A0A087X2C8_HUMAN Loading...

Transcriptional adaptor 2A

AlphaFold DB , UniProt , Accession A0A087X2C8, Species HUMAN (Homo sapiens, Human), Gene TADA2A, Length 56 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
1M52.4Low82.9Confident236 Ų23698.5 Ų98.5100%1.16356%0.56SS**  01170-67.1178.9-148.400105.4
2T67.9Low83.9Confident114 Ų11491.6 Ų91.670%0.69952%0.518SS*.  trans-81119.1178.1480000107.5D4T2-D4 PolarHBondContact O-N 3.35Å
3S80.8Confident84.7Confident48 Ų4886.6 Ų86.634%0.33649%0.491SS..  trans-7939.7-179.2-60.80000111.7F5 A14 Q15S3-F5 VanDerWaalsContact C-N 3.25Å; S3-F5 PolarHBondContact O-N 2.75Å; S3-A14 WeakPolarHBondContact O-CB 3.46Å; S3-A14 PolarHBondContact O-N 3.36Å; S3-Q15 PolarHBondContact O-N 3.1Å
4D80.9Confident85.3Confident101 Ų10181.9 Ų81.954%0.5447%0.468SS..  trans-89.346.2-176.2-81.2-64.2000111.9T2T2-D4 PolarHBondContact O-N 3.35Å
5F87.7Confident85.9Confident116 Ų11684.1 Ų84.151%0.50947%0.473SS..SBendtrans-122.3144.5173.957.5-91.2000109.7S3 V7 T13 A14S3-F5 VanDerWaalsContact C-N 3.25Å; S3-F5 PolarHBondContact O-N 2.75Å; F5-V7 HydrophobicContact CD2-CG2 4.12Å; F5-V7 HydrophobicContact CE2-CG2 3.89Å; F5-T13 CarbonylContact O-C 3.53Å; F5-T13 WeakPolarHBondContact O-CA 3.22Å; F5-A14 HydrophobicContact CD2-CB 4.23Å; F5-A14 HydrophobicContact CE1-CB 4.29Å; F5-A14 HydrophobicContact CE2-CB 3.79Å; F5-A14 HydrophobicContact CZ-CB 3.82Å; F5-A14 PolarHBondContact O-N 3.15Å
6P91.3Very high86.5Confident80 Ų8080.2 Ų80.252%0.51945%0.449SS..BIsolated β-bridgetrans-71.7143.2-179.928.4-33.7000112.1D9 W12P6-D9 WeakPolarHBondContact CB-O 3.42Å; P6-W12 VanDerWaalsContact CA-O 3.28Å; P6-W12 WeakPolarHBondContact CA-O 3.25Å
7V88.3Confident87Confident85 Ų8576.2 Ų76.252%0.51543%0.427SS..SBendtrans-117.4-60.4-179.9-176.10000111.5F5 A14F5-V7 HydrophobicContact CD2-CG2 4.12Å; F5-V7 HydrophobicContact CE2-CG2 3.89Å; V7-A14 HydrophobicContact CG2-CB 3.43Å; V7-A14 VanDerWaalsContact CG2-CB 3.43Å
8L89.3Confident87.4Confident82 Ų8278.2 Ų78.243%0.42943%0.433SS..SBendtrans-105.1-34.7-175.9-55.5176.7000112.1E17 H54 F55L8-E17 WeakPolarHBondContact CB-OE1 3.27Å; L8-H54 HydrophobicContact CD1-CB 4.06Å; L8-F55 HydrophobicContact CD1-CE1 4.13Å; L8-F55 HydrophobicContact CD1-CE2 4.16Å; L8-F55 HydrophobicContact CD1-CZ 3.64Å
9D91Very high87.8Confident29 Ų2975.8 Ų75.816%0.15543%0.425CS..SBendtrans-131.4139.2175.7-166.2-72.9000109.8P6 S11 W12 K53P6-D9 WeakPolarHBondContact CB-O 3.42Å; D9-S11 PolarHBondContact O-N 3.16Å; D9-S11 VanDerWaalsContact OD1-CB 3.25Å; D9-S11 WeakPolarHBondContact OD1-CB 3.31Å; D9-S11 PolarHBondContact OD1-N 3.46Å; D9-S11 PolarHBondContact OD1-OG 3.18Å; D9-W12 HydrophobicContact CB-CB 4.24Å; D9-W12 HydrophobicContact CB-CG 4.37Å; D9-W12 PolarHBondContact O-N 2.89Å; D9-K53 IonicContact OD2-NZ 3.53Å; D9-K53 PolarHBondContact OD2-NZ 3.32Å
10P90.8Very high88.3Confident114 Ų11472 Ų7274%0.7440%0.403SS*.THydrogen-bonded Turntrans-59.5-17.8176.923.7-34.4000113.9
11S91.8Very high88.7Confident79 Ų7971 Ų7155%0.55240%0.397SS*.THydrogen-bonded Turntrans-93.3-3.5-179.9-33.40000113.5D9 K42D9-S11 PolarHBondContact O-N 3.16Å; D9-S11 VanDerWaalsContact OD1-CB 3.25Å; D9-S11 WeakPolarHBondContact OD1-CB 3.31Å; D9-S11 PolarHBondContact OD1-N 3.46Å; D9-S11 PolarHBondContact OD1-OG 3.18Å; S11-K42 WeakPolarHBondContact O-CE 3.4Å; S11-K42 PolarHBondContact O-NZ 2.93Å
12W94.5Very high90.8Very high15 Ų1564.2 Ų64.26%0.05736%0.362CS..SBendtrans-124123-175.4-76.274.6000110.7P6 D9 E16 E17 L20 M39 K42 E46 H50P6-W12 VanDerWaalsContact CA-O 3.28Å; P6-W12 WeakPolarHBondContact CA-O 3.25Å; D9-W12 HydrophobicContact CB-CB 4.24Å; D9-W12 HydrophobicContact CB-CG 4.37Å; D9-W12 PolarHBondContact O-N 2.89Å; W12-E16 WeakPolarHBondContact CA-OE2 3.36Å; W12-E16 HydrophobicContact CE3-CB 3.78Å; W12-E16 HydrophobicContact CZ3-CB 4.27Å; W12-E17 WeakPolarHBondContact CB-OE1 3.35Å; W12-L20 HydrophobicContact CH2-CD1 4.36Å; W12-L20 HydrophobicContact CH2-CD2 4Å; W12-L20 HydrophobicContact CZ3-CB 4.02Å; W12-L20 HydrophobicContact CZ3-CD2 3.79Å; W12-L20 HydrophobicContact CZ3-CG 4.33Å; W12-M39 HydrophobicContact CH2-CE 4.19Å; W12-M39 HydrophobicContact CH2-SD 4.24Å; W12-M39 HydrophobicContact CZ3-CE 3.66Å; W12-M39 HydrophobicContact CZ3-SD 4.17Å; W12-K42 HydrophobicContact CH2-CB 4.16Å; W12-K42 HydrophobicContact CH2-CG 3.8Å; W12-K42 HydrophobicContact CZ2-CB 4.32Å; W12-K42 HydrophobicContact CZ2-CD 4.1Å; W12-K42 HydrophobicContact CZ2-CG 3.84Å; W12-K42 HydrophobicContact CZ3-CG 4.28Å; W12-E46 HydrophobicContact CZ2-CB 4.37Å; W12-H50 AromaticContact CD1-CE1 3.61Å; W12-H50 AromaticContact CD1-ND1 3.53Å; W12-H50 HydrophobicContact CD2-CB 4.44Å; W12-H50 AromaticContact CD2-CD2 3.61Å; W12-H50 AromaticContact CD2-CE1 3.78Å; W12-H50 AromaticContact CD2-CG 3.73Å; W12-H50 AromaticContact CD2-ND1 3.88Å; W12-H50 AromaticContact CD2-NE2 3.64Å; W12-H50 AromaticContact CE2-CD2 3.75Å; W12-H50 AromaticContact CE2-CG 3.42Å; W12-H50 VanDerWaalsContact CE2-CG 3.42Å; W12-H50 AromaticContact CE2-ND1 3.69Å; W12-H50 AromaticContact CE3-CD2 3.67Å; W12-H50 AromaticContact CE3-NE2 3.83Å; W12-H50 AromaticContact CG-CE1 3.52Å; W12-H50 AromaticContact CG-ND1 3.82Å; W12-H50 AromaticContact CG-NE2 3.76Å; W12-H50 HydrophobicContact CH2-CB 4.02Å; W12-H50 HydrophobicContact CZ2-CB 3.46Å; W12-H50 VanDerWaalsContact CZ2-CB 3.46Å; W12-H50 AromaticContact CZ2-CG 3.68Å; W12-H50 AromaticContact CZ3-CD2 3.88Å; W12-H50 AromaticContact NE1-CE1 3.95Å; W12-H50 AromaticContact NE1-CG 3.66Å; W12-H50 AromaticContact NE1-ND1 3.44Å; W12-H50 PolarHBondContact NE1-ND1 3.18Å
13T94.6Very high92.1Very high27 Ų2758.8 Ų58.817%0.16633%0.329CS..BIsolated β-bridgetrans-81.8157.6176.873.40000111.6F5 Q15 E16 E17F5-T13 CarbonylContact O-C 3.53Å; F5-T13 WeakPolarHBondContact O-CA 3.22Å; T13-Q15 PolarHBondContact O-N 3.46Å; T13-Q15 VanDerWaalsContact O-N 3.1Å; T13-E16 PolarHBondContact N-OE2 2.95Å; T13-E16 WeakPolarHBondContact O-CA 3.29Å; T13-E16 WeakPolarHBondContact O-CB 3.47Å; T13-E16 PolarHBondContact O-N 3.14Å; T13-E16 WeakPolarHBondContact OG1-CG 3.18Å; T13-E16 PolarHBondContact OG1-N 3.18Å; T13-E17 WeakPolarHBondContact O-CG 3.43Å; T13-E17 PolarHBondContact O-N 3.43Å
14A93.5Very high92.9Very high21 Ų2156.9 Ų56.917%0.17432%0.315CS..Hα-helixtrans-53.3-33.2174.600000112.6S3 F5 V7 M18S3-A14 WeakPolarHBondContact O-CB 3.46Å; S3-A14 PolarHBondContact O-N 3.36Å; F5-A14 HydrophobicContact CD2-CB 4.23Å; F5-A14 HydrophobicContact CE1-CB 4.29Å; F5-A14 HydrophobicContact CE2-CB 3.79Å; F5-A14 HydrophobicContact CZ-CB 3.82Å; F5-A14 PolarHBondContact O-N 3.15Å; V7-A14 HydrophobicContact CG2-CB 3.43Å; V7-A14 VanDerWaalsContact CG2-CB 3.43Å; A14-M18 PolarHBondContact O-N 2.94Å
15Q93.8Very high93.6Very high115 Ų11559 Ų5954%0.53732%0.324SS..Hα-helixtrans-68.5-42.5174.1-168.8176.2-79.100112.3S3 T13 E17 M18 A19S3-Q15 PolarHBondContact O-N 3.1Å; T13-Q15 PolarHBondContact O-N 3.46Å; T13-Q15 VanDerWaalsContact O-N 3.1Å; Q15-E17 VanDerWaalsContact C-N 3.35Å; Q15-M18 PolarHBondContact O-N 2.79Å; Q15-A19 VanDerWaalsContact O-CB 3.31Å; Q15-A19 WeakPolarHBondContact O-CB 3.15Å; Q15-A19 PolarHBondContact O-N 3.29Å
16E95.4Very high94Very high21 Ų2159 Ų5910%0.09833%0.329CS..Hα-helixtrans-65.8-37.3177.2-69.3-178.8127.400112.2W12 T13 A19 L20 M39 T41 K42W12-E16 WeakPolarHBondContact CA-OE2 3.36Å; W12-E16 HydrophobicContact CE3-CB 3.78Å; W12-E16 HydrophobicContact CZ3-CB 4.27Å; T13-E16 PolarHBondContact N-OE2 2.95Å; T13-E16 WeakPolarHBondContact O-CA 3.29Å; T13-E16 WeakPolarHBondContact O-CB 3.47Å; T13-E16 PolarHBondContact O-N 3.14Å; T13-E16 WeakPolarHBondContact OG1-CG 3.18Å; T13-E16 PolarHBondContact OG1-N 3.18Å; E16-A19 PolarHBondContact O-N 2.72Å; E16-L20 WeakPolarHBondContact O-CB 3.31Å; E16-L20 PolarHBondContact O-N 3.42Å; E16-M39 HydrophobicContact CB-CE 4.05Å; E16-M39 VanDerWaalsContact O-CE 3.27Å; E16-M39 WeakPolarHBondContact O-CE 3.35Å; E16-T41 VanDerWaalsContact OE1-CB 3.29Å; E16-T41 WeakPolarHBondContact OE1-CB 3.47Å; E16-T41 PolarHBondContact OE1-OG1 3.38Å; E16-K42 IonicContact OE1-NZ 2.74Å; E16-K42 PolarHBondContact OE1-NZ 2.94Å; E16-K42 IonicContact OE2-NZ 2.94Å; E16-K42 PolarHBondContact OE2-NZ 3.18Å
17E95.5Very high94.2Very high13 Ų1356.9 Ų56.96%0.06132%0.316CS..Hα-helixtrans-59.2-47.8174.6-62.3-68.7-179.600111.1L8 W12 T13 Q15 L20 L21 H50 F55L8-E17 WeakPolarHBondContact CB-OE1 3.27Å; W12-E17 WeakPolarHBondContact CB-OE1 3.35Å; T13-E17 WeakPolarHBondContact O-CG 3.43Å; T13-E17 PolarHBondContact O-N 3.43Å; Q15-E17 VanDerWaalsContact C-N 3.35Å; E17-L20 PolarHBondContact O-N 3.23Å; E17-L21 WeakPolarHBondContact O-CG 3.35Å; E17-L21 PolarHBondContact O-N 3.14Å; E17-H50 IonicContact OE1-CE1 3.94Å; E17-H50 PolarHBondContact OE1-CE1 3.45Å; E17-H50 IonicContact OE1-NE2 2.81Å; E17-H50 PolarHBondContact OE1-NE2 3.07Å; E17-H50 IonicContact OE2-CD2 3.18Å; E17-H50 IonicContact OE2-CE1 3.33Å; E17-H50 IonicContact OE2-NE2 2.9Å; E17-H50 PolarHBondContact OE2-NE2 3.34Å; E17-F55 WeakPolarHBondContact OE2-CZ 3.5Å
18M94.3Very high94.5Very high112 Ų11254.3 Ų54.355%0.55231%0.306SS*.Hα-helixtrans-65.7-45.4178.5-161.768145.700111.4A14 Q15 L20 L21 E22A14-M18 PolarHBondContact O-N 2.94Å; Q15-M18 PolarHBondContact O-N 2.79Å; M18-L20 VanDerWaalsContact C-N 3.28Å; M18-L20 PolarHBondContact O-N 2.91Å; M18-L21 PolarHBondContact O-N 2.83Å; M18-E22 WeakPolarHBondContact O-CG 3.24Å; M18-E22 PolarHBondContact O-N 3.34Å
19A95.5Very high94.7Very high32 Ų3256.2 Ų56.226%0.26431%0.311SS..Hα-helixtrans-61.5-36.4179.100000112.2Q15 E16 A23 M39Q15-A19 VanDerWaalsContact O-CB 3.31Å; Q15-A19 WeakPolarHBondContact O-CB 3.15Å; Q15-A19 PolarHBondContact O-N 3.29Å; E16-A19 PolarHBondContact O-N 2.72Å; A19-A23 WeakPolarHBondContact O-CB 3.5Å; A19-A23 PolarHBondContact O-N 3.37Å; A19-M39 HydrophobicContact CB-CE 4.26Å
20L96.6Very high94.8Very high0 Ų056.9 Ų56.90%033%0.325CS..Hα-helixtrans-62.9-47.7174.5179.367.6000111.3W12 E16 E17 M18 A23 V24 V35 M39 C47 Y51 F55W12-L20 HydrophobicContact CH2-CD1 4.36Å; W12-L20 HydrophobicContact CH2-CD2 4Å; W12-L20 HydrophobicContact CZ3-CB 4.02Å; W12-L20 HydrophobicContact CZ3-CD2 3.79Å; W12-L20 HydrophobicContact CZ3-CG 4.33Å; E16-L20 WeakPolarHBondContact O-CB 3.31Å; E16-L20 PolarHBondContact O-N 3.42Å; E17-L20 PolarHBondContact O-N 3.23Å; M18-L20 VanDerWaalsContact C-N 3.28Å; M18-L20 PolarHBondContact O-N 2.91Å; L20-A23 PolarHBondContact O-N 2.84Å; L20-V24 HydrophobicContact CD1-CG2 4.36Å; L20-V24 WeakPolarHBondContact O-CB 3.42Å; L20-V24 WeakPolarHBondContact O-CG2 3.45Å; L20-V24 PolarHBondContact O-N 2.99Å; L20-V35 HydrophobicContact CD1-CG1 3.73Å; L20-M39 HydrophobicContact CB-CE 4.05Å; L20-M39 HydrophobicContact CB-SD 3.74Å; L20-M39 HydrophobicContact CD1-SD 3.58Å; L20-M39 VanDerWaalsContact CD1-SD 3.58Å; L20-M39 HydrophobicContact CG-SD 4.26Å; L20-C47 HydrophobicContact CD1-CB 3.69Å; L20-Y51 HydrophobicContact CD2-CD2 4.22Å; L20-Y51 HydrophobicContact CG-CD2 4.29Å; L20-F55 HydrophobicContact CD2-CE2 4.37Å
21L96.3Very high95Very high51 Ų5154.2 Ų54.227%0.26731%0.305SS..Hα-helixtrans-63.6-44.9179.8-66.6177000111.7E17 M18 V24 M25 Y51 F55E17-L21 WeakPolarHBondContact O-CG 3.35Å; E17-L21 PolarHBondContact O-N 3.14Å; M18-L21 PolarHBondContact O-N 2.83Å; L21-V24 PolarHBondContact O-N 3.03Å; L21-M25 WeakPolarHBondContact O-CG 3.18Å; L21-M25 PolarHBondContact O-N 3.08Å; L21-Y51 HydrophobicContact CD2-CD2 4.38Å; L21-Y51 HydrophobicContact CD2-CE2 3.82Å; L21-F55 HydrophobicContact CD1-CE1 3.84Å; L21-F55 HydrophobicContact CD1-CZ 4.2Å; L21-F55 HydrophobicContact CD2-CD1 3.82Å; L21-F55 HydrophobicContact CD2-CD2 4.39Å; L21-F55 HydrophobicContact CD2-CE1 3.8Å; L21-F55 HydrophobicContact CD2-CE2 4.35Å; L21-F55 HydrophobicContact CD2-CG 4.11Å; L21-F55 HydrophobicContact CD2-CZ 4.06Å; L21-F55 HydrophobicContact CG-CE1 4.16Å; L21-F55 HydrophobicContact CG-CZ 4.21Å
22E96.4Very high95.3Very high93 Ų9351.3 Ų51.344%0.43528%0.281SS..Hα-helixtrans-59.9-49.9175.5-72.1176.4175.700111.2M18 V24 M25 D26M18-E22 WeakPolarHBondContact O-CG 3.24Å; M18-E22 PolarHBondContact O-N 3.34Å; E22-V24 VanDerWaalsContact C-N 3.3Å; E22-V24 PolarHBondContact O-N 3.4Å; E22-M25 HydrophobicContact CG-CE 4.28Å; E22-M25 WeakPolarHBondContact O-CB 3.47Å; E22-M25 PolarHBondContact O-N 3.17Å; E22-M25 VanDerWaalsContact O-N 3.09Å; E22-D26 PolarHBondContact O-N 3.5Å
23A96.8Very high95.4Very high0 Ų054.8 Ų54.80%030%0.298CS..Hα-helixtrans-62.1-36179.100000112.7A19 L20 D26 C27 V35 Q38 M39A19-A23 WeakPolarHBondContact O-CB 3.5Å; A19-A23 PolarHBondContact O-N 3.37Å; L20-A23 PolarHBondContact O-N 2.84Å; A23-D26 PolarHBondContact O-N 3.46Å; A23-C27 WeakPolarHBondContact O-CB 3.14Å; A23-C27 PolarHBondContact O-N 3.47Å; A23-C27 PolarHBondContact O-SG 3.46Å; A23-C27 VanDerWaalsContact O-SG 3.4Å; A23-V35 HydrophobicContact CB-CB 4.36Å; A23-V35 HydrophobicContact CB-CG1 3.9Å; A23-V35 HydrophobicContact CB-CG2 4.46Å; A23-Q38 HydrophobicContact CB-CB 4.04Å; A23-Q38 HydrophobicContact CB-CG 3.99Å; A23-M39 HydrophobicContact CB-CG 4.41Å
24V96.8Very high95.5Very high9 Ų957 Ų576%0.05531%0.309CS..Hα-helixtrans-69.1-36.7174.7171.80000111.8L20 L21 E22 G28 F29 W32 V35 Y51L20-V24 HydrophobicContact CD1-CG2 4.36Å; L20-V24 WeakPolarHBondContact O-CB 3.42Å; L20-V24 WeakPolarHBondContact O-CG2 3.45Å; L20-V24 PolarHBondContact O-N 2.99Å; L21-V24 PolarHBondContact O-N 3.03Å; E22-V24 VanDerWaalsContact C-N 3.3Å; E22-V24 PolarHBondContact O-N 3.4Å; V24-G28 CarbonylContact O-C 3.32Å; V24-G28 VanDerWaalsContact O-C 3.32Å; V24-G28 WeakPolarHBondContact O-CA 3.15Å; V24-G28 PolarHBondContact O-N 3.15Å; V24-F29 HydrophobicContact CG1-CB 4.4Å; V24-W32 HydrophobicContact CG2-CE3 4.4Å; V24-W32 HydrophobicContact CG2-CH2 4.23Å; V24-W32 HydrophobicContact CG2-CZ3 3.55Å; V24-V35 HydrophobicContact CG2-CG1 4.09Å; V24-V35 HydrophobicContact CG2-CG2 3.91Å; V24-Y51 HydrophobicContact CB-CE2 4.16Å; V24-Y51 HydrophobicContact CG1-CE2 3.91Å; V24-Y51 HydrophobicContact CG2-CD2 3.98Å; V24-Y51 HydrophobicContact CG2-CE2 4Å
25M95.8Very high95.7Very high144 Ų14456 Ų5671%0.70930%0.301SS*.Hα-helixtrans-66.9-39.3173.9-71.9-173.9-64.300111.9L21 E22L21-M25 WeakPolarHBondContact O-CG 3.18Å; L21-M25 PolarHBondContact O-N 3.08Å; E22-M25 HydrophobicContact CG-CE 4.28Å; E22-M25 WeakPolarHBondContact O-CB 3.47Å; E22-M25 PolarHBondContact O-N 3.17Å; E22-M25 VanDerWaalsContact O-N 3.09Å
26D96.4Very high95.8Very high118 Ų11850.9 Ų50.963%0.63128%0.279SS*.Hα-helixtrans-75.9-49-178.8-70.1-19.5000112.7E22 A23 Q38E22-D26 PolarHBondContact O-N 3.5Å; A23-D26 PolarHBondContact O-N 3.46Å; D26-Q38 PolarHBondContact OD2-NE2 3.09Å
27C95.8Very high95.9Very high35 Ų3554.3 Ų54.324%0.23630%0.298CS..Hα-helixtrans-85.1-20-175.5-61.50000113.3A23 N31 D34 V35 Q38A23-C27 WeakPolarHBondContact O-CB 3.14Å; A23-C27 PolarHBondContact O-N 3.47Å; A23-C27 PolarHBondContact O-SG 3.46Å; A23-C27 VanDerWaalsContact O-SG 3.4Å; C27-N31 HydrophobicContact CB-CB 4.41Å; C27-N31 WeakPolarHBondContact O-CB 3.33Å; C27-N31 PolarHBondContact O-ND2 2.74Å; C27-D34 HydrophobicContact CB-CB 4.02Å; C27-V35 HydrophobicContact CB-CG2 3.93Å; C27-Q38 PolarHBondContact SG-OE1 2.87Å; C27-Q38 VanDerWaalsContact SG-OE1 3.37Å
28G94.3Very high95.9Very high30 Ų3058 Ų5831%0.30932%0.315SS..  trans90.2145.8-174.100000113.6V24 G30 N31V24-G28 CarbonylContact O-C 3.32Å; V24-G28 VanDerWaalsContact O-C 3.32Å; V24-G28 WeakPolarHBondContact O-CA 3.15Å; V24-G28 PolarHBondContact O-N 3.15Å; G28-G30 PolarHBondContact O-N 2.92Å; G28-N31 WeakPolarHBondContact O-CB 3.25Å; G28-N31 PolarHBondContact O-N 2.91Å
29F93.6Very high95.8Very high122 Ų12253.3 Ų53.354%0.53529%0.292SS..THydrogen-bonded Turntrans-58.8135.1176.5179-95.8000112V24 N31 W32 Y51 M52 I56V24-F29 HydrophobicContact CG1-CB 4.4Å; F29-N31 VanDerWaalsContact C-N 3.28Å; F29-N31 PolarHBondContact O-N 3.45Å; F29-W32 HydrophobicContact CD2-CH2 4Å; F29-W32 HydrophobicContact CD2-CZ2 4.05Å; F29-W32 HydrophobicContact CE2-CH2 4.01Å; F29-W32 AromaticContact CE2-CZ2 3.82Å; F29-W32 HydrophobicContact CE2-CZ2 3.82Å; F29-W32 HydrophobicContact CZ-CZ2 4.37Å; F29-Y51 HydrophobicContact CD2-CD1 4.34Å; F29-Y51 AromaticContact CD2-CE1 3.78Å; F29-Y51 HydrophobicContact CD2-CE1 3.78Å; F29-Y51 AromaticContact CE2-CD1 3.91Å; F29-Y51 HydrophobicContact CE2-CD1 3.91Å; F29-Y51 AromaticContact CE2-CE1 3.59Å; F29-Y51 HydrophobicContact CE2-CE1 3.59Å; F29-M52 HydrophobicContact CE1-CE 4.31Å; F29-M52 HydrophobicContact CE2-CE 3.85Å; F29-M52 HydrophobicContact CZ-CE 3.37Å; F29-M52 HydrophobicContact CZ-SD 4.32Å; F29-I56 HydrophobicContact CE2-CD1 3.79Å; F29-I56 HydrophobicContact CZ-CD1 3.96Å
30G91.9Very high95.7Very high43 Ų4357 Ų5744%0.44332%0.315SS..THydrogen-bonded Turntrans87.3-13.9-177.200000114.4G28 W32G28-G30 PolarHBondContact O-N 2.92Å; G30-W32 PolarHBondContact O-N 3.04Å
31N95.9Very high95.5Very high59 Ų5961.1 Ų61.132%0.31634%0.34SS..  trans-85.254.3175.7-1654.9000112.1C27 G28 F29 Q33 D34 V35C27-N31 HydrophobicContact CB-CB 4.41Å; C27-N31 WeakPolarHBondContact O-CB 3.33Å; C27-N31 PolarHBondContact O-ND2 2.74Å; G28-N31 WeakPolarHBondContact O-CB 3.25Å; G28-N31 PolarHBondContact O-N 2.91Å; F29-N31 VanDerWaalsContact C-N 3.28Å; F29-N31 PolarHBondContact O-N 3.45Å; N31-Q33 PolarHBondContact O-N 3.05Å; N31-Q33 VanDerWaalsContact O-N 3.14Å; N31-D34 PolarHBondContact ND2-OD2 2.92Å; N31-D34 PolarHBondContact O-N 3.37Å; N31-D34 VanDerWaalsContact O-N 3.15Å; N31-D34 PolarHBondContact OD1-OD2 3.32Å; N31-V35 WeakPolarHBondContact O-CG2 3.18Å; N31-V35 PolarHBondContact O-N 2.94Å; N31-V35 VanDerWaalsContact O-N 3.08Å
32W96.9Very high95.4Very high17 Ų1760.4 Ų60.46%0.06433%0.334CS..Hα-helixtrans-63-24.7-171.3-53.9121.6000114.1V24 F29 G30 V35 A36 K44 C47 E48 Y51 M52V24-W32 HydrophobicContact CG2-CE3 4.4Å; V24-W32 HydrophobicContact CG2-CH2 4.23Å; V24-W32 HydrophobicContact CG2-CZ3 3.55Å; F29-W32 HydrophobicContact CD2-CH2 4Å; F29-W32 HydrophobicContact CD2-CZ2 4.05Å; F29-W32 HydrophobicContact CE2-CH2 4.01Å; F29-W32 AromaticContact CE2-CZ2 3.82Å; F29-W32 HydrophobicContact CE2-CZ2 3.82Å; F29-W32 HydrophobicContact CZ-CZ2 4.37Å; G30-W32 PolarHBondContact O-N 3.04Å; W32-V35 HydrophobicContact CE3-CB 4.46Å; W32-V35 HydrophobicContact CE3-CG1 4.41Å; W32-V35 HydrophobicContact CE3-CG2 4.36Å; W32-A36 VanDerWaalsContact O-CB 3.31Å; W32-A36 WeakPolarHBondContact O-CB 3.42Å; W32-A36 PolarHBondContact O-N 2.82Å; W32-K44 HydrophobicContact CB-CB 3.89Å; W32-K44 VanDerWaalsContact O-CB 3.25Å; W32-K44 WeakPolarHBondContact O-CB 3.49Å; W32-C47 HydrophobicContact CE3-CB 4.42Å; W32-E48 HydrophobicContact CB-CB 4.44Å; W32-E48 VanDerWaalsContact CD1-CD 3.43Å; W32-E48 HydrophobicContact CD2-CB 3.73Å; W32-E48 HydrophobicContact CD2-CG 4.21Å; W32-E48 HydrophobicContact CE3-CB 4.34Å; W32-E48 HydrophobicContact CG-CB 3.73Å; W32-E48 HydrophobicContact CG-CG 4.27Å; W32-E48 HydrophobicContact CZ2-CB 4.49Å; W32-E48 HydrophobicContact CZ2-CG 4.28Å; W32-E48 VanDerWaalsContact NE1-CD 3.28Å; W32-E48 PolarHBondContact NE1-OE1 3.23Å; W32-E48 VanDerWaalsContact NE1-OE1 3.15Å; W32-Y51 AromaticContact CH2-CD1 3.66Å; W32-Y51 HydrophobicContact CH2-CD1 3.66Å; W32-Y51 HydrophobicContact CH2-CD2 4.32Å; W32-Y51 HydrophobicContact CH2-CE1 4.35Å; W32-Y51 AromaticContact CH2-CG 3.63Å; W32-Y51 HydrophobicContact CH2-CG 3.63Å; W32-Y51 HydrophobicContact CZ2-CD1 4.48Å; W32-Y51 HydrophobicContact CZ3-CD1 4.49Å; W32-Y51 HydrophobicContact CZ3-CD2 4.43Å; W32-Y51 HydrophobicContact CZ3-CG 4.03Å; W32-M52 HydrophobicContact CZ2-CE 3.96Å
33Q97.3Very high95.4Very high89 Ų8959.2 Ų59.242%0.41633%0.333SS..Hα-helixtrans-65-46.6176.1-174.663.273.100111.2N31 N37 K44N31-Q33 PolarHBondContact O-N 3.05Å; N31-Q33 VanDerWaalsContact O-N 3.14Å; Q33-N37 PolarHBondContact O-N 3.26Å; Q33-N37 VanDerWaalsContact O-N 3.1Å; Q33-N37 PolarHBondContact O-ND2 2.85Å; Q33-N37 VanDerWaalsContact O-ND2 3.16Å; Q33-N37 PolarHBondContact O-OD1 2.96Å; Q33-K44 HydrophobicContact CB-CD 4.42Å; Q33-K44 VanDerWaalsContact OE1-NZ 3.08Å
34D96.9Very high95.4Very high72 Ų7262.8 Ų62.839%0.38535%0.349SS..Hα-helixtrans-74.4-35.4178.8-69.3-22.2000111.5C27 N31 A36 N37 Q38C27-D34 HydrophobicContact CB-CB 4.02Å; N31-D34 PolarHBondContact ND2-OD2 2.92Å; N31-D34 PolarHBondContact O-N 3.37Å; N31-D34 VanDerWaalsContact O-N 3.15Å; N31-D34 PolarHBondContact OD1-OD2 3.32Å; D34-A36 PolarHBondContact O-N 2.89Å; D34-N37 WeakPolarHBondContact O-CB 3.21Å; D34-N37 PolarHBondContact O-N 3.03Å; D34-Q38 PolarHBondContact O-N 3.48Å
35V97.3Very high95.5Very high0 Ų067.7 Ų67.70%037%0.371CS..Hα-helixtrans-56.4-50.1171.8171.70000111L20 A23 V24 C27 N31 W32 N37 Q38 M39 C47L20-V35 HydrophobicContact CD1-CG1 3.73Å; A23-V35 HydrophobicContact CB-CB 4.36Å; A23-V35 HydrophobicContact CB-CG1 3.9Å; A23-V35 HydrophobicContact CB-CG2 4.46Å; V24-V35 HydrophobicContact CG2-CG1 4.09Å; V24-V35 HydrophobicContact CG2-CG2 3.91Å; C27-V35 HydrophobicContact CB-CG2 3.93Å; N31-V35 WeakPolarHBondContact O-CG2 3.18Å; N31-V35 PolarHBondContact O-N 2.94Å; N31-V35 VanDerWaalsContact O-N 3.08Å; W32-V35 HydrophobicContact CE3-CB 4.46Å; W32-V35 HydrophobicContact CE3-CG1 4.41Å; W32-V35 HydrophobicContact CE3-CG2 4.36Å; V35-N37 VanDerWaalsContact C-N 3.31Å; V35-N37 PolarHBondContact O-N 3.07Å; V35-Q38 PolarHBondContact O-N 2.89Å; V35-M39 HydrophobicContact CG1-CG 4.45Å; V35-M39 HydrophobicContact CG1-SD 4.49Å; V35-M39 WeakPolarHBondContact O-CB 3.45Å; V35-M39 WeakPolarHBondContact O-CG 3.43Å; V35-M39 PolarHBondContact O-N 3.44Å; V35-C47 HydrophobicContact CG1-CB 4.2Å
36A96.9Very high95.5Very high9 Ų965.1 Ų65.17%0.07436%0.358CS..Hα-helixtrans-63.8-37.3177.700000112.4W32 D34 Q38 M39 C40 K44W32-A36 VanDerWaalsContact O-CB 3.31Å; W32-A36 WeakPolarHBondContact O-CB 3.42Å; W32-A36 PolarHBondContact O-N 2.82Å; D34-A36 PolarHBondContact O-N 2.89Å; A36-Q38 VanDerWaalsContact C-N 3.31Å; A36-Q38 PolarHBondContact O-N 3Å; A36-M39 PolarHBondContact O-N 3.44Å; A36-C40 PolarHBondContact O-N 3.07Å; A36-K44 HydrophobicContact CB-CB 3.99Å
37N96.2Very high95.5Very high93 Ų9359.5 Ų59.550%0.49733%0.328SS..Hα-helixtrans-62.1-39174.5-67.2-23.1000111.6Q33 D34 V35 C40Q33-N37 PolarHBondContact O-N 3.26Å; Q33-N37 VanDerWaalsContact O-N 3.1Å; Q33-N37 PolarHBondContact O-ND2 2.85Å; Q33-N37 VanDerWaalsContact O-ND2 3.16Å; Q33-N37 PolarHBondContact O-OD1 2.96Å; D34-N37 WeakPolarHBondContact O-CB 3.21Å; D34-N37 PolarHBondContact O-N 3.03Å; V35-N37 VanDerWaalsContact C-N 3.31Å; V35-N37 PolarHBondContact O-N 3.07Å; N37-C40 PolarHBondContact O-SG 2.88Å
38Q95.2Very high95.6Very high89 Ų8961.9 Ų61.942%0.41634%0.335SS..Hα-helixtrans-72.1-40.1176.1-176.2167.8-15.600111.6A23 D26 C27 D34 V35 A36A23-Q38 HydrophobicContact CB-CB 4.04Å; A23-Q38 HydrophobicContact CB-CG 3.99Å; D26-Q38 PolarHBondContact OD2-NE2 3.09Å; C27-Q38 PolarHBondContact SG-OE1 2.87Å; C27-Q38 VanDerWaalsContact SG-OE1 3.37Å; D34-Q38 PolarHBondContact O-N 3.48Å; V35-Q38 PolarHBondContact O-N 2.89Å; A36-Q38 VanDerWaalsContact C-N 3.31Å; A36-Q38 PolarHBondContact O-N 3Å
39M93.6Very high95.7Very high14 Ų1467.8 Ų67.87%0.06935%0.352CS..Hα-helixtrans-66.7-35.5178.7-74.4-158.773.600113.3W12 E16 A19 L20 A23 V35 A36 T41 K42 C47W12-M39 HydrophobicContact CH2-CE 4.19Å; W12-M39 HydrophobicContact CH2-SD 4.24Å; W12-M39 HydrophobicContact CZ3-CE 3.66Å; W12-M39 HydrophobicContact CZ3-SD 4.17Å; E16-M39 HydrophobicContact CB-CE 4.05Å; E16-M39 VanDerWaalsContact O-CE 3.27Å; E16-M39 WeakPolarHBondContact O-CE 3.35Å; A19-M39 HydrophobicContact CB-CE 4.26Å; L20-M39 HydrophobicContact CB-CE 4.05Å; L20-M39 HydrophobicContact CB-SD 3.74Å; L20-M39 HydrophobicContact CD1-SD 3.58Å; L20-M39 VanDerWaalsContact CD1-SD 3.58Å; L20-M39 HydrophobicContact CG-SD 4.26Å; A23-M39 HydrophobicContact CB-CG 4.41Å; V35-M39 HydrophobicContact CG1-CG 4.45Å; V35-M39 HydrophobicContact CG1-SD 4.49Å; V35-M39 WeakPolarHBondContact O-CB 3.45Å; V35-M39 WeakPolarHBondContact O-CG 3.43Å; V35-M39 PolarHBondContact O-N 3.44Å; A36-M39 PolarHBondContact O-N 3.44Å; M39-T41 PolarHBondContact O-N 3.33Å; M39-K42 HydrophobicContact CE-CG 4.46Å; M39-C47 PolarHBondContact SD-SG 2.89Å
40C92.6Very high95.9Very high111 Ų11162.3 Ų62.375%0.7533%0.328SS*.SBendtrans57.6-11.4-176.8-60.50000116.7A36 N37A36-C40 PolarHBondContact O-N 3.07Å; N37-C40 PolarHBondContact O-SG 2.88Å
41T92.5Very high96.1Very high85 Ų8562.3 Ų62.352%0.52132%0.315SS..SBendtrans-106.6-18.9-174.863.10000114E16 M39E16-T41 VanDerWaalsContact OE1-CB 3.29Å; E16-T41 WeakPolarHBondContact OE1-CB 3.47Å; E16-T41 PolarHBondContact OE1-OG1 3.38Å; M39-T41 PolarHBondContact O-N 3.33Å
42K94.6Very high96.1Very high37 Ų3763 Ų6316%0.16132%0.317CS..SBendtrans-133.2152.7-174.4-64.5-65.3-161.9-93.20110.6S11 W12 E16 M39 E46S11-K42 WeakPolarHBondContact O-CE 3.4Å; S11-K42 PolarHBondContact O-NZ 2.93Å; W12-K42 HydrophobicContact CH2-CB 4.16Å; W12-K42 HydrophobicContact CH2-CG 3.8Å; W12-K42 HydrophobicContact CZ2-CB 4.32Å; W12-K42 HydrophobicContact CZ2-CD 4.1Å; W12-K42 HydrophobicContact CZ2-CG 3.84Å; W12-K42 HydrophobicContact CZ3-CG 4.28Å; E16-K42 IonicContact OE1-NZ 2.74Å; E16-K42 PolarHBondContact OE1-NZ 2.94Å; E16-K42 IonicContact OE2-NZ 2.94Å; E16-K42 PolarHBondContact OE2-NZ 3.18Å; M39-K42 HydrophobicContact CE-CG 4.46Å; K42-E46 HydrophobicContact CB-CB 4.37Å
43T97.1Very high96Very high67 Ų6767.9 Ų67.941%0.41134%0.339SS..  trans-80.6161.2175.660.10000111.5E45 E46 C47T43-E45 PolarHBondContact O-N 3.39Å; T43-E46 WeakPolarHBondContact CB-OE2 3.48Å; T43-E46 PolarHBondContact N-OE2 3.22Å; T43-E46 PolarHBondContact O-N 3.36Å; T43-E46 VanDerWaalsContact O-N 3.14Å; T43-E46 VanDerWaalsContact OG1-CD 3.23Å; T43-E46 VanDerWaalsContact OG1-CG 3.22Å; T43-E46 WeakPolarHBondContact OG1-CG 3.48Å; T43-E46 PolarHBondContact OG1-N 2.93Å; T43-E46 PolarHBondContact OG1-OE2 3.4Å; T43-C47 PolarHBondContact O-N 3.44Å; T43-C47 PolarHBondContact O-SG 2.87Å
44K96.8Very high95.9Very high75 Ų7566.3 Ų66.333%0.32633%0.332SS..Hα-helixtrans-59.5-36.9179.167.9178.9174.2-166.30112.5W32 Q33 A36 C47 E48W32-K44 HydrophobicContact CB-CB 3.89Å; W32-K44 VanDerWaalsContact O-CB 3.25Å; W32-K44 WeakPolarHBondContact O-CB 3.49Å; Q33-K44 HydrophobicContact CB-CD 4.42Å; Q33-K44 VanDerWaalsContact OE1-NZ 3.08Å; A36-K44 HydrophobicContact CB-CB 3.99Å; K44-C47 PolarHBondContact O-N 3.28Å; K44-E48 WeakPolarHBondContact O-CB 3.14Å; K44-E48 PolarHBondContact O-N 2.95Å
45E97.6Very high95.6Very high113 Ų11366.3 Ų66.353%0.52833%0.328SS..Hα-helixtrans-68.1-37.8178.6-65.376.6-16600111.3T43 K49T43-E45 PolarHBondContact O-N 3.39Å; E45-K49 WeakPolarHBondContact O-CB 3.28Å; E45-K49 PolarHBondContact O-N 2.82Å
46E96.8Very high95.2Very high90 Ų9073.1 Ų73.142%0.42136%0.363SS..Hα-helixtrans-68.1-45.8174.5-71.5167137.800111.4W12 K42 T43 K49 H50W12-E46 HydrophobicContact CZ2-CB 4.37Å; K42-E46 HydrophobicContact CB-CB 4.37Å; T43-E46 WeakPolarHBondContact CB-OE2 3.48Å; T43-E46 PolarHBondContact N-OE2 3.22Å; T43-E46 PolarHBondContact O-N 3.36Å; T43-E46 VanDerWaalsContact O-N 3.14Å; T43-E46 VanDerWaalsContact OG1-CD 3.23Å; T43-E46 VanDerWaalsContact OG1-CG 3.22Å; T43-E46 WeakPolarHBondContact OG1-CG 3.48Å; T43-E46 PolarHBondContact OG1-N 2.93Å; T43-E46 PolarHBondContact OG1-OE2 3.4Å; E46-K49 PolarHBondContact O-N 3.35Å; E46-H50 WeakPolarHBondContact O-CB 3.36Å; E46-H50 PolarHBondContact O-N 3.2Å
47C96.8Very high95.1Very high0 Ų076.3 Ų76.30%038%0.378CS..Hα-helixtrans-58.2-49.5176.5-65.80000111.7L20 W32 V35 M39 T43 K44 Y51L20-C47 HydrophobicContact CD1-CB 3.69Å; W32-C47 HydrophobicContact CE3-CB 4.42Å; V35-C47 HydrophobicContact CG1-CB 4.2Å; M39-C47 PolarHBondContact SD-SG 2.89Å; T43-C47 PolarHBondContact O-N 3.44Å; T43-C47 PolarHBondContact O-SG 2.87Å; K44-C47 PolarHBondContact O-N 3.28Å; C47-Y51 VanDerWaalsContact O-CB 3.24Å; C47-Y51 WeakPolarHBondContact O-CB 3.44Å; C47-Y51 PolarHBondContact O-N 2.81Å
48E97.2Very high95.1Very high84 Ų8475.4 Ų75.439%0.39337%0.371SS..Hα-helixtrans-60.7-53.1178.3176.8170.2-147.300111.3W32 K44 H50 Y51 M52W32-E48 HydrophobicContact CB-CB 4.44Å; W32-E48 VanDerWaalsContact CD1-CD 3.43Å; W32-E48 HydrophobicContact CD2-CB 3.73Å; W32-E48 HydrophobicContact CD2-CG 4.21Å; W32-E48 HydrophobicContact CE3-CB 4.34Å; W32-E48 HydrophobicContact CG-CB 3.73Å; W32-E48 HydrophobicContact CG-CG 4.27Å; W32-E48 HydrophobicContact CZ2-CB 4.49Å; W32-E48 HydrophobicContact CZ2-CG 4.28Å; W32-E48 VanDerWaalsContact NE1-CD 3.28Å; W32-E48 PolarHBondContact NE1-OE1 3.23Å; W32-E48 VanDerWaalsContact NE1-OE1 3.15Å; K44-E48 WeakPolarHBondContact O-CB 3.14Å; K44-E48 PolarHBondContact O-N 2.95Å; E48-H50 VanDerWaalsContact C-N 3.3Å; E48-H50 PolarHBondContact O-N 2.94Å; E48-Y51 PolarHBondContact O-N 2.91Å; E48-M52 HydrophobicContact CG-CG 4.26Å; E48-M52 WeakPolarHBondContact O-CB 3.4Å; E48-M52 WeakPolarHBondContact O-CG 3.48Å; E48-M52 PolarHBondContact O-N 3.1Å
49K96.9Very high95.1Very high155 Ų15574.7 Ų74.767%0.67437%0.369SS*.Hα-helixtrans-62.1-41.1-176.7-176.5-178.9177.6-174.90111.4E45 E46 K53E45-K49 WeakPolarHBondContact O-CB 3.28Å; E45-K49 PolarHBondContact O-N 2.82Å; E46-K49 PolarHBondContact O-N 3.35Å; K49-K53 WeakPolarHBondContact O-CB 3.35Å; K49-K53 PolarHBondContact O-N 3.07Å
50H96.6Very high95.1Very high7 Ų778.2 Ų78.23%0.03239%0.387CS..Hα-helixtrans-67.2-47.1178.7-170.275.1000111.1W12 E17 E46 E48 M52 K53 H54W12-H50 AromaticContact CD1-CE1 3.61Å; W12-H50 AromaticContact CD1-ND1 3.53Å; W12-H50 HydrophobicContact CD2-CB 4.44Å; W12-H50 AromaticContact CD2-CD2 3.61Å; W12-H50 AromaticContact CD2-CE1 3.78Å; W12-H50 AromaticContact CD2-CG 3.73Å; W12-H50 AromaticContact CD2-ND1 3.88Å; W12-H50 AromaticContact CD2-NE2 3.64Å; W12-H50 AromaticContact CE2-CD2 3.75Å; W12-H50 AromaticContact CE2-CG 3.42Å; W12-H50 VanDerWaalsContact CE2-CG 3.42Å; W12-H50 AromaticContact CE2-ND1 3.69Å; W12-H50 AromaticContact CE3-CD2 3.67Å; W12-H50 AromaticContact CE3-NE2 3.83Å; W12-H50 AromaticContact CG-CE1 3.52Å; W12-H50 AromaticContact CG-ND1 3.82Å; W12-H50 AromaticContact CG-NE2 3.76Å; W12-H50 HydrophobicContact CH2-CB 4.02Å; W12-H50 HydrophobicContact CZ2-CB 3.46Å; W12-H50 VanDerWaalsContact CZ2-CB 3.46Å; W12-H50 AromaticContact CZ2-CG 3.68Å; W12-H50 AromaticContact CZ3-CD2 3.88Å; W12-H50 AromaticContact NE1-CE1 3.95Å; W12-H50 AromaticContact NE1-CG 3.66Å; W12-H50 AromaticContact NE1-ND1 3.44Å; W12-H50 PolarHBondContact NE1-ND1 3.18Å; E17-H50 IonicContact OE1-CE1 3.94Å; E17-H50 PolarHBondContact OE1-CE1 3.45Å; E17-H50 IonicContact OE1-NE2 2.81Å; E17-H50 PolarHBondContact OE1-NE2 3.07Å; E17-H50 IonicContact OE2-CD2 3.18Å; E17-H50 IonicContact OE2-CE1 3.33Å; E17-H50 IonicContact OE2-NE2 2.9Å; E17-H50 PolarHBondContact OE2-NE2 3.34Å; E46-H50 WeakPolarHBondContact O-CB 3.36Å; E46-H50 PolarHBondContact O-N 3.2Å; E48-H50 VanDerWaalsContact C-N 3.3Å; E48-H50 PolarHBondContact O-N 2.94Å; H50-M52 PolarHBondContact O-N 3.17Å; H50-K53 PolarHBondContact O-N 3.41Å; H50-K53 VanDerWaalsContact O-N 3.17Å; H50-H54 AromaticContact CE1-CD2 3.32Å; H50-H54 PolarHBondContact CE1-CD2 3.18Å; H50-H54 AromaticContact CE1-NE2 3.76Å; H50-H54 AromaticContact ND1-CD2 3.32Å; H50-H54 PolarHBondContact ND1-CD2 3.33Å; H50-H54 VanDerWaalsContact ND1-CD2 3.32Å; H50-H54 AromaticContact ND1-NE2 3.8Å; H50-H54 AromaticContact NE2-CD2 3.95Å; H50-H54 PolarHBondContact O-N 3.32Å; H50-H54 VanDerWaalsContact O-N 3.07Å
51Y95.8Very high95.3Very high43 Ų4376.2 Ų76.217%0.16936%0.364CS..Hα-helixtrans-56.6-50.4177.5-168.7-86.4000111.5L20 L21 V24 F29 W32 C47 E48 K53 H54 F55 I56L20-Y51 HydrophobicContact CD2-CD2 4.22Å; L20-Y51 HydrophobicContact CG-CD2 4.29Å; L21-Y51 HydrophobicContact CD2-CD2 4.38Å; L21-Y51 HydrophobicContact CD2-CE2 3.82Å; V24-Y51 HydrophobicContact CB-CE2 4.16Å; V24-Y51 HydrophobicContact CG1-CE2 3.91Å; V24-Y51 HydrophobicContact CG2-CD2 3.98Å; V24-Y51 HydrophobicContact CG2-CE2 4Å; F29-Y51 HydrophobicContact CD2-CD1 4.34Å; F29-Y51 AromaticContact CD2-CE1 3.78Å; F29-Y51 HydrophobicContact CD2-CE1 3.78Å; F29-Y51 AromaticContact CE2-CD1 3.91Å; F29-Y51 HydrophobicContact CE2-CD1 3.91Å; F29-Y51 AromaticContact CE2-CE1 3.59Å; F29-Y51 HydrophobicContact CE2-CE1 3.59Å; W32-Y51 AromaticContact CH2-CD1 3.66Å; W32-Y51 HydrophobicContact CH2-CD1 3.66Å; W32-Y51 HydrophobicContact CH2-CD2 4.32Å; W32-Y51 HydrophobicContact CH2-CE1 4.35Å; W32-Y51 AromaticContact CH2-CG 3.63Å; W32-Y51 HydrophobicContact CH2-CG 3.63Å; W32-Y51 HydrophobicContact CZ2-CD1 4.48Å; W32-Y51 HydrophobicContact CZ3-CD1 4.49Å; W32-Y51 HydrophobicContact CZ3-CD2 4.43Å; W32-Y51 HydrophobicContact CZ3-CG 4.03Å; C47-Y51 VanDerWaalsContact O-CB 3.24Å; C47-Y51 WeakPolarHBondContact O-CB 3.44Å; C47-Y51 PolarHBondContact O-N 2.81Å; E48-Y51 PolarHBondContact O-N 2.91Å; Y51-K53 VanDerWaalsContact C-N 3.27Å; Y51-K53 PolarHBondContact O-N 2.96Å; Y51-H54 PolarHBondContact O-N 2.9Å; Y51-F55 HydrophobicContact CD2-CB 4.45Å; Y51-F55 HydrophobicContact CD2-CD2 4.2Å; Y51-F55 HydrophobicContact CE1-CB 4.43Å; Y51-F55 HydrophobicContact CE2-CB 4.34Å; Y51-F55 WeakPolarHBondContact O-CB 3.47Å; Y51-F55 PolarHBondContact O-N 3.33Å; Y51-I56 HydrophobicContact CD1-CD1 4.09Å; Y51-I56 HydrophobicContact CD1-CG1 4.44Å; Y51-I56 HydrophobicContact CE1-CD1 3.92Å; Y51-I56 HydrophobicContact CE1-CG1 4.15Å
52M95.8Very high95.5Very high73 Ų7375.6 Ų75.636%0.3635%0.353SS..Hα-helixtrans-65.7-26.6-179.8-67.8-75.7179.600113.7F29 W32 E48 H50 I56F29-M52 HydrophobicContact CE1-CE 4.31Å; F29-M52 HydrophobicContact CE2-CE 3.85Å; F29-M52 HydrophobicContact CZ-CE 3.37Å; F29-M52 HydrophobicContact CZ-SD 4.32Å; W32-M52 HydrophobicContact CZ2-CE 3.96Å; E48-M52 HydrophobicContact CG-CG 4.26Å; E48-M52 WeakPolarHBondContact O-CB 3.4Å; E48-M52 WeakPolarHBondContact O-CG 3.48Å; E48-M52 PolarHBondContact O-N 3.1Å; H50-M52 PolarHBondContact O-N 3.17Å; M52-I56 HydrophobicContact CE-CD1 4.41Å; M52-I56 HydrophobicContact SD-CD1 3.56Å; M52-I56 VanDerWaalsContact SD-CD1 3.56Å
53K95.7Very high95.6Very high119 Ų11978.4 Ų78.452%0.51737%0.367SS..Hα-helixtrans-84.3-32-178.4177.6-178167.6-1320112.7D9 K49 H50 Y51D9-K53 IonicContact OD2-NZ 3.53Å; D9-K53 PolarHBondContact OD2-NZ 3.32Å; K49-K53 WeakPolarHBondContact O-CB 3.35Å; K49-K53 PolarHBondContact O-N 3.07Å; H50-K53 PolarHBondContact O-N 3.41Å; H50-K53 VanDerWaalsContact O-N 3.17Å; Y51-K53 VanDerWaalsContact C-N 3.27Å; Y51-K53 PolarHBondContact O-N 2.96Å
54H94.6Very high95.4Very high57 Ų5779.2 Ų79.226%0.26436%0.364SS..Hα-helixtrans-115.1-22-167.8-71.8-76000114.6L8 H50 Y51L8-H54 HydrophobicContact CD1-CB 4.06Å; H50-H54 AromaticContact CE1-CD2 3.32Å; H50-H54 PolarHBondContact CE1-CD2 3.18Å; H50-H54 AromaticContact CE1-NE2 3.76Å; H50-H54 AromaticContact ND1-CD2 3.32Å; H50-H54 PolarHBondContact ND1-CD2 3.33Å; H50-H54 VanDerWaalsContact ND1-CD2 3.32Å; H50-H54 AromaticContact ND1-NE2 3.8Å; H50-H54 AromaticContact NE2-CD2 3.95Å; H50-H54 PolarHBondContact O-N 3.32Å; H50-H54 VanDerWaalsContact O-N 3.07Å; Y51-H54 PolarHBondContact O-N 2.9Å
55F90.6Very high95.3Very high71 Ų7179.6 Ų79.631%0.31137%0.367SS..  trans-118.9-3.1-174.5-59.8-82.5000114.2L8 E17 L20 L21 Y51L8-F55 HydrophobicContact CD1-CE1 4.13Å; L8-F55 HydrophobicContact CD1-CE2 4.16Å; L8-F55 HydrophobicContact CD1-CZ 3.64Å; E17-F55 WeakPolarHBondContact OE2-CZ 3.5Å; L20-F55 HydrophobicContact CD2-CE2 4.37Å; L21-F55 HydrophobicContact CD1-CE1 3.84Å; L21-F55 HydrophobicContact CD1-CZ 4.2Å; L21-F55 HydrophobicContact CD2-CD1 3.82Å; L21-F55 HydrophobicContact CD2-CD2 4.39Å; L21-F55 HydrophobicContact CD2-CE1 3.8Å; L21-F55 HydrophobicContact CD2-CE2 4.35Å; L21-F55 HydrophobicContact CD2-CG 4.11Å; L21-F55 HydrophobicContact CD2-CZ 4.06Å; L21-F55 HydrophobicContact CG-CE1 4.16Å; L21-F55 HydrophobicContact CG-CZ 4.21Å; Y51-F55 HydrophobicContact CD2-CB 4.45Å; Y51-F55 HydrophobicContact CD2-CD2 4.2Å; Y51-F55 HydrophobicContact CE1-CB 4.43Å; Y51-F55 HydrophobicContact CE2-CB 4.34Å; Y51-F55 WeakPolarHBondContact O-CB 3.47Å; Y51-F55 PolarHBondContact O-N 3.33Å
56I89.6Confident95.1Very high143 Ų14376.5 Ų76.573%0.73335%0.352SS*.  trans-123.60172.6-65.9175.8000107.9F29 Y51 M52F29-I56 HydrophobicContact CE2-CD1 3.79Å; F29-I56 HydrophobicContact CZ-CD1 3.96Å; Y51-I56 HydrophobicContact CD1-CD1 4.09Å; Y51-I56 HydrophobicContact CD1-CG1 4.44Å; Y51-I56 HydrophobicContact CE1-CD1 3.92Å; Y51-I56 HydrophobicContact CE1-CG1 4.15Å; M52-I56 HydrophobicContact CE-CD1 4.41Å; M52-I56 HydrophobicContact SD-CD1 3.56Å; M52-I56 VanDerWaalsContact SD-CD1 3.56Å

Retrieved 56 of 56 residues in 36.5 ms (Link to these results)

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