A0A077Z9K6_TRITR Loading...

Leptin receptor protein

AlphaFold DB , UniProt , Accession A0A077Z9K6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 134 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
1M56.8Low82.9Confident174 Ų17478.1 Ų78.186%0.85747%0.469SS*.  0-30.4067.3-176.7-77.800114.1T3 V4 K5M1-T3 VanDerWaalsContact C-N 3.32Å; M1-T3 PolarHBondContact O-N 3.1Å; M1-V4 PolarHBondContact O-N 3.24Å; M1-K5 PolarHBondContact O-N 3.45Å
2A65.4Low83.9Confident75 Ų7584.1 Ų84.162%0.6249%0.485SS*.Hα-helixtrans-58.5-43.417600000112V4 K5 A6A2-V4 PolarHBondContact O-N 3.17Å; A2-K5 PolarHBondContact O-N 3.48Å; A2-A6 PolarHBondContact O-N 2.95Å
3T76.1Confident84.6Confident39 Ų3979.9 Ų79.924%0.23947%0.466CS..Hα-helixtrans-56.9-46.6176.9-390000112.9M1 K5 A6 L7 I123 E127M1-T3 VanDerWaalsContact C-N 3.32Å; M1-T3 PolarHBondContact O-N 3.1Å; T3-K5 VanDerWaalsContact C-N 3.28Å; T3-K5 PolarHBondContact O-N 3.08Å; T3-A6 CarbonylContact O-C 3.48Å; T3-A6 WeakPolarHBondContact O-CB 3.27Å; T3-A6 PolarHBondContact O-N 2.93Å; T3-L7 HydrophobicContact CG2-CD1 4Å; T3-L7 HydrophobicContact CG2-CG 4.16Å; T3-L7 WeakPolarHBondContact O-CB 3.26Å; T3-L7 VanDerWaalsContact O-CG 3.32Å; T3-L7 WeakPolarHBondContact O-CG 3.46Å; T3-L7 PolarHBondContact O-N 3.07Å; T3-I123 HydrophobicContact CG2-CG2 4.36Å; T3-E127 VanDerWaalsContact CB-OE1 3.23Å; T3-E127 WeakPolarHBondContact CB-OE1 3.23Å; T3-E127 WeakPolarHBondContact CG2-OE1 3.5Å; T3-E127 PolarHBondContact OG1-OE1 3.38Å
4V83.8Confident85.1Confident91 Ų9175.6 Ų75.655%0.55245%0.447SS*.Hα-helixtrans-59.3-42.3-179.5-178.30000110.9M1 A2 L7 I8M1-V4 PolarHBondContact O-N 3.24Å; A2-V4 PolarHBondContact O-N 3.17Å; V4-L7 PolarHBondContact O-N 3.46Å; V4-I8 HydrophobicContact CG1-CD1 3.94Å; V4-I8 WeakPolarHBondContact O-CD1 2.99Å; V4-I8 WeakPolarHBondContact O-CG1 3.34Å; V4-I8 PolarHBondContact O-N 3.47Å
5K86.7Confident85.8Confident137 Ų13775.3 Ų75.360%0.59645%0.45SS*.Hα-helixtrans-64.4-41.4176-65.6174.5177.4175.70111.6M1 A2 T3 I8 G9M1-K5 PolarHBondContact O-N 3.45Å; A2-K5 PolarHBondContact O-N 3.48Å; T3-K5 VanDerWaalsContact C-N 3.28Å; T3-K5 PolarHBondContact O-N 3.08Å; K5-I8 PolarHBondContact O-N 2.96Å; K5-G9 PolarHBondContact O-N 3.14Å
6A86.9Confident86.4Confident38 Ų3873.3 Ų73.331%0.31444%0.438SS..Hα-helixtrans-63.6-46.1177.300000111.3A2 T3 I8 G9 L10 I123A2-A6 PolarHBondContact O-N 2.95Å; T3-A6 CarbonylContact O-C 3.48Å; T3-A6 WeakPolarHBondContact O-CB 3.27Å; T3-A6 PolarHBondContact O-N 2.93Å; A6-I8 VanDerWaalsContact C-N 3.34Å; A6-I8 PolarHBondContact O-N 3.05Å; A6-G9 PolarHBondContact O-N 3.17Å; A6-L10 VanDerWaalsContact O-CB 3.3Å; A6-L10 WeakPolarHBondContact O-CB 3.43Å; A6-L10 PolarHBondContact O-N 3.47Å; A6-I123 HydrophobicContact CB-CD1 3.78Å
7L88.7Confident86.8Confident69 Ų6969 Ų6936%0.36141%0.412SS..Hα-helixtrans-61.9-38.1175.9-67.6174.4000112.5T3 V4 L10 A11 Y120T3-L7 HydrophobicContact CG2-CD1 4Å; T3-L7 HydrophobicContact CG2-CG 4.16Å; T3-L7 WeakPolarHBondContact O-CB 3.26Å; T3-L7 VanDerWaalsContact O-CG 3.32Å; T3-L7 WeakPolarHBondContact O-CG 3.46Å; T3-L7 PolarHBondContact O-N 3.07Å; V4-L7 PolarHBondContact O-N 3.46Å; L7-L10 HydrophobicContact CD2-CD2 4.36Å; L7-L10 WeakPolarHBondContact O-CB 3.23Å; L7-L10 PolarHBondContact O-N 3.37Å; L7-A11 WeakPolarHBondContact O-CB 3.11Å; L7-A11 PolarHBondContact O-N 2.94Å; L7-Y120 HydrophobicContact CD2-CD2 4.41Å; L7-Y120 HydrophobicContact CD2-CE2 4.37Å
8I92.1Very high87Confident110 Ų11070.2 Ų70.256%0.56442%0.416SS*.Hα-helixtrans-63.6-46.4173.8-69.1161.9000110.6V4 K5 A6 L10 A11 F12V4-I8 HydrophobicContact CG1-CD1 3.94Å; V4-I8 WeakPolarHBondContact O-CD1 2.99Å; V4-I8 WeakPolarHBondContact O-CG1 3.34Å; V4-I8 PolarHBondContact O-N 3.47Å; K5-I8 PolarHBondContact O-N 2.96Å; A6-I8 VanDerWaalsContact C-N 3.34Å; A6-I8 PolarHBondContact O-N 3.05Å; I8-L10 VanDerWaalsContact C-N 3.27Å; I8-L10 PolarHBondContact O-N 3.1Å; I8-A11 PolarHBondContact O-N 3.31Å; I8-F12 PolarHBondContact O-N 3.28Å
9G91.3Very high87.4Confident42 Ų4272.1 Ų72.143%0.43342%0.423SS..Hα-helixtrans-61.2-38.317600000112.3K5 A6 F12 A13K5-G9 PolarHBondContact O-N 3.14Å; A6-G9 PolarHBondContact O-N 3.17Å; G9-F12 PolarHBondContact O-N 3.2Å; G9-A13 WeakPolarHBondContact O-CB 3.12Å; G9-A13 PolarHBondContact O-N 3.01Å
10L90.5Very high87.5Confident24 Ų2472 Ų7213%0.12642%0.417CS..Hα-helixtrans-65.8-44.5176.6-157.975.5000112.2A6 L7 I8 F12 A13 G14 T116 A119 Y120A6-L10 VanDerWaalsContact O-CB 3.3Å; A6-L10 WeakPolarHBondContact O-CB 3.43Å; A6-L10 PolarHBondContact O-N 3.47Å; L7-L10 HydrophobicContact CD2-CD2 4.36Å; L7-L10 WeakPolarHBondContact O-CB 3.23Å; L7-L10 PolarHBondContact O-N 3.37Å; I8-L10 VanDerWaalsContact C-N 3.27Å; I8-L10 PolarHBondContact O-N 3.1Å; L10-F12 VanDerWaalsContact C-N 3.35Å; L10-A13 PolarHBondContact O-N 2.79Å; L10-G14 PolarHBondContact O-N 3.19Å; L10-T116 HydrophobicContact CD1-CG2 3.82Å; L10-T116 VanDerWaalsContact CD1-O 3.32Å; L10-T116 WeakPolarHBondContact CD1-O 3.3Å; L10-T116 HydrophobicContact CG-CG2 3.67Å; L10-T116 VanDerWaalsContact O-CG2 3.32Å; L10-T116 WeakPolarHBondContact O-CG2 3.35Å; L10-A119 HydrophobicContact CD1-CB 3.59Å; L10-Y120 HydrophobicContact CD2-CD2 3.63Å; L10-Y120 HydrophobicContact CD2-CG 4.11Å
11A93.1Very high87.5Confident60 Ų6068.8 Ų68.850%0.49640%0.399SS..Hα-helixtrans-63.3-41.9175.500000111.2L7 I8 G14 C15L7-A11 WeakPolarHBondContact O-CB 3.11Å; L7-A11 PolarHBondContact O-N 2.94Å; I8-A11 PolarHBondContact O-N 3.31Å; A11-G14 PolarHBondContact O-N 2.89Å; A11-C15 WeakPolarHBondContact O-CB 3.01Å; A11-C15 PolarHBondContact O-N 3.24Å; A11-C15 PolarHBondContact O-SG 3.22Å
12F94.8Very high89Confident150 Ų15064.7 Ų64.766%0.65838%0.383SS*.Hα-helixtrans-63-45.7175.2-174.8-99.1000111.8I8 G9 L10 G14 C15 V16I8-F12 PolarHBondContact O-N 3.28Å; G9-F12 PolarHBondContact O-N 3.2Å; L10-F12 VanDerWaalsContact C-N 3.35Å; F12-G14 VanDerWaalsContact C-N 3.35Å; F12-G14 PolarHBondContact O-N 2.93Å; F12-C15 PolarHBondContact O-N 3.06Å; F12-V16 HydrophobicContact CD1-CG2 4.22Å; F12-V16 HydrophobicContact CE1-CG2 3.88Å; F12-V16 HydrophobicContact CZ-CG2 4.15Å; F12-V16 WeakPolarHBondContact O-CG2 3.34Å; F12-V16 PolarHBondContact O-N 2.94Å
13A93.3Very high90.1Very high30 Ų3065.1 Ų65.125%0.24838%0.375CS..Hα-helixtrans-60.3-44.1175.100000111.7G9 L10 C15 V16 G17 V112G9-A13 WeakPolarHBondContact O-CB 3.12Å; G9-A13 PolarHBondContact O-N 3.01Å; L10-A13 PolarHBondContact O-N 2.79Å; A13-C15 PolarHBondContact O-N 3.21Å; A13-V16 PolarHBondContact O-N 3.45Å; A13-G17 PolarHBondContact O-N 3.13Å; A13-V112 HydrophobicContact CB-CG1 4.44Å; A13-V112 WeakPolarHBondContact O-CG1 3.34Å
14G92.2Very high90.3Very high19 Ų1963.3 Ų63.320%0.19636%0.363CS..Hα-helixtrans-58.7-46.317500000112.4L10 A11 F12 V16 G17 L18L10-G14 PolarHBondContact O-N 3.19Å; A11-G14 PolarHBondContact O-N 2.89Å; F12-G14 VanDerWaalsContact C-N 3.35Å; F12-G14 PolarHBondContact O-N 2.93Å; G14-V16 PolarHBondContact O-N 3.01Å; G14-G17 PolarHBondContact O-N 3.12Å; G14-L18 WeakPolarHBondContact O-CG 3.34Å; G14-L18 PolarHBondContact O-N 3.02Å
15C95.3Very high90.2Very high72 Ų7260.6 Ų60.649%0.48635%0.348SS..Hα-helixtrans-58.9-45.3174.2-71.70000111.8A11 F12 A13 G17 L18 L19A11-C15 WeakPolarHBondContact O-CB 3.01Å; A11-C15 PolarHBondContact O-N 3.24Å; A11-C15 PolarHBondContact O-SG 3.22Å; F12-C15 PolarHBondContact O-N 3.06Å; A13-C15 PolarHBondContact O-N 3.21Å; C15-G17 VanDerWaalsContact C-N 3.33Å; C15-G17 PolarHBondContact O-N 3.24Å; C15-L18 PolarHBondContact O-N 3.34Å; C15-L19 WeakPolarHBondContact O-CB 3.29Å; C15-L19 WeakPolarHBondContact O-CG 3.44Å; C15-L19 PolarHBondContact O-N 2.72Å
16V95.4Very high90Very high42 Ų4257.7 Ų57.726%0.25535%0.35SS..Hα-helixtrans-59.8-43.3176.8170.80000111.3F12 A13 G14 L19 F20F12-V16 HydrophobicContact CD1-CG2 4.22Å; F12-V16 HydrophobicContact CE1-CG2 3.88Å; F12-V16 HydrophobicContact CZ-CG2 4.15Å; F12-V16 WeakPolarHBondContact O-CG2 3.34Å; F12-V16 PolarHBondContact O-N 2.94Å; A13-V16 PolarHBondContact O-N 3.45Å; G14-V16 PolarHBondContact O-N 3.01Å; V16-L19 PolarHBondContact O-N 3.15Å; V16-F20 HydrophobicContact CG1-CD2 3.91Å; V16-F20 HydrophobicContact CG1-CE2 3.42Å; V16-F20 VanDerWaalsContact CG1-CE2 3.42Å; V16-F20 HydrophobicContact CG1-CZ 4.25Å; V16-F20 WeakPolarHBondContact O-CD2 3.32Å; V16-F20 PolarHBondContact O-N 3.14Å; V16-F20 VanDerWaalsContact O-N 3.07Å
17G92.6Very high89.4Confident1 Ų159.6 Ų59.61%0.0135%0.354CS..Hα-helixtrans-61.7-44.1175.600000113.1A13 G14 C15 F20 L21A13-G17 PolarHBondContact O-N 3.13Å; G14-G17 PolarHBondContact O-N 3.12Å; C15-G17 VanDerWaalsContact C-N 3.33Å; C15-G17 PolarHBondContact O-N 3.24Å; G17-F20 PolarHBondContact O-N 3.21Å; G17-L21 PolarHBondContact O-N 2.95Å; G17-L21 VanDerWaalsContact O-N 3.16Å
18L91.2Very high88.1Confident90 Ų9061.1 Ų61.147%0.47137%0.368SS..Hα-helixtrans-66.8-38176-68.3174.6000112.1G14 C15 F20 L21 V22G14-L18 WeakPolarHBondContact O-CG 3.34Å; G14-L18 PolarHBondContact O-N 3.02Å; C15-L18 PolarHBondContact O-N 3.34Å; L18-F20 PolarHBondContact O-N 2.83Å; L18-L21 WeakPolarHBondContact O-CB 3.39Å; L18-L21 PolarHBondContact O-N 3.43Å; L18-V22 WeakPolarHBondContact O-CG2 3.44Å; L18-V22 PolarHBondContact O-N 3.36Å
19L93.5Very high86.7Confident107 Ų10762.2 Ų62.256%0.5638%0.376SS*.Hα-helixtrans-61.5-43.4176-75173.9000111.3C15 V16 L21 V22 L23C15-L19 WeakPolarHBondContact O-CB 3.29Å; C15-L19 WeakPolarHBondContact O-CG 3.44Å; C15-L19 PolarHBondContact O-N 2.72Å; V16-L19 PolarHBondContact O-N 3.15Å; L19-L21 VanDerWaalsContact C-N 3.31Å; L19-L21 PolarHBondContact O-N 3.32Å; L19-V22 PolarHBondContact O-N 2.99Å; L19-L23 WeakPolarHBondContact O-CB 3.5Å; L19-L23 PolarHBondContact O-N 3Å
20F89.9Confident85.4Confident69 Ų6962.6 Ų62.630%0.30336%0.364SS..Hα-helixtrans-62.9-38.4174.5-72.8-52000112.5V16 G17 L18 L23 G24 F105V16-F20 HydrophobicContact CG1-CD2 3.91Å; V16-F20 HydrophobicContact CG1-CE2 3.42Å; V16-F20 VanDerWaalsContact CG1-CE2 3.42Å; V16-F20 HydrophobicContact CG1-CZ 4.25Å; V16-F20 WeakPolarHBondContact O-CD2 3.32Å; V16-F20 PolarHBondContact O-N 3.14Å; V16-F20 VanDerWaalsContact O-N 3.07Å; G17-F20 PolarHBondContact O-N 3.21Å; L18-F20 PolarHBondContact O-N 2.83Å; F20-L23 PolarHBondContact O-N 2.72Å; F20-G24 PolarHBondContact O-N 3.28Å; F20-F105 AromaticContact CD1-CD1 3.76Å; F20-F105 HydrophobicContact CD1-CD1 3.76Å; F20-F105 HydrophobicContact CD1-CE1 4.19Å; F20-F105 HydrophobicContact CE1-CD1 4.38Å; F20-F105 HydrophobicContact CE1-CE1 4.43Å
21L87.5Confident84.3Confident5 Ų563.9 Ų63.93%0.02637%0.371CS..Hα-helixtrans-64-46.7175.9-16678.9000111.4G17 L18 L19 G24 C25 I38 T106G17-L21 PolarHBondContact O-N 2.95Å; G17-L21 VanDerWaalsContact O-N 3.16Å; L18-L21 WeakPolarHBondContact O-CB 3.39Å; L18-L21 PolarHBondContact O-N 3.43Å; L19-L21 VanDerWaalsContact C-N 3.31Å; L19-L21 PolarHBondContact O-N 3.32Å; L21-G24 WeakPolarHBondContact O-CA 3.3Å; L21-G24 PolarHBondContact O-N 3.43Å; L21-G24 VanDerWaalsContact O-N 3.13Å; L21-C25 PolarHBondContact O-N 2.98Å; L21-C25 PolarHBondContact O-SG 3.11Å; L21-I38 HydrophobicContact CD2-CD1 3.57Å; L21-I38 HydrophobicContact CD2-CG1 3.4Å; L21-I38 VanDerWaalsContact CD2-CG1 3.4Å; L21-T106 HydrophobicContact CD1-CG2 4.19Å
22V88.2Confident83.1Confident88 Ų8869.7 Ų69.753%0.53338%0.38SS..Hα-helixtrans-64.2-40177.1173.60000110.9L18 L19 G24 C25 A26L18-V22 WeakPolarHBondContact O-CG2 3.44Å; L18-V22 PolarHBondContact O-N 3.36Å; L19-V22 PolarHBondContact O-N 2.99Å; V22-G24 PolarHBondContact O-N 2.72Å; V22-C25 PolarHBondContact O-N 2.83Å; V22-A26 HydrophobicContact CG1-CB 4.4Å; V22-A26 WeakPolarHBondContact O-CB 3.35Å; V22-A26 PolarHBondContact O-N 3.35Å
23L87.9Confident82Confident85 Ų8567.1 Ų67.145%0.44537%0.367SS..Hα-helixtrans-58.3-40172.9-118.492.5000111.5L19 F20 C25 L27 F105L19-L23 WeakPolarHBondContact O-CB 3.5Å; L19-L23 PolarHBondContact O-N 3Å; F20-L23 PolarHBondContact O-N 2.72Å; L23-C25 PolarHBondContact O-N 3.38Å; L23-L27 PolarHBondContact O-N 2.96Å; L23-F105 HydrophobicContact CD2-CD1 4.3Å; L23-F105 HydrophobicContact CD2-CE1 3.82Å; L23-F105 HydrophobicContact CD2-CE2 4.45Å; L23-F105 HydrophobicContact CD2-CZ 3.9Å
24G82.3Confident81Confident0 Ų065.8 Ų65.80%036%0.356CS..Hα-helixtrans-63.5-24.9175.200000114F20 L21 V22 Y30 A102F20-G24 PolarHBondContact O-N 3.28Å; L21-G24 WeakPolarHBondContact O-CA 3.3Å; L21-G24 PolarHBondContact O-N 3.43Å; L21-G24 VanDerWaalsContact O-N 3.13Å; V22-G24 PolarHBondContact O-N 2.72Å; G24-Y30 VanDerWaalsContact O-CB 3.32Å; G24-Y30 WeakPolarHBondContact O-CB 3.31Å; G24-Y30 WeakPolarHBondContact O-CD1 3.29Å; G24-A102 VanDerWaalsContact O-CB 3.29Å; G24-A102 WeakPolarHBondContact O-CB 3.38Å
25C80.4Confident80.2Confident34 Ų3469 Ų6923%0.2337%0.368CS..Hα-helixtrans-94-37.1176.5-61.50000113.7L21 V22 L23 P34L21-C25 PolarHBondContact O-N 2.98Å; L21-C25 PolarHBondContact O-SG 3.11Å; V22-C25 PolarHBondContact O-N 2.83Å; L23-C25 PolarHBondContact O-N 3.38Å; C25-P34 VanDerWaalsContact SG-CG 3.59Å
26A82.8Confident79.4Confident77 Ų7770.2 Ų70.264%0.63637%0.365SS*.Hα-helixtrans-86-17.9-164.600000113.9V22V22-A26 HydrophobicContact CG1-CB 4.4Å; V22-A26 WeakPolarHBondContact O-CB 3.35Å; V22-A26 PolarHBondContact O-N 3.35Å
27L74Confident78.9Confident77 Ų7768.2 Ų68.240%0.40335%0.353SS..SBendtrans-64.9145.4-179.8-161.470000108.6L23 N29 Y30L23-L27 PolarHBondContact O-N 2.96Å; L27-N29 PolarHBondContact O-N 3.42Å; L27-Y30 HydrophobicContact CB-CD2 3.3Å; L27-Y30 HydrophobicContact CB-CE2 3.36Å; L27-Y30 HydrophobicContact CB-CG 4.1Å; L27-Y30 HydrophobicContact CD2-CD2 4.09Å; L27-Y30 HydrophobicContact CD2-CE2 3.19Å; L27-Y30 WeakPolarHBondContact CD2-OH 2.97Å; L27-Y30 HydrophobicContact CG-CD2 3.85Å; L27-Y30 HydrophobicContact CG-CE2 3.38Å; L27-Y30 WeakPolarHBondContact O-CB 3.38Å; L27-Y30 WeakPolarHBondContact O-CD2 3.39Å; L27-Y30 PolarHBondContact O-N 2.85Å
28P61.2Low78.5Confident101 Ų10170.6 Ų70.666%0.65637%0.365SS*.THydrogen-bonded Turntrans-65.5134.4-179.922.4-31.3000110.2Y30P28-Y30 WeakPolarHBondContact O-CD2 3.37Å
29N63.8Low78.2Confident134 Ų13470.2 Ų70.272%0.71736%0.363SS*.THydrogen-bonded Turntrans84.57.8-168.4-52.7-75.6000116.6L27L27-N29 PolarHBondContact O-N 3.42Å
30Y64Low77.7Confident49 Ų4966.6 Ų66.619%0.19234%0.343CS..  trans-102.5137.8-179.9-65.6-89.6000111.5G24 L27 P28 H99 A102G24-Y30 VanDerWaalsContact O-CB 3.32Å; G24-Y30 WeakPolarHBondContact O-CB 3.31Å; G24-Y30 WeakPolarHBondContact O-CD1 3.29Å; L27-Y30 HydrophobicContact CB-CD2 3.3Å; L27-Y30 HydrophobicContact CB-CE2 3.36Å; L27-Y30 HydrophobicContact CB-CG 4.1Å; L27-Y30 HydrophobicContact CD2-CD2 4.09Å; L27-Y30 HydrophobicContact CD2-CE2 3.19Å; L27-Y30 WeakPolarHBondContact CD2-OH 2.97Å; L27-Y30 HydrophobicContact CG-CD2 3.85Å; L27-Y30 HydrophobicContact CG-CE2 3.38Å; L27-Y30 WeakPolarHBondContact O-CB 3.38Å; L27-Y30 WeakPolarHBondContact O-CD2 3.39Å; L27-Y30 PolarHBondContact O-N 2.85Å; P28-Y30 WeakPolarHBondContact O-CD2 3.37Å; Y30-H99 HydrophobicContact CD1-CB 4.42Å; Y30-H99 HydrophobicContact CE1-CB 3.6Å; Y30-A102 HydrophobicContact CD1-CB 3.13Å; Y30-A102 HydrophobicContact CE1-CB 3.08Å; Y30-A102 HydrophobicContact CG-CB 4.29Å
31N67.8Low77.4Confident51 Ų5164.6 Ų64.627%0.27333%0.333SS..  trans-96160.6-178.4-151.4-7.8000109.9Y33 P34 A97N31-Y33 HydrophobicContact CB-CD2 3.75Å; N31-Y33 HydrophobicContact CB-CE2 4.35Å; N31-Y33 VanDerWaalsContact ND2-CD2 3.26Å; N31-Y33 WeakPolarHBondContact ND2-CD2 3.21Å; N31-Y33 WeakPolarHBondContact ND2-CE2 3.49Å; N31-Y33 PolarHBondContact O-N 3.08Å; N31-Y33 VanDerWaalsContact O-N 3.14Å; N31-P34 WeakPolarHBondContact O-CD 2.97Å; N31-A97 VanDerWaalsContact CB-O 3.23Å; N31-A97 WeakPolarHBondContact CB-O 3.34Å
32W67.9Low77Confident182 Ų18270 Ų7069%0.68936%0.361SS*.SBendtrans-73.41.2-178.644-80.6000113.7L35W32-L35 WeakPolarHBondContact O-CB 3.47Å; W32-L35 PolarHBondContact O-N 3.31Å
33Y71.5Confident76.5Confident97 Ų9769.4 Ų69.438%0.3835%0.354SS..G310 helixtrans-56.6-38.5179.7-74.9-61.4000117.1N31 L35 F36 L88 A97N31-Y33 HydrophobicContact CB-CD2 3.75Å; N31-Y33 HydrophobicContact CB-CE2 4.35Å; N31-Y33 VanDerWaalsContact ND2-CD2 3.26Å; N31-Y33 WeakPolarHBondContact ND2-CD2 3.21Å; N31-Y33 WeakPolarHBondContact ND2-CE2 3.49Å; N31-Y33 PolarHBondContact O-N 3.08Å; N31-Y33 VanDerWaalsContact O-N 3.14Å; Y33-L35 PolarHBondContact O-N 2.97Å; Y33-L35 VanDerWaalsContact O-N 3.1Å; Y33-F36 WeakPolarHBondContact O-CB 3.42Å; Y33-F36 PolarHBondContact O-N 3.34Å; Y33-L88 HydrophobicContact CD1-CD2 4.11Å; Y33-L88 HydrophobicContact CD2-CD2 4.26Å; Y33-L88 HydrophobicContact CG-CD2 3.88Å; Y33-A97 HydrophobicContact CD2-CB 3.69Å; Y33-A97 HydrophobicContact CE2-CB 3.83Å
34P71Confident75.9Confident1 Ų165.5 Ų65.51%0.00633%0.334CS..G310 helixtrans-67.8-12.8-179.527.1-30.1000113C25 N31 F36 V37 I98 T106C25-P34 VanDerWaalsContact SG-CG 3.59Å; N31-P34 WeakPolarHBondContact O-CD 2.97Å; P34-F36 PolarHBondContact O-N 3.5Å; P34-V37 WeakPolarHBondContact O-CB 3.43Å; P34-V37 VanDerWaalsContact O-CG2 3.29Å; P34-V37 WeakPolarHBondContact O-CG2 3.28Å; P34-V37 PolarHBondContact O-N 2.85Å; P34-I98 HydrophobicContact CB-CD1 3.79Å; P34-I98 HydrophobicContact CG-CD1 3.8Å; P34-T106 HydrophobicContact CB-CG2 3.28Å; P34-T106 HydrophobicContact CG-CG2 3.99Å
35L76.5Confident75.4Confident88 Ų8867.8 Ų67.846%0.46135%0.349SS..G310 helixtrans-63-22.6172.2-150.9163.5000111.7W32 Y33 V37 I38W32-L35 WeakPolarHBondContact O-CB 3.47Å; W32-L35 PolarHBondContact O-N 3.31Å; Y33-L35 PolarHBondContact O-N 2.97Å; Y33-L35 VanDerWaalsContact O-N 3.1Å; L35-V37 PolarHBondContact O-N 3.32Å; L35-I38 HydrophobicContact CD2-CB 4.36Å; L35-I38 HydrophobicContact CD2-CD1 3.61Å; L35-I38 HydrophobicContact CD2-CG1 4.14Å; L35-I38 HydrophobicContact CG-CD1 3.83Å; L35-I38 HydrophobicContact CG-CG1 4.46Å; L35-I38 VanDerWaalsContact O-CB 3.31Å; L35-I38 WeakPolarHBondContact O-CB 3.41Å; L35-I38 WeakPolarHBondContact O-CG1 3.46Å; L35-I38 PolarHBondContact O-N 3.23Å
36F79Confident75Confident97 Ų9769.5 Ų69.543%0.42536%0.358SS..G310 helixtrans-57.3-27.2175.5-166.8-93000112.9Y33 P34 I38 I39 F40 L84Y33-F36 WeakPolarHBondContact O-CB 3.42Å; Y33-F36 PolarHBondContact O-N 3.34Å; P34-F36 PolarHBondContact O-N 3.5Å; F36-I38 PolarHBondContact O-N 3.06Å; F36-I39 HydrophobicContact CD2-CD1 3.73Å; F36-I39 HydrophobicContact CE2-CD1 3.74Å; F36-I39 HydrophobicContact CG-CD1 4.34Å; F36-I39 HydrophobicContact CZ-CD1 4.37Å; F36-I39 WeakPolarHBondContact O-CB 3.27Å; F36-I39 PolarHBondContact O-N 3.2Å; F36-I39 VanDerWaalsContact O-N 3.12Å; F36-F40 HydrophobicContact CD1-CD2 4.38Å; F36-F40 AromaticContact CD1-CE2 3.73Å; F36-F40 HydrophobicContact CD1-CE2 3.73Å; F36-F40 HydrophobicContact CE1-CD2 4.45Å; F36-F40 AromaticContact CE1-CE2 3.54Å; F36-F40 HydrophobicContact CE1-CE2 3.54Å; F36-F40 AromaticContact CE1-CZ 3.95Å; F36-F40 HydrophobicContact CE1-CZ 3.95Å; F36-L84 HydrophobicContact CB-CD2 4.04Å; F36-L84 HydrophobicContact CD1-CD1 3.32Å; F36-L84 HydrophobicContact CD1-CD2 3.81Å; F36-L84 HydrophobicContact CD1-CG 4.21Å; F36-L84 HydrophobicContact CE1-CD1 3.5Å; F36-L84 VanDerWaalsContact CE1-CD1 3.5Å; F36-L84 HydrophobicContact CG-CD1 4.32Å; F36-L84 HydrophobicContact CG-CD2 4.29Å
37V84.2Confident74Confident0 Ų065.9 Ų65.90%033%0.329CS..Hα-helixtrans-59.6-30.6175.7-178.30000112.2P34 L35 I39 F40 Y41 A81 N110P34-V37 WeakPolarHBondContact O-CB 3.43Å; P34-V37 VanDerWaalsContact O-CG2 3.29Å; P34-V37 WeakPolarHBondContact O-CG2 3.28Å; P34-V37 PolarHBondContact O-N 2.85Å; L35-V37 PolarHBondContact O-N 3.32Å; V37-I39 PolarHBondContact O-N 2.98Å; V37-F40 WeakPolarHBondContact O-CB 3.43Å; V37-F40 PolarHBondContact O-N 3.2Å; V37-Y41 HydrophobicContact CG1-CD1 4.31Å; V37-Y41 HydrophobicContact CG1-CE1 3.52Å; V37-Y41 HydrophobicContact CG1-CE2 4.17Å; V37-Y41 VanDerWaalsContact CG1-CZ 3.42Å; V37-Y41 WeakPolarHBondContact CG1-OH 3.48Å; V37-Y41 PolarHBondContact O-N 2.87Å; V37-A81 HydrophobicContact CG1-CB 4.33Å; V37-N110 WeakPolarHBondContact CG1-ND2 3.46Å; V37-N110 WeakPolarHBondContact CG1-OD1 3.35Å
38I84.1Confident73.6Confident51 Ų5164.8 Ų64.826%0.26232%0.323SS..Hα-helixtrans-59.2-33.3178-59-172000111.5L21 L35 F36 F40 Y41 I42L21-I38 HydrophobicContact CD2-CD1 3.57Å; L21-I38 HydrophobicContact CD2-CG1 3.4Å; L21-I38 VanDerWaalsContact CD2-CG1 3.4Å; L35-I38 HydrophobicContact CD2-CB 4.36Å; L35-I38 HydrophobicContact CD2-CD1 3.61Å; L35-I38 HydrophobicContact CD2-CG1 4.14Å; L35-I38 HydrophobicContact CG-CD1 3.83Å; L35-I38 HydrophobicContact CG-CG1 4.46Å; L35-I38 VanDerWaalsContact O-CB 3.31Å; L35-I38 WeakPolarHBondContact O-CB 3.41Å; L35-I38 WeakPolarHBondContact O-CG1 3.46Å; L35-I38 PolarHBondContact O-N 3.23Å; F36-I38 PolarHBondContact O-N 3.06Å; I38-F40 VanDerWaalsContact C-N 3.26Å; I38-F40 PolarHBondContact O-N 3.05Å; I38-Y41 WeakPolarHBondContact O-CB 3.04Å; I38-Y41 PolarHBondContact O-N 3.35Å; I38-I42 HydrophobicContact CG2-CD1 4.25Å; I38-I42 WeakPolarHBondContact O-CG1 3.35Å; I38-I42 PolarHBondContact O-N 3.37Å
39I84Confident74Confident81 Ų8163.4 Ų63.442%0.41531%0.313SS..Hα-helixtrans-62-39.5177.6-61.4169.5000109.9F36 V37 Y41 I42 L43F36-I39 HydrophobicContact CD2-CD1 3.73Å; F36-I39 HydrophobicContact CE2-CD1 3.74Å; F36-I39 HydrophobicContact CG-CD1 4.34Å; F36-I39 HydrophobicContact CZ-CD1 4.37Å; F36-I39 WeakPolarHBondContact O-CB 3.27Å; F36-I39 PolarHBondContact O-N 3.2Å; F36-I39 VanDerWaalsContact O-N 3.12Å; V37-I39 PolarHBondContact O-N 2.98Å; I39-Y41 VanDerWaalsContact C-N 3.34Å; I39-Y41 PolarHBondContact O-N 2.81Å; I39-I42 PolarHBondContact O-N 3.29Å; I39-L43 HydrophobicContact CG2-CD1 3.8Å; I39-L43 WeakPolarHBondContact O-CD1 3.41Å; I39-L43 WeakPolarHBondContact O-CG 3.36Å; I39-L43 PolarHBondContact O-N 2.97Å
40F83.6Confident74.2Confident32 Ų3260 Ų6014%0.1429%0.294CS..Hα-helixtrans-68.4-31.5174.5-66.4-71.7000112.8F36 V37 I38 I42 L43 A44 I77 S80 A81 L84F36-F40 HydrophobicContact CD1-CD2 4.38Å; F36-F40 AromaticContact CD1-CE2 3.73Å; F36-F40 HydrophobicContact CD1-CE2 3.73Å; F36-F40 HydrophobicContact CE1-CD2 4.45Å; F36-F40 AromaticContact CE1-CE2 3.54Å; F36-F40 HydrophobicContact CE1-CE2 3.54Å; F36-F40 AromaticContact CE1-CZ 3.95Å; F36-F40 HydrophobicContact CE1-CZ 3.95Å; V37-F40 WeakPolarHBondContact O-CB 3.43Å; V37-F40 PolarHBondContact O-N 3.2Å; I38-F40 VanDerWaalsContact C-N 3.26Å; I38-F40 PolarHBondContact O-N 3.05Å; F40-I42 VanDerWaalsContact C-N 3.32Å; F40-L43 PolarHBondContact O-N 3.19Å; F40-A44 WeakPolarHBondContact O-CB 3.25Å; F40-A44 PolarHBondContact O-N 3.49Å; F40-I77 HydrophobicContact CB-CG2 4.19Å; F40-I77 HydrophobicContact CD1-CG2 4.11Å; F40-S80 WeakPolarHBondContact CD1-OG 3.38Å; F40-S80 WeakPolarHBondContact CE1-OG 3.25Å; F40-S80 WeakPolarHBondContact CZ-OG 3.23Å; F40-A81 HydrophobicContact CB-CB 3.81Å; F40-A81 HydrophobicContact CD2-CB 4.14Å; F40-A81 HydrophobicContact CG-CB 4.04Å; F40-L84 HydrophobicContact CE2-CD1 4.17Å
41Y84.5Confident73.9Confident26 Ų2659 Ų5910%0.10230%0.295CS..Hα-helixtrans-66.6-34.8173.6-58.6-20000112.3V37 I38 I39 P45 N110 S113 F114V37-Y41 HydrophobicContact CG1-CD1 4.31Å; V37-Y41 HydrophobicContact CG1-CE1 3.52Å; V37-Y41 HydrophobicContact CG1-CE2 4.17Å; V37-Y41 VanDerWaalsContact CG1-CZ 3.42Å; V37-Y41 WeakPolarHBondContact CG1-OH 3.48Å; V37-Y41 PolarHBondContact O-N 2.87Å; I38-Y41 WeakPolarHBondContact O-CB 3.04Å; I38-Y41 PolarHBondContact O-N 3.35Å; I39-Y41 VanDerWaalsContact C-N 3.34Å; I39-Y41 PolarHBondContact O-N 2.81Å; Y41-P45 WeakPolarHBondContact O-CD 3.42Å; Y41-N110 WeakPolarHBondContact CE1-OD1 3.32Å; Y41-N110 VanDerWaalsContact OH-CA 3.24Å; Y41-N110 WeakPolarHBondContact OH-CA 3.3Å; Y41-N110 VanDerWaalsContact OH-CG 3.31Å; Y41-N110 PolarHBondContact OH-N 3.32Å; Y41-N110 PolarHBondContact OH-OD1 3.36Å; Y41-S113 WeakPolarHBondContact CE1-OG 3.22Å; Y41-S113 PolarHBondContact OH-OG 3.34Å; Y41-S113 VanDerWaalsContact OH-OG 3.04Å; Y41-F114 HydrophobicContact CD1-CE1 4.3Å; Y41-F114 HydrophobicContact CD1-CZ 4.08Å; Y41-F114 HydrophobicContact CE1-CD2 4.49Å; Y41-F114 AromaticContact CE1-CE2 3.99Å; Y41-F114 HydrophobicContact CE1-CE2 3.99Å; Y41-F114 HydrophobicContact CE1-CZ 4.02Å
42I78.4Confident73.6Confident118 Ų11858.4 Ų58.461%0.60530%0.302SS*.Hα-helixtrans-74.2-33.8175-61.5169.5000111I38 I39 F40 P45I38-I42 HydrophobicContact CG2-CD1 4.25Å; I38-I42 WeakPolarHBondContact O-CG1 3.35Å; I38-I42 PolarHBondContact O-N 3.37Å; I39-I42 PolarHBondContact O-N 3.29Å; F40-I42 VanDerWaalsContact C-N 3.32Å; I42-P45 VanDerWaalsContact O-CD 3.25Å; I42-P45 WeakPolarHBondContact O-CD 3.45Å; I42-P45 VanDerWaalsContact O-CG 3.28Å; I42-P45 WeakPolarHBondContact O-CG 3.43Å
43L78.2Confident73.2Confident76 Ų7658.5 Ų58.540%0.39830%0.302SS..Hα-helixtrans-74.2-28.1175.3-77.5155.1000113I39 F40 V46 P47 I77I39-L43 HydrophobicContact CG2-CD1 3.8Å; I39-L43 WeakPolarHBondContact O-CD1 3.41Å; I39-L43 WeakPolarHBondContact O-CG 3.36Å; I39-L43 PolarHBondContact O-N 2.97Å; F40-L43 PolarHBondContact O-N 3.19Å; L43-V46 VanDerWaalsContact O-CB 3.26Å; L43-V46 WeakPolarHBondContact O-CB 3.36Å; L43-V46 WeakPolarHBondContact O-CG2 3.31Å; L43-V46 PolarHBondContact O-N 3.27Å; L43-V46 VanDerWaalsContact O-N 3.15Å; L43-P47 WeakPolarHBondContact O-CD 3.47Å; L43-I77 HydrophobicContact CB-CD1 4.34Å
44A75Confident72.4Confident4 Ų457.4 Ų57.43%0.03330%0.298CS..THydrogen-bonded Turntrans-58.7-40.2-179.200000116F40 V46 P47 L48 I77 F114 I117F40-A44 WeakPolarHBondContact O-CB 3.25Å; F40-A44 PolarHBondContact O-N 3.49Å; A44-V46 PolarHBondContact O-N 2.87Å; A44-P47 WeakPolarHBondContact O-CD 3.38Å; A44-P47 VanDerWaalsContact O-CG 3.31Å; A44-P47 WeakPolarHBondContact O-CG 3.48Å; A44-L48 WeakPolarHBondContact O-CD1 3.41Å; A44-I77 HydrophobicContact CB-CG2 4.46Å; A44-F114 HydrophobicContact CB-CE1 4.29Å; A44-I117 HydrophobicContact CB-CD1 4.19Å
45P70.7Confident71.6Confident47 Ų4763.3 Ų63.331%0.30533%0.325SS..Hα-helixtrans-69.5-19.717524.4-34.3000113.6Y41 I42 L48 T49 F121Y41-P45 WeakPolarHBondContact O-CD 3.42Å; I42-P45 VanDerWaalsContact O-CD 3.25Å; I42-P45 WeakPolarHBondContact O-CD 3.45Å; I42-P45 VanDerWaalsContact O-CG 3.28Å; I42-P45 WeakPolarHBondContact O-CG 3.43Å; P45-L48 PolarHBondContact O-N 2.97Å; P45-T49 WeakPolarHBondContact O-CG2 2.95Å; P45-T49 PolarHBondContact O-N 3.27Å; P45-T49 PolarHBondContact O-OG1 3.5Å; P45-F121 HydrophobicContact CB-CE2 4.19Å; P45-F121 HydrophobicContact CB-CZ 3.95Å
46V72.8Confident70.5Confident70 Ų7066.7 Ų66.742%0.42434%0.339SS..Hα-helixtrans-59.6-55-179.7-177.50000112L43 A44 L48 T49 L50L43-V46 VanDerWaalsContact O-CB 3.26Å; L43-V46 WeakPolarHBondContact O-CB 3.36Å; L43-V46 WeakPolarHBondContact O-CG2 3.31Å; L43-V46 PolarHBondContact O-N 3.27Å; L43-V46 VanDerWaalsContact O-N 3.15Å; A44-V46 PolarHBondContact O-N 2.87Å; V46-L48 VanDerWaalsContact C-N 3.33Å; V46-L48 PolarHBondContact O-N 3.35Å; V46-T49 PolarHBondContact O-N 3.26Å; V46-T49 PolarHBondContact O-OG1 3.47Å; V46-L50 HydrophobicContact CG1-CD1 4.21Å; V46-L50 VanDerWaalsContact O-CD1 3.31Å; V46-L50 WeakPolarHBondContact O-CD1 3.24Å; V46-L50 PolarHBondContact O-N 2.86Å; V46-L50 VanDerWaalsContact O-N 3.08Å
47P61.4Low69.1Low2 Ų270.2 Ų70.21%0.01335%0.349CS..Hα-helixtrans-67.3-30.4179.328.1-37.7000113.7L43 A44 L50 A51 L73 T74 I77L43-P47 WeakPolarHBondContact O-CD 3.47Å; A44-P47 WeakPolarHBondContact O-CD 3.38Å; A44-P47 VanDerWaalsContact O-CG 3.31Å; A44-P47 WeakPolarHBondContact O-CG 3.48Å; P47-L50 WeakPolarHBondContact O-CB 3.46Å; P47-L50 PolarHBondContact O-N 3.18Å; P47-A51 PolarHBondContact O-N 2.87Å; P47-L73 HydrophobicContact CB-CD2 4.48Å; P47-T74 WeakPolarHBondContact CB-OG1 3.48Å; P47-T74 HydrophobicContact CG-CG2 4.35Å; P47-T74 VanDerWaalsContact CG-OG1 3.23Å; P47-T74 WeakPolarHBondContact CG-OG1 3.4Å; P47-I77 HydrophobicContact CG-CD1 4.14Å
48L66.9Low67.5Low53 Ų5373.1 Ų73.128%0.27737%0.373SS..Hα-helixtrans-67.1-42.4177.5-77.5144.6000111.7A44 P45 V46 L50 A51 G52 I117 F121A44-L48 WeakPolarHBondContact O-CD1 3.41Å; P45-L48 PolarHBondContact O-N 2.97Å; V46-L48 VanDerWaalsContact C-N 3.33Å; V46-L48 PolarHBondContact O-N 3.35Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L48-A51 PolarHBondContact O-N 3.44Å; L48-G52 PolarHBondContact O-N 3.29Å; L48-I117 HydrophobicContact CD1-CG2 4.14Å; L48-F121 HydrophobicContact CB-CD1 3.91Å; L48-F121 HydrophobicContact CB-CD2 4Å; L48-F121 HydrophobicContact CB-CE1 3.54Å; L48-F121 HydrophobicContact CB-CE2 3.64Å; L48-F121 HydrophobicContact CB-CG 4.13Å; L48-F121 HydrophobicContact CB-CZ 3.39Å; L48-F121 HydrophobicContact CD1-CD2 3.44Å; L48-F121 VanDerWaalsContact CD1-CD2 3.44Å; L48-F121 HydrophobicContact CD1-CE2 3.34Å; L48-F121 HydrophobicContact CD1-CG 4.22Å; L48-F121 HydrophobicContact CD1-CZ 4.05Å; L48-F121 HydrophobicContact CD2-CB 4.16Å; L48-F121 HydrophobicContact CD2-CD1 4.28Å; L48-F121 HydrophobicContact CD2-CD2 3.94Å; L48-F121 HydrophobicContact CD2-CE2 4.41Å; L48-F121 HydrophobicContact CD2-CG 3.87Å; L48-F121 HydrophobicContact CG-CD2 3.97Å; L48-F121 HydrophobicContact CG-CE2 3.94Å; L48-F121 HydrophobicContact CG-CG 4.27Å; L48-F121 HydrophobicContact CG-CZ 4.22Å
49T68.6Low66Low73 Ų7376.3 Ų76.345%0.44840%0.4SS..Hα-helixtrans-68.4-33.417358.80000112.4P45 V46 G52 R53 F121P45-T49 WeakPolarHBondContact O-CG2 2.95Å; P45-T49 PolarHBondContact O-N 3.27Å; P45-T49 PolarHBondContact O-OG1 3.5Å; V46-T49 PolarHBondContact O-N 3.26Å; V46-T49 PolarHBondContact O-OG1 3.47Å; T49-G52 PolarHBondContact O-N 3.45Å; T49-R53 WeakPolarHBondContact O-CG 3.37Å; T49-R53 PolarHBondContact O-N 3.41Å; T49-R53 VanDerWaalsContact O-N 3.12Å; T49-F121 HydrophobicContact CG2-CE1 4.42Å
50L66.9Low64.6Low63 Ų6376.4 Ų76.433%0.3340%0.404SS..Hα-helixtrans-58.6-47.3172.7-103.568.9000110.8V46 P47 L48 G52 R53 Y54V46-L50 HydrophobicContact CG1-CD1 4.21Å; V46-L50 VanDerWaalsContact O-CD1 3.31Å; V46-L50 WeakPolarHBondContact O-CD1 3.24Å; V46-L50 PolarHBondContact O-N 2.86Å; V46-L50 VanDerWaalsContact O-N 3.08Å; P47-L50 WeakPolarHBondContact O-CB 3.46Å; P47-L50 PolarHBondContact O-N 3.18Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L50-G52 VanDerWaalsContact C-N 3.31Å; L50-G52 PolarHBondContact O-N 2.81Å; L50-R53 PolarHBondContact O-N 3.04Å; L50-Y54 HydrophobicContact CB-CD2 4.23Å; L50-Y54 HydrophobicContact CB-CE2 3.87Å; L50-Y54 HydrophobicContact CD2-CE2 3.98Å; L50-Y54 HydrophobicContact CG-CE2 3.7Å; L50-Y54 WeakPolarHBondContact O-CD2 3.36Å; L50-Y54 PolarHBondContact O-N 3.16Å; L50-Y54 VanDerWaalsContact O-N 3.08Å
51A59Low63.3Low26 Ų2678.6 Ų78.622%0.21544%0.436CS..Hα-helixtrans-56.3-43.8178.800000112.5P47 L48 Y54 Q55P47-A51 PolarHBondContact O-N 2.87Å; L48-A51 PolarHBondContact O-N 3.44Å; A51-Y54 PolarHBondContact O-N 3.45Å; A51-Q55 PolarHBondContact O-N 2.88Å; A51-Q55 VanDerWaalsContact O-N 3.08Å
52G60.3Low62.1Low40 Ų4081.6 Ų81.641%0.41246%0.461SS..Hα-helixtrans-64-42.8177.300000113.6L48 T49 L50 Y54 Q55L48-G52 PolarHBondContact O-N 3.29Å; T49-G52 PolarHBondContact O-N 3.45Å; L50-G52 VanDerWaalsContact C-N 3.31Å; L50-G52 PolarHBondContact O-N 2.81Å; G52-Y54 VanDerWaalsContact C-N 3.28Å; G52-Y54 PolarHBondContact O-N 3.43Å; G52-Q55 PolarHBondContact O-N 3.05Å
53R60.5Low61.3Low183 Ų18376.7 Ų76.769%0.69144%0.438SS*.Hα-helixtrans-65.2-31177.5-65.6-70.2-173.5-175.5-0.6112.8T49 L50T49-R53 WeakPolarHBondContact O-CG 3.37Å; T49-R53 PolarHBondContact O-N 3.41Å; T49-R53 VanDerWaalsContact O-N 3.12Å; L50-R53 PolarHBondContact O-N 3.04Å
54Y55.3Low60.7Low75 Ų7576 Ų7629%0.29444%0.443SS..Hα-helixtrans-85.1-26.4-179.1-66.4-59.4000113.6L50 A51 G52 E56 R57 A58 C66L50-Y54 HydrophobicContact CB-CD2 4.23Å; L50-Y54 HydrophobicContact CB-CE2 3.87Å; L50-Y54 HydrophobicContact CD2-CE2 3.98Å; L50-Y54 HydrophobicContact CG-CE2 3.7Å; L50-Y54 WeakPolarHBondContact O-CD2 3.36Å; L50-Y54 PolarHBondContact O-N 3.16Å; L50-Y54 VanDerWaalsContact O-N 3.08Å; A51-Y54 PolarHBondContact O-N 3.45Å; G52-Y54 VanDerWaalsContact C-N 3.28Å; G52-Y54 PolarHBondContact O-N 3.43Å; Y54-E56 PolarHBondContact O-N 3.07Å; Y54-R57 CarbonylContact O-C 3.24Å; Y54-R57 WeakPolarHBondContact O-CA 3.43Å; Y54-R57 PolarHBondContact O-N 2.89Å; Y54-A58 PolarHBondContact O-N 3.32Å; Y54-A58 VanDerWaalsContact O-N 3.15Å; Y54-C66 WeakPolarHBondContact CE2-SG 3.18Å
55Q54Low60.5Low125 Ų12579.7 Ų79.758%0.58447%0.469SS*.Hα-helixtrans-55.2-37166.7-103-177.8-82.500111.2A51 G52 R57 A58A51-Q55 PolarHBondContact O-N 2.88Å; A51-Q55 VanDerWaalsContact O-N 3.08Å; G52-Q55 PolarHBondContact O-N 3.05Å; Q55-R57 PolarHBondContact O-N 3.25Å; Q55-A58 WeakPolarHBondContact O-CB 3.2Å; Q55-A58 PolarHBondContact O-N 3.1Å; Q55-A58 VanDerWaalsContact O-N 3.09Å
56E52.4Low60.6Low158 Ų15879.1 Ų79.174%0.73847%0.465SS*.THydrogen-bonded Turntrans-68.9-21.3176.5-159.6157.8-158.700113.2Y54Y54-E56 PolarHBondContact O-N 3.07Å
57R50Low60.7Low172 Ų17279.9 Ų79.965%0.64946%0.464SS*.THydrogen-bonded Turntrans-93.72.6172.5-69.2-175.4175.5-165.5-0.8113.8Y54 Q55 S59 T60Y54-R57 CarbonylContact O-C 3.24Å; Y54-R57 WeakPolarHBondContact O-CA 3.43Å; Y54-R57 PolarHBondContact O-N 2.89Å; Q55-R57 PolarHBondContact O-N 3.25Å; R57-S59 PolarHBondContact O-N 3.41Å; R57-T60 PolarHBondContact O-N 2.87Å; R57-T60 VanDerWaalsContact O-N 3.11Å; R57-T60 PolarHBondContact O-OG1 3.15Å
58A51.3Low61.5Low61 Ų6184.8 Ų84.850%0.50449%0.49SS..THydrogen-bonded Turntrans-64.3-1.3-17400000115Y54 Q55 T60 A63Y54-A58 PolarHBondContact O-N 3.32Å; Y54-A58 VanDerWaalsContact O-N 3.15Å; Q55-A58 WeakPolarHBondContact O-CB 3.2Å; Q55-A58 PolarHBondContact O-N 3.1Å; Q55-A58 VanDerWaalsContact O-N 3.09Å; A58-T60 PolarHBondContact O-N 3.38Å; A58-T60 VanDerWaalsContact O-N 3.15Å; A58-A63 HydrophobicContact CB-CB 4.31Å
59S51.8Low62.2Low117 Ų11788.3 Ų88.382%0.81850%0.504SS*.THydrogen-bonded Turntrans-64.6-7.4164.858.40000113.6R57R57-S59 PolarHBondContact O-N 3.41Å
60T54.1Low62.9Low83 Ų8385 Ų8551%0.50948%0.484SS..SBendtrans-125.1122.4174.648.40000111.3R57 A58 S62 A63R57-T60 PolarHBondContact O-N 2.87Å; R57-T60 VanDerWaalsContact O-N 3.11Å; R57-T60 PolarHBondContact O-OG1 3.15Å; A58-T60 PolarHBondContact O-N 3.38Å; A58-T60 VanDerWaalsContact O-N 3.15Å; T60-S62 PolarHBondContact O-N 2.95Å; T60-A63 PolarHBondContact O-N 3.46Å
61G57.1Low63.6Low78 Ų7886.8 Ų86.880%0.80449%0.494SS*.THydrogen-bonded Turntrans-56.4-4.2-173.300000117.3A63G61-A63 PolarHBondContact O-N 3.43Å
62S59.2Low65Low90 Ų9092.8 Ų92.863%0.62952%0.515SS*.Hα-helixtrans-67.3-22.3167.3-57.80000113.1T60 A64 S65T60-S62 PolarHBondContact O-N 2.95Å; S62-A64 PolarHBondContact O-N 3.27Å; S62-S65 PolarHBondContact O-N 3.24Å; S62-S65 PolarHBondContact O-OG 3.33Å
63A61.1Low66.2Low15 Ų1594.4 Ų94.412%0.12451%0.514CS..Hα-helixtrans-64.4-36.1-17700000113.7A58 T60 G61 S65 C66 Q67A58-A63 HydrophobicContact CB-CB 4.31Å; T60-A63 PolarHBondContact O-N 3.46Å; G61-A63 PolarHBondContact O-N 3.43Å; A63-S65 VanDerWaalsContact C-N 3.35Å; A63-S65 PolarHBondContact O-N 3.14Å; A63-C66 PolarHBondContact O-N 2.88Å; A63-Q67 PolarHBondContact O-N 3.42Å
64A66.7Low67.4Low61 Ų6186.8 Ų86.850%0.50449%0.488SS..Hα-helixtrans-58.6-45.3-179.900000111.9S62 C66 Q67 D68S62-A64 PolarHBondContact O-N 3.27Å; A64-C66 VanDerWaalsContact C-N 3.34Å; A64-C66 PolarHBondContact O-N 3.36Å; A64-Q67 PolarHBondContact O-N 3.11Å; A64-D68 PolarHBondContact O-N 2.96Å; A64-D68 VanDerWaalsContact O-N 3.12Å
65S71.1Confident69Low82 Ų8285.6 Ų85.657%0.57349%0.493SS*.Hα-helixtrans-64.8-35.4178.367.50000113.5S62 A63 F69S62-S65 PolarHBondContact O-N 3.24Å; S62-S65 PolarHBondContact O-OG 3.33Å; A63-S65 VanDerWaalsContact C-N 3.35Å; A63-S65 PolarHBondContact O-N 3.14Å; S65-F69 PolarHBondContact O-N 2.76Å; S65-F69 VanDerWaalsContact O-N 3.11Å
66C72.5Confident70.7Confident34 Ų3481.5 Ų81.523%0.2349%0.485CS..Hα-helixtrans-73-33.7178.4-1710000111.8Y54 A63 A64 F69 A70Y54-C66 WeakPolarHBondContact CE2-SG 3.18Å; A63-C66 PolarHBondContact O-N 2.88Å; A64-C66 VanDerWaalsContact C-N 3.34Å; A64-C66 PolarHBondContact O-N 3.36Å; C66-F69 PolarHBondContact O-N 2.93Å; C66-A70 PolarHBondContact O-N 3.49Å
67Q73.9Confident72.4Confident86 Ų8674.9 Ų74.940%0.40245%0.454SS..Hα-helixtrans-64.2-46.9174.1-178.6179.8-3500110.8A63 A64 F69 A70 L71A63-Q67 PolarHBondContact O-N 3.42Å; A64-Q67 PolarHBondContact O-N 3.11Å; Q67-F69 VanDerWaalsContact C-N 3.27Å; Q67-F69 PolarHBondContact O-N 3.26Å; Q67-A70 PolarHBondContact O-N 3.44Å; Q67-A70 VanDerWaalsContact O-N 3.14Å; Q67-L71 HydrophobicContact CG-CD1 4.41Å; Q67-L71 WeakPolarHBondContact O-CG 3.24Å; Q67-L71 PolarHBondContact O-N 2.9Å
68D79.4Confident74.3Confident105 Ų10569.5 Ų69.556%0.56144%0.438SS*.Hα-helixtrans-60-39.7176.5-68.9-18.3000111.4A64 L71 F72A64-D68 PolarHBondContact O-N 2.96Å; A64-D68 VanDerWaalsContact O-N 3.12Å; D68-L71 PolarHBondContact O-N 2.75Å; D68-F72 WeakPolarHBondContact O-CB 3.19Å; D68-F72 PolarHBondContact O-N 2.96Å
69F81.5Confident76.2Confident127 Ų12770.7 Ų70.756%0.55744%0.439SS*.Hα-helixtrans-64.8-41.1174.8-177.6-107.1000113S65 C66 Q67 F72 L73S65-F69 PolarHBondContact O-N 2.76Å; S65-F69 VanDerWaalsContact O-N 3.11Å; C66-F69 PolarHBondContact O-N 2.93Å; Q67-F69 VanDerWaalsContact C-N 3.27Å; Q67-F69 PolarHBondContact O-N 3.26Å; F69-F72 PolarHBondContact O-N 3.45Å; F69-L73 WeakPolarHBondContact O-CB 3.4Å; F69-L73 PolarHBondContact O-N 3.39Å
70A82.2Confident78Confident5 Ų566.9 Ų66.94%0.04141%0.412CS..Hα-helixtrans-65.5-40176.700000112C66 Q67 L73 T74C66-A70 PolarHBondContact O-N 3.49Å; Q67-A70 PolarHBondContact O-N 3.44Å; Q67-A70 VanDerWaalsContact O-N 3.14Å; A70-L73 PolarHBondContact O-N 3.14Å; A70-T74 PolarHBondContact O-N 3.41Å; A70-T74 PolarHBondContact O-OG1 3.19Å
71L82.3Confident79.6Confident100 Ų10062.9 Ų62.952%0.52439%0.387SS..Hα-helixtrans-63.7-43.4173.5-71173.5000111.3Q67 D68 L73 T74 A75Q67-L71 HydrophobicContact CG-CD1 4.41Å; Q67-L71 WeakPolarHBondContact O-CG 3.24Å; Q67-L71 PolarHBondContact O-N 2.9Å; D68-L71 PolarHBondContact O-N 2.75Å; L71-L73 PolarHBondContact O-N 3.5Å; L71-T74 WeakPolarHBondContact O-CB 3.42Å; L71-T74 PolarHBondContact O-N 3.46Å; L71-A75 PolarHBondContact O-N 2.91Å
72F87.8Confident81.1Confident151 Ų15161.5 Ų61.566%0.66236%0.359SS*.Hα-helixtrans-60.1-45.3174.7-179.8-100.7000112D68 F69 T74 A75 G76D68-F72 WeakPolarHBondContact O-CB 3.19Å; D68-F72 PolarHBondContact O-N 2.96Å; F69-F72 PolarHBondContact O-N 3.45Å; F72-T74 VanDerWaalsContact C-N 3.33Å; F72-T74 PolarHBondContact O-N 2.93Å; F72-A75 PolarHBondContact O-N 2.85Å; F72-G76 PolarHBondContact O-N 2.96Å
73L86.4Confident82.6Confident75 Ų7559.8 Ų59.839%0.39335%0.347SS..Hα-helixtrans-62.5-40.3176.7-167.177.7000111.6P47 F69 A70 L71 G76 I77P47-L73 HydrophobicContact CB-CD2 4.48Å; F69-L73 WeakPolarHBondContact O-CB 3.4Å; F69-L73 PolarHBondContact O-N 3.39Å; A70-L73 PolarHBondContact O-N 3.14Å; L71-L73 PolarHBondContact O-N 3.5Å; L73-G76 PolarHBondContact O-N 2.92Å; L73-I77 HydrophobicContact CG-CD1 4.22Å; L73-I77 VanDerWaalsContact O-CG1 3.31Å; L73-I77 WeakPolarHBondContact O-CG1 3.39Å; L73-I77 PolarHBondContact O-N 3.49Å
74T85.3Confident83.8Confident23 Ų2361 Ų6114%0.14135%0.351CS..Hα-helixtrans-61.2-47.7176.2-51.90000111P47 A70 L71 F72 G76 I77 I78P47-T74 WeakPolarHBondContact CB-OG1 3.48Å; P47-T74 HydrophobicContact CG-CG2 4.35Å; P47-T74 VanDerWaalsContact CG-OG1 3.23Å; P47-T74 WeakPolarHBondContact CG-OG1 3.4Å; A70-T74 PolarHBondContact O-N 3.41Å; A70-T74 PolarHBondContact O-OG1 3.19Å; L71-T74 WeakPolarHBondContact O-CB 3.42Å; L71-T74 PolarHBondContact O-N 3.46Å; F72-T74 VanDerWaalsContact C-N 3.33Å; F72-T74 PolarHBondContact O-N 2.93Å; T74-G76 VanDerWaalsContact C-N 3.32Å; T74-G76 PolarHBondContact O-N 2.95Å; T74-I77 PolarHBondContact O-N 2.9Å; T74-I78 HydrophobicContact CG2-CD1 4.09Å; T74-I78 WeakPolarHBondContact O-CG1 3.44Å; T74-I78 PolarHBondContact O-N 3.37Å
75A88Confident84.5Confident50 Ų5058.1 Ų58.141%0.41333%0.328SS..Hα-helixtrans-60.9-4217600000111.4L71 F72 I77 I78 V79L71-A75 PolarHBondContact O-N 2.91Å; F72-A75 PolarHBondContact O-N 2.85Å; A75-I77 PolarHBondContact O-N 3.19Å; A75-I78 PolarHBondContact O-N 3.31Å; A75-V79 WeakPolarHBondContact O-CB 3.28Å; A75-V79 VanDerWaalsContact O-CG2 3.24Å; A75-V79 WeakPolarHBondContact O-CG2 3.18Å; A75-V79 PolarHBondContact O-N 3.08Å
76G89.6Confident85.1Confident39 Ų3957.1 Ų57.140%0.40232%0.318SS..Hα-helixtrans-60-44.1174.800000113F72 L73 T74 V79 S80F72-G76 PolarHBondContact O-N 2.96Å; L73-G76 PolarHBondContact O-N 2.92Å; T74-G76 VanDerWaalsContact C-N 3.32Å; T74-G76 PolarHBondContact O-N 2.95Å; G76-V79 PolarHBondContact O-N 3.44Å; G76-S80 VanDerWaalsContact O-CB 3.28Å; G76-S80 WeakPolarHBondContact O-CB 3.04Å; G76-S80 PolarHBondContact O-N 2.98Å; G76-S80 PolarHBondContact O-OG 3.3Å
77I88.4Confident85.6Confident19 Ų1959.9 Ų59.910%0.09733%0.334CS..Hα-helixtrans-61-49.1175.8-72.6164.9000110.4F40 L43 A44 P47 L73 T74 A75 S80 A81F40-I77 HydrophobicContact CB-CG2 4.19Å; F40-I77 HydrophobicContact CD1-CG2 4.11Å; L43-I77 HydrophobicContact CB-CD1 4.34Å; A44-I77 HydrophobicContact CB-CG2 4.46Å; P47-I77 HydrophobicContact CG-CD1 4.14Å; L73-I77 HydrophobicContact CG-CD1 4.22Å; L73-I77 VanDerWaalsContact O-CG1 3.31Å; L73-I77 WeakPolarHBondContact O-CG1 3.39Å; L73-I77 PolarHBondContact O-N 3.49Å; T74-I77 PolarHBondContact O-N 2.9Å; A75-I77 PolarHBondContact O-N 3.19Å; I77-S80 WeakPolarHBondContact CA-OG 3.31Å; I77-S80 PolarHBondContact O-N 3.04Å; I77-S80 PolarHBondContact O-OG 3.36Å; I77-A81 WeakPolarHBondContact O-CB 3.25Å; I77-A81 PolarHBondContact O-N 3.26Å
78I90Very high85.6Confident59 Ų5957.3 Ų57.330%0.30332%0.322SS..Hα-helixtrans-59.3-52.4178.5-67.1168.6000109.9T74 A75 S80 A81 F82 F114T74-I78 HydrophobicContact CG2-CD1 4.09Å; T74-I78 WeakPolarHBondContact O-CG1 3.44Å; T74-I78 PolarHBondContact O-N 3.37Å; A75-I78 PolarHBondContact O-N 3.31Å; I78-S80 VanDerWaalsContact C-N 3.27Å; I78-S80 PolarHBondContact O-N 3.4Å; I78-A81 WeakPolarHBondContact O-CB 3.26Å; I78-A81 PolarHBondContact O-N 2.84Å; I78-A81 VanDerWaalsContact O-N 3.14Å; I78-F82 HydrophobicContact CG2-CD2 3.75Å; I78-F82 HydrophobicContact CG2-CE2 3.7Å; I78-F82 WeakPolarHBondContact O-CD2 3.38Å; I78-F82 PolarHBondContact O-N 3.35Å; I78-F82 VanDerWaalsContact O-N 3.11Å; I78-F114 HydrophobicContact CB-CE1 4.48Å; I78-F114 HydrophobicContact CB-CZ 4.46Å; I78-F114 HydrophobicContact CG1-CD1 3.85Å; I78-F114 HydrophobicContact CG1-CE1 3.73Å; I78-F114 HydrophobicContact CG1-CG 4.42Å; I78-F114 HydrophobicContact CG1-CZ 4.19Å; I78-F114 HydrophobicContact CG2-CD2 4.38Å; I78-F114 HydrophobicContact CG2-CE2 4.38Å
79V91.2Very high85.2Confident86 Ų8652.8 Ų52.852%0.52130%0.3SS..Hα-helixtrans-59.1-39.4179.7171.70000111.3A75 G76 F82 S83A75-V79 WeakPolarHBondContact O-CB 3.28Å; A75-V79 VanDerWaalsContact O-CG2 3.24Å; A75-V79 WeakPolarHBondContact O-CG2 3.18Å; A75-V79 PolarHBondContact O-N 3.08Å; G76-V79 PolarHBondContact O-N 3.44Å; V79-F82 PolarHBondContact O-N 3.43Å; V79-S83 VanDerWaalsContact O-CB 3.25Å; V79-S83 WeakPolarHBondContact O-CB 3.21Å; V79-S83 PolarHBondContact O-N 3Å; V79-S83 PolarHBondContact O-OG 3.43Å
80S89.9Confident84.6Confident36 Ų3656.2 Ų56.225%0.25231%0.309SS..Hα-helixtrans-67.7-37.5177.968.90000113F40 G76 I77 I78 F82 S83 L84F40-S80 WeakPolarHBondContact CD1-OG 3.38Å; F40-S80 WeakPolarHBondContact CE1-OG 3.25Å; F40-S80 WeakPolarHBondContact CZ-OG 3.23Å; G76-S80 VanDerWaalsContact O-CB 3.28Å; G76-S80 WeakPolarHBondContact O-CB 3.04Å; G76-S80 PolarHBondContact O-N 2.98Å; G76-S80 PolarHBondContact O-OG 3.3Å; I77-S80 WeakPolarHBondContact CA-OG 3.31Å; I77-S80 PolarHBondContact O-N 3.04Å; I77-S80 PolarHBondContact O-OG 3.36Å; I78-S80 VanDerWaalsContact C-N 3.27Å; I78-S80 PolarHBondContact O-N 3.4Å; S80-F82 VanDerWaalsContact C-N 3.3Å; S80-F82 PolarHBondContact O-N 3.42Å; S80-S83 PolarHBondContact O-N 2.9Å; S80-L84 WeakPolarHBondContact O-CB 3.4Å; S80-L84 PolarHBondContact O-N 3.47Å
81A88.2Confident83.8Confident0 Ų059.4 Ų59.40%033%0.331CS..Hα-helixtrans-65.3-33.4175.800000112.5V37 F40 I77 I78 P85 F114V37-A81 HydrophobicContact CG1-CB 4.33Å; F40-A81 HydrophobicContact CB-CB 3.81Å; F40-A81 HydrophobicContact CD2-CB 4.14Å; F40-A81 HydrophobicContact CG-CB 4.04Å; I77-A81 WeakPolarHBondContact O-CB 3.25Å; I77-A81 PolarHBondContact O-N 3.26Å; I78-A81 WeakPolarHBondContact O-CB 3.26Å; I78-A81 PolarHBondContact O-N 2.84Å; I78-A81 VanDerWaalsContact O-N 3.14Å; A81-P85 WeakPolarHBondContact O-CD 3.46Å; A81-P85 WeakPolarHBondContact O-CG 3.03Å; A81-F114 HydrophobicContact CB-CE2 3.62Å; A81-F114 HydrophobicContact CB-CZ 3.46Å; A81-F114 VanDerWaalsContact CB-CZ 3.46Å
82F89.2Confident82.4Confident49 Ų4957.5 Ų57.522%0.21533%0.325CS..Hα-helixtrans-79.5-36.6173.2-78.9-72.3000113.2I78 V79 S80 P85 V86 L107 N110 I111 F114I78-F82 HydrophobicContact CG2-CD2 3.75Å; I78-F82 HydrophobicContact CG2-CE2 3.7Å; I78-F82 WeakPolarHBondContact O-CD2 3.38Å; I78-F82 PolarHBondContact O-N 3.35Å; I78-F82 VanDerWaalsContact O-N 3.11Å; V79-F82 PolarHBondContact O-N 3.43Å; S80-F82 VanDerWaalsContact C-N 3.3Å; S80-F82 PolarHBondContact O-N 3.42Å; F82-P85 WeakPolarHBondContact O-CD 3.19Å; F82-P85 WeakPolarHBondContact O-CG 3.33Å; F82-V86 WeakPolarHBondContact O-CG2 3.33Å; F82-L107 HydrophobicContact CD1-CD1 3.49Å; F82-L107 VanDerWaalsContact CD1-CD1 3.49Å; F82-L107 HydrophobicContact CD1-CG 4.25Å; F82-L107 HydrophobicContact CE1-CD1 4.01Å; F82-L107 HydrophobicContact CE1-CG 4.27Å; F82-N110 HydrophobicContact CD1-CB 4.08Å; F82-N110 HydrophobicContact CE1-CB 3.48Å; F82-N110 VanDerWaalsContact CE1-CB 3.48Å; F82-N110 HydrophobicContact CE2-CB 4.41Å; F82-N110 HydrophobicContact CZ-CB 3.67Å; F82-I111 HydrophobicContact CE1-CG1 3.8Å; F82-I111 HydrophobicContact CZ-CG1 3.82Å; F82-F114 HydrophobicContact CD2-CD2 4.42Å; F82-F114 HydrophobicContact CD2-CE2 4.24Å; F82-F114 AromaticContact CE2-CD2 3.55Å; F82-F114 HydrophobicContact CE2-CD2 3.55Å; F82-F114 AromaticContact CE2-CE2 3.81Å; F82-F114 HydrophobicContact CE2-CE2 3.81Å; F82-F114 AromaticContact CZ-CD2 3.96Å; F82-F114 HydrophobicContact CZ-CD2 3.96Å; F82-F114 HydrophobicContact CZ-CE2 4.42Å
83S90Very high81Confident54 Ų5454.9 Ų54.938%0.37833%0.331SS..Hα-helixtrans-72.7-37-177.2-61.30000112.1V79 S80 V86 V87V79-S83 VanDerWaalsContact O-CB 3.25Å; V79-S83 WeakPolarHBondContact O-CB 3.21Å; V79-S83 PolarHBondContact O-N 3Å; V79-S83 PolarHBondContact O-OG 3.43Å; S80-S83 PolarHBondContact O-N 2.9Å; S83-V86 WeakPolarHBondContact O-CB 3.47Å; S83-V86 PolarHBondContact O-N 2.83Å; S83-V87 VanDerWaalsContact O-CG2 3.3Å; S83-V87 WeakPolarHBondContact O-CG2 3.12Å; S83-V87 PolarHBondContact O-N 3.18Å
84L85.7Confident79.5Confident40 Ų4059.2 Ų59.221%0.20935%0.354CS..Hα-helixtrans-58.2-52.7-177.6-170.2132.3000114F36 F40 S80 V86 V87 L88F36-L84 HydrophobicContact CB-CD2 4.04Å; F36-L84 HydrophobicContact CD1-CD1 3.32Å; F36-L84 HydrophobicContact CD1-CD2 3.81Å; F36-L84 HydrophobicContact CD1-CG 4.21Å; F36-L84 HydrophobicContact CE1-CD1 3.5Å; F36-L84 VanDerWaalsContact CE1-CD1 3.5Å; F36-L84 HydrophobicContact CG-CD1 4.32Å; F36-L84 HydrophobicContact CG-CD2 4.29Å; F40-L84 HydrophobicContact CE2-CD1 4.17Å; S80-L84 WeakPolarHBondContact O-CB 3.4Å; S80-L84 PolarHBondContact O-N 3.47Å; L84-V86 PolarHBondContact O-N 3.47Å; L84-V87 PolarHBondContact O-N 2.99Å; L84-L88 HydrophobicContact CD2-CD1 3.31Å; L84-L88 HydrophobicContact CG-CD1 3.77Å; L84-L88 WeakPolarHBondContact O-CD1 3.37Å; L84-L88 PolarHBondContact O-N 3.27Å
85P81.7Confident78.2Confident1 Ų161.2 Ų61.21%0.00637%0.373CS..Hα-helixtrans-61.4-33.3176.523-32.7000112.6A81 F82 A89A81-P85 WeakPolarHBondContact O-CD 3.46Å; A81-P85 WeakPolarHBondContact O-CG 3.03Å; F82-P85 WeakPolarHBondContact O-CD 3.19Å; F82-P85 WeakPolarHBondContact O-CG 3.33Å; P85-A89 WeakPolarHBondContact O-CB 3.29Å; P85-A89 PolarHBondContact O-N 3.47Å
86V83.8Confident76.6Confident60 Ų6062.5 Ų62.536%0.36438%0.377SS..Hα-helixtrans-68.4-39.9176.7177.10000111.5F82 S83 L84 A89 R90F82-V86 WeakPolarHBondContact O-CG2 3.33Å; S83-V86 WeakPolarHBondContact O-CB 3.47Å; S83-V86 PolarHBondContact O-N 2.83Å; L84-V86 PolarHBondContact O-N 3.47Å; V86-A89 PolarHBondContact O-N 3.23Å; V86-R90 PolarHBondContact O-N 3.25Å
87V82.6Confident75.2Confident93 Ų9361.2 Ų61.256%0.56436%0.363SS*.Hα-helixtrans-69.7-40.8176.7173.80000111.1S83 L84 A89 R90 S91S83-V87 VanDerWaalsContact O-CG2 3.3Å; S83-V87 WeakPolarHBondContact O-CG2 3.12Å; S83-V87 PolarHBondContact O-N 3.18Å; L84-V87 PolarHBondContact O-N 2.99Å; V87-A89 VanDerWaalsContact C-N 3.31Å; V87-A89 PolarHBondContact O-N 3.4Å; V87-R90 PolarHBondContact O-N 2.96Å; V87-R90 VanDerWaalsContact O-N 3.07Å; V87-S91 PolarHBondContact O-N 3.43Å
88L73.9Confident74Confident31 Ų3160.4 Ų60.416%0.16236%0.359CS..Hα-helixtrans-66.5-29.2175.2-84.3146.2000113.3Y33 L84 R90 A97Y33-L88 HydrophobicContact CD1-CD2 4.11Å; Y33-L88 HydrophobicContact CD2-CD2 4.26Å; Y33-L88 HydrophobicContact CG-CD2 3.88Å; L84-L88 HydrophobicContact CD2-CD1 3.31Å; L84-L88 HydrophobicContact CG-CD1 3.77Å; L84-L88 WeakPolarHBondContact O-CD1 3.37Å; L84-L88 PolarHBondContact O-N 3.27Å; L88-R90 PolarHBondContact O-N 2.87Å; L88-A97 HydrophobicContact CD2-CB 4.11Å
89A71.3Confident73.3Confident11 Ų1161.6 Ų61.69%0.09136%0.363CS..Hα-helixtrans-69.2-25.1170.700000113P85 V86 V87 I98 W100 C103P85-A89 WeakPolarHBondContact O-CB 3.29Å; P85-A89 PolarHBondContact O-N 3.47Å; V86-A89 PolarHBondContact O-N 3.23Å; V87-A89 VanDerWaalsContact C-N 3.31Å; V87-A89 PolarHBondContact O-N 3.4Å; A89-I98 HydrophobicContact CB-CG2 3.74Å; A89-W100 HydrophobicContact CB-CE3 4.43Å; A89-W100 HydrophobicContact CB-CZ3 4.41Å; A89-C103 HydrophobicContact CB-CB 4.06Å
90R69.7Low72.5Confident199 Ų19966.3 Ų66.375%0.75137%0.371SS*.Hα-helixtrans-92.1-28.4179.5-171.4177.4-70.8-174.1-2113.2V86 V87 L88V86-R90 PolarHBondContact O-N 3.25Å; V87-R90 PolarHBondContact O-N 2.96Å; V87-R90 VanDerWaalsContact O-N 3.07Å; L88-R90 PolarHBondContact O-N 2.87Å
91S64.5Low72.1Confident72 Ų7266.4 Ų66.450%0.50338%0.378SS..SBendtrans-133.1130.1-173.4-170.70000111V87V87-S91 PolarHBondContact O-N 3.43Å
92P54.3Low71.8Confident60 Ų6066.4 Ų66.439%0.3938%0.378SS..  cis-96.6137.614.418.5-5.2000114.9N94 A95P92-N94 PolarHBondContact O-N 3.45Å; P92-N94 VanDerWaalsContact O-N 3.08Å; P92-A95 VanDerWaalsContact CD-O 3.27Å; P92-A95 WeakPolarHBondContact CD-O 3.11Å; P92-A95 WeakPolarHBondContact CG-O 3.33Å; P92-A95 CarbonylContact O-C 3.59Å; P92-A95 VanDerWaalsContact O-C 3.24Å; P92-A95 PolarHBondContact O-N 3.35Å; P92-A95 VanDerWaalsContact O-N 3.1Å
93A56.4Low71.5Confident96 Ų9664.5 Ų64.579%0.79337%0.37SS*.THydrogen-bonded Turntrans-58.2-21.2-179.100000115.3
94N56.4Low71.3Confident166 Ų16664 Ų6489%0.88837%0.373SS*.THydrogen-bonded Turntrans-95.7-15.2-179.7-61.8-35.9000113.5P92P92-N94 PolarHBondContact O-N 3.45Å; P92-N94 VanDerWaalsContact O-N 3.08Å
95A56.7Low71.5Confident65 Ų6565.3 Ų65.354%0.53738%0.378SS..SBendtrans-157.981.4-178.500000108.3P92 A97P92-A95 VanDerWaalsContact CD-O 3.27Å; P92-A95 WeakPolarHBondContact CD-O 3.11Å; P92-A95 WeakPolarHBondContact CG-O 3.33Å; P92-A95 CarbonylContact O-C 3.59Å; P92-A95 VanDerWaalsContact O-C 3.24Å; P92-A95 PolarHBondContact O-N 3.35Å; P92-A95 VanDerWaalsContact O-N 3.1Å; A95-A97 PolarHBondContact O-N 3.48Å
96P55.3Low71.8Confident76 Ų7665.3 Ų65.349%0.49438%0.377SS..  trans-54.2113.5-175.717.7-28.9000109.7I98P96-I98 PolarHBondContact O-N 2.66Å
97A60Low72.1Confident12 Ų1265.5 Ų65.510%0.09938%0.376CS..SBendtrans-62.6-27.9-179.100000111.3N31 Y33 L88 A95N31-A97 VanDerWaalsContact CB-O 3.23Å; N31-A97 WeakPolarHBondContact CB-O 3.34Å; Y33-A97 HydrophobicContact CD2-CB 3.69Å; Y33-A97 HydrophobicContact CE2-CB 3.83Å; L88-A97 HydrophobicContact CD2-CB 4.11Å; A95-A97 PolarHBondContact O-N 3.48Å
98I64.1Low72.6Confident2 Ų262.9 Ų62.91%0.0136%0.364CS..SBendtrans-136.1134.2177.5-124.2178.4000109.6P34 A89 P96 A102 C103P34-I98 HydrophobicContact CB-CD1 3.79Å; P34-I98 HydrophobicContact CG-CD1 3.8Å; A89-I98 HydrophobicContact CB-CG2 3.74Å; P96-I98 PolarHBondContact O-N 2.66Å; I98-A102 HydrophobicContact CD1-CB 4.06Å; I98-A102 HydrophobicContact CG1-CB 3.9Å; I98-C103 HydrophobicContact CG2-CB 4.19Å
99H74.2Confident73.4Confident84 Ų8461.4 Ų61.439%0.38936%0.356SS..  trans-75.1149.4167-74.675.9000109.6Y30 G101 A102 C103Y30-H99 HydrophobicContact CD1-CB 4.42Å; Y30-H99 HydrophobicContact CE1-CB 3.6Å; H99-G101 PolarHBondContact O-N 2.98Å; H99-A102 PolarHBondContact O-N 3.49Å; H99-C103 PolarHBondContact O-N 2.85Å
100W75.4Confident74.4Confident186 Ų18660.9 Ų60.971%0.70535%0.352SS*.Hα-helixtrans-50.2-32.6176.8-79.3106.1000113.5A89 C103 G104A89-W100 HydrophobicContact CB-CE3 4.43Å; A89-W100 HydrophobicContact CB-CZ3 4.41Å; W100-C103 HydrophobicContact CE3-CB 4.47Å; W100-C103 WeakPolarHBondContact O-CB 3.42Å; W100-C103 PolarHBondContact O-N 3.48Å; W100-G104 PolarHBondContact O-N 2.88Å
101G80.4Confident75.5Confident37 Ų3755.4 Ų55.438%0.38134%0.337SS..Hα-helixtrans-59.9-43.7174.600000114H99 G104 F105H99-G101 PolarHBondContact O-N 2.98Å; G101-G104 PolarHBondContact O-N 3.48Å; G101-F105 VanDerWaalsContact O-CD2 3.22Å; G101-F105 WeakPolarHBondContact O-CD2 3.27Å; G101-F105 PolarHBondContact O-N 3.48Å; G101-F105 VanDerWaalsContact O-N 3.08Å
102A81.4Confident76.9Confident0 Ų053.7 Ų53.70%032%0.323CS..Hα-helixtrans-75-30.9176.200000111.9G24 Y30 I98 H99 G104 F105 T106G24-A102 VanDerWaalsContact O-CB 3.29Å; G24-A102 WeakPolarHBondContact O-CB 3.38Å; Y30-A102 HydrophobicContact CD1-CB 3.13Å; Y30-A102 HydrophobicContact CE1-CB 3.08Å; Y30-A102 HydrophobicContact CG-CB 4.29Å; I98-A102 HydrophobicContact CD1-CB 4.06Å; I98-A102 HydrophobicContact CG1-CB 3.9Å; H99-A102 PolarHBondContact O-N 3.49Å; A102-G104 PolarHBondContact O-N 2.91Å; A102-F105 PolarHBondContact O-N 3.34Å; A102-T106 VanDerWaalsContact O-CB 3.27Å; A102-T106 WeakPolarHBondContact O-CB 3.36Å; A102-T106 WeakPolarHBondContact O-CG2 3.49Å; A102-T106 PolarHBondContact O-N 3.14Å; A102-T106 PolarHBondContact O-OG1 3.29Å
103C83.8Confident78.6Confident9 Ų951.4 Ų51.46%0.06131%0.309CS..Hα-helixtrans-55.5-42.3168.8-170.20000110.2A89 I98 H99 W100 T106 L107A89-C103 HydrophobicContact CB-CB 4.06Å; I98-C103 HydrophobicContact CG2-CB 4.19Å; H99-C103 PolarHBondContact O-N 2.85Å; W100-C103 HydrophobicContact CE3-CB 4.47Å; W100-C103 WeakPolarHBondContact O-CB 3.42Å; W100-C103 PolarHBondContact O-N 3.48Å; C103-T106 WeakPolarHBondContact CA-OG1 2.88Å; C103-T106 PolarHBondContact O-OG1 3.08Å; C103-L107 VanDerWaalsContact O-CB 3.25Å; C103-L107 WeakPolarHBondContact O-CB 3.31Å; C103-L107 PolarHBondContact O-N 3.45Å
104G86.9Confident80.2Confident43 Ų4347.9 Ų47.944%0.44328%0.275SS..Hα-helixtrans-62.6-50.517500000113.7W100 G101 A102 T106 L107 A108W100-G104 PolarHBondContact O-N 2.88Å; G101-G104 PolarHBondContact O-N 3.48Å; A102-G104 PolarHBondContact O-N 2.91Å; G104-T106 VanDerWaalsContact C-N 3.33Å; G104-T106 PolarHBondContact O-N 3.15Å; G104-L107 PolarHBondContact O-N 3.34Å; G104-A108 PolarHBondContact O-N 3.12Å
105F88.6Confident81.9Confident69 Ų6945.3 Ų45.330%0.30326%0.261SS..Hα-helixtrans-62.3-39.4178.8-78.6-66.1000112.9F20 L23 G101 A102 A108 G109F20-F105 AromaticContact CD1-CD1 3.76Å; F20-F105 HydrophobicContact CD1-CD1 3.76Å; F20-F105 HydrophobicContact CD1-CE1 4.19Å; F20-F105 HydrophobicContact CE1-CD1 4.38Å; F20-F105 HydrophobicContact CE1-CE1 4.43Å; L23-F105 HydrophobicContact CD2-CD1 4.3Å; L23-F105 HydrophobicContact CD2-CE1 3.82Å; L23-F105 HydrophobicContact CD2-CE2 4.45Å; L23-F105 HydrophobicContact CD2-CZ 3.9Å; G101-F105 VanDerWaalsContact O-CD2 3.22Å; G101-F105 WeakPolarHBondContact O-CD2 3.27Å; G101-F105 PolarHBondContact O-N 3.48Å; G101-F105 VanDerWaalsContact O-N 3.08Å; A102-F105 PolarHBondContact O-N 3.34Å; F105-A108 PolarHBondContact O-N 3.08Å; F105-G109 PolarHBondContact O-N 3.21Å
106T88.1Confident83.5Confident0 Ų043.2 Ų43.20%024%0.242CC..Hα-helixtrans-72.2-36.8-18056.80000111.2L21 P34 A102 C103 G104 G109 N110L21-T106 HydrophobicContact CD1-CG2 4.19Å; P34-T106 HydrophobicContact CB-CG2 3.28Å; P34-T106 HydrophobicContact CG-CG2 3.99Å; A102-T106 VanDerWaalsContact O-CB 3.27Å; A102-T106 WeakPolarHBondContact O-CB 3.36Å; A102-T106 WeakPolarHBondContact O-CG2 3.49Å; A102-T106 PolarHBondContact O-N 3.14Å; A102-T106 PolarHBondContact O-OG1 3.29Å; C103-T106 WeakPolarHBondContact CA-OG1 2.88Å; C103-T106 PolarHBondContact O-OG1 3.08Å; G104-T106 VanDerWaalsContact C-N 3.33Å; G104-T106 PolarHBondContact O-N 3.15Å; T106-G109 PolarHBondContact O-N 2.94Å; T106-N110 WeakPolarHBondContact O-CB 3.38Å; T106-N110 PolarHBondContact O-N 3.36Å; T106-N110 PolarHBondContact O-ND2 3.32Å
107L90.2Very high85.1Confident65 Ų6541.3 Ų41.334%0.3423%0.227SC..Hα-helixtrans-62.2-45.6171.7-160.181.6000111.4F82 C103 G104 N110 I111F82-L107 HydrophobicContact CD1-CD1 3.49Å; F82-L107 VanDerWaalsContact CD1-CD1 3.49Å; F82-L107 HydrophobicContact CD1-CG 4.25Å; F82-L107 HydrophobicContact CE1-CD1 4.01Å; F82-L107 HydrophobicContact CE1-CG 4.27Å; C103-L107 VanDerWaalsContact O-CB 3.25Å; C103-L107 WeakPolarHBondContact O-CB 3.31Å; C103-L107 PolarHBondContact O-N 3.45Å; G104-L107 PolarHBondContact O-N 3.34Å; L107-N110 WeakPolarHBondContact O-CB 3.32Å; L107-N110 PolarHBondContact O-N 3.41Å; L107-I111 WeakPolarHBondContact O-CG1 3.41Å; L107-I111 PolarHBondContact O-N 2.96Å
108A92.9Very high86.3Confident37 Ų3743.4 Ų43.431%0.30624%0.244SC..Hα-helixtrans-62.2-44.7176.200000111.6G104 F105 N110 I111 V112G104-A108 PolarHBondContact O-N 3.12Å; F105-A108 PolarHBondContact O-N 3.08Å; A108-N110 VanDerWaalsContact C-N 3.34Å; A108-N110 PolarHBondContact O-N 2.85Å; A108-I111 PolarHBondContact O-N 3.42Å; A108-V112 WeakPolarHBondContact O-CG2 3.38Å; A108-V112 PolarHBondContact O-N 3.36Å; A108-V112 VanDerWaalsContact O-N 3.1Å
109G91.8Very high87.5Confident0 Ų045.1 Ų45.10%026%0.259CS..Hα-helixtrans-61.1-3917500000113.2F105 T106 V112 S113F105-G109 PolarHBondContact O-N 3.21Å; T106-G109 PolarHBondContact O-N 2.94Å; G109-V112 PolarHBondContact O-N 3.12Å; G109-S113 WeakPolarHBondContact O-CB 3.38Å; G109-S113 PolarHBondContact O-N 2.78Å; G109-S113 PolarHBondContact O-OG 3.36Å
110N91.7Very high88.1Confident0 Ų045.4 Ų45.40%026%0.257CS..Hα-helixtrans-60.2-47.5173-88.7-76.1000111.9V37 Y41 F82 T106 L107 A108 V112 S113 F114V37-N110 WeakPolarHBondContact CG1-ND2 3.46Å; V37-N110 WeakPolarHBondContact CG1-OD1 3.35Å; Y41-N110 WeakPolarHBondContact CE1-OD1 3.32Å; Y41-N110 VanDerWaalsContact OH-CA 3.24Å; Y41-N110 WeakPolarHBondContact OH-CA 3.3Å; Y41-N110 VanDerWaalsContact OH-CG 3.31Å; Y41-N110 PolarHBondContact OH-N 3.32Å; Y41-N110 PolarHBondContact OH-OD1 3.36Å; F82-N110 HydrophobicContact CD1-CB 4.08Å; F82-N110 HydrophobicContact CE1-CB 3.48Å; F82-N110 VanDerWaalsContact CE1-CB 3.48Å; F82-N110 HydrophobicContact CE2-CB 4.41Å; F82-N110 HydrophobicContact CZ-CB 3.67Å; T106-N110 WeakPolarHBondContact O-CB 3.38Å; T106-N110 PolarHBondContact O-N 3.36Å; T106-N110 PolarHBondContact O-ND2 3.32Å; L107-N110 WeakPolarHBondContact O-CB 3.32Å; L107-N110 PolarHBondContact O-N 3.41Å; A108-N110 VanDerWaalsContact C-N 3.34Å; A108-N110 PolarHBondContact O-N 2.85Å; N110-V112 PolarHBondContact O-N 3.47Å; N110-S113 WeakPolarHBondContact CA-OG 3.5Å; N110-S113 PolarHBondContact O-N 3.38Å; N110-S113 PolarHBondContact O-OG 3.44Å; N110-F114 HydrophobicContact CB-CD2 4.28Å; N110-F114 HydrophobicContact CB-CE2 4.3Å; N110-F114 WeakPolarHBondContact O-CB 3.4Å; N110-F114 WeakPolarHBondContact O-CD2 3.42Å; N110-F114 PolarHBondContact O-N 2.95Å; N110-F114 WeakPolarHBondContact OD1-CE2 3.32Å
111I92.6Very high88.5Confident84 Ų8438.1 Ų38.143%0.43123%0.23SC..Hα-helixtrans-58.9-49.7178.8-65.5166.4000110.3F82 L107 A108 S113 L115F82-I111 HydrophobicContact CE1-CG1 3.8Å; F82-I111 HydrophobicContact CZ-CG1 3.82Å; L107-I111 WeakPolarHBondContact O-CG1 3.41Å; L107-I111 PolarHBondContact O-N 2.96Å; A108-I111 PolarHBondContact O-N 3.42Å; I111-S113 PolarHBondContact O-N 3.47Å; I111-L115 HydrophobicContact CG2-CD1 3.99Å; I111-L115 HydrophobicContact CG2-CG 4.48Å; I111-L115 WeakPolarHBondContact O-CB 3.36Å; I111-L115 VanDerWaalsContact O-CG 3.27Å; I111-L115 WeakPolarHBondContact O-CG 3.18Å; I111-L115 PolarHBondContact O-N 3.41Å
112V93.8Very high88.6Confident36 Ų3643.4 Ų43.422%0.21824%0.24CC..Hα-helixtrans-64-44.2-178178.20000111.3A13 A108 G109 N110 L115 T116A13-V112 HydrophobicContact CB-CG1 4.44Å; A13-V112 WeakPolarHBondContact O-CG1 3.34Å; A108-V112 WeakPolarHBondContact O-CG2 3.38Å; A108-V112 PolarHBondContact O-N 3.36Å; A108-V112 VanDerWaalsContact O-N 3.1Å; G109-V112 PolarHBondContact O-N 3.12Å; N110-V112 PolarHBondContact O-N 3.47Å; V112-L115 PolarHBondContact O-N 2.97Å; V112-T116 WeakPolarHBondContact O-CB 3.38Å; V112-T116 PolarHBondContact O-N 2.92Å; V112-T116 PolarHBondContact O-OG1 3.31Å
113S91.2Very high88.6Confident12 Ų1245.1 Ų45.18%0.08425%0.249CC..Hα-helixtrans-67.5-43.7-179.953.70000112.7Y41 G109 N110 I111 L115 T116 I117Y41-S113 WeakPolarHBondContact CE1-OG 3.22Å; Y41-S113 PolarHBondContact OH-OG 3.34Å; Y41-S113 VanDerWaalsContact OH-OG 3.04Å; G109-S113 WeakPolarHBondContact O-CB 3.38Å; G109-S113 PolarHBondContact O-N 2.78Å; G109-S113 PolarHBondContact O-OG 3.36Å; N110-S113 WeakPolarHBondContact CA-OG 3.5Å; N110-S113 PolarHBondContact O-N 3.38Å; N110-S113 PolarHBondContact O-OG 3.44Å; I111-S113 PolarHBondContact O-N 3.47Å; S113-L115 PolarHBondContact O-N 2.94Å; S113-T116 WeakPolarHBondContact O-CB 3.44Å; S113-T116 PolarHBondContact O-N 3.34Å; S113-T116 VanDerWaalsContact O-N 3.14Å; S113-I117 VanDerWaalsContact O-CG1 3.29Å; S113-I117 WeakPolarHBondContact O-CG1 3.35Å; S113-I117 PolarHBondContact O-N 3.01Å
114F89.8Confident88.3Confident22 Ų2248 Ų4810%0.09626%0.261CS..Hα-helixtrans-65.4-38.7175.6-76.8-59000112.4Y41 A44 I78 A81 F82 N110 T116 I117 A118Y41-F114 HydrophobicContact CD1-CE1 4.3Å; Y41-F114 HydrophobicContact CD1-CZ 4.08Å; Y41-F114 HydrophobicContact CE1-CD2 4.49Å; Y41-F114 AromaticContact CE1-CE2 3.99Å; Y41-F114 HydrophobicContact CE1-CE2 3.99Å; Y41-F114 HydrophobicContact CE1-CZ 4.02Å; A44-F114 HydrophobicContact CB-CE1 4.29Å; I78-F114 HydrophobicContact CB-CE1 4.48Å; I78-F114 HydrophobicContact CB-CZ 4.46Å; I78-F114 HydrophobicContact CG1-CD1 3.85Å; I78-F114 HydrophobicContact CG1-CE1 3.73Å; I78-F114 HydrophobicContact CG1-CG 4.42Å; I78-F114 HydrophobicContact CG1-CZ 4.19Å; I78-F114 HydrophobicContact CG2-CD2 4.38Å; I78-F114 HydrophobicContact CG2-CE2 4.38Å; A81-F114 HydrophobicContact CB-CE2 3.62Å; A81-F114 HydrophobicContact CB-CZ 3.46Å; A81-F114 VanDerWaalsContact CB-CZ 3.46Å; F82-F114 HydrophobicContact CD2-CD2 4.42Å; F82-F114 HydrophobicContact CD2-CE2 4.24Å; F82-F114 AromaticContact CE2-CD2 3.55Å; F82-F114 HydrophobicContact CE2-CD2 3.55Å; F82-F114 AromaticContact CE2-CE2 3.81Å; F82-F114 HydrophobicContact CE2-CE2 3.81Å; F82-F114 AromaticContact CZ-CD2 3.96Å; F82-F114 HydrophobicContact CZ-CD2 3.96Å; F82-F114 HydrophobicContact CZ-CE2 4.42Å; N110-F114 HydrophobicContact CB-CD2 4.28Å; N110-F114 HydrophobicContact CB-CE2 4.3Å; N110-F114 WeakPolarHBondContact O-CB 3.4Å; N110-F114 WeakPolarHBondContact O-CD2 3.42Å; N110-F114 PolarHBondContact O-N 2.95Å; N110-F114 WeakPolarHBondContact OD1-CE2 3.32Å; F114-T116 VanDerWaalsContact C-N 3.29Å; F114-T116 PolarHBondContact O-N 2.84Å; F114-I117 HydrophobicContact CD1-CD1 4.37Å; F114-I117 PolarHBondContact O-N 3.18Å; F114-A118 WeakPolarHBondContact O-CB 3.4Å; F114-A118 PolarHBondContact O-N 2.96Å
115L90.4Very high87.6Confident112 Ų11251.3 Ų51.359%0.58627%0.265SS*.Hα-helixtrans-62.5-39171.3-74.4178.3000111.7I111 V112 S113 A118 A119I111-L115 HydrophobicContact CG2-CD1 3.99Å; I111-L115 HydrophobicContact CG2-CG 4.48Å; I111-L115 WeakPolarHBondContact O-CB 3.36Å; I111-L115 VanDerWaalsContact O-CG 3.27Å; I111-L115 WeakPolarHBondContact O-CG 3.18Å; I111-L115 PolarHBondContact O-N 3.41Å; V112-L115 PolarHBondContact O-N 2.97Å; S113-L115 PolarHBondContact O-N 2.94Å; L115-A118 PolarHBondContact O-N 3.42Å; L115-A119 WeakPolarHBondContact O-CB 3.17Å; L115-A119 PolarHBondContact O-N 3.02Å
116T91.3Very high86.6Confident21 Ų2151.9 Ų51.913%0.12927%0.271CS..Hα-helixtrans-64.4-44.1176.4-56.30000110.9L10 V112 S113 F114 A119 Y120L10-T116 HydrophobicContact CD1-CG2 3.82Å; L10-T116 VanDerWaalsContact CD1-O 3.32Å; L10-T116 WeakPolarHBondContact CD1-O 3.3Å; L10-T116 HydrophobicContact CG-CG2 3.67Å; L10-T116 VanDerWaalsContact O-CG2 3.32Å; L10-T116 WeakPolarHBondContact O-CG2 3.35Å; V112-T116 WeakPolarHBondContact O-CB 3.38Å; V112-T116 PolarHBondContact O-N 2.92Å; V112-T116 PolarHBondContact O-OG1 3.31Å; S113-T116 WeakPolarHBondContact O-CB 3.44Å; S113-T116 PolarHBondContact O-N 3.34Å; S113-T116 VanDerWaalsContact O-N 3.14Å; F114-T116 VanDerWaalsContact C-N 3.29Å; F114-T116 PolarHBondContact O-N 2.84Å; T116-A119 PolarHBondContact O-N 3.11Å; T116-Y120 PolarHBondContact O-N 3.09Å
117I87.9Confident85.5Confident36 Ų3654.4 Ų54.419%0.18528%0.283CS..Hα-helixtrans-64.4-47.5176.9-65162.1000110.1A44 L48 S113 F114 A119 Y120 F121A44-I117 HydrophobicContact CB-CD1 4.19Å; L48-I117 HydrophobicContact CD1-CG2 4.14Å; S113-I117 VanDerWaalsContact O-CG1 3.29Å; S113-I117 WeakPolarHBondContact O-CG1 3.35Å; S113-I117 PolarHBondContact O-N 3.01Å; F114-I117 HydrophobicContact CD1-CD1 4.37Å; F114-I117 PolarHBondContact O-N 3.18Å; I117-A119 PolarHBondContact O-N 3.17Å; I117-Y120 WeakPolarHBondContact O-CB 3.2Å; I117-Y120 PolarHBondContact O-N 3.48Å; I117-F121 HydrophobicContact CG2-CD2 4.01Å; I117-F121 HydrophobicContact CG2-CE2 3.9Å; I117-F121 VanDerWaalsContact O-CD2 3.3Å; I117-F121 WeakPolarHBondContact O-CD2 3.44Å; I117-F121 PolarHBondContact O-N 3.21Å
118A86.3Confident84Confident56 Ų5657 Ų5746%0.46330%0.297SS..Hα-helixtrans-61.1-44.2178.500000112F114 L115 Y120 F121 Y122F114-A118 WeakPolarHBondContact O-CB 3.4Å; F114-A118 PolarHBondContact O-N 2.96Å; L115-A118 PolarHBondContact O-N 3.42Å; A118-Y120 VanDerWaalsContact C-N 3.32Å; A118-Y120 PolarHBondContact O-N 3.44Å; A118-F121 PolarHBondContact O-N 2.94Å; A118-Y122 WeakPolarHBondContact O-CB 3.08Å; A118-Y122 PolarHBondContact O-N 3.48Å
119A88.8Confident82.3Confident38 Ų3858.7 Ų58.731%0.31431%0.307SS..Hα-helixtrans-63.7-36.9177.300000112.1L10 L115 T116 I117 Y122 I123L10-A119 HydrophobicContact CD1-CB 3.59Å; L115-A119 WeakPolarHBondContact O-CB 3.17Å; L115-A119 PolarHBondContact O-N 3.02Å; T116-A119 PolarHBondContact O-N 3.11Å; I117-A119 PolarHBondContact O-N 3.17Å; A119-Y122 PolarHBondContact O-N 3.48Å; A119-I123 WeakPolarHBondContact O-CB 3.32Å; A119-I123 WeakPolarHBondContact O-CD1 3.42Å; A119-I123 WeakPolarHBondContact O-CG1 3.5Å; A119-I123 PolarHBondContact O-N 3.39Å
120Y87.4Confident80.6Confident91 Ų9163.3 Ų63.336%0.35733%0.332SS..Hα-helixtrans-57-52.7174.1-179.2-110.4000111.9L7 L10 T116 I117 A118 I123 H124L7-Y120 HydrophobicContact CD2-CD2 4.41Å; L7-Y120 HydrophobicContact CD2-CE2 4.37Å; L10-Y120 HydrophobicContact CD2-CD2 3.63Å; L10-Y120 HydrophobicContact CD2-CG 4.11Å; T116-Y120 PolarHBondContact O-N 3.09Å; I117-Y120 WeakPolarHBondContact O-CB 3.2Å; I117-Y120 PolarHBondContact O-N 3.48Å; A118-Y120 VanDerWaalsContact C-N 3.32Å; A118-Y120 PolarHBondContact O-N 3.44Å; Y120-I123 PolarHBondContact O-N 2.8Å; Y120-H124 AromaticContact CE2-CE1 3.63Å; Y120-H124 AromaticContact CE2-ND1 3.64Å; Y120-H124 AromaticContact CZ-CE1 3.63Å; Y120-H124 AromaticContact CZ-ND1 3.71Å; Y120-H124 PolarHBondContact O-N 3.3Å; Y120-H124 PolarHBondContact OH-CE1 3.06Å; Y120-H124 PolarHBondContact OH-NE2 3.15Å
121F83.2Confident78.8Confident32 Ų3271.6 Ų71.614%0.1436%0.364CS..Hα-helixtrans-66.7-39.8-178.5-79.4-75.7000111.8P45 L48 T49 I117 A118 I123 H124 Q125P45-F121 HydrophobicContact CB-CE2 4.19Å; P45-F121 HydrophobicContact CB-CZ 3.95Å; L48-F121 HydrophobicContact CB-CD1 3.91Å; L48-F121 HydrophobicContact CB-CD2 4Å; L48-F121 HydrophobicContact CB-CE1 3.54Å; L48-F121 HydrophobicContact CB-CE2 3.64Å; L48-F121 HydrophobicContact CB-CG 4.13Å; L48-F121 HydrophobicContact CB-CZ 3.39Å; L48-F121 HydrophobicContact CD1-CD2 3.44Å; L48-F121 VanDerWaalsContact CD1-CD2 3.44Å; L48-F121 HydrophobicContact CD1-CE2 3.34Å; L48-F121 HydrophobicContact CD1-CG 4.22Å; L48-F121 HydrophobicContact CD1-CZ 4.05Å; L48-F121 HydrophobicContact CD2-CB 4.16Å; L48-F121 HydrophobicContact CD2-CD1 4.28Å; L48-F121 HydrophobicContact CD2-CD2 3.94Å; L48-F121 HydrophobicContact CD2-CE2 4.41Å; L48-F121 HydrophobicContact CD2-CG 3.87Å; L48-F121 HydrophobicContact CG-CD2 3.97Å; L48-F121 HydrophobicContact CG-CE2 3.94Å; L48-F121 HydrophobicContact CG-CG 4.27Å; L48-F121 HydrophobicContact CG-CZ 4.22Å; T49-F121 HydrophobicContact CG2-CE1 4.42Å; I117-F121 HydrophobicContact CG2-CD2 4.01Å; I117-F121 HydrophobicContact CG2-CE2 3.9Å; I117-F121 VanDerWaalsContact O-CD2 3.3Å; I117-F121 WeakPolarHBondContact O-CD2 3.44Å; I117-F121 PolarHBondContact O-N 3.21Å; A118-F121 PolarHBondContact O-N 2.94Å; F121-I123 PolarHBondContact O-N 3.34Å; F121-H124 PolarHBondContact O-N 3.32Å; F121-Q125 WeakPolarHBondContact O-CB 3.49Å; F121-Q125 VanDerWaalsContact O-CG 3.28Å; F121-Q125 WeakPolarHBondContact O-CG 3.13Å; F121-Q125 PolarHBondContact O-N 3.02Å
122Y82.2Confident76.9Confident148 Ų14870.7 Ų70.758%0.5838%0.375SS*.Hα-helixtrans-58.9-46.8174.9-175.1-88.6000111.5A118 A119 H124 Q125 D126A118-Y122 WeakPolarHBondContact O-CB 3.08Å; A118-Y122 PolarHBondContact O-N 3.48Å; A119-Y122 PolarHBondContact O-N 3.48Å; Y122-H124 PolarHBondContact O-N 3Å; Y122-Q125 PolarHBondContact O-N 3.15Å; Y122-D126 WeakPolarHBondContact CE1-OD2 3.28Å; Y122-D126 PolarHBondContact O-N 3.26Å; Y122-D126 VanDerWaalsContact O-N 3.15Å
123I82.9Confident75Confident36 Ų3674.5 Ų74.519%0.18540%0.398CS..Hα-helixtrans-63-43.2178-68.1161.1000111.3T3 A6 A119 Y120 F121 D126 E127T3-I123 HydrophobicContact CG2-CG2 4.36Å; A6-I123 HydrophobicContact CB-CD1 3.78Å; A119-I123 WeakPolarHBondContact O-CB 3.32Å; A119-I123 WeakPolarHBondContact O-CD1 3.42Å; A119-I123 WeakPolarHBondContact O-CG1 3.5Å; A119-I123 PolarHBondContact O-N 3.39Å; Y120-I123 PolarHBondContact O-N 2.8Å; F121-I123 PolarHBondContact O-N 3.34Å; I123-D126 PolarHBondContact O-N 3.43Å; I123-E127 WeakPolarHBondContact O-CG 2.93Å; I123-E127 PolarHBondContact O-N 3.15Å
124H77Confident72.8Confident69 Ų6984.4 Ų84.432%0.31944%0.44SS..Hα-helixtrans-64.9-38.9177.9-101.262.6000112.7Y120 F121 Y122 D126 E127 D128Y120-H124 AromaticContact CE2-CE1 3.63Å; Y120-H124 AromaticContact CE2-ND1 3.64Å; Y120-H124 AromaticContact CZ-CE1 3.63Å; Y120-H124 AromaticContact CZ-ND1 3.71Å; Y120-H124 PolarHBondContact O-N 3.3Å; Y120-H124 PolarHBondContact OH-CE1 3.06Å; Y120-H124 PolarHBondContact OH-NE2 3.15Å; F121-H124 PolarHBondContact O-N 3.32Å; Y122-H124 PolarHBondContact O-N 3Å; H124-D126 VanDerWaalsContact C-N 3.34Å; H124-D126 PolarHBondContact O-N 3.11Å; H124-E127 PolarHBondContact O-N 3.43Å; H124-D128 PolarHBondContact O-N 3.47Å
125Q72.6Confident72Confident114 Ų11487.5 Ų87.553%0.53346%0.457SS..Hα-helixtrans-63.5-39.3177.3-74.5178-38.500112.4F121 Y122 E127 S129F121-Q125 WeakPolarHBondContact O-CB 3.49Å; F121-Q125 VanDerWaalsContact O-CG 3.28Å; F121-Q125 WeakPolarHBondContact O-CG 3.13Å; F121-Q125 PolarHBondContact O-N 3.02Å; Y122-Q125 PolarHBondContact O-N 3.15Å; Q125-E127 VanDerWaalsContact C-N 3.31Å; Q125-E127 PolarHBondContact O-N 3.34Å; Q125-S129 PolarHBondContact O-N 3.13Å; Q125-S129 VanDerWaalsContact O-N 3.13Å
126D66Low71Confident80 Ų8086.2 Ų86.243%0.42845%0.451SS..Hα-helixtrans-63.8-36.2175-79.1-22.5000111.6Y122 I123 H124 S129 N130Y122-D126 WeakPolarHBondContact CE1-OD2 3.28Å; Y122-D126 PolarHBondContact O-N 3.26Å; Y122-D126 VanDerWaalsContact O-N 3.15Å; I123-D126 PolarHBondContact O-N 3.43Å; H124-D126 VanDerWaalsContact C-N 3.34Å; H124-D126 PolarHBondContact O-N 3.11Å; D126-S129 PolarHBondContact O-N 3.08Å; D126-S129 PolarHBondContact O-OG 3.47Å; D126-N130 PolarHBondContact O-N 2.58Å; D126-N130 VanDerWaalsContact O-N 3.08Å
127E65.2Low69.9Low54 Ų5489.8 Ų89.825%0.25247%0.468SS..Hα-helixtrans-65.8-48.4177.3-67.5-163136.200112.3T3 I123 H124 Q125 S129 N130 Y131T3-E127 VanDerWaalsContact CB-OE1 3.23Å; T3-E127 WeakPolarHBondContact CB-OE1 3.23Å; T3-E127 WeakPolarHBondContact CG2-OE1 3.5Å; T3-E127 PolarHBondContact OG1-OE1 3.38Å; I123-E127 WeakPolarHBondContact O-CG 2.93Å; I123-E127 PolarHBondContact O-N 3.15Å; H124-E127 PolarHBondContact O-N 3.43Å; Q125-E127 VanDerWaalsContact C-N 3.31Å; Q125-E127 PolarHBondContact O-N 3.34Å; E127-S129 PolarHBondContact O-N 3.47Å; E127-N130 PolarHBondContact O-N 3.41Å; E127-N130 VanDerWaalsContact O-N 3.15Å; E127-Y131 WeakPolarHBondContact O-CD2 3.33Å; E127-Y131 PolarHBondContact O-N 3.2Å
128D59.2Low68.8Low118 Ų11893 Ų9363%0.63149%0.485SS*.Hα-helixtrans-59.4-40.1177.8-69.4-28.2000111H124 N130 Y131 G132H124-D128 PolarHBondContact O-N 3.47Å; D128-N130 PolarHBondContact O-N 3.39Å; D128-Y131 PolarHBondContact O-N 2.78Å; D128-G132 PolarHBondContact O-N 3.47Å; D128-G132 VanDerWaalsContact O-N 3.11Å
129S57.5Low67.7Low73 Ų7395.3 Ų95.351%0.5149%0.487SS..Hα-helixtrans-65-37.6177.979.90000112.8Q125 D126 E127 V133Q125-S129 PolarHBondContact O-N 3.13Å; Q125-S129 VanDerWaalsContact O-N 3.13Å; D126-S129 PolarHBondContact O-N 3.08Å; D126-S129 PolarHBondContact O-OG 3.47Å; E127-S129 PolarHBondContact O-N 3.47Å; S129-V133 WeakPolarHBondContact O-CG2 3.13Å
130N55.5Low66.3Low98 Ų9899.1 Ų99.152%0.52450%0.498SS..Hα-helixtrans-77.3-28.3179.8-175.777.2000112.7D126 E127 D128 F134D126-N130 PolarHBondContact O-N 2.58Å; D126-N130 VanDerWaalsContact O-N 3.08Å; E127-N130 PolarHBondContact O-N 3.41Å; E127-N130 VanDerWaalsContact O-N 3.15Å; D128-N130 PolarHBondContact O-N 3.39Å; N130-F134 WeakPolarHBondContact O-CE2 3.11Å
131Y54.6Low64.8Low174 Ų17499.7 Ų99.768%0.68251%0.508SS*.Hα-helixtrans-76.3-28.1172.5-84-81.3000112.8E127 D128 V133E127-Y131 WeakPolarHBondContact O-CD2 3.33Å; E127-Y131 PolarHBondContact O-N 3.2Å; D128-Y131 PolarHBondContact O-N 2.78Å; Y131-V133 VanDerWaalsContact C-N 3.28Å; Y131-V133 PolarHBondContact O-N 3.32Å
132G52.5Low63.4Low64 Ų64104.9 Ų104.966%0.6654%0.536SS*.THydrogen-bonded Turntrans-74.2-5.4-179.600000116.3D128D128-G132 PolarHBondContact O-N 3.47Å; D128-G132 VanDerWaalsContact O-N 3.11Å
133V54Low61.9Low116 Ų116101.3 Ų101.370%0.70353%0.533SS*.THydrogen-bonded Turntrans-94.44.1-177.9-127.30000114.2S129 Y131S129-V133 WeakPolarHBondContact O-CG2 3.13Å; Y131-V133 VanDerWaalsContact C-N 3.28Å; Y131-V133 PolarHBondContact O-N 3.32Å
134F45.4Very low60Low220 Ų220107.3 Ų107.397%0.96556%0.564SS**  trans-1100173.3-50-77.7000110.6N130N130-F134 WeakPolarHBondContact O-CE2 3.11Å

Retrieved 134 of 134 residues in 216.2 ms (Link to these results)