 PolarHBondContact N-OD2 3.48Å
167V83.2Confident83.6Confident6 Ų630.1 Ų30.14%0.03615%0.15CC..Hα-helixtrans-67.5-42.4-179.61720000111.8V25 A156 F160 H163 R164 G169 L170 V171V25-V167 HydrophobicContact CG2-CG1 3.79Å; A156-V167 HydrophobicContact CB-CG1 4.4Å; F160-V167 HydrophobicContact CB-CG2 3.82Å; F160-V167 HydrophobicContact CD2-CG2 3.79Å; F160-V167 HydrophobicContact CG-CG2 4.13Å; H163-V167 PolarHBondContact O-N 2.88Å; R164-V167 PolarHBondContact O-N 3.25Å; V167-G169 VanDerWaalsContact C-N 3.35Å; V167-L170 PolarHBondContact O-N 2.93Å; V167-V171 HydrophobicContact CG1-CG2 4.49Å; V167-V171 WeakPolarHBondContact O-CG2 3.47Å; V167-V171 PolarHBondContact O-N 3.48Å
168V84.8Confident83.9Confident3 Ų329.7 Ų29.72%0.01815%0.147CC..Hα-helixtrans-57.4-50.3171.7161.60000109.8L153 A157 R164 L170 V171 V172 P402 M414L153-V168 HydrophobicContact CD1-CB 4.08Å; L153-V168 HydrophobicContact CD1-CG1 4.01Å; L153-V168 HydrophobicContact CD1-CG2 3.86Å; L153-V168 HydrophobicContact CD2-CG1 4.2Å; L153-V168 HydrophobicContact CG-CG2 4.17Å; A157-V168 HydrophobicContact CB-CG2 4.17Å; R164-V168 VanDerWaalsContact O-CB 3.3Å; R164-V168 WeakPolarHBondContact O-CB 3.17Å; R164-V168 VanDerWaalsContact O-CG2 3.25Å; R164-V168 WeakPolarHBondContact O-CG2 3.35Å; R164-V168 PolarHBondContact O-N 3.37Å; V168-L170 VanDerWaalsContact C-N 3.33Å; V168-L170 PolarHBondContact O-N 3.14Å; V168-V171 PolarHBondContact O-N 3.44Å; V168-V172 HydrophobicContact CG1-CG2 4.31Å; V168-V172 WeakPolarHBondContact O-CB 3.14Å; V168-V172 WeakPolarHBondContact O-CG2 3.39Å; V168-V172 PolarHBondContact O-N 3.43Å; V168-P402 HydrophobicContact CG1-CB 4.38Å; V168-P402 HydrophobicContact CG1-CG 4.01Å; V168-M414 HydrophobicContact CG2-CE 4.41Å
169G86.1Confident84.1Confident0 Ų026.6 Ų26.60%013%0.128CC..Hα-helixtrans-59.6-40.3178.300000113G165 L166 V167 S173G165-G169 PolarHBondContact O-N 3.35Å; L166-G169 PolarHBondContact O-N 2.97Å; V167-G169 VanDerWaalsContact C-N 3.35Å; G169-S173 VanDerWaalsContact O-CB 3.28Å; G169-S173 WeakPolarHBondContact O-CB 3.26Å; G169-S173 PolarHBondContact O-N 3.23Å
170L89.4Confident84.6Confident56 Ų5628 Ų2829%0.29314%0.137SC..Hα-helixtrans-68-50.5178-170.7147.3000111.3V25 Y29 L166 V167 V168 V172 S173V25-L170 HydrophobicContact CG1-CD2 3.44Å; V25-L170 VanDerWaalsContact CG1-CD2 3.44Å; Y29-L170 HydrophobicContact CD2-CD2 4.34Å; Y29-L170 VanDerWaalsContact CD2-O 3.32Å; Y29-L170 WeakPolarHBondContact CD2-O 3.45Å; L166-L170 WeakPolarHBondContact O-CB 2.96Å; L166-L170 PolarHBondContact O-N 3.3Å; V167-L170 PolarHBondContact O-N 2.93Å; V168-L170 VanDerWaalsContact C-N 3.33Å; V168-L170 PolarHBondContact O-N 3.14Å; L170-V172 VanDerWaalsContact C-N 3.34Å; L170-V172 PolarHBondContact O-N 3.49Å; L170-S173 WeakPolarHBondContact O-CB 3.29Å; L170-S173 PolarHBondContact O-N 3.41Å; L170-S173 VanDerWaalsContact O-N 3.15Å; L170-S173 PolarHBondContact O-OG 2.79Å
171V90.5Very high85.1Confident0 Ų029.2 Ų29.20%015%0.146CC..Hα-helixtrans-59.9-47.1177.5168.90000110.9V25 H32 L153 A156 V167 V168 S173 G174V25-V171 HydrophobicContact CG1-CG2 4.05Å; H32-V171 HydrophobicContact CB-CG1 4.49Å; H32-V171 VanDerWaalsContact CB-O 3.26Å; H32-V171 WeakPolarHBondContact CB-O 3.19Å; H32-V171 VanDerWaalsContact CE1-CG1 3.46Å; H32-V171 WeakPolarHBondContact CE1-CG1 3.42Å; H32-V171 VanDerWaalsContact ND1-CG1 3.29Å; H32-V171 WeakPolarHBondContact ND1-CG1 3.28Å; L153-V171 HydrophobicContact CD1-CB 4.32Å; L153-V171 HydrophobicContact CD1-CG1 4.15Å; A156-V171 HydrophobicContact CB-CG2 3.74Å; V167-V171 HydrophobicContact CG1-CG2 4.49Å; V167-V171 WeakPolarHBondContact O-CG2 3.47Å; V167-V171 PolarHBondContact O-N 3.48Å; V168-V171 PolarHBondContact O-N 3.44Å; V171-S173 PolarHBondContact O-N 2.83Å; V171-G174 PolarHBondContact O-N 3.31Å; V171-G174 VanDerWaalsContact O-N 3.15Å
172V90.5Very high85.9Confident0 Ų026.9 Ų26.90%013%0.131CC..Hα-helixtrans-68-24.8179.9173.70000111.3F149 L153 V168 L170 G174 Y175 G176 R338F149-V172 HydrophobicContact CZ-CG2 4.46Å; L153-V172 HydrophobicContact CD1-CG2 3.67Å; L153-V172 HydrophobicContact CD2-CG2 4.22Å; V168-V172 HydrophobicContact CG1-CG2 4.31Å; V168-V172 WeakPolarHBondContact O-CB 3.14Å; V168-V172 WeakPolarHBondContact O-CG2 3.39Å; V168-V172 PolarHBondContact O-N 3.43Å; L170-V172 VanDerWaalsContact C-N 3.34Å; L170-V172 PolarHBondContact O-N 3.49Å; V172-G174 PolarHBondContact O-N 3.15Å; V172-Y175 WeakPolarHBondContact O-CB 3.43Å; V172-Y175 PolarHBondContact O-N 3.27Å; V172-G176 PolarHBondContact O-N 3.02Å; V172-R338 HydrophobicContact CG1-CG 4.3Å; V172-R338 VanDerWaalsContact O-CD 3.23Å; V172-R338 WeakPolarHBondContact O-CD 3.27Å
173S91.1Very high86.7Confident4 Ų418.7 Ų18.73%0.0289%0.093CC..Hα-helixtrans-61.3-30.1173.179.20000113.1Y29 G169 L170 V171 Y175 G176 M177Y29-S173 WeakPolarHBondContact CE2-OG 3.47Å; G169-S173 VanDerWaalsContact O-CB 3.28Å; G169-S173 WeakPolarHBondContact O-CB 3.26Å; G169-S173 PolarHBondContact O-N 3.23Å; L170-S173 WeakPolarHBondContact O-CB 3.29Å; L170-S173 PolarHBondContact O-N 3.41Å; L170-S173 VanDerWaalsContact O-N 3.15Å; L170-S173 PolarHBondContact O-OG 2.79Å; V171-S173 PolarHBondContact O-N 2.83Å; S173-Y175 PolarHBondContact O-N 3.3Å; S173-G176 WeakPolarHBondContact O-CA 3.08Å; S173-G176 PolarHBondContact O-N 3.02Å; S173-M177 PolarHBondContact O-N 3.5Å
174G91.2Very high87.6Confident0 Ų018.5 Ų18.50%010%0.097CC..Hα-helixtrans-55.5-42.1170.800000111.5Y29 L33 V171 V172 G176 M177 G178Y29-G174 VanDerWaalsContact CE2-CA 3.4Å; Y29-G174 VanDerWaalsContact CE2-N 3.34Å; L33-G174 VanDerWaalsContact CA-O 3.28Å; L33-G174 WeakPolarHBondContact CA-O 3.28Å; L33-G174 WeakPolarHBondContact CD1-O 3.33Å; V171-G174 PolarHBondContact O-N 3.31Å; V171-G174 VanDerWaalsContact O-N 3.15Å; V172-G174 PolarHBondContact O-N 3.15Å; G174-G176 VanDerWaalsContact C-N 3.31Å; G174-G176 PolarHBondContact O-N 3.4Å; G174-M177 PolarHBondContact O-N 3.16Å; G174-G178 PolarHBondContact O-N 3.41Å
175Y90Very high88.5Confident6 Ų617.3 Ų17.32%0.02410%0.096CC..Hα-helixtrans-59.1-39.7175.1-167.7-102000112.7H32 Y35 G36 L38 Y39 F149 V172 S173H32-Y175 WeakPolarHBondContact O-CA 3.48Å; H32-Y175 PolarHBondContact O-N 2.99Å; Y35-Y175 VanDerWaalsContact C-CD2 3.45Å; Y35-Y175 WeakPolarHBondContact O-CE2 3.34Å; G36-Y175 WeakPolarHBondContact CA-O 3.12Å; G36-Y175 VanDerWaalsContact N-CD2 3.34Å; L38-Y175 WeakPolarHBondContact CD2-OH 3.44Å; Y39-Y175 HydrophobicContact CD2-CD1 4.1Å; Y39-Y175 AromaticContact CD2-CE1 3.99Å; Y39-Y175 HydrophobicContact CD2-CE1 3.99Å; Y39-Y175 WeakPolarHBondContact CD2-O 3.41Å; Y39-Y175 AromaticContact CE2-CD1 3.33Å; Y39-Y175 HydrophobicContact CE2-CD1 3.33Å; Y39-Y175 AromaticContact CE2-CE1 3.22Å; Y39-Y175 HydrophobicContact CE2-CE1 3.22Å; Y39-Y175 HydrophobicContact CE2-CG 4.41Å; Y39-Y175 AromaticContact CZ-CE1 3.66Å; F149-Y175 AromaticContact CE2-CD2 3.98Å; F149-Y175 HydrophobicContact CE2-CD2 3.98Å; F149-Y175 HydrophobicContact CE2-CE2 4.19Å; F149-Y175 HydrophobicContact CE2-CG 4.23Å; V172-Y175 WeakPolarHBondContact O-CB 3.43Å; V172-Y175 PolarHBondContact O-N 3.27Å; S173-Y175 PolarHBondContact O-N 3.3Å
176G86.8Confident89.4Confident0 Ų017.2 Ų17.20%010%0.095CC..Hα-helixtrans-68.1-33.6174.300000113.5V172 S173 G174 G178V172-G176 PolarHBondContact O-N 3.02Å; S173-G176 WeakPolarHBondContact O-CA 3.08Å; S173-G176 PolarHBondContact O-N 3.02Å; G174-G176 VanDerWaalsContact C-N 3.31Å; G174-G176 PolarHBondContact O-N 3.4Å; G176-G178 VanDerWaalsContact C-N 3.35Å
177M90.6Very high90.1Very high56 Ų5617 Ų1728%0.2769%0.094SC..Hα-helixtrans-79.2-10.5-179.2-69.2-170.852.400114.3Y29 L33 S173 G174 S179 L180 V181 A335Y29-M177 WeakPolarHBondContact OH-CE 3.47Å; Y29-M177 PolarHBondContact OH-SD 2.75Å; L33-M177 HydrophobicContact CD1-CB 3.77Å; S173-M177 PolarHBondContact O-N 3.5Å; G174-M177 PolarHBondContact O-N 3.16Å; M177-S179 VanDerWaalsContact C-N 3.32Å; M177-S179 PolarHBondContact O-N 2.81Å; M177-L180 VanDerWaalsContact O-CB 3.27Å; M177-L180 WeakPolarHBondContact O-CB 3.47Å; M177-L180 PolarHBondContact O-N 3.3Å; M177-V181 PolarHBondContact O-N 3.43Å; M177-A335 HydrophobicContact CB-CB 4.49Å; M177-A335 HydrophobicContact CG-CB 3.28Å; M177-A335 HydrophobicContact SD-CB 4.12Å
178G87.7Confident90.6Very high0 Ų024 Ų240%012%0.124CC..Hα-helixtrans-55.7-46.3-178.700000112.6G174 G176 L180 V181 F182G174-G178 PolarHBondContact O-N 3.41Å; G176-G178 VanDerWaalsContact C-N 3.35Å; G178-L180 PolarHBondContact O-N 3Å; G178-V181 PolarHBondContact O-N 3.34Å; G178-V181 VanDerWaalsContact O-N 3.16Å; G178-F182 WeakPolarHBondContact O-CD2 3.23Å; G178-F182 PolarHBondContact O-N 3.17Å
179S86.6Confident91.1Very high3 Ų326.4 Ų26.42%0.02114%0.137CC..Hα-helixtrans-61.8-30.6177-172.50000113.2M177 V181 S183M177-S179 VanDerWaalsContact C-N 3.32Å; M177-S179 PolarHBondContact O-N 2.81Å; S179-V181 VanDerWaalsContact C-N 3.29Å; S179-V181 PolarHBondContact O-N 2.94Å; S179-S183 WeakPolarHBondContact O-CB 3.07Å; S179-S183 PolarHBondContact O-N 3.18Å; S179-S183 PolarHBondContact O-OG 3.2Å; S179-S183 PolarHBondContact OG-OG 2.94Å; S179-S183 VanDerWaalsContact OG-OG 3.11Å
180L92.4Very high91.5Very high55 Ų5526.5 Ų26.529%0.28814%0.137SC..Hα-helixtrans-64.2-35.9177.3-179.4140.4000112.4M177 G178 P184 T328 A331 V332M177-L180 VanDerWaalsContact O-CB 3.27Å; M177-L180 WeakPolarHBondContact O-CB 3.47Å; M177-L180 PolarHBondContact O-N 3.3Å; G178-L180 PolarHBondContact O-N 3Å; L180-P184 VanDerWaalsContact O-CD 3.31Å; L180-P184 WeakPolarHBondContact O-CD 3.21Å; L180-P184 WeakPolarHBondContact O-CG 3.28Å; L180-T328 HydrophobicContact CB-CG2 4.45Å; L180-T328 HydrophobicContact CG-CG2 4.09Å; L180-A331 HydrophobicContact CB-CB 4Å; L180-V332 HydrophobicContact CD1-CG2 3.32Å
181V91.6Very high91.7Very high51 Ų5123.9 Ų23.931%0.30912%0.123SC..Hα-helixtrans-82.9-49.4177.7179.90000110.3L33 M177 G178 S179 I185L33-V181 HydrophobicContact CD1-CG2 4.31Å; M177-V181 PolarHBondContact O-N 3.43Å; G178-V181 PolarHBondContact O-N 3.34Å; G178-V181 VanDerWaalsContact O-N 3.16Å; S179-V181 VanDerWaalsContact C-N 3.29Å; S179-V181 PolarHBondContact O-N 2.94Å; V181-I185 HydrophobicContact CG1-CD1 4.04Å; V181-I185 WeakPolarHBondContact O-CD1 3.26Å; V181-I185 VanDerWaalsContact O-CG1 3.24Å; V181-I185 WeakPolarHBondContact O-CG1 3.33Å
182F91.9Very high91.9Very high1 Ų125.4 Ų25.40%0.00413%0.134CC..Hα-helixtrans-80.6-36.4-168.3-61-60.8000113.8Y37 G178 I185 Q186 I220 I223 L224Y37-F182 HydrophobicContact CD2-CB 4.04Å; Y37-F182 HydrophobicContact CD2-CD1 4.33Å; Y37-F182 AromaticContact CD2-CD2 3.83Å; Y37-F182 HydrophobicContact CD2-CD2 3.83Å; Y37-F182 HydrophobicContact CD2-CE2 4.45Å; Y37-F182 AromaticContact CD2-CG 3.8Å; Y37-F182 HydrophobicContact CD2-CG 3.8Å; Y37-F182 HydrophobicContact CE2-CB 4.48Å; Y37-F182 HydrophobicContact CG-CD2 4.42Å; G178-F182 WeakPolarHBondContact O-CD2 3.23Å; G178-F182 PolarHBondContact O-N 3.17Å; F182-I185 PolarHBondContact O-N 3.07Å; F182-Q186 WeakPolarHBondContact O-CB 3.38Å; F182-Q186 VanDerWaalsContact O-CD 3.25Å; F182-Q186 WeakPolarHBondContact O-CG 3.48Å; F182-Q186 PolarHBondContact O-N 3.11Å; F182-I220 HydrophobicContact CD1-CD1 4.12Å; F182-I220 HydrophobicContact CD1-CG2 4.17Å; F182-I220 HydrophobicContact CE1-CG2 4.48Å; F182-I223 HydrophobicContact CE1-CG2 3.83Å; F182-L224 HydrophobicContact CE1-CD2 3.85Å; F182-L224 HydrophobicContact CE1-CG 4.25Å; F182-L224 HydrophobicContact CE2-CD2 3.74Å; F182-L224 HydrophobicContact CZ-CD2 3.29Å; F182-L224 HydrophobicContact CZ-CG 4.17Å
183S92.5Very high91.9Very high0 Ų030.9 Ų30.90%016%0.163CC..Hα-helixtrans-65.2-46.2-175-65.30000114.2N43 S179 I185 Q186 T187N43-S183 WeakPolarHBondContact CB-OG 3.49Å; N43-S183 PolarHBondContact ND2-O 3.15Å; N43-S183 VanDerWaalsContact ND2-O 3.08Å; S179-S183 WeakPolarHBondContact O-CB 3.07Å; S179-S183 PolarHBondContact O-N 3.18Å; S179-S183 PolarHBondContact O-OG 3.2Å; S179-S183 PolarHBondContact OG-OG 2.94Å; S179-S183 VanDerWaalsContact OG-OG 3.11Å; S183-I185 VanDerWaalsContact C-N 3.33Å; S183-I185 PolarHBondContact O-N 3.35Å; S183-Q186 PolarHBondContact O-N 3.4Å; S183-T187 PolarHBondContact O-N 3.46Å; S183-T187 PolarHBondContact O-OG1 3.03Å
184P92.8Very high92Very high54 Ų5432.6 Ų32.635%0.35117%0.171SC..Hα-helixtrans-61.3-40.8174.4-24.435.3000112.7L180 T187 F188 T328L180-P184 VanDerWaalsContact O-CD 3.31Å; L180-P184 WeakPolarHBondContact O-CD 3.21Å; L180-P184 WeakPolarHBondContact O-CG 3.28Å; P184-T187 PolarHBondContact O-N 3.08Å; P184-F188 VanDerWaalsContact O-CB 3.26Å; P184-F188 WeakPolarHBondContact O-CB 3.44Å; P184-F188 PolarHBondContact O-N 3.47Å; P184-T328 HydrophobicContact CG-CG2 3.87Å
185I93.5Very high92.1Very high56 Ų5634.6 Ų34.629%0.28718%0.184SC..Hα-helixtrans-61.9-46.3177.8-65173.1000110.2V181 F182 S183 F188 L189 I220 I223V181-I185 HydrophobicContact CG1-CD1 4.04Å; V181-I185 WeakPolarHBondContact O-CD1 3.26Å; V181-I185 VanDerWaalsContact O-CG1 3.24Å; V181-I185 WeakPolarHBondContact O-CG1 3.33Å; F182-I185 PolarHBondContact O-N 3.07Å; S183-I185 VanDerWaalsContact C-N 3.33Å; S183-I185 PolarHBondContact O-N 3.35Å; I185-F188 PolarHBondContact O-N 3.13Å; I185-L189 HydrophobicContact CG2-CD1 3.79Å; I185-L189 HydrophobicContact CG2-CG 4.4Å; I185-L189 WeakPolarHBondContact O-CB 3.21Å; I185-L189 VanDerWaalsContact O-CG 3.22Å; I185-L189 WeakPolarHBondContact O-CG 3.37Å; I185-L189 PolarHBondContact O-N 3.26Å; I185-I220 HydrophobicContact CB-CD1 4.48Å; I185-I220 HydrophobicContact CG2-CD1 3.86Å; I185-I223 HydrophobicContact CD1-CD1 4.49Å
186Q94.1Very high92.1Very high0 Ų038 Ų380%021%0.207CC..Hα-helixtrans-58.9-51.2177.9-71.1158.8-4.300111.8S40 N43 M44 F182 S183 F188 L189 I190 V216 I220S40-Q186 PolarHBondContact OG-NE2 3.27Å; N43-Q186 PolarHBondContact ND2-OE1 2.92Å; M44-Q186 HydrophobicContact CG-CG 4.14Å; M44-Q186 HydrophobicContact SD-CB 3.85Å; M44-Q186 HydrophobicContact SD-CG 3.5Å; M44-Q186 VanDerWaalsContact SD-CG 3.5Å; F182-Q186 WeakPolarHBondContact O-CB 3.38Å; F182-Q186 VanDerWaalsContact O-CD 3.25Å; F182-Q186 WeakPolarHBondContact O-CG 3.48Å; F182-Q186 PolarHBondContact O-N 3.11Å; S183-Q186 PolarHBondContact O-N 3.4Å; Q186-F188 VanDerWaalsContact C-N 3.34Å; Q186-F188 PolarHBondContact O-N 3.39Å; Q186-L189 PolarHBondContact O-N 3.07Å; Q186-I190 WeakPolarHBondContact O-CB 3.34Å; Q186-I190 VanDerWaalsContact O-CG1 3.25Å; Q186-I190 WeakPolarHBondContact O-CG1 2.98Å; Q186-I190 PolarHBondContact O-N 3.12Å; Q186-V216 HydrophobicContact CG-CG1 4.33Å; Q186-I220 HydrophobicContact CG-CD1 4.17Å; Q186-I220 HydrophobicContact CG-CG1 4.34Å
187T93.8Very high92.3Very high7 Ų738.2 Ų38.24%0.04321%0.208CC..Hα-helixtrans-67-36.7-178-61.70000111.7N43 Y47 S183 P184 L189 I190 N191 T324N43-T187 PolarHBondContact ND2-OG1 3.46Å; N43-T187 PolarHBondContact OD1-OG1 2.88Å; Y47-T187 PolarHBondContact OH-OG1 3.35Å; S183-T187 PolarHBondContact O-N 3.46Å; S183-T187 PolarHBondContact O-OG1 3.03Å; P184-T187 PolarHBondContact O-N 3.08Å; T187-L189 VanDerWaalsContact C-N 3.34Å; T187-L189 PolarHBondContact O-N 3.02Å; T187-I190 PolarHBondContact O-N 3.2Å; T187-N191 CarbonylContact O-C 3.56Å; T187-N191 VanDerWaalsContact O-C 3.23Å; T187-N191 WeakPolarHBondContact O-CA 3.39Å; T187-N191 PolarHBondContact O-N 3.41Å; T187-T324 HydrophobicContact CG2-CG2 4.22Å; T187-T324 WeakPolarHBondContact OG1-CG2 3.09Å; T187-T324 PolarHBondContact OG1-OG1 2.96Å
188F94.6Very high92.2Very high151 Ų15137.9 Ų37.966%0.66221%0.207SC*.Hα-helixtrans-63-40.1174.2179.9-100.9000112.4P184 I185 Q186 P192P184-F188 VanDerWaalsContact O-CB 3.26Å; P184-F188 WeakPolarHBondContact O-CB 3.44Å; P184-F188 PolarHBondContact O-N 3.47Å; I185-F188 PolarHBondContact O-N 3.13Å; Q186-F188 VanDerWaalsContact C-N 3.34Å; Q186-F188 PolarHBondContact O-N 3.39Å; F188-P192 WeakPolarHBondContact O-CB 3.48Å
189L94.6Very high92.2Very high55 Ų5543.4 Ų43.429%0.28824%0.237SC..Hα-helixtrans-74.3-36.8178.7-67.8172.6000112.8I185 Q186 T187 V216 V219I185-L189 HydrophobicContact CG2-CD1 3.79Å; I185-L189 HydrophobicContact CG2-CG 4.4Å; I185-L189 WeakPolarHBondContact O-CB 3.21Å; I185-L189 VanDerWaalsContact O-CG 3.22Å; I185-L189 WeakPolarHBondContact O-CG 3.37Å; I185-L189 PolarHBondContact O-N 3.26Å; Q186-L189 PolarHBondContact O-N 3.07Å; T187-L189 VanDerWaalsContact C-N 3.34Å; T187-L189 PolarHBondContact O-N 3.02Å; L189-V216 HydrophobicContact CB-CG2 3.63Å; L189-V216 HydrophobicContact CD1-CG1 4.31Å; L189-V216 HydrophobicContact CD1-CG2 4.33Å; L189-V219 HydrophobicContact CD1-CB 4.19Å; L189-V219 HydrophobicContact CD1-CG1 3.87Å
190I95.2Very high92.2Very high1 Ų149.5 Ų49.51%0.00527%0.273CS..Hα-helixtrans-87.1-53-175.3-61.9169.4000111.6M44 Y47 Q186 T187 P192 I209 R212 L213 V216M44-I190 HydrophobicContact CE-CD1 4.33Å; M44-I190 HydrophobicContact SD-CD1 3.88Å; Y47-I190 HydrophobicContact CD1-CG2 3.51Å; Y47-I190 HydrophobicContact CD2-CD1 3.6Å; Y47-I190 HydrophobicContact CD2-CG2 4.3Å; Y47-I190 HydrophobicContact CE1-CB 4.5Å; Y47-I190 HydrophobicContact CE1-CG2 3.76Å; Y47-I190 HydrophobicContact CE2-CD1 4.06Å; Y47-I190 HydrophobicContact CG-CD1 3.94Å; Y47-I190 HydrophobicContact CG-CG2 3.82Å; Q186-I190 WeakPolarHBondContact O-CB 3.34Å; Q186-I190 VanDerWaalsContact O-CG1 3.25Å; Q186-I190 WeakPolarHBondContact O-CG1 2.98Å; Q186-I190 PolarHBondContact O-N 3.12Å; T187-I190 PolarHBondContact O-N 3.2Å; I190-P192 VanDerWaalsContact C-CD 3.49Å; I190-P192 WeakPolarHBondContact O-CD 3.27Å; I190-I209 HydrophobicContact CG2-CG2 3.47Å; I190-I209 VanDerWaalsContact CG2-CG2 3.47Å; I190-R212 WeakPolarHBondContact O-CD 3.25Å; I190-L213 HydrophobicContact CD1-CD1 3.75Å; I190-V216 HydrophobicContact CD1-CB 4.44Å; I190-V216 HydrophobicContact CD1-CG1 4.26Å; I190-V216 HydrophobicContact CD1-CG2 4.21Å; I190-V216 HydrophobicContact CG1-CB 4.26Å; I190-V216 HydrophobicContact CG1-CG1 4.37Å; I190-V216 HydrophobicContact CG1-CG2 3.51Å
191N94.4Very high92Very high1 Ų150 Ų501%0.00528%0.279CS..  trans-12863-172.7-170.412.6000112.6Y47 T187 N193 N194 V195 I209 D320Y47-N191 HydrophobicContact CE1-CB 4.32Å; T187-N191 CarbonylContact O-C 3.56Å; T187-N191 VanDerWaalsContact O-C 3.23Å; T187-N191 WeakPolarHBondContact O-CA 3.39Å; T187-N191 PolarHBondContact O-N 3.41Å; N191-N193 PolarHBondContact O-N 3.35Å; N191-N194 PolarHBondContact O-N 3.43Å; N191-N194 PolarHBondContact OD1-N 2.93Å; N191-V195 PolarHBondContact ND2-N 2.93Å; N191-V195 PolarHBondContact ND2-O 3.23Å; N191-V195 PolarHBondContact OD1-N 3.27Å; N191-I209 HydrophobicContact CB-CG2 4.18Å; N191-D320 PolarHBondContact ND2-OD2 3.04Å
192P93.2Very high91.8Very high33 Ų3351.6 Ų51.621%0.21428%0.28CS..THydrogen-bonded Turntrans-61.9-31.5-177.922.7-31.7000113.2F188 I190 N194 K321F188-P192 WeakPolarHBondContact O-CB 3.48Å; I190-P192 VanDerWaalsContact C-CD 3.49Å; I190-P192 WeakPolarHBondContact O-CD 3.27Å; P192-N194 VanDerWaalsContact C-N 3.3Å; P192-N194 PolarHBondContact O-N 3.34Å; P192-K321 WeakPolarHBondContact O-CE 3.3Å; P192-K321 PolarHBondContact O-NZ 3.12Å
193N92.2Very high91.6Very high114 Ų11453.6 Ų53.661%0.6129%0.289SS*.THydrogen-bonded Turntrans-84.5-0-176.6-65.3-24.2000113.7N191 V195N191-N193 PolarHBondContact O-N 3.35Å; N193-V195 VanDerWaalsContact C-N 3.27Å; N193-V195 HydrophobicContact CB-CG2 4.17Å; N193-V195 PolarHBondContact O-N 3.15Å
194N92.5Very high91.6Very high40 Ų4053.8 Ų53.821%0.21429%0.289CS..  trans53.741.7-176.2-158.332.6000113.6N191 P192 D319 D320 K321N191-N194 PolarHBondContact O-N 3.43Å; N191-N194 PolarHBondContact OD1-N 2.93Å; P192-N194 VanDerWaalsContact C-N 3.3Å; P192-N194 PolarHBondContact O-N 3.34Å; N194-D319 PolarHBondContact ND2-OD1 3.46Å; N194-D319 PolarHBondContact OD1-OD1 2.76Å; N194-D320 WeakPolarHBondContact OD1-CB 3.31Å; N194-D320 PolarHBondContact OD1-N 3.1Å; N194-K321 HydrophobicContact CB-CD 3.63Å; N194-K321 HydrophobicContact CB-CG 3.89Å; N194-K321 WeakPolarHBondContact OD1-CB 3.29Å; N194-K321 WeakPolarHBondContact OD1-CG 3.48Å; N194-K321 PolarHBondContact OD1-N 3.3Å
195V92.3Very high91.5Very high43 Ų4354.2 Ų54.226%0.26129%0.289SS..PPolyproline II helixtrans-61.5127.2175.6-1790000107.8N191 N193 I209N191-V195 PolarHBondContact ND2-N 2.93Å; N191-V195 PolarHBondContact ND2-O 3.23Å; N191-V195 PolarHBondContact OD1-N 3.27Å; N193-V195 VanDerWaalsContact C-N 3.27Å; N193-V195 HydrophobicContact CB-CG2 4.17Å; N193-V195 PolarHBondContact O-N 3.15Å; V195-I209 HydrophobicContact CB-CD1 3.49Å; V195-I209 VanDerWaalsContact CB-CD1 3.49Å; V195-I209 HydrophobicContact CB-CG1 4.46Å; V195-I209 HydrophobicContact CG1-CD1 3.84Å; V195-I209 HydrophobicContact CG2-CD1 3.98Å; V195-I209 HydrophobicContact CG2-CG1 4.46Å
196P90.4Very high91.4Very high77 Ų7753.8 Ų53.850%0.529%0.287SS..PPolyproline II helixtrans-70157.6-179.629.5-34.9000111.1S318P196-S318 WeakPolarHBondContact CA-O 3.41Å
197V90.6Very high91.3Very high4 Ų457 Ų572%0.02431%0.308CS..PPolyproline II helixtrans-63.4155.8169.8-64.40000111.1N199 F204 Q314V197-N199 PolarHBondContact O-N 3.45Å; V197-F204 HydrophobicContact CG1-CD1 3.84Å; V197-F204 HydrophobicContact CG1-CD2 4.24Å; V197-F204 HydrophobicContact CG1-CE1 3.57Å; V197-F204 HydrophobicContact CG1-CE2 4.02Å; V197-F204 HydrophobicContact CG1-CG 4.15Å; V197-F204 HydrophobicContact CG1-CZ 3.64Å; V197-Q314 HydrophobicContact CG1-CG 4.34Å
198N89.7Confident91.3Very high50 Ų5061.9 Ų61.927%0.26733%0.331SS..PPolyproline II helixtrans-58.2130.9173.5179.5-45.3000110.6V200 T201 R202 Q203 D205N198-V200 PolarHBondContact O-N 2.98Å; N198-V200 WeakPolarHBondContact OD1-CB 2.95Å; N198-V200 PolarHBondContact OD1-N 2.89Å; N198-T201 WeakPolarHBondContact CB-OG1 2.97Å; N198-T201 PolarHBondContact OD1-N 2.9Å; N198-R202 WeakPolarHBondContact O-CA 3.28Å; N198-R202 PolarHBondContact O-N 3.37Å; N198-Q203 PolarHBondContact N-O 3.37Å; N198-D205 WeakPolarHBondContact CB-OD2 3.38Å; N198-D205 PolarHBondContact ND2-OD2 3.32Å
199N87.1Confident91.2Very high116 Ų11655 Ų5562%0.6230%0.301SS*.THydrogen-bonded Turntrans-64.2-23.8-174.4-71.9-27.8000114V197 R202V197-N199 PolarHBondContact O-N 3.45Å; N199-R202 PolarHBondContact O-NE 3.16Å; N199-R202 VanDerWaalsContact O-NE 3.15Å
200V87Confident91.2Very high130 Ų13052.4 Ų52.479%0.78829%0.287SS*.THydrogen-bonded Turntrans-91.7-58-179.4-176.50000110.7N198 R202N198-V200 PolarHBondContact O-N 2.98Å; N198-V200 WeakPolarHBondContact OD1-CB 2.95Å; N198-V200 PolarHBondContact OD1-N 2.89Å; V200-R202 VanDerWaalsContact C-N 3.31Å; V200-R202 PolarHBondContact O-N 3.36Å
201T87Confident91.1Very high66 Ų6656.6 Ų56.641%0.40531%0.309SS..THydrogen-bonded Turntrans-78.4-18.4-175.163.70000112.9N198 Q203N198-T201 WeakPolarHBondContact CB-OG1 2.97Å; N198-T201 PolarHBondContact OD1-N 2.9Å; T201-Q203 WeakPolarHBondContact O-CG 3.11Å; T201-Q203 PolarHBondContact O-N 2.88Å; T201-Q203 PolarHBondContact OG1-N 3.02Å
202R88.3Confident91.1Very high85 Ų8560.3 Ų60.332%0.32132%0.323SS..  trans55.530.2-173.2-58.5-63.3-175.2147.93.2113.1N198 N199 V200 S318N198-R202 WeakPolarHBondContact O-CA 3.28Å; N198-R202 PolarHBondContact O-N 3.37Å; N199-R202 PolarHBondContact O-NE 3.16Å; N199-R202 VanDerWaalsContact O-NE 3.15Å; V200-R202 VanDerWaalsContact C-N 3.31Å; V200-R202 PolarHBondContact O-N 3.36Å; R202-S318 PolarHBondContact NH1-OG 2.8Å
203Q88.7Confident91.2Very high43 Ų4358.8 Ų58.820%0.20131%0.313CS..SBendtrans-123161.4179.9-68.1166.138.500110.6I53 V62 N198 T201I53-Q203 VanDerWaalsContact CD1-OE1 3.28Å; V62-Q203 HydrophobicContact CG2-CG 4.25Å; N198-Q203 PolarHBondContact N-O 3.37Å; T201-Q203 WeakPolarHBondContact O-CG 3.11Å; T201-Q203 PolarHBondContact O-N 2.88Å; T201-Q203 PolarHBondContact OG1-N 3.02Å
204F92.1Very high91.2Very high3 Ų353.5 Ų53.51%0.01329%0.285CS..  trans-79.7118.5166.2-65.1-68.4000109.1P46 Y47 G50 V197 I209 L210 D320P46-F204 HydrophobicContact CB-CD2 4.23Å; P46-F204 HydrophobicContact CB-CE2 4.09Å; Y47-F204 AromaticContact CD1-CD2 3.48Å; Y47-F204 HydrophobicContact CD1-CD2 3.48Å; Y47-F204 VanDerWaalsContact CD1-CD2 3.48Å; Y47-F204 AromaticContact CD1-CE2 3.56Å; Y47-F204 HydrophobicContact CD1-CE2 3.56Å; Y47-F204 HydrophobicContact CD1-CG 4.13Å; Y47-F204 HydrophobicContact CD1-CZ 4.31Å; Y47-F204 AromaticContact CE1-CD2 3.69Å; Y47-F204 HydrophobicContact CE1-CD2 3.69Å; Y47-F204 HydrophobicContact CE1-CE1 4.28Å; Y47-F204 AromaticContact CE1-CE2 3.27Å; Y47-F204 HydrophobicContact CE1-CE2 3.27Å; Y47-F204 HydrophobicContact CE1-CG 4.33Å; Y47-F204 AromaticContact CE1-CZ 3.64Å; Y47-F204 HydrophobicContact CE1-CZ 3.64Å; Y47-F204 HydrophobicContact CG-CD2 4.42Å; G50-F204 VanDerWaalsContact CA-O 3.29Å; G50-F204 WeakPolarHBondContact CA-O 3.23Å; V197-F204 HydrophobicContact CG1-CD1 3.84Å; V197-F204 HydrophobicContact CG1-CD2 4.24Å; V197-F204 HydrophobicContact CG1-CE1 3.57Å; V197-F204 HydrophobicContact CG1-CE2 4.02Å; V197-F204 HydrophobicContact CG1-CG 4.15Å; V197-F204 HydrophobicContact CG1-CZ 3.64Å; F204-I209 HydrophobicContact CD1-CD1 4.31Å; F204-L210 HydrophobicContact CB-CD2 4.08Å; F204-D320 HydrophobicContact CE1-CB 4.33Å; F204-D320 HydrophobicContact CZ-CB 3.91Å; F204-D320 VanDerWaalsContact CZ-CG 3.43Å; F204-D320 WeakPolarHBondContact CZ-OD1 3.4Å
205D90.4Very high91.2Very high64 Ų6456.8 Ų56.834%0.34230%0.299SS..  trans-121.5-8.4177.257.7-10.5000112.8N198 P207N198-D205 WeakPolarHBondContact CB-OD2 3.38Å; N198-D205 PolarHBondContact ND2-OD2 3.32Å; D205-P207 VanDerWaalsContact O-CD 3.23Å; D205-P207 WeakPolarHBondContact O-CD 3.22Å
206D92Very high91.3Very high46 Ų4655 Ų5525%0.24629%0.288CS..  trans-61.3114.6177.1-173.4-22.2000111.3E208 I209 L210D206-E208 PolarHBondContact O-N 3.41Å; D206-E208 WeakPolarHBondContact OD1-CB 3.19Å; D206-E208 PolarHBondContact OD1-N 2.94Å; D206-I209 HydrophobicContact CB-CB 4.4Å; D206-I209 HydrophobicContact CB-CD1 3.68Å; D206-I209 HydrophobicContact CB-CG1 3.99Å; D206-I209 PolarHBondContact O-N 3.49Å; D206-L210 WeakPolarHBondContact O-CG 3.26Å; D206-L210 PolarHBondContact O-N 3.36Å; D206-L210 VanDerWaalsContact O-N 3.14Å
207P92Very high91.3Very high68 Ų6851.3 Ų51.344%0.44226%0.264SS..Hα-helixtrans-59.2-29.5-179.9-24.635.4000113.9F55 D205 N211F55-P207 HydrophobicContact CZ-CB 4.05Å; D205-P207 VanDerWaalsContact O-CD 3.23Å; D205-P207 WeakPolarHBondContact O-CD 3.22Å; P207-N211 VanDerWaalsContact O-CB 3.27Å; P207-N211 WeakPolarHBondContact O-CB 3.42Å; P207-N211 VanDerWaalsContact O-CG 3.27Å; P207-N211 PolarHBondContact O-N 3.13Å; P207-N211 PolarHBondContact O-ND2 3.28Å
208E92.1Very high91.4Very high110 Ų11054 Ų5451%0.51428%0.278SS..Hα-helixtrans-67.5-39.4-178.7-165.2-170.2149.800111.5D206 R212D206-E208 PolarHBondContact O-N 3.41Å; D206-E208 WeakPolarHBondContact OD1-CB 3.19Å; D206-E208 PolarHBondContact OD1-N 2.94Å; E208-R212 WeakPolarHBondContact O-CD 3.45Å; E208-R212 WeakPolarHBondContact O-CG 3.38Å; E208-R212 PolarHBondContact O-NE 3.21Å; E208-R212 IonicContact OE1-CZ 2.66Å; E208-R212 IonicContact OE1-NH2 3.79Å; E208-R212 PolarHBondContact OE1-NH2 3.28Å
209I93.5Very high91.5Very high6 Ų654.7 Ų54.73%0.03128%0.284CS..Hα-helixtrans-70.9-49177.4-58.9172.6000109.6Y47 I190 N191 V195 F204 D206 N211 R212Y47-I209 HydrophobicContact CD1-CG2 4.43Å; I190-I209 HydrophobicContact CG2-CG2 3.47Å; I190-I209 VanDerWaalsContact CG2-CG2 3.47Å; N191-I209 HydrophobicContact CB-CG2 4.18Å; V195-I209 HydrophobicContact CB-CD1 3.49Å; V195-I209 VanDerWaalsContact CB-CD1 3.49Å; V195-I209 HydrophobicContact CB-CG1 4.46Å; V195-I209 HydrophobicContact CG1-CD1 3.84Å; V195-I209 HydrophobicContact CG2-CD1 3.98Å; V195-I209 HydrophobicContact CG2-CG1 4.46Å; F204-I209 HydrophobicContact CD1-CD1 4.31Å; D206-I209 HydrophobicContact CB-CB 4.4Å; D206-I209 HydrophobicContact CB-CD1 3.68Å; D206-I209 HydrophobicContact CB-CG1 3.99Å; D206-I209 PolarHBondContact O-N 3.49Å; I209-N211 PolarHBondContact O-N 2.93Å; I209-R212 WeakPolarHBondContact O-CB 3.46Å; I209-R212 PolarHBondContact O-N 3.24Å
210L94.2Very high91.7Very high0 Ų049.1 Ų49.10%025%0.254CS..Hα-helixtrans-68.6-36.5-172.4-64.1179.4000111.8Y51 T54 F55 F204 D206 R212 L213Y51-L210 HydrophobicContact CD2-CB 4.05Å; Y51-L210 WeakPolarHBondContact CD2-O 3.46Å; Y51-L210 WeakPolarHBondContact CE2-O 3.46Å; T54-L210 HydrophobicContact CG2-CD1 4.09Å; F55-L210 HydrophobicContact CD2-CB 4.31Å; F55-L210 HydrophobicContact CE2-CB 3.48Å; F55-L210 VanDerWaalsContact CE2-CB 3.48Å; F55-L210 HydrophobicContact CE2-CD1 4.2Å; F55-L210 HydrophobicContact CZ-CB 4.26Å; F204-L210 HydrophobicContact CB-CD2 4.08Å; D206-L210 WeakPolarHBondContact O-CG 3.26Å; D206-L210 PolarHBondContact O-N 3.36Å; D206-L210 VanDerWaalsContact O-N 3.14Å; L210-R212 PolarHBondContact O-N 3.48Å; L210-R212 VanDerWaalsContact O-N 3.13Å; L210-L213 VanDerWaalsContact O-CB 3.25Å; L210-L213 WeakPolarHBondContact O-CB 3.45Å; L210-L213 PolarHBondContact O-N 2.96Å
211N94.1Very high91.7Very high89 Ų8943 Ų4348%0.47622%0.217SC..THydrogen-bonded Turntrans-63.3-18.9176.4-80.2-44.6000114.1P207 I209P207-N211 VanDerWaalsContact O-CB 3.27Å; P207-N211 WeakPolarHBondContact O-CB 3.42Å; P207-N211 VanDerWaalsContact O-CG 3.27Å; P207-N211 PolarHBondContact O-N 3.13Å; P207-N211 PolarHBondContact O-ND2 3.28Å; I209-N211 PolarHBondContact O-N 2.93Å
212R94.5Very high91.8Very high80 Ų8043.6 Ų43.630%0.30222%0.22SC..THydrogen-bonded Turntrans-78.5-24.2175.3-62.1165.5-175-135.86112.3I190 E208 I209 L210 H215 V216I190-R212 WeakPolarHBondContact O-CD 3.25Å; E208-R212 WeakPolarHBondContact O-CD 3.45Å; E208-R212 WeakPolarHBondContact O-CG 3.38Å; E208-R212 PolarHBondContact O-NE 3.21Å; E208-R212 IonicContact OE1-CZ 2.66Å; E208-R212 IonicContact OE1-NH2 3.79Å; E208-R212 PolarHBondContact OE1-NH2 3.28Å; I209-R212 WeakPolarHBondContact O-CB 3.46Å; I209-R212 PolarHBondContact O-N 3.24Å; L210-R212 PolarHBondContact O-N 3.48Å; L210-R212 VanDerWaalsContact O-N 3.13Å; R212-H215 PolarHBondContact O-N 2.97Å; R212-V216 PolarHBondContact O-N 3.22Å
213L94.4Very high91.9Very high0 Ų042 Ų420%022%0.218CC..Hα-helixtrans-54.5-47.8-173.2176.769.8000114M44 I48 Y51 I126 I190 L210 H215 V216 F217M44-L213 HydrophobicContact CE-CD1 3.61Å; I48-L213 HydrophobicContact CG1-CD1 4.38Å; I48-L213 HydrophobicContact CG1-CD2 4.18Å; Y51-L213 HydrophobicContact CD2-CB 4.31Å; Y51-L213 HydrophobicContact CD2-CD2 4.14Å; Y51-L213 HydrophobicContact CG-CD2 3.91Å; I126-L213 HydrophobicContact CD1-CD2 4.3Å; I126-L213 HydrophobicContact CG1-CD2 4.15Å; I190-L213 HydrophobicContact CD1-CD1 3.75Å; L210-L213 VanDerWaalsContact O-CB 3.25Å; L210-L213 WeakPolarHBondContact O-CB 3.45Å; L210-L213 PolarHBondContact O-N 2.96Å; L213-H215 VanDerWaalsContact C-N 3.3Å; L213-H215 PolarHBondContact O-N 3.32Å; L213-V216 WeakPolarHBondContact O-CB 3.43Å; L213-V216 PolarHBondContact O-N 3.22Å; L213-F217 HydrophobicContact CD1-CE2 4.36Å; L213-F217 HydrophobicContact CD1-CZ 4.38Å; L213-F217 HydrophobicContact CD2-CE2 4.47Å; L213-F217 HydrophobicContact CG-CE2 4.07Å; L213-F217 HydrophobicContact CG-CZ 4.49Å
214P93.3Very high92Very high3 Ų340 Ų402%0.01921%0.209CC..Hα-helixtrans-56-45.1-178.5-26.836.2000112.4Y51 Y123 I126 V216 F217Y51-P214 HydrophobicContact CE2-CG 3.97Å; Y123-P214 HydrophobicContact CD2-CB 3.71Å; Y123-P214 WeakPolarHBondContact CD2-O 3.22Å; Y123-P214 HydrophobicContact CE2-CB 3.77Å; I126-P214 HydrophobicContact CG2-CB 4.16Å; I126-P214 HydrophobicContact CG2-CG 4.04Å; P214-V216 PolarHBondContact O-N 3.42Å; P214-F217 WeakPolarHBondContact O-CB 3.09Å; P214-F217 PolarHBondContact O-N 2.95Å; P214-F217 VanDerWaalsContact O-N 3.1Å
215H92.1Very high91.7Very high110 Ų11040 Ų4051%0.50921%0.209SC..Hα-helixtrans-61.8-30.1-179.4-64.691000112.8R212 L213 F217 L218 V219R212-H215 PolarHBondContact O-N 2.97Å; L213-H215 VanDerWaalsContact C-N 3.3Å; L213-H215 PolarHBondContact O-N 3.32Å; H215-F217 VanDerWaalsContact C-N 3.31Å; H215-F217 PolarHBondContact O-N 3.43Å; H215-L218 WeakPolarHBondContact O-CB 3.2Å; H215-L218 PolarHBondContact O-N 3.12Å; H215-L218 VanDerWaalsContact O-N 3.15Å; H215-V219 PolarHBondContact O-N 3.39Å; H215-V219 VanDerWaalsContact O-N 3.12Å
216V93.2Very high91.6Very high4 Ų440.2 Ų40.22%0.02421%0.212CC..Hα-helixtrans-65-35.2177.2179.70000111.8M44 Q186 L189 I190 R212 L213 P214 L218 V219 I220M44-V216 HydrophobicContact CE-CG1 4.46Å; Q186-V216 HydrophobicContact CG-CG1 4.33Å; L189-V216 HydrophobicContact CB-CG2 3.63Å; L189-V216 HydrophobicContact CD1-CG1 4.31Å; L189-V216 HydrophobicContact CD1-CG2 4.33Å; I190-V216 HydrophobicContact CD1-CB 4.44Å; I190-V216 HydrophobicContact CD1-CG1 4.26Å; I190-V216 HydrophobicContact CD1-CG2 4.21Å; I190-V216 HydrophobicContact CG1-CB 4.26Å; I190-V216 HydrophobicContact CG1-CG1 4.37Å; I190-V216 HydrophobicContact CG1-CG2 3.51Å; R212-V216 PolarHBondContact O-N 3.22Å; L213-V216 WeakPolarHBondContact O-CB 3.43Å; L213-V216 PolarHBondContact O-N 3.22Å; P214-V216 PolarHBondContact O-N 3.42Å; V216-L218 VanDerWaalsContact C-N 3.26Å; V216-L218 PolarHBondContact O-N 2.91Å; V216-V219 PolarHBondContact O-N 3.22Å; V216-I220 HydrophobicContact CG1-CG1 3.87Å; V216-I220 WeakPolarHBondContact O-CB 3.1Å; V216-I220 VanDerWaalsContact O-CG1 3.28Å; V216-I220 WeakPolarHBondContact O-CG1 3.31Å; V216-I220 PolarHBondContact O-N 2.87Å
217F91.9Very high91.5Very high0 Ų039.2 Ų39.20%021%0.208CC..Hα-helixtrans-60.1-37.7173.7-68.8-57.6000112.3M44 I48 V119 I126 Y137 L213 P214 H215 G221M44-F217 HydrophobicContact CE-CD1 4.29Å; M44-F217 HydrophobicContact CE-CE1 3.75Å; M44-F217 HydrophobicContact CE-CZ 4.15Å; I48-F217 HydrophobicContact CD1-CE1 4.17Å; I48-F217 HydrophobicContact CD1-CZ 3.87Å; I48-F217 HydrophobicContact CG1-CZ 3.92Å; V119-F217 HydrophobicContact CG1-CD1 4.15Å; V119-F217 WeakPolarHBondContact O-CB 3.45Å; I126-F217 HydrophobicContact CB-CE2 3.99Å; I126-F217 HydrophobicContact CG1-CE2 4.04Å; I126-F217 HydrophobicContact CG2-CD2 4.3Å; I126-F217 HydrophobicContact CG2-CE2 4.06Å; Y137-F217 HydrophobicContact CD2-CD1 4.24Å; Y137-F217 AromaticContact CD2-CE1 3.79Å; Y137-F217 HydrophobicContact CD2-CE1 3.79Å; Y137-F217 AromaticContact CE2-CD1 3.94Å; Y137-F217 HydrophobicContact CE2-CD1 3.94Å; Y137-F217 AromaticContact CE2-CE1 3.5Å; Y137-F217 HydrophobicContact CE2-CE1 3.5Å; Y137-F217 VanDerWaalsContact CE2-CE1 3.5Å; Y137-F217 AromaticContact CZ-CE1 3.96Å; L213-F217 HydrophobicContact CD1-CE2 4.36Å; L213-F217 HydrophobicContact CD1-CZ 4.38Å; L213-F217 HydrophobicContact CD2-CE2 4.47Å; L213-F217 HydrophobicContact CG-CE2 4.07Å; L213-F217 HydrophobicContact CG-CZ 4.49Å; P214-F217 WeakPolarHBondContact O-CB 3.09Å; P214-F217 PolarHBondContact O-N 2.95Å; P214-F217 VanDerWaalsContact O-N 3.1Å; H215-F217 VanDerWaalsContact C-N 3.31Å; H215-F217 PolarHBondContact O-N 3.43Å; F217-G221 PolarHBondContact O-N 2.84Å
218L91.1Very high91.4Very high61 Ų6136 Ų3632%0.31919%0.187SC..Hα-helixtrans-67-50.7176.3-63177.1000111.4L120 Y123 H215 V216 I220 G221 V222L120-L218 HydrophobicContact CD2-CD2 4.1Å; Y123-L218 HydrophobicContact CD2-CD1 3.64Å; Y123-L218 HydrophobicContact CD2-CD2 4.29Å; Y123-L218 HydrophobicContact CD2-CG 3.74Å; Y123-L218 HydrophobicContact CE2-CD1 3.83Å; Y123-L218 HydrophobicContact CE2-CG 4.43Å; Y123-L218 HydrophobicContact CG-CD1 4.11Å; Y123-L218 HydrophobicContact CG-CD2 4.03Å; Y123-L218 HydrophobicContact CG-CG 4Å; H215-L218 WeakPolarHBondContact O-CB 3.2Å; H215-L218 PolarHBondContact O-N 3.12Å; H215-L218 VanDerWaalsContact O-N 3.15Å; V216-L218 VanDerWaalsContact C-N 3.26Å; V216-L218 PolarHBondContact O-N 2.91Å; L218-I220 PolarHBondContact O-N 3.27Å; L218-G221 PolarHBondContact O-N 3.25Å; L218-V222 WeakPolarHBondContact O-CG2 3.49Å; L218-V222 PolarHBondContact O-N 3.06Å
219V91.6Very high91.2Very high64 Ų6432.9 Ų32.939%0.38817%0.173SC..Hα-helixtrans-60-48.5-179176.20000110.9L189 H215 V216 V222 I223L189-V219 HydrophobicContact CD1-CB 4.19Å; L189-V219 HydrophobicContact CD1-CG1 3.87Å; H215-V219 PolarHBondContact O-N 3.39Å; H215-V219 VanDerWaalsContact O-N 3.12Å; V216-V219 PolarHBondContact O-N 3.22Å; V219-V222 PolarHBondContact O-N 3.28Å; V219-I223 HydrophobicContact CG1-CD1 4.03Å; V219-I223 WeakPolarHBondContact O-CG1 3.11Å; V219-I223 PolarHBondContact O-N 3.38Å; V219-I223 VanDerWaalsContact O-N 3.09Å
220I91.3Very high91Very high0 Ų036.4 Ų36.40%019%0.191CC..Hα-helixtrans-67.7-40.1179.9-60.8-65000111.4Y37 F182 I185 Q186 V216 L218 V222 I223 L224Y37-I220 HydrophobicContact CD2-CG2 3.81Å; Y37-I220 HydrophobicContact CE2-CB 4.45Å; Y37-I220 HydrophobicContact CE2-CG2 3.33Å; F182-I220 HydrophobicContact CD1-CD1 4.12Å; F182-I220 HydrophobicContact CD1-CG2 4.17Å; F182-I220 HydrophobicContact CE1-CG2 4.48Å; I185-I220 HydrophobicContact CB-CD1 4.48Å; I185-I220 HydrophobicContact CG2-CD1 3.86Å; Q186-I220 HydrophobicContact CG-CD1 4.17Å; Q186-I220 HydrophobicContact CG-CG1 4.34Å; V216-I220 HydrophobicContact CG1-CG1 3.87Å; V216-I220 WeakPolarHBondContact O-CB 3.1Å; V216-I220 VanDerWaalsContact O-CG1 3.28Å; V216-I220 WeakPolarHBondContact O-CG1 3.31Å; V216-I220 PolarHBondContact O-N 2.87Å; L218-I220 PolarHBondContact O-N 3.27Å; I220-V222 VanDerWaalsContact C-N 3.27Å; I220-V222 PolarHBondContact O-N 3.07Å; I220-I223 HydrophobicContact CD1-CD1 4.49Å; I220-I223 PolarHBondContact O-N 3.02Å; I220-L224 HydrophobicContact CG2-CD1 3.76Å; I220-L224 HydrophobicContact CG2-CG 4.03Å; I220-L224 WeakPolarHBondContact O-CB 3.43Å; I220-L224 VanDerWaalsContact O-CG 3.26Å; I220-L224 WeakPolarHBondContact O-CG 3.49Å; I220-L224 PolarHBondContact O-N 2.57Å
221G88.9Confident90.7Very high0 Ų036.4 Ų36.40%019%0.191CC..Hα-helixtrans-60-36.4176.200000113F217 L218 S225F217-G221 PolarHBondContact O-N 2.84Å; L218-G221 PolarHBondContact O-N 3.25Å; G221-S225 WeakPolarHBondContact O-CB 3.02Å; G221-S225 PolarHBondContact O-N 3.28Å; G221-S225 PolarHBondContact O-OG 2.85Å
222V88.9Confident90.4Very high79 Ų7934.2 Ų34.248%0.47918%0.179SC..Hα-helixtrans-67.2-48.3173.2172.60000111.2L218 V219 I220 L224 S225 V226L218-V222 WeakPolarHBondContact O-CG2 3.49Å; L218-V222 PolarHBondContact O-N 3.06Å; V219-V222 PolarHBondContact O-N 3.28Å; I220-V222 VanDerWaalsContact C-N 3.27Å; I220-V222 PolarHBondContact O-N 3.07Å; V222-L224 VanDerWaalsContact C-N 3.32Å; V222-L224 PolarHBondContact O-N 3.39Å; V222-S225 WeakPolarHBondContact O-CB 3.43Å; V222-S225 PolarHBondContact O-N 2.7Å; V222-S225 VanDerWaalsContact O-N 3.14Å; V222-V226 HydrophobicContact CG1-CG2 4.42Å; V222-V226 WeakPolarHBondContact O-CG2 3.44Å; V222-V226 PolarHBondContact O-N 2.93Å
223I90.4Very high90.1Very high52 Ų5235.9 Ų35.927%0.26719%0.193SC..Hα-helixtrans-59-45.4178.7-64.3167.4000110.6F182 I185 V219 I220 S225 V226 T227F182-I223 HydrophobicContact CE1-CG2 3.83Å; I185-I223 HydrophobicContact CD1-CD1 4.49Å; V219-I223 HydrophobicContact CG1-CD1 4.03Å; V219-I223 WeakPolarHBondContact O-CG1 3.11Å; V219-I223 PolarHBondContact O-N 3.38Å; V219-I223 VanDerWaalsContact O-N 3.09Å; I220-I223 HydrophobicContact CD1-CD1 4.49Å; I220-I223 PolarHBondContact O-N 3.02Å; I223-S225 VanDerWaalsContact C-N 3.33Å; I223-S225 PolarHBondContact O-N 3.35Å; I223-V226 PolarHBondContact O-N 3.32Å; I223-T227 PolarHBondContact O-N 3.1Å; I223-T227 PolarHBondContact O-OG1 2.87Å; I223-T227 VanDerWaalsContact O-OG1 3.09Å
224L90.9Very high89.8Confident2 Ų237.6 Ų37.61%0.0120%0.202CC..Hα-helixtrans-59.4-44.4176.2-70.9171000111.7S34 Y37 V119 F182 I220 V222 T227 Q228S34-L224 WeakPolarHBondContact O-CD2 3.14Å; Y37-L224 HydrophobicContact CD1-CD1 4.05Å; Y37-L224 HydrophobicContact CD2-CD1 4.18Å; Y37-L224 HydrophobicContact CE1-CD1 4.38Å; Y37-L224 HydrophobicContact CG-CD1 3.9Å; Y37-L224 HydrophobicContact CG-CD2 4.26Å; V119-L224 HydrophobicContact CG2-CD1 4.05Å; F182-L224 HydrophobicContact CE1-CD2 3.85Å; F182-L224 HydrophobicContact CE1-CG 4.25Å; F182-L224 HydrophobicContact CE2-CD2 3.74Å; F182-L224 HydrophobicContact CZ-CD2 3.29Å; F182-L224 HydrophobicContact CZ-CG 4.17Å; I220-L224 HydrophobicContact CG2-CD1 3.76Å; I220-L224 HydrophobicContact CG2-CG 4.03Å; I220-L224 WeakPolarHBondContact O-CB 3.43Å; I220-L224 VanDerWaalsContact O-CG 3.26Å; I220-L224 WeakPolarHBondContact O-CG 3.49Å; I220-L224 PolarHBondContact O-N 2.57Å; V222-L224 VanDerWaalsContact C-N 3.32Å; V222-L224 PolarHBondContact O-N 3.39Å; L224-T227 PolarHBondContact O-N 3.49Å; L224-Q228 WeakPolarHBondContact O-CB 3.4Å; L224-Q228 WeakPolarHBondContact O-CG 3.5Å; L224-Q228 PolarHBondContact O-N 3.26Å
225S85.7Confident89.5Confident2 Ų237.6 Ų37.61%0.01420%0.202CC..Hα-helixtrans-62.5-44179.2-62.50000112G221 V222 I223 Q228 I229G221-S225 WeakPolarHBondContact O-CB 3.02Å; G221-S225 PolarHBondContact O-N 3.28Å; G221-S225 PolarHBondContact O-OG 2.85Å; V222-S225 WeakPolarHBondContact O-CB 3.43Å; V222-S225 PolarHBondContact O-N 2.7Å; V222-S225 VanDerWaalsContact O-N 3.14Å; I223-S225 VanDerWaalsContact C-N 3.33Å; I223-S225 PolarHBondContact O-N 3.35Å; S225-Q228 PolarHBondContact O-N 2.74Å; S225-I229 VanDerWaalsContact O-CD1 3.32Å; S225-I229 WeakPolarHBondContact O-CD1 3.2Å; S225-I229 WeakPolarHBondContact O-CG1 3.44Å; S225-I229 PolarHBondContact O-N 2.96Å
226V88.7Confident89.1Confident69 Ų6939.1 Ų39.142%0.41820%0.203SC..Hα-helixtrans-63.9-48.91791730000110.8V222 I223 Q228 I229 I230V222-V226 HydrophobicContact CG1-CG2 4.42Å; V222-V226 WeakPolarHBondContact O-CG2 3.44Å; V222-V226 PolarHBondContact O-N 2.93Å; I223-V226 PolarHBondContact O-N 3.32Å; V226-Q228 VanDerWaalsContact C-N 3.29Å; V226-Q228 PolarHBondContact O-N 3.26Å; V226-I229 PolarHBondContact O-N 3.11Å; V226-I230 HydrophobicContact CG1-CD1 3.91Å; V226-I230 WeakPolarHBondContact O-CG1 3.11Å; V226-I230 PolarHBondContact O-N 3.49Å; V226-I230 VanDerWaalsContact O-N 3.09Å
227T89.8Confident88.4Confident25 Ų2540.3 Ų40.315%0.15321%0.211CC..Hα-helixtrans-60.2-39.5178.9-58.60000111.9L30 L33 S34 I223 L224 G231L30-T227 HydrophobicContact CB-CG2 4.05Å; L30-T227 HydrophobicContact CD2-CG2 4.14Å; L30-T227 WeakPolarHBondContact O-CG2 3.43Å; L33-T227 HydrophobicContact CD2-CG2 4.36Å; S34-T227 WeakPolarHBondContact OG-CB 3.39Å; S34-T227 WeakPolarHBondContact OG-CG2 3.38Å; I223-T227 PolarHBondContact O-N 3.1Å; I223-T227 PolarHBondContact O-OG1 2.87Å; I223-T227 VanDerWaalsContact O-OG1 3.09Å; L224-T227 PolarHBondContact O-N 3.49Å; T227-G231 PolarHBondContact O-N 3.36Å
228Q89.5Confident87.6Confident0 Ų044.7 Ų44.70%023%0.231CC..Hα-helixtrans-68-39.9176.8-74.5170.9200113.2S34 C100 L103 L224 S225 V226 I230 G231 L232S34-Q228 WeakPolarHBondContact OG-CG 3.25Å; C100-Q228 HydrophobicContact CB-CB 4.42Å; L103-Q228 VanDerWaalsContact CD1-NE2 3.29Å; L224-Q228 WeakPolarHBondContact O-CB 3.4Å; L224-Q228 WeakPolarHBondContact O-CG 3.5Å; L224-Q228 PolarHBondContact O-N 3.26Å; S225-Q228 PolarHBondContact O-N 2.74Å; V226-Q228 VanDerWaalsContact C-N 3.29Å; V226-Q228 PolarHBondContact O-N 3.26Å; Q228-I230 VanDerWaalsContact C-N 3.35Å; Q228-G231 PolarHBondContact O-N 3.49Å; Q228-L232 WeakPolarHBondContact O-CB 3.27Å; Q228-L232 WeakPolarHBondContact O-CG 3.3Å; Q228-L232 PolarHBondContact O-N 2.81Å
229I87.6Confident86.3Confident45 Ų4544.7 Ų44.723%0.23123%0.234CC..Hα-helixtrans-59.9-48.4175.5-69.4158.8000110.4S225 V226 G231 L232 I233S225-I229 VanDerWaalsContact O-CD1 3.32Å; S225-I229 WeakPolarHBondContact O-CD1 3.2Å; S225-I229 WeakPolarHBondContact O-CG1 3.44Å; S225-I229 PolarHBondContact O-N 2.96Å; V226-I229 PolarHBondContact O-N 3.11Å; I229-G231 VanDerWaalsContact C-N 3.32Å; I229-G231 PolarHBondContact O-N 3.24Å; I229-L232 WeakPolarHBondContact O-CB 3.41Å; I229-L232 PolarHBondContact O-N 3.01Å; I229-I233 HydrophobicContact CG2-CD1 3.86Å; I229-I233 WeakPolarHBondContact O-CG1 3.35Å; I229-I233 PolarHBondContact O-N 2.95Å
230I89.4Confident84.8Confident79 Ų7948.2 Ų48.241%0.40524%0.244SC..Hα-helixtrans-61.8-45.8179.2-63167.6000109.3L30 V226 Q228 L232 I233 L234L30-I230 HydrophobicContact CD1-CB 4.37Å; L30-I230 HydrophobicContact CD1-CG2 3.71Å; V226-I230 HydrophobicContact CG1-CD1 3.91Å; V226-I230 WeakPolarHBondContact O-CG1 3.11Å; V226-I230 PolarHBondContact O-N 3.49Å; V226-I230 VanDerWaalsContact O-N 3.09Å; Q228-I230 VanDerWaalsContact C-N 3.35Å; I230-L232 PolarHBondContact O-N 3.41Å; I230-I233 PolarHBondContact O-N 2.98Å; I230-L234 HydrophobicContact CG2-CD1 3.92Å; I230-L234 HydrophobicContact CG2-CG 4.43Å; I230-L234 WeakPolarHBondContact O-CG 3.39Å; I230-L234 PolarHBondContact O-N 3.49Å; I230-L234 VanDerWaalsContact O-N 3.08Å
231G87.7Confident82.2Confident0 Ų055.6 Ų55.60%027%0.272CS..Hα-helixtrans-59.9-41.2177.300000113.7G27 T227 Q228 I229 L234 L235G27-G231 WeakPolarHBondContact CA-O 3.43Å; T227-G231 PolarHBondContact O-N 3.36Å; Q228-G231 PolarHBondContact O-N 3.49Å; I229-G231 VanDerWaalsContact C-N 3.32Å; I229-G231 PolarHBondContact O-N 3.24Å; G231-L234 PolarHBondContact O-N 3.46Å; G231-L235 WeakPolarHBondContact O-CB 3.25Å; G231-L235 PolarHBondContact O-N 3.01Å
232L88Confident79.6Confident43 Ų4358.1 Ų58.123%0.22529%0.286CS..Hα-helixtrans-62.3-41175.3-88167.6000113L96 C100 Q228 I229 I230 L234L96-L232 HydrophobicContact CB-CD2 3.93Å; L96-L232 HydrophobicContact CD2-CD2 3.56Å; L96-L232 HydrophobicContact CD2-CG 4.49Å; L96-L232 HydrophobicContact CG-CD2 3.45Å; L96-L232 VanDerWaalsContact CG-CD2 3.45Å; L96-L232 HydrophobicContact CG-CG 4.36Å; C100-L232 HydrophobicContact CB-CD1 3.92Å; Q228-L232 WeakPolarHBondContact O-CB 3.27Å; Q228-L232 WeakPolarHBondContact O-CG 3.3Å; Q228-L232 PolarHBondContact O-N 2.81Å; I229-L232 WeakPolarHBondContact O-CB 3.41Å; I229-L232 PolarHBondContact O-N 3.01Å; I230-L232 PolarHBondContact O-N 3.41Å; L232-L234 VanDerWaalsContact C-N 3.34Å
233I88.1Confident77.1Confident115 Ų11559.8 Ų59.859%0.5930%0.3SS*.Hα-helixtrans-68.5-37.5179.2-68165.9000110.8I229 I230I229-I233 HydrophobicContact CG2-CD1 3.86Å; I229-I233 WeakPolarHBondContact O-CG1 3.35Å; I229-I233 PolarHBondContact O-N 2.95Å; I230-I233 PolarHBondContact O-N 2.98Å
234L89Confident74.7Confident37 Ų3765.9 Ų65.919%0.19433%0.327CS..Hα-helixtrans-78.8-34-178.6-68.6179.4000113.1F23 L26 L30 I230 G231 L232 R236F23-L234 CarbonylContact C-O 3.2Å; F23-L234 HydrophobicContact CB-CD2 4.46Å; F23-L234 HydrophobicContact CD1-CD2 3.78Å; F23-L234 HydrophobicContact CE1-CD2 4.43Å; F23-L234 HydrophobicContact CG-CD2 4.4Å; L26-L234 HydrophobicContact CD2-CD1 4.06Å; L26-L234 HydrophobicContact CG-CD1 4.15Å; L30-L234 HydrophobicContact CD1-CD1 3.98Å; I230-L234 HydrophobicContact CG2-CD1 3.92Å; I230-L234 HydrophobicContact CG2-CG 4.43Å; I230-L234 WeakPolarHBondContact O-CG 3.39Å; I230-L234 PolarHBondContact O-N 3.49Å; I230-L234 VanDerWaalsContact O-N 3.08Å; G231-L234 PolarHBondContact O-N 3.46Å; L232-L234 VanDerWaalsContact C-N 3.34Å; L234-R236 PolarHBondContact O-N 2.91Å
235L86.1Confident72.3Confident3 Ų370.3 Ų70.32%0.01635%0.351CS..  trans-69.1113.9-179.4-169.577.9000110.9S24 I31 L96 T152 V155 G231S24-L235 VanDerWaalsContact O-CD1 3.28Å; S24-L235 WeakPolarHBondContact O-CD1 3.38Å; I31-L235 HydrophobicContact CD1-CB 4.44Å; I31-L235 HydrophobicContact CD1-CD2 4.29Å; L96-L235 HydrophobicContact CD2-CD2 3.27Å; T152-L235 HydrophobicContact CG2-CD1 4.37Å; T152-L235 HydrophobicContact CG2-CD2 4.17Å; V155-L235 HydrophobicContact CB-CD2 4.49Å; V155-L235 HydrophobicContact CG1-CD1 4.05Å; V155-L235 HydrophobicContact CG1-CD2 4.27Å; V155-L235 HydrophobicContact CG1-CG 4.03Å; G231-L235 WeakPolarHBondContact O-CB 3.25Å; G231-L235 PolarHBondContact O-N 3.01Å
236R82.7Confident70.2Confident142 Ų14276.7 Ų76.754%0.53639%0.385SS..  trans-125.5142.4175.5-63.8-176.9-179.5-167.7-0.6109.7S24 W159 L234S24-R236 WeakPolarHBondContact CB-O 3.27Å; S24-R236 PolarHBondContact OG-N 3.43Å; S24-R236 PolarHBondContact OG-O 3.45Å; W159-R236 HydrophobicContact CZ2-CB 4.46Å; W159-R236 PolarHBondContact NE1-O 2.84Å; L234-R236 PolarHBondContact O-N 2.91Å
237S79.3Confident67.3Low28 Ų2880 Ų8020%0.19639%0.393CS..PPolyproline II helixtrans-72.7146.6168.3510000110.7Y92 W159Y92-S237 WeakPolarHBondContact CE1-OG 3.47Å; Y92-S237 PolarHBondContact OH-N 3.03Å; Y92-S237 VanDerWaalsContact OH-N 3.11Å; Y92-S237 PolarHBondContact OH-OG 2.88Å; W159-S237 WeakPolarHBondContact CZ2-O 3.16Å
238K74.9Confident64.7Low93 Ų9383.8 Ų83.840%0.40441%0.412SS..PPolyproline II helixtrans-63.8129.7167.6-172.4175.2-177.7170.50108W159 K240W159-K238 HydrophobicContact CD2-CB 3.86Å; W159-K238 HydrophobicContact CD2-CG 4.29Å; W159-K238 HydrophobicContact CE3-CB 4.2Å; W159-K238 HydrophobicContact CE3-CD 4.42Å; W159-K238 HydrophobicContact CE3-CG 4.12Å; W159-K238 HydrophobicContact CG-CB 4.25Å; W159-K238 HydrophobicContact CZ2-CB 4.23Å; W159-K238 HydrophobicContact CZ3-CG 4.3Å; K238-K240 PolarHBondContact O-N 3.32Å
239P65Low62.2Low61 Ų6188.2 Ų88.240%0.39643%0.432SS..PPolyproline II helixtrans-59.7132.3172.9-16.328000109I248P239-I248 HydrophobicContact CB-CG2 3.69Å; P239-I248 HydrophobicContact CG-CG2 4.39Å
240K59.9Low59.8Low138 Ų13891.9 Ų91.960%0.645%0.451SS*.EExtended strand (participates in β ladder)trans-84.6130.2167.2-71.4-174177.1-175.10107.2K238K238-K240 PolarHBondContact O-N 3.32Å
241W35.2Very low57.4Low154 Ų15492.9 Ų92.958%0.58346%0.457SS*.EExtended strand (participates in β ladder)trans-85.8111.7168.3-124.372.9000106.5D246W241-D246 WeakPolarHBondContact CH2-OD1 3.43Å
242N35.8Very low54.9Low53 Ų5398 Ų9828%0.28348%0.484SS..EExtended strand (participates in β ladder)trans-84115.2164.8-75.5-6.6000106.4E244 D245 E249N242-E244 PolarHBondContact O-N 2.89Å; N242-E244 VanDerWaalsContact O-N 3.13Å; N242-D245 PolarHBondContact O-N 3.34Å; N242-E249 PolarHBondContact ND2-OE2 3.09Å
243C36.6Very low52.3Low114 Ų114102.7 Ų102.777%0.7751%0.51SS*.THydrogen-bonded Turntrans-62.7-13.3175.1-63.30000112.7
244E39.9Very low49.6Very low180 Ų180103 Ų10384%0.84152%0.522SS*.THydrogen-bonded Turntrans-81-14.9-176.2-71.3174.7163.300114.2N242N242-E244 PolarHBondContact O-N 2.89Å; N242-E244 VanDerWaalsContact O-N 3.13Å
245D40.6Very low46.9Very low95 Ų95105.1 Ų105.151%0.50855%0.552SS.*THydrogen-bonded Turntrans-132-0.9-170.6-100.1-38.8000116.2N242 K247N242-D245 PolarHBondContact O-N 3.34Å; D245-K247 HydrophobicContact CB-CB 4.27Å; D245-K247 WeakPolarHBondContact O-CG 3.08Å; D245-K247 PolarHBondContact O-N 3.08Å
246D41.4Very low44.2Very low136 Ų136110.3 Ų110.373%0.72759%0.589SS**THydrogen-bonded Turntrans48.325.3-173.9-116.44.3000113W241W241-D246 WeakPolarHBondContact CH2-OD1 3.43Å
247K27.6Very low41.8Very low139 Ų139109.3 Ų109.360%0.60460%0.604SS**EExtended strand (participates in β ladder)trans-122.2135.3-177.2-75.8169.6-171.8164.60109.9D245 E249D245-K247 HydrophobicContact CB-CB 4.27Å; D245-K247 WeakPolarHBondContact O-CG 3.08Å; D245-K247 PolarHBondContact O-N 3.08Å; K247-E249 PolarHBondContact O-N 3.27Å; K247-E249 VanDerWaalsContact O-N 3.13Å
248I35.2Very low39.3Very low104 Ų104115.4 Ų115.453%0.53363%0.634SS.*EExtended strand (participates in β ladder)trans-73100.3169-59.6172.4000107P239 I250P239-I248 HydrophobicContact CB-CG2 3.69Å; P239-I248 HydrophobicContact CG-CG2 4.39Å; I248-I250 HydrophobicContact CG2-CG1 4.3Å; I248-I250 PolarHBondContact O-N 3.2Å
249E36.5Very low37Very low93 Ų93117.6 Ų117.644%0.43566%0.66SS.*EExtended strand (participates in β ladder)trans-69.298.3168.7-88.5-167.315500109.4N242 K247 L251N242-E249 PolarHBondContact ND2-OE2 3.09Å; K247-E249 PolarHBondContact O-N 3.27Å; K247-E249 VanDerWaalsContact O-N 3.13Å; E249-L251 PolarHBondContact O-N 2.63Å
250I37.5Very low35.3Very low122 Ų122122.9 Ų122.963%0.62668%0.679SS**  trans-75.2110.3157.9-57.3175.7000105.3I248 D252I248-I250 HydrophobicContact CG2-CG1 4.3Å; I248-I250 PolarHBondContact O-N 3.2Å; I250-D252 VanDerWaalsContact C-N 3.26Å; I250-D252 PolarHBondContact O-N 2.89Å
251L38.6Very low33.9Very low100 Ų100122.5 Ų122.552%0.52468%0.682SS.*  trans-62.485.5175-68.8166.7000110.5E249E249-L251 PolarHBondContact O-N 2.63Å
252D34.8Very low33.7Very low109 Ų109123.3 Ų123.358%0.58369%0.694SS**  trans-128.5126.2157.2-86.5-25.5000107.7R93 I250R93-D252 IonicContact NH1-OD1 3.17Å; R93-D252 PolarHBondContact NH1-OD1 3.48Å; R93-D252 IonicContact NH1-OD2 2.72Å; R93-D252 PolarHBondContact NH1-OD2 2.92Å; R93-D252 VanDerWaalsContact NH1-OD2 3.17Å; I250-D252 VanDerWaalsContact C-N 3.26Å; I250-D252 PolarHBondContact O-N 2.89Å
253D33.5Very low33.4Very low141 Ų141127.9 Ų127.975%0.75472%0.719SS**SBendtrans11132.5171.6-98.5-31.7000122.8
254S32.8Very low33.3Very low122 Ų122130.6 Ų130.685%0.85373%0.726SS**  trans90.8122.5148.474.10000120.4
255G31.6Very low32.7Very low80 Ų80131.3 Ų131.383%0.82573%0.729SS**  trans128.1108.3152.900000116.1
256S29.1Very low32.3Very low113 Ų113133.1 Ų133.179%0.7974%0.743SS**  trans-60.6148.4170.149.90000114.5
257S32Very low31.5Very low120 Ų120136.6 Ų136.684%0.83975%0.752SS**  177.6140.2119.7-87.90000112.7
258D27.3Very low31.6Very low157 Ų157138.1 Ų138.184%0.8476%0.759SS**  trans-68.6147.6179.5-54.3-61.9000113.7
259C27.6Very low31.2Very low139 Ų139138.2 Ų138.294%0.93977%0.769SS**  178.4159.7127.8-99.20000113.9
260E28.2Very low30.6Very low172 Ų172141.8 Ų141.880%0.80479%0.791SS**  trans-92.8145.1-159.3-92.2177.1159.300116.8
261I29.8Very low30.3Very low129 Ų129139.6 Ų139.666%0.66279%0.785SS**  trans74118.8137.9-57.9162.3000119
262M32.3Very low29.8Very low171 Ų171139.3 Ų139.384%0.84279%0.792SS**  170.7151.589.1-132.7152.793.500113
263D29.1Very low29.9Very low150 Ų150141.8 Ų141.880%0.80281%0.805SS**  trans-55.9140.4-169.3-59.9-61.3000117.4
264D33.4Very low30.7Very low171 Ų171137.9 Ų137.991%0.91479%0.793SS**  trans-149.4132.4143.8-101.2-30.9000112.1V266D264-V266 PolarHBondContact O-N 3.2Å
265E29.1Very low32.1Very low194 Ų194137.2 Ų137.291%0.90778%0.783SS**  trans-63.7118.6-171-68.9177.7124.500114
266V32.2Very low34.1Very low133 Ų133136.7 Ų136.781%0.80676%0.761SS**  trans-128.3117.5153.2-177.60000109.5D264 F268D264-V266 PolarHBondContact O-N 3.2Å; V266-F268 PolarHBondContact O-N 3.03Å
267K24.7Very low36.6Very low209 Ų209132 Ų13291%0.90973%0.727SS**  trans-48.394178.7-71.8171.5175.4171.30112.6
268F28.5Very low39.1Very low172 Ų172129.1 Ų129.175%0.75471%0.705SS**  trans-93.5103.7162.5-119.2-85.4000109V266 N270V266-F268 PolarHBondContact O-N 3.03Å; F268-N270 PolarHBondContact O-N 3.39Å
269S26.5Very low41.8Very low106 Ų106122.3 Ų122.374%0.74167%0.669SS**  trans-63.1116173.752.90000111.1C271S269-C271 PolarHBondContact O-N 2.89Å
270N25.2Very low44.6Very low168 Ų168120.5 Ų120.590%0.89866%0.658SS**SBendtrans68.323.7150.9-77-4.7000122.3F268F268-N270 PolarHBondContact O-N 3.39Å
271C29.4Very low47.4Very low75 Ų75120 Ų12051%0.50765%0.649SS.*  trans-11012.5162.1-128.20000114.5S269S269-C271 PolarHBondContact O-N 2.89Å
272S29.6Very low50.1Low95 Ų95113.9 Ų113.966%0.66462%0.617SS**THydrogen-bonded Turntrans-97.518-166-46.40000116.1
273N35.3Very low52.8Low161 Ų161110.5 Ų110.586%0.86160%0.598SS**THydrogen-bonded Turntrans-125.410.5173.9-83.2-22.7000114.2V275N273-V275 PolarHBondContact O-N 3.36Å; N273-V275 VanDerWaalsContact O-N 3.13Å
274A52Low55.6Low59 Ų59113.4 Ų113.449%0.48860%0.598SS.*  trans-76.6102.9176.100000109.6D276A274-D276 PolarHBondContact O-N 3.31Å
275V61.2Low58.2Low107 Ų107108.5 Ų108.565%0.64857%0.569SS**  trans-62.7100.1171.3-176.90000108.2N273 I277 F409N273-V275 PolarHBondContact O-N 3.36Å; N273-V275 VanDerWaalsContact O-N 3.13Å; V275-I277 HydrophobicContact CG1-CD1 4.41Å; V275-I277 HydrophobicContact CG1-CG1 3.83Å; V275-I277 PolarHBondContact O-N 3.19Å; V275-I277 VanDerWaalsContact O-N 3.12Å; V275-F409 CarbonylContact O-C 3.55Å
276D74.7Confident61.1Low69 Ų69105 Ų10537%0.36956%0.556SS.*  trans-74.399.6173.8-85.1-38.1000109.6A274 T278 G410 C411 T412A274-D276 PolarHBondContact O-N 3.31Å; D276-T278 PolarHBondContact O-N 2.69Å; D276-G410 VanDerWaalsContact OD1-C 3.24Å; D276-G410 WeakPolarHBondContact OD1-CA 3.46Å; D276-C411 PolarHBondContact OD1-N 2.8Å; D276-T412 VanDerWaalsContact CG-OG1 3.29Å; D276-T412 PolarHBondContact OD1-N 3.48Å; D276-T412 VanDerWaalsContact OD1-N 3.15Å; D276-T412 VanDerWaalsContact OD2-CB 3.28Å; D276-T412 WeakPolarHBondContact OD2-CB 3.39Å; D276-T412 PolarHBondContact OD2-OG1 3.12Å
277I81.4Confident63.7Low14 Ų14100.9 Ų100.97%0.07253%0.529CS..  trans-81.8124.3-175.7-66.2170.6000109.2V275 R281 H285 F409 N413 N417V275-I277 HydrophobicContact CG1-CD1 4.41Å; V275-I277 HydrophobicContact CG1-CG1 3.83Å; V275-I277 PolarHBondContact O-N 3.19Å; V275-I277 VanDerWaalsContact O-N 3.12Å; I277-R281 HydrophobicContact CG2-CB 3.77Å; I277-H285 WeakPolarHBondContact CD1-NE2 3.33Å; I277-F409 HydrophobicContact CB-CB 4.26Å; I277-F409 HydrophobicContact CB-CD1 4.27Å; I277-F409 HydrophobicContact CD1-CD1 3.66Å; I277-F409 HydrophobicContact CD1-CE1 4.38Å; I277-F409 HydrophobicContact CG2-CD1 4.41Å; I277-F409 PolarHBondContact N-O 3.17Å; I277-N413 PolarHBondContact O-ND2 3.4Å; I277-N417 PolarHBondContact O-ND2 2.68Å; I277-N417 VanDerWaalsContact O-ND2 3.14Å
278T84.7Confident66.8Low60 Ų6091.3 Ų91.337%0.36849%0.488SS..  trans-65.7145.9172.754.20000111.2D276 S280 R281 L282 N413D276-T278 PolarHBondContact O-N 2.69Å; T278-S280 PolarHBondContact O-N 3.35Å; T278-R281 PolarHBondContact O-N 2.88Å; T278-R281 WeakPolarHBondContact OG1-CD 3.22Å; T278-R281 WeakPolarHBondContact OG1-CG 3.48Å; T278-L282 PolarHBondContact O-N 3.46Å; T278-N413 WeakPolarHBondContact CA-ND2 3.31Å
279P82.9Confident69.7Low14 Ų1489.4 Ų89.49%0.09148%0.476CS..Hα-helixtrans-51-36.6-178.3-28.834.7000114.9R281 L282 I416 N417 I420P279-R281 VanDerWaalsContact C-N 3.32Å; P279-R281 PolarHBondContact O-N 3.05Å; P279-L282 WeakPolarHBondContact O-CB 3.38Å; P279-L282 PolarHBondContact O-N 2.91Å; P279-I416 HydrophobicContact CB-CG2 3.87Å; P279-I416 HydrophobicContact CG-CB 3.98Å; P279-I416 HydrophobicContact CG-CD1 4.37Å; P279-I416 HydrophobicContact CG-CG2 3.55Å; P279-N417 WeakPolarHBondContact CA-OD1 3.27Å; P279-I420 HydrophobicContact CB-CD1 3.82Å
280S85.4Confident72.7Confident102 Ų10288.6 Ų88.671%0.71346%0.463SS*.Hα-helixtrans-68.8-29.7178.8-47.70000113.4T278 L282T278-S280 PolarHBondContact O-N 3.35Å; S280-L282 VanDerWaalsContact C-N 3.35Å
281R88Confident75.7Confident162 Ų16280.9 Ų80.961%0.61142%0.422SS*.Hα-helixtrans-80.7-18.2176.8-70.6-179-177.2-175.61.7112.1I277 T278 P279 F283 R284 H285I277-R281 HydrophobicContact CG2-CB 3.77Å; T278-R281 PolarHBondContact O-N 2.88Å; T278-R281 WeakPolarHBondContact OG1-CD 3.22Å; T278-R281 WeakPolarHBondContact OG1-CG 3.48Å; P279-R281 VanDerWaalsContact C-N 3.32Å; P279-R281 PolarHBondContact O-N 3.05Å; R281-F283 VanDerWaalsContact C-N 3.27Å; R281-F283 PolarHBondContact O-N 3.45Å; R281-R284 WeakPolarHBondContact O-CB 3.44Å; R281-R284 PolarHBondContact O-N 3.22Å; R281-H285 PolarHBondContact O-CD2 2.85Å
282L86.4Confident78.6Confident0 Ų080.1 Ų80.10%041%0.408CS..Hα-helixtrans-53.7-42.9179.4-173.265.9000112.3T278 P279 S280 R284 H285 F288 F409 N417 I420T278-L282 PolarHBondContact O-N 3.46Å; P279-L282 WeakPolarHBondContact O-CB 3.38Å; P279-L282 PolarHBondContact O-N 2.91Å; S280-L282 VanDerWaalsContact C-N 3.35Å; L282-R284 PolarHBondContact O-N 3.26Å; L282-H285 PolarHBondContact O-N 3.05Å; L282-H285 VanDerWaalsContact O-N 3.12Å; L282-F288 HydrophobicContact CD1-CB 4.25Å; L282-F288 HydrophobicContact CD1-CD2 4.15Å; L282-F288 HydrophobicContact CD2-CD2 3.59Å; L282-F288 HydrophobicContact CD2-CE2 3.82Å; L282-F288 HydrophobicContact CD2-CG 4.47Å; L282-F288 HydrophobicContact CG-CB 4.15Å; L282-F288 HydrophobicContact CG-CD2 3.53Å; L282-F288 HydrophobicContact CG-CE2 4.18Å; L282-F288 HydrophobicContact CG-CG 3.95Å; L282-F288 WeakPolarHBondContact O-CB 3.23Å; L282-F409 HydrophobicContact CD1-CB 4.47Å; L282-F409 HydrophobicContact CD1-CD1 3.48Å; L282-F409 VanDerWaalsContact CD1-CD1 3.48Å; L282-F409 HydrophobicContact CD1-CD2 3.67Å; L282-F409 HydrophobicContact CD1-CE1 3.46Å; L282-F409 VanDerWaalsContact CD1-CE1 3.46Å; L282-F409 HydrophobicContact CD1-CE2 3.62Å; L282-F409 HydrophobicContact CD1-CG 3.6Å; L282-F409 HydrophobicContact CD1-CZ 3.52Å; L282-N417 HydrophobicContact CD2-CB 4.14Å; L282-I420 HydrophobicContact CD2-CB 4.17Å; L282-I420 HydrophobicContact CD2-CD1 4.31Å; L282-I420 HydrophobicContact CD2-CG2 4.16Å
283F89.1Confident81.4Confident99 Ų9979.9 Ų79.943%0.43440%0.399SS..THydrogen-bonded Turntrans-64.5-10.8-179.8-63.6-76.5000114.5R281 F288 Y289 I420R281-F283 VanDerWaalsContact C-N 3.27Å; R281-F283 PolarHBondContact O-N 3.45Å; F283-F288 HydrophobicContact CD1-CD1 4.21Å; F283-F288 AromaticContact CD1-CE1 3.52Å; F283-F288 HydrophobicContact CD1-CE1 3.52Å; F283-F288 AromaticContact CD1-CZ 3.86Å; F283-F288 HydrophobicContact CD1-CZ 3.86Å; F283-F288 AromaticContact CE1-CE1 3.77Å; F283-F288 HydrophobicContact CE1-CE1 3.77Å; F283-F288 AromaticContact CE1-CZ 3.63Å; F283-F288 HydrophobicContact CE1-CZ 3.63Å; F283-Y289 VanDerWaalsContact O-CE2 3.3Å; F283-Y289 WeakPolarHBondContact O-CE2 3.32Å; F283-Y289 PolarHBondContact O-OH 3.32Å; F283-Y289 VanDerWaalsContact O-OH 3.11Å; F283-I420 HydrophobicContact CE1-CG2 4.14Å; F283-I420 HydrophobicContact CZ-CG2 3.72Å
284R88.7Confident83.8Confident211 Ų21174.4 Ų74.480%0.79637%0.369SS*.THydrogen-bonded Turntrans-86.2-13176.6-63.2-175.1176.4179.3-2.1113.2R281 L282R281-R284 WeakPolarHBondContact O-CB 3.44Å; R281-R284 PolarHBondContact O-N 3.22Å; L282-R284 PolarHBondContact O-N 3.26Å
285H88.4Confident85.4Confident69 Ų6971.8 Ų71.832%0.31935%0.347SS..  trans-95.2133.9-176.4-68.7-88.1000111.6I277 R281 L282 D287 F288 Y289 F409I277-H285 WeakPolarHBondContact CD1-NE2 3.33Å; R281-H285 PolarHBondContact O-CD2 2.85Å; L282-H285 PolarHBondContact O-N 3.05Å; L282-H285 VanDerWaalsContact O-N 3.12Å; H285-D287 PolarHBondContact O-N 3.44Å; H285-F288 WeakPolarHBondContact O-CB 3.44Å; H285-F288 PolarHBondContact O-N 2.94Å; H285-Y289 WeakPolarHBondContact O-CD2 3.44Å; H285-F409 HydrophobicContact CB-CE1 3.95Å
286I89.6Confident86.6Confident120 Ų12067.7 Ų67.762%0.61532%0.322SS*.Hα-helixtrans-62.9-33.6175.2-168166.9000112F288 Y289 L290I286-F288 PolarHBondContact O-N 3.07Å; I286-Y289 PolarHBondContact O-N 3.22Å; I286-L290 HydrophobicContact CG1-CD1 4.38Å; I286-L290 HydrophobicContact CG1-CG 4.38Å; I286-L290 PolarHBondContact O-N 2.92Å
287D87Confident87.1Confident47 Ų4767.8 Ų67.825%0.25133%0.327SS..Hα-helixtrans-59.9-31.7179.2-60.3-63.4000112.4H285 L291 M408 F409H285-D287 PolarHBondContact O-N 3.44Å; D287-L291 WeakPolarHBondContact O-CB 3.33Å; D287-L291 WeakPolarHBondContact O-CG 3.4Å; D287-L291 PolarHBondContact O-N 3.46Å; D287-M408 HydrophobicContact CB-CE 4.2Å; D287-M408 HydrophobicContact CB-SD 3.77Å; D287-F409 HydrophobicContact CB-CZ 4.17Å
288F89.2Confident87.3Confident8 Ų867.7 Ų67.74%0.03533%0.326CS..Hα-helixtrans-61.2-50.4173.4164.4-102.1000111.1L282 F283 H285 I286 L290 L291 W292 F409 I420 I421L282-F288 HydrophobicContact CD1-CB 4.25Å; L282-F288 HydrophobicContact CD1-CD2 4.15Å; L282-F288 HydrophobicContact CD2-CD2 3.59Å; L282-F288 HydrophobicContact CD2-CE2 3.82Å; L282-F288 HydrophobicContact CD2-CG 4.47Å; L282-F288 HydrophobicContact CG-CB 4.15Å; L282-F288 HydrophobicContact CG-CD2 3.53Å; L282-F288 HydrophobicContact CG-CE2 4.18Å; L282-F288 HydrophobicContact CG-CG 3.95Å; L282-F288 WeakPolarHBondContact O-CB 3.23Å; F283-F288 HydrophobicContact CD1-CD1 4.21Å; F283-F288 AromaticContact CD1-CE1 3.52Å; F283-F288 HydrophobicContact CD1-CE1 3.52Å; F283-F288 AromaticContact CD1-CZ 3.86Å; F283-F288 HydrophobicContact CD1-CZ 3.86Å; F283-F288 AromaticContact CE1-CE1 3.77Å; F283-F288 HydrophobicContact CE1-CE1 3.77Å; F283-F288 AromaticContact CE1-CZ 3.63Å; F283-F288 HydrophobicContact CE1-CZ 3.63Å; H285-F288 WeakPolarHBondContact O-CB 3.44Å; H285-F288 PolarHBondContact O-N 2.94Å; I286-F288 PolarHBondContact O-N 3.07Å; F288-L290 VanDerWaalsContact C-N 3.33Å; F288-L290 PolarHBondContact O-N 3.1Å; F288-L291 PolarHBondContact O-N 3.26Å; F288-W292 WeakPolarHBondContact O-CB 3.27Å; F288-W292 PolarHBondContact O-N 3.07Å; F288-F409 HydrophobicContact CB-CZ 4.24Å; F288-I420 HydrophobicContact CE2-CG2 3.76Å; F288-I420 HydrophobicContact CZ-CG2 3.99Å; F288-I421 HydrophobicContact CD2-CD1 4.06Å; F288-I421 HydrophobicContact CD2-CG1 3.52Å; F288-I421 HydrophobicContact CE2-CG1 3.6Å
289Y89.8Confident87.1Confident131 Ų13165 Ų6551%0.51431%0.31SS..Hα-helixtrans-65.6-36.9-179-65.7-75.9000112.3F283 H285 I286 L293F283-Y289 VanDerWaalsContact O-CE2 3.3Å; F283-Y289 WeakPolarHBondContact O-CE2 3.32Å; F283-Y289 PolarHBondContact O-OH 3.32Å; F283-Y289 VanDerWaalsContact O-OH 3.11Å; H285-Y289 WeakPolarHBondContact O-CD2 3.44Å; I286-Y289 PolarHBondContact O-N 3.22Å; Y289-L293 WeakPolarHBondContact O-CB 3.36Å; Y289-L293 PolarHBondContact O-N 3.28Å
290L89.5Confident86.9Confident89 Ų8968.3 Ų68.347%0.46633%0.326SS..Hα-helixtrans-65-49.1175.8-67.5175.7000111.6I286 F288 W292 L293 I294I286-L290 HydrophobicContact CG1-CD1 4.38Å; I286-L290 HydrophobicContact CG1-CG 4.38Å; I286-L290 PolarHBondContact O-N 2.92Å; F288-L290 VanDerWaalsContact C-N 3.33Å; F288-L290 PolarHBondContact O-N 3.1Å; L290-W292 VanDerWaalsContact C-N 3.34Å; L290-W292 PolarHBondContact O-N 3.05Å; L290-L293 PolarHBondContact O-N 3.11Å; L290-I294 VanDerWaalsContact O-CG1 3.29Å; L290-I294 WeakPolarHBondContact O-CG1 3.44Å; L290-I294 PolarHBondContact O-N 2.65Å
291L87.6Confident86.7Confident7 Ų764.1 Ų64.14%0.03730%0.296CS..Hα-helixtrans-63.8-40.8176.9-76.4-172.4000112.3D287 F288 L293 I294 E295 F354 A404 I405 M408 I421D287-L291 WeakPolarHBondContact O-CB 3.33Å; D287-L291 WeakPolarHBondContact O-CG 3.4Å; D287-L291 PolarHBondContact O-N 3.46Å; F288-L291 PolarHBondContact O-N 3.26Å; L291-L293 VanDerWaalsContact C-N 3.31Å; L291-L293 PolarHBondContact O-N 3.1Å; L291-I294 PolarHBondContact O-N 3.5Å; L291-E295 WeakPolarHBondContact O-CB 3.3Å; L291-E295 PolarHBondContact O-N 3.22Å; L291-F354 HydrophobicContact CD2-CD2 4.45Å; L291-F354 HydrophobicContact CD2-CE2 3.67Å; L291-F354 HydrophobicContact CD2-CZ 4.08Å; L291-A404 HydrophobicContact CD1-CB 4.49Å; L291-I405 HydrophobicContact CD1-CD1 4.36Å; L291-I405 HydrophobicContact CD1-CG1 3.65Å; L291-M408 HydrophobicContact CD1-CE 3.25Å; L291-M408 HydrophobicContact CG-CE 4.03Å; L291-I421 HydrophobicContact CB-CD1 4.39Å; L291-I421 HydrophobicContact CB-CG2 4.26Å; L291-I421 HydrophobicContact CD1-CD1 4.1Å
292W89.2Confident86.6Confident58 Ų5857.1 Ų57.122%0.2227%0.271CS..Hα-helixtrans-61-41.5176.6-174.297.2000111.4F288 L290 E295 L296 A424F288-W292 WeakPolarHBondContact O-CB 3.27Å; F288-W292 PolarHBondContact O-N 3.07Å; L290-W292 VanDerWaalsContact C-N 3.34Å; L290-W292 PolarHBondContact O-N 3.05Å; W292-E295 PolarHBondContact O-N 3.41Å; W292-L296 HydrophobicContact CH2-CD2 3.95Å; W292-L296 HydrophobicContact CZ3-CB 4.45Å; W292-L296 HydrophobicContact CZ3-CD2 3.71Å; W292-L296 WeakPolarHBondContact O-CB 3.25Å; W292-L296 PolarHBondContact O-N 3.19Å; W292-A424 HydrophobicContact CD2-CB 3.87Å; W292-A424 HydrophobicContact CG-CB 3.91Å; W292-A424 HydrophobicContact CZ2-CB 4.24Å; W292-A424 VanDerWaalsContact O-CB 3.31Å; W292-A424 WeakPolarHBondContact O-CB 3.18Å
293L88.4Confident86.4Confident90 Ų9057.3 Ų57.347%0.47127%0.272SS..Hα-helixtrans-66.7-42.4176.2-176.863.6000112Y289 L290 L291 L296 C297Y289-L293 WeakPolarHBondContact O-CB 3.36Å; Y289-L293 PolarHBondContact O-N 3.28Å; L290-L293 PolarHBondContact O-N 3.11Å; L291-L293 VanDerWaalsContact C-N 3.31Å; L291-L293 PolarHBondContact O-N 3.1Å; L293-L296 HydrophobicContact CD1-CD2 4.44Å; L293-L296 WeakPolarHBondContact O-CB 3.41Å; L293-L296 PolarHBondContact O-N 2.93Å; L293-C297 PolarHBondContact O-N 3.31Å; L293-C297 PolarHBondContact O-SG 3.03Å; L293-C297 VanDerWaalsContact O-SG 3.41Å
294I87.3Confident86.1Confident46 Ų4656.7 Ų56.724%0.23627%0.273CS..Hα-helixtrans-60.3-47176-69.5166000110.2L290 L291 L296 C297 N298 F354L290-I294 VanDerWaalsContact O-CG1 3.29Å; L290-I294 WeakPolarHBondContact O-CG1 3.44Å; L290-I294 PolarHBondContact O-N 2.65Å; L291-I294 PolarHBondContact O-N 3.5Å; I294-L296 VanDerWaalsContact C-N 3.34Å; I294-L296 PolarHBondContact O-N 2.87Å; I294-C297 PolarHBondContact O-N 3.2Å; I294-N298 WeakPolarHBondContact CG2-ND2 3.46Å; I294-N298 WeakPolarHBondContact O-CB 3.19Å; I294-N298 PolarHBondContact O-N 3.04Å; I294-N298 PolarHBondContact O-ND2 3.43Å; I294-F354 HydrophobicContact CG2-CD1 3.84Å; I294-F354 HydrophobicContact CG2-CE1 3.91Å
295E85.6Confident85.9Confident4 Ų447.2 Ų47.22%0.01924%0.238CC..Hα-helixtrans-62.4-39.9176.7-80.9-75.2-177.600112.2L291 W292 S299 V397 A401 I421 A424 R425L291-E295 WeakPolarHBondContact O-CB 3.3Å; L291-E295 PolarHBondContact O-N 3.22Å; W292-E295 PolarHBondContact O-N 3.41Å; E295-S299 WeakPolarHBondContact O-CB 3.26Å; E295-S299 PolarHBondContact O-N 3.36Å; E295-V397 WeakPolarHBondContact OE1-CG1 3.43Å; E295-A401 WeakPolarHBondContact OE1-CB 3.49Å; E295-I421 HydrophobicContact CG-CG2 4.05Å; E295-A424 HydrophobicContact CB-CB 4.02Å; E295-R425 IonicContact OE1-NH2 2.69Å; E295-R425 PolarHBondContact OE1-NH2 3.36Å; E295-R425 VanDerWaalsContact OE1-NH2 3.17Å; E295-R425 IonicContact OE2-CZ 3.31Å; E295-R425 IonicContact OE2-NE 3.17Å; E295-R425 PolarHBondContact OE2-NE 3.46Å; E295-R425 IonicContact OE2-NH2 3.35Å; E295-R425 PolarHBondContact OE2-NH2 2.94Å
296L86.5Confident85.7Confident22 Ų2244 Ų4412%0.11522%0.223CC..Hα-helixtrans-59.2-52.7174.2178.464.2000111.2W292 L293 I294 N298 S299 A424 R427W292-L296 HydrophobicContact CH2-CD2 3.95Å; W292-L296 HydrophobicContact CZ3-CB 4.45Å; W292-L296 HydrophobicContact CZ3-CD2 3.71Å; W292-L296 WeakPolarHBondContact O-CB 3.25Å; W292-L296 PolarHBondContact O-N 3.19Å; L293-L296 HydrophobicContact CD1-CD2 4.44Å; L293-L296 WeakPolarHBondContact O-CB 3.41Å; L293-L296 PolarHBondContact O-N 2.93Å; I294-L296 VanDerWaalsContact C-N 3.34Å; I294-L296 PolarHBondContact O-N 2.87Å; L296-N298 PolarHBondContact O-N 3.32Å; L296-S299 WeakPolarHBondContact O-CB 3.37Å; L296-S299 PolarHBondContact O-N 3.46Å; L296-S299 PolarHBondContact O-OG 2.75Å; L296-A424 HydrophobicContact CB-CB 4.13Å; L296-A424 VanDerWaalsContact CD1-O 3.24Å; L296-A424 WeakPolarHBondContact CD1-O 3.25Å; L296-R427 HydrophobicContact CD1-CB 3.8Å; L296-R427 HydrophobicContact CD1-CG 4.29Å
297C85.5Confident85.4Confident70 Ų7038.2 Ų38.247%0.47319%0.194SC..Hα-helixtrans-62.6-41.9-178.3-70.80000112.1L293 I294 S299 I300 P301L293-C297 PolarHBondContact O-N 3.31Å; L293-C297 PolarHBondContact O-SG 3.03Å; L293-C297 VanDerWaalsContact O-SG 3.41Å; I294-C297 PolarHBondContact O-N 3.2Å; C297-S299 VanDerWaalsContact C-N 3.34Å; C297-S299 PolarHBondContact O-N 3.34Å; C297-I300 PolarHBondContact O-N 2.8Å; C297-P301 WeakPolarHBondContact O-CD 3.3Å
298N83.9Confident85.3Confident13 Ų1337 Ų377%0.0719%0.189CC..Hα-helixtrans-73.5-23.8179.2-76.9-81.4000113.2I294 L296 I300 P301 L302 W361 V397I294-N298 WeakPolarHBondContact CG2-ND2 3.46Å; I294-N298 WeakPolarHBondContact O-CB 3.19Å; I294-N298 PolarHBondContact O-N 3.04Å; I294-N298 PolarHBondContact O-ND2 3.43Å; L296-N298 PolarHBondContact O-N 3.32Å; N298-I300 PolarHBondContact O-N 3.16Å; N298-P301 WeakPolarHBondContact O-CD 3.09Å; N298-P301 WeakPolarHBondContact O-CG 3.31Å; N298-L302 WeakPolarHBondContact O-CB 3.21Å; N298-L302 PolarHBondContact O-N 2.99Å; N298-W361 HydrophobicContact CB-CH2 4.43Å; N298-W361 HydrophobicContact CB-CZ3 4.03Å; N298-W361 WeakPolarHBondContact OD1-CZ3 3.39Å; N298-V397 HydrophobicContact CB-CG1 4.12Å; N298-V397 HydrophobicContact CB-CG2 3.97Å
299S81.8Confident85.3Confident3 Ų336.8 Ų36.82%0.02119%0.187CC..Hα-helixtrans-63.2-26.5173.878.30000112.8E295 L296 C297 T303 R428E295-S299 WeakPolarHBondContact O-CB 3.26Å; E295-S299 PolarHBondContact O-N 3.36Å; L296-S299 WeakPolarHBondContact O-CB 3.37Å; L296-S299 PolarHBondContact O-N 3.46Å; L296-S299 PolarHBondContact O-OG 2.75Å; C297-S299 VanDerWaalsContact C-N 3.34Å; C297-S299 PolarHBondContact O-N 3.34Å; S299-T303 PolarHBondContact O-N 3.46Å; S299-T303 PolarHBondContact O-OG1 3.02Å; S299-R428 PolarHBondContact O-NH1 3.47Å; S299-R428 VanDerWaalsContact O-NH1 3.15Å
300I79.3Confident85.3Confident83 Ų8330.5 Ų30.543%0.42616%0.163SC..Hα-helixtrans-65.1-58.3-177.4-60173.4000112.1C297 N298 L302 R428C297-I300 PolarHBondContact O-N 2.8Å; N298-I300 PolarHBondContact O-N 3.16Å; I300-L302 VanDerWaalsContact C-N 3.29Å; I300-L302 PolarHBondContact O-N 3.48Å; I300-R428 HydrophobicContact CG1-CG 4.46Å; I300-R428 PolarHBondContact O-NH1 3.38Å; I300-R428 PolarHBondContact O-NH2 2.74Å
301P80.4Confident85.3Confident14 Ų1427.9 Ų27.99%0.09115%0.149CC..Hα-helixtrans-68.6-30.8176.525.3-34.1000113.4C297 N298 T303 L304 L305 W361 L365C297-P301 WeakPolarHBondContact O-CD 3.3Å; N298-P301 WeakPolarHBondContact O-CD 3.09Å; N298-P301 WeakPolarHBondContact O-CG 3.31Å; P301-T303 PolarHBondContact O-N 3.2Å; P301-L304 PolarHBondContact O-N 3.49Å; P301-L305 PolarHBondContact O-N 2.94Å; P301-W361 HydrophobicContact CB-CZ2 3.75Å; P301-W361 HydrophobicContact CG-CD2 4.32Å; P301-W361 HydrophobicContact CG-CH2 4.04Å; P301-W361 HydrophobicContact CG-CZ2 3.54Å; P301-L365 HydrophobicContact CB-CD1 3.21Å; P301-L365 HydrophobicContact CB-CD2 3.56Å; P301-L365 HydrophobicContact CB-CG 3.97Å; P301-L365 HydrophobicContact CG-CD1 3.65Å
302L84.8Confident85.4Confident16 Ų1630 Ų308%0.08416%0.158CC..Hα-helixtrans-56.1-54.1178.5169.556.8000111.6Y39 F73 N298 I300 L304 L305 T306 W361 L394Y39-L302 HydrophobicContact CE1-CD1 3.98Å; F73-L302 HydrophobicContact CD1-CD2 4.24Å; F73-L302 HydrophobicContact CE1-CD1 4.47Å; F73-L302 HydrophobicContact CE1-CD2 3.71Å; F73-L302 HydrophobicContact CE1-CG 4.17Å; F73-L302 HydrophobicContact CE2-CD1 4.25Å; F73-L302 HydrophobicContact CE2-CD2 4.33Å; F73-L302 HydrophobicContact CE2-CG 3.92Å; F73-L302 HydrophobicContact CZ-CD1 3.76Å; F73-L302 HydrophobicContact CZ-CD2 3.76Å; F73-L302 HydrophobicContact CZ-CG 3.68Å; N298-L302 WeakPolarHBondContact O-CB 3.21Å; N298-L302 PolarHBondContact O-N 2.99Å; I300-L302 VanDerWaalsContact C-N 3.29Å; I300-L302 PolarHBondContact O-N 3.48Å; L302-L304 VanDerWaalsContact C-N 3.27Å; L302-L304 PolarHBondContact O-N 3.08Å; L302-L305 PolarHBondContact O-N 3Å; L302-T306 HydrophobicContact CD1-CG2 3.68Å; L302-T306 WeakPolarHBondContact O-CG2 3.45Å; L302-T306 PolarHBondContact O-N 2.84Å; L302-T306 PolarHBondContact O-OG1 3.49Å; L302-T306 VanDerWaalsContact O-OG1 3.1Å; L302-W361 HydrophobicContact CB-CH2 4.22Å; L302-W361 HydrophobicContact CB-CZ2 4.47Å; L302-L394 HydrophobicContact CB-CD1 3.91Å; L302-L394 HydrophobicContact CD1-CD1 3.4Å; L302-L394 VanDerWaalsContact CD1-CD1 3.4Å; L302-L394 HydrophobicContact CD1-CD2 3.86Å; L302-L394 HydrophobicContact CD1-CG 4.23Å; L302-L394 HydrophobicContact CD2-CD1 4.34Å; L302-L394 HydrophobicContact CG-CD1 4.04Å
303T83.9Confident85.3Confident4 Ų427.3 Ų27.33%0.02515%0.148CC..Hα-helixtrans-62.5-35.9-179.7-390000112.2V66 S69 A70 F73 S299 P301 T306 S307 R428V66-T303 HydrophobicContact CG1-CG2 4.46Å; S69-T303 VanDerWaalsContact C-CG2 3.48Å; A70-T303 VanDerWaalsContact CA-CG2 3.46Å; A70-T303 HydrophobicContact CB-CG2 3.83Å; F73-T303 HydrophobicContact CD2-CG2 4.34Å; S299-T303 PolarHBondContact O-N 3.46Å; S299-T303 PolarHBondContact O-OG1 3.02Å; P301-T303 PolarHBondContact O-N 3.2Å; T303-T306 PolarHBondContact O-OG1 2.91Å; T303-S307 PolarHBondContact O-N 3.11Å; T303-S307 PolarHBondContact O-OG 3.05Å; T303-R428 PolarHBondContact OG1-NH1 2.93Å
304L81.9Confident85.4Confident85 Ų8523.1 Ų23.145%0.44513%0.126SC..Hα-helixtrans-68.2-45.4-177.5-179.265.2000110.8P301 L302 S308P301-L304 PolarHBondContact O-N 3.49Å; L302-L304 VanDerWaalsContact C-N 3.27Å; L302-L304 PolarHBondContact O-N 3.08Å; L304-S308 VanDerWaalsContact O-CB 3.25Å; L304-S308 WeakPolarHBondContact O-CB 3.18Å; L304-S308 PolarHBondContact O-N 3.46Å; L304-S308 PolarHBondContact O-OG 3.28Å
305L84Confident85.4Confident13 Ų1323.2 Ų23.27%0.06813%0.131CC..Hα-helixtrans-65.8-43.2177.7-73.2170.6000111P301 L302 S307 Y309 W361 L365P301-L305 PolarHBondContact O-N 2.94Å; L302-L305 PolarHBondContact O-N 3Å; L305-S307 VanDerWaalsContact C-N 3.35Å; L305-S307 PolarHBondContact O-N 3.01Å; L305-Y309 HydrophobicContact CD2-CD2 3.86Å; L305-Y309 WeakPolarHBondContact O-CB 3.45Å; L305-Y309 PolarHBondContact O-N 3.23Å; L305-Y309 VanDerWaalsContact O-N 3.14Å; L305-W361 HydrophobicContact CD1-CZ2 4.44Å; L305-L365 HydrophobicContact CD1-CD2 4.3Å
306T84.2Confident85.6Confident0 Ų025 Ų250%014%0.138CC..Hα-helixtrans-68.1-29.7-176.755.60000114.1Y39 T42 S69 F73 L302 T303Y39-T306 HydrophobicContact CD1-CG2 3.73Å; Y39-T306 HydrophobicContact CE1-CG2 3.8Å; T42-T306 WeakPolarHBondContact CA-O 3.25Å; T42-T306 WeakPolarHBondContact CB-O 3.3Å; T42-T306 PolarHBondContact N-O 2.95Å; T42-T306 VanDerWaalsContact OG1-C 3.31Å; T42-T306 WeakPolarHBondContact OG1-CA 3.42Å; T42-T306 PolarHBondContact OG1-O 3.16Å; S69-T306 WeakPolarHBondContact CB-OG1 3.33Å; S69-T306 WeakPolarHBondContact OG-CB 3.27Å; S69-T306 PolarHBondContact OG-OG1 3.42Å; F73-T306 HydrophobicContact CE2-CG2 4.25Å; F73-T306 HydrophobicContact CZ-CG2 4.28Å; L302-T306 HydrophobicContact CD1-CG2 3.68Å; L302-T306 WeakPolarHBondContact O-CG2 3.45Å; L302-T306 PolarHBondContact O-N 2.84Å; L302-T306 PolarHBondContact O-OG1 3.49Å; L302-T306 VanDerWaalsContact O-OG1 3.1Å; T303-T306 PolarHBondContact O-OG1 2.91Å
307S83.6Confident85.7Confident0 Ų024.2 Ų24.20%013%0.134CC..Hα-helixtrans-91.6-34.617758.20000113.5V45 S69 T303 L305V45-S307 WeakPolarHBondContact CG1-O 3.45Å; S69-S307 PolarHBondContact OG-N 3.15Å; T303-S307 PolarHBondContact O-N 3.11Å; T303-S307 PolarHBondContact O-OG 3.05Å; L305-S307 VanDerWaalsContact C-N 3.35Å; L305-S307 PolarHBondContact O-N 3.01Å
308S84.1Confident85.8Confident21 Ų2122.7 Ų22.715%0.14713%0.125CC..Hα-helixtrans-119.5-3.2-160-48.50000114L304 L311 F312L304-S308 VanDerWaalsContact O-CB 3.25Å; L304-S308 WeakPolarHBondContact O-CB 3.18Å; L304-S308 PolarHBondContact O-N 3.46Å; L304-S308 PolarHBondContact O-OG 3.28Å; S308-L311 PolarHBondContact O-N 3.35Å; S308-F312 VanDerWaalsContact O-CB 3.31Å; S308-F312 WeakPolarHBondContact O-CB 3.4Å; S308-F312 PolarHBondContact O-N 2.98Å
309Y89.3Confident86.1Confident3 Ų324.6 Ų24.61%0.01214%0.135CC..Hα-helixtrans-63.8-47.9-175178-102.3000113.5T42 L305 G313 I326 V327 F368 Y383 G387 F391T42-Y309 HydrophobicContact CG2-CD1 3.91Å; T42-Y309 HydrophobicContact CG2-CG 4.33Å; L305-Y309 HydrophobicContact CD2-CD2 3.86Å; L305-Y309 WeakPolarHBondContact O-CB 3.45Å; L305-Y309 PolarHBondContact O-N 3.23Å; L305-Y309 VanDerWaalsContact O-N 3.14Å; Y309-G313 PolarHBondContact O-N 3.38Å; Y309-G313 VanDerWaalsContact O-N 3.11Å; Y309-I326 HydrophobicContact CE1-CG2 4.35Å; Y309-I326 WeakPolarHBondContact OH-CG2 3.16Å; Y309-V327 HydrophobicContact CD1-CG2 4Å; Y309-V327 HydrophobicContact CE1-CG2 4.1Å; Y309-F368 HydrophobicContact CD2-CE1 4.42Å; Y309-F368 HydrophobicContact CD2-CE2 4.07Å; Y309-F368 AromaticContact CD2-CZ 3.55Å; Y309-F368 HydrophobicContact CD2-CZ 3.55Å; Y309-F368 AromaticContact CE2-CE2 3.7Å; Y309-F368 HydrophobicContact CE2-CE2 3.7Å; Y309-F368 AromaticContact CE2-CZ 3.63Å; Y309-F368 HydrophobicContact CE2-CZ 3.63Å; Y309-Y383 VanDerWaalsContact CD1-OH 3.28Å; Y309-Y383 WeakPolarHBondContact CD1-OH 3.38Å; Y309-Y383 HydrophobicContact CD2-CE2 4.2Å; Y309-Y383 AromaticContact CE1-CE1 3.89Å; Y309-Y383 HydrophobicContact CE1-CE1 3.89Å; Y309-Y383 HydrophobicContact CE1-CE2 4.23Å; Y309-Y383 AromaticContact CE1-CZ 3.5Å; Y309-Y383 WeakPolarHBondContact CE1-OH 3.16Å; Y309-Y383 HydrophobicContact CE2-CD2 4.33Å; Y309-Y383 AromaticContact CE2-CE2 3.69Å; Y309-Y383 HydrophobicContact CE2-CE2 3.69Å; Y309-Y383 AromaticContact CE2-CZ 3.84Å; Y309-Y383 AromaticContact CZ-CE1 3.74Å; Y309-Y383 AromaticContact CZ-CE2 3.68Å; Y309-Y383 AromaticContact CZ-CZ 3.35Å; Y309-Y383 PolarHBondContact O-OH 3.35Å; Y309-Y383 WeakPolarHBondContact OH-CE1 3.35Å; Y309-Y383 PolarHBondContact OH-O 2.97Å; Y309-G387 WeakPolarHBondContact OH-CA 3.34Å; Y309-F391 HydrophobicContact CD1-CE2 4.21Å; Y309-F391 HydrophobicContact CE1-CE2 4.42Å; Y309-F391 HydrophobicContact CG-CE2 4.3Å
310K91.5Very high86.6Confident0 Ų024.5 Ų24.50%013%0.134CC..Hα-helixtrans-67.4-41.5175.4-173.4171.8177.3-1780111.5T42 N43 P46 Y47 F312 G313 Q314 D320 L323 T324T42-K310 HydrophobicContact CG2-CB 3.96Å; T42-K310 WeakPolarHBondContact O-CB 3.44Å; N43-K310 WeakPolarHBondContact OD1-CD 3.39Å; N43-K310 PolarHBondContact OD1-NZ 2.9Å; P46-K310 HydrophobicContact CG-CB 4.13Å; P46-K310 HydrophobicContact CG-CD 4.05Å; P46-K310 HydrophobicContact CG-CG 4.02Å; Y47-K310 PolarHBondContact OH-NZ 2.97Å; K310-F312 VanDerWaalsContact C-N 3.3Å; K310-F312 PolarHBondContact O-N 3.3Å; K310-G313 CarbonylContact O-C 3.6Å; K310-G313 WeakPolarHBondContact O-CA 3.29Å; K310-G313 PolarHBondContact O-N 3.34Å; K310-G313 VanDerWaalsContact O-N 3.09Å; K310-Q314 HydrophobicContact CG-CG 4.44Å; K310-Q314 WeakPolarHBondContact O-CG 3.04Å; K310-Q314 PolarHBondContact O-N 3.33Å; K310-D320 WeakPolarHBondContact CE-OD1 3.47Å; K310-D320 IonicContact NZ-OD1 3.35Å; K310-D320 PolarHBondContact NZ-OD1 3.49Å; K310-L323 HydrophobicContact CG-CB 4.18Å; K310-L323 HydrophobicContact CG-CD1 4.26Å; K310-T324 PolarHBondContact NZ-OG1 3.48Å
311L88.1Confident87.2Confident34 Ų3424.9 Ų24.918%0.17813%0.133CC..Hα-helixtrans-60.4-39.9178.1-172.772.9000112.1V62 S308 Q314 S315V62-L311 HydrophobicContact CG1-CD1 3.75Å; V62-L311 HydrophobicContact CG1-CD2 3.24Å; V62-L311 HydrophobicContact CG1-CG 4.01Å; S308-L311 PolarHBondContact O-N 3.35Å; L311-Q314 PolarHBondContact O-N 2.91Å; L311-S315 PolarHBondContact O-N 3.35Å
312F89.3Confident87.8Confident52 Ų5226.7 Ų26.723%0.22814%0.138CC..Hα-helixtrans-63.3-46.9171.8178.7-102.4000111S308 K310 Q314 S315 F316 F368 Y383S308-F312 VanDerWaalsContact O-CB 3.31Å; S308-F312 WeakPolarHBondContact O-CB 3.4Å; S308-F312 PolarHBondContact O-N 2.98Å; K310-F312 VanDerWaalsContact C-N 3.3Å; K310-F312 PolarHBondContact O-N 3.3Å; F312-Q314 VanDerWaalsContact C-N 3.28Å; F312-Q314 PolarHBondContact O-N 2.96Å; F312-S315 WeakPolarHBondContact O-CB 3.26Å; F312-S315 PolarHBondContact O-N 2.87Å; F312-S315 VanDerWaalsContact O-N 3.12Å; F312-S315 PolarHBondContact O-OG 2.99Å; F312-F316 AromaticContact CD1-CE1 3.82Å; F312-F316 HydrophobicContact CD1-CE1 3.82Å; F312-F316 HydrophobicContact CD1-CZ 4.26Å; F312-F316 AromaticContact CE1-CE1 3.61Å; F312-F316 HydrophobicContact CE1-CE1 3.61Å; F312-F316 HydrophobicContact CE1-CZ 4.01Å; F312-F316 HydrophobicContact CG-CE1 4.45Å; F312-F316 HydrophobicContact CZ-CE1 4.05Å; F312-F316 VanDerWaalsContact O-CE1 3.22Å; F312-F316 WeakPolarHBondContact O-CE1 3.32Å; F312-F368 HydrophobicContact CB-CE1 4.44Å; F312-F368 HydrophobicContact CD1-CD1 4.27Å; F312-F368 AromaticContact CD1-CE1 3.36Å; F312-F368 HydrophobicContact CD1-CE1 3.36Å; F312-F368 HydrophobicContact CD1-CE2 4.27Å; F312-F368 AromaticContact CD1-CZ 3.36Å; F312-F368 HydrophobicContact CD1-CZ 3.36Å; F312-F368 HydrophobicContact CE1-CD1 4.11Å; F312-F368 AromaticContact CE1-CE1 3.61Å; F312-F368 HydrophobicContact CE1-CE1 3.61Å; F312-F368 HydrophobicContact CE1-CE2 4.21Å; F312-F368 AromaticContact CE1-CZ 3.68Å; F312-F368 HydrophobicContact CE1-CZ 3.68Å; F312-F368 AromaticContact CG-CE1 3.89Å; F312-F368 HydrophobicContact CG-CE1 3.89Å; F312-F368 HydrophobicContact CG-CZ 4.25Å; F312-F368 HydrophobicContact CZ-CE1 4.35Å; F312-Y383 HydrophobicContact CD1-CE2 4.3Å
313G88.6Confident88.2Confident0 Ų026 Ų260%013%0.134CC..Hα-helixtrans-57.2-39.5175.200000113.2Y309 K310 S315 F316 I317Y309-G313 PolarHBondContact O-N 3.38Å; Y309-G313 VanDerWaalsContact O-N 3.11Å; K310-G313 CarbonylContact O-C 3.6Å; K310-G313 WeakPolarHBondContact O-CA 3.29Å; K310-G313 PolarHBondContact O-N 3.34Å; K310-G313 VanDerWaalsContact O-N 3.09Å; G313-S315 PolarHBondContact O-N 3.04Å; G313-F316 PolarHBondContact O-N 3.15Å; G313-I317 WeakPolarHBondContact O-CA 3.34Å; G313-I317 WeakPolarHBondContact O-CB 3.44Å; G313-I317 PolarHBondContact O-N 3.27Å
314Q90.4Very high88.6Confident3 Ų326.1 Ų26.11%0.01414%0.135CC..Hα-helixtrans-63.4-21.5178.5-74.1174.7-37.300114.1P46 V197 K310 L311 F312 F316 I317 L323P46-Q314 VanDerWaalsContact CB-OE1 3.26Å; V197-Q314 HydrophobicContact CG1-CG 4.34Å; K310-Q314 HydrophobicContact CG-CG 4.44Å; K310-Q314 WeakPolarHBondContact O-CG 3.04Å; K310-Q314 PolarHBondContact O-N 3.33Å; L311-Q314 PolarHBondContact O-N 2.91Å; F312-Q314 VanDerWaalsContact C-N 3.28Å; F312-Q314 PolarHBondContact O-N 2.96Å; Q314-F316 VanDerWaalsContact C-N 3.26Å; Q314-F316 PolarHBondContact O-N 3.4Å; Q314-I317 WeakPolarHBondContact CA-O 3.22Å; Q314-L323 HydrophobicContact CB-CD1 4.29Å; Q314-L323 HydrophobicContact CG-CD1 3.39Å
315S87.5Confident89.1Confident47 Ų4726.6 Ų26.633%0.32914%0.137SC..THydrogen-bonded Turntrans-67.7-26179.570.90000113.3L311 F312 G313L311-S315 PolarHBondContact O-N 3.35Å; F312-S315 WeakPolarHBondContact O-CB 3.26Å; F312-S315 PolarHBondContact O-N 2.87Å; F312-S315 VanDerWaalsContact O-N 3.12Å; F312-S315 PolarHBondContact O-OG 2.99Å; G313-S315 PolarHBondContact O-N 3.04Å
316F88Confident89.6Confident42 Ų4226.2 Ų26.218%0.18414%0.135CC..THydrogen-bonded Turntrans-127.2-14.5178.355.6-87.3000113.9F312 G313 Q314 I371 A379 Y383F312-F316 AromaticContact CD1-CE1 3.82Å; F312-F316 HydrophobicContact CD1-CE1 3.82Å; F312-F316 HydrophobicContact CD1-CZ 4.26Å; F312-F316 AromaticContact CE1-CE1 3.61Å; F312-F316 HydrophobicContact CE1-CE1 3.61Å; F312-F316 HydrophobicContact CE1-CZ 4.01Å; F312-F316 HydrophobicContact CG-CE1 4.45Å; F312-F316 HydrophobicContact CZ-CE1 4.05Å; F312-F316 VanDerWaalsContact O-CE1 3.22Å; F312-F316 WeakPolarHBondContact O-CE1 3.32Å; G313-F316 PolarHBondContact O-N 3.15Å; Q314-F316 VanDerWaalsContact C-N 3.26Å; Q314-F316 PolarHBondContact O-N 3.4Å; F316-I371 HydrophobicContact CE2-CG2 4.03Å; F316-I371 HydrophobicContact CZ-CG2 3.9Å; F316-A379 HydrophobicContact CD2-CB 3.82Å; F316-A379 HydrophobicContact CE2-CB 4.04Å; F316-Y383 HydrophobicContact CE2-CD2 4.47Å; F316-Y383 AromaticContact CZ-CD2 3.82Å; F316-Y383 HydrophobicContact CZ-CD2 3.82Å; F316-Y383 HydrophobicContact CZ-CE2 4.46Å; F316-Y383 HydrophobicContact CZ-CG 4.34Å
317I89.6Confident89.9Confident6 Ų626.3 Ų26.33%0.03114%0.136CC..  trans-117.8110.7176.5-58.2165.7000109.9G313 Q314 D319 Y322 L323 K380 Y383G313-I317 WeakPolarHBondContact O-CA 3.34Å; G313-I317 WeakPolarHBondContact O-CB 3.44Å; G313-I317 PolarHBondContact O-N 3.27Å; Q314-I317 WeakPolarHBondContact CA-O 3.22Å; I317-D319 VanDerWaalsContact C-N 3.33Å; I317-D319 HydrophobicContact CG2-CB 4.17Å; I317-D319 PolarHBondContact O-N 2.9Å; I317-Y322 HydrophobicContact CD1-CD1 4.29Å; I317-Y322 HydrophobicContact CD1-CE1 3.96Å; I317-Y322 HydrophobicContact CG2-CD1 3.94Å; I317-L323 HydrophobicContact CB-CD2 4.14Å; I317-L323 HydrophobicContact CB-CG 4.41Å; I317-L323 HydrophobicContact CD1-CD2 4Å; I317-L323 HydrophobicContact CG2-CD2 4.22Å; I317-L323 HydrophobicContact CG2-CG 4.14Å; I317-K380 HydrophobicContact CD1-CG 3.94Å; I317-K380 HydrophobicContact CG1-CG 4.11Å; I317-Y383 HydrophobicContact CD1-CD1 4.27Å; I317-Y383 HydrophobicContact CD1-CG 4.33Å
318S88.1Confident90.3Very high38 Ų3827.5 Ų27.527%0.26614%0.143SC..  trans-81-9179.5-49.80000114.6P196 R202 D320P196-S318 WeakPolarHBondContact CA-O 3.41Å; R202-S318 PolarHBondContact NH1-OG 2.8Å; S318-D320 PolarHBondContact O-N 3.44Å
319D90.6Very high90.7Very high53 Ų5330.1 Ų30.128%0.28315%0.154SC..  trans-84.9104.2-176.8-175.6-9.1000111.7N194 I317 K321 Y322 L323N194-D319 PolarHBondContact ND2-OD1 3.46Å; N194-D319 PolarHBondContact OD1-OD1 2.76Å; I317-D319 VanDerWaalsContact C-N 3.33Å; I317-D319 HydrophobicContact CG2-CB 4.17Å; I317-D319 PolarHBondContact O-N 2.9Å; D319-K321 PolarHBondContact OD1-N 2.98Å; D319-Y322 VanDerWaalsContact CG-CB 3.46Å; D319-Y322 PolarHBondContact O-N 3.36Å; D319-Y322 PolarHBondContact OD1-N 2.83Å; D319-Y322 VanDerWaalsContact OD1-N 3.13Å; D319-Y322 WeakPolarHBondContact OD2-CB 3.19Å; D319-L323 WeakPolarHBondContact O-CG 3.33Å; D319-L323 PolarHBondContact O-N 2.81Å; D319-L323 VanDerWaalsContact O-N 3.17Å
320D91.6Very high90.8Very high1 Ų130.1 Ų30.11%0.00515%0.154CC..Hα-helixtrans-70-39.8-174.6-175.842.2000113.4Y47 N191 N194 F204 K310 S318 Y322 L323 T324Y47-D320 PolarHBondContact OH-OD1 2.88Å; Y47-D320 VanDerWaalsContact OH-OD1 3.09Å; Y47-D320 PolarHBondContact OH-OD2 2.77Å; N191-D320 PolarHBondContact ND2-OD2 3.04Å; N194-D320 WeakPolarHBondContact OD1-CB 3.31Å; N194-D320 PolarHBondContact OD1-N 3.1Å; F204-D320 HydrophobicContact CE1-CB 4.33Å; F204-D320 HydrophobicContact CZ-CB 3.91Å; F204-D320 VanDerWaalsContact CZ-CG 3.43Å; F204-D320 WeakPolarHBondContact CZ-OD1 3.4Å; K310-D320 WeakPolarHBondContact CE-OD1 3.47Å; K310-D320 IonicContact NZ-OD1 3.35Å; K310-D320 PolarHBondContact NZ-OD1 3.49Å; S318-D320 PolarHBondContact O-N 3.44Å; D320-Y322 VanDerWaalsContact C-N 3.35Å; D320-L323 PolarHBondContact O-N 3.24Å; D320-T324 WeakPolarHBondContact O-CB 3.34Å; D320-T324 PolarHBondContact O-N 3.22Å; D320-T324 PolarHBondContact O-OG1 2.98Å
321K91.8Very high90.7Very high91 Ų9130.2 Ų30.240%0.39616%0.155SC..Hα-helixtrans-62.3-43.3174.2-80.6-179.9-175.21650110.6P192 N194 D319 T324 I325P192-K321 WeakPolarHBondContact O-CE 3.3Å; P192-K321 PolarHBondContact O-NZ 3.12Å; N194-K321 HydrophobicContact CB-CD 3.63Å; N194-K321 HydrophobicContact CB-CG 3.89Å; N194-K321 WeakPolarHBondContact OD1-CB 3.29Å; N194-K321 WeakPolarHBondContact OD1-CG 3.48Å; N194-K321 PolarHBondContact OD1-N 3.3Å; D319-K321 PolarHBondContact OD1-N 2.98Å; K321-T324 PolarHBondContact O-N 3.23Å; K321-I325 VanDerWaalsContact O-CG1 3.27Å; K321-I325 WeakPolarHBondContact O-CG1 3.5Å; K321-I325 PolarHBondContact O-N 2.8Å
322Y93.2Very high90.9Very high51 Ų5131.9 Ų31.920%0.217%0.166CC..Hα-helixtrans-57.5-51.7175177.5-94.7000111.5I317 D319 D320 T324 I325 I326 K380I317-Y322 HydrophobicContact CD1-CD1 4.29Å; I317-Y322 HydrophobicContact CD1-CE1 3.96Å; I317-Y322 HydrophobicContact CG2-CD1 3.94Å; D319-Y322 VanDerWaalsContact CG-CB 3.46Å; D319-Y322 PolarHBondContact O-N 3.36Å; D319-Y322 PolarHBondContact OD1-N 2.83Å; D319-Y322 VanDerWaalsContact OD1-N 3.13Å; D319-Y322 WeakPolarHBondContact OD2-CB 3.19Å; D320-Y322 VanDerWaalsContact C-N 3.35Å; Y322-T324 VanDerWaalsContact C-N 3.28Å; Y322-T324 PolarHBondContact O-N 2.93Å; Y322-I325 PolarHBondContact O-N 3.31Å; Y322-I325 VanDerWaalsContact O-N 3.15Å; Y322-I326 HydrophobicContact CD1-CG1 4.18Å; Y322-I326 HydrophobicContact CE1-CD1 4.32Å; Y322-I326 HydrophobicContact CE1-CG1 3.68Å; Y322-I326 HydrophobicContact CE2-CD1 4.17Å; Y322-I326 HydrophobicContact CE2-CG1 4.28Å; Y322-I326 WeakPolarHBondContact O-CG1 3.19Å; Y322-I326 PolarHBondContact O-N 3.3Å; Y322-K380 HydrophobicContact CE1-CB 4.05Å; Y322-K380 HydrophobicContact CE1-CD 4.31Å; Y322-K380 HydrophobicContact CE1-CG 3.96Å; Y322-K380 HydrophobicContact CE2-CD 4.42Å; Y322-K380 VanDerWaalsContact OH-C 3.28Å; Y322-K380 WeakPolarHBondContact OH-CB 3.48Å; Y322-K380 PolarHBondContact OH-O 3.38Å
323L92.8Very high91Very high1 Ų133 Ų331%0.00517%0.171CC..Hα-helixtrans-60.4-39179.7-69.2175.5000112.3K310 Q314 I317 D319 D320 I326 V327 Y383K310-L323 HydrophobicContact CG-CB 4.18Å; K310-L323 HydrophobicContact CG-CD1 4.26Å; Q314-L323 HydrophobicContact CB-CD1 4.29Å; Q314-L323 HydrophobicContact CG-CD1 3.39Å; I317-L323 HydrophobicContact CB-CD2 4.14Å; I317-L323 HydrophobicContact CB-CG 4.41Å; I317-L323 HydrophobicContact CD1-CD2 4Å; I317-L323 HydrophobicContact CG2-CD2 4.22Å; I317-L323 HydrophobicContact CG2-CG 4.14Å; D319-L323 WeakPolarHBondContact O-CG 3.33Å; D319-L323 PolarHBondContact O-N 2.81Å; D319-L323 VanDerWaalsContact O-N 3.17Å; D320-L323 PolarHBondContact O-N 3.24Å; L323-I326 PolarHBondContact O-N 3.48Å; L323-V327 WeakPolarHBondContact O-CG2 3.23Å; L323-V327 PolarHBondContact O-N 3.24Å; L323-Y383 HydrophobicContact CD2-CD1 4.16Å; L323-Y383 HydrophobicContact CD2-CE1 3.51Å
324T92.6Very high91Very high7 Ų733 Ų334%0.04317%0.171CC..Hα-helixtrans-65.3-41.1176.5-550000111.6N43 T187 K310 D320 K321 Y322 I326 V327 T328N43-T324 PolarHBondContact OD1-OG1 3.35Å; T187-T324 HydrophobicContact CG2-CG2 4.22Å; T187-T324 WeakPolarHBondContact OG1-CG2 3.09Å; T187-T324 PolarHBondContact OG1-OG1 2.96Å; K310-T324 PolarHBondContact NZ-OG1 3.48Å; D320-T324 WeakPolarHBondContact O-CB 3.34Å; D320-T324 PolarHBondContact O-N 3.22Å; D320-T324 PolarHBondContact O-OG1 2.98Å; K321-T324 PolarHBondContact O-N 3.23Å; Y322-T324 VanDerWaalsContact C-N 3.28Å; Y322-T324 PolarHBondContact O-N 2.93Å; T324-I326 VanDerWaalsContact C-N 3.35Å; T324-V327 PolarHBondContact O-N 2.86Å; T324-T328 WeakPolarHBondContact O-CB 3.21Å; T324-T328 PolarHBondContact O-N 2.86Å; T324-T328 PolarHBondContact O-OG1 2.94Å
325I93.2Very high91Very high96 Ų9633.1 Ų33.149%0.49217%0.173SC..Hα-helixtrans-61.4-44.9174.9-70.4164.2000110.1K321 Y322 V327 T328 M329K321-I325 VanDerWaalsContact O-CG1 3.27Å; K321-I325 WeakPolarHBondContact O-CG1 3.5Å; K321-I325 PolarHBondContact O-N 2.8Å; Y322-I325 PolarHBondContact O-N 3.31Å; Y322-I325 VanDerWaalsContact O-N 3.15Å; I325-V327 PolarHBondContact O-N 2.55Å; I325-T328 CarbonylContact O-C 3.57Å; I325-T328 WeakPolarHBondContact O-CB 3.36Å; I325-T328 PolarHBondContact O-N 3.34Å; I325-T328 VanDerWaalsContact O-N 3.12Å; I325-M329 HydrophobicContact CG2-CG 4.38Å; I325-M329 HydrophobicContact CG2-SD 4.22Å; I325-M329 WeakPolarHBondContact O-CG 3.48Å; I325-M329 PolarHBondContact O-N 3.09Å
326I93Very high91.1Very high5 Ų532.9 Ų32.93%0.02617%0.171CC..Hα-helixtrans-60.2-48.1176.6-61.9-50.8000111Y309 Y322 L323 T324 T328 M329 T330 Y383 C384Y309-I326 HydrophobicContact CE1-CG2 4.35Å; Y309-I326 WeakPolarHBondContact OH-CG2 3.16Å; Y322-I326 HydrophobicContact CD1-CG1 4.18Å; Y322-I326 HydrophobicContact CE1-CD1 4.32Å; Y322-I326 HydrophobicContact CE1-CG1 3.68Å; Y322-I326 HydrophobicContact CE2-CD1 4.17Å; Y322-I326 HydrophobicContact CE2-CG1 4.28Å; Y322-I326 WeakPolarHBondContact O-CG1 3.19Å; Y322-I326 PolarHBondContact O-N 3.3Å; L323-I326 PolarHBondContact O-N 3.48Å; T324-I326 VanDerWaalsContact C-N 3.35Å; I326-T328 PolarHBondContact O-N 3.39Å; I326-M329 HydrophobicContact CD1-SD 4.38Å; I326-M329 WeakPolarHBondContact O-CB 3.39Å; I326-M329 PolarHBondContact O-N 3.03Å; I326-M329 VanDerWaalsContact O-N 3.07Å; I326-T330 HydrophobicContact CG2-CG2 4.34Å; I326-T330 WeakPolarHBondContact O-CG2 3.35Å; I326-T330 PolarHBondContact O-N 2.66Å; I326-Y383 HydrophobicContact CB-CD1 4.49Å; I326-Y383 HydrophobicContact CB-CE1 4.21Å; I326-Y383 HydrophobicContact CG1-CD1 4.43Å; I326-Y383 HydrophobicContact CG2-CD1 3.97Å; I326-Y383 HydrophobicContact CG2-CE1 3.8Å; I326-C384 HydrophobicContact CD1-CB 3.77Å
327V90.7Very high91.1Very high2 Ų230.9 Ų30.91%0.01216%0.162CC..Hα-helixtrans-59.2-32.6175.8171.60000112.3T42 Y309 L323 T324 I325 T330 A331T42-V327 HydrophobicContact CG2-CG1 4.38Å; T42-V327 HydrophobicContact CG2-CG2 3.9Å; Y309-V327 HydrophobicContact CD1-CG2 4Å; Y309-V327 HydrophobicContact CE1-CG2 4.1Å; L323-V327 WeakPolarHBondContact O-CG2 3.23Å; L323-V327 PolarHBondContact O-N 3.24Å; T324-V327 PolarHBondContact O-N 2.86Å; I325-V327 PolarHBondContact O-N 2.55Å; V327-T330 PolarHBondContact O-OG1 3.19Å; V327-A331 PolarHBondContact O-N 2.71Å
328T92Very high91.1Very high24 Ų2430.6 Ų30.615%0.14716%0.161CC..Hα-helixtrans-72.6-40.7175.2-54.20000111L180 P184 T324 I325 I326 A331 V332L180-T328 HydrophobicContact CB-CG2 4.45Å; L180-T328 HydrophobicContact CG-CG2 4.09Å; P184-T328 HydrophobicContact CG-CG2 3.87Å; T324-T328 WeakPolarHBondContact O-CB 3.21Å; T324-T328 PolarHBondContact O-N 2.86Å; T324-T328 PolarHBondContact O-OG1 2.94Å; I325-T328 CarbonylContact O-C 3.57Å; I325-T328 WeakPolarHBondContact O-CB 3.36Å; I325-T328 PolarHBondContact O-N 3.34Å; I325-T328 VanDerWaalsContact O-N 3.12Å; I326-T328 PolarHBondContact O-N 3.39Å; T328-A331 VanDerWaalsContact O-CB 3.3Å; T328-A331 WeakPolarHBondContact O-CB 3.49Å; T328-A331 PolarHBondContact O-N 3.06Å; T328-V332 PolarHBondContact O-N 3.1Å
329M92.4Very high91Very high77 Ų7731.6 Ų31.638%0.37916%0.162SC..Hα-helixtrans-65.1-42.6175.6-70.5-177.673.500111.7I325 I326 A331 V332 F333 I388I325-M329 HydrophobicContact CG2-CG 4.38Å; I325-M329 HydrophobicContact CG2-SD 4.22Å; I325-M329 WeakPolarHBondContact O-CG 3.48Å; I325-M329 PolarHBondContact O-N 3.09Å; I326-M329 HydrophobicContact CD1-SD 4.38Å; I326-M329 WeakPolarHBondContact O-CB 3.39Å; I326-M329 PolarHBondContact O-N 3.03Å; I326-M329 VanDerWaalsContact O-N 3.07Å; M329-A331 PolarHBondContact O-N 3.16Å; M329-V332 WeakPolarHBondContact O-CB 3.44Å; M329-V332 PolarHBondContact O-N 3.02Å; M329-F333 WeakPolarHBondContact O-CD2 3.42Å; M329-F333 PolarHBondContact O-N 2.7Å; M329-I388 HydrophobicContact CE-CD1 4.34Å
330T91.3Very high90.9Very high2 Ų231.9 Ų31.91%0.01216%0.164CC..Hα-helixtrans-60.4-30.9176.864.60000111.9I326 V327 F333 N334 G387 F391I326-T330 HydrophobicContact CG2-CG2 4.34Å; I326-T330 WeakPolarHBondContact O-CG2 3.35Å; I326-T330 PolarHBondContact O-N 2.66Å; V327-T330 PolarHBondContact O-OG1 3.19Å; T330-F333 PolarHBondContact O-N 3.19Å; T330-N334 VanDerWaalsContact O-CB 3.27Å; T330-N334 WeakPolarHBondContact O-CB 3.35Å; T330-N334 PolarHBondContact O-N 3.32Å; T330-G387 WeakPolarHBondContact CG2-O 3.33Å; T330-F391 HydrophobicContact CG2-CD2 3.8Å; T330-F391 HydrophobicContact CG2-CE2 4.38Å; T330-F391 HydrophobicContact CG2-CG 4.41Å
331A90.3Very high90.6Very high2 Ų232.9 Ų32.92%0.01717%0.167CC..Hα-helixtrans-65.2-39.117400000113L180 V327 T328 M329 N334 A335L180-A331 HydrophobicContact CB-CB 4Å; V327-A331 PolarHBondContact O-N 2.71Å; T328-A331 VanDerWaalsContact O-CB 3.3Å; T328-A331 WeakPolarHBondContact O-CB 3.49Å; T328-A331 PolarHBondContact O-N 3.06Å; M329-A331 PolarHBondContact O-N 3.16Å; A331-N334 PolarHBondContact O-N 2.78Å; A331-A335 WeakPolarHBondContact O-CB 3.35Å; A331-A335 PolarHBondContact O-N 2.65Å
332V92.2Very high89.9Confident69 Ų6928.6 Ų28.642%0.41815%0.149SC..Hα-helixtrans-58.6-49.9173.4-178.60000110.2L180 T328 M329 N334 A335 S336L180-V332 HydrophobicContact CD1-CG2 3.32Å; T328-V332 PolarHBondContact O-N 3.1Å; M329-V332 WeakPolarHBondContact O-CB 3.44Å; M329-V332 PolarHBondContact O-N 3.02Å; V332-N334 VanDerWaalsContact C-N 3.34Å; V332-N334 PolarHBondContact O-N 3.48Å; V332-A335 PolarHBondContact O-N 3.15Å; V332-S336 PolarHBondContact O-N 3.01Å; V332-S336 PolarHBondContact O-OG 2.93Å
333F91.2Very high89.3Confident76 Ų7626.7 Ų26.733%0.33314%0.142SC..Hα-helixtrans-69.9-31.2-178.7-76.3-84.4000112.9M329 T330 S336 G337 I388 L392M329-F333 WeakPolarHBondContact O-CD2 3.42Å; M329-F333 PolarHBondContact O-N 2.7Å; T330-F333 PolarHBondContact O-N 3.19Å; F333-S336 WeakPolarHBondContact CA-OG 3.41Å; F333-S336 PolarHBondContact O-OG 3.28Å; F333-G337 WeakPolarHBondContact O-CA 3.42Å; F333-G337 PolarHBondContact O-N 3.34Å; F333-I388 HydrophobicContact CB-CG2 4.06Å; F333-I388 HydrophobicContact CD1-CG2 3.7Å; F333-I388 HydrophobicContact CD2-CB 4.25Å; F333-I388 HydrophobicContact CD2-CD1 4.14Å; F333-I388 HydrophobicContact CD2-CG1 3.83Å; F333-I388 HydrophobicContact CD2-CG2 3.56Å; F333-I388 HydrophobicContact CE1-CG2 3.95Å; F333-I388 HydrophobicContact CE2-CD1 3.8Å; F333-I388 HydrophobicContact CE2-CG1 4.03Å; F333-I388 HydrophobicContact CE2-CG2 3.83Å; F333-I388 HydrophobicContact CG-CG2 3.5Å; F333-I388 VanDerWaalsContact CG-CG2 3.5Å; F333-I388 HydrophobicContact CZ-CD1 4.48Å; F333-I388 HydrophobicContact CZ-CG2 4.01Å; F333-L392 HydrophobicContact CB-CB 4.48Å; F333-L392 WeakPolarHBondContact O-CD1 3.29Å
334N89.5Confident88.9Confident1 Ų128.1 Ų28.11%0.00515%0.15CC..Hα-helixtrans-63.5-46170.9-171.4-17000110.7T330 A331 V332 G337 R338 F391 S395T330-N334 VanDerWaalsContact O-CB 3.27Å; T330-N334 WeakPolarHBondContact O-CB 3.35Å; T330-N334 PolarHBondContact O-N 3.32Å; A331-N334 PolarHBondContact O-N 2.78Å; V332-N334 VanDerWaalsContact C-N 3.34Å; V332-N334 PolarHBondContact O-N 3.48Å; N334-G337 PolarHBondContact O-N 3.46Å; N334-R338 WeakPolarHBondContact O-CG 3.24Å; N334-R338 PolarHBondContact O-N 3.41Å; N334-R338 VanDerWaalsContact O-N 3.14Å; N334-R338 PolarHBondContact OD1-NE 2.72Å; N334-R338 PolarHBondContact OD1-NH2 3.47Å; N334-F391 HydrophobicContact CB-CB 4.27Å; N334-S395 WeakPolarHBondContact O-CB 3.31Å; N334-S395 PolarHBondContact O-OG 3.4Å; N334-S395 WeakPolarHBondContact OD1-CB 3.38Å
335A90.2Very high88.3Confident5 Ų528.8 Ų28.84%0.04115%0.154CC..Hα-helixtrans-66.2-47.7178.100000112.6M177 A331 V332 G337 R338 I339M177-A335 HydrophobicContact CB-CB 4.49Å; M177-A335 HydrophobicContact CG-CB 3.28Å; M177-A335 HydrophobicContact SD-CB 4.12Å; A331-A335 WeakPolarHBondContact O-CB 3.35Å; A331-A335 PolarHBondContact O-N 2.65Å; V332-A335 PolarHBondContact O-N 3.15Å; A335-G337 VanDerWaalsContact C-N 3.29Å; A335-G337 PolarHBondContact O-N 3.28Å; A335-R338 PolarHBondContact O-N 2.95Å; A335-I339 PolarHBondContact O-N 3.24Å
336S90Very high87.4Confident42 Ų4228.1 Ų28.129%0.29415%0.151SC..Hα-helixtrans-64.5-36.6177.466.70000111.7V332 F333 R338 I339 L340V332-S336 PolarHBondContact O-N 3.01Å; V332-S336 PolarHBondContact O-OG 2.93Å; F333-S336 WeakPolarHBondContact CA-OG 3.41Å; F333-S336 PolarHBondContact O-OG 3.28Å; S336-R338 VanDerWaalsContact C-N 3.35Å; S336-R338 PolarHBondContact O-N 3.49Å; S336-I339 PolarHBondContact O-N 3.27Å; S336-L340 WeakPolarHBondContact O-CB 3.44Å; S336-L340 PolarHBondContact O-N 3.05Å
337G88.2Confident86.7Confident0 Ų033.6 Ų33.60%018%0.177CC..Hα-helixtrans-56.7-47.1173.400000111.5F333 N334 A335 I339 L340 W341 S395F333-G337 WeakPolarHBondContact O-CA 3.42Å; F333-G337 PolarHBondContact O-N 3.34Å; N334-G337 PolarHBondContact O-N 3.46Å; A335-G337 VanDerWaalsContact C-N 3.29Å; A335-G337 PolarHBondContact O-N 3.28Å; G337-I339 VanDerWaalsContact C-N 3.33Å; G337-I339 PolarHBondContact O-N 2.92Å; G337-L340 PolarHBondContact O-N 2.98Å; G337-W341 VanDerWaalsContact C-CD1 3.46Å; G337-W341 WeakPolarHBondContact O-CB 3.18Å; G337-W341 PolarHBondContact O-N 3.48Å; G337-S395 WeakPolarHBondContact CA-OG 3.42Å
338R88.3Confident86.1Confident0 Ų039.3 Ų39.30%020%0.201CC..Hα-helixtrans-57.6-45.5178.2-67.4160.1-173.7-87.2-14111.9Y39 V172 N334 A335 S336 G342 S395 S398 T399Y39-R338 PolarHBondContact OH-NH2 3.21Å; V172-R338 HydrophobicContact CG1-CG 4.3Å; V172-R338 VanDerWaalsContact O-CD 3.23Å; V172-R338 WeakPolarHBondContact O-CD 3.27Å; N334-R338 WeakPolarHBondContact O-CG 3.24Å; N334-R338 PolarHBondContact O-N 3.41Å; N334-R338 VanDerWaalsContact O-N 3.14Å; N334-R338 PolarHBondContact OD1-NE 2.72Å; N334-R338 PolarHBondContact OD1-NH2 3.47Å; A335-R338 PolarHBondContact O-N 2.95Å; S336-R338 VanDerWaalsContact C-N 3.35Å; S336-R338 PolarHBondContact O-N 3.49Å; R338-G342 PolarHBondContact O-N 2.96Å; R338-S395 PolarHBondContact N-OG 2.95Å; R338-S398 PolarHBondContact NH1-OG 3.27Å; R338-S398 PolarHBondContact NH2-OG 3.06Å; R338-T399 WeakPolarHBondContact CA-OG1 3.34Å; R338-T399 WeakPolarHBondContact CB-OG1 3.15Å; R338-T399 WeakPolarHBondContact CG-OG1 3.28Å; R338-T399 WeakPolarHBondContact O-CG2 3.3Å
339I86.6Confident85.7Confident58 Ų5841.2 Ų41.230%0.29722%0.216SC..Hα-helixtrans-64.3-47.3177.6-59171.4000110.2A335 S336 G337 G342 T343A335-I339 PolarHBondContact O-N 3.24Å; S336-I339 PolarHBondContact O-N 3.27Å; G337-I339 VanDerWaalsContact C-N 3.33Å; G337-I339 PolarHBondContact O-N 2.92Å; I339-G342 PolarHBondContact O-N 2.86Å; I339-T343 WeakPolarHBondContact O-CG2 3.41Å; I339-T343 PolarHBondContact O-N 3.2Å; I339-T343 PolarHBondContact O-OG1 3.13Å
340L87Confident85.1Confident60 Ų6039.4 Ų39.431%0.31421%0.205SC..Hα-helixtrans-58.6-53.1179.2179.565.7000111.6M1 S336 G337 G342 T343 I344M1-L340 HydrophobicContact CE-CD1 3.75Å; M1-L340 HydrophobicContact SD-CD1 3.31Å; M1-L340 WeakPolarHBondContact SD-CD1 3.17Å; S336-L340 WeakPolarHBondContact O-CB 3.44Å; S336-L340 PolarHBondContact O-N 3.05Å; G337-L340 PolarHBondContact O-N 2.98Å; L340-G342 VanDerWaalsContact C-N 3.34Å; L340-G342 PolarHBondContact O-N 3.39Å; L340-T343 PolarHBondContact O-N 3.19Å; L340-T343 PolarHBondContact O-OG1 2.99Å; L340-I344 HydrophobicContact CD1-CD1 4.12Å; L340-I344 HydrophobicContact CG-CD1 3.89Å; L340-I344 WeakPolarHBondContact O-CG1 3.4Å; L340-I344 PolarHBondContact O-N 3.15Å
341W85.3Confident84.8Confident22 Ų2245 Ų458%0.08323%0.229CC..Hα-helixtrans-65.8-36-179-64.9118.8000112.3G337 T343 I344 V345 P353 I357 L392 F393 S396 V400G337-W341 VanDerWaalsContact C-CD1 3.46Å; G337-W341 WeakPolarHBondContact O-CB 3.18Å; G337-W341 PolarHBondContact O-N 3.48Å; W341-T343 PolarHBondContact O-N 2.97Å; W341-I344 HydrophobicContact CD2-CD1 4.46Å; W341-I344 HydrophobicContact CE3-CD1 3.71Å; W341-I344 HydrophobicContact CZ3-CD1 3.87Å; W341-I344 PolarHBondContact O-N 3.29Å; W341-V345 VanDerWaalsContact O-CG2 3.3Å; W341-V345 WeakPolarHBondContact O-CG2 3.25Å; W341-V345 PolarHBondContact O-N 3.47Å; W341-P353 HydrophobicContact CE3-CB 4.42Å; W341-P353 HydrophobicContact CZ3-CB 4.4Å; W341-I357 HydrophobicContact CD2-CD1 4.1Å; W341-I357 HydrophobicContact CD2-CG1 4.45Å; W341-I357 HydrophobicContact CE3-CD1 3.93Å; W341-I357 HydrophobicContact CE3-CG1 4.36Å; W341-I357 HydrophobicContact CH2-CD1 4.39Å; W341-I357 HydrophobicContact CH2-CG1 3.92Å; W341-I357 HydrophobicContact CZ2-CG1 4.01Å; W341-I357 HydrophobicContact CZ3-CD1 4.08Å; W341-I357 HydrophobicContact CZ3-CG1 4.1Å; W341-L392 PolarHBondContact NE1-O 2.84Å; W341-F393 HydrophobicContact CH2-CD1 4.46Å; W341-F393 HydrophobicContact CH2-CE1 4.29Å; W341-F393 AromaticContact CZ2-CD1 3.78Å; W341-F393 HydrophobicContact CZ2-CD1 3.78Å; W341-F393 AromaticContact CZ2-CE1 3.85Å; W341-F393 HydrophobicContact CZ2-CE1 3.85Å; W341-S396 VanDerWaalsContact CG-CB 3.44Å; W341-V400 HydrophobicContact CB-CG2 4.15Å
342G78.9Confident84.5Confident0 Ų049.8 Ų49.80%025%0.254CS..Hα-helixtrans-57.3-47.8171.500000111.8R338 I339 L340 I344 V345 D346R338-G342 PolarHBondContact O-N 2.96Å; I339-G342 PolarHBondContact O-N 2.86Å; L340-G342 VanDerWaalsContact C-N 3.34Å; L340-G342 PolarHBondContact O-N 3.39Å; G342-I344 PolarHBondContact O-N 3.26Å; G342-V345 PolarHBondContact O-N 3.1Å; G342-D346 PolarHBondContact O-N 3.03Å
343T80.3Confident84.2Confident11 Ų1146.7 Ų46.77%0.06724%0.235CC..Hα-helixtrans-67.7-32.6177.661.80000113.9L166 I339 L340 W341L166-T343 HydrophobicContact CD1-CG2 3.83Å; I339-T343 WeakPolarHBondContact O-CG2 3.41Å; I339-T343 PolarHBondContact O-N 3.2Å; I339-T343 PolarHBondContact O-OG1 3.13Å; L340-T343 PolarHBondContact O-N 3.19Å; L340-T343 PolarHBondContact O-OG1 2.99Å; W341-T343 PolarHBondContact O-N 2.97Å
344I84.7Confident84Confident32 Ų3243.5 Ų43.516%0.16422%0.221CC..Hα-helixtrans-67.8-41.3176.9-71.1168.4000110.1M1 L340 W341 G342 D346 Q347 F348 P353M1-I344 HydrophobicContact CE-CG1 4.31Å; L340-I344 HydrophobicContact CD1-CD1 4.12Å; L340-I344 HydrophobicContact CG-CD1 3.89Å; L340-I344 WeakPolarHBondContact O-CG1 3.4Å; L340-I344 PolarHBondContact O-N 3.15Å; W341-I344 HydrophobicContact CD2-CD1 4.46Å; W341-I344 HydrophobicContact CE3-CD1 3.71Å; W341-I344 HydrophobicContact CZ3-CD1 3.87Å; W341-I344 PolarHBondContact O-N 3.29Å; G342-I344 PolarHBondContact O-N 3.26Å; I344-D346 VanDerWaalsContact C-N 3.3Å; I344-D346 PolarHBondContact O-N 3.14Å; I344-Q347 PolarHBondContact O-N 3.44Å; I344-Q347 VanDerWaalsContact O-N 3.11Å; I344-F348 HydrophobicContact CG2-CD2 4.09Å; I344-F348 WeakPolarHBondContact O-CB 3.3Å; I344-F348 PolarHBondContact O-N 3.28Å; I344-P353 HydrophobicContact CG2-CG 3.81Å
345V79Confident83.9Confident21 Ų2147.8 Ų47.813%0.12725%0.25CC..Hα-helixtrans-68.2-30.5179.31740000112.4W341 G342 Q347 F348 V400 A403W341-V345 VanDerWaalsContact O-CG2 3.3Å; W341-V345 WeakPolarHBondContact O-CG2 3.25Å; W341-V345 PolarHBondContact O-N 3.47Å; G342-V345 PolarHBondContact O-N 3.1Å; V345-Q347 PolarHBondContact O-N 2.96Å; V345-F348 CarbonylContact C-O 3.43Å; V345-V400 HydrophobicContact CG2-CB 4.07Å; V345-V400 HydrophobicContact CG2-CG1 3.7Å; V345-V400 HydrophobicContact CG2-CG2 3.71Å; V345-A403 HydrophobicContact CG1-CB 3.8Å
346D73.5Confident83.8Confident81 Ų8151.4 Ų51.443%0.43327%0.268SS..Hα-helixtrans-67.5-22173.6-72.5-22.8000112.2G165 L166 G342 I344G165-D346 VanDerWaalsContact CA-OD1 3.25Å; G165-D346 WeakPolarHBondContact CA-OD1 3.38Å; G165-D346 WeakPolarHBondContact CA-OD2 3.11Å; G165-D346 PolarHBondContact N-OD1 3.25Å; L166-D346 PolarHBondContact N-OD2 3.48Å; G342-D346 PolarHBondContact O-N 3.03Å; I344-D346 VanDerWaalsContact C-N 3.3Å; I344-D346 PolarHBondContact O-N 3.14Å
347Q78.3Confident83.6Confident120 Ų12049.4 Ų49.456%0.56125%0.254SS*.Hα-helixtrans-105.6-30.8-177.1-66.7177.712.900113.9I344 V345I344-Q347 PolarHBondContact O-N 3.44Å; I344-Q347 VanDerWaalsContact O-N 3.11Å; V345-Q347 PolarHBondContact O-N 2.96Å
348F79.2Confident83.6Confident122 Ų12251.3 Ų51.354%0.53527%0.267SS..SBendtrans-122.9150.5-175.1-66.5-87.1000110.4I344 V345 Y350I344-F348 HydrophobicContact CG2-CD2 4.09Å; I344-F348 WeakPolarHBondContact O-CB 3.3Å; I344-F348 PolarHBondContact O-N 3.28Å; V345-F348 CarbonylContact C-O 3.43Å; F348-Y350 PolarHBondContact O-N 3.03Å
349S83.1Confident83.7Confident65 Ų6556.4 Ų56.446%0.45529%0.294SS..  trans-55.2132.3171.4-177.90000110.7K351 I352 P353S349-K351 PolarHBondContact O-N 2.86Å; S349-I352 PolarHBondContact O-N 3.36Å; S349-P353 WeakPolarHBondContact O-CD 3.31Å
350Y79.4Confident83.8Confident39 Ų3956.8 Ų56.815%0.15330%0.295CS..THydrogen-bonded Turntrans-52.2-22.2179.460.3-90.3000114.5F348 P353 F354 A404 M408F348-Y350 PolarHBondContact O-N 3.03Å; Y350-P353 WeakPolarHBondContact O-CD 3.46Å; Y350-F354 HydrophobicContact CD2-CD2 4.24Å; Y350-F354 HydrophobicContact CD2-CE2 4.39Å; Y350-F354 VanDerWaalsContact O-CD2 3.22Å; Y350-F354 WeakPolarHBondContact O-CD2 3.47Å; Y350-F354 PolarHBondContact O-N 3.46Å; Y350-A404 HydrophobicContact CD1-CB 4.23Å; Y350-A404 HydrophobicContact CD2-CB 3.95Å; Y350-A404 HydrophobicContact CG-CB 3.75Å; Y350-M408 HydrophobicContact CE1-CG 4.18Å; Y350-M408 HydrophobicContact CE1-SD 4.06Å; Y350-M408 HydrophobicContact CE2-SD 4.04Å; Y350-M408 PolarHBondContact OH-SD 3.26Å
351K85Confident83.7Confident119 Ų11954.1 Ų54.152%0.51728%0.281SS..Hα-helixtrans-63.4-47.2-178-62.1-179.1-179.6-179.60112.8S349 F354 C355S349-K351 PolarHBondContact O-N 2.86Å; K351-F354 PolarHBondContact O-N 3.4Å; K351-C355 PolarHBondContact O-N 3.01Å; K351-C355 PolarHBondContact O-SG 3.28Å
352I85.6Confident83.9Confident103 Ų10355.7 Ų55.753%0.52830%0.298SS..Hα-helixtrans-66.9-48.8-176.1-62.5171.6000111.1S349 F354 C355 I356S349-I352 PolarHBondContact O-N 3.36Å; I352-F354 VanDerWaalsContact C-N 3.34Å; I352-F354 PolarHBondContact O-N 3.08Å; I352-C355 PolarHBondContact O-N 3.35Å; I352-I356 HydrophobicContact CG2-CD1 3.81Å; I352-I356 HydrophobicContact CG2-CG1 4.45Å; I352-I356 WeakPolarHBondContact O-CG1 3.39Å; I352-I356 PolarHBondContact O-N 3.24Å; I352-I356 VanDerWaalsContact O-N 3.11Å
353P84.9Confident84.5Confident4 Ų459.5 Ų59.53%0.02632%0.318CS..Hα-helixtrans-52.9-48.9173.4-28.436.4000112.3W341 I344 S349 Y350 C355 I356 I357W341-P353 HydrophobicContact CE3-CB 4.42Å; W341-P353 HydrophobicContact CZ3-CB 4.4Å; I344-P353 HydrophobicContact CG2-CG 3.81Å; S349-P353 WeakPolarHBondContact O-CD 3.31Å; Y350-P353 WeakPolarHBondContact O-CD 3.46Å; P353-C355 VanDerWaalsContact C-N 3.3Å; P353-C355 PolarHBondContact O-N 3.2Å; P353-I356 PolarHBondContact O-N 3.12Å; P353-I356 VanDerWaalsContact O-N 3.15Å; P353-I357 HydrophobicContact CB-CD1 4.05Å; P353-I357 VanDerWaalsContact O-CB 3.3Å; P353-I357 WeakPolarHBondContact O-CB 3.33Å; P353-I357 WeakPolarHBondContact O-CD1 3.26Å; P353-I357 WeakPolarHBondContact O-CG1 3.23Å; P353-I357 PolarHBondContact O-N 2.76Å
354F86.3Confident84.9Confident8 Ų860.5 Ų60.54%0.03532%0.323CS..Hα-helixtrans-57.2-40.8-179.1-90.1-54.5000113.3L291 I294 Y350 K351 I352 S358 V400 A401 A404L291-F354 HydrophobicContact CD2-CD2 4.45Å; L291-F354 HydrophobicContact CD2-CE2 3.67Å; L291-F354 HydrophobicContact CD2-CZ 4.08Å; I294-F354 HydrophobicContact CG2-CD1 3.84Å; I294-F354 HydrophobicContact CG2-CE1 3.91Å; Y350-F354 HydrophobicContact CD2-CD2 4.24Å; Y350-F354 HydrophobicContact CD2-CE2 4.39Å; Y350-F354 VanDerWaalsContact O-CD2 3.22Å; Y350-F354 WeakPolarHBondContact O-CD2 3.47Å; Y350-F354 PolarHBondContact O-N 3.46Å; K351-F354 PolarHBondContact O-N 3.4Å; I352-F354 VanDerWaalsContact C-N 3.34Å; I352-F354 PolarHBondContact O-N 3.08Å; F354-S358 VanDerWaalsContact O-CB 3.29Å; F354-S358 WeakPolarHBondContact O-CB 3.31Å; F354-S358 PolarHBondContact O-N 3.19Å; F354-S358 PolarHBondContact O-OG 3.26Å; F354-V400 HydrophobicContact CD1-CG1 4.24Å; F354-V400 HydrophobicContact CD2-CG1 3.64Å; F354-V400 HydrophobicContact CE1-CB 4.05Å; F354-V400 HydrophobicContact CE1-CG1 3.94Å; F354-V400 HydrophobicContact CE2-CB 4.18Å; F354-V400 HydrophobicContact CE2-CG1 3.31Å; F354-V400 HydrophobicContact CG-CG1 4.1Å; F354-V400 HydrophobicContact CZ-CB 3.81Å; F354-V400 HydrophobicContact CZ-CG1 3.47Å; F354-V400 VanDerWaalsContact CZ-CG1 3.47Å; F354-A401 HydrophobicContact CZ-CB 4.12Å; F354-A404 HydrophobicContact CE2-CB 4.39Å
355C87.6Confident85Confident91 Ų9161.4 Ų61.462%0.61533%0.328SS*.Hα-helixtrans-63.8-48176.1-68.80000111.8K351 I352 P353 S358 L359K351-C355 PolarHBondContact O-N 3.01Å; K351-C355 PolarHBondContact O-SG 3.28Å; I352-C355 PolarHBondContact O-N 3.35Å; P353-C355 VanDerWaalsContact C-N 3.3Å; P353-C355 PolarHBondContact O-N 3.2Å; C355-S358 PolarHBondContact O-N 2.95Å; C355-L359 VanDerWaalsContact O-CB 3.31Å; C355-L359 WeakPolarHBondContact O-CB 3.49Å; C355-L359 PolarHBondContact O-N 3.44Å
356I87.8Confident85.5Confident82 Ų8266.5 Ų66.542%0.42135%0.354SS..Hα-helixtrans-62-48.3179.9-65.6170.4000110.3I352 P353 S358 L359 M360I352-I356 HydrophobicContact CG2-CD1 3.81Å; I352-I356 HydrophobicContact CG2-CG1 4.45Å; I352-I356 WeakPolarHBondContact O-CG1 3.39Å; I352-I356 PolarHBondContact O-N 3.24Å; I352-I356 VanDerWaalsContact O-N 3.11Å; P353-I356 PolarHBondContact O-N 3.12Å; P353-I356 VanDerWaalsContact O-N 3.15Å; I356-S358 PolarHBondContact O-N 3.02Å; I356-L359 PolarHBondContact O-N 3.17Å; I356-M360 HydrophobicContact CG2-CG 4.26Å; I356-M360 WeakPolarHBondContact O-CB 3.37Å; I356-M360 VanDerWaalsContact O-CG 3.26Å; I356-M360 WeakPolarHBondContact O-CG 3.36Å; I356-M360 PolarHBondContact O-N 3.34Å
357I87.3Confident86.3Confident0 Ų064.9 Ų64.90%035%0.347CS..Hα-helixtrans-57.1-52179.1-73.7156.5000110.6W341 P353 L359 M360 W361 S396 V397 V400W341-I357 HydrophobicContact CD2-CD1 4.1Å; W341-I357 HydrophobicContact CD2-CG1 4.45Å; W341-I357 HydrophobicContact CE3-CD1 3.93Å; W341-I357 HydrophobicContact CE3-CG1 4.36Å; W341-I357 HydrophobicContact CH2-CD1 4.39Å; W341-I357 HydrophobicContact CH2-CG1 3.92Å; W341-I357 HydrophobicContact CZ2-CG1 4.01Å; W341-I357 HydrophobicContact CZ3-CD1 4.08Å; W341-I357 HydrophobicContact CZ3-CG1 4.1Å; P353-I357 HydrophobicContact CB-CD1 4.05Å; P353-I357 VanDerWaalsContact O-CB 3.3Å; P353-I357 WeakPolarHBondContact O-CB 3.33Å; P353-I357 WeakPolarHBondContact O-CD1 3.26Å; P353-I357 WeakPolarHBondContact O-CG1 3.23Å; P353-I357 PolarHBondContact O-N 2.76Å; I357-L359 VanDerWaalsContact C-N 3.34Å; I357-L359 PolarHBondContact O-N 3.12Å; I357-M360 PolarHBondContact O-N 3.3Å; I357-W361 VanDerWaalsContact O-CB 3.26Å; I357-W361 WeakPolarHBondContact O-CB 3.45Å; I357-W361 PolarHBondContact O-N 2.97Å; I357-S396 WeakPolarHBondContact CD1-OG 3.32Å; I357-S396 VanDerWaalsContact CG1-OG 3.28Å; I357-S396 WeakPolarHBondContact CG1-OG 3.33Å; I357-S396 WeakPolarHBondContact CG2-OG 3.26Å; I357-V397 HydrophobicContact CG2-CG2 4.15Å; I357-V400 HydrophobicContact CD1-CG2 4.07Å
358S86.9Confident86.8Confident40 Ų4060.4 Ų60.428%0.2833%0.325SS..Hα-helixtrans-66.9-38.4-174.8-56.20000111.1F354 C355 I356 A362F354-S358 VanDerWaalsContact O-CB 3.29Å; F354-S358 WeakPolarHBondContact O-CB 3.31Å; F354-S358 PolarHBondContact O-N 3.19Å; F354-S358 PolarHBondContact O-OG 3.26Å; C355-S358 PolarHBondContact O-N 2.95Å; I356-S358 PolarHBondContact O-N 3.02Å; S358-A362 VanDerWaalsContact O-CB 3.32Å; S358-A362 WeakPolarHBondContact O-CB 3.4Å; S358-A362 PolarHBondContact O-N 3.43Å
359L90.4Very high87.2Confident106 Ų10657.9 Ų57.956%0.55532%0.321SS*.Hα-helixtrans-66.3-48.9176.2-177.865.7000111.8C355 I356 I357 W361 A362 I363C355-L359 VanDerWaalsContact O-CB 3.31Å; C355-L359 WeakPolarHBondContact O-CB 3.49Å; C355-L359 PolarHBondContact O-N 3.44Å; I356-L359 PolarHBondContact O-N 3.17Å; I357-L359 VanDerWaalsContact C-N 3.34Å; I357-L359 PolarHBondContact O-N 3.12Å; L359-W361 VanDerWaalsContact C-N 3.31Å; L359-W361 PolarHBondContact O-N 2.91Å; L359-A362 PolarHBondContact O-N 3.48Å; L359-I363 HydrophobicContact CD1-CD1 4.48Å; L359-I363 HydrophobicContact CG-CD1 4.24Å; L359-I363 WeakPolarHBondContact O-CG1 3.3Å; L359-I363 PolarHBondContact O-N 3.21Å
360M89Confident87.5Confident66 Ų6661.7 Ų61.733%0.32533%0.327SS..Hα-helixtrans-62.3-41.2179.1-71.7-61101.600111.4I356 I357 I363 L364 F393I356-M360 HydrophobicContact CG2-CG 4.26Å; I356-M360 WeakPolarHBondContact O-CB 3.37Å; I356-M360 VanDerWaalsContact O-CG 3.26Å; I356-M360 WeakPolarHBondContact O-CG 3.36Å; I356-M360 PolarHBondContact O-N 3.34Å; I357-M360 PolarHBondContact O-N 3.3Å; M360-I363 HydrophobicContact CE-CD1 3.66Å; M360-I363 PolarHBondContact O-N 3.47Å; M360-L364 VanDerWaalsContact O-CG 3.3Å; M360-L364 WeakPolarHBondContact O-CG 3.35Å; M360-L364 PolarHBondContact O-N 2.91Å; M360-F393 HydrophobicContact CB-CD1 3.98Å; M360-F393 HydrophobicContact CB-CD2 3.98Å; M360-F393 HydrophobicContact CB-CE1 3.91Å; M360-F393 HydrophobicContact CB-CE2 3.93Å; M360-F393 HydrophobicContact CB-CG 4.03Å; M360-F393 HydrophobicContact CB-CZ 3.9Å; M360-F393 HydrophobicContact CG-CD1 4.47Å; M360-F393 HydrophobicContact CG-CE1 3.95Å; M360-F393 HydrophobicContact CG-CE2 4.36Å; M360-F393 HydrophobicContact CG-CZ 3.9Å
361W85.8Confident87.9Confident4 Ų460 Ų602%0.01532%0.32CS..Hα-helixtrans-68.2-39.5178-161.8-6.9000111.9N298 P301 L302 L305 I357 L359 I363 L364 L365 F393 L394 V397N298-W361 HydrophobicContact CB-CH2 4.43Å; N298-W361 HydrophobicContact CB-CZ3 4.03Å; N298-W361 WeakPolarHBondContact OD1-CZ3 3.39Å; P301-W361 HydrophobicContact CB-CZ2 3.75Å; P301-W361 HydrophobicContact CG-CD2 4.32Å; P301-W361 HydrophobicContact CG-CH2 4.04Å; P301-W361 HydrophobicContact CG-CZ2 3.54Å; L302-W361 HydrophobicContact CB-CH2 4.22Å; L302-W361 HydrophobicContact CB-CZ2 4.47Å; L305-W361 HydrophobicContact CD1-CZ2 4.44Å; I357-W361 VanDerWaalsContact O-CB 3.26Å; I357-W361 WeakPolarHBondContact O-CB 3.45Å; I357-W361 PolarHBondContact O-N 2.97Å; L359-W361 VanDerWaalsContact C-N 3.31Å; L359-W361 PolarHBondContact O-N 2.91Å; W361-I363 PolarHBondContact O-N 3.45Å; W361-L364 PolarHBondContact O-N 3.4Å; W361-L365 VanDerWaalsContact CD1-CD1 3.43Å; W361-L365 HydrophobicContact CG-CD1 4.2Å; W361-L365 WeakPolarHBondContact O-CD1 3.47Å; W361-L365 VanDerWaalsContact O-CG 3.28Å; W361-L365 WeakPolarHBondContact O-CG 3.37Å; W361-L365 PolarHBondContact O-N 3.02Å; W361-F393 HydrophobicContact CB-CB 4.44Å; W361-L394 HydrophobicContact CD2-CB 4.45Å; W361-L394 HydrophobicContact CE3-CB 4.35Å; W361-L394 HydrophobicContact CH2-CB 3.71Å; W361-L394 HydrophobicContact CH2-CD1 3.01Å; W361-L394 HydrophobicContact CH2-CG 3.88Å; W361-L394 HydrophobicContact CZ2-CB 3.66Å; W361-L394 HydrophobicContact CZ2-CD1 3.49Å; W361-L394 VanDerWaalsContact CZ2-CD1 3.49Å; W361-L394 HydrophobicContact CZ2-CD2 4.4Å; W361-L394 HydrophobicContact CZ2-CG 4Å; W361-L394 VanDerWaalsContact CZ3-CA 3.45Å; W361-L394 HydrophobicContact CZ3-CB 4.01Å; W361-L394 HydrophobicContact CZ3-CD1 3.77Å; W361-L394 HydrophobicContact CZ3-CG 4.49Å; W361-V397 HydrophobicContact CE3-CG2 4.45Å; W361-V397 HydrophobicContact CZ3-CG2 3.9Å
362A88.3Confident87.9Confident55 Ų5557 Ų5746%0.45531%0.314SS..Hα-helixtrans-58.8-45.1173.700000112.2S358 L359 L365 L366S358-A362 VanDerWaalsContact O-CB 3.32Å; S358-A362 WeakPolarHBondContact O-CB 3.4Å; S358-A362 PolarHBondContact O-N 3.43Å; L359-A362 PolarHBondContact O-N 3.48Å; A362-L365 PolarHBondContact O-N 3.43Å; A362-L366 WeakPolarHBondContact O-CB 3.05Å; A362-L366 PolarHBondContact O-N 3.34Å
363I91.3Very high88.1Confident81 Ų8158.3 Ų58.342%0.41532%0.322SS..Hα-helixtrans-61.4-46.3176.9-66.8167.4000110.8L359 M360 W361 L365 L366 T367L359-I363 HydrophobicContact CD1-CD1 4.48Å; L359-I363 HydrophobicContact CG-CD1 4.24Å; L359-I363 WeakPolarHBondContact O-CG1 3.3Å; L359-I363 PolarHBondContact O-N 3.21Å; M360-I363 HydrophobicContact CE-CD1 3.66Å; M360-I363 PolarHBondContact O-N 3.47Å; W361-I363 PolarHBondContact O-N 3.45Å; I363-L365 VanDerWaalsContact C-N 3.34Å; I363-L365 PolarHBondContact O-N 3.48Å; I363-L366 PolarHBondContact O-N 3.13Å; I363-T367 WeakPolarHBondContact O-CB 3.32Å; I363-T367 WeakPolarHBondContact O-CG2 3.47Å; I363-T367 PolarHBondContact O-N 3.05Å; I363-T367 PolarHBondContact O-OG1 3.44Å
364L90Very high88.3Confident31 Ų3159.9 Ų59.916%0.16233%0.331CS..Hα-helixtrans-62-41.2-179.9-74.4167.7000112.1M360 W361 T367 F368 W386 F393M360-L364 VanDerWaalsContact O-CG 3.3Å; M360-L364 WeakPolarHBondContact O-CG 3.35Å; M360-L364 PolarHBondContact O-N 2.91Å; W361-L364 PolarHBondContact O-N 3.4Å; L364-T367 PolarHBondContact O-N 3.29Å; L364-T367 PolarHBondContact O-OG1 2.96Å; L364-F368 VanDerWaalsContact O-CB 3.31Å; L364-F368 WeakPolarHBondContact O-CB 3.46Å; L364-F368 PolarHBondContact O-N 2.95Å; L364-W386 HydrophobicContact CD2-CG 4.37Å; L364-W386 PolarHBondContact O-NE1 3.2Å; L364-F393 HydrophobicContact CD1-CD2 3.58Å; L364-F393 HydrophobicContact CD1-CE2 4.09Å
365L85.7Confident88.2Confident51 Ų5165.9 Ų65.927%0.26736%0.364SS..Hα-helixtrans-71-39.6178.5-68158.3000112.6P301 L305 W361 A362 I363 T367 F368 P369P301-L365 HydrophobicContact CB-CD1 3.21Å; P301-L365 HydrophobicContact CB-CD2 3.56Å; P301-L365 HydrophobicContact CB-CG 3.97Å; P301-L365 HydrophobicContact CG-CD1 3.65Å; L305-L365 HydrophobicContact CD1-CD2 4.3Å; W361-L365 VanDerWaalsContact CD1-CD1 3.43Å; W361-L365 HydrophobicContact CG-CD1 4.2Å; W361-L365 WeakPolarHBondContact O-CD1 3.47Å; W361-L365 VanDerWaalsContact O-CG 3.28Å; W361-L365 WeakPolarHBondContact O-CG 3.37Å; W361-L365 PolarHBondContact O-N 3.02Å; A362-L365 PolarHBondContact O-N 3.43Å; I363-L365 VanDerWaalsContact C-N 3.34Å; I363-L365 PolarHBondContact O-N 3.48Å; L365-T367 PolarHBondContact O-N 2.82Å; L365-F368 PolarHBondContact O-N 2.96Å; L365-P369 WeakPolarHBondContact O-CD 3.28Å
366L89.7Confident88.2Confident129 Ų12964.2 Ų64.268%0.67536%0.362SS*.Hα-helixtrans-62.3-37.6177.3-175.566.7000110.8A362 I363 Y370A362-L366 WeakPolarHBondContact O-CB 3.05Å; A362-L366 PolarHBondContact O-N 3.34Å; I363-L366 PolarHBondContact O-N 3.13Å; L366-Y370 VanDerWaalsContact O-CE2 3.26Å; L366-Y370 WeakPolarHBondContact O-CE2 3.28Å
367T91Very high88.4Confident46 Ų4666.4 Ų66.428%0.28237%0.373SS..Hα-helixtrans-87.2-18.3-177.652.60000113.8I363 L364 L365 Y370 W386I363-T367 WeakPolarHBondContact O-CB 3.32Å; I363-T367 WeakPolarHBondContact O-CG2 3.47Å; I363-T367 PolarHBondContact O-N 3.05Å; I363-T367 PolarHBondContact O-OG1 3.44Å; L364-T367 PolarHBondContact O-N 3.29Å; L364-T367 PolarHBondContact O-OG1 2.96Å; L365-T367 PolarHBondContact O-N 2.82Å; T367-Y370 PolarHBondContact O-N 2.97Å; T367-W386 PolarHBondContact OG1-NE1 3.07Å
368F88.6Confident88.6Confident27 Ų2770.2 Ų70.212%0.11840%0.397CS..G310 helixtrans-57.4-43.6-175.2-173.1-114.3000115.2Y309 F312 L364 L365 Y370 I371 Y383 W386Y309-F368 HydrophobicContact CD2-CE1 4.42Å; Y309-F368 HydrophobicContact CD2-CE2 4.07Å; Y309-F368 AromaticContact CD2-CZ 3.55Å; Y309-F368 HydrophobicContact CD2-CZ 3.55Å; Y309-F368 AromaticContact CE2-CE2 3.7Å; Y309-F368 HydrophobicContact CE2-CE2 3.7Å; Y309-F368 AromaticContact CE2-CZ 3.63Å; Y309-F368 HydrophobicContact CE2-CZ 3.63Å; F312-F368 HydrophobicContact CB-CE1 4.44Å; F312-F368 HydrophobicContact CD1-CD1 4.27Å; F312-F368 AromaticContact CD1-CE1 3.36Å; F312-F368 HydrophobicContact CD1-CE1 3.36Å; F312-F368 HydrophobicContact CD1-CE2 4.27Å; F312-F368 AromaticContact CD1-CZ 3.36Å; F312-F368 HydrophobicContact CD1-CZ 3.36Å; F312-F368 HydrophobicContact CE1-CD1 4.11Å; F312-F368 AromaticContact CE1-CE1 3.61Å; F312-F368 HydrophobicContact CE1-CE1 3.61Å; F312-F368 HydrophobicContact CE1-CE2 4.21Å; F312-F368 AromaticContact CE1-CZ 3.68Å; F312-F368 HydrophobicContact CE1-CZ 3.68Å; F312-F368 AromaticContact CG-CE1 3.89Å; F312-F368 HydrophobicContact CG-CE1 3.89Å; F312-F368 HydrophobicContact CG-CZ 4.25Å; F312-F368 HydrophobicContact CZ-CE1 4.35Å; L364-F368 VanDerWaalsContact O-CB 3.31Å; L364-F368 WeakPolarHBondContact O-CB 3.46Å; L364-F368 PolarHBondContact O-N 2.95Å; L365-F368 PolarHBondContact O-N 2.96Å; F368-Y370 PolarHBondContact O-N 3.28Å; F368-I371 HydrophobicContact CD2-CD1 3.65Å; F368-I371 HydrophobicContact CE2-CD1 3.97Å; F368-I371 WeakPolarHBondContact O-CB 3.01Å; F368-I371 WeakPolarHBondContact O-CD1 3.45Å; F368-I371 WeakPolarHBondContact O-CG1 3.47Å; F368-I371 PolarHBondContact O-N 3.35Å; F368-Y383 HydrophobicContact CE2-CD2 4.33Å; F368-Y383 HydrophobicContact CE2-CE2 4.47Å; F368-Y383 HydrophobicContact CZ-CD2 4.44Å; F368-Y383 HydrophobicContact CZ-CE2 4.2Å; F368-W386 HydrophobicContact CD2-CB 3.84Å; F368-W386 AromaticContact CD2-CD1 3.91Å; F368-W386 HydrophobicContact CD2-CG 4.15Å; F368-W386 HydrophobicContact CE2-CB 4.21Å
369P86.7Confident88.8Confident68 Ų6868.4 Ų68.444%0.44238%0.384SS..G310 helixtrans-63-28.6-179.3-24.736.1000114L365 I371 S372L365-P369 WeakPolarHBondContact O-CD 3.28Å; P369-I371 PolarHBondContact O-N 3.17Å; P369-S372 PolarHBondContact O-N 3.11Å; P369-S372 VanDerWaalsContact O-N 3.16Å; P369-S372 PolarHBondContact O-OG 3.44Å
370Y90Very high88.8Confident146 Ų14666.5 Ų66.557%0.57337%0.372SS*.G310 helixtrans-68.6-13.9-177.7-63.9-83.8000113.3L366 T367 F368 S372 L373L366-Y370 VanDerWaalsContact O-CE2 3.26Å; L366-Y370 WeakPolarHBondContact O-CE2 3.28Å; T367-Y370 PolarHBondContact O-N 2.97Å; F368-Y370 PolarHBondContact O-N 3.28Å; Y370-S372 PolarHBondContact O-N 2.99Å; Y370-L373 HydrophobicContact CD1-CD1 3.79Å; Y370-L373 WeakPolarHBondContact O-CB 3.15Å; Y370-L373 PolarHBondContact O-N 3.39Å; Y370-L373 VanDerWaalsContact O-N 3.14Å
371I89Confident89Confident2 Ų267.4 Ų67.41%0.0138%0.377CS..G310 helixtrans-60.2-33.3173-61170.4000110.7F316 F368 P369 L373 T374 L382 W386F316-I371 HydrophobicContact CE2-CG2 4.03Å; F316-I371 HydrophobicContact CZ-CG2 3.9Å; F368-I371 HydrophobicContact CD2-CD1 3.65Å; F368-I371 HydrophobicContact CE2-CD1 3.97Å; F368-I371 WeakPolarHBondContact O-CB 3.01Å; F368-I371 WeakPolarHBondContact O-CD1 3.45Å; F368-I371 WeakPolarHBondContact O-CG1 3.47Å; F368-I371 PolarHBondContact O-N 3.35Å; P369-I371 PolarHBondContact O-N 3.17Å; I371-L373 PolarHBondContact O-N 3.41Å; I371-T374 PolarHBondContact O-N 2.73Å; I371-T374 PolarHBondContact O-OG1 3.4Å; I371-L382 HydrophobicContact CD1-CB 4.46Å; I371-L382 HydrophobicContact CG1-CB 4.11Å; I371-L382 HydrophobicContact CG2-CB 4.12Å; I371-W386 HydrophobicContact CD1-CB 3.76Å; I371-W386 HydrophobicContact CD1-CD2 3.85Å; I371-W386 HydrophobicContact CD1-CE3 4.34Å; I371-W386 HydrophobicContact CD1-CG 3.63Å; I371-W386 HydrophobicContact CG1-CD2 4.42Å
372S84.6Confident89.4Confident56 Ų5669.2 Ų69.239%0.39239%0.387SS..G310 helixtrans-68.6-11.7-179.966.40000114.1P369 Y370 T374P369-S372 PolarHBondContact O-N 3.11Å; P369-S372 VanDerWaalsContact O-N 3.16Å; P369-S372 PolarHBondContact O-OG 3.44Å; Y370-S372 PolarHBondContact O-N 2.99Å; S372-T374 VanDerWaalsContact C-N 3.32Å
373L88.4Confident89.6Confident132 Ų13266.6 Ų66.669%0.69137%0.365SS*.G310 helixtrans-84.7-8.5173.1-56.7177.4000112.9Y370 I371Y370-L373 HydrophobicContact CD1-CD1 3.79Å; Y370-L373 WeakPolarHBondContact O-CB 3.15Å; Y370-L373 PolarHBondContact O-N 3.39Å; Y370-L373 VanDerWaalsContact O-N 3.14Å; I371-L373 PolarHBondContact O-N 3.41Å
374T89.4Confident89.6Confident37 Ų3763.9 Ų63.923%0.22735%0.353CS..SBendtrans-103.8148.4177.767.30000109.8I371 S372 T378 A379 L382I371-T374 PolarHBondContact O-N 2.73Å; I371-T374 PolarHBondContact O-OG1 3.4Å; S372-T374 VanDerWaalsContact C-N 3.32Å; T374-T378 HydrophobicContact CG2-CG2 4.35Å; T374-A379 VanDerWaalsContact O-CB 3.32Å; T374-A379 WeakPolarHBondContact O-CB 3.25Å; T374-A379 VanDerWaalsContact OG1-CA 3.3Å; T374-A379 WeakPolarHBondContact OG1-CA 3.34Å; T374-L382 HydrophobicContact CG2-CD1 3.85Å
375D85.2Confident89.8Confident134 Ų13466.9 Ų66.972%0.71737%0.368SS*.  trans-117.1161-178.2-70.8-45.7000112.8
376G88.2Confident90.1Very high56 Ų5667.2 Ų67.258%0.57737%0.366SS*.Hα-helixtrans67-133.7170.500000114.6T378 K380G376-T378 VanDerWaalsContact C-N 3.34Å; G376-T378 PolarHBondContact O-N 3.39Å; G376-K380 PolarHBondContact O-N 2.96Å
377L90.7Very high90.1Very high127 Ų12761.1 Ų61.167%0.66533%0.334SS*.Hα-helixtrans-66.3-35.3-176.7-178.963000112.2A379 K380 I381L377-A379 PolarHBondContact O-N 3.4Å; L377-K380 WeakPolarHBondContact O-CB 3.38Å; L377-K380 PolarHBondContact O-N 3.37Å; L377-I381 HydrophobicContact CD1-CD1 4.17Å; L377-I381 HydrophobicContact CD1-CG1 4.29Å; L377-I381 HydrophobicContact CD2-CD1 4.33Å; L377-I381 HydrophobicContact CG-CD1 3.83Å; L377-I381 HydrophobicContact CG-CG1 4.35Å; L377-I381 WeakPolarHBondContact O-CG1 3.45Å; L377-I381 PolarHBondContact O-N 3Å
378T91.5Very high90.1Very high80 Ų8060.4 Ų60.449%0.49133%0.329SS..Hα-helixtrans-60.6-47.4179.8-54.70000110.8T374 G376 K380 I381 L382T374-T378 HydrophobicContact CG2-CG2 4.35Å; G376-T378 VanDerWaalsContact C-N 3.34Å; G376-T378 PolarHBondContact O-N 3.39Å; T378-K380 VanDerWaalsContact C-N 3.3Å; T378-K380 PolarHBondContact O-N 3.21Å; T378-I381 PolarHBondContact O-N 3.23Å; T378-L382 HydrophobicContact CG2-CD1 3.86Å; T378-L382 HydrophobicContact CG2-CG 4.24Å; T378-L382 VanDerWaalsContact O-CG 3.3Å; T378-L382 WeakPolarHBondContact O-CG 2.94Å; T378-L382 PolarHBondContact O-N 3.14Å
379A90.6Very high90.2Very high2 Ų259.8 Ų59.82%0.01733%0.33CS..Hα-helixtrans-58.9-42.2177.200000112.2F316 T374 L377 Y383F316-A379 HydrophobicContact CD2-CB 3.82Å; F316-A379 HydrophobicContact CE2-CB 4.04Å; T374-A379 VanDerWaalsContact O-CB 3.32Å; T374-A379 WeakPolarHBondContact O-CB 3.25Å; T374-A379 VanDerWaalsContact OG1-CA 3.3Å; T374-A379 WeakPolarHBondContact OG1-CA 3.34Å; L377-A379 PolarHBondContact O-N 3.4Å; A379-Y383 WeakPolarHBondContact O-CB 3.17Å; A379-Y383 PolarHBondContact O-N 3.5Å
380K91.8Very high90.1Very high66 Ų6656.8 Ų56.829%0.28731%0.311SS..Hα-helixtrans-60.9-46.6176.6-73.9-172.2179.6-170.60111.9I317 Y322 G376 L377 T378 C384I317-K380 HydrophobicContact CD1-CG 3.94Å; I317-K380 HydrophobicContact CG1-CG 4.11Å; Y322-K380 HydrophobicContact CE1-CB 4.05Å; Y322-K380 HydrophobicContact CE1-CD 4.31Å; Y322-K380 HydrophobicContact CE1-CG 3.96Å; Y322-K380 HydrophobicContact CE2-CD 4.42Å; Y322-K380 VanDerWaalsContact OH-C 3.28Å; Y322-K380 WeakPolarHBondContact OH-CB 3.48Å; Y322-K380 PolarHBondContact OH-O 3.38Å; G376-K380 PolarHBondContact O-N 2.96Å; L377-K380 WeakPolarHBondContact O-CB 3.38Å; L377-K380 PolarHBondContact O-N 3.37Å; T378-K380 VanDerWaalsContact C-N 3.3Å; T378-K380 PolarHBondContact O-N 3.21Å; K380-C384 PolarHBondContact O-N 2.94Å; K380-C384 VanDerWaalsContact O-N 3.12Å
381I93Very high90Very high86 Ų8650.1 Ų50.144%0.44129%0.285SS..Hα-helixtrans-66.1-48.5179.8-67.4171.2000110.8L377 T378 Y383 C384 I385L377-I381 HydrophobicContact CD1-CD1 4.17Å; L377-I381 HydrophobicContact CD1-CG1 4.29Å; L377-I381 HydrophobicContact CD2-CD1 4.33Å; L377-I381 HydrophobicContact CG-CD1 3.83Å; L377-I381 HydrophobicContact CG-CG1 4.35Å; L377-I381 WeakPolarHBondContact O-CG1 3.45Å; L377-I381 PolarHBondContact O-N 3Å; T378-I381 PolarHBondContact O-N 3.23Å; I381-Y383 PolarHBondContact O-N 3.42Å; I381-C384 WeakPolarHBondContact O-CB 3.4Å; I381-C384 PolarHBondContact O-N 2.85Å; I381-I385 HydrophobicContact CG2-CD1 3.74Å; I381-I385 HydrophobicContact CG2-CG1 4.43Å; I381-I385 WeakPolarHBondContact O-CG1 3.46Å; I381-I385 PolarHBondContact O-N 3.25Å
382L93.2Very high90Very high42 Ų4251.9 Ų51.922%0.2229%0.294CS..Hα-helixtrans-62.4-43.3178.8-63175.3000111.1I371 T374 T378 C384 I385 W386I371-L382 HydrophobicContact CD1-CB 4.46Å; I371-L382 HydrophobicContact CG1-CB 4.11Å; I371-L382 HydrophobicContact CG2-CB 4.12Å; T374-L382 HydrophobicContact CG2-CD1 3.85Å; T378-L382 HydrophobicContact CG2-CD1 3.86Å; T378-L382 HydrophobicContact CG2-CG 4.24Å; T378-L382 VanDerWaalsContact O-CG 3.3Å; T378-L382 WeakPolarHBondContact O-CG 2.94Å; T378-L382 PolarHBondContact O-N 3.14Å; L382-C384 VanDerWaalsContact C-N 3.28Å; L382-C384 PolarHBondContact O-N 3.33Å; L382-I385 PolarHBondContact O-N 3.44Å; L382-W386 HydrophobicContact CB-CE3 4.13Å; L382-W386 HydrophobicContact CB-CZ3 4.01Å; L382-W386 HydrophobicContact CD2-CE3 4.33Å; L382-W386 HydrophobicContact CD2-CH2 3.92Å; L382-W386 HydrophobicContact CD2-CZ3 3.4Å; L382-W386 VanDerWaalsContact CD2-CZ3 3.4Å; L382-W386 HydrophobicContact CG-CZ3 4.26Å; L382-W386 PolarHBondContact O-N 3.14Å
383Y92.5Very high90.1Very high0 Ų051 Ų510%028%0.284CS..Hα-helixtrans-57.2-41.1175.5-177.9-101.4000112.6Y309 F312 F316 I317 L323 I326 F368 A379 I381 G387Y309-Y383 VanDerWaalsContact CD1-OH 3.28Å; Y309-Y383 WeakPolarHBondContact CD1-OH 3.38Å; Y309-Y383 HydrophobicContact CD2-CE2 4.2Å; Y309-Y383 AromaticContact CE1-CE1 3.89Å; Y309-Y383 HydrophobicContact CE1-CE1 3.89Å; Y309-Y383 HydrophobicContact CE1-CE2 4.23Å; Y309-Y383 AromaticContact CE1-CZ 3.5Å; Y309-Y383 WeakPolarHBondContact CE1-OH 3.16Å; Y309-Y383 HydrophobicContact CE2-CD2 4.33Å; Y309-Y383 AromaticContact CE2-CE2 3.69Å; Y309-Y383 HydrophobicContact CE2-CE2 3.69Å; Y309-Y383 AromaticContact CE2-CZ 3.84Å; Y309-Y383 AromaticContact CZ-CE1 3.74Å; Y309-Y383 AromaticContact CZ-CE2 3.68Å; Y309-Y383 AromaticContact CZ-CZ 3.35Å; Y309-Y383 PolarHBondContact O-OH 3.35Å; Y309-Y383 WeakPolarHBondContact OH-CE1 3.35Å; Y309-Y383 PolarHBondContact OH-O 2.97Å; F312-Y383 HydrophobicContact CD1-CE2 4.3Å; F316-Y383 HydrophobicContact CE2-CD2 4.47Å; F316-Y383 AromaticContact CZ-CD2 3.82Å; F316-Y383 HydrophobicContact CZ-CD2 3.82Å; F316-Y383 HydrophobicContact CZ-CE2 4.46Å; F316-Y383 HydrophobicContact CZ-CG 4.34Å; I317-Y383 HydrophobicContact CD1-CD1 4.27Å; I317-Y383 HydrophobicContact CD1-CG 4.33Å; L323-Y383 HydrophobicContact CD2-CD1 4.16Å; L323-Y383 HydrophobicContact CD2-CE1 3.51Å; I326-Y383 HydrophobicContact CB-CD1 4.49Å; I326-Y383 HydrophobicContact CB-CE1 4.21Å; I326-Y383 HydrophobicContact CG1-CD1 4.43Å; I326-Y383 HydrophobicContact CG2-CD1 3.97Å; I326-Y383 HydrophobicContact CG2-CE1 3.8Å; F368-Y383 HydrophobicContact CE2-CD2 4.33Å; F368-Y383 HydrophobicContact CE2-CE2 4.47Å; F368-Y383 HydrophobicContact CZ-CD2 4.44Å; F368-Y383 HydrophobicContact CZ-CE2 4.2Å; A379-Y383 WeakPolarHBondContact O-CB 3.17Å; A379-Y383 PolarHBondContact O-N 3.5Å; I381-Y383 PolarHBondContact O-N 3.42Å; Y383-G387 PolarHBondContact O-N 2.57Å
384C92.8Very high89.7Confident24 Ų2445 Ų4516%0.16225%0.252CS..Hα-helixtrans-63.7-49.8174.8-179.80000111.9I326 K380 I381 L382 W386 G387 I388I326-C384 HydrophobicContact CD1-CB 3.77Å; K380-C384 PolarHBondContact O-N 2.94Å; K380-C384 VanDerWaalsContact O-N 3.12Å; I381-C384 WeakPolarHBondContact O-CB 3.4Å; I381-C384 PolarHBondContact O-N 2.85Å; L382-C384 VanDerWaalsContact C-N 3.28Å; L382-C384 PolarHBondContact O-N 3.33Å; C384-W386 PolarHBondContact O-N 3Å; C384-G387 PolarHBondContact O-N 2.87Å; C384-I388 WeakPolarHBondContact O-CG1 3.23Å; C384-I388 PolarHBondContact O-N 3.25Å
385I93Very high89.1Confident94 Ų9443.2 Ų43.248%0.48224%0.241SC..Hα-helixtrans-60.6-47.6-179.1-68.2169.1000111.1I381 L382 G387 I388 G389I381-I385 HydrophobicContact CG2-CD1 3.74Å; I381-I385 HydrophobicContact CG2-CG1 4.43Å; I381-I385 WeakPolarHBondContact O-CG1 3.46Å; I381-I385 PolarHBondContact O-N 3.25Å; L382-I385 PolarHBondContact O-N 3.44Å; I385-G387 VanDerWaalsContact C-N 3.34Å; I385-I388 PolarHBondContact O-N 3.02Å; I385-G389 PolarHBondContact O-N 2.91Å
386W92.1Very high88.7Confident57 Ų5736.8 Ų36.822%0.21621%0.207CC..Hα-helixtrans-68.2-34.8178.6-91.1-109.4000112.3L364 T367 F368 I371 L382 C384 G390L364-W386 HydrophobicContact CD2-CG 4.37Å; L364-W386 PolarHBondContact O-NE1 3.2Å; T367-W386 PolarHBondContact OG1-NE1 3.07Å; F368-W386 HydrophobicContact CD2-CB 3.84Å; F368-W386 AromaticContact CD2-CD1 3.91Å; F368-W386 HydrophobicContact CD2-CG 4.15Å; F368-W386 HydrophobicContact CE2-CB 4.21Å; I371-W386 HydrophobicContact CD1-CB 3.76Å; I371-W386 HydrophobicContact CD1-CD2 3.85Å; I371-W386 HydrophobicContact CD1-CE3 4.34Å; I371-W386 HydrophobicContact CD1-CG 3.63Å; I371-W386 HydrophobicContact CG1-CD2 4.42Å; L382-W386 HydrophobicContact CB-CE3 4.13Å; L382-W386 HydrophobicContact CB-CZ3 4.01Å; L382-W386 HydrophobicContact CD2-CE3 4.33Å; L382-W386 HydrophobicContact CD2-CH2 3.92Å; L382-W386 HydrophobicContact CD2-CZ3 3.4Å; L382-W386 VanDerWaalsContact CD2-CZ3 3.4Å; L382-W386 HydrophobicContact CG-CZ3 4.26Å; L382-W386 PolarHBondContact O-N 3.14Å; C384-W386 PolarHBondContact O-N 3Å; W386-G390 WeakPolarHBondContact O-CA 3.36Å; W386-G390 PolarHBondContact O-N 3.39Å
387G89.9Confident88.4Confident1 Ų134.4 Ų34.41%0.0118%0.181CC..Hα-helixtrans-59.2-56.2172.100000112Y309 T330 Y383 C384 I385 G389 G390 F391Y309-G387 WeakPolarHBondContact OH-CA 3.34Å; T330-G387 WeakPolarHBondContact CG2-O 3.33Å; Y383-G387 PolarHBondContact O-N 2.57Å; C384-G387 PolarHBondContact O-N 2.87Å; I385-G387 VanDerWaalsContact C-N 3.34Å; G387-G389 PolarHBondContact O-N 3.44Å; G387-G390 PolarHBondContact O-N 3.2Å; G387-F391 WeakPolarHBondContact O-CD2 3.36Å; G387-F391 PolarHBondContact O-N 3.07Å
388I91.4Very high87.8Confident32 Ų3229.1 Ų29.116%0.16416%0.155CC..Hα-helixtrans-59.6-50-178.7-71.4170.2000110.5M329 F333 C384 I385 L392M329-I388 HydrophobicContact CE-CD1 4.34Å; F333-I388 HydrophobicContact CB-CG2 4.06Å; F333-I388 HydrophobicContact CD1-CG2 3.7Å; F333-I388 HydrophobicContact CD2-CB 4.25Å; F333-I388 HydrophobicContact CD2-CD1 4.14Å; F333-I388 HydrophobicContact CD2-CG1 3.83Å; F333-I388 HydrophobicContact CD2-CG2 3.56Å; F333-I388 HydrophobicContact CE1-CG2 3.95Å; F333-I388 HydrophobicContact CE2-CD1 3.8Å; F333-I388 HydrophobicContact CE2-CG1 4.03Å; F333-I388 HydrophobicContact CE2-CG2 3.83Å; F333-I388 HydrophobicContact CG-CG2 3.5Å; F333-I388 VanDerWaalsContact CG-CG2 3.5Å; F333-I388 HydrophobicContact CZ-CD1 4.48Å; F333-I388 HydrophobicContact CZ-CG2 4.01Å; C384-I388 WeakPolarHBondContact O-CG1 3.23Å; C384-I388 PolarHBondContact O-N 3.25Å; I385-I388 PolarHBondContact O-N 3.02Å; I388-L392 WeakPolarHBondContact O-CB 3.37Å; I388-L392 PolarHBondContact O-N 2.88Å
389G89.4Confident87.4Confident14 Ų1425.3 Ų25.314%0.14413%0.131CC..Hα-helixtrans-59.9-49.1177.400000111.9I385 G387 F391 L392 F393I385-G389 PolarHBondContact O-N 2.91Å; G387-G389 PolarHBondContact O-N 3.44Å; G389-F391 PolarHBondContact O-N 2.96Å; G389-L392 PolarHBondContact O-N 3.49Å; G389-F393 WeakPolarHBondContact O-CD2 3.23Å; G389-F393 PolarHBondContact O-N 3.47Å
390G86.4Confident87.2Confident5 Ų525.2 Ų25.25%0.05213%0.13CC..Hα-helixtrans-57.8-48.1-178.400000112.2W386 G387 L394W386-G390 WeakPolarHBondContact O-CA 3.36Å; W386-G390 PolarHBondContact O-N 3.39Å; G387-G390 PolarHBondContact O-N 3.2Å; G390-L394 WeakPolarHBondContact O-CB 3.43Å; G390-L394 PolarHBondContact O-N 3.43Å
391F87Confident86.8Confident5 Ų522.1 Ų22.12%0.02212%0.117CC..Hα-helixtrans-74.2-31.1179.6-82.2-88.6000113.6Y39 Y309 T330 N334 G387 G389 L394 S395Y39-F391 HydrophobicContact CD1-CE1 4.05Å; Y39-F391 HydrophobicContact CE1-CE1 4.39Å; Y309-F391 HydrophobicContact CD1-CE2 4.21Å; Y309-F391 HydrophobicContact CE1-CE2 4.42Å; Y309-F391 HydrophobicContact CG-CE2 4.3Å; T330-F391 HydrophobicContact CG2-CD2 3.8Å; T330-F391 HydrophobicContact CG2-CE2 4.38Å; T330-F391 HydrophobicContact CG2-CG 4.41Å; N334-F391 HydrophobicContact CB-CB 4.27Å; G387-F391 WeakPolarHBondContact O-CD2 3.36Å; G387-F391 PolarHBondContact O-N 3.07Å; G389-F391 PolarHBondContact O-N 2.96Å; F391-L394 HydrophobicContact CD1-CD2 3.77Å; F391-L394 HydrophobicContact CE1-CD2 3.94Å; F391-L394 HydrophobicContact CG-CD2 4.42Å; F391-S395 VanDerWaalsContact O-CB 3.31Å; F391-S395 WeakPolarHBondContact O-CB 3.27Å; F391-S395 PolarHBondContact O-N 2.95Å
392L88.4Confident86.3Confident39 Ų3918 Ų1820%0.20410%0.096CC..Hα-helixtrans-62.4-47.8173.6179.768.3000111.5F333 W341 I388 G389 S395F333-L392 HydrophobicContact CB-CB 4.48Å; F333-L392 WeakPolarHBondContact O-CD1 3.29Å; W341-L392 PolarHBondContact NE1-O 2.84Å; I388-L392 WeakPolarHBondContact O-CB 3.37Å; I388-L392 PolarHBondContact O-N 2.88Å; G389-L392 PolarHBondContact O-N 3.49Å; L392-S395 PolarHBondContact O-OG 2.96Å
393F86.3Confident85.7Confident38 Ų3816.8 Ų16.817%0.1679%0.092CC..Hα-helixtrans-76.7-34.8178.1-66-67.6000112.2W341 M360 W361 L364 G389 S395 S396W341-F393 HydrophobicContact CH2-CD1 4.46Å; W341-F393 HydrophobicContact CH2-CE1 4.29Å; W341-F393 AromaticContact CZ2-CD1 3.78Å; W341-F393 HydrophobicContact CZ2-CD1 3.78Å; W341-F393 AromaticContact CZ2-CE1 3.85Å; W341-F393 HydrophobicContact CZ2-CE1 3.85Å; M360-F393 HydrophobicContact CB-CD1 3.98Å; M360-F393 HydrophobicContact CB-CD2 3.98Å; M360-F393 HydrophobicContact CB-CE1 3.91Å; M360-F393 HydrophobicContact CB-CE2 3.93Å; M360-F393 HydrophobicContact CB-CG 4.03Å; M360-F393 HydrophobicContact CB-CZ 3.9Å; M360-F393 HydrophobicContact CG-CD1 4.47Å; M360-F393 HydrophobicContact CG-CE1 3.95Å; M360-F393 HydrophobicContact CG-CE2 4.36Å; M360-F393 HydrophobicContact CG-CZ 3.9Å; W361-F393 HydrophobicContact CB-CB 4.44Å; L364-F393 HydrophobicContact CD1-CD2 3.58Å; L364-F393 HydrophobicContact CD1-CE2 4.09Å; G389-F393 WeakPolarHBondContact O-CD2 3.23Å; G389-F393 PolarHBondContact O-N 3.47Å; F393-S395 VanDerWaalsContact C-N 3.29Å; F393-S395 PolarHBondContact O-N 3.33Å; F393-S396 WeakPolarHBondContact O-CB 3.46Å; F393-S396 PolarHBondContact O-N 3.33Å; F393-S396 PolarHBondContact O-OG 3.28Å
394L80.9Confident85.3Confident5 Ų516.8 Ų16.83%0.0269%0.092CC..Hα-helixtrans-56.7-42.4172.6160.158.8000112.6Y39 L302 W361 G390 F391 S396 V397Y39-L394 HydrophobicContact CE1-CD2 4.31Å; L302-L394 HydrophobicContact CB-CD1 3.91Å; L302-L394 HydrophobicContact CD1-CD1 3.4Å; L302-L394 VanDerWaalsContact CD1-CD1 3.4Å; L302-L394 HydrophobicContact CD1-CD2 3.86Å; L302-L394 HydrophobicContact CD1-CG 4.23Å; L302-L394 HydrophobicContact CD2-CD1 4.34Å; L302-L394 HydrophobicContact CG-CD1 4.04Å; W361-L394 HydrophobicContact CD2-CB 4.45Å; W361-L394 HydrophobicContact CE3-CB 4.35Å; W361-L394 HydrophobicContact CH2-CB 3.71Å; W361-L394 HydrophobicContact CH2-CD1 3.01Å; W361-L394 HydrophobicContact CH2-CG 3.88Å; W361-L394 HydrophobicContact CZ2-CB 3.66Å; W361-L394 HydrophobicContact CZ2-CD1 3.49Å; W361-L394 VanDerWaalsContact CZ2-CD1 3.49Å; W361-L394 HydrophobicContact CZ2-CD2 4.4Å; W361-L394 HydrophobicContact CZ2-CG 4Å; W361-L394 VanDerWaalsContact CZ3-CA 3.45Å; W361-L394 HydrophobicContact CZ3-CB 4.01Å; W361-L394 HydrophobicContact CZ3-CD1 3.77Å; W361-L394 HydrophobicContact CZ3-CG 4.49Å; G390-L394 WeakPolarHBondContact O-CB 3.43Å; G390-L394 PolarHBondContact O-N 3.43Å; F391-L394 HydrophobicContact CD1-CD2 3.77Å; F391-L394 HydrophobicContact CE1-CD2 3.94Å; F391-L394 HydrophobicContact CG-CD2 4.42Å; L394-S396 PolarHBondContact O-N 3.39Å; L394-S396 VanDerWaalsContact O-N 3.1Å; L394-V397 PolarHBondContact O-N 2.98Å
395S77.3Confident84.9Confident0 Ų015.6 Ų15.60%08%0.084CC..Hα-helixtrans-57.2-30.2-176.180.20000114.2N334 G337 R338 F391 L392 F393 V397 S398 T399N334-S395 WeakPolarHBondContact O-CB 3.31Å; N334-S395 PolarHBondContact O-OG 3.4Å; N334-S395 WeakPolarHBondContact OD1-CB 3.38Å; G337-S395 WeakPolarHBondContact CA-OG 3.42Å; R338-S395 PolarHBondContact N-OG 2.95Å; F391-S395 VanDerWaalsContact O-CB 3.31Å; F391-S395 WeakPolarHBondContact O-CB 3.27Å; F391-S395 PolarHBondContact O-N 2.95Å; L392-S395 PolarHBondContact O-OG 2.96Å; F393-S395 VanDerWaalsContact C-N 3.29Å; F393-S395 PolarHBondContact O-N 3.33Å; S395-V397 PolarHBondContact O-N 3.01Å; S395-S398 PolarHBondContact O-OG 2.96Å; S395-T399 PolarHBondContact O-OG1 3.2Å
396S77.4Confident84.1Confident0 Ų011.7 Ų11.70%07%0.067CC..Hα-helixtrans-67.1-39.3-170.870.30000113.1W341 I357 F393 L394 S398 T399 V400W341-S396 VanDerWaalsContact CG-CB 3.44Å; I357-S396 WeakPolarHBondContact CD1-OG 3.32Å; I357-S396 VanDerWaalsContact CG1-OG 3.28Å; I357-S396 WeakPolarHBondContact CG1-OG 3.33Å; I357-S396 WeakPolarHBondContact CG2-OG 3.26Å; F393-S396 WeakPolarHBondContact O-CB 3.46Å; F393-S396 PolarHBondContact O-N 3.33Å; F393-S396 PolarHBondContact O-OG 3.28Å; L394-S396 PolarHBondContact O-N 3.39Å; L394-S396 VanDerWaalsContact O-N 3.1Å; S396-S398 VanDerWaalsContact C-N 3.29Å; S396-S398 PolarHBondContact O-N 2.82Å; S396-T399 PolarHBondContact O-N 2.8Å; S396-V400 WeakPolarHBondContact O-CB 3.46Å; S396-V400 VanDerWaalsContact O-CG2 3.23Å; S396-V400 WeakPolarHBondContact O-CG2 3.31Å; S396-V400 PolarHBondContact O-N 2.99Å
397V80.8Confident83.5Confident6 Ų613.1 Ų13.14%0.0369%0.086CC..Hα-helixtrans-59.7-44.3-175.5177.70000110.3E295 N298 I357 W361 L394 S395 T399 A401E295-V397 WeakPolarHBondContact OE1-CG1 3.43Å; N298-V397 HydrophobicContact CB-CG1 4.12Å; N298-V397 HydrophobicContact CB-CG2 3.97Å; I357-V397 HydrophobicContact CG2-CG2 4.15Å; W361-V397 HydrophobicContact CE3-CG2 4.45Å; W361-V397 HydrophobicContact CZ3-CG2 3.9Å; L394-V397 PolarHBondContact O-N 2.98Å; S395-V397 PolarHBondContact O-N 3.01Å; V397-T399 PolarHBondContact O-N 2.94Å; V397-A401 WeakPolarHBondContact O-CB 3.34Å; V397-A401 PolarHBondContact O-N 3.45Å
398S78.2Confident83.1Confident15 Ų1514.9 Ų14.911%0.1059%0.094CC..Hα-helixtrans-70.4-8.317859.60000115.4R338 S395 S396 P402R338-S398 PolarHBondContact NH1-OG 3.27Å; R338-S398 PolarHBondContact NH2-OG 3.06Å; S395-S398 PolarHBondContact O-OG 2.96Å; S396-S398 VanDerWaalsContact C-N 3.29Å; S396-S398 PolarHBondContact O-N 2.82Å; S398-P402 WeakPolarHBondContact O-CD 3.39Å; S398-P402 VanDerWaalsContact O-CG 3.24Å; S398-P402 WeakPolarHBondContact O-CG 3.45Å
399T83.3Confident82.7Confident0 Ų013.4 Ų13.40%09%0.087CC..Hα-helixtrans-106.5-46175.3-49.40000111.6R338 S395 S396 V397 P402 A403R338-T399 WeakPolarHBondContact CA-OG1 3.34Å; R338-T399 WeakPolarHBondContact CB-OG1 3.15Å; R338-T399 WeakPolarHBondContact CG-OG1 3.28Å; R338-T399 WeakPolarHBondContact O-CG2 3.3Å; S395-T399 PolarHBondContact O-OG1 3.2Å; S396-T399 PolarHBondContact O-N 2.8Å; V397-T399 PolarHBondContact O-N 2.94Å; T399-P402 WeakPolarHBondContact O-CD 3.16Å; T399-P402 WeakPolarHBondContact O-CG 3.45Å; T399-A403 WeakPolarHBondContact O-CB 3.46Å; T399-A403 PolarHBondContact O-N 3.38Å
400V85.5Confident82.1Confident0 Ų013 Ų130%08%0.082CC..Hα-helixtrans-68-39-178.9-177.70000110.4W341 V345 F354 I357 S396 A403 A404W341-V400 HydrophobicContact CB-CG2 4.15Å; V345-V400 HydrophobicContact CG2-CB 4.07Å; V345-V400 HydrophobicContact CG2-CG1 3.7Å; V345-V400 HydrophobicContact CG2-CG2 3.71Å; F354-V400 HydrophobicContact CD1-CG1 4.24Å; F354-V400 HydrophobicContact CD2-CG1 3.64Å; F354-V400 HydrophobicContact CE1-CB 4.05Å; F354-V400 HydrophobicContact CE1-CG1 3.94Å; F354-V400 HydrophobicContact CE2-CB 4.18Å; F354-V400 HydrophobicContact CE2-CG1 3.31Å; F354-V400 HydrophobicContact CG-CG1 4.1Å; F354-V400 HydrophobicContact CZ-CB 3.81Å; F354-V400 HydrophobicContact CZ-CG1 3.47Å; F354-V400 VanDerWaalsContact CZ-CG1 3.47Å; I357-V400 HydrophobicContact CD1-CG2 4.07Å; S396-V400 WeakPolarHBondContact O-CB 3.46Å; S396-V400 VanDerWaalsContact O-CG2 3.23Å; S396-V400 WeakPolarHBondContact O-CG2 3.31Å; S396-V400 PolarHBondContact O-N 2.99Å; V400-A403 PolarHBondContact O-N 3.35Å; V400-A404 VanDerWaalsContact O-CB 3.26Å; V400-A404 WeakPolarHBondContact O-CB 3.35Å; V400-A404 PolarHBondContact O-N 3.23Å
401A85.2Confident81.4Confident1 Ų114.7 Ų14.71%0.0089%0.092CC..Hα-helixtrans-61.7-55.4-179.900000113.5E295 F354 V397 A403 A404 I405 Y418E295-A401 WeakPolarHBondContact OE1-CB 3.49Å; F354-A401 HydrophobicContact CZ-CB 4.12Å; V397-A401 WeakPolarHBondContact O-CB 3.34Å; V397-A401 PolarHBondContact O-N 3.45Å; A401-A403 VanDerWaalsContact C-N 3.3Å; A401-A403 PolarHBondContact O-N 2.8Å; A401-A404 PolarHBondContact O-N 2.88Å; A401-I405 WeakPolarHBondContact O-CB 3.31Å; A401-I405 VanDerWaalsContact O-CD1 3.32Å; A401-I405 WeakPolarHBondContact O-CD1 3.38Å; A401-I405 WeakPolarHBondContact O-CG1 3.33Å; A401-I405 PolarHBondContact O-N 2.9Å; A401-Y418 HydrophobicContact CB-CE2 4.28Å
402P82.2Confident80.9Confident0 Ų019 Ų190%012%0.119CC..Hα-helixtrans-62-37.7177.121.9-31.1000112.2L153 V168 S398 T399 I405 G406 M414 Y418L153-P402 HydrophobicContact CD2-CB 3.79Å; L153-P402 HydrophobicContact CD2-CG 4.13Å; V168-P402 HydrophobicContact CG1-CB 4.38Å; V168-P402 HydrophobicContact CG1-CG 4.01Å; S398-P402 WeakPolarHBondContact O-CD 3.39Å; S398-P402 VanDerWaalsContact O-CG 3.24Å; S398-P402 WeakPolarHBondContact O-CG 3.45Å; T399-P402 WeakPolarHBondContact O-CD 3.16Å; T399-P402 WeakPolarHBondContact O-CG 3.45Å; P402-I405 PolarHBondContact O-N 3.48Å; P402-G406 PolarHBondContact O-N 3.48Å; P402-M414 HydrophobicContact CB-CE 3.78Å; P402-M414 WeakPolarHBondContact O-CE 3.49Å; P402-Y418 HydrophobicContact CB-CD1 4.05Å; P402-Y418 HydrophobicContact CB-CE1 3.91Å; P402-Y418 HydrophobicContact CB-CE2 4.39Å; P402-Y418 HydrophobicContact CB-CG 4.4Å; P402-Y418 HydrophobicContact CG-CE1 4.23Å
403A80.3Confident80.6Confident16 Ų1617.6 Ų17.613%0.13211%0.112CC..Hα-helixtrans-61.8-47176.100000112.1V345 T399 V400 A401 I405 G406 S407V345-A403 HydrophobicContact CG1-CB 3.8Å; T399-A403 WeakPolarHBondContact O-CB 3.46Å; T399-A403 PolarHBondContact O-N 3.38Å; V400-A403 PolarHBondContact O-N 3.35Å; A401-A403 VanDerWaalsContact C-N 3.3Å; A401-A403 PolarHBondContact O-N 2.8Å; A403-I405 VanDerWaalsContact C-N 3.35Å; A403-I405 PolarHBondContact O-N 3.19Å; A403-G406 PolarHBondContact O-N 2.7Å; A403-S407 PolarHBondContact O-N 3.43Å; A403-S407 PolarHBondContact O-OG 3.49Å
404A83.8Confident80.4Confident0 Ų016.4 Ų16.40%011%0.107CC..Hα-helixtrans-60.7-43.917600000111.4L291 Y350 F354 V400 A401 G406 S407 M408L291-A404 HydrophobicContact CD1-CB 4.49Å; Y350-A404 HydrophobicContact CD1-CB 4.23Å; Y350-A404 HydrophobicContact CD2-CB 3.95Å; Y350-A404 HydrophobicContact CG-CB 3.75Å; F354-A404 HydrophobicContact CE2-CB 4.39Å; V400-A404 VanDerWaalsContact O-CB 3.26Å; V400-A404 WeakPolarHBondContact O-CB 3.35Å; V400-A404 PolarHBondContact O-N 3.23Å; A401-A404 PolarHBondContact O-N 2.88Å; A404-G406 PolarHBondContact O-N 2.97Å; A404-S407 PolarHBondContact O-N 3.43Å; A404-S407 PolarHBondContact O-OG 3.04Å; A404-M408 HydrophobicContact CB-CE 4.28Å; A404-M408 WeakPolarHBondContact O-CB 3.39Å; A404-M408 WeakPolarHBondContact O-CG 3.48Å; A404-M408 PolarHBondContact O-N 3.48Å
405I84.4Confident80.5Confident0 Ų016.7 Ų16.70%011%0.111CC..Hα-helixtrans-62.5-45.1178.8-69163.4000111.3L291 A401 P402 A403 S407 M408 F409 N417 Y418 I421L291-I405 HydrophobicContact CD1-CD1 4.36Å; L291-I405 HydrophobicContact CD1-CG1 3.65Å; A401-I405 WeakPolarHBondContact O-CB 3.31Å; A401-I405 VanDerWaalsContact O-CD1 3.32Å; A401-I405 WeakPolarHBondContact O-CD1 3.38Å; A401-I405 WeakPolarHBondContact O-CG1 3.33Å; A401-I405 PolarHBondContact O-N 2.9Å; P402-I405 PolarHBondContact O-N 3.48Å; A403-I405 VanDerWaalsContact C-N 3.35Å; A403-I405 PolarHBondContact O-N 3.19Å; I405-S407 VanDerWaalsContact C-N 3.28Å; I405-S407 PolarHBondContact O-N 3.4Å; I405-M408 PolarHBondContact O-N 2.95Å; I405-F409 HydrophobicContact CB-CD2 4.36Å; I405-F409 HydrophobicContact CG1-CD2 4.45Å; I405-F409 HydrophobicContact CG2-CD2 4.03Å; I405-F409 PolarHBondContact O-N 3.37Å; I405-N417 HydrophobicContact CG2-CB 4.07Å; I405-Y418 HydrophobicContact CD1-CD2 3.41Å; I405-Y418 VanDerWaalsContact CD1-CD2 3.41Å; I405-Y418 HydrophobicContact CD1-CE2 4.22Å; I405-Y418 HydrophobicContact CD1-CG 4.12Å; I405-I421 HydrophobicContact CD1-CB 4.17Å; I405-I421 HydrophobicContact CD1-CD1 3.41Å; I405-I421 VanDerWaalsContact CD1-CD1 3.41Å; I405-I421 HydrophobicContact CD1-CG1 4.36Å; I405-I421 HydrophobicContact CD1-CG2 4.22Å; I405-I421 HydrophobicContact CG1-CD1 3.55Å
406G77.1Confident80.9Confident12 Ų1216.7 Ų16.712%0.12411%0.111CC..Hα-helixtrans-61.9-36.1176.800000112.8P402 A403 A404 G410P402-G406 PolarHBondContact O-N 3.48Å; A403-G406 PolarHBondContact O-N 2.7Å; A404-G406 PolarHBondContact O-N 2.97Å; G406-G410 CarbonylContact O-C 3.22Å; G406-G410 WeakPolarHBondContact O-CA 3.22Å; G406-G410 PolarHBondContact O-N 3.41Å
407S78Confident81.5Confident86 Ų8616.7 Ų16.760%0.60111%0.111SC*.Hα-helixtrans-73.7-35.7176.770.50000114.1A403 A404 I405A403-S407 PolarHBondContact O-N 3.43Å; A403-S407 PolarHBondContact O-OG 3.49Å; A404-S407 PolarHBondContact O-N 3.43Å; A404-S407 PolarHBondContact O-OG 3.04Å; I405-S407 VanDerWaalsContact C-N 3.28Å; I405-S407 PolarHBondContact O-N 3.4Å
408M81.7Confident81.8Confident38 Ų3816.5 Ų16.519%0.18711%0.109CC..Hα-helixtrans-90.5-40-174-69.6-172.3-60.100113.7D287 L291 Y350 A404 I405D287-M408 HydrophobicContact CB-CE 4.2Å; D287-M408 HydrophobicContact CB-SD 3.77Å; L291-M408 HydrophobicContact CD1-CE 3.25Å; L291-M408 HydrophobicContact CG-CE 4.03Å; Y350-M408 HydrophobicContact CE1-CG 4.18Å; Y350-M408 HydrophobicContact CE1-SD 4.06Å; Y350-M408 HydrophobicContact CE2-SD 4.04Å; Y350-M408 PolarHBondContact OH-SD 3.26Å; A404-M408 HydrophobicContact CB-CE 4.28Å; A404-M408 WeakPolarHBondContact O-CB 3.39Å; A404-M408 WeakPolarHBondContact O-CG 3.48Å; A404-M408 PolarHBondContact O-N 3.48Å; I405-M408 PolarHBondContact O-N 2.95Å
409F84.1Confident82.1Confident2 Ų215.8 Ų15.81%0.00910%0.104CC..Hα-helixtrans-110.13.4-171.2-55.3-63.1000113V275 I277 L282 H285 D287 F288 I405 I421V275-F409 CarbonylContact O-C 3.55Å; I277-F409 HydrophobicContact CB-CB 4.26Å; I277-F409 HydrophobicContact CB-CD1 4.27Å; I277-F409 HydrophobicContact CD1-CD1 3.66Å; I277-F409 HydrophobicContact CD1-CE1 4.38Å; I277-F409 HydrophobicContact CG2-CD1 4.41Å; I277-F409 PolarHBondContact N-O 3.17Å; L282-F409 HydrophobicContact CD1-CB 4.47Å; L282-F409 HydrophobicContact CD1-CD1 3.48Å; L282-F409 VanDerWaalsContact CD1-CD1 3.48Å; L282-F409 HydrophobicContact CD1-CD2 3.67Å; L282-F409 HydrophobicContact CD1-CE1 3.46Å; L282-F409 VanDerWaalsContact CD1-CE1 3.46Å; L282-F409 HydrophobicContact CD1-CE2 3.62Å; L282-F409 HydrophobicContact CD1-CG 3.6Å; L282-F409 HydrophobicContact CD1-CZ 3.52Å; H285-F409 HydrophobicContact CB-CE1 3.95Å; D287-F409 HydrophobicContact CB-CZ 4.17Å; F288-F409 HydrophobicContact CB-CZ 4.24Å; I405-F409 HydrophobicContact CB-CD2 4.36Å; I405-F409 HydrophobicContact CG1-CD2 4.45Å; I405-F409 HydrophobicContact CG2-CD2 4.03Å; I405-F409 PolarHBondContact O-N 3.37Å; F409-I421 HydrophobicContact CE2-CD1 4.2Å
410G76.5Confident82.4Confident4 Ų416.9 Ų16.94%0.04111%0.11CC..  trans78.6175.9-178.900000114D276 G406D276-G410 VanDerWaalsContact OD1-C 3.24Å; D276-G410 WeakPolarHBondContact OD1-CA 3.46Å; G406-G410 CarbonylContact O-C 3.22Å; G406-G410 WeakPolarHBondContact O-CA 3.22Å; G406-G410 PolarHBondContact O-N 3.41Å
411C71.5Confident82.5Confident41 Ų4116.9 Ų16.928%0.27711%0.11SC..SBendtrans-99.3-27.7-168.3-72.30000113.4R164 D276 N413 M414R164-C411 PolarHBondContact NH1-SG 3.2Å; D276-C411 PolarHBondContact OD1-N 2.8Å; C411-N413 PolarHBondContact O-N 3.37Å; C411-M414 WeakPolarHBondContact O-CB 3.29Å; C411-M414 PolarHBondContact O-N 3.33Å
412T75.7Confident82.6Confident95 Ų9516.9 Ų16.958%0.58311%0.109SC*.THydrogen-bonded Turntrans-60.8-35.8-175.6-630000111.6D276D276-T412 VanDerWaalsContact CG-OG1 3.29Å; D276-T412 PolarHBondContact OD1-N 3.48Å; D276-T412 VanDerWaalsContact OD1-N 3.15Å; D276-T412 VanDerWaalsContact OD2-CB 3.28Å; D276-T412 WeakPolarHBondContact OD2-CB 3.39Å; D276-T412 PolarHBondContact OD2-OG1 3.12Å
413N82.8Confident82.8Confident10 Ų1018.8 Ų18.85%0.05312%0.122CC..THydrogen-bonded Turntrans-108.312.5-177.8-55.7-48.7000114.6R88 I277 T278 C411 A415 I416 N417R88-N413 PolarHBondContact NH1-OD1 2.85Å; R88-N413 PolarHBondContact NH2-OD1 2.94Å; I277-N413 PolarHBondContact O-ND2 3.4Å; T278-N413 WeakPolarHBondContact CA-ND2 3.31Å; C411-N413 PolarHBondContact O-N 3.37Å; N413-A415 PolarHBondContact O-N 2.63Å; N413-I416 PolarHBondContact O-N 3.35Å; N413-I416 VanDerWaalsContact O-N 3.15Å; N413-N417 PolarHBondContact O-N 3.27Å
414M82.6Confident83Confident13 Ų1318 Ų186%0.06412%0.116CC..Hα-helixtrans-54.9-45.9-170.5-175.6-175.5175.900113.2L153 V168 P402 C411 I416 N417 Y418L153-M414 HydrophobicContact CD2-CE 4.4Å; V168-M414 HydrophobicContact CG2-CE 4.41Å; P402-M414 HydrophobicContact CB-CE 3.78Å; P402-M414 WeakPolarHBondContact O-CE 3.49Å; C411-M414 WeakPolarHBondContact O-CB 3.29Å; C411-M414 PolarHBondContact O-N 3.33Å; M414-I416 VanDerWaalsContact C-N 3.3Å; M414-I416 PolarHBondContact O-N 3.29Å; M414-N417 PolarHBondContact O-N 3.09Å; M414-Y418 WeakPolarHBondContact O-CB 3.21Å; M414-Y418 PolarHBondContact O-N 2.99Å
415A82Confident82.8Confident12 Ų1218.7 Ų18.710%0.09912%0.118CC..Hα-helixtrans-60.5-39-177.500000112.9S150 A154 N413 G419S150-A415 WeakPolarHBondContact CB-O 3.47Å; A154-A415 HydrophobicContact CB-CB 4.1Å; N413-A415 PolarHBondContact O-N 2.63Å; A415-G419 PolarHBondContact O-N 2.93Å; A415-G419 VanDerWaalsContact O-N 3.15Å
416I87.1Confident82.4Confident0 Ų021.7 Ų21.70%013%0.133CC..Hα-helixtrans-76.9-49179.3-56.4-168.2000110.4G84 F85 R88 P279 N413 M414 Y418 G419 I420G84-I416 VanDerWaalsContact C-CG1 3.48Å; F85-I416 HydrophobicContact CB-CD1 4.42Å; F85-I416 HydrophobicContact CD1-CD1 3.54Å; F85-I416 HydrophobicContact CD2-CD1 4.39Å; F85-I416 HydrophobicContact CD2-CG2 4.09Å; F85-I416 HydrophobicContact CE1-CD1 3.76Å; F85-I416 HydrophobicContact CE1-CG2 4.1Å; F85-I416 HydrophobicContact CE2-CG2 3.57Å; F85-I416 HydrophobicContact CG-CD1 3.86Å; F85-I416 HydrophobicContact CZ-CD1 4.28Å; F85-I416 HydrophobicContact CZ-CG2 3.58Å; R88-I416 HydrophobicContact CG-CD1 4.49Å; R88-I416 VanDerWaalsContact NH2-CD1 3.31Å; P279-I416 HydrophobicContact CB-CG2 3.87Å; P279-I416 HydrophobicContact CG-CB 3.98Å; P279-I416 HydrophobicContact CG-CD1 4.37Å; P279-I416 HydrophobicContact CG-CG2 3.55Å; N413-I416 PolarHBondContact O-N 3.35Å; N413-I416 VanDerWaalsContact O-N 3.15Å; M414-I416 VanDerWaalsContact C-N 3.3Å; M414-I416 PolarHBondContact O-N 3.29Å; I416-Y418 VanDerWaalsContact C-N 3.26Å; I416-Y418 PolarHBondContact O-N 3.15Å; I416-G419 CarbonylContact O-C 3.56Å; I416-G419 WeakPolarHBondContact O-CA 3.44Å; I416-G419 PolarHBondContact O-N 2.81Å; I416-I420 HydrophobicContact CG2-CD1 3.91Å; I416-I420 HydrophobicContact CG2-CG1 4.32Å; I416-I420 WeakPolarHBondContact O-CG1 3.39Å; I416-I420 PolarHBondContact O-N 3.45Å
417N88.3Confident81.9Confident0 Ų028 Ų280%015%0.153CC..Hα-helixtrans-59.8-41.2-178.4-67.8-9.6000110.9I277 P279 L282 I405 N413 M414 I420 I421I277-N417 PolarHBondContact O-ND2 2.68Å; I277-N417 VanDerWaalsContact O-ND2 3.14Å; P279-N417 WeakPolarHBondContact CA-OD1 3.27Å; L282-N417 HydrophobicContact CD2-CB 4.14Å; I405-N417 HydrophobicContact CG2-CB 4.07Å; N413-N417 PolarHBondContact O-N 3.27Å; M414-N417 PolarHBondContact O-N 3.09Å; N417-I420 PolarHBondContact O-N 2.85Å; N417-I421 PolarHBondContact O-N 3.49Å; N417-I421 VanDerWaalsContact O-N 3.13Å
418Y87.1Confident81Confident2 Ų225 Ų251%0.00813%0.129CC..Hα-helixtrans-67.1-39.8174.4-175.3-145.9000112.6M80 F149 L153 A401 P402 I405 M414 I416 I420 I421 A422M80-Y418 HydrophobicContact CE-CD1 2.95Å; M80-Y418 HydrophobicContact CE-CD2 3.9Å; M80-Y418 HydrophobicContact CE-CE1 3.08Å; M80-Y418 HydrophobicContact CE-CE2 4.04Å; M80-Y418 HydrophobicContact CE-CG 3.37Å; F149-Y418 HydrophobicContact CD1-CE1 4.13Å; F149-Y418 AromaticContact CE1-CE1 3.84Å; F149-Y418 HydrophobicContact CE1-CE1 3.84Å; L153-Y418 HydrophobicContact CD2-CE1 4.35Å; A401-Y418 HydrophobicContact CB-CE2 4.28Å; P402-Y418 HydrophobicContact CB-CD1 4.05Å; P402-Y418 HydrophobicContact CB-CE1 3.91Å; P402-Y418 HydrophobicContact CB-CE2 4.39Å; P402-Y418 HydrophobicContact CB-CG 4.4Å; P402-Y418 HydrophobicContact CG-CE1 4.23Å; I405-Y418 HydrophobicContact CD1-CD2 3.41Å; I405-Y418 VanDerWaalsContact CD1-CD2 3.41Å; I405-Y418 HydrophobicContact CD1-CE2 4.22Å; I405-Y418 HydrophobicContact CD1-CG 4.12Å; M414-Y418 WeakPolarHBondContact O-CB 3.21Å; M414-Y418 PolarHBondContact O-N 2.99Å; I416-Y418 VanDerWaalsContact C-N 3.26Å; I416-Y418 PolarHBondContact O-N 3.15Å; Y418-I420 PolarHBondContact O-N 3.22Å; Y418-I421 PolarHBondContact O-N 2.65Å; Y418-A422 VanDerWaalsContact O-CB 3.28Å; Y418-A422 WeakPolarHBondContact O-CB 3.45Å; Y418-A422 PolarHBondContact O-N 3.17Å
419G85.7Confident80.1Confident0 Ų025.7 Ų25.70%013%0.131CC..Hα-helixtrans-58.3-44.6172.400000113.1P81 A415 I416 I421 A422 C423P81-G419 WeakPolarHBondContact CD-O 3.43Å; A415-G419 PolarHBondContact O-N 2.93Å; A415-G419 VanDerWaalsContact O-N 3.15Å; I416-G419 CarbonylContact O-C 3.56Å; I416-G419 WeakPolarHBondContact O-CA 3.44Å; I416-G419 PolarHBondContact O-N 2.81Å; G419-I421 PolarHBondContact O-N 3.05Å; G419-A422 WeakPolarHBondContact O-CB 3.38Å; G419-A422 PolarHBondContact O-N 2.7Å; G419-C423 PolarHBondContact O-N 3.41Å; G419-C423 VanDerWaalsContact O-N 3.08Å; G419-C423 PolarHBondContact O-SG 2.79Å; G419-C423 VanDerWaalsContact O-SG 3.41Å
420I89.1Confident79Confident23 Ų2330 Ų3012%0.11815%0.153CC..Hα-helixtrans-64.1-41.2179.3-64169.9000111.1P81 P279 L282 F283 F288 I416 N417 Y418 A422 C423P81-I420 HydrophobicContact CB-CG1 4.17Å; P279-I420 HydrophobicContact CB-CD1 3.82Å; L282-I420 HydrophobicContact CD2-CB 4.17Å; L282-I420 HydrophobicContact CD2-CD1 4.31Å; L282-I420 HydrophobicContact CD2-CG2 4.16Å; F283-I420 HydrophobicContact CE1-CG2 4.14Å; F283-I420 HydrophobicContact CZ-CG2 3.72Å; F288-I420 HydrophobicContact CE2-CG2 3.76Å; F288-I420 HydrophobicContact CZ-CG2 3.99Å; I416-I420 HydrophobicContact CG2-CD1 3.91Å; I416-I420 HydrophobicContact CG2-CG1 4.32Å; I416-I420 WeakPolarHBondContact O-CG1 3.39Å; I416-I420 PolarHBondContact O-N 3.45Å; N417-I420 PolarHBondContact O-N 2.85Å; Y418-I420 PolarHBondContact O-N 3.22Å; I420-A422 VanDerWaalsContact C-N 3.35Å; I420-C423 VanDerWaalsContact O-CB 3.27Å; I420-C423 WeakPolarHBondContact O-CB 3.46Å; I420-C423 PolarHBondContact O-N 3.2Å
421I88.3Confident78.4Confident0 Ų036 Ų360%018%0.175CC..Hα-helixtrans-65.8-40.7175.3-71.3167.3000110.6F288 L291 E295 I405 F409 N417 Y418 G419 C423 A424F288-I421 HydrophobicContact CD2-CD1 4.06Å; F288-I421 HydrophobicContact CD2-CG1 3.52Å; F288-I421 HydrophobicContact CE2-CG1 3.6Å; L291-I421 HydrophobicContact CB-CD1 4.39Å; L291-I421 HydrophobicContact CB-CG2 4.26Å; L291-I421 HydrophobicContact CD1-CD1 4.1Å; E295-I421 HydrophobicContact CG-CG2 4.05Å; I405-I421 HydrophobicContact CD1-CB 4.17Å; I405-I421 HydrophobicContact CD1-CD1 3.41Å; I405-I421 VanDerWaalsContact CD1-CD1 3.41Å; I405-I421 HydrophobicContact CD1-CG1 4.36Å; I405-I421 HydrophobicContact CD1-CG2 4.22Å; I405-I421 HydrophobicContact CG1-CD1 3.55Å; F409-I421 HydrophobicContact CE2-CD1 4.2Å; N417-I421 PolarHBondContact O-N 3.49Å; N417-I421 VanDerWaalsContact O-N 3.13Å; Y418-I421 PolarHBondContact O-N 2.65Å; G419-I421 PolarHBondContact O-N 3.05Å; I421-C423 PolarHBondContact O-N 3.12Å; I421-A424 VanDerWaalsContact O-CB 3.25Å; I421-A424 WeakPolarHBondContact O-CB 3.33Å; I421-A424 PolarHBondContact O-N 3.48Å; I421-A424 VanDerWaalsContact O-N 3.1Å
422A86.1Confident77.9Confident0 Ų035.8 Ų35.80%017%0.169CC..Hα-helixtrans-64.3-20.1177.300000114.1M80 Y418 G419 I420 A424 R425M80-A422 HydrophobicContact CE-CB 3.98Å; M80-A422 HydrophobicContact SD-CB 3.26Å; M80-A422 WeakPolarHBondContact SD-CB 3.39Å; Y418-A422 VanDerWaalsContact O-CB 3.28Å; Y418-A422 WeakPolarHBondContact O-CB 3.45Å; Y418-A422 PolarHBondContact O-N 3.17Å; G419-A422 WeakPolarHBondContact O-CB 3.38Å; G419-A422 PolarHBondContact O-N 2.7Å; I420-A422 VanDerWaalsContact C-N 3.35Å; A422-A424 PolarHBondContact O-N 3.45Å; A422-R425 WeakPolarHBondContact O-CB 3.48Å; A422-R425 WeakPolarHBondContact O-CG 3.29Å; A422-R425 PolarHBondContact O-N 3.23Å
423C87.1Confident77.2Confident40 Ų4034.2 Ų34.227%0.2716%0.157SC..THydrogen-bonded Turntrans-56.4-20.8170.6-68.60000113G77 G419 I420 I421 R425 M426G77-C423 PolarHBondContact O-SG 3.07Å; G419-C423 PolarHBondContact O-N 3.41Å; G419-C423 VanDerWaalsContact O-N 3.08Å; G419-C423 PolarHBondContact O-SG 2.79Å; G419-C423 VanDerWaalsContact O-SG 3.41Å; I420-C423 VanDerWaalsContact O-CB 3.27Å; I420-C423 WeakPolarHBondContact O-CB 3.46Å; I420-C423 PolarHBondContact O-N 3.2Å; I421-C423 PolarHBondContact O-N 3.12Å; C423-R425 PolarHBondContact O-N 3.27Å; C423-R425 VanDerWaalsContact O-N 3.1Å; C423-M426 VanDerWaalsContact O-CB 3.28Å; C423-M426 WeakPolarHBondContact O-CB 3.4Å; C423-M426 PolarHBondContact O-N 2.89Å
424A84.4Confident75.8Confident0 Ų039.5 Ų39.50%018%0.181CC..Hα-helixtrans-48.8-35.8171.400000112.7W292 E295 L296 I421 A422 M426 R427W292-A424 HydrophobicContact CD2-CB 3.87Å; W292-A424 HydrophobicContact CG-CB 3.91Å; W292-A424 HydrophobicContact CZ2-CB 4.24Å; W292-A424 VanDerWaalsContact O-CB 3.31Å; W292-A424 WeakPolarHBondContact O-CB 3.18Å; E295-A424 HydrophobicContact CB-CB 4.02Å; L296-A424 HydrophobicContact CB-CB 4.13Å; L296-A424 VanDerWaalsContact CD1-O 3.24Å; L296-A424 WeakPolarHBondContact CD1-O 3.25Å; I421-A424 VanDerWaalsContact O-CB 3.25Å; I421-A424 WeakPolarHBondContact O-CB 3.33Å; I421-A424 PolarHBondContact O-N 3.48Å; I421-A424 VanDerWaalsContact O-N 3.1Å; A422-A424 PolarHBondContact O-N 3.45Å; A424-M426 PolarHBondContact O-N 2.89Å; A424-R427 PolarHBondContact O-N 2.87Å
425R79.1Confident74.6Confident14 Ų1441.2 Ų41.25%0.05319%0.189CC..Hα-helixtrans-63.2-23.6-179.8-59.2-176.1-173.9118.53.8113.2E295 A422 C423E295-R425 IonicContact OE1-NH2 2.69Å; E295-R425 PolarHBondContact OE1-NH2 3.36Å; E295-R425 VanDerWaalsContact OE1-NH2 3.17Å; E295-R425 IonicContact OE2-CZ 3.31Å; E295-R425 IonicContact OE2-NE 3.17Å; E295-R425 PolarHBondContact OE2-NE 3.46Å; E295-R425 IonicContact OE2-NH2 3.35Å; E295-R425 PolarHBondContact OE2-NH2 2.94Å; A422-R425 WeakPolarHBondContact O-CB 3.48Å; A422-R425 WeakPolarHBondContact O-CG 3.29Å; A422-R425 PolarHBondContact O-N 3.23Å; C423-R425 PolarHBondContact O-N 3.27Å; C423-R425 VanDerWaalsContact O-N 3.1Å
426M76.7Confident73.3Confident63 Ų6342.6 Ų42.631%0.3120%0.198SC..Hα-helixtrans-69.7-35.5177.1-175.7-170.2176.200112.7I78 C423 A424 R428 F429 L430I78-M426 HydrophobicContact CD1-CE 3.85Å; I78-M426 HydrophobicContact CD1-CG 3.99Å; I78-M426 HydrophobicContact CD1-SD 3.69Å; I78-M426 HydrophobicContact CG1-CB 4.34Å; I78-M426 HydrophobicContact CG1-CE 4.34Å; I78-M426 HydrophobicContact CG1-CG 4Å; I78-M426 HydrophobicContact CG1-SD 3.54Å; I78-M426 VanDerWaalsContact CG1-SD 3.54Å; C423-M426 VanDerWaalsContact O-CB 3.28Å; C423-M426 WeakPolarHBondContact O-CB 3.4Å; C423-M426 PolarHBondContact O-N 2.89Å; A424-M426 PolarHBondContact O-N 2.89Å; M426-R428 PolarHBondContact O-N 3.23Å; M426-F429 WeakPolarHBondContact O-CA 3.28Å; M426-F429 VanDerWaalsContact O-CB 3.31Å; M426-F429 WeakPolarHBondContact O-CB 3.4Å; M426-F429 PolarHBondContact O-N 3.42Å; M426-L430 HydrophobicContact CE-CD1 4.48Å; M426-L430 PolarHBondContact O-N 3.14Å
427R66.8Low71.1Confident145 Ų14547.7 Ų47.755%0.54723%0.233SC..Hα-helixtrans-60-28.5-174.2-178172.7-179.7-173.24.8112.1L296 A424 L430 W431L296-R427 HydrophobicContact CD1-CB 3.8Å; L296-R427 HydrophobicContact CD1-CG 4.29Å; A424-R427 PolarHBondContact O-N 2.87Å; R427-L430 PolarHBondContact O-N 3.04Å; R427-W431 PolarHBondContact O-N 3.19Å
428R58.7Low68.9Low24 Ų2453.1 Ų53.19%0.09126%0.261CS..Hα-helixtrans-68.8-34.9173.7-161.9-175.9-179.1-161.63.4113.2S299 I300 T303 M426 L430 W431 F432S299-R428 PolarHBondContact O-NH1 3.47Å; S299-R428 VanDerWaalsContact O-NH1 3.15Å; I300-R428 HydrophobicContact CG1-CG 4.46Å; I300-R428 PolarHBondContact O-NH1 3.38Å; I300-R428 PolarHBondContact O-NH2 2.74Å; T303-R428 PolarHBondContact OG1-NH1 2.93Å; M426-R428 PolarHBondContact O-N 3.23Å; R428-L430 VanDerWaalsContact C-N 3.3Å; R428-W431 PolarHBondContact O-N 3.5Å; R428-F432 HydrophobicContact CG-CD2 3.75Å; R428-F432 HydrophobicContact CG-CE2 3.82Å; R428-F432 WeakPolarHBondContact O-CB 3.3Å; R428-F432 WeakPolarHBondContact O-CD2 3.39Å; R428-F432 PolarHBondContact O-N 2.76Å
429F62.6Low66.8Low51 Ų5159.3 Ų59.322%0.22429%0.287CS..Hα-helixtrans-63.4-39.5172.7174.9-101.4000111.4W67 V71 A74 M426 F432 L433W67-F429 HydrophobicContact CE3-CD2 4.48Å; W67-F429 HydrophobicContact CE3-CE2 4.21Å; W67-F429 AromaticContact CZ3-CD2 3.86Å; W67-F429 HydrophobicContact CZ3-CD2 3.86Å; W67-F429 AromaticContact CZ3-CE2 3.63Å; W67-F429 HydrophobicContact CZ3-CE2 3.63Å; V71-F429 HydrophobicContact CG2-CE2 3.93Å; A74-F429 HydrophobicContact CB-CB 3.4Å; A74-F429 VanDerWaalsContact CB-CB 3.4Å; A74-F429 HydrophobicContact CB-CD1 4.29Å; A74-F429 HydrophobicContact CB-CD2 4.07Å; A74-F429 HydrophobicContact CB-CG 3.69Å; M426-F429 WeakPolarHBondContact O-CA 3.28Å; M426-F429 VanDerWaalsContact O-CB 3.31Å; M426-F429 WeakPolarHBondContact O-CB 3.4Å; M426-F429 PolarHBondContact O-N 3.42Å; F429-F432 PolarHBondContact O-N 3.29Å; F429-L433 HydrophobicContact CD1-CD1 3.65Å; F429-L433 HydrophobicContact CD1-CG 4.29Å; F429-L433 HydrophobicContact CE1-CD1 3.23Å; F429-L433 HydrophobicContact CE1-CG 4.02Å; F429-L433 HydrophobicContact CE2-CD1 4.33Å; F429-L433 HydrophobicContact CE2-CD2 4.46Å; F429-L433 HydrophobicContact CE2-CG 4.25Å; F429-L433 HydrophobicContact CG-CD1 4.37Å; F429-L433 HydrophobicContact CZ-CD1 3.61Å; F429-L433 HydrophobicContact CZ-CD2 4.17Å; F429-L433 HydrophobicContact CZ-CG 3.98Å; F429-L433 VanDerWaalsContact O-CB 3.32Å; F429-L433 WeakPolarHBondContact O-CB 3.32Å; F429-L433 VanDerWaalsContact O-CG 3.26Å; F429-L433 WeakPolarHBondContact O-CG 3.48Å; F429-L433 PolarHBondContact O-N 3.16Å
430L61.6Low64.4Low92 Ų9262.1 Ų62.148%0.48232%0.317SS..Hα-helixtrans-63.7-42.8172.7-68.8170.4000112.1M426 R427 R428 L433 Q434M426-L430 HydrophobicContact CE-CD1 4.48Å; M426-L430 PolarHBondContact O-N 3.14Å; R427-L430 PolarHBondContact O-N 3.04Å; R428-L430 VanDerWaalsContact C-N 3.3Å; L430-L433 PolarHBondContact O-N 3.25Å; L430-Q434 VanDerWaalsContact O-CB 3.29Å; L430-Q434 WeakPolarHBondContact O-CB 3.47Å; L430-Q434 PolarHBondContact O-N 3.3Å
431W62.6Low61.8Low130 Ų13065.5 Ų65.549%0.49234%0.338SS..Hα-helixtrans-64.2-42.7175.3-175.479.8000112.2R427 R428 Q434 E435R427-W431 PolarHBondContact O-N 3.19Å; R428-W431 PolarHBondContact O-N 3.5Å; W431-Q434 CarbonylContact O-C 3.57Å; W431-Q434 WeakPolarHBondContact O-CB 3.39Å; W431-Q434 PolarHBondContact O-N 3.18Å; W431-E435 HydrophobicContact CH2-CG 4.19Å; W431-E435 HydrophobicContact CZ2-CG 4.33Å; W431-E435 WeakPolarHBondContact O-CB 3.26Å; W431-E435 PolarHBondContact O-N 3.15Å
432F61.4Low59.2Low37 Ų3768 Ų6816%0.16236%0.355CS..Hα-helixtrans-66.4-40.7176.1-89.5-59.8000112.8V66 W67 A70 R428 F429 Q434 E435 S436V66-F432 HydrophobicContact CG1-CE1 4.32Å; V66-F432 HydrophobicContact CG1-CE2 4.26Å; V66-F432 HydrophobicContact CG1-CZ 3.84Å; W67-F432 HydrophobicContact CH2-CB 4.21Å; W67-F432 HydrophobicContact CZ3-CB 4.48Å; A70-F432 HydrophobicContact CB-CD2 4.36Å; R428-F432 HydrophobicContact CG-CD2 3.75Å; R428-F432 HydrophobicContact CG-CE2 3.82Å; R428-F432 WeakPolarHBondContact O-CB 3.3Å; R428-F432 WeakPolarHBondContact O-CD2 3.39Å; R428-F432 PolarHBondContact O-N 2.76Å; F429-F432 PolarHBondContact O-N 3.29Å; F432-Q434 VanDerWaalsContact C-N 3.27Å; F432-Q434 PolarHBondContact O-N 3.29Å; F432-E435 PolarHBondContact O-N 3.2Å; F432-S436 WeakPolarHBondContact O-CB 3.17Å; F432-S436 PolarHBondContact O-N 3.14Å; F432-S436 PolarHBondContact O-OG 3.33Å
433L61.3Low56.4Low63 Ų6373.5 Ų73.533%0.3339%0.389SS..Hα-helixtrans-58.3-45.1171.4-78.9174000110.1W67 F429 L430 S436 C437W67-L433 HydrophobicContact CH2-CD2 3.69Å; W67-L433 HydrophobicContact CH2-CG 4.04Å; W67-L433 HydrophobicContact CZ3-CD2 4.1Å; W67-L433 HydrophobicContact CZ3-CG 4.34Å; F429-L433 HydrophobicContact CD1-CD1 3.65Å; F429-L433 HydrophobicContact CD1-CG 4.29Å; F429-L433 HydrophobicContact CE1-CD1 3.23Å; F429-L433 HydrophobicContact CE1-CG 4.02Å; F429-L433 HydrophobicContact CE2-CD1 4.33Å; F429-L433 HydrophobicContact CE2-CD2 4.46Å; F429-L433 HydrophobicContact CE2-CG 4.25Å; F429-L433 HydrophobicContact CG-CD1 4.37Å; F429-L433 HydrophobicContact CZ-CD1 3.61Å; F429-L433 HydrophobicContact CZ-CD2 4.17Å; F429-L433 HydrophobicContact CZ-CG 3.98Å; F429-L433 VanDerWaalsContact O-CB 3.32Å; F429-L433 WeakPolarHBondContact O-CB 3.32Å; F429-L433 VanDerWaalsContact O-CG 3.26Å; F429-L433 WeakPolarHBondContact O-CG 3.48Å; F429-L433 PolarHBondContact O-N 3.16Å; L430-L433 PolarHBondContact O-N 3.25Å; L433-S436 PolarHBondContact O-N 2.85Å; L433-C437 VanDerWaalsContact O-CB 3.25Å; L433-C437 WeakPolarHBondContact O-CB 3.49Å; L433-C437 PolarHBondContact O-N 3.26Å; L433-C437 PolarHBondContact O-SG 2.72Å
434Q53.3Low53.9Low120 Ų12076.7 Ų76.756%0.56140%0.402SS*.Hα-helixtrans-63.5-47.7177.9-175.5173-19.100111.6L430 W431 F432 S436 C437 I438L430-Q434 VanDerWaalsContact O-CB 3.29Å; L430-Q434 WeakPolarHBondContact O-CB 3.47Å; L430-Q434 PolarHBondContact O-N 3.3Å; W431-Q434 CarbonylContact O-C 3.57Å; W431-Q434 WeakPolarHBondContact O-CB 3.39Å; W431-Q434 PolarHBondContact O-N 3.18Å; F432-Q434 VanDerWaalsContact C-N 3.27Å; F432-Q434 PolarHBondContact O-N 3.29Å; Q434-S436 VanDerWaalsContact C-N 3.35Å; Q434-S436 PolarHBondContact O-N 2.71Å; Q434-C437 PolarHBondContact O-N 3.47Å; Q434-I438 HydrophobicContact CG-CD1 3.61Å; Q434-I438 HydrophobicContact CG-CG1 4.41Å; Q434-I438 WeakPolarHBondContact O-CB 3.15Å; Q434-I438 WeakPolarHBondContact O-CD1 3.49Å; Q434-I438 WeakPolarHBondContact O-CG1 3.38Å; Q434-I438 PolarHBondContact O-N 2.68Å
435E58.4Low51.2Low49 Ų4983.7 Ų83.723%0.22943%0.429CS..Hα-helixtrans-65-38.3179.5-159.675.1-178.600111.9W431 F432 I438 K439W431-E435 HydrophobicContact CH2-CG 4.19Å; W431-E435 HydrophobicContact CZ2-CG 4.33Å; W431-E435 WeakPolarHBondContact O-CB 3.26Å; W431-E435 PolarHBondContact O-N 3.15Å; F432-E435 PolarHBondContact O-N 3.2Å; E435-I438 PolarHBondContact O-N 2.9Å; E435-K439 HydrophobicContact CG-CD 4.27Å; E435-K439 WeakPolarHBondContact O-CB 3.17Å; E435-K439 PolarHBondContact O-N 3.42Å; E435-K439 WeakPolarHBondContact OE1-CE 3.03Å; E435-K439 IonicContact OE1-NZ 2.68Å; E435-K439 PolarHBondContact OE1-NZ 2.82Å
436S54Low48.7Very low41 Ų4190.8 Ų90.829%0.28747%0.467SS..Hα-helixtrans-72.2-36.9178.2-53.70000111.9W67 F432 L433 Q434 G440W67-S436 VanDerWaalsContact CZ2-OG 3.27Å; W67-S436 WeakPolarHBondContact CZ2-OG 3.34Å; F432-S436 WeakPolarHBondContact O-CB 3.17Å; F432-S436 PolarHBondContact O-N 3.14Å; F432-S436 PolarHBondContact O-OG 3.33Å; L433-S436 PolarHBondContact O-N 2.85Å; Q434-S436 VanDerWaalsContact C-N 3.35Å; Q434-S436 PolarHBondContact O-N 2.71Å; S436-G440 PolarHBondContact O-N 3.26Å
437C41.6Very low46.4Very low107 Ų10790.6 Ų90.672%0.72348%0.481SS*.Hα-helixtrans-67.1-37.8171-76.70000112.1L433 Q434L433-C437 VanDerWaalsContact O-CB 3.25Å; L433-C437 WeakPolarHBondContact O-CB 3.49Å; L433-C437 PolarHBondContact O-N 3.26Å; L433-C437 PolarHBondContact O-SG 2.72Å; Q434-C437 PolarHBondContact O-N 3.47Å
438I41.8Very low44.4Very low114 Ų11491.4 Ų91.459%0.58550%0.496SS*.Hα-helixtrans-74.8-41.4-178.1-71.3168.7000111.8Q434 E435 G440Q434-I438 HydrophobicContact CG-CD1 3.61Å; Q434-I438 HydrophobicContact CG-CG1 4.41Å; Q434-I438 WeakPolarHBondContact O-CB 3.15Å; Q434-I438 WeakPolarHBondContact O-CD1 3.49Å; Q434-I438 WeakPolarHBondContact O-CG1 3.38Å; Q434-I438 PolarHBondContact O-N 2.68Å; E435-I438 PolarHBondContact O-N 2.9Å; I438-G440 PolarHBondContact O-N 2.82Å
439K43.5Very low42.9Very low132 Ų13296.9 Ų96.957%0.57453%0.527SS*.SBendtrans-87.10.7-174.5-69-174176.5160.90114.7E435 T441E435-K439 HydrophobicContact CG-CD 4.27Å; E435-K439 WeakPolarHBondContact O-CB 3.17Å; E435-K439 PolarHBondContact O-N 3.42Å; E435-K439 WeakPolarHBondContact OE1-CE 3.03Å; E435-K439 IonicContact OE1-NZ 2.68Å; E435-K439 PolarHBondContact OE1-NZ 2.82Å; K439-T441 WeakPolarHBondContact CB-OG1 3.43Å; K439-T441 PolarHBondContact O-N 2.82Å; K439-T441 PolarHBondContact O-OG1 3.49Å
440G33.9Very low41.2Very low60 Ų60102.1 Ų102.162%0.61956%0.556SS**  trans53.415.5177.800000114.6S436 I438S436-G440 PolarHBondContact O-N 3.26Å; I438-G440 PolarHBondContact O-N 2.82Å
441T35Very low39.5Very low93 Ų93102 Ų10257%0.57156%0.562SS**  trans-96.5112.8-169.4-30000107.5K439K439-T441 WeakPolarHBondContact CB-OG1 3.43Å; K439-T441 PolarHBondContact O-N 2.82Å; K439-T441 PolarHBondContact O-OG1 3.49Å
442C33.1Very low37.8Very low52 Ų5299.7 Ų99.735%0.35157%0.572SS.*SBendtrans72.977.9-168.2-640000114.9C61 T64 I444C61-C442 WeakPolarHBondContact CB-SG 3.16Å; C61-C442 PolarHBondContact SG-SG 3.34Å; T64-C442 HydrophobicContact CG2-CB 3.72Å; T64-C442 WeakPolarHBondContact CG2-SG 3.22Å; C442-I444 PolarHBondContact O-N 3.5Å
443T28.1Very low36.1Very low116 Ų116107.2 Ų107.271%0.71260%0.604SS**  trans-50.9109.3154.14.30000109.5R445T443-R445 PolarHBondContact O-N 2.91Å
444I33.9Very low34.4Very low107 Ų107113.4 Ų113.455%0.54963%0.632SS.*  trans-6890.3156.8-61.8175.8000105.3V131 C442 L446V131-I444 HydrophobicContact CG2-CG2 3.55Å; C442-I444 PolarHBondContact O-N 3.5Å; I444-L446 PolarHBondContact O-N 3.22Å; I444-L446 VanDerWaalsContact O-N 3.14Å
445R27.1Very low33.2Very low147 Ų147118.1 Ų118.156%0.55565%0.646SS**  trans-75.5100.5178.4-117.3-175-167.2169.98.7109.1T443 G447 D449 S451T443-R445 PolarHBondContact O-N 2.91Å; R445-G447 PolarHBondContact O-N 3.39Å; R445-D449 VanDerWaalsContact CZ-O 3.25Å; R445-D449 PolarHBondContact NH1-O 2.86Å; R445-S451 PolarHBondContact NH2-O 3.36Å
446L27.7Very low31.7Very low164 Ų164119.5 Ų119.586%0.85966%0.661SS**  trans-80.1101160.9-74.9162.8000107.6I444I444-L446 PolarHBondContact O-N 3.22Å; I444-L446 VanDerWaalsContact O-N 3.14Å
447G27.5Very low30.5Very low58 Ų58123 Ų12360%0.59869%0.685SS**SBendtrans103.1145.616600000116.3R445 D449R445-G447 PolarHBondContact O-N 3.39Å; G447-D449 PolarHBondContact O-N 2.75Å
448N25.3Very low29.8Very low163 Ų163123.4 Ų123.487%0.87268%0.68SS**  trans-60107.9-179.7-70.9-17.6000110.7
449D28Very low29.2Very low138 Ų138127.4 Ų127.474%0.73870%0.699SS**  trans-166.1139.3142.7-92.9-31.4000112.3R445 G447R445-D449 VanDerWaalsContact CZ-O 3.25Å; R445-D449 PolarHBondContact NH1-O 2.86Å; G447-D449 PolarHBondContact O-N 2.75Å
450I26.9Very low28.6Very low162 Ų162132.7 Ų132.783%0.83172%0.715SS**  trans-82.4118.1-171.5-64.6164.4000109.3
451S25.3Very low28.3Very low88 Ų88137.1 Ų137.162%0.61572%0.72SS**  trans174.4130.7147360000112.7R445R445-S451 PolarHBondContact NH2-O 3.36Å
452A25.9Very low27.9Very low83 Ų83142.2 Ų142.269%0.68674%0.737SS**  trans59.1111152.300000120.6
453F27.5Very low27.6Very low194 Ų194148.5 Ų148.585%0.85176%0.764SS**  176.3123.392.2-120.2-91.1000110
454Q24Very low27.6Very low193 Ų193148.7 Ų148.790%0.90276%0.764SS**  trans-92.5118.9178.4-161.4156.3-27.100106.6
455Y27.9Very low27.4Very low220 Ų220149.8 Ų149.886%0.86377%0.77SS**  trans-118.4126.9171.4-146.3-92000110.6
456S27.6Very low27.5Very low77 Ų77149.6 Ų149.654%0.53879%0.785SS.*  trans-57136.7-166.4-173.90000114D458S456-D458 VanDerWaalsContact C-N 3.33Å; S456-D458 PolarHBondContact O-N 3.11Å; S456-D458 VanDerWaalsContact O-N 3.11Å; S456-D458 PolarHBondContact OG-OD2 3.18Å
457S28Very low27.5Very low115 Ų115149.4 Ų149.480%0.80478%0.78SS**  trans-63.883.6153.850.50000110.9
458D27.4Very low27.6Very low115 Ų115154.2 Ų154.262%0.61579%0.792SS**  trans-149.689.6168.4-86.6-44.2000110.9S456S456-D458 VanDerWaalsContact C-N 3.33Å; S456-D458 PolarHBondContact O-N 3.11Å; S456-D458 VanDerWaalsContact O-N 3.11Å; S456-D458 PolarHBondContact OG-OD2 3.18Å
459M29.4Very low27.9Very low199 Ų199151.9 Ų151.998%0.9879%0.788SS**SBendtrans-147.439.1162-94.2-144.9-80.600111.3
460R30.7Very low28.1Very low242 Ų242155.3 Ų155.391%0.91379%0.792SS**SBendtrans-138.627175.7-131.9-168.9-77.7-138.35.1115.1
461Q27.7Very low28.5Very low154 Ų154152.4 Ų152.472%0.7279%0.787SS**  trans-137.36-177.8-116.5176.8-11.400118.5M463Q461-M463 PolarHBondContact O-N 3.15Å
462E26.3Very low29Very low199 Ų199158.7 Ų158.793%0.9380%0.797SS**THydrogen-bonded Turntrans-91.666172.1-72.8-171.3160.300112.1
463M26.7Very low29.6Very low184 Ų184161.1 Ų161.191%0.90680%0.803SS**THydrogen-bonded Turntrans-164.430.3157.3-126.3-172.1-60.500113.6Q461Q461-M463 PolarHBondContact O-N 3.15Å
464V29.7Very low30.4Very low120 Ų120160.4 Ų160.473%0.72783%0.833SS**SBendtrans-100.6110.8166.8-178.30000107.8V466V464-V466 PolarHBondContact O-N 3.05Å
465I29.3Very low30.8Very low130 Ų130158.8 Ų158.867%0.66783%0.83SS**  trans-41.8118.1170.4-68.3160.4000109.7E467I465-E467 HydrophobicContact CG2-CB 3.76Å; I465-E467 HydrophobicContact CG2-CG 4Å; I465-E467 PolarHBondContact O-N 3.25Å
466V27.7Very low30.9Very low144 Ų144155.6 Ų155.687%0.87383%0.828SS**  trans-78.176.6166.4-179.70000107.1V464V464-V466 PolarHBondContact O-N 3.05Å
467E28.3Very low31.1Very low160 Ų160159.9 Ų159.975%0.74884%0.844SS**  trans-139.985.2164.2-78.5-177.7141.300107.5I465I465-E467 HydrophobicContact CG2-CB 3.76Å; I465-E467 HydrophobicContact CG2-CG 4Å; I465-E467 PolarHBondContact O-N 3.25Å
468D30.5Very low31.3Very low158 Ų158162.6 Ų162.685%0.84585%0.847SS**  trans-175.484142.7-105.1-18.4000110
469S30.7Very low31.5Very low115 Ų115165.6 Ų165.680%0.80486%0.861SS**  trans-128.253.9160.148.60000109
470Y32.8Very low31.7Very low210 Ų210163.3 Ų163.382%0.82485%0.853SS**  trans-144.6124.1163.6-110.2-92.8000110.5
471S35.3Very low31.7Very low101 Ų101157.7 Ų157.771%0.70685%0.849SS**  trans99.3119.2152.486.50000119.6
472R35.1Very low32.1Very low220 Ų220158 Ų15883%0.8386%0.859SS**  trans99.398.5137.6-73.1175.3-164.7-153.75.7120.6
473T38Very low32.5Very low133 Ų133154.6 Ų154.682%0.81685%0.853SS**  65.5103.3121.553.30000119.9
474A46.2Very low33.1Very low180 Ų180151.9 Ų151.9100%1.48885%0.848SS**  -154.90114.600000108.7

Retrieved 474 of 474 residues in 149.8 ms (Link to these results)

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