A0A087XU16_POEFO Loading...

Gamma-secretase subunit APH-1

Potential subunit of the gamma-secretase complex, an endoprotease complex that catalyzes the intramembrane cleavage of integral proteins such as Notch receptors.

AlphaFold DB (A0A3B3VYY9), UniProt , Accession A0A087XU16, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 258 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
1M57.2Low90Very high194 Ų19471.4 Ų71.496%0.95641%0.405SS*.  0-26.60-75.1-177.163.500113.1V5M1-V5 VanDerWaalsContact O-CG2 3.22Å; M1-V5 WeakPolarHBondContact O-CG2 3.3Å; M1-V5 PolarHBondContact O-N 3.38Å
2T78.7Confident90.7Very high48 Ų4868.6 Ų68.629%0.29439%0.388SS..Hα-helixtrans-67.3-60.1-16755.90000115.9A4 V5 F6 V142 G143 P144T2-A4 PolarHBondContact O-N 3.16Å; T2-V5 PolarHBondContact O-N 3.32Å; T2-F6 PolarHBondContact O-N 3Å; T2-V142 WeakPolarHBondContact CB-O 3.4Å; T2-V142 WeakPolarHBondContact CG2-O 3.38Å; T2-G143 VanDerWaalsContact CG2-C 3.43Å; T2-G143 WeakPolarHBondContact CG2-O 3.33Å; T2-P144 VanDerWaalsContact CG2-CA 3.42Å; T2-P144 HydrophobicContact CG2-CB 4.38Å
3A88Confident91.3Very high52 Ų5263.4 Ų63.443%0.4336%0.359SS..Hα-helixtrans-61.6-36.2177.900000111.6F6 F7A3-F6 PolarHBondContact O-N 3.29Å; A3-F7 HydrophobicContact CB-CD2 4.37Å; A3-F7 HydrophobicContact CB-CE2 4.4Å; A3-F7 WeakPolarHBondContact O-CB 3.45Å; A3-F7 WeakPolarHBondContact O-CD2 3.39Å; A3-F7 PolarHBondContact O-N 3.03Å
4A92.8Very high91.7Very high73 Ų7360.8 Ų60.860%0.60334%0.341SS*.Hα-helixtrans-64.3-43.1177.400000112.3T2 G8T2-A4 PolarHBondContact O-N 3.16Å; A4-G8 PolarHBondContact O-N 3.22Å
5V93.3Very high92.2Very high50 Ų5058.1 Ų58.130%0.30333%0.333SS..Hα-helixtrans-65-46174.41710000110.2M1 T2 F7 G8 C9 F157M1-V5 VanDerWaalsContact O-CG2 3.22Å; M1-V5 WeakPolarHBondContact O-CG2 3.3Å; M1-V5 PolarHBondContact O-N 3.38Å; T2-V5 PolarHBondContact O-N 3.32Å; V5-F7 PolarHBondContact O-N 3.25Å; V5-G8 PolarHBondContact O-N 3.37Å; V5-C9 VanDerWaalsContact O-CB 3.28Å; V5-C9 WeakPolarHBondContact O-CB 3.08Å; V5-C9 PolarHBondContact O-N 3.13Å; V5-C9 PolarHBondContact O-SG 3.27Å; V5-F157 HydrophobicContact CG1-CB 4.29Å; V5-F157 HydrophobicContact CG1-CD2 4.36Å
6F94.9Very high92.5Very high57 Ų5757.2 Ų57.225%0.2533%0.33CS..Hα-helixtrans-55.3-54.5176.6172.4-96.4000112.3T2 A3 T10 L138 V142T2-F6 PolarHBondContact O-N 3Å; A3-F6 PolarHBondContact O-N 3.29Å; F6-T10 VanDerWaalsContact O-CB 3.24Å; F6-T10 WeakPolarHBondContact O-CB 3.47Å; F6-T10 PolarHBondContact O-N 3.37Å; F6-T10 PolarHBondContact O-OG1 3.48Å; F6-L138 HydrophobicContact CD2-CB 4.21Å; F6-L138 WeakPolarHBondContact CD2-O 3.38Å; F6-L138 HydrophobicContact CE2-CB 4.06Å; F6-V142 HydrophobicContact CB-CG2 4.17Å; F6-V142 HydrophobicContact CD2-CG2 3.66Å; F6-V142 HydrophobicContact CE2-CG2 4.27Å; F6-V142 HydrophobicContact CG-CG2 3.98Å
7F96.3Very high92.7Very high107 Ų10753.9 Ų53.947%0.46931%0.311SS..Hα-helixtrans-66.8-40.6-179.7-76.6-65.5000111.8A3 V5 T10 F11A3-F7 HydrophobicContact CB-CD2 4.37Å; A3-F7 HydrophobicContact CB-CE2 4.4Å; A3-F7 WeakPolarHBondContact O-CB 3.45Å; A3-F7 WeakPolarHBondContact O-CD2 3.39Å; A3-F7 PolarHBondContact O-N 3.03Å; V5-F7 PolarHBondContact O-N 3.25Å; F7-T10 PolarHBondContact O-N 3.2Å; F7-F11 HydrophobicContact CB-CD2 4.45Å; F7-F11 HydrophobicContact CB-CE2 4.08Å; F7-F11 HydrophobicContact CD1-CE2 4.39Å; F7-F11 HydrophobicContact CD1-CZ 4.06Å; F7-F11 WeakPolarHBondContact O-CB 3.41Å; F7-F11 WeakPolarHBondContact O-CD2 3.36Å; F7-F11 WeakPolarHBondContact O-CG 3.32Å; F7-F11 PolarHBondContact O-N 3.16Å
8G96.4Very high93Very high32 Ų3254.4 Ų54.433%0.3332%0.315SS..Hα-helixtrans-58.9-51.9176.100000112.2A4 V5 T10 F11 I12A4-G8 PolarHBondContact O-N 3.22Å; V5-G8 PolarHBondContact O-N 3.37Å; G8-T10 PolarHBondContact O-N 3.35Å; G8-F11 PolarHBondContact O-N 2.7Å; G8-I12 VanDerWaalsContact O-CG1 3.25Å; G8-I12 WeakPolarHBondContact O-CG1 3.47Å; G8-I12 PolarHBondContact O-N 2.98Å
9C96.9Very high93.2Very high7 Ų754.4 Ų54.45%0.04732%0.318CS..Hα-helixtrans-65.3-38.4177.3-72.70000112.1V5 I12 A13 L138 F157 A161V5-C9 VanDerWaalsContact O-CB 3.28Å; V5-C9 WeakPolarHBondContact O-CB 3.08Å; V5-C9 PolarHBondContact O-N 3.13Å; V5-C9 PolarHBondContact O-SG 3.27Å; C9-I12 PolarHBondContact O-N 3.35Å; C9-A13 VanDerWaalsContact O-CB 3.29Å; C9-A13 WeakPolarHBondContact O-CB 3.46Å; C9-A13 PolarHBondContact O-N 2.94Å; C9-L138 HydrophobicContact CB-CD2 3.43Å; C9-L138 VanDerWaalsContact CB-CD2 3.43Å; C9-F157 PolarHBondContact SG-O 3.46Å; C9-F157 VanDerWaalsContact SG-O 3.41Å; C9-A161 HydrophobicContact CB-CB 3.87Å; C9-A161 WeakPolarHBondContact O-CB 3.39Å
10T97.6Very high93.4Very high30 Ų3054.2 Ų54.218%0.18432%0.315CS..Hα-helixtrans-62.4-46176-60.60000111.4F6 F7 G8 A13 F14F6-T10 VanDerWaalsContact O-CB 3.24Å; F6-T10 WeakPolarHBondContact O-CB 3.47Å; F6-T10 PolarHBondContact O-N 3.37Å; F6-T10 PolarHBondContact O-OG1 3.48Å; F7-T10 PolarHBondContact O-N 3.2Å; G8-T10 PolarHBondContact O-N 3.35Å; T10-A13 PolarHBondContact O-N 3.34Å; T10-F14 HydrophobicContact CG2-CD2 4.39Å; T10-F14 PolarHBondContact O-N 2.91Å
11F97.9Very high93.6Very high135 Ų13554.3 Ų54.359%0.59231%0.312SS*.Hα-helixtrans-70.8-31.9179.1-64.3-31000112.8F7 G8 G15F7-F11 HydrophobicContact CB-CD2 4.45Å; F7-F11 HydrophobicContact CB-CE2 4.08Å; F7-F11 HydrophobicContact CD1-CE2 4.39Å; F7-F11 HydrophobicContact CD1-CZ 4.06Å; F7-F11 WeakPolarHBondContact O-CB 3.41Å; F7-F11 WeakPolarHBondContact O-CD2 3.36Å; F7-F11 WeakPolarHBondContact O-CG 3.32Å; F7-F11 PolarHBondContact O-N 3.16Å; G8-F11 PolarHBondContact O-N 2.7Å; F11-G15 WeakPolarHBondContact O-CA 3.35Å; F11-G15 PolarHBondContact O-N 3.37Å
12I98.3Very high95.5Very high38 Ų3849.6 Ų49.620%0.19529%0.29CS..Hα-helixtrans-64.7-53.3170.3-70165.7000109.9G8 C9 L158 A161 F162 M165G8-I12 VanDerWaalsContact O-CG1 3.25Å; G8-I12 WeakPolarHBondContact O-CG1 3.47Å; G8-I12 PolarHBondContact O-N 2.98Å; C9-I12 PolarHBondContact O-N 3.35Å; I12-L158 HydrophobicContact CD1-CD1 3.48Å; I12-L158 VanDerWaalsContact CD1-CD1 3.48Å; I12-A161 HydrophobicContact CB-CB 4.05Å; I12-A161 HydrophobicContact CG2-CB 3.85Å; I12-F162 HydrophobicContact CD1-CE2 4.11Å; I12-F162 HydrophobicContact CD1-CZ 4.04Å; I12-F162 HydrophobicContact CG1-CZ 4.48Å; I12-F162 HydrophobicContact CG2-CB 4.49Å; I12-F162 HydrophobicContact CG2-CD1 3.55Å; I12-F162 HydrophobicContact CG2-CD2 4.27Å; I12-F162 HydrophobicContact CG2-CE1 3.76Å; I12-F162 HydrophobicContact CG2-CE2 4.44Å; I12-F162 HydrophobicContact CG2-CG 3.84Å; I12-F162 HydrophobicContact CG2-CZ 4.2Å; I12-M165 WeakPolarHBondContact O-CB 3.19Å; I12-M165 VanDerWaalsContact O-CG 3.29Å; I12-M165 WeakPolarHBondContact O-CG 3.47Å; I12-M165 VanDerWaalsContact O-SD 3.35Å
13A98Very high96.3Very high1 Ų154 Ų541%0.00831%0.306CS..Hα-helixtrans-63-51.2-175.200000112.5C9 T10 V134 A161 T164 I168C9-A13 VanDerWaalsContact O-CB 3.29Å; C9-A13 WeakPolarHBondContact O-CB 3.46Å; C9-A13 PolarHBondContact O-N 2.94Å; T10-A13 PolarHBondContact O-N 3.34Å; A13-V134 HydrophobicContact CB-CG1 4.21Å; A13-A161 HydrophobicContact CB-CB 4.3Å; A13-T164 HydrophobicContact CB-CG2 3.9Å; A13-I168 WeakPolarHBondContact O-CD1 3.29Å
14F98.1Very high96.6Very high27 Ų2753.5 Ų53.512%0.11830%0.298CS..Hα-helixtrans-108.5-9.8-170.1-63.7-75.7000114.5T10 A17 V18 F127 A131 V134 V135 L138 I168T10-F14 HydrophobicContact CG2-CD2 4.39Å; T10-F14 PolarHBondContact O-N 2.91Å; F14-A17 PolarHBondContact O-N 3.26Å; F14-A17 VanDerWaalsContact O-N 3.11Å; F14-V18 HydrophobicContact CB-CG2 4.14Å; F14-V18 WeakPolarHBondContact O-CB 3.36Å; F14-V18 WeakPolarHBondContact O-CG2 3.49Å; F14-V18 PolarHBondContact O-N 3.44Å; F14-F127 HydrophobicContact CD1-CD1 4.3Å; F14-F127 HydrophobicContact CD1-CE1 4.4Å; F14-A131 HydrophobicContact CZ-CB 4.49Å; F14-V134 HydrophobicContact CE2-CG1 3.47Å; F14-V134 VanDerWaalsContact CE2-CG1 3.47Å; F14-V134 HydrophobicContact CZ-CG1 3.67Å; F14-V135 HydrophobicContact CZ-CG2 4.49Å; F14-L138 HydrophobicContact CE2-CD1 4.14Å; F14-I168 HydrophobicContact CD1-CD1 3.92Å; F14-I168 HydrophobicContact CE1-CD1 4.02Å
15G98.1Very high96.7Very high21 Ų2150 Ų5022%0.21627%0.269CS..Hα-helixtrans-54-51-175.700000113.8F11 A17 S19F11-G15 WeakPolarHBondContact O-CA 3.35Å; F11-G15 PolarHBondContact O-N 3.37Å; G15-A17 PolarHBondContact O-N 3.35Å; G15-S19 WeakPolarHBondContact O-CB 3.47Å; G15-S19 PolarHBondContact O-N 2.89Å; G15-S19 PolarHBondContact O-OG 3.48Å
16P97.2Very high96.8Very high43 Ų4349.9 Ų49.928%0.27927%0.273SS..Hα-helixtrans-61.1-43.4175.7-25.636.1000112.6S19 L20 M165 L169P16-S19 PolarHBondContact O-N 2.94Å; P16-L20 WeakPolarHBondContact O-CB 3.44Å; P16-L20 VanDerWaalsContact O-CG 3.24Å; P16-L20 WeakPolarHBondContact O-CG 3.31Å; P16-L20 PolarHBondContact O-N 2.98Å; P16-M165 HydrophobicContact CG-CG 3.82Å; P16-M165 HydrophobicContact CG-SD 3.76Å; P16-L169 HydrophobicContact CB-CD2 4.16Å
17A96.5Very high96.6Very high1 Ų156.5 Ų56.51%0.00830%0.296CS..Hα-helixtrans-64.8-45.4-178.100000112.2F14 G15 L20 F21 L123 F127 I168F14-A17 PolarHBondContact O-N 3.26Å; F14-A17 VanDerWaalsContact O-N 3.11Å; G15-A17 PolarHBondContact O-N 3.35Å; A17-L20 PolarHBondContact O-N 3.41Å; A17-F21 WeakPolarHBondContact O-CB 3.5Å; A17-F21 PolarHBondContact O-N 3.08Å; A17-L123 HydrophobicContact CB-CD1 4.19Å; A17-F127 HydrophobicContact CB-CD1 4.23Å; A17-F127 HydrophobicContact CB-CD2 4.47Å; A17-F127 HydrophobicContact CB-CE1 3.67Å; A17-F127 HydrophobicContact CB-CE2 3.93Å; A17-F127 HydrophobicContact CB-CZ 3.51Å; A17-F127 VanDerWaalsContact O-CZ 3.29Å; A17-F127 WeakPolarHBondContact O-CZ 3.22Å; A17-I168 HydrophobicContact CB-CG2 3.66Å
18V97.5Very high96.3Very high63 Ų6354.9 Ų54.938%0.38229%0.29SS..Hα-helixtrans-65.4-41.5176.91710000110.7F14 L20 F21 L22 F127F14-V18 HydrophobicContact CB-CG2 4.14Å; F14-V18 WeakPolarHBondContact O-CB 3.36Å; F14-V18 WeakPolarHBondContact O-CG2 3.49Å; F14-V18 PolarHBondContact O-N 3.44Å; V18-L20 VanDerWaalsContact C-N 3.33Å; V18-L20 PolarHBondContact O-N 3.09Å; V18-F21 PolarHBondContact O-N 3.28Å; V18-L22 HydrophobicContact CG1-CD1 3.77Å; V18-L22 HydrophobicContact CG1-CG 4.15Å; V18-L22 WeakPolarHBondContact O-CB 3.46Å; V18-L22 VanDerWaalsContact O-CG 3.29Å; V18-L22 WeakPolarHBondContact O-CG 3.48Å; V18-L22 PolarHBondContact O-N 2.82Å; V18-F127 HydrophobicContact CG2-CE1 4.22Å; V18-F127 HydrophobicContact CG2-CZ 4.37Å
19S97.8Very high96.1Very high55 Ų5558 Ų5839%0.38531%0.305SS..Hα-helixtrans-58.7-47.8175.3-59.70000110.9G15 P16 F21 L22 F23G15-S19 WeakPolarHBondContact O-CB 3.47Å; G15-S19 PolarHBondContact O-N 2.89Å; G15-S19 PolarHBondContact O-OG 3.48Å; P16-S19 PolarHBondContact O-N 2.94Å; S19-F21 PolarHBondContact O-N 3.24Å; S19-L22 PolarHBondContact O-N 2.64Å; S19-F23 WeakPolarHBondContact O-CB 3.33Å; S19-F23 WeakPolarHBondContact O-CD2 3.39Å; S19-F23 PolarHBondContact O-N 3Å
20L96.8Very high95.9Very high49 Ų4961 Ų6126%0.25732%0.32SS..Hα-helixtrans-62.2-43.6176.7-73.4171.9000112P16 A17 V18 T24 Y119 L123 L169 M172P16-L20 WeakPolarHBondContact O-CB 3.44Å; P16-L20 VanDerWaalsContact O-CG 3.24Å; P16-L20 WeakPolarHBondContact O-CG 3.31Å; P16-L20 PolarHBondContact O-N 2.98Å; A17-L20 PolarHBondContact O-N 3.41Å; V18-L20 VanDerWaalsContact C-N 3.33Å; V18-L20 PolarHBondContact O-N 3.09Å; L20-T24 WeakPolarHBondContact O-CB 3.43Å; L20-T24 PolarHBondContact O-N 3.48Å; L20-T24 PolarHBondContact O-OG1 3.32Å; L20-Y119 WeakPolarHBondContact CB-OH 3.37Å; L20-Y119 WeakPolarHBondContact CD2-OH 3.28Å; L20-L123 HydrophobicContact CB-CD2 3.83Å; L20-L169 HydrophobicContact CD1-CD2 4.42Å; L20-M172 HydrophobicContact CD1-CE 3.12Å; L20-M172 HydrophobicContact CD1-SD 4.26Å
21F96.8Very high95.7Very high57 Ų5761.3 Ų61.325%0.2532%0.318CS..Iπ-helixtrans-57.9-53.5175.1175.5-101.6000111.9A17 V18 S19 F23 I25 A26 V32 L35 F127A17-F21 WeakPolarHBondContact O-CB 3.5Å; A17-F21 PolarHBondContact O-N 3.08Å; V18-F21 PolarHBondContact O-N 3.28Å; S19-F21 PolarHBondContact O-N 3.24Å; F21-F23 PolarHBondContact O-N 3.07Å; F21-I25 HydrophobicContact CD2-CB 3.94Å; F21-I25 HydrophobicContact CD2-CG2 3.87Å; F21-I25 HydrophobicContact CE2-CB 4.4Å; F21-I25 HydrophobicContact CE2-CG2 3.93Å; F21-I25 WeakPolarHBondContact O-CA 3.49Å; F21-I25 WeakPolarHBondContact O-CB 3.46Å; F21-I25 PolarHBondContact O-N 3.43Å; F21-A26 HydrophobicContact CD1-CB 4.4Å; F21-A26 HydrophobicContact CE1-CB 4.02Å; F21-A26 HydrophobicContact CZ-CB 4.21Å; F21-A26 PolarHBondContact O-N 3.28Å; F21-V32 HydrophobicContact CE2-CG2 4.35Å; F21-L35 HydrophobicContact CD2-CD1 4.07Å; F21-F127 HydrophobicContact CB-CE2 4.03Å; F21-F127 HydrophobicContact CB-CZ 4.02Å
22L97.6Very high95.6Very high95 Ų9556.7 Ų56.750%0.49730%0.3SS..Iπ-helixtrans-62.6-44.5-176.6-70.3174.4000112.3V18 S19V18-L22 HydrophobicContact CG1-CD1 3.77Å; V18-L22 HydrophobicContact CG1-CG 4.15Å; V18-L22 WeakPolarHBondContact O-CB 3.46Å; V18-L22 VanDerWaalsContact O-CG 3.29Å; V18-L22 WeakPolarHBondContact O-CG 3.48Å; V18-L22 PolarHBondContact O-N 2.82Å; S19-L22 PolarHBondContact O-N 2.64Å
23F95.6Very high95.4Very high140 Ų14059.6 Ų59.661%0.61432%0.315SS*.Iπ-helixtrans-84.3-27.1-174.2-66.9-58.3000114.1S19 F21S19-F23 WeakPolarHBondContact O-CB 3.33Å; S19-F23 WeakPolarHBondContact O-CD2 3.39Å; S19-F23 PolarHBondContact O-N 3Å; F21-F23 PolarHBondContact O-N 3.07Å
24T94.5Very high95.3Very high43 Ų4360.5 Ų60.526%0.26432%0.319SS..Iπ-helixtrans-119.3-25.2-170.973.20000115.1L20 R31 Y119L20-T24 WeakPolarHBondContact O-CB 3.43Å; L20-T24 PolarHBondContact O-N 3.48Å; L20-T24 PolarHBondContact O-OG1 3.32Å; T24-R31 PolarHBondContact O-NH1 3.41Å; T24-Y119 VanDerWaalsContact OG1-CE1 3.31Å; T24-Y119 WeakPolarHBondContact OG1-CE1 3.46Å; T24-Y119 PolarHBondContact OG1-OH 3.29Å
25I94.7Very high95.2Very high0 Ų060 Ų600%032%0.317CS..Iπ-helixtrans-109.7-47.3-172.7-61.2-171.6000111.6F21 R27 E28 R31 V32 L35 Y119 V120 L123F21-I25 HydrophobicContact CD2-CB 3.94Å; F21-I25 HydrophobicContact CD2-CG2 3.87Å; F21-I25 HydrophobicContact CE2-CB 4.4Å; F21-I25 HydrophobicContact CE2-CG2 3.93Å; F21-I25 WeakPolarHBondContact O-CA 3.49Å; F21-I25 WeakPolarHBondContact O-CB 3.46Å; F21-I25 PolarHBondContact O-N 3.43Å; I25-R27 PolarHBondContact O-N 2.79Å; I25-E28 PolarHBondContact O-N 2.9Å; I25-E28 VanDerWaalsContact O-N 3.07Å; I25-R31 HydrophobicContact CB-CB 4.45Å; I25-R31 HydrophobicContact CG2-CB 3.81Å; I25-V32 HydrophobicContact CG2-CG2 4Å; I25-L35 HydrophobicContact CD1-CD1 3.4Å; I25-L35 HydrophobicContact CG2-CB 4.48Å; I25-L35 HydrophobicContact CG2-CD1 4.29Å; I25-Y119 HydrophobicContact CD1-CE1 4.22Å; I25-Y119 HydrophobicContact CG1-CE1 4.14Å; I25-V120 HydrophobicContact CD1-CB 4.44Å; I25-V120 HydrophobicContact CD1-CG1 4.33Å; I25-V120 HydrophobicContact CD1-CG2 4Å; I25-V120 HydrophobicContact CG1-CG2 4.17Å; I25-L123 HydrophobicContact CD1-CD2 3.71Å
26A94.6Very high95.2Very high47 Ų4764 Ų6439%0.38833%0.333SS..THydrogen-bonded Turntrans-60.8-19.5-170.900000114.6F21F21-A26 HydrophobicContact CD1-CB 4.4Å; F21-A26 HydrophobicContact CE1-CB 4.02Å; F21-A26 HydrophobicContact CZ-CB 4.21Å; F21-A26 PolarHBondContact O-N 3.28Å
27R91.7Very high95.2Very high196 Ų19663.3 Ų63.374%0.7433%0.331SS*.THydrogen-bonded Turntrans-75.9-22.1179.1-64.4-177.4178.5177.6-0.9113.8I25I25-R27 PolarHBondContact O-N 2.79Å
28E90.9Very high95.3Very high73 Ų7363.3 Ų63.334%0.34133%0.331SS..  trans-124.2114.6-176.6-76175.9-142.400110.4I25 L30 R31 V32I25-E28 PolarHBondContact O-N 2.9Å; I25-E28 VanDerWaalsContact O-N 3.07Å; E28-L30 VanDerWaalsContact C-N 3.28Å; E28-L30 PolarHBondContact O-N 3.05Å; E28-R31 HydrophobicContact CB-CB 4.39Å; E28-R31 HydrophobicContact CB-CG 3.89Å; E28-R31 VanDerWaalsContact CD-NE 3.34Å; E28-R31 WeakPolarHBondContact O-CB 3.25Å; E28-R31 PolarHBondContact O-N 3.36Å; E28-R31 IonicContact OE1-CZ 3.06Å; E28-R31 IonicContact OE1-NE 3.68Å; E28-R31 IonicContact OE1-NH1 3.48Å; E28-R31 PolarHBondContact OE1-NH1 2.87Å; E28-R31 IonicContact OE1-NH2 2.64Å; E28-R31 PolarHBondContact OE1-NH2 3.49Å; E28-R31 IonicContact OE2-CZ 2.95Å; E28-R31 IonicContact OE2-NE 2.72Å; E28-R31 PolarHBondContact OE2-NE 3.47Å; E28-R31 IonicContact OE2-NH1 3.93Å; E28-R31 IonicContact OE2-NH2 2.82Å; E28-R31 PolarHBondContact OE2-NH2 3.25Å; E28-V32 PolarHBondContact O-N 2.75Å
29P92.1Very high95.3Very high98 Ų9860.8 Ų60.864%0.63632%0.316SS*.Hα-helixtrans-62.1-34.6-172.223.3-33.3000112.7R31 V32 I33P29-R31 VanDerWaalsContact C-N 3.28Å; P29-R31 PolarHBondContact O-N 3.44Å; P29-V32 WeakPolarHBondContact O-CB 3.34Å; P29-V32 PolarHBondContact O-N 2.86Å; P29-V32 VanDerWaalsContact O-N 3.12Å; P29-I33 WeakPolarHBondContact O-CG1 3.18Å; P29-I33 PolarHBondContact O-N 2.97Å
30L90.8Very high95.3Very high70 Ų7063.9 Ų63.937%0.36632%0.323SS..Hα-helixtrans-60.1-37.5175.7-71.1176000112.3E28 V32 I33 F34 I112E28-L30 VanDerWaalsContact C-N 3.28Å; E28-L30 PolarHBondContact O-N 3.05Å; L30-V32 VanDerWaalsContact C-N 3.34Å; L30-I33 PolarHBondContact O-N 2.96Å; L30-F34 WeakPolarHBondContact O-CD2 3.2Å; L30-F34 WeakPolarHBondContact O-CG 3.41Å; L30-F34 PolarHBondContact O-N 2.56Å; L30-I112 HydrophobicContact CB-CD1 3.55Å; L30-I112 HydrophobicContact CD1-CD1 4.23Å
31R94Very high95.4Very high35 Ų3563.4 Ų63.413%0.13232%0.319CS..Hα-helixtrans-67.4-37176.3-59.8-175.5-174.21664.8111.2T24 I25 E28 P29 F34 L35 I112 Q116 V120T24-R31 PolarHBondContact O-NH1 3.41Å; I25-R31 HydrophobicContact CB-CB 4.45Å; I25-R31 HydrophobicContact CG2-CB 3.81Å; E28-R31 HydrophobicContact CB-CB 4.39Å; E28-R31 HydrophobicContact CB-CG 3.89Å; E28-R31 VanDerWaalsContact CD-NE 3.34Å; E28-R31 WeakPolarHBondContact O-CB 3.25Å; E28-R31 PolarHBondContact O-N 3.36Å; E28-R31 IonicContact OE1-CZ 3.06Å; E28-R31 IonicContact OE1-NE 3.68Å; E28-R31 IonicContact OE1-NH1 3.48Å; E28-R31 PolarHBondContact OE1-NH1 2.87Å; E28-R31 IonicContact OE1-NH2 2.64Å; E28-R31 PolarHBondContact OE1-NH2 3.49Å; E28-R31 IonicContact OE2-CZ 2.95Å; E28-R31 IonicContact OE2-NE 2.72Å; E28-R31 PolarHBondContact OE2-NE 3.47Å; E28-R31 IonicContact OE2-NH1 3.93Å; E28-R31 IonicContact OE2-NH2 2.82Å; E28-R31 PolarHBondContact OE2-NH2 3.25Å; P29-R31 VanDerWaalsContact C-N 3.28Å; P29-R31 PolarHBondContact O-N 3.44Å; R31-F34 PolarHBondContact O-N 2.98Å; R31-L35 WeakPolarHBondContact O-CB 3.21Å; R31-L35 PolarHBondContact O-N 3.48Å; R31-I112 HydrophobicContact CG-CD1 4.28Å; R31-Q116 VanDerWaalsContact NH2-NE2 3.15Å; R31-V120 HydrophobicContact CB-CG2 4.06Å; R31-V120 HydrophobicContact CG-CG2 4.26Å; R31-V120 WeakPolarHBondContact O-CG1 3.33Å
32V96.4Very high95.5Very high38 Ų3861.1 Ų61.123%0.2331%0.309CS..Hα-helixtrans-63.5-45.1174.9-179.80000110.6F21 I25 E28 P29 L30 F34 L35 I36F21-V32 HydrophobicContact CE2-CG2 4.35Å; I25-V32 HydrophobicContact CG2-CG2 4Å; E28-V32 PolarHBondContact O-N 2.75Å; P29-V32 WeakPolarHBondContact O-CB 3.34Å; P29-V32 PolarHBondContact O-N 2.86Å; P29-V32 VanDerWaalsContact O-N 3.12Å; L30-V32 VanDerWaalsContact C-N 3.34Å; V32-F34 VanDerWaalsContact C-N 3.35Å; V32-F34 PolarHBondContact O-N 2.95Å; V32-L35 PolarHBondContact O-N 2.72Å; V32-I36 HydrophobicContact CG1-CD1 3.88Å; V32-I36 HydrophobicContact CG1-CG1 4.49Å; V32-I36 WeakPolarHBondContact O-CG1 3.46Å; V32-I36 PolarHBondContact O-N 3.02Å
33I94.9Very high95.5Very high99 Ų9959.2 Ų59.251%0.50830%0.299SS..Hα-helixtrans-59.4-46.2177.9-65.2169000110.7P29 L30 I36 A37P29-I33 WeakPolarHBondContact O-CG1 3.18Å; P29-I33 PolarHBondContact O-N 2.97Å; L30-I33 PolarHBondContact O-N 2.96Å; I33-I36 PolarHBondContact O-N 3.35Å; I33-A37 WeakPolarHBondContact O-CB 3.4Å; I33-A37 PolarHBondContact O-N 3.29Å
34F94.2Very high95.6Very high20 Ų2054.4 Ų54.49%0.08828%0.281CS..Hα-helixtrans-67.8-35.5177.5-63.4-31.9000112.9L30 R31 V32 I36 A37 G38 Y90 L94 L101 I112 L117 V120L30-F34 WeakPolarHBondContact O-CD2 3.2Å; L30-F34 WeakPolarHBondContact O-CG 3.41Å; L30-F34 PolarHBondContact O-N 2.56Å; R31-F34 PolarHBondContact O-N 2.98Å; V32-F34 VanDerWaalsContact C-N 3.35Å; V32-F34 PolarHBondContact O-N 2.95Å; F34-I36 PolarHBondContact O-N 3.35Å; F34-A37 PolarHBondContact O-N 2.86Å; F34-G38 PolarHBondContact O-N 3Å; F34-Y90 WeakPolarHBondContact CA-OH 3.45Å; F34-Y90 PolarHBondContact O-OH 2.79Å; F34-L94 HydrophobicContact CB-CD2 4.4Å; F34-L94 HydrophobicContact CD1-CD2 3.47Å; F34-L94 VanDerWaalsContact CD1-CD2 3.47Å; F34-L94 HydrophobicContact CD2-CD2 4.42Å; F34-L94 HydrophobicContact CE1-CD2 3.71Å; F34-L94 HydrophobicContact CG-CD2 3.86Å; F34-L94 HydrophobicContact CZ-CD2 4.28Å; F34-L101 HydrophobicContact CZ-CD1 4.48Å; F34-I112 HydrophobicContact CD2-CD1 3.9Å; F34-I112 HydrophobicContact CE2-CD1 3.6Å; F34-L117 HydrophobicContact CD2-CD2 3.28Å; F34-L117 HydrophobicContact CE2-CD2 3.36Å; F34-L117 HydrophobicContact CG-CD2 4.14Å; F34-L117 HydrophobicContact CZ-CD2 4.28Å; F34-V120 HydrophobicContact CB-CG1 3.93Å
35L97.4Very high95.8Very high16 Ų1652.4 Ų52.48%0.08427%0.269CS..Hα-helixtrans-60.2-47.5173.2-176.9141.4000111.3F21 I25 R31 V32 G38 A39 V120 L123 F127F21-L35 HydrophobicContact CD2-CD1 4.07Å; I25-L35 HydrophobicContact CD1-CD1 3.4Å; I25-L35 HydrophobicContact CG2-CB 4.48Å; I25-L35 HydrophobicContact CG2-CD1 4.29Å; R31-L35 WeakPolarHBondContact O-CB 3.21Å; R31-L35 PolarHBondContact O-N 3.48Å; V32-L35 PolarHBondContact O-N 2.72Å; L35-G38 PolarHBondContact O-N 2.91Å; L35-A39 PolarHBondContact O-N 2.86Å; L35-V120 HydrophobicContact CB-CG1 3.85Å; L35-L123 HydrophobicContact CD1-CG 4.34Å; L35-F127 HydrophobicContact CD1-CD2 4.17Å; L35-F127 HydrophobicContact CD1-CE2 4.33Å
36I97.8Very high96Very high106 Ų10654.4 Ų54.454%0.54428%0.279SS..Hα-helixtrans-64-43.4179.9-66.7168.7000110.6V32 I33 F34 G38 A39 F40V32-I36 HydrophobicContact CG1-CD1 3.88Å; V32-I36 HydrophobicContact CG1-CG1 4.49Å; V32-I36 WeakPolarHBondContact O-CG1 3.46Å; V32-I36 PolarHBondContact O-N 3.02Å; I33-I36 PolarHBondContact O-N 3.35Å; F34-I36 PolarHBondContact O-N 3.35Å; I36-G38 VanDerWaalsContact C-N 3.34Å; I36-G38 PolarHBondContact O-N 3.41Å; I36-A39 WeakPolarHBondContact O-CB 3.09Å; I36-A39 PolarHBondContact O-N 3.29Å; I36-F40 PolarHBondContact O-N 3.23Å
37A97.1Very high96.2Very high29 Ų2957.6 Ų57.624%0.2429%0.289CS..Hα-helixtrans-61.9-41.1175.700000111.8I33 F34 F40 F41 Y90I33-A37 WeakPolarHBondContact O-CB 3.4Å; I33-A37 PolarHBondContact O-N 3.29Å; F34-A37 PolarHBondContact O-N 2.86Å; A37-F40 WeakPolarHBondContact O-CB 3.42Å; A37-F40 PolarHBondContact O-N 3.05Å; A37-F41 WeakPolarHBondContact O-CD2 3.37Å; A37-F41 PolarHBondContact O-N 3.16Å; A37-Y90 HydrophobicContact CB-CE2 3.85Å
38G97.4Very high96.5Very high0 Ų051.7 Ų51.70%027%0.272CS..Hα-helixtrans-60.1-46.1173.700000112.7F34 L35 I36 F40 F41 W42 Y90 F125F34-G38 PolarHBondContact O-N 3Å; L35-G38 PolarHBondContact O-N 2.91Å; I36-G38 VanDerWaalsContact C-N 3.34Å; I36-G38 PolarHBondContact O-N 3.41Å; G38-F40 VanDerWaalsContact C-N 3.3Å; G38-F40 PolarHBondContact O-N 3.39Å; G38-F41 PolarHBondContact O-N 3.22Å; G38-W42 PolarHBondContact O-N 2.9Å; G38-Y90 PolarHBondContact N-OH 2.88Å; G38-F125 VanDerWaalsContact O-CD2 3.31Å; G38-F125 WeakPolarHBondContact O-CD2 3.36Å; G38-F125 WeakPolarHBondContact O-CE2 3.39Å
39A98.3Very high96.8Very high10 Ų1048.4 Ų48.48%0.08326%0.257CS..Hα-helixtrans-59.3-40.3174.600000112.3L35 I36 W42 L43 M128L35-A39 PolarHBondContact O-N 2.86Å; I36-A39 WeakPolarHBondContact O-CB 3.09Å; I36-A39 PolarHBondContact O-N 3.29Å; A39-W42 WeakPolarHBondContact O-CB 3.45Å; A39-W42 PolarHBondContact O-N 3.49Å; A39-L43 WeakPolarHBondContact O-CG 3.24Å; A39-L43 PolarHBondContact O-N 3.46Å; A39-M128 HydrophobicContact CB-CB 3.95Å; A39-M128 HydrophobicContact CB-CE 3.88Å
40F98.2Very high97.1Very high121 Ų12146.3 Ų46.353%0.53125%0.245SC..Hα-helixtrans-63.5-45.7174.8175.9-101.3000112.5I36 A37 G38 W42 L43 V44I36-F40 PolarHBondContact O-N 3.23Å; A37-F40 WeakPolarHBondContact O-CB 3.42Å; A37-F40 PolarHBondContact O-N 3.05Å; G38-F40 VanDerWaalsContact C-N 3.3Å; G38-F40 PolarHBondContact O-N 3.39Å; F40-W42 VanDerWaalsContact C-N 3.26Å; F40-W42 PolarHBondContact O-N 2.91Å; F40-L43 WeakPolarHBondContact O-CB 3.47Å; F40-L43 PolarHBondContact O-N 3.49Å; F40-L43 VanDerWaalsContact O-N 3.07Å; F40-V44 HydrophobicContact CD1-CG2 4.22Å; F40-V44 HydrophobicContact CD2-CG2 4.49Å; F40-V44 HydrophobicContact CE1-CG2 3.74Å; F40-V44 HydrophobicContact CE2-CG2 4.05Å; F40-V44 HydrophobicContact CZ-CG2 3.64Å; F40-V44 WeakPolarHBondContact O-CG2 3.42Å; F40-V44 PolarHBondContact O-N 2.9Å
41F98.2Very high97.4Very high39 Ų3947.4 Ų47.417%0.17125%0.251CS..Hα-helixtrans-60.9-36.6176.4-92-106000112.2A37 G38 V44 S45 F86 A89 Y90 L93 F125A37-F41 WeakPolarHBondContact O-CD2 3.37Å; A37-F41 PolarHBondContact O-N 3.16Å; G38-F41 PolarHBondContact O-N 3.22Å; F41-V44 PolarHBondContact O-N 3.32Å; F41-S45 PolarHBondContact O-N 3.28Å; F41-F86 HydrophobicContact CB-CD1 4.49Å; F41-F86 AromaticContact CD1-CD1 3.77Å; F41-F86 HydrophobicContact CD1-CD1 3.77Å; F41-F86 HydrophobicContact CE1-CD1 4.46Å; F41-F86 HydrophobicContact CG-CD1 4.49Å; F41-F86 WeakPolarHBondContact O-CD1 3.22Å; F41-A89 HydrophobicContact CE1-CB 4.48Å; F41-Y90 HydrophobicContact CB-CG 4.45Å; F41-Y90 HydrophobicContact CD1-CD2 4.23Å; F41-Y90 HydrophobicContact CD1-CG 4.36Å; F41-Y90 AromaticContact CD2-CD2 3.65Å; F41-Y90 HydrophobicContact CD2-CD2 3.65Å; F41-Y90 HydrophobicContact CD2-CE2 4.18Å; F41-Y90 HydrophobicContact CD2-CG 4.34Å; F41-Y90 HydrophobicContact CE1-CD2 4.4Å; F41-Y90 AromaticContact CE2-CD2 3.82Å; F41-Y90 HydrophobicContact CE2-CD2 3.82Å; F41-Y90 HydrophobicContact CE2-CE2 4.34Å; F41-Y90 AromaticContact CG-CD2 3.88Å; F41-Y90 HydrophobicContact CG-CD2 3.88Å; F41-Y90 HydrophobicContact CG-CG 4.13Å; F41-Y90 HydrophobicContact CZ-CD2 4.21Å; F41-L93 HydrophobicContact CE2-CD1 4.21Å; F41-L93 HydrophobicContact CZ-CD1 3.72Å; F41-F125 HydrophobicContact CB-CE2 4.19Å; F41-F125 HydrophobicContact CB-CZ 4.21Å
42W98.6Very high97.6Very high8 Ų848.6 Ų48.63%0.0326%0.262CS..Hα-helixtrans-61.8-45.8172-174.190.9000111.6G38 A39 F40 V44 S45 L46 Q83 F125 M128 F132G38-W42 PolarHBondContact O-N 2.9Å; A39-W42 WeakPolarHBondContact O-CB 3.45Å; A39-W42 PolarHBondContact O-N 3.49Å; F40-W42 VanDerWaalsContact C-N 3.26Å; F40-W42 PolarHBondContact O-N 2.91Å; W42-V44 PolarHBondContact O-N 3.38Å; W42-S45 WeakPolarHBondContact O-CB 3.1Å; W42-S45 PolarHBondContact O-N 3.15Å; W42-S45 PolarHBondContact O-OG 3.36Å; W42-L46 HydrophobicContact CH2-CD2 3.61Å; W42-L46 HydrophobicContact CH2-CG 4.49Å; W42-L46 HydrophobicContact CZ2-CD2 4.46Å; W42-L46 HydrophobicContact CZ3-CB 4.38Å; W42-L46 HydrophobicContact CZ3-CD2 3.76Å; W42-L46 PolarHBondContact O-N 3.5Å; W42-Q83 VanDerWaalsContact NE1-CD 3.34Å; W42-F125 HydrophobicContact CB-CD1 4.11Å; W42-F125 HydrophobicContact CB-CD2 4.37Å; W42-F125 HydrophobicContact CB-CE1 4.25Å; W42-F125 HydrophobicContact CB-CG 4.15Å; W42-F125 HydrophobicContact CB-CZ 4.46Å; W42-F125 AromaticContact CD1-CD1 3.58Å; W42-F125 HydrophobicContact CG-CD1 4.24Å; W42-M128 HydrophobicContact CD2-CB 4.23Å; W42-M128 HydrophobicContact CD2-CG 4.14Å; W42-M128 HydrophobicContact CE3-CB 3.84Å; W42-M128 HydrophobicContact CE3-CG 3.28Å; W42-M128 HydrophobicContact CZ3-CB 4.42Å; W42-M128 HydrophobicContact CZ3-CG 3.67Å; W42-F132 HydrophobicContact CH2-CB 3.59Å; W42-F132 HydrophobicContact CH2-CD1 4.22Å; W42-F132 HydrophobicContact CH2-CD2 4.17Å; W42-F132 AromaticContact CH2-CG 3.72Å; W42-F132 HydrophobicContact CH2-CG 3.72Å; W42-F132 HydrophobicContact CZ3-CB 3.99Å; W42-F132 HydrophobicContact CZ3-CD1 4.24Å; W42-F132 AromaticContact CZ3-CD2 3.66Å; W42-F132 HydrophobicContact CZ3-CD2 3.66Å; W42-F132 HydrophobicContact CZ3-CE2 4.23Å; W42-F132 AromaticContact CZ3-CG 3.67Å; W42-F132 HydrophobicContact CZ3-CG 3.67Å
43L98.4Very high97.7Very high55 Ų5551 Ų5129%0.28827%0.266SS..Hα-helixtrans-59.9-44.1176.7-71.2171.6000112.7A39 F40 S45 L46 L47 M128 F132A39-L43 WeakPolarHBondContact O-CG 3.24Å; A39-L43 PolarHBondContact O-N 3.46Å; F40-L43 WeakPolarHBondContact O-CB 3.47Å; F40-L43 PolarHBondContact O-N 3.49Å; F40-L43 VanDerWaalsContact O-N 3.07Å; L43-S45 VanDerWaalsContact C-N 3.3Å; L43-S45 PolarHBondContact O-N 3.06Å; L43-L46 PolarHBondContact O-N 3.32Å; L43-L47 WeakPolarHBondContact O-CB 3.36Å; L43-L47 PolarHBondContact O-N 2.86Å; L43-M128 HydrophobicContact CD1-CE 3.84Å; L43-M128 HydrophobicContact CD1-CG 4.37Å; L43-M128 HydrophobicContact CD1-SD 4.1Å; L43-M128 HydrophobicContact CD2-CG 3.7Å; L43-M128 HydrophobicContact CD2-SD 3.73Å; L43-M128 HydrophobicContact CG-CE 4.27Å; L43-M128 HydrophobicContact CG-CG 3.75Å; L43-M128 HydrophobicContact CG-SD 4.02Å; L43-F132 HydrophobicContact CD2-CD2 4.01Å; L43-F132 HydrophobicContact CD2-CE2 3.23Å; L43-F132 HydrophobicContact CD2-CZ 3.64Å
44V98.6Very high97.8Very high40 Ų4051.4 Ų51.424%0.24227%0.265CS..Hα-helixtrans-63-40.6178.1-1800000110.5F40 F41 W42 L46 L47 L48 F86F40-V44 HydrophobicContact CD1-CG2 4.22Å; F40-V44 HydrophobicContact CD2-CG2 4.49Å; F40-V44 HydrophobicContact CE1-CG2 3.74Å; F40-V44 HydrophobicContact CE2-CG2 4.05Å; F40-V44 HydrophobicContact CZ-CG2 3.64Å; F40-V44 WeakPolarHBondContact O-CG2 3.42Å; F40-V44 PolarHBondContact O-N 2.9Å; F41-V44 PolarHBondContact O-N 3.32Å; W42-V44 PolarHBondContact O-N 3.38Å; V44-L46 VanDerWaalsContact C-N 3.33Å; V44-L46 PolarHBondContact O-N 3.48Å; V44-L47 PolarHBondContact O-N 3.36Å; V44-L48 WeakPolarHBondContact O-CG 3.36Å; V44-L48 PolarHBondContact O-N 2.88Å; V44-F86 HydrophobicContact CB-CD1 4.34Å; V44-F86 HydrophobicContact CB-CE1 3.79Å; V44-F86 HydrophobicContact CB-CZ 4.48Å; V44-F86 HydrophobicContact CG1-CD1 4.39Å; V44-F86 HydrophobicContact CG1-CE1 3.4Å; V44-F86 VanDerWaalsContact CG1-CE1 3.4Å; V44-F86 HydrophobicContact CG1-CZ 3.73Å
45S98.4Very high97.9Very high0 Ų054.4 Ų54.40%028%0.281CS..Hα-helixtrans-61.4-41.3176.379.70000112.4F41 W42 L43 A49 Q83F41-S45 PolarHBondContact O-N 3.28Å; W42-S45 WeakPolarHBondContact O-CB 3.1Å; W42-S45 PolarHBondContact O-N 3.15Å; W42-S45 PolarHBondContact O-OG 3.36Å; L43-S45 VanDerWaalsContact C-N 3.3Å; L43-S45 PolarHBondContact O-N 3.06Å; S45-A49 WeakPolarHBondContact O-CB 3.29Å; S45-A49 PolarHBondContact O-N 3.41Å; S45-A49 VanDerWaalsContact O-N 3.08Å; S45-Q83 VanDerWaalsContact OG-CG 3.24Å; S45-Q83 WeakPolarHBondContact OG-CG 3.47Å
46L98Very high97.8Very high43 Ų4355.3 Ų55.323%0.22529%0.289CS..Hα-helixtrans-70.7-38.9177.3-172.670.9000111.7W42 L43 V44 L48 A49 S50 F132W42-L46 HydrophobicContact CH2-CD2 3.61Å; W42-L46 HydrophobicContact CH2-CG 4.49Å; W42-L46 HydrophobicContact CZ2-CD2 4.46Å; W42-L46 HydrophobicContact CZ3-CB 4.38Å; W42-L46 HydrophobicContact CZ3-CD2 3.76Å; W42-L46 PolarHBondContact O-N 3.5Å; L43-L46 PolarHBondContact O-N 3.32Å; V44-L46 VanDerWaalsContact C-N 3.33Å; V44-L46 PolarHBondContact O-N 3.48Å; L46-L48 VanDerWaalsContact C-N 3.35Å; L46-L48 PolarHBondContact O-N 3.36Å; L46-A49 PolarHBondContact O-N 3.3Å; L46-S50 VanDerWaalsContact O-CB 3.31Å; L46-S50 WeakPolarHBondContact O-CB 3.44Å; L46-S50 PolarHBondContact O-N 2.91Å; L46-S50 PolarHBondContact O-OG 3.36Å; L46-F132 HydrophobicContact CD2-CD1 3.45Å; L46-F132 VanDerWaalsContact CD2-CD1 3.45Å; L46-F132 HydrophobicContact CD2-CE1 3.51Å; L46-F132 HydrophobicContact CD2-CG 4.22Å; L46-F132 HydrophobicContact CD2-CZ 4.33Å
47L98.3Very high97.7Very high114 Ų11451.2 Ų51.260%0.59727%0.269SS*.Hα-helixtrans-57.4-49.3176.2178.665000110.5L43 V44 A49 S50 L51L43-L47 WeakPolarHBondContact O-CB 3.36Å; L43-L47 PolarHBondContact O-N 2.86Å; V44-L47 PolarHBondContact O-N 3.36Å; L47-A49 PolarHBondContact O-N 2.96Å; L47-S50 PolarHBondContact O-N 2.66Å; L47-S50 PolarHBondContact O-OG 3.32Å; L47-L51 PolarHBondContact O-N 3.41Å
48L98.3Very high97.6Very high72 Ų7254.5 Ų54.538%0.37728%0.279SS..Hα-helixtrans-63.1-42.8176.8-66.2178.4000112.3V44 L46 S50 L51 V52 L82 F86V44-L48 WeakPolarHBondContact O-CG 3.36Å; V44-L48 PolarHBondContact O-N 2.88Å; L46-L48 VanDerWaalsContact C-N 3.35Å; L46-L48 PolarHBondContact O-N 3.36Å; L48-S50 VanDerWaalsContact C-N 3.34Å; L48-S50 PolarHBondContact O-N 3.03Å; L48-L51 PolarHBondContact O-N 2.89Å; L48-V52 WeakPolarHBondContact O-CG2 3.22Å; L48-V52 PolarHBondContact O-N 3.4Å; L48-V52 VanDerWaalsContact O-N 3.14Å; L48-L82 HydrophobicContact CB-CD1 4.14Å; L48-F86 HydrophobicContact CD1-CE2 3.71Å; L48-F86 HydrophobicContact CD1-CZ 3.52Å
49A98.2Very high97.5Very high3 Ų361.3 Ų61.33%0.02531%0.314CS..Hα-helixtrans-60.7-44.4176.500000111.9S45 L46 L47 L51 V52 W53 L82S45-A49 WeakPolarHBondContact O-CB 3.29Å; S45-A49 PolarHBondContact O-N 3.41Å; S45-A49 VanDerWaalsContact O-N 3.08Å; L46-A49 PolarHBondContact O-N 3.3Å; L47-A49 PolarHBondContact O-N 2.96Å; A49-L51 VanDerWaalsContact C-N 3.35Å; A49-L51 PolarHBondContact O-N 3.47Å; A49-V52 PolarHBondContact O-N 3.11Å; A49-W53 WeakPolarHBondContact O-CB 3.39Å; A49-W53 PolarHBondContact O-N 3.38Å; A49-L82 HydrophobicContact CB-CD1 3.8Å
50S97.6Very high97.2Very high54 Ų5461.7 Ų61.738%0.37832%0.316SS..Hα-helixtrans-65.4-36179.173.90000112.4L46 L47 L48 W53 F54L46-S50 VanDerWaalsContact O-CB 3.31Å; L46-S50 WeakPolarHBondContact O-CB 3.44Å; L46-S50 PolarHBondContact O-N 2.91Å; L46-S50 PolarHBondContact O-OG 3.36Å; L47-S50 PolarHBondContact O-N 2.66Å; L47-S50 PolarHBondContact O-OG 3.32Å; L48-S50 VanDerWaalsContact C-N 3.34Å; L48-S50 PolarHBondContact O-N 3.03Å; S50-W53 PolarHBondContact O-N 3.33Å; S50-F54 WeakPolarHBondContact O-CB 3.42Å; S50-F54 PolarHBondContact O-N 3.01Å
51L97.9Very high96.8Very high94 Ų9459.9 Ų59.949%0.49231%0.312SS..Hα-helixtrans-65-46.8175.6-179.562.8000111.4L47 L48 A49 F54 I55L47-L51 PolarHBondContact O-N 3.41Å; L48-L51 PolarHBondContact O-N 2.89Å; A49-L51 VanDerWaalsContact C-N 3.35Å; A49-L51 PolarHBondContact O-N 3.47Å; L51-F54 PolarHBondContact O-N 3.48Å; L51-I55 HydrophobicContact CD1-CD1 4.16Å; L51-I55 HydrophobicContact CD1-CG1 4.5Å; L51-I55 HydrophobicContact CG-CD1 4.1Å; L51-I55 WeakPolarHBondContact O-CG1 3.08Å; L51-I55 PolarHBondContact O-N 2.9Å
52V97.8Very high96.5Very high60 Ų6063.8 Ų63.836%0.36433%0.329SS..Hα-helixtrans-63.9-43.6177.2176.90000110.9L48 A49 S56 F74 L78L48-V52 WeakPolarHBondContact O-CG2 3.22Å; L48-V52 PolarHBondContact O-N 3.4Å; L48-V52 VanDerWaalsContact O-N 3.14Å; A49-V52 PolarHBondContact O-N 3.11Å; V52-S56 WeakPolarHBondContact O-CB 3.12Å; V52-S56 PolarHBondContact O-N 3.11Å; V52-S56 PolarHBondContact O-OG 3.29Å; V52-F74 HydrophobicContact CG1-CE1 4.28Å; V52-F74 HydrophobicContact CG1-CZ 4.45Å; V52-L78 HydrophobicContact CB-CD2 3.61Å; V52-L78 HydrophobicContact CG1-CD2 3.41Å; V52-L78 VanDerWaalsContact CG1-CD2 3.41Å; V52-L78 HydrophobicContact CG2-CD2 4.24Å
53W97.5Very high96.2Very high87 Ų8772 Ų7233%0.3337%0.367SS..Hα-helixtrans-61.1-44.9174.9177.783.2000111.8A49 S50 I55 S56 V57 L71 L72A49-W53 WeakPolarHBondContact O-CB 3.39Å; A49-W53 PolarHBondContact O-N 3.38Å; S50-W53 PolarHBondContact O-N 3.33Å; W53-I55 PolarHBondContact O-N 2.87Å; W53-S56 WeakPolarHBondContact O-CB 3.45Å; W53-S56 PolarHBondContact O-N 3.38Å; W53-V57 HydrophobicContact CD2-CG2 4.03Å; W53-V57 HydrophobicContact CE3-CG2 4.42Å; W53-V57 HydrophobicContact CH2-CG2 4.12Å; W53-V57 HydrophobicContact CZ2-CG2 3.68Å; W53-V57 HydrophobicContact CZ3-CG2 4.47Å; W53-V57 WeakPolarHBondContact O-CG2 3.42Å; W53-V57 PolarHBondContact O-N 2.8Å; W53-L71 VanDerWaalsContact CD1-O 3.28Å; W53-L71 PolarHBondContact NE1-O 3.5Å; W53-L72 HydrophobicContact CZ2-CD2 3.77Å
54F96.8Very high95.9Very high108 Ų10871 Ų7147%0.47437%0.365SS..Hα-helixtrans-60-48.6178.5177.9-97.5000111.9S50 L51 S56 V57 Q58S50-F54 WeakPolarHBondContact O-CB 3.42Å; S50-F54 PolarHBondContact O-N 3.01Å; L51-F54 PolarHBondContact O-N 3.48Å; F54-S56 VanDerWaalsContact C-N 3.29Å; F54-S56 PolarHBondContact O-N 3.43Å; F54-V57 PolarHBondContact O-N 3.41Å; F54-Q58 HydrophobicContact CD1-CG 4.33Å; F54-Q58 HydrophobicContact CE1-CG 3.98Å; F54-Q58 HydrophobicContact CE2-CG 4.43Å; F54-Q58 HydrophobicContact CZ-CG 4.04Å; F54-Q58 VanDerWaalsContact CZ-NE2 3.26Å; F54-Q58 WeakPolarHBondContact O-CG 3.34Å; F54-Q58 PolarHBondContact O-N 2.92Å
55I96.9Very high95.7Very high84 Ų8473 Ų7343%0.43139%0.385SS..Hα-helixtrans-59.2-43.4176-67.2166.5000110.3L51 W53 V57 Q58 I59L51-I55 HydrophobicContact CD1-CD1 4.16Å; L51-I55 HydrophobicContact CD1-CG1 4.5Å; L51-I55 HydrophobicContact CG-CD1 4.1Å; L51-I55 WeakPolarHBondContact O-CG1 3.08Å; L51-I55 PolarHBondContact O-N 2.9Å; W53-I55 PolarHBondContact O-N 2.87Å; I55-V57 VanDerWaalsContact C-N 3.33Å; I55-V57 PolarHBondContact O-N 3Å; I55-Q58 PolarHBondContact O-N 2.9Å; I55-I59 HydrophobicContact CG2-CD1 3.7Å; I55-I59 WeakPolarHBondContact O-CG1 3.4Å; I55-I59 PolarHBondContact O-N 3.22Å
56S95.3Very high95.4Very high35 Ų3577.4 Ų77.425%0.24542%0.416CS..Hα-helixtrans-59.9-43178.3-56.90000111.7V52 W53 F54 I59 S60 L71V52-S56 WeakPolarHBondContact O-CB 3.12Å; V52-S56 PolarHBondContact O-N 3.11Å; V52-S56 PolarHBondContact O-OG 3.29Å; W53-S56 WeakPolarHBondContact O-CB 3.45Å; W53-S56 PolarHBondContact O-N 3.38Å; F54-S56 VanDerWaalsContact C-N 3.29Å; F54-S56 PolarHBondContact O-N 3.43Å; S56-I59 PolarHBondContact O-N 3.12Å; S56-S60 VanDerWaalsContact O-CB 3.29Å; S56-S60 WeakPolarHBondContact O-CB 3.3Å; S56-S60 PolarHBondContact O-N 2.94Å; S56-L71 VanDerWaalsContact C-CD2 3.47Å; S56-L71 WeakPolarHBondContact O-CD2 3.32Å
57V95.3Very high95.2Very high20 Ų2078.9 Ų78.912%0.12142%0.422CS..Hα-helixtrans-65.1-41.5177.61710000111.6W53 F54 I55 I59 S60 L71W53-V57 HydrophobicContact CD2-CG2 4.03Å; W53-V57 HydrophobicContact CE3-CG2 4.42Å; W53-V57 HydrophobicContact CH2-CG2 4.12Å; W53-V57 HydrophobicContact CZ2-CG2 3.68Å; W53-V57 HydrophobicContact CZ3-CG2 4.47Å; W53-V57 WeakPolarHBondContact O-CG2 3.42Å; W53-V57 PolarHBondContact O-N 2.8Å; F54-V57 PolarHBondContact O-N 3.41Å; I55-V57 VanDerWaalsContact C-N 3.33Å; I55-V57 PolarHBondContact O-N 3Å; V57-I59 VanDerWaalsContact C-N 3.3Å; V57-I59 PolarHBondContact O-N 3.46Å; V57-S60 WeakPolarHBondContact CA-OG 3.35Å; V57-S60 PolarHBondContact O-N 3.44Å; V57-S60 PolarHBondContact O-OG 2.86Å; V57-L71 HydrophobicContact CB-CD2 4.31Å; V57-L71 HydrophobicContact CG2-CD2 3.71Å
58Q95.3Very high95Very high98 Ų9875.4 Ų75.446%0.45840%0.403SS..Hα-helixtrans-66.9-30.4-179-65.3-63.21.600113.4F54 I55F54-Q58 HydrophobicContact CD1-CG 4.33Å; F54-Q58 HydrophobicContact CE1-CG 3.98Å; F54-Q58 HydrophobicContact CE2-CG 4.43Å; F54-Q58 HydrophobicContact CZ-CG 4.04Å; F54-Q58 VanDerWaalsContact CZ-NE2 3.26Å; F54-Q58 WeakPolarHBondContact O-CG 3.34Å; F54-Q58 PolarHBondContact O-N 2.92Å; I55-Q58 PolarHBondContact O-N 2.9Å
59I94.8Very high94.8Very high143 Ų14378.8 Ų78.873%0.73342%0.415SS*.Hα-helixtrans-83.9-23.6177-60.1166.9000111.1I55 S56 V57I55-I59 HydrophobicContact CG2-CD1 3.7Å; I55-I59 WeakPolarHBondContact O-CG1 3.4Å; I55-I59 PolarHBondContact O-N 3.22Å; S56-I59 PolarHBondContact O-N 3.12Å; V57-I59 VanDerWaalsContact C-N 3.3Å; V57-I59 PolarHBondContact O-N 3.46Å
60S92.5Very high94.6Very high17 Ų1780.4 Ų80.412%0.11943%0.432CS..SBendtrans-76.6160.3-178.475.60000113.8S56 V57 K62 Q68S56-S60 VanDerWaalsContact O-CB 3.29Å; S56-S60 WeakPolarHBondContact O-CB 3.3Å; S56-S60 PolarHBondContact O-N 2.94Å; V57-S60 WeakPolarHBondContact CA-OG 3.35Å; V57-S60 PolarHBondContact O-N 3.44Å; V57-S60 PolarHBondContact O-OG 2.86Å; S60-K62 PolarHBondContact O-N 3.25Å; S60-Q68 PolarHBondContact OG-NE2 3.23Å
61N90.3Very high94.5Very high84 Ų8479 Ų7945%0.44942%0.42SS..  trans-75114.6169.2-174.3-3.2000110.2E63 Q68N61-E63 VanDerWaalsContact C-N 3.3Å; N61-E63 PolarHBondContact O-N 2.99Å; N61-E63 WeakPolarHBondContact OD1-CB 3.28Å; N61-E63 PolarHBondContact OD1-N 3.44Å; N61-Q68 PolarHBondContact O-NE2 3.49Å
62K91.9Very high94.4Very high121 Ų12179 Ų7953%0.52642%0.42SS..THydrogen-bonded Turntrans-73.3-19.9-178.6-64.5179.5-175.6172.40113.5S60 S64S60-K62 PolarHBondContact O-N 3.25Å; K62-S64 VanDerWaalsContact C-N 3.33Å
63E91.4Very high94.3Very high180 Ų18079.4 Ų79.484%0.84142%0.419SS*.THydrogen-bonded Turntrans-78.5-21.3179.8-59.7-176.9168.700112.3N61 A65N61-E63 VanDerWaalsContact C-N 3.3Å; N61-E63 PolarHBondContact O-N 2.99Å; N61-E63 WeakPolarHBondContact OD1-CB 3.28Å; N61-E63 PolarHBondContact OD1-N 3.44Å; E63-A65 PolarHBondContact O-N 3.01Å
64S93.5Very high94.3Very high34 Ų3479.9 Ų79.924%0.23842%0.423CS..  trans-86101-179.3-179.30000111.8K62 S66 Q67 Q68K62-S64 VanDerWaalsContact C-N 3.33Å; S64-S66 VanDerWaalsContact C-N 3.28Å; S64-S66 PolarHBondContact O-N 3.04Å; S64-S66 PolarHBondContact OG-OG 2.86Å; S64-Q67 PolarHBondContact O-N 3.32Å; S64-Q67 PolarHBondContact OG-N 3.25Å; S64-Q68 WeakPolarHBondContact O-CG 3.35Å; S64-Q68 PolarHBondContact O-N 2.96Å
65A93.1Very high94.3Very high81 Ų8175.2 Ų75.267%0.66941%0.406SS*.Hα-helixtrans-59.4-35.3178.600000113.4E63 Q68 K69E63-A65 PolarHBondContact O-N 3.01Å; A65-Q68 PolarHBondContact O-N 3.44Å; A65-K69 WeakPolarHBondContact O-CB 3.48Å; A65-K69 PolarHBondContact O-N 2.93Å
66S92.9Very high94.3Very high93 Ų9373.3 Ų73.365%0.6540%0.398SS*.Hα-helixtrans-67.1-40.5177.760.80000111.7S64 K69 G70S64-S66 VanDerWaalsContact C-N 3.28Å; S64-S66 PolarHBondContact O-N 3.04Å; S64-S66 PolarHBondContact OG-OG 2.86Å; S66-K69 PolarHBondContact O-N 3.24Å; S66-G70 PolarHBondContact O-N 3.35Å
67Q93.4Very high94.5Very high75 Ų7574 Ų7435%0.3540%0.401SS..Hα-helixtrans-64.5-47175.7-173.9170.14.600110.5S64 K69 G70 L71S64-Q67 PolarHBondContact O-N 3.32Å; S64-Q67 PolarHBondContact OG-N 3.25Å; Q67-K69 VanDerWaalsContact C-N 3.33Å; Q67-K69 PolarHBondContact O-N 3.35Å; Q67-G70 PolarHBondContact O-N 3.5Å; Q67-G70 VanDerWaalsContact O-N 3.1Å; Q67-L71 HydrophobicContact CG-CD1 3.72Å; Q67-L71 WeakPolarHBondContact O-CD1 3.46Å; Q67-L71 PolarHBondContact O-N 2.94Å
68Q94.6Very high94.6Very high41 Ų4174.8 Ų74.819%0.19240%0.404CS..Hα-helixtrans-60.6-41177.9-64.2-51.3-49.300112.3S60 N61 S64 A65 G70 L71 L72S60-Q68 PolarHBondContact OG-NE2 3.23Å; N61-Q68 PolarHBondContact O-NE2 3.49Å; S64-Q68 WeakPolarHBondContact O-CG 3.35Å; S64-Q68 PolarHBondContact O-N 2.96Å; A65-Q68 PolarHBondContact O-N 3.44Å; Q68-G70 VanDerWaalsContact C-N 3.34Å; Q68-G70 PolarHBondContact O-N 2.85Å; Q68-L71 PolarHBondContact O-N 3.36Å; Q68-L72 WeakPolarHBondContact O-CG 3.5Å; Q68-L72 PolarHBondContact O-N 3.11Å
69K94Very high94.7Very high143 Ų14371 Ų7162%0.62239%0.388SS*.Hα-helixtrans-61.3-42.5173.9-171.7176.6-178.2177.80112A65 S66 Q67 L72 I73A65-K69 WeakPolarHBondContact O-CB 3.48Å; A65-K69 PolarHBondContact O-N 2.93Å; S66-K69 PolarHBondContact O-N 3.24Å; Q67-K69 VanDerWaalsContact C-N 3.33Å; Q67-K69 PolarHBondContact O-N 3.35Å; K69-L72 PolarHBondContact O-N 2.92Å; K69-I73 WeakPolarHBondContact O-CG1 3.32Å; K69-I73 PolarHBondContact O-N 3.07Å; K69-I73 VanDerWaalsContact O-N 3.16Å
70G94.8Very high94.9Very high37 Ų3764.2 Ų64.238%0.38135%0.353SS..Hα-helixtrans-60.8-41.8174.500000112.8S66 Q67 Q68 L72 I73 F74S66-G70 PolarHBondContact O-N 3.35Å; Q67-G70 PolarHBondContact O-N 3.5Å; Q67-G70 VanDerWaalsContact O-N 3.1Å; Q68-G70 VanDerWaalsContact C-N 3.34Å; Q68-G70 PolarHBondContact O-N 2.85Å; G70-L72 VanDerWaalsContact C-N 3.35Å; G70-L72 PolarHBondContact O-N 2.83Å; G70-I73 PolarHBondContact O-N 3.5Å; G70-F74 WeakPolarHBondContact O-CB 3.37Å; G70-F74 PolarHBondContact O-N 3.39Å
71L95.4Very high95.2Very high24 Ų2467 Ų6713%0.12637%0.367CS..Hα-helixtrans-65.1-35.8176.7-90.278.2000112.7W53 S56 V57 Q67 Q68 F74 G75W53-L71 VanDerWaalsContact CD1-O 3.28Å; W53-L71 PolarHBondContact NE1-O 3.5Å; S56-L71 VanDerWaalsContact C-CD2 3.47Å; S56-L71 WeakPolarHBondContact O-CD2 3.32Å; V57-L71 HydrophobicContact CB-CD2 4.31Å; V57-L71 HydrophobicContact CG2-CD2 3.71Å; Q67-L71 HydrophobicContact CG-CD1 3.72Å; Q67-L71 WeakPolarHBondContact O-CD1 3.46Å; Q67-L71 PolarHBondContact O-N 2.94Å; Q68-L71 PolarHBondContact O-N 3.36Å; L71-F74 PolarHBondContact O-N 3.48Å; L71-G75 PolarHBondContact O-N 3.5Å
72L95.1Very high95.6Very high94 Ų9464.7 Ų64.749%0.49235%0.354SS..Hα-helixtrans-64-45.9173.8-71.3172.2000111.5W53 Q68 K69 G70 F74 G75 V76W53-L72 HydrophobicContact CZ2-CD2 3.77Å; Q68-L72 WeakPolarHBondContact O-CG 3.5Å; Q68-L72 PolarHBondContact O-N 3.11Å; K69-L72 PolarHBondContact O-N 2.92Å; G70-L72 VanDerWaalsContact C-N 3.35Å; G70-L72 PolarHBondContact O-N 2.83Å; L72-F74 VanDerWaalsContact C-N 3.35Å; L72-F74 PolarHBondContact O-N 2.71Å; L72-G75 PolarHBondContact O-N 2.68Å; L72-V76 WeakPolarHBondContact O-CG2 3.26Å; L72-V76 PolarHBondContact O-N 3.38Å
73I96.3Very high95.9Very high69 Ų6959.4 Ų59.435%0.35433%0.332SS..Hα-helixtrans-61-46.8176.6-64.8168.5000110.2K69 G70 G75 V76 V77 F205K69-I73 WeakPolarHBondContact O-CG1 3.32Å; K69-I73 PolarHBondContact O-N 3.07Å; K69-I73 VanDerWaalsContact O-N 3.16Å; G70-I73 PolarHBondContact O-N 3.5Å; I73-G75 VanDerWaalsContact C-N 3.35Å; I73-G75 PolarHBondContact O-N 3.21Å; I73-V76 PolarHBondContact O-N 2.96Å; I73-V77 WeakPolarHBondContact O-CG2 3.25Å; I73-V77 PolarHBondContact O-N 2.81Å; I73-F205 HydrophobicContact CB-CE2 4.5Å; I73-F205 HydrophobicContact CB-CZ 4.38Å; I73-F205 HydrophobicContact CG1-CE2 4.2Å; I73-F205 HydrophobicContact CG1-CZ 4.16Å; I73-F205 HydrophobicContact CG2-CE2 4.07Å; I73-F205 HydrophobicContact CG2-CZ 4.35Å
74F96.4Very high96.3Very high96 Ų9651.2 Ų51.242%0.42129%0.293SS..Hα-helixtrans-57.1-47.1174.9167.9-104000111.9V52 G70 L71 L72 V76 V77 L78V52-F74 HydrophobicContact CG1-CE1 4.28Å; V52-F74 HydrophobicContact CG1-CZ 4.45Å; G70-F74 WeakPolarHBondContact O-CB 3.37Å; G70-F74 PolarHBondContact O-N 3.39Å; L71-F74 PolarHBondContact O-N 3.48Å; L72-F74 VanDerWaalsContact C-N 3.35Å; L72-F74 PolarHBondContact O-N 2.71Å; F74-V76 VanDerWaalsContact C-N 3.33Å; F74-V76 PolarHBondContact O-N 3.31Å; F74-V77 PolarHBondContact O-N 2.7Å; F74-L78 HydrophobicContact CE1-CD2 4.14Å; F74-L78 HydrophobicContact CZ-CD2 4.03Å; F74-L78 VanDerWaalsContact O-CB 3.31Å; F74-L78 WeakPolarHBondContact O-CB 3.03Å; F74-L78 PolarHBondContact O-N 2.89Å
75G97.3Very high96.5Very high10 Ų1053.6 Ų53.610%0.10331%0.307CS..Hα-helixtrans-59-42.9178.800000112.4L71 L72 I73 S79L71-G75 PolarHBondContact O-N 3.5Å; L72-G75 PolarHBondContact O-N 2.68Å; I73-G75 VanDerWaalsContact C-N 3.35Å; I73-G75 PolarHBondContact O-N 3.21Å; G75-S79 VanDerWaalsContact O-CB 3.29Å; G75-S79 WeakPolarHBondContact O-CB 3.46Å; G75-S79 PolarHBondContact O-N 3.22Å
76V97.2Very high96.8Very high44 Ų4451.5 Ų51.527%0.26728%0.282SS..Hα-helixtrans-64.2-49.7175.8169.80000111.2L72 I73 F74 L78 S79 V80 F205L72-V76 WeakPolarHBondContact O-CG2 3.26Å; L72-V76 PolarHBondContact O-N 3.38Å; I73-V76 PolarHBondContact O-N 2.96Å; F74-V76 VanDerWaalsContact C-N 3.33Å; F74-V76 PolarHBondContact O-N 3.31Å; V76-L78 VanDerWaalsContact C-N 3.34Å; V76-L78 PolarHBondContact O-N 2.99Å; V76-S79 PolarHBondContact O-N 3.02Å; V76-S79 VanDerWaalsContact O-N 3.16Å; V76-S79 PolarHBondContact O-OG 3.18Å; V76-V80 WeakPolarHBondContact O-CG2 3.29Å; V76-V80 PolarHBondContact O-N 3.37Å; V76-F205 HydrophobicContact CB-CE1 4.24Å; V76-F205 HydrophobicContact CB-CZ 3.74Å; V76-F205 HydrophobicContact CG1-CE1 4.26Å; V76-F205 HydrophobicContact CG1-CZ 3.68Å; V76-F205 HydrophobicContact CG2-CE1 3.95Å; V76-F205 HydrophobicContact CG2-CZ 3.98Å
77V98Very high97Very high51 Ų5147.1 Ų47.131%0.30925%0.251SS..Hα-helixtrans-58.5-47.1178.4171.80000111I73 F74 S79 V80 L81 L198I73-V77 WeakPolarHBondContact O-CG2 3.25Å; I73-V77 PolarHBondContact O-N 2.81Å; F74-V77 PolarHBondContact O-N 2.7Å; V77-S79 VanDerWaalsContact C-N 3.34Å; V77-S79 PolarHBondContact O-N 3.48Å; V77-V80 PolarHBondContact O-N 3.33Å; V77-L81 HydrophobicContact CG1-CD1 4.22Å; V77-L81 WeakPolarHBondContact O-CG 3.42Å; V77-L81 PolarHBondContact O-N 2.95Å; V77-L81 VanDerWaalsContact O-N 3.07Å; V77-L198 HydrophobicContact CB-CD2 4.46Å; V77-L198 HydrophobicContact CG1-CD2 4.08Å; V77-L198 HydrophobicContact CG2-CD2 4.45Å
78L98.3Very high97.2Very high36 Ų3646.8 Ų46.819%0.18825%0.249CC..Hα-helixtrans-60.1-43.7176.7178.464.6000111.6V52 F74 V76 V80 L81 L82V52-L78 HydrophobicContact CB-CD2 3.61Å; V52-L78 HydrophobicContact CG1-CD2 3.41Å; V52-L78 VanDerWaalsContact CG1-CD2 3.41Å; V52-L78 HydrophobicContact CG2-CD2 4.24Å; F74-L78 HydrophobicContact CE1-CD2 4.14Å; F74-L78 HydrophobicContact CZ-CD2 4.03Å; F74-L78 VanDerWaalsContact O-CB 3.31Å; F74-L78 WeakPolarHBondContact O-CB 3.03Å; F74-L78 PolarHBondContact O-N 2.89Å; V76-L78 VanDerWaalsContact C-N 3.34Å; V76-L78 PolarHBondContact O-N 2.99Å; L78-V80 VanDerWaalsContact C-N 3.32Å; L78-V80 PolarHBondContact O-N 3.49Å; L78-L81 PolarHBondContact O-N 3.5Å; L78-L82 HydrophobicContact CD1-CD1 4.21Å; L78-L82 HydrophobicContact CD1-CG 4.32Å; L78-L82 HydrophobicContact CG-CD1 4.09Å; L78-L82 WeakPolarHBondContact O-CB 3.28Å; L78-L82 PolarHBondContact O-N 3.5Å
79S98.3Very high97.4Very high17 Ų1747 Ų4712%0.11926%0.257CS..Hα-helixtrans-61.4-40.817979.10000112G75 V76 V77 L82 Q83G75-S79 VanDerWaalsContact O-CB 3.29Å; G75-S79 WeakPolarHBondContact O-CB 3.46Å; G75-S79 PolarHBondContact O-N 3.22Å; V76-S79 PolarHBondContact O-N 3.02Å; V76-S79 VanDerWaalsContact O-N 3.16Å; V76-S79 PolarHBondContact O-OG 3.18Å; V77-S79 VanDerWaalsContact C-N 3.34Å; V77-S79 PolarHBondContact O-N 3.48Å; S79-L82 PolarHBondContact O-N 2.84Å; S79-Q83 WeakPolarHBondContact O-CB 3.36Å; S79-Q83 WeakPolarHBondContact O-CG 3.4Å; S79-Q83 PolarHBondContact O-N 3.45Å; S79-Q83 PolarHBondContact O-NE2 3.08Å
80V98.6Very high97.6Very high1 Ų140.1 Ų40.11%0.00623%0.228CC..Hα-helixtrans-65-46.3177.61710000110.4V76 V77 L78 L82 Q83 E84 H197 L198 S201V76-V80 WeakPolarHBondContact O-CG2 3.29Å; V76-V80 PolarHBondContact O-N 3.37Å; V77-V80 PolarHBondContact O-N 3.33Å; L78-V80 VanDerWaalsContact C-N 3.32Å; L78-V80 PolarHBondContact O-N 3.49Å; V80-L82 VanDerWaalsContact C-N 3.34Å; V80-L82 PolarHBondContact O-N 2.89Å; V80-Q83 WeakPolarHBondContact O-CB 3.4Å; V80-Q83 PolarHBondContact O-N 3.42Å; V80-E84 WeakPolarHBondContact O-CG 3.08Å; V80-E84 PolarHBondContact O-N 3.41Å; V80-H197 HydrophobicContact CG1-CB 4.07Å; V80-L198 HydrophobicContact CB-CD2 3.8Å; V80-L198 HydrophobicContact CB-CG 4.49Å; V80-L198 HydrophobicContact CG1-CD2 3.6Å; V80-L198 HydrophobicContact CG1-CG 3.74Å; V80-L198 HydrophobicContact CG2-CD2 4.41Å; V80-S201 VanDerWaalsContact CG2-OG 3.28Å; V80-S201 WeakPolarHBondContact CG2-OG 3.44Å
81L98.6Very high97.7Very high77 Ų7738.6 Ų38.640%0.40321%0.21SC..Hα-helixtrans-62.7-40.1178.4-66.2177.2000112.4V77 L78 E84 T85 V194 L198V77-L81 HydrophobicContact CG1-CD1 4.22Å; V77-L81 WeakPolarHBondContact O-CG 3.42Å; V77-L81 PolarHBondContact O-N 2.95Å; V77-L81 VanDerWaalsContact O-N 3.07Å; L78-L81 PolarHBondContact O-N 3.5Å; L81-E84 PolarHBondContact O-N 3.23Å; L81-T85 WeakPolarHBondContact O-CB 3.36Å; L81-T85 PolarHBondContact O-N 2.87Å; L81-T85 PolarHBondContact O-OG1 2.88Å; L81-V194 HydrophobicContact CD2-CG1 4.05Å; L81-L198 HydrophobicContact CD2-CD1 4.29Å
82L98.5Very high97.7Very high35 Ų3542.5 Ų42.518%0.18323%0.226CC..Hα-helixtrans-66.2-42.8174-77.4174.3000111.6L48 A49 L78 S79 V80 E84 T85 F86L48-L82 HydrophobicContact CB-CD1 4.14Å; A49-L82 HydrophobicContact CB-CD1 3.8Å; L78-L82 HydrophobicContact CD1-CD1 4.21Å; L78-L82 HydrophobicContact CD1-CG 4.32Å; L78-L82 HydrophobicContact CG-CD1 4.09Å; L78-L82 WeakPolarHBondContact O-CB 3.28Å; L78-L82 PolarHBondContact O-N 3.5Å; S79-L82 PolarHBondContact O-N 2.84Å; V80-L82 VanDerWaalsContact C-N 3.34Å; V80-L82 PolarHBondContact O-N 2.89Å; L82-E84 VanDerWaalsContact C-N 3.32Å; L82-E84 PolarHBondContact O-N 3.43Å; L82-T85 PolarHBondContact O-N 3.27Å; L82-F86 WeakPolarHBondContact O-CB 3.24Å; L82-F86 VanDerWaalsContact O-CD2 3.29Å; L82-F86 WeakPolarHBondContact O-CD2 3.38Å; L82-F86 PolarHBondContact O-N 3.24Å
83Q98.7Very high97.8Very high10 Ų1042 Ų425%0.04722%0.224CC..Hα-helixtrans-57.8-43.6175.5-76.1172.756.600111.9W42 S45 S79 V80 F86 R87 H197W42-Q83 VanDerWaalsContact NE1-CD 3.34Å; S45-Q83 VanDerWaalsContact OG-CG 3.24Å; S45-Q83 WeakPolarHBondContact OG-CG 3.47Å; S79-Q83 WeakPolarHBondContact O-CB 3.36Å; S79-Q83 WeakPolarHBondContact O-CG 3.4Å; S79-Q83 PolarHBondContact O-N 3.45Å; S79-Q83 PolarHBondContact O-NE2 3.08Å; V80-Q83 WeakPolarHBondContact O-CB 3.4Å; V80-Q83 PolarHBondContact O-N 3.42Å; Q83-F86 PolarHBondContact O-N 3.43Å; Q83-R87 WeakPolarHBondContact O-CB 3.41Å; Q83-R87 PolarHBondContact O-N 3.2Å; Q83-H197 PolarHBondContact OE1-CE1 3.42Å
84E98.5Very high97.6Very high7 Ų738.7 Ų38.73%0.03321%0.207CC..Hα-helixtrans-69.3-36.6177.5-64.4-56.613600112.5V80 L81 L82 R87 F88 V194 H197V80-E84 WeakPolarHBondContact O-CG 3.08Å; V80-E84 PolarHBondContact O-N 3.41Å; L81-E84 PolarHBondContact O-N 3.23Å; L82-E84 VanDerWaalsContact C-N 3.32Å; L82-E84 PolarHBondContact O-N 3.43Å; E84-R87 WeakPolarHBondContact O-CB 3.28Å; E84-R87 PolarHBondContact O-N 2.94Å; E84-R87 IonicContact OE1-CZ 2.73Å; E84-R87 IonicContact OE1-NH1 3.07Å; E84-R87 PolarHBondContact OE1-NH1 3.5Å; E84-R87 IonicContact OE1-NH2 2.69Å; E84-R87 PolarHBondContact OE1-NH2 2.96Å; E84-R87 IonicContact OE2-CZ 3.77Å; E84-R87 IonicContact OE2-NH1 3.42Å; E84-R87 PolarHBondContact OE2-NH1 3.22Å; E84-R87 IonicContact OE2-NH2 3.7Å; E84-F88 PolarHBondContact O-N 3.27Å; E84-V194 HydrophobicContact CB-CG2 4.01Å; E84-V194 HydrophobicContact CG-CB 4.41Å; E84-V194 HydrophobicContact CG-CG1 4.32Å; E84-V194 HydrophobicContact CG-CG2 3.93Å; E84-H197 IonicContact OE1-CE1 2.71Å; E84-H197 IonicContact OE1-CG 2.71Å; E84-H197 IonicContact OE1-ND1 3.56Å; E84-H197 PolarHBondContact OE1-ND1 3.22Å
85T98.6Very high97.4Very high85 Ų8537.3 Ų37.352%0.52120%0.201SC..Hα-helixtrans-63.4-44.7173.8-58.10000111.1L81 L82 R87 F88 A89L81-T85 WeakPolarHBondContact O-CB 3.36Å; L81-T85 PolarHBondContact O-N 2.87Å; L81-T85 PolarHBondContact O-OG1 2.88Å; L82-T85 PolarHBondContact O-N 3.27Å; T85-R87 VanDerWaalsContact C-N 3.33Å; T85-R87 PolarHBondContact O-N 2.7Å; T85-F88 WeakPolarHBondContact O-CB 3.42Å; T85-F88 PolarHBondContact O-N 3.47Å; T85-A89 PolarHBondContact O-N 3.04Å
86F98.5Very high97.1Very high37 Ų3744.5 Ų44.516%0.16223%0.229CC..Hα-helixtrans-68.3-32.2176.4-89-105000112.1F41 V44 L48 L82 Q83 F88 A89 Y90F41-F86 HydrophobicContact CB-CD1 4.49Å; F41-F86 AromaticContact CD1-CD1 3.77Å; F41-F86 HydrophobicContact CD1-CD1 3.77Å; F41-F86 HydrophobicContact CE1-CD1 4.46Å; F41-F86 HydrophobicContact CG-CD1 4.49Å; F41-F86 WeakPolarHBondContact O-CD1 3.22Å; V44-F86 HydrophobicContact CB-CD1 4.34Å; V44-F86 HydrophobicContact CB-CE1 3.79Å; V44-F86 HydrophobicContact CB-CZ 4.48Å; V44-F86 HydrophobicContact CG1-CD1 4.39Å; V44-F86 HydrophobicContact CG1-CE1 3.4Å; V44-F86 VanDerWaalsContact CG1-CE1 3.4Å; V44-F86 HydrophobicContact CG1-CZ 3.73Å; L48-F86 HydrophobicContact CD1-CE2 3.71Å; L48-F86 HydrophobicContact CD1-CZ 3.52Å; L82-F86 WeakPolarHBondContact O-CB 3.24Å; L82-F86 VanDerWaalsContact O-CD2 3.29Å; L82-F86 WeakPolarHBondContact O-CD2 3.38Å; L82-F86 PolarHBondContact O-N 3.24Å; Q83-F86 PolarHBondContact O-N 3.43Å; F86-F88 VanDerWaalsContact C-N 3.35Å; F86-A89 PolarHBondContact O-N 2.9Å; F86-Y90 WeakPolarHBondContact O-CB 3.29Å; F86-Y90 PolarHBondContact O-N 3.37Å
87R98.4Very high96.8Very high0 Ų044.1 Ų44.10%023%0.23CC..Hα-helixtrans-61.9-43.1170.5-172.2178.9-61.7142.615.2111.4Q83 E84 T85 Y90 Y91 F125 H171 F178 F179Q83-R87 WeakPolarHBondContact O-CB 3.41Å; Q83-R87 PolarHBondContact O-N 3.2Å; E84-R87 WeakPolarHBondContact O-CB 3.28Å; E84-R87 PolarHBondContact O-N 2.94Å; E84-R87 IonicContact OE1-CZ 2.73Å; E84-R87 IonicContact OE1-NH1 3.07Å; E84-R87 PolarHBondContact OE1-NH1 3.5Å; E84-R87 IonicContact OE1-NH2 2.69Å; E84-R87 PolarHBondContact OE1-NH2 2.96Å; E84-R87 IonicContact OE2-CZ 3.77Å; E84-R87 IonicContact OE2-NH1 3.42Å; E84-R87 PolarHBondContact OE2-NH1 3.22Å; E84-R87 IonicContact OE2-NH2 3.7Å; T85-R87 VanDerWaalsContact C-N 3.33Å; T85-R87 PolarHBondContact O-N 2.7Å; R87-Y90 PolarHBondContact O-N 2.83Å; R87-Y91 WeakPolarHBondContact O-CB 3.4Å; R87-Y91 PolarHBondContact O-N 2.86Å; R87-F125 HydrophobicContact CB-CE1 3.99Å; R87-F125 HydrophobicContact CB-CZ 4.09Å; R87-H171 PolarHBondContact NH2-ND1 3.18Å; R87-F178 HydrophobicContact CG-CD1 4.16Å; R87-F178 HydrophobicContact CG-CE1 4.34Å; R87-F178 HydrophobicContact CG-CG 4.39Å; R87-F179 HydrophobicContact CG-CE1 4.26Å
88F98.3Very high96.2Very high69 Ų6942.1 Ų42.130%0.30322%0.218SC..Hα-helixtrans-63.3-46.1174.4-174.1-105.6000112.7E84 T85 F86 Y90 Y91 K92 F178 W187E84-F88 PolarHBondContact O-N 3.27Å; T85-F88 WeakPolarHBondContact O-CB 3.42Å; T85-F88 PolarHBondContact O-N 3.47Å; F86-F88 VanDerWaalsContact C-N 3.35Å; F88-Y90 VanDerWaalsContact C-N 3.28Å; F88-Y90 PolarHBondContact O-N 3.45Å; F88-Y91 HydrophobicContact CD2-CD1 4.27Å; F88-Y91 HydrophobicContact CE2-CD1 4.31Å; F88-Y91 HydrophobicContact CE2-CE1 4.44Å; F88-Y91 WeakPolarHBondContact O-CB 3.18Å; F88-Y91 PolarHBondContact O-N 2.73Å; F88-K92 HydrophobicContact CD1-CG 4.48Å; F88-K92 HydrophobicContact CE1-CG 4.14Å; F88-K92 HydrophobicContact CZ-CD 4.5Å; F88-K92 VanDerWaalsContact CZ-CE 3.44Å; F88-K92 HydrophobicContact CZ-CG 4.3Å; F88-K92 PolarHBondContact O-N 2.93Å; F88-F178 HydrophobicContact CB-CE1 4.01Å; F88-F178 HydrophobicContact CB-CZ 3.85Å; F88-F178 AromaticContact CD2-CE1 3.99Å; F88-F178 HydrophobicContact CD2-CE1 3.99Å; F88-F178 HydrophobicContact CD2-CZ 4.17Å; F88-W187 HydrophobicContact CE2-CH2 4.3Å; F88-W187 HydrophobicContact CE2-CZ3 4.35Å
89A98.1Very high95.7Very high44 Ų4445.4 Ų45.436%0.36423%0.232SC..Hα-helixtrans-59.1-42.7176.300000111.2F41 T85 F86 K92 L93F41-A89 HydrophobicContact CE1-CB 4.48Å; T85-A89 PolarHBondContact O-N 3.04Å; F86-A89 PolarHBondContact O-N 2.9Å; A89-K92 PolarHBondContact O-N 2.78Å; A89-L93 PolarHBondContact O-N 3.37Å
90Y97.2Very high95.2Very high0 Ų046.1 Ų46.10%024%0.243CC..Hα-helixtrans-67.3-40.8178.5-172.4-124.7000112.6F34 A37 G38 F41 F86 R87 F88 K92 L93 L94 S121 F125F34-Y90 WeakPolarHBondContact CA-OH 3.45Å; F34-Y90 PolarHBondContact O-OH 2.79Å; A37-Y90 HydrophobicContact CB-CE2 3.85Å; G38-Y90 PolarHBondContact N-OH 2.88Å; F41-Y90 HydrophobicContact CB-CG 4.45Å; F41-Y90 HydrophobicContact CD1-CD2 4.23Å; F41-Y90 HydrophobicContact CD1-CG 4.36Å; F41-Y90 AromaticContact CD2-CD2 3.65Å; F41-Y90 HydrophobicContact CD2-CD2 3.65Å; F41-Y90 HydrophobicContact CD2-CE2 4.18Å; F41-Y90 HydrophobicContact CD2-CG 4.34Å; F41-Y90 HydrophobicContact CE1-CD2 4.4Å; F41-Y90 AromaticContact CE2-CD2 3.82Å; F41-Y90 HydrophobicContact CE2-CD2 3.82Å; F41-Y90 HydrophobicContact CE2-CE2 4.34Å; F41-Y90 AromaticContact CG-CD2 3.88Å; F41-Y90 HydrophobicContact CG-CD2 3.88Å; F41-Y90 HydrophobicContact CG-CG 4.13Å; F41-Y90 HydrophobicContact CZ-CD2 4.21Å; F86-Y90 WeakPolarHBondContact O-CB 3.29Å; F86-Y90 PolarHBondContact O-N 3.37Å; R87-Y90 PolarHBondContact O-N 2.83Å; F88-Y90 VanDerWaalsContact C-N 3.28Å; F88-Y90 PolarHBondContact O-N 3.45Å; Y90-K92 VanDerWaalsContact C-N 3.34Å; Y90-K92 PolarHBondContact O-N 2.92Å; Y90-L93 PolarHBondContact O-N 3.06Å; Y90-L94 HydrophobicContact CD1-CD1 3.96Å; Y90-L94 HydrophobicContact CD1-CG 4.38Å; Y90-L94 HydrophobicContact CD2-CG 4.3Å; Y90-L94 HydrophobicContact CE1-CD1 3.42Å; Y90-L94 VanDerWaalsContact CE1-CD1 3.42Å; Y90-L94 HydrophobicContact CE1-CG 3.96Å; Y90-L94 HydrophobicContact CE2-CD1 4.24Å; Y90-L94 HydrophobicContact CE2-CD2 4Å; Y90-L94 HydrophobicContact CE2-CG 3.83Å; Y90-L94 WeakPolarHBondContact O-CB 3.28Å; Y90-L94 WeakPolarHBondContact O-CG 3.49Å; Y90-L94 PolarHBondContact O-N 3.27Å; Y90-L94 WeakPolarHBondContact OH-CD2 3.36Å; Y90-S121 WeakPolarHBondContact CD1-OG 3.44Å; Y90-S121 VanDerWaalsContact CE1-OG 3.24Å; Y90-S121 WeakPolarHBondContact CE1-OG 3.32Å; Y90-F125 HydrophobicContact CD1-CE2 4.27Å
91Y96.7Very high94.6Very high4 Ų449.3 Ų49.32%0.01626%0.259CS..Hα-helixtrans-54.5-48.7170155.8-107.1000111.9R87 F88 L93 L94 K95 I114 F179 C182 E183R87-Y91 WeakPolarHBondContact O-CB 3.4Å; R87-Y91 PolarHBondContact O-N 2.86Å; F88-Y91 HydrophobicContact CD2-CD1 4.27Å; F88-Y91 HydrophobicContact CE2-CD1 4.31Å; F88-Y91 HydrophobicContact CE2-CE1 4.44Å; F88-Y91 WeakPolarHBondContact O-CB 3.18Å; F88-Y91 PolarHBondContact O-N 2.73Å; Y91-L93 VanDerWaalsContact C-N 3.33Å; Y91-L93 PolarHBondContact O-N 2.99Å; Y91-L94 PolarHBondContact O-N 2.9Å; Y91-K95 HydrophobicContact CE2-CD 4.48Å; Y91-K95 WeakPolarHBondContact O-CB 3.4Å; Y91-K95 PolarHBondContact O-N 3.49Å; Y91-I114 HydrophobicContact CD2-CD1 4.48Å; Y91-I114 HydrophobicContact CE2-CD1 4.28Å; Y91-F179 HydrophobicContact CD2-CD1 4.35Å; Y91-F179 AromaticContact CD2-CD2 3.76Å; Y91-F179 HydrophobicContact CD2-CD2 3.76Å; Y91-F179 AromaticContact CD2-CE2 4Å; Y91-F179 HydrophobicContact CD2-CE2 4Å; Y91-F179 AromaticContact CD2-CG 3.96Å; Y91-F179 HydrophobicContact CD2-CG 3.96Å; Y91-F179 HydrophobicContact CD2-CZ 4.39Å; Y91-C182 HydrophobicContact CD1-CB 3.99Å; Y91-C182 HydrophobicContact CE1-CB 3.46Å; Y91-C182 VanDerWaalsContact CE1-CB 3.46Å; Y91-C182 HydrophobicContact CE2-CB 4.17Å; Y91-E183 HydrophobicContact CE2-CG 4.22Å; Y91-E183 PolarHBondContact OH-OE1 3.19Å
92K96.6Very high94Very high106 Ų10648.2 Ų48.246%0.46125%0.254SS..Hα-helixtrans-61.8-41.8178.4-71.4-67.6-170.9174.80111.9F88 A89 Y90 K96F88-K92 HydrophobicContact CD1-CG 4.48Å; F88-K92 HydrophobicContact CE1-CG 4.14Å; F88-K92 HydrophobicContact CZ-CD 4.5Å; F88-K92 VanDerWaalsContact CZ-CE 3.44Å; F88-K92 HydrophobicContact CZ-CG 4.3Å; F88-K92 PolarHBondContact O-N 2.93Å; A89-K92 PolarHBondContact O-N 2.78Å; Y90-K92 VanDerWaalsContact C-N 3.34Å; Y90-K92 PolarHBondContact O-N 2.92Å; K92-K96 WeakPolarHBondContact O-CB 3.46Å; K92-K96 PolarHBondContact O-N 3.45Å; K92-K96 VanDerWaalsContact O-N 3.08Å
93L96.3Very high93.4Very high84 Ų8450.8 Ų50.844%0.4428%0.28SS..Hα-helixtrans-62.9-48.3176.4-174.4155000111.1F41 A89 Y90 Y91 K95 K96 A97F41-L93 HydrophobicContact CE2-CD1 4.21Å; F41-L93 HydrophobicContact CZ-CD1 3.72Å; A89-L93 PolarHBondContact O-N 3.37Å; Y90-L93 PolarHBondContact O-N 3.06Å; Y91-L93 VanDerWaalsContact C-N 3.33Å; Y91-L93 PolarHBondContact O-N 2.99Å; L93-K95 VanDerWaalsContact C-N 3.34Å; L93-K95 PolarHBondContact O-N 3.42Å; L93-K96 PolarHBondContact O-N 3.47Å; L93-A97 WeakPolarHBondContact O-CB 3.27Å; L93-A97 PolarHBondContact O-N 2.98Å
94L92.9Very high92.8Very high0 Ų057.6 Ų57.60%032%0.316CS..Hα-helixtrans-61.5-41.9179-78.5-176.7000112.2F34 Y90 Y91 A97 N98 L117 F179F34-L94 HydrophobicContact CB-CD2 4.4Å; F34-L94 HydrophobicContact CD1-CD2 3.47Å; F34-L94 VanDerWaalsContact CD1-CD2 3.47Å; F34-L94 HydrophobicContact CD2-CD2 4.42Å; F34-L94 HydrophobicContact CE1-CD2 3.71Å; F34-L94 HydrophobicContact CG-CD2 3.86Å; F34-L94 HydrophobicContact CZ-CD2 4.28Å; Y90-L94 HydrophobicContact CD1-CD1 3.96Å; Y90-L94 HydrophobicContact CD1-CG 4.38Å; Y90-L94 HydrophobicContact CD2-CG 4.3Å; Y90-L94 HydrophobicContact CE1-CD1 3.42Å; Y90-L94 VanDerWaalsContact CE1-CD1 3.42Å; Y90-L94 HydrophobicContact CE1-CG 3.96Å; Y90-L94 HydrophobicContact CE2-CD1 4.24Å; Y90-L94 HydrophobicContact CE2-CD2 4Å; Y90-L94 HydrophobicContact CE2-CG 3.83Å; Y90-L94 WeakPolarHBondContact O-CB 3.28Å; Y90-L94 WeakPolarHBondContact O-CG 3.49Å; Y90-L94 PolarHBondContact O-N 3.27Å; Y90-L94 WeakPolarHBondContact OH-CD2 3.36Å; Y91-L94 PolarHBondContact O-N 2.9Å; L94-A97 PolarHBondContact O-N 3.46Å; L94-N98 VanDerWaalsContact O-CB 3.3Å; L94-N98 WeakPolarHBondContact O-CB 3.02Å; L94-N98 PolarHBondContact O-N 3.33Å; L94-L117 HydrophobicContact CB-CD1 4.47Å; L94-L117 HydrophobicContact CD1-CB 4.3Å; L94-L117 HydrophobicContact CD1-CD2 4.4Å; L94-L117 HydrophobicContact CD2-CD2 4.37Å; L94-F179 HydrophobicContact CD1-CE2 3.99Å; L94-F179 HydrophobicContact CD1-CZ 4.08Å
95K91.3Very high92Very high67 Ų6759.4 Ų59.429%0.29133%0.329SS..Hα-helixtrans-59.5-49.7175.8-175.7167.4-173.8157.20111.2Y91 L93 A97 N98 E99 E183Y91-K95 HydrophobicContact CE2-CD 4.48Å; Y91-K95 WeakPolarHBondContact O-CB 3.4Å; Y91-K95 PolarHBondContact O-N 3.49Å; L93-K95 VanDerWaalsContact C-N 3.34Å; L93-K95 PolarHBondContact O-N 3.42Å; K95-A97 VanDerWaalsContact C-N 3.34Å; K95-A97 PolarHBondContact O-N 2.73Å; K95-N98 PolarHBondContact O-N 2.83Å; K95-E99 WeakPolarHBondContact CE-OE1 3.42Å; K95-E99 WeakPolarHBondContact CG-OE1 3.39Å; K95-E99 WeakPolarHBondContact O-CG 3.16Å; K95-E99 PolarHBondContact O-N 3.08Å; K95-E183 IonicContact NZ-OE1 2.85Å; K95-E183 PolarHBondContact NZ-OE1 2.69Å; K95-E183 IonicContact NZ-OE2 3.97Å
96K91.9Very high90.9Very high161 Ų16165.1 Ų65.170%0.735%0.35SS*.Hα-helixtrans-62.6-39.5177.4-172.5174.1-177.7178.60112.5K92 L93 G100K92-K96 WeakPolarHBondContact O-CB 3.46Å; K92-K96 PolarHBondContact O-N 3.45Å; K92-K96 VanDerWaalsContact O-N 3.08Å; L93-K96 PolarHBondContact O-N 3.47Å; K96-G100 PolarHBondContact O-N 3.43Å
97A89.8Confident89.7Confident35 Ų3569.1 Ų69.129%0.28937%0.369SS..Hα-helixtrans-65.7-41.9176.700000111.5L93 L94 K95 G100 L101L93-A97 WeakPolarHBondContact O-CB 3.27Å; L93-A97 PolarHBondContact O-N 2.98Å; L94-A97 PolarHBondContact O-N 3.46Å; K95-A97 VanDerWaalsContact C-N 3.34Å; K95-A97 PolarHBondContact O-N 2.73Å; A97-G100 PolarHBondContact O-N 2.91Å; A97-L101 WeakPolarHBondContact O-CB 3.42Å; A97-L101 VanDerWaalsContact O-CG 3.28Å; A97-L101 WeakPolarHBondContact O-CG 3.15Å; A97-L101 PolarHBondContact O-N 3.33Å
98N85.9Confident88.3Confident10 Ų1078.5 Ų78.55%0.05341%0.413CS..Hα-helixtrans-66.9-41.2179.4-154.826.2000111.6L94 K95 L101 L102 M110 P111 I112 L117L94-N98 VanDerWaalsContact O-CB 3.3Å; L94-N98 WeakPolarHBondContact O-CB 3.02Å; L94-N98 PolarHBondContact O-N 3.33Å; K95-N98 PolarHBondContact O-N 2.83Å; N98-L101 PolarHBondContact O-N 2.82Å; N98-L102 PolarHBondContact O-N 3.28Å; N98-M110 HydrophobicContact CB-CE 3.76Å; N98-M110 WeakPolarHBondContact ND2-CE 3.45Å; N98-M110 WeakPolarHBondContact O-CE 3.45Å; N98-P111 WeakPolarHBondContact OD1-CG 3.43Å; N98-I112 PolarHBondContact ND2-O 2.92Å; N98-L117 HydrophobicContact CB-CD1 4.22Å
99E87.8Confident87.1Confident104 Ų10479.6 Ų79.649%0.48643%0.425SS..Hα-helixtrans-62.6-42.8172.5-71.6167.3-172.800111.7K95 L102 A103K95-E99 WeakPolarHBondContact CE-OE1 3.42Å; K95-E99 WeakPolarHBondContact CG-OE1 3.39Å; K95-E99 WeakPolarHBondContact O-CG 3.16Å; K95-E99 PolarHBondContact O-N 3.08Å; E99-L102 PolarHBondContact O-N 3.38Å; E99-A103 PolarHBondContact O-N 3.28Å
100G87.9Confident85.8Confident33 Ų3381.4 Ų81.434%0.3443%0.427SS..Hα-helixtrans-65.4-38.8176.400000113.3K96 A97 A103 L104K96-G100 PolarHBondContact O-N 3.43Å; A97-G100 PolarHBondContact O-N 2.91Å; G100-A103 PolarHBondContact O-N 3.19Å; G100-L104 WeakPolarHBondContact O-CG 3.24Å; G100-L104 PolarHBondContact O-N 2.91Å
101L85.9Confident84.6Confident68 Ų6883.7 Ų83.736%0.35644%0.442SS..Hα-helixtrans-65.6-42.4174.8-74.2171.4000111.5F34 A97 N98 A103 L104 S105 P111F34-L101 HydrophobicContact CZ-CD1 4.48Å; A97-L101 WeakPolarHBondContact O-CB 3.42Å; A97-L101 VanDerWaalsContact O-CG 3.28Å; A97-L101 WeakPolarHBondContact O-CG 3.15Å; A97-L101 PolarHBondContact O-N 3.33Å; N98-L101 PolarHBondContact O-N 2.82Å; L101-A103 PolarHBondContact O-N 2.93Å; L101-L104 PolarHBondContact O-N 3.06Å; L101-S105 WeakPolarHBondContact O-CB 3.42Å; L101-S105 PolarHBondContact O-N 3.24Å; L101-S105 PolarHBondContact O-OG 2.99Å; L101-P111 HydrophobicContact CB-CG 4.12Å
102L85.9Confident83.8Confident54 Ų5483.7 Ų83.728%0.28344%0.442SS..Hα-helixtrans-59.7-47175.7-179.469.6000111N98 E99 L104 S105 E107 M110N98-L102 PolarHBondContact O-N 3.28Å; E99-L102 PolarHBondContact O-N 3.38Å; L102-L104 PolarHBondContact O-N 3.22Å; L102-S105 WeakPolarHBondContact CA-OG 3.09Å; L102-S105 PolarHBondContact O-N 3.49Å; L102-S105 VanDerWaalsContact O-N 3.16Å; L102-S105 PolarHBondContact O-OG 3.41Å; L102-E107 WeakPolarHBondContact CD1-O 3.24Å; L102-M110 HydrophobicContact CB-CE 4.37Å; L102-M110 HydrophobicContact CB-SD 4.04Å; L102-M110 HydrophobicContact CD1-SD 4.36Å; L102-M110 HydrophobicContact CD2-SD 3.48Å; L102-M110 WeakPolarHBondContact CD2-SD 3.35Å; L102-M110 HydrophobicContact CG-SD 4.15Å
103A86.4Confident83.5Confident88 Ų8881.1 Ų81.173%0.72744%0.438SS*.Hα-helixtrans-63.3-25.1-178.700000113.9E99 G100 L101E99-A103 PolarHBondContact O-N 3.28Å; G100-A103 PolarHBondContact O-N 3.19Å; L101-A103 PolarHBondContact O-N 2.93Å
104L86.2Confident83Confident154 Ų15479.4 Ų79.481%0.80643%0.429SS*.Hα-helixtrans-93.3-22.6176.8-66174.9000112.9G100 L101 L102G100-L104 WeakPolarHBondContact O-CG 3.24Å; G100-L104 PolarHBondContact O-N 2.91Å; L101-L104 PolarHBondContact O-N 3.06Å; L102-L104 PolarHBondContact O-N 3.22Å
105S80.5Confident82.9Confident44 Ų4486.3 Ų86.331%0.30846%0.455SS..SBendtrans-77.1146.7177.2720000110.8L101 L102 E107L101-S105 WeakPolarHBondContact O-CB 3.42Å; L101-S105 PolarHBondContact O-N 3.24Å; L101-S105 PolarHBondContact O-OG 2.99Å; L102-S105 WeakPolarHBondContact CA-OG 3.09Å; L102-S105 PolarHBondContact O-N 3.49Å; L102-S105 VanDerWaalsContact O-N 3.16Å; L102-S105 PolarHBondContact O-OG 3.41Å; S105-E107 PolarHBondContact O-N 3.43Å; S105-E107 PolarHBondContact OG-O 2.86Å
106Q76.4Confident83Confident205 Ų20586.3 Ų86.396%0.95846%0.456SS*.SBendtrans-783.8169.4-66.1-178.6-19.300112.4
107E73.9Confident83Confident121 Ų12178.7 Ų78.757%0.56542%0.423SS*.  trans-91.5139-177.9-63.4-176.2-177.700110.6L102 S105 T109L102-E107 WeakPolarHBondContact CD1-O 3.24Å; S105-E107 PolarHBondContact O-N 3.43Å; S105-E107 PolarHBondContact OG-O 2.86Å; E107-T109 VanDerWaalsContact C-N 3.25Å; E107-T109 PolarHBondContact O-N 3.37Å
108E68.6Low83.3Confident197 Ų19777.1 Ų77.192%0.92141%0.41SS*.SBendtrans-80.1-7.4175-69.6-174165.900112.9
109T72.6Confident83.9Confident93 Ų9378.7 Ų78.757%0.57142%0.415SS*.SBendtrans-109.1140.7-175.954.10000112.2E107E107-T109 VanDerWaalsContact C-N 3.25Å; E107-T109 PolarHBondContact O-N 3.37Å
110M70.6Confident84.3Confident81 Ų8173.8 Ų73.840%0.39939%0.392SS..  trans-56.1131.2174.8-61.2-59.6-59.600110.7N98 L102 I112N98-M110 HydrophobicContact CB-CE 3.76Å; N98-M110 WeakPolarHBondContact ND2-CE 3.45Å; N98-M110 WeakPolarHBondContact O-CE 3.45Å; L102-M110 HydrophobicContact CB-CE 4.37Å; L102-M110 HydrophobicContact CB-SD 4.04Å; L102-M110 HydrophobicContact CD1-SD 4.36Å; L102-M110 HydrophobicContact CD2-SD 3.48Å; L102-M110 WeakPolarHBondContact CD2-SD 3.35Å; L102-M110 HydrophobicContact CG-SD 4.15Å; M110-I112 VanDerWaalsContact C-N 3.27Å; M110-I112 PolarHBondContact O-N 2.86Å
111P72.8Confident84.7Confident48 Ų4872.2 Ų72.231%0.31238%0.376SS..SBendtrans-64.9-33.1-177.123.1-31.9000112N98 L101N98-P111 WeakPolarHBondContact OD1-CG 3.43Å; L101-P111 HydrophobicContact CB-CG 4.12Å
112I80.4Confident85.3Confident4 Ų469 Ų692%0.02136%0.359CS..SBendtrans-135.3134.6174.1-63174.5000109.8L30 R31 F34 N98 M110 Q116 L117L30-I112 HydrophobicContact CB-CD1 3.55Å; L30-I112 HydrophobicContact CD1-CD1 4.23Å; R31-I112 HydrophobicContact CG-CD1 4.28Å; F34-I112 HydrophobicContact CD2-CD1 3.9Å; F34-I112 HydrophobicContact CE2-CD1 3.6Å; N98-I112 PolarHBondContact ND2-O 2.92Å; M110-I112 VanDerWaalsContact C-N 3.27Å; M110-I112 PolarHBondContact O-N 2.86Å; I112-Q116 HydrophobicContact CG2-CB 3.66Å; I112-L117 HydrophobicContact CB-CD2 4.27Å; I112-L117 HydrophobicContact CB-CG 4.39Å; I112-L117 HydrophobicContact CG2-CD2 3.81Å; I112-L117 HydrophobicContact CG2-CG 3.77Å
113S88.6Confident85.9Confident52 Ų5266.4 Ų66.436%0.36435%0.346SS..  trans-68.9146.9175.169.40000111.8R115 Q116 L117S113-R115 PolarHBondContact O-N 3.38Å; S113-R115 VanDerWaalsContact O-N 3.11Å; S113-Q116 WeakPolarHBondContact O-CB 3.43Å; S113-Q116 PolarHBondContact O-N 3.02Å; S113-Q116 WeakPolarHBondContact OG-CB 3.34Å; S113-Q116 VanDerWaalsContact OG-CD 3.25Å; S113-Q116 VanDerWaalsContact OG-CG 3.28Å; S113-Q116 WeakPolarHBondContact OG-CG 3.45Å; S113-Q116 PolarHBondContact OG-N 3.48Å; S113-Q116 PolarHBondContact OG-OE1 2.87Å; S113-L117 PolarHBondContact O-N 3.46Å
114I87.6Confident86.5Confident49 Ų4962.2 Ų62.225%0.25131%0.311SS..Hα-helixtrans-57.7-30.2178.4-16858.7000113.1Y91 L117 A118 F179 E183Y91-I114 HydrophobicContact CD2-CD1 4.48Å; Y91-I114 HydrophobicContact CE2-CD1 4.28Å; I114-L117 HydrophobicContact CD1-CB 4.43Å; I114-L117 HydrophobicContact CD1-CD1 4.13Å; I114-L117 PolarHBondContact O-N 3.46Å; I114-A118 WeakPolarHBondContact O-CB 3.38Å; I114-A118 PolarHBondContact O-N 3.07Å; I114-F179 HydrophobicContact CD1-CD2 4.03Å; I114-E183 HydrophobicContact CG1-CG 3.85Å
115R90.7Very high87Confident145 Ų14554.9 Ų54.955%0.54727%0.273SS..Hα-helixtrans-67.9-41.3176.1-62.2-176.4-168.1163.611.6112S113 A118 Y119 A232S113-R115 PolarHBondContact O-N 3.38Å; S113-R115 VanDerWaalsContact O-N 3.11Å; R115-A118 PolarHBondContact O-N 3.44Å; R115-Y119 WeakPolarHBondContact O-CB 3.44Å; R115-Y119 PolarHBondContact O-N 3.26Å; R115-A232 PolarHBondContact NH1-O 3.45Å
116Q92.4Very high87.9Confident67 Ų6752.8 Ų52.831%0.31326%0.258SS..Hα-helixtrans-66.9-41.2174.4-74.7163.6-30.100110.8R31 I112 S113 A118 Y119 V120R31-Q116 VanDerWaalsContact NH2-NE2 3.15Å; I112-Q116 HydrophobicContact CG2-CB 3.66Å; S113-Q116 WeakPolarHBondContact O-CB 3.43Å; S113-Q116 PolarHBondContact O-N 3.02Å; S113-Q116 WeakPolarHBondContact OG-CB 3.34Å; S113-Q116 VanDerWaalsContact OG-CD 3.25Å; S113-Q116 VanDerWaalsContact OG-CG 3.28Å; S113-Q116 WeakPolarHBondContact OG-CG 3.45Å; S113-Q116 PolarHBondContact OG-N 3.48Å; S113-Q116 PolarHBondContact OG-OE1 2.87Å; Q116-A118 VanDerWaalsContact C-N 3.32Å; Q116-A118 PolarHBondContact O-N 2.9Å; Q116-Y119 PolarHBondContact O-N 3.5Å; Q116-V120 WeakPolarHBondContact O-CB 3.16Å; Q116-V120 WeakPolarHBondContact O-CG2 3.44Å; Q116-V120 PolarHBondContact O-N 3.09Å
117L93.1Very high88.9Confident1 Ų144.9 Ų44.91%0.00522%0.221CC..Hα-helixtrans-57.4-45.8173.3-70.1176.4000111.7F34 L94 N98 I112 S113 I114 V120 S121 F179F34-L117 HydrophobicContact CD2-CD2 3.28Å; F34-L117 HydrophobicContact CE2-CD2 3.36Å; F34-L117 HydrophobicContact CG-CD2 4.14Å; F34-L117 HydrophobicContact CZ-CD2 4.28Å; L94-L117 HydrophobicContact CB-CD1 4.47Å; L94-L117 HydrophobicContact CD1-CB 4.3Å; L94-L117 HydrophobicContact CD1-CD2 4.4Å; L94-L117 HydrophobicContact CD2-CD2 4.37Å; N98-L117 HydrophobicContact CB-CD1 4.22Å; I112-L117 HydrophobicContact CB-CD2 4.27Å; I112-L117 HydrophobicContact CB-CG 4.39Å; I112-L117 HydrophobicContact CG2-CD2 3.81Å; I112-L117 HydrophobicContact CG2-CG 3.77Å; S113-L117 PolarHBondContact O-N 3.46Å; I114-L117 HydrophobicContact CD1-CB 4.43Å; I114-L117 HydrophobicContact CD1-CD1 4.13Å; I114-L117 PolarHBondContact O-N 3.46Å; L117-V120 PolarHBondContact O-N 3.26Å; L117-S121 WeakPolarHBondContact O-CB 3.39Å; L117-S121 PolarHBondContact O-N 3.42Å; L117-F179 HydrophobicContact CB-CE2 4.37Å
118A96.1Very high90.1Very high2 Ų241.4 Ų41.42%0.01721%0.205CC..Hα-helixtrans-60.7-46.3178.100000112.7I114 R115 Q116 G122 F179I114-A118 WeakPolarHBondContact O-CB 3.38Å; I114-A118 PolarHBondContact O-N 3.07Å; R115-A118 PolarHBondContact O-N 3.44Å; Q116-A118 VanDerWaalsContact C-N 3.32Å; Q116-A118 PolarHBondContact O-N 2.9Å; A118-G122 PolarHBondContact O-N 3.35Å; A118-F179 VanDerWaalsContact CA-CD2 3.46Å; A118-F179 HydrophobicContact CB-CB 3.42Å; A118-F179 VanDerWaalsContact CB-CB 3.42Å; A118-F179 HydrophobicContact CB-CD1 4.29Å; A118-F179 HydrophobicContact CB-CD2 3.5Å; A118-F179 VanDerWaalsContact CB-CD2 3.5Å; A118-F179 HydrophobicContact CB-CE2 4.31Å; A118-F179 HydrophobicContact CB-CG 3.49Å; A118-F179 VanDerWaalsContact CB-CG 3.49Å
119Y97.2Very high91.5Very high42 Ų4232.5 Ų32.517%0.16516%0.164CC..Hα-helixtrans-62.4-49.8177.6162.4-103.6000112.1L20 T24 I25 R115 Q116 G122 L123 M172L20-Y119 WeakPolarHBondContact CB-OH 3.37Å; L20-Y119 WeakPolarHBondContact CD2-OH 3.28Å; T24-Y119 VanDerWaalsContact OG1-CE1 3.31Å; T24-Y119 WeakPolarHBondContact OG1-CE1 3.46Å; T24-Y119 PolarHBondContact OG1-OH 3.29Å; I25-Y119 HydrophobicContact CD1-CE1 4.22Å; I25-Y119 HydrophobicContact CG1-CE1 4.14Å; R115-Y119 WeakPolarHBondContact O-CB 3.44Å; R115-Y119 PolarHBondContact O-N 3.26Å; Q116-Y119 PolarHBondContact O-N 3.5Å; Y119-G122 PolarHBondContact O-N 2.93Å; Y119-L123 WeakPolarHBondContact O-CB 3.42Å; Y119-L123 PolarHBondContact O-N 3.19Å; Y119-M172 HydrophobicContact CD2-CG 3.71Å; Y119-M172 HydrophobicContact CD2-SD 3.79Å; Y119-M172 HydrophobicContact CE2-CE 4.39Å; Y119-M172 HydrophobicContact CE2-CG 3.94Å; Y119-M172 HydrophobicContact CE2-SD 3.61Å
120V97.1Very high92.7Very high2 Ų228 Ų281%0.01214%0.137CC..Hα-helixtrans-64-44.1-180170.80000110.9I25 R31 F34 L35 Q116 L117 L123 G124I25-V120 HydrophobicContact CD1-CB 4.44Å; I25-V120 HydrophobicContact CD1-CG1 4.33Å; I25-V120 HydrophobicContact CD1-CG2 4Å; I25-V120 HydrophobicContact CG1-CG2 4.17Å; R31-V120 HydrophobicContact CB-CG2 4.06Å; R31-V120 HydrophobicContact CG-CG2 4.26Å; R31-V120 WeakPolarHBondContact O-CG1 3.33Å; F34-V120 HydrophobicContact CB-CG1 3.93Å; L35-V120 HydrophobicContact CB-CG1 3.85Å; Q116-V120 WeakPolarHBondContact O-CB 3.16Å; Q116-V120 WeakPolarHBondContact O-CG2 3.44Å; Q116-V120 PolarHBondContact O-N 3.09Å; L117-V120 PolarHBondContact O-N 3.26Å; V120-L123 PolarHBondContact O-N 3.38Å; V120-G124 PolarHBondContact O-N 3.47Å
121S96.7Very high93.9Very high0 Ų025.6 Ų25.60%013%0.129CC..Hα-helixtrans-60.2-50.4176.3171.40000111.8Y90 L117 L123 G124 F125Y90-S121 WeakPolarHBondContact CD1-OG 3.44Å; Y90-S121 VanDerWaalsContact CE1-OG 3.24Å; Y90-S121 WeakPolarHBondContact CE1-OG 3.32Å; L117-S121 WeakPolarHBondContact O-CB 3.39Å; L117-S121 PolarHBondContact O-N 3.42Å; S121-L123 VanDerWaalsContact C-N 3.34Å; S121-L123 PolarHBondContact O-N 2.92Å; S121-G124 PolarHBondContact O-N 2.87Å; S121-F125 WeakPolarHBondContact O-CD2 3.3Å; S121-F125 PolarHBondContact O-N 2.84Å
122G97.9Very high95Very high0 Ų028.7 Ų28.70%014%0.138CC..Hα-helixtrans-62.2-41.1179.500000112.1A118 Y119 G124 F125 G126 H171A118-G122 PolarHBondContact O-N 3.35Å; Y119-G122 PolarHBondContact O-N 2.93Å; G122-G124 PolarHBondContact O-N 3.45Å; G122-F125 PolarHBondContact O-N 3.33Å; G122-G126 PolarHBondContact O-N 2.76Å; G122-H171 VanDerWaalsContact CA-O 3.31Å; G122-H171 WeakPolarHBondContact CA-O 3.48Å; G122-H171 CarbonylContact O-C 3.44Å
123L98.3Very high95.7Very high0 Ų031.3 Ų31.30%016%0.157CC..Hα-helixtrans-66.1-36.1175.9-174.155.1000112.2A17 L20 I25 L35 Y119 V120 S121 G126 F127 I168 M172A17-L123 HydrophobicContact CB-CD1 4.19Å; L20-L123 HydrophobicContact CB-CD2 3.83Å; I25-L123 HydrophobicContact CD1-CD2 3.71Å; L35-L123 HydrophobicContact CD1-CG 4.34Å; Y119-L123 WeakPolarHBondContact O-CB 3.42Å; Y119-L123 PolarHBondContact O-N 3.19Å; V120-L123 PolarHBondContact O-N 3.38Å; S121-L123 VanDerWaalsContact C-N 3.34Å; S121-L123 PolarHBondContact O-N 2.92Å; L123-G126 PolarHBondContact O-N 2.78Å; L123-F127 HydrophobicContact CD1-CD2 3.96Å; L123-F127 HydrophobicContact CD1-CE2 3.96Å; L123-F127 HydrophobicContact CD2-CE2 4.15Å; L123-F127 HydrophobicContact CG-CD2 3.82Å; L123-F127 HydrophobicContact CG-CE2 3.83Å; L123-F127 WeakPolarHBondContact O-CD2 3.24Å; L123-F127 PolarHBondContact O-N 3.14Å; L123-I168 HydrophobicContact CD1-CG2 4.1Å; L123-M172 HydrophobicContact CB-CG 4.43Å; L123-M172 HydrophobicContact CD1-CE 4.21Å
124G98.3Very high96Very high0 Ų028.9 Ų28.90%014%0.14CC..Hα-helixtrans-62.6-44173.300000113.4V120 S121 G122 G126 M128V120-G124 PolarHBondContact O-N 3.47Å; S121-G124 PolarHBondContact O-N 2.87Å; G122-G124 PolarHBondContact O-N 3.45Å; G124-G126 VanDerWaalsContact C-N 3.33Å; G124-M128 PolarHBondContact O-N 3.25Å
125F98.5Very high96.3Very high0 Ų030.1 Ų30.10%015%0.149CC..Hα-helixtrans-59-46171.1-88.8-122.1000111G38 F41 W42 R87 Y90 S121 G122 M128 S129 H171G38-F125 VanDerWaalsContact O-CD2 3.31Å; G38-F125 WeakPolarHBondContact O-CD2 3.36Å; G38-F125 WeakPolarHBondContact O-CE2 3.39Å; F41-F125 HydrophobicContact CB-CE2 4.19Å; F41-F125 HydrophobicContact CB-CZ 4.21Å; W42-F125 HydrophobicContact CB-CD1 4.11Å; W42-F125 HydrophobicContact CB-CD2 4.37Å; W42-F125 HydrophobicContact CB-CE1 4.25Å; W42-F125 HydrophobicContact CB-CG 4.15Å; W42-F125 HydrophobicContact CB-CZ 4.46Å; W42-F125 AromaticContact CD1-CD1 3.58Å; W42-F125 HydrophobicContact CG-CD1 4.24Å; R87-F125 HydrophobicContact CB-CE1 3.99Å; R87-F125 HydrophobicContact CB-CZ 4.09Å; Y90-F125 HydrophobicContact CD1-CE2 4.27Å; S121-F125 WeakPolarHBondContact O-CD2 3.3Å; S121-F125 PolarHBondContact O-N 2.84Å; G122-F125 PolarHBondContact O-N 3.33Å; F125-M128 PolarHBondContact O-N 3.46Å; F125-S129 WeakPolarHBondContact O-CB 3.44Å; F125-S129 PolarHBondContact O-N 2.81Å; F125-H171 HydrophobicContact CB-CB 4.24Å
126G98.4Very high96.5Very high0 Ų029.1 Ų29.10%016%0.155CC..Hα-helixtrans-58-53.6177.600000112.5G122 L123 G124 M128 S129 G130 I168G122-G126 PolarHBondContact O-N 2.76Å; L123-G126 PolarHBondContact O-N 2.78Å; G124-G126 VanDerWaalsContact C-N 3.33Å; G126-M128 VanDerWaalsContact C-N 3.33Å; G126-M128 PolarHBondContact O-N 3.15Å; G126-S129 PolarHBondContact O-N 3.23Å; G126-G130 PolarHBondContact O-N 3.48Å; G126-I168 VanDerWaalsContact O-CG1 3.28Å; G126-I168 WeakPolarHBondContact O-CG1 3.48Å
127F97.7Very high96.5Very high39 Ų3927.5 Ų27.517%0.17115%0.148CC..Hα-helixtrans-53.1-49.5179.7-98.8-67.3000112.4F14 A17 V18 F21 L35 L123 G130 A131F14-F127 HydrophobicContact CD1-CD1 4.3Å; F14-F127 HydrophobicContact CD1-CE1 4.4Å; A17-F127 HydrophobicContact CB-CD1 4.23Å; A17-F127 HydrophobicContact CB-CD2 4.47Å; A17-F127 HydrophobicContact CB-CE1 3.67Å; A17-F127 HydrophobicContact CB-CE2 3.93Å; A17-F127 HydrophobicContact CB-CZ 3.51Å; A17-F127 VanDerWaalsContact O-CZ 3.29Å; A17-F127 WeakPolarHBondContact O-CZ 3.22Å; V18-F127 HydrophobicContact CG2-CE1 4.22Å; V18-F127 HydrophobicContact CG2-CZ 4.37Å; F21-F127 HydrophobicContact CB-CE2 4.03Å; F21-F127 HydrophobicContact CB-CZ 4.02Å; L35-F127 HydrophobicContact CD1-CD2 4.17Å; L35-F127 HydrophobicContact CD1-CE2 4.33Å; L123-F127 HydrophobicContact CD1-CD2 3.96Å; L123-F127 HydrophobicContact CD1-CE2 3.96Å; L123-F127 HydrophobicContact CD2-CE2 4.15Å; L123-F127 HydrophobicContact CG-CD2 3.82Å; L123-F127 HydrophobicContact CG-CE2 3.83Å; L123-F127 WeakPolarHBondContact O-CD2 3.24Å; L123-F127 PolarHBondContact O-N 3.14Å; F127-G130 PolarHBondContact O-N 3.43Å; F127-A131 WeakPolarHBondContact O-CB 3.3Å; F127-A131 PolarHBondContact O-N 2.87Å
128M98.3Very high96.5Very high47 Ų4727.9 Ų27.923%0.23215%0.15CC..Hα-helixtrans-71.2-40.9-176.2-168.657.269.500112.1A39 W42 L43 G124 F125 G126 G130 A131 F132A39-M128 HydrophobicContact CB-CB 3.95Å; A39-M128 HydrophobicContact CB-CE 3.88Å; W42-M128 HydrophobicContact CD2-CB 4.23Å; W42-M128 HydrophobicContact CD2-CG 4.14Å; W42-M128 HydrophobicContact CE3-CB 3.84Å; W42-M128 HydrophobicContact CE3-CG 3.28Å; W42-M128 HydrophobicContact CZ3-CB 4.42Å; W42-M128 HydrophobicContact CZ3-CG 3.67Å; L43-M128 HydrophobicContact CD1-CE 3.84Å; L43-M128 HydrophobicContact CD1-CG 4.37Å; L43-M128 HydrophobicContact CD1-SD 4.1Å; L43-M128 HydrophobicContact CD2-CG 3.7Å; L43-M128 HydrophobicContact CD2-SD 3.73Å; L43-M128 HydrophobicContact CG-CE 4.27Å; L43-M128 HydrophobicContact CG-CG 3.75Å; L43-M128 HydrophobicContact CG-SD 4.02Å; G124-M128 PolarHBondContact O-N 3.25Å; F125-M128 PolarHBondContact O-N 3.46Å; G126-M128 VanDerWaalsContact C-N 3.33Å; G126-M128 PolarHBondContact O-N 3.15Å; M128-G130 VanDerWaalsContact C-N 3.33Å; M128-G130 PolarHBondContact O-N 3.41Å; M128-A131 PolarHBondContact O-N 2.95Å; M128-F132 HydrophobicContact CG-CD2 4.38Å; M128-F132 PolarHBondContact O-N 3.35Å; M128-F132 HydrophobicContact SD-CD2 3.98Å; M128-F132 HydrophobicContact SD-CE2 4.1Å
129S98Very high96.3Very high10 Ų1030.6 Ų30.67%0.0717%0.173CC..Hα-helixtrans-58.2-45.1172.9-176.30000112.1F125 G126 F132 S133 I167 H171F125-S129 WeakPolarHBondContact O-CB 3.44Å; F125-S129 PolarHBondContact O-N 2.81Å; G126-S129 PolarHBondContact O-N 3.23Å; S129-F132 PolarHBondContact O-N 3.09Å; S129-S133 WeakPolarHBondContact O-CB 3.37Å; S129-S133 PolarHBondContact O-N 2.92Å; S129-S133 PolarHBondContact O-OG 3.24Å; S129-I167 WeakPolarHBondContact OG-CG2 3.2Å; S129-H171 WeakPolarHBondContact CB-NE2 3.16Å; S129-H171 PolarHBondContact OG-NE2 3.43Å
130G97.6Very high96.1Very high0 Ų034.2 Ų34.20%020%0.195CC..Hα-helixtrans-66.4-42.1176.900000113G126 F127 M128 S133 V134G126-G130 PolarHBondContact O-N 3.48Å; F127-G130 PolarHBondContact O-N 3.43Å; M128-G130 VanDerWaalsContact C-N 3.33Å; M128-G130 PolarHBondContact O-N 3.41Å; G130-S133 PolarHBondContact O-N 3.05Å; G130-V134 WeakPolarHBondContact O-CG1 3.46Å; G130-V134 PolarHBondContact O-N 3.01Å; G130-V134 VanDerWaalsContact O-N 3.07Å
131A96.9Very high95.8Very high29 Ų2934.2 Ų34.224%0.2420%0.195CC..Hα-helixtrans-58.3-49.8175.400000111.6F14 F127 M128 S133 V134 V135F14-A131 HydrophobicContact CZ-CB 4.49Å; F127-A131 WeakPolarHBondContact O-CB 3.3Å; F127-A131 PolarHBondContact O-N 2.87Å; M128-A131 PolarHBondContact O-N 2.95Å; A131-S133 PolarHBondContact O-N 3.21Å; A131-V134 PolarHBondContact O-N 2.92Å; A131-V135 HydrophobicContact CB-CG2 4.13Å; A131-V135 VanDerWaalsContact O-CB 3.28Å; A131-V135 WeakPolarHBondContact O-CB 3.43Å; A131-V135 WeakPolarHBondContact O-CG2 3.43Å; A131-V135 PolarHBondContact O-N 2.71Å
132F96.1Very high95.7Very high114 Ų11437.9 Ų37.950%0.522%0.217SC..Hα-helixtrans-60.7-34.2176.2-101.7-107.1000113W42 L43 L46 M128 S129W42-F132 HydrophobicContact CH2-CB 3.59Å; W42-F132 HydrophobicContact CH2-CD1 4.22Å; W42-F132 HydrophobicContact CH2-CD2 4.17Å; W42-F132 AromaticContact CH2-CG 3.72Å; W42-F132 HydrophobicContact CH2-CG 3.72Å; W42-F132 HydrophobicContact CZ3-CB 3.99Å; W42-F132 HydrophobicContact CZ3-CD1 4.24Å; W42-F132 AromaticContact CZ3-CD2 3.66Å; W42-F132 HydrophobicContact CZ3-CD2 3.66Å; W42-F132 HydrophobicContact CZ3-CE2 4.23Å; W42-F132 AromaticContact CZ3-CG 3.67Å; W42-F132 HydrophobicContact CZ3-CG 3.67Å; L43-F132 HydrophobicContact CD2-CD2 4.01Å; L43-F132 HydrophobicContact CD2-CE2 3.23Å; L43-F132 HydrophobicContact CD2-CZ 3.64Å; L46-F132 HydrophobicContact CD2-CD1 3.45Å; L46-F132 VanDerWaalsContact CD2-CD1 3.45Å; L46-F132 HydrophobicContact CD2-CE1 3.51Å; L46-F132 HydrophobicContact CD2-CG 4.22Å; L46-F132 HydrophobicContact CD2-CZ 4.33Å; M128-F132 HydrophobicContact CG-CD2 4.38Å; M128-F132 PolarHBondContact O-N 3.35Å; M128-F132 HydrophobicContact SD-CD2 3.98Å; M128-F132 HydrophobicContact SD-CE2 4.1Å; S129-F132 PolarHBondContact O-N 3.09Å
133S93.7Very high95.3Very high59 Ų5939.4 Ų39.441%0.41323%0.233SC..Hα-helixtrans-74.6-35.7-177.1-60.70000113.3S129 G130 A131 I137S129-S133 WeakPolarHBondContact O-CB 3.37Å; S129-S133 PolarHBondContact O-N 2.92Å; S129-S133 PolarHBondContact O-OG 3.24Å; G130-S133 PolarHBondContact O-N 3.05Å; A131-S133 PolarHBondContact O-N 3.21Å; S133-I137 WeakPolarHBondContact O-CD1 3.43Å
134V95Very high94.9Very high1 Ų145.9 Ų45.91%0.00628%0.275CS..Hα-helixtrans-127.5-17.3-163.2890000115.6A13 F14 G130 A131 N136 I137 L138 T164A13-V134 HydrophobicContact CB-CG1 4.21Å; F14-V134 HydrophobicContact CE2-CG1 3.47Å; F14-V134 VanDerWaalsContact CE2-CG1 3.47Å; F14-V134 HydrophobicContact CZ-CG1 3.67Å; G130-V134 WeakPolarHBondContact O-CG1 3.46Å; G130-V134 PolarHBondContact O-N 3.01Å; G130-V134 VanDerWaalsContact O-N 3.07Å; A131-V134 PolarHBondContact O-N 2.92Å; V134-N136 PolarHBondContact O-N 2.89Å; V134-I137 CarbonylContact O-C 3.59Å; V134-I137 PolarHBondContact O-N 2.71Å; V134-L138 HydrophobicContact CG1-CD1 3.76Å; V134-L138 HydrophobicContact CG1-CG 4.28Å; V134-L138 HydrophobicContact CG2-CD1 4.48Å; V134-L138 HydrophobicContact CG2-CG 4.15Å; V134-L138 WeakPolarHBondContact O-CB 3.31Å; V134-L138 WeakPolarHBondContact O-CG 2.99Å; V134-L138 PolarHBondContact O-N 2.91Å; V134-T164 HydrophobicContact CB-CG2 4.19Å; V134-T164 WeakPolarHBondContact CB-OG1 3.28Å; V134-T164 HydrophobicContact CG1-CG2 3.93Å
135V95.1Very high94.4Very high74 Ų7448.4 Ų48.445%0.44830%0.301SS..Hα-helixtrans-61.5-43.8-173.7167.20000112.2F14 A131 L138 A139F14-V135 HydrophobicContact CZ-CG2 4.49Å; A131-V135 HydrophobicContact CB-CG2 4.13Å; A131-V135 VanDerWaalsContact O-CB 3.28Å; A131-V135 WeakPolarHBondContact O-CB 3.43Å; A131-V135 WeakPolarHBondContact O-CG2 3.43Å; A131-V135 PolarHBondContact O-N 2.71Å; V135-L138 PolarHBondContact O-N 2.93Å; V135-A139 PolarHBondContact O-N 3.22Å
136N94.7Very high94.1Very high125 Ų12552.2 Ų52.267%0.66832%0.324SS*.Hα-helixtrans-65.7-42.7176.9-66.5-31.1000111.3V134 L138 A139 D140V134-N136 PolarHBondContact O-N 2.89Å; N136-L138 VanDerWaalsContact C-N 3.32Å; N136-L138 PolarHBondContact O-N 3.2Å; N136-A139 WeakPolarHBondContact O-CB 3.49Å; N136-A139 PolarHBondContact O-N 3.29Å; N136-D140 PolarHBondContact O-N 3.33Å
137I92.3Very high93.7Very high32 Ų3254 Ų5416%0.16434%0.335CS..Hα-helixtrans-62.9-39.3177-64.4173.8000111.1S133 V134 D140 S141 Y156 F157S133-I137 WeakPolarHBondContact O-CD1 3.43Å; V134-I137 CarbonylContact O-C 3.59Å; V134-I137 PolarHBondContact O-N 2.71Å; I137-D140 PolarHBondContact O-N 3.35Å; I137-S141 PolarHBondContact O-N 3.05Å; I137-Y156 HydrophobicContact CD1-CE1 4.21Å; I137-Y156 WeakPolarHBondContact CD1-OH 3.32Å; I137-Y156 HydrophobicContact CG1-CE1 4.38Å; I137-Y156 HydrophobicContact CG2-CD1 4.32Å; I137-Y156 HydrophobicContact CG2-CE1 3.7Å; I137-F157 HydrophobicContact CG2-CD1 3.58Å; I137-F157 HydrophobicContact CG2-CE1 3.81Å; I137-F157 VanDerWaalsContact O-CE1 3.23Å; I137-F157 WeakPolarHBondContact O-CE1 3.46Å
138L92.8Very high93.5Very high10 Ų1053.3 Ų53.35%0.05234%0.339CS..Hα-helixtrans-65.4-40.2176-79.2173.1000111.3F6 C9 F14 V134 V135 N136 D140 S141F6-L138 HydrophobicContact CD2-CB 4.21Å; F6-L138 WeakPolarHBondContact CD2-O 3.38Å; F6-L138 HydrophobicContact CE2-CB 4.06Å; C9-L138 HydrophobicContact CB-CD2 3.43Å; C9-L138 VanDerWaalsContact CB-CD2 3.43Å; F14-L138 HydrophobicContact CE2-CD1 4.14Å; V134-L138 HydrophobicContact CG1-CD1 3.76Å; V134-L138 HydrophobicContact CG1-CG 4.28Å; V134-L138 HydrophobicContact CG2-CD1 4.48Å; V134-L138 HydrophobicContact CG2-CG 4.15Å; V134-L138 WeakPolarHBondContact O-CB 3.31Å; V134-L138 WeakPolarHBondContact O-CG 2.99Å; V134-L138 PolarHBondContact O-N 2.91Å; V135-L138 PolarHBondContact O-N 2.93Å; N136-L138 VanDerWaalsContact C-N 3.32Å; N136-L138 PolarHBondContact O-N 3.2Å; L138-D140 PolarHBondContact O-N 3.25Å; L138-S141 WeakPolarHBondContact O-CB 3.41Å; L138-S141 PolarHBondContact O-N 3.25Å; L138-S141 PolarHBondContact O-OG 3.35Å
139A92.9Very high93.3Very high59 Ų5958.6 Ų58.649%0.48837%0.367SS..Hα-helixtrans-57.5-41.8175.900000111.3V135 N136 S141 V142V135-A139 PolarHBondContact O-N 3.22Å; N136-A139 WeakPolarHBondContact O-CB 3.49Å; N136-A139 PolarHBondContact O-N 3.29Å; A139-S141 VanDerWaalsContact C-N 3.26Å; A139-S141 PolarHBondContact O-N 2.62Å; A139-V142 WeakPolarHBondContact O-CB 3.23Å; A139-V142 PolarHBondContact O-N 3.41Å
140D91.8Very high93.1Very high117 Ų11766 Ų6663%0.62640%0.4SS*.Hα-helixtrans-65.5-28.1177.1-63.9-25.5000113N136 I137 L138 V142 G143 F157N136-D140 PolarHBondContact O-N 3.33Å; I137-D140 PolarHBondContact O-N 3.35Å; L138-D140 PolarHBondContact O-N 3.25Å; D140-V142 PolarHBondContact O-N 3.36Å; D140-G143 PolarHBondContact O-N 2.77Å; D140-F157 HydrophobicContact CB-CE1 4.4Å
141S91.9Very high92.8Very high3 Ų369.5 Ų69.52%0.02144%0.436CS..THydrogen-bonded Turntrans-70.4-10.5179.478.60000114.8I137 L138 A139 G143I137-S141 PolarHBondContact O-N 3.05Å; L138-S141 WeakPolarHBondContact O-CB 3.41Å; L138-S141 PolarHBondContact O-N 3.25Å; L138-S141 PolarHBondContact O-OG 3.35Å; A139-S141 VanDerWaalsContact C-N 3.26Å; A139-S141 PolarHBondContact O-N 2.62Å; S141-G143 VanDerWaalsContact C-N 3.27Å
142V92.9Very high92.6Very high77 Ų7772.7 Ų72.747%0.46745%0.449SS..THydrogen-bonded Turntrans-74.9-20.5175.4-177.80000111.5T2 F6 A139 D140T2-V142 WeakPolarHBondContact CB-O 3.4Å; T2-V142 WeakPolarHBondContact CG2-O 3.38Å; F6-V142 HydrophobicContact CB-CG2 4.17Å; F6-V142 HydrophobicContact CD2-CG2 3.66Å; F6-V142 HydrophobicContact CE2-CG2 4.27Å; F6-V142 HydrophobicContact CG-CG2 3.98Å; A139-V142 WeakPolarHBondContact O-CB 3.23Å; A139-V142 PolarHBondContact O-N 3.41Å; D140-V142 PolarHBondContact O-N 3.36Å
143G89.6Confident92.5Very high31 Ų3169 Ų6932%0.3244%0.437SS..SBendtrans-68.4156.2175.900000112.9T2 D140 S141 G145T2-G143 VanDerWaalsContact CG2-C 3.43Å; T2-G143 WeakPolarHBondContact CG2-O 3.33Å; D140-G143 PolarHBondContact O-N 2.77Å; S141-G143 VanDerWaalsContact C-N 3.27Å; G143-G145 PolarHBondContact O-N 3.34Å
144P90Very high92.4Very high137 Ų13772.7 Ų72.789%0.8945%0.448SS*.SBendtrans-67-15-17928.2-35.3000114.5T2T2-P144 VanDerWaalsContact CG2-CA 3.42Å; T2-P144 HydrophobicContact CG2-CB 4.38Å
145G89.3Confident92.3Very high53 Ų5378.2 Ų78.255%0.54647%0.474SS..  trans-90.1154.1-179.600000113.4G143G143-G145 PolarHBondContact O-N 3.34Å
146T90.3Very high92.3Very high79 Ų7978.7 Ų78.749%0.48547%0.468SS..  trans-109.5159.6165-169.50000110Q154T146-Q154 HydrophobicContact CG2-CG 4.26Å
147V91.8Very high92.3Very high37 Ų3773.6 Ų73.622%0.22444%0.44CS..SBendtrans-61.8142172.2177.60000109.7D152 Q154 Y156 F157V147-D152 HydrophobicContact CG1-CB 3.55Å; V147-Q154 WeakPolarHBondContact O-CA 3.48Å; V147-Y156 HydrophobicContact CB-CG 4.37Å; V147-Y156 HydrophobicContact CG1-CG 4.3Å; V147-Y156 HydrophobicContact CG2-CD1 3.74Å; V147-Y156 HydrophobicContact CG2-CG 4.04Å; V147-F157 HydrophobicContact CG2-CE2 4.09Å; V147-F157 HydrophobicContact CG2-CZ 4.05Å
148G92.4Very high92.4Very high26 Ų2675.7 Ų75.727%0.26845%0.451SS..  trans136.5-0.817200000116.9H150 G151 D152G148-H150 PolarHBondContact O-N 3.05Å; G148-G151 PolarHBondContact O-N 3.18Å; G148-D152 WeakPolarHBondContact CA-O 3.41Å
149I93.5Very high92.6Very high157 Ų15776 Ų7681%0.80545%0.454SS*.THydrogen-bonded Turntrans-60.2-28.7177.5-167164.1000113.1
150H93.9Very high92.8Very high167 Ų16774.2 Ų74.277%0.77344%0.438SS*.THydrogen-bonded Turntrans-10020.2176.1-59.5110.3000113.5G148G148-H150 PolarHBondContact O-N 3.05Å
151G91.4Very high93.1Very high73 Ų7368.7 Ų68.775%0.75341%0.408SS*.SBendtrans87.45179.400000115.2G148G148-G151 PolarHBondContact O-N 3.18Å
152D93.9Very high93.4Very high96 Ų9672 Ų7251%0.51342%0.422SS..  trans-68.9163.4170.7-65.8-52.1000112.3V147 G148V147-D152 HydrophobicContact CG1-CB 3.55Å; G148-D152 WeakPolarHBondContact CA-O 3.41Å
153S92.8Very high93.6Very high36 Ų3669.3 Ų69.325%0.25241%0.405SS..  trans-73.4134.6179.5-177.30000112.8H155 Y156S153-H155 PolarHBondContact O-N 3.07Å; S153-H155 PolarHBondContact OG-N 3.31Å; S153-H155 VanDerWaalsContact OG-N 3.17Å; S153-Y156 WeakPolarHBondContact O-CB 3.43Å; S153-Y156 PolarHBondContact O-N 3.37Å
154Q92.1Very high94Very high137 Ų13768.1 Ų68.164%0.6439%0.392SS*.THydrogen-bonded Turntrans-63.9-17.6171.1-63.1-177.5-19.700113.1T146 V147 Y156T146-Q154 HydrophobicContact CG2-CG 4.26Å; V147-Q154 WeakPolarHBondContact O-CA 3.48Å; Q154-Y156 VanDerWaalsContact C-N 3.27Å; Q154-Y156 PolarHBondContact O-N 2.88Å
155H92.7Very high94.4Very high117 Ų11763 Ų6354%0.54236%0.356SS..THydrogen-bonded Turntrans-84.95.4179.1-57.8-56.7000113.7S153 F157 L158 S159S153-H155 PolarHBondContact O-N 3.07Å; S153-H155 PolarHBondContact OG-N 3.31Å; S153-H155 VanDerWaalsContact OG-N 3.17Å; H155-F157 PolarHBondContact O-N 3.18Å; H155-L158 PolarHBondContact O-N 2.98Å; H155-S159 PolarHBondContact O-N 2.9Å; H155-S159 PolarHBondContact O-OG 3.44Å
156Y94.6Very high94.9Very high84 Ų8460.5 Ų60.533%0.32933%0.33SS..Hα-helixtrans-49.2-52.1-176.2-180-98.3000113.6I137 V147 S153 Q154 L158 S159 S160I137-Y156 HydrophobicContact CD1-CE1 4.21Å; I137-Y156 WeakPolarHBondContact CD1-OH 3.32Å; I137-Y156 HydrophobicContact CG1-CE1 4.38Å; I137-Y156 HydrophobicContact CG2-CD1 4.32Å; I137-Y156 HydrophobicContact CG2-CE1 3.7Å; V147-Y156 HydrophobicContact CB-CG 4.37Å; V147-Y156 HydrophobicContact CG1-CG 4.3Å; V147-Y156 HydrophobicContact CG2-CD1 3.74Å; V147-Y156 HydrophobicContact CG2-CG 4.04Å; S153-Y156 WeakPolarHBondContact O-CB 3.43Å; S153-Y156 PolarHBondContact O-N 3.37Å; Q154-Y156 VanDerWaalsContact C-N 3.27Å; Q154-Y156 PolarHBondContact O-N 2.88Å; Y156-L158 VanDerWaalsContact C-N 3.32Å; Y156-L158 PolarHBondContact O-N 3.33Å; Y156-S159 PolarHBondContact O-N 3.32Å; Y156-S160 WeakPolarHBondContact O-CB 3.2Å; Y156-S160 PolarHBondContact O-N 3.04Å; Y156-S160 PolarHBondContact O-OG 2.83Å
157F95.1Very high95.3Very high18 Ų1857.6 Ų57.68%0.07931%0.311CS..Hα-helixtrans-62.1-39.2-179.6-65.9-59.1000112.7V5 C9 I137 D140 V147 H155 A161V5-F157 HydrophobicContact CG1-CB 4.29Å; V5-F157 HydrophobicContact CG1-CD2 4.36Å; C9-F157 PolarHBondContact SG-O 3.46Å; C9-F157 VanDerWaalsContact SG-O 3.41Å; I137-F157 HydrophobicContact CG2-CD1 3.58Å; I137-F157 HydrophobicContact CG2-CE1 3.81Å; I137-F157 VanDerWaalsContact O-CE1 3.23Å; I137-F157 WeakPolarHBondContact O-CE1 3.46Å; D140-F157 HydrophobicContact CB-CE1 4.4Å; V147-F157 HydrophobicContact CG2-CE2 4.09Å; V147-F157 HydrophobicContact CG2-CZ 4.05Å; H155-F157 PolarHBondContact O-N 3.18Å; F157-A161 WeakPolarHBondContact O-CB 3.18Å; F157-A161 PolarHBondContact O-N 3.31Å
158L95.4Very high95.6Very high75 Ų7555.9 Ų55.939%0.39330%0.301SS..Hα-helixtrans-71.3-46.9-179-171.965.8000111.2I12 H155 Y156 S160 A161 F162I12-L158 HydrophobicContact CD1-CD1 3.48Å; I12-L158 VanDerWaalsContact CD1-CD1 3.48Å; H155-L158 PolarHBondContact O-N 2.98Å; Y156-L158 VanDerWaalsContact C-N 3.32Å; Y156-L158 PolarHBondContact O-N 3.33Å; L158-S160 VanDerWaalsContact C-N 3.33Å; L158-S160 PolarHBondContact O-N 3.23Å; L158-A161 PolarHBondContact O-N 3.49Å; L158-F162 HydrophobicContact CD1-CD2 4.09Å; L158-F162 HydrophobicContact CD1-CE2 3.66Å; L158-F162 HydrophobicContact CD2-CE2 4.31Å; L158-F162 HydrophobicContact CG-CD2 3.93Å; L158-F162 HydrophobicContact CG-CE2 3.77Å; L158-F162 WeakPolarHBondContact O-CD2 3.48Å; L158-F162 PolarHBondContact O-N 3.2Å
159S95.9Very high95.9Very high16 Ų1655.8 Ų55.811%0.11229%0.294CS..Hα-helixtrans-59.9-43.3176.1-65.40000111.5H155 Y156 F162 M163H155-S159 PolarHBondContact O-N 2.9Å; H155-S159 PolarHBondContact O-OG 3.44Å; Y156-S159 PolarHBondContact O-N 3.32Å; S159-F162 PolarHBondContact O-N 3.02Å; S159-M163 WeakPolarHBondContact O-CB 3.31Å; S159-M163 PolarHBondContact O-N 3.39Å
160S97.1Very high96.1Very high23 Ų2348.3 Ų48.316%0.16126%0.256CS..Hα-helixtrans-62-44.8175.8-66.50000111.7Y156 L158 F162 M163 T164Y156-S160 WeakPolarHBondContact O-CB 3.2Å; Y156-S160 PolarHBondContact O-N 3.04Å; Y156-S160 PolarHBondContact O-OG 2.83Å; L158-S160 VanDerWaalsContact C-N 3.33Å; L158-S160 PolarHBondContact O-N 3.23Å; S160-F162 PolarHBondContact O-N 2.95Å; S160-M163 PolarHBondContact O-N 3.36Å; S160-T164 WeakPolarHBondContact O-CB 3.48Å; S160-T164 PolarHBondContact O-N 3.41Å; S160-T164 PolarHBondContact O-OG1 3.21Å
161A97.9Very high96.4Very high0 Ų040.4 Ų40.40%022%0.219CC..Hα-helixtrans-61.1-45.4177.300000112.7C9 I12 A13 F157 L158 T164 M165C9-A161 HydrophobicContact CB-CB 3.87Å; C9-A161 WeakPolarHBondContact O-CB 3.39Å; I12-A161 HydrophobicContact CB-CB 4.05Å; I12-A161 HydrophobicContact CG2-CB 3.85Å; A13-A161 HydrophobicContact CB-CB 4.3Å; F157-A161 WeakPolarHBondContact O-CB 3.18Å; F157-A161 PolarHBondContact O-N 3.31Å; L158-A161 PolarHBondContact O-N 3.49Å; A161-T164 PolarHBondContact O-N 3.04Å; A161-M165 PolarHBondContact O-N 3.41Å
162F98.2Very high96.7Very high73 Ų7337.5 Ų37.532%0.3219%0.186SC..Hα-helixtrans-66.5-37.3176.4-82-63.7000112.6I12 L158 S159 S160 M165 A166 L214 Y218I12-F162 HydrophobicContact CD1-CE2 4.11Å; I12-F162 HydrophobicContact CD1-CZ 4.04Å; I12-F162 HydrophobicContact CG1-CZ 4.48Å; I12-F162 HydrophobicContact CG2-CB 4.49Å; I12-F162 HydrophobicContact CG2-CD1 3.55Å; I12-F162 HydrophobicContact CG2-CD2 4.27Å; I12-F162 HydrophobicContact CG2-CE1 3.76Å; I12-F162 HydrophobicContact CG2-CE2 4.44Å; I12-F162 HydrophobicContact CG2-CG 3.84Å; I12-F162 HydrophobicContact CG2-CZ 4.2Å; L158-F162 HydrophobicContact CD1-CD2 4.09Å; L158-F162 HydrophobicContact CD1-CE2 3.66Å; L158-F162 HydrophobicContact CD2-CE2 4.31Å; L158-F162 HydrophobicContact CG-CD2 3.93Å; L158-F162 HydrophobicContact CG-CE2 3.77Å; L158-F162 WeakPolarHBondContact O-CD2 3.48Å; L158-F162 PolarHBondContact O-N 3.2Å; S159-F162 PolarHBondContact O-N 3.02Å; S160-F162 PolarHBondContact O-N 2.95Å; F162-M165 HydrophobicContact CD1-CE 4.31Å; F162-A166 PolarHBondContact O-N 3.06Å; F162-A166 VanDerWaalsContact O-N 3.09Å; F162-L214 HydrophobicContact CB-CD1 4.24Å; F162-L214 HydrophobicContact CB-CD2 4.17Å; F162-Y218 WeakPolarHBondContact CA-OH 3.46Å; F162-Y218 HydrophobicContact CB-CE2 4.28Å; F162-Y218 WeakPolarHBondContact CB-OH 3.48Å; F162-Y218 VanDerWaalsContact CD1-OH 3.26Å; F162-Y218 WeakPolarHBondContact CD1-OH 3.45Å; F162-Y218 PolarHBondContact O-OH 3.08Å
163M98Very high96.9Very high21 Ų2134.9 Ų34.910%0.10317%0.171CC..Hα-helixtrans-63.8-44.6174.4-172.669.6-160.300110.6S159 S160 M165 A166 I167 V200 T204 L214 T217S159-M163 WeakPolarHBondContact O-CB 3.31Å; S159-M163 PolarHBondContact O-N 3.39Å; S160-M163 PolarHBondContact O-N 3.36Å; M163-M165 PolarHBondContact O-N 3.28Å; M163-A166 PolarHBondContact O-N 3.26Å; M163-I167 HydrophobicContact CE-CD1 3.77Å; M163-I167 HydrophobicContact CE-CG1 3.85Å; M163-I167 WeakPolarHBondContact O-CG1 3.41Å; M163-I167 PolarHBondContact O-N 2.94Å; M163-V200 HydrophobicContact CE-CG1 3.88Å; M163-T204 HydrophobicContact CE-CG2 3.38Å; M163-T204 HydrophobicContact SD-CG2 4.36Å; M163-L214 HydrophobicContact CB-CD1 4Å; M163-L214 HydrophobicContact SD-CD1 4.07Å; M163-T217 HydrophobicContact CE-CG2 3.83Å; M163-T217 HydrophobicContact SD-CG2 4.01Å
164T98.4Very high97.2Very high6 Ų633.2 Ų33.24%0.03716%0.159CC..Hα-helixtrans-60.3-46.4177-64.40000112.1A13 V134 S160 A161 A166 I167 I168A13-T164 HydrophobicContact CB-CG2 3.9Å; V134-T164 HydrophobicContact CB-CG2 4.19Å; V134-T164 WeakPolarHBondContact CB-OG1 3.28Å; V134-T164 HydrophobicContact CG1-CG2 3.93Å; S160-T164 WeakPolarHBondContact O-CB 3.48Å; S160-T164 PolarHBondContact O-N 3.41Å; S160-T164 PolarHBondContact O-OG1 3.21Å; A161-T164 PolarHBondContact O-N 3.04Å; T164-A166 VanDerWaalsContact C-N 3.27Å; T164-A166 PolarHBondContact O-N 2.83Å; T164-I167 PolarHBondContact O-N 3.3Å; T164-I168 HydrophobicContact CG2-CD1 3.67Å; T164-I168 HydrophobicContact CG2-CG1 4.32Å; T164-I168 WeakPolarHBondContact O-CD1 3.46Å; T164-I168 VanDerWaalsContact O-CG1 3.27Å; T164-I168 WeakPolarHBondContact O-CG1 3.34Å; T164-I168 PolarHBondContact O-N 3.24Å
165M98.4Very high97.5Very high30 Ų3026.7 Ų26.715%0.14813%0.128CC..Hα-helixtrans-55.6-45.6174.8-171-17277.500111.2I12 P16 A161 F162 M163 I168 L169 Y218I12-M165 WeakPolarHBondContact O-CB 3.19Å; I12-M165 VanDerWaalsContact O-CG 3.29Å; I12-M165 WeakPolarHBondContact O-CG 3.47Å; I12-M165 VanDerWaalsContact O-SD 3.35Å; P16-M165 HydrophobicContact CG-CG 3.82Å; P16-M165 HydrophobicContact CG-SD 3.76Å; A161-M165 PolarHBondContact O-N 3.41Å; F162-M165 HydrophobicContact CD1-CE 4.31Å; M163-M165 PolarHBondContact O-N 3.28Å; M165-I168 PolarHBondContact O-N 3.25Å; M165-L169 HydrophobicContact CG-CD1 4.37Å; M165-L169 WeakPolarHBondContact O-CG 3.39Å; M165-L169 PolarHBondContact O-N 3.44Å; M165-L169 VanDerWaalsContact O-N 3.07Å; M165-Y218 HydrophobicContact CE-CE1 3.71Å; M165-Y218 WeakPolarHBondContact CE-OH 3.42Å
166A98.6Very high97.8Very high0 Ų022 Ų220%011%0.108CC..Hα-helixtrans-63.9-43.9179.700000112.3F162 M163 T164 L169 L170 T217 Y218 M221F162-A166 PolarHBondContact O-N 3.06Å; F162-A166 VanDerWaalsContact O-N 3.09Å; M163-A166 PolarHBondContact O-N 3.26Å; T164-A166 VanDerWaalsContact C-N 3.27Å; T164-A166 PolarHBondContact O-N 2.83Å; A166-L169 PolarHBondContact O-N 3.45Å; A166-L170 VanDerWaalsContact O-CB 3.24Å; A166-L170 WeakPolarHBondContact O-CB 3.49Å; A166-L170 VanDerWaalsContact O-CG 3.3Å; A166-L170 WeakPolarHBondContact O-CG 3.49Å; A166-L170 PolarHBondContact O-N 2.96Å; A166-T217 HydrophobicContact CB-CG2 3.86Å; A166-Y218 HydrophobicContact CB-CD2 4.29Å; A166-Y218 HydrophobicContact CB-CE2 3.81Å; A166-M221 HydrophobicContact CB-SD 3.92Å
167I98.5Very high98Very high17 Ų1718.1 Ų18.19%0.0879%0.093CC..Hα-helixtrans-63.1-42.2176.5-68.9-65.2000111.6S129 M163 T164 L169 L170 H171 V200S129-I167 WeakPolarHBondContact OG-CG2 3.2Å; M163-I167 HydrophobicContact CE-CD1 3.77Å; M163-I167 HydrophobicContact CE-CG1 3.85Å; M163-I167 WeakPolarHBondContact O-CG1 3.41Å; M163-I167 PolarHBondContact O-N 2.94Å; T164-I167 PolarHBondContact O-N 3.3Å; I167-L169 PolarHBondContact O-N 3.42Å; I167-L170 PolarHBondContact O-N 2.79Å; I167-H171 PolarHBondContact O-CD2 2.94Å; I167-H171 VanDerWaalsContact O-CD2 3.24Å; I167-H171 PolarHBondContact O-N 2.93Å; I167-V200 HydrophobicContact CD1-CG1 3.54Å
168I98.7Very high98.1Very high2 Ų217.4 Ų17.41%0.019%0.09CC..Hα-helixtrans-60.9-48.4177.8-66.3158.4000110.7A13 F14 A17 L123 G126 T164 M165 H171 M172A13-I168 WeakPolarHBondContact O-CD1 3.29Å; F14-I168 HydrophobicContact CD1-CD1 3.92Å; F14-I168 HydrophobicContact CE1-CD1 4.02Å; A17-I168 HydrophobicContact CB-CG2 3.66Å; L123-I168 HydrophobicContact CD1-CG2 4.1Å; G126-I168 VanDerWaalsContact O-CG1 3.28Å; G126-I168 WeakPolarHBondContact O-CG1 3.48Å; T164-I168 HydrophobicContact CG2-CD1 3.67Å; T164-I168 HydrophobicContact CG2-CG1 4.32Å; T164-I168 WeakPolarHBondContact O-CD1 3.46Å; T164-I168 VanDerWaalsContact O-CG1 3.27Å; T164-I168 WeakPolarHBondContact O-CG1 3.34Å; T164-I168 PolarHBondContact O-N 3.24Å; M165-I168 PolarHBondContact O-N 3.25Å; I168-H171 PolarHBondContact O-N 3.24Å; I168-M172 PolarHBondContact O-N 3.23Å
169L98.6Very high98.2Very high24 Ų2414 Ų1413%0.1267%0.071CC..Hα-helixtrans-66.4-40.5178.9-68.1178.7000111.9P16 L20 M165 A166 I167 H171 M172 F173 M221P16-L169 HydrophobicContact CB-CD2 4.16Å; L20-L169 HydrophobicContact CD1-CD2 4.42Å; M165-L169 HydrophobicContact CG-CD1 4.37Å; M165-L169 WeakPolarHBondContact O-CG 3.39Å; M165-L169 PolarHBondContact O-N 3.44Å; M165-L169 VanDerWaalsContact O-N 3.07Å; A166-L169 PolarHBondContact O-N 3.45Å; I167-L169 PolarHBondContact O-N 3.42Å; L169-H171 PolarHBondContact O-N 3.17Å; L169-M172 HydrophobicContact CD2-CE 3.62Å; L169-M172 WeakPolarHBondContact O-CB 3.32Å; L169-M172 PolarHBondContact O-N 3.3Å; L169-F173 HydrophobicContact CB-CE2 4.01Å; L169-F173 HydrophobicContact CB-CZ 4.25Å; L169-F173 VanDerWaalsContact O-CD2 3.28Å; L169-F173 WeakPolarHBondContact O-CD2 3.31Å; L169-F173 VanDerWaalsContact O-CG 3.24Å; L169-F173 WeakPolarHBondContact O-CG 3.41Å; L169-F173 PolarHBondContact O-N 2.77Å; L169-M221 HydrophobicContact CB-CG 4.36Å; L169-M221 HydrophobicContact CB-SD 3.89Å; L169-M221 HydrophobicContact CD1-SD 3.78Å; L169-M221 HydrophobicContact CG-SD 4.45Å
170L98.8Very high98.3Very high0 Ų014.6 Ų14.60%07%0.073CC..Hα-helixtrans-60.5-44.2175.2-83.8167.1000112.1A166 I167 M172 F173 W174 V200 T217 I220 M221 M224A166-L170 VanDerWaalsContact O-CB 3.24Å; A166-L170 WeakPolarHBondContact O-CB 3.49Å; A166-L170 VanDerWaalsContact O-CG 3.3Å; A166-L170 WeakPolarHBondContact O-CG 3.49Å; A166-L170 PolarHBondContact O-N 2.96Å; I167-L170 PolarHBondContact O-N 2.79Å; L170-M172 VanDerWaalsContact C-N 3.27Å; L170-M172 PolarHBondContact O-N 3.3Å; L170-F173 PolarHBondContact O-N 2.94Å; L170-W174 HydrophobicContact CB-CD2 4.16Å; L170-W174 HydrophobicContact CB-CE3 4.02Å; L170-W174 HydrophobicContact CB-CH2 3.73Å; L170-W174 HydrophobicContact CB-CZ2 3.92Å; L170-W174 HydrophobicContact CB-CZ3 3.8Å; L170-W174 HydrophobicContact CD1-CH2 4.01Å; L170-W174 HydrophobicContact CD1-CZ2 4.09Å; L170-W174 HydrophobicContact CD2-CH2 4.43Å; L170-W174 HydrophobicContact CD2-CZ2 3.82Å; L170-W174 HydrophobicContact CG-CH2 4.29Å; L170-W174 HydrophobicContact CG-CZ2 4.18Å; L170-W174 VanDerWaalsContact O-CB 3.22Å; L170-W174 WeakPolarHBondContact O-CB 3.36Å; L170-W174 VanDerWaalsContact O-CD2 3.27Å; L170-W174 PolarHBondContact O-N 3.45Å; L170-V200 HydrophobicContact CD1-CB 4.45Å; L170-V200 HydrophobicContact CD1-CG1 3.94Å; L170-V200 HydrophobicContact CD1-CG2 3.93Å; L170-T217 HydrophobicContact CD1-CG2 4.18Å; L170-I220 HydrophobicContact CD2-CG2 4.27Å; L170-M221 HydrophobicContact CD1-CB 4.31Å; L170-M221 HydrophobicContact CD2-CB 4.11Å; L170-M221 HydrophobicContact CD2-CG 4.49Å; L170-M221 HydrophobicContact CG-CB 3.97Å; L170-M221 HydrophobicContact CG-CG 4.14Å; L170-M224 HydrophobicContact CD2-CB 3.97Å; L170-M224 HydrophobicContact CD2-CG 4Å
171H98.8Very high98.3Very high1 Ų113.5 Ų13.51%0.0057%0.066CC..Hα-helixtrans-59.8-37.2175.4-84.4-63.3000113R87 G122 F125 S129 I167 I168 L169 W174 G175 H197R87-H171 PolarHBondContact NH2-ND1 3.18Å; G122-H171 VanDerWaalsContact CA-O 3.31Å; G122-H171 WeakPolarHBondContact CA-O 3.48Å; G122-H171 CarbonylContact O-C 3.44Å; F125-H171 HydrophobicContact CB-CB 4.24Å; S129-H171 WeakPolarHBondContact CB-NE2 3.16Å; S129-H171 PolarHBondContact OG-NE2 3.43Å; I167-H171 PolarHBondContact O-CD2 2.94Å; I167-H171 VanDerWaalsContact O-CD2 3.24Å; I167-H171 PolarHBondContact O-N 2.93Å; I168-H171 PolarHBondContact O-N 3.24Å; L169-H171 PolarHBondContact O-N 3.17Å; H171-W174 AromaticContact ND1-CE3 3.86Å; H171-G175 PolarHBondContact O-N 3.04Å; H171-H197 AromaticContact CE1-CE1 3.56Å; H171-H197 AromaticContact CE1-NE2 3.72Å
172M98.6Very high98.2Very high12 Ų1213.6 Ų13.66%0.0597%0.066CC..Hα-helixtrans-64.7-49.6173-176-144.5-49.500111.6L20 Y119 L123 I168 L169 L170 G175 V176L20-M172 HydrophobicContact CD1-CE 3.12Å; L20-M172 HydrophobicContact CD1-SD 4.26Å; Y119-M172 HydrophobicContact CD2-CG 3.71Å; Y119-M172 HydrophobicContact CD2-SD 3.79Å; Y119-M172 HydrophobicContact CE2-CE 4.39Å; Y119-M172 HydrophobicContact CE2-CG 3.94Å; Y119-M172 HydrophobicContact CE2-SD 3.61Å; L123-M172 HydrophobicContact CB-CG 4.43Å; L123-M172 HydrophobicContact CD1-CE 4.21Å; I168-M172 PolarHBondContact O-N 3.23Å; L169-M172 HydrophobicContact CD2-CE 3.62Å; L169-M172 WeakPolarHBondContact O-CB 3.32Å; L169-M172 PolarHBondContact O-N 3.3Å; L170-M172 VanDerWaalsContact C-N 3.27Å; L170-M172 PolarHBondContact O-N 3.3Å; M172-G175 PolarHBondContact O-N 3.29Å; M172-V176 WeakPolarHBondContact O-CG2 3.36Å; M172-V176 PolarHBondContact O-N 3.27Å; M172-V176 VanDerWaalsContact O-N 3.08Å
173F98.7Very high98.1Very high41 Ų4113.5 Ų13.518%0.187%0.067CC..Hα-helixtrans-63.7-43.8180-58.7-29.6000111.9L169 L170 G175 V176 I177 M221 M224 A228L169-F173 HydrophobicContact CB-CE2 4.01Å; L169-F173 HydrophobicContact CB-CZ 4.25Å; L169-F173 VanDerWaalsContact O-CD2 3.28Å; L169-F173 WeakPolarHBondContact O-CD2 3.31Å; L169-F173 VanDerWaalsContact O-CG 3.24Å; L169-F173 WeakPolarHBondContact O-CG 3.41Å; L169-F173 PolarHBondContact O-N 2.77Å; L170-F173 PolarHBondContact O-N 2.94Å; F173-G175 VanDerWaalsContact C-N 3.34Å; F173-G175 PolarHBondContact O-N 2.92Å; F173-V176 PolarHBondContact O-N 3.39Å; F173-I177 WeakPolarHBondContact O-CG1 3.49Å; F173-I177 PolarHBondContact O-N 2.96Å; F173-M221 HydrophobicContact CD2-CG 4.37Å; F173-M221 HydrophobicContact CE2-CG 3.91Å; F173-M224 HydrophobicContact CB-CB 4.22Å; F173-M224 HydrophobicContact CD2-CB 4.41Å; F173-A228 HydrophobicContact CB-CB 3.96Å; F173-A228 HydrophobicContact CD1-CB 3.95Å; F173-A228 HydrophobicContact CG-CB 4.22Å
174W98.7Very high98Very high0 Ų017.2 Ų17.20%08%0.083CC..Hα-helixtrans-57.9-45172-71.5-32.8000111.4L170 H171 V176 I177 F178 V193 T196 H197 V200L170-W174 HydrophobicContact CB-CD2 4.16Å; L170-W174 HydrophobicContact CB-CE3 4.02Å; L170-W174 HydrophobicContact CB-CH2 3.73Å; L170-W174 HydrophobicContact CB-CZ2 3.92Å; L170-W174 HydrophobicContact CB-CZ3 3.8Å; L170-W174 HydrophobicContact CD1-CH2 4.01Å; L170-W174 HydrophobicContact CD1-CZ2 4.09Å; L170-W174 HydrophobicContact CD2-CH2 4.43Å; L170-W174 HydrophobicContact CD2-CZ2 3.82Å; L170-W174 HydrophobicContact CG-CH2 4.29Å; L170-W174 HydrophobicContact CG-CZ2 4.18Å; L170-W174 VanDerWaalsContact O-CB 3.22Å; L170-W174 WeakPolarHBondContact O-CB 3.36Å; L170-W174 VanDerWaalsContact O-CD2 3.27Å; L170-W174 PolarHBondContact O-N 3.45Å; H171-W174 AromaticContact ND1-CE3 3.86Å; W174-V176 PolarHBondContact O-N 3.38Å; W174-I177 PolarHBondContact O-N 3.44Å; W174-F178 WeakPolarHBondContact O-CA 3.37Å; W174-F178 WeakPolarHBondContact O-CB 3.47Å; W174-F178 PolarHBondContact O-N 3.09Å; W174-V193 HydrophobicContact CB-CG1 3.62Å; W174-V193 HydrophobicContact CG-CG1 3.73Å; W174-T196 PolarHBondContact NE1-OG1 3.33Å; W174-H197 HydrophobicContact CD2-CB 4.3Å; W174-H197 HydrophobicContact CE3-CB 4.17Å; W174-H197 AromaticContact CE3-CG 3.97Å; W174-H197 HydrophobicContact CH2-CB 3.76Å; W174-H197 AromaticContact CH2-CD2 3.48Å; W174-H197 VanDerWaalsContact CH2-CD2 3.48Å; W174-H197 WeakPolarHBondContact CH2-CD2 3.31Å; W174-H197 AromaticContact CH2-CG 3.74Å; W174-H197 VanDerWaalsContact CZ2-CA 3.41Å; W174-H197 HydrophobicContact CZ2-CB 3.84Å; W174-H197 HydrophobicContact CZ3-CB 3.92Å; W174-H197 AromaticContact CZ3-CD2 3.32Å; W174-H197 WeakPolarHBondContact CZ3-CD2 3.39Å; W174-H197 AromaticContact CZ3-CG 3.52Å; W174-H197 AromaticContact CZ3-NE2 3.85Å; W174-V200 HydrophobicContact CH2-CB 4.26Å; W174-V200 HydrophobicContact CZ2-CB 4.45Å; W174-V200 HydrophobicContact CZ2-CG2 4.26Å
175G98.2Very high97.8Very high0 Ų022.3 Ų22.30%011%0.106CC..Hα-helixtrans-55.6-48.6175.700000112.8H171 M172 F173 F178 F179H171-G175 PolarHBondContact O-N 3.04Å; M172-G175 PolarHBondContact O-N 3.29Å; F173-G175 VanDerWaalsContact C-N 3.34Å; F173-G175 PolarHBondContact O-N 2.92Å; G175-F178 PolarHBondContact O-N 3.31Å; G175-F179 WeakPolarHBondContact O-CD1 3.39Å; G175-F179 PolarHBondContact O-N 2.78Å
176V98.3Very high97.7Very high19 Ų1928 Ų2812%0.11513%0.126CC..Hα-helixtrans-60.2-50.21781740000111.8M172 F173 W174 D180 A228 T231M172-V176 WeakPolarHBondContact O-CG2 3.36Å; M172-V176 PolarHBondContact O-N 3.27Å; M172-V176 VanDerWaalsContact O-N 3.08Å; F173-V176 PolarHBondContact O-N 3.39Å; W174-V176 PolarHBondContact O-N 3.38Å; V176-D180 PolarHBondContact O-N 2.88Å; V176-A228 HydrophobicContact CB-CB 4.28Å; V176-A228 HydrophobicContact CG1-CB 4.22Å; V176-T231 HydrophobicContact CG1-CG2 4.37Å
177I98.4Very high97.6Very high2 Ų234.4 Ų34.41%0.0115%0.15CC..Hα-helixtrans-68.5-39.2-178.1-63.6162.7000111F173 W174 G181 A189 V193 M224 W227 A228F173-I177 WeakPolarHBondContact O-CG1 3.49Å; F173-I177 PolarHBondContact O-N 2.96Å; W174-I177 PolarHBondContact O-N 3.44Å; I177-G181 PolarHBondContact O-N 3.48Å; I177-A189 HydrophobicContact CG2-CB 4.29Å; I177-V193 HydrophobicContact CB-CG2 3.93Å; I177-V193 HydrophobicContact CG2-CG2 3.67Å; I177-M224 HydrophobicContact CD1-CE 3.49Å; I177-M224 VanDerWaalsContact CD1-CE 3.49Å; I177-M224 HydrophobicContact CD1-SD 4.41Å; I177-W227 HydrophobicContact CD1-CB 3.92Å; I177-W227 HydrophobicContact CD1-CD2 3.84Å; I177-W227 HydrophobicContact CD1-CE3 4.03Å; I177-W227 HydrophobicContact CD1-CG 3.82Å; I177-W227 HydrophobicContact CG1-CD2 4.33Å; I177-W227 HydrophobicContact CG1-CG 4.22Å; I177-W227 HydrophobicContact CG2-CD2 4.2Å; I177-W227 HydrophobicContact CG2-CE3 4.47Å; I177-W227 HydrophobicContact CG2-CH2 4.24Å; I177-W227 HydrophobicContact CG2-CZ2 3.93Å; I177-W227 HydrophobicContact CG2-CZ3 4.49Å; I177-A228 HydrophobicContact CD1-CB 4.23Å; I177-A228 HydrophobicContact CG1-CB 4.19Å
178F98.5Very high97.5Very high4 Ų441.1 Ų41.12%0.01819%0.185CC..Hα-helixtrans-64.4-49.3-178.7-170.3-76.6000111.3R87 F88 W174 G175 G181 C182 V190 V193R87-F178 HydrophobicContact CG-CD1 4.16Å; R87-F178 HydrophobicContact CG-CE1 4.34Å; R87-F178 HydrophobicContact CG-CG 4.39Å; F88-F178 HydrophobicContact CB-CE1 4.01Å; F88-F178 HydrophobicContact CB-CZ 3.85Å; F88-F178 AromaticContact CD2-CE1 3.99Å; F88-F178 HydrophobicContact CD2-CE1 3.99Å; F88-F178 HydrophobicContact CD2-CZ 4.17Å; W174-F178 WeakPolarHBondContact O-CA 3.37Å; W174-F178 WeakPolarHBondContact O-CB 3.47Å; W174-F178 PolarHBondContact O-N 3.09Å; G175-F178 PolarHBondContact O-N 3.31Å; F178-G181 PolarHBondContact O-N 2.85Å; F178-C182 VanDerWaalsContact CE1-SG 3.54Å; F178-C182 PolarHBondContact O-N 3Å; F178-C182 PolarHBondContact O-SG 3.39Å; F178-C182 VanDerWaalsContact O-SG 3.35Å; F178-V190 HydrophobicContact CD2-CG1 4.02Å; F178-V190 HydrophobicContact CE2-CG1 3.56Å; F178-V190 HydrophobicContact CZ-CG1 3.92Å; F178-V193 HydrophobicContact CB-CG1 4.4Å; F178-V193 HydrophobicContact CB-CG2 4.46Å; F178-V193 HydrophobicContact CD2-CB 4.3Å; F178-V193 HydrophobicContact CD2-CG1 3.91Å
179F97.6Very high97.4Very high2 Ų241.6 Ų41.61%0.00919%0.19CC..Hα-helixtrans-64.7-43.2179.9-83.543.6000111.3R87 Y91 L94 I114 L117 A118 G175 G181 C182 E183R87-F179 HydrophobicContact CG-CE1 4.26Å; Y91-F179 HydrophobicContact CD2-CD1 4.35Å; Y91-F179 AromaticContact CD2-CD2 3.76Å; Y91-F179 HydrophobicContact CD2-CD2 3.76Å; Y91-F179 AromaticContact CD2-CE2 4Å; Y91-F179 HydrophobicContact CD2-CE2 4Å; Y91-F179 AromaticContact CD2-CG 3.96Å; Y91-F179 HydrophobicContact CD2-CG 3.96Å; Y91-F179 HydrophobicContact CD2-CZ 4.39Å; L94-F179 HydrophobicContact CD1-CE2 3.99Å; L94-F179 HydrophobicContact CD1-CZ 4.08Å; I114-F179 HydrophobicContact CD1-CD2 4.03Å; L117-F179 HydrophobicContact CB-CE2 4.37Å; A118-F179 VanDerWaalsContact CA-CD2 3.46Å; A118-F179 HydrophobicContact CB-CB 3.42Å; A118-F179 VanDerWaalsContact CB-CB 3.42Å; A118-F179 HydrophobicContact CB-CD1 4.29Å; A118-F179 HydrophobicContact CB-CD2 3.5Å; A118-F179 VanDerWaalsContact CB-CD2 3.5Å; A118-F179 HydrophobicContact CB-CE2 4.31Å; A118-F179 HydrophobicContact CB-CG 3.49Å; A118-F179 VanDerWaalsContact CB-CG 3.49Å; G175-F179 WeakPolarHBondContact O-CD1 3.39Å; G175-F179 PolarHBondContact O-N 2.78Å; F179-G181 VanDerWaalsContact C-N 3.31Å; F179-G181 PolarHBondContact O-N 3.27Å; F179-C182 PolarHBondContact O-N 3.15Å; F179-E183 WeakPolarHBondContact O-CG 3.34Å; F179-E183 PolarHBondContact O-N 3.03Å
180D97.2Very high97.4Very high29 Ų2941.2 Ų41.216%0.15519%0.189CC..Hα-helixtrans-62.5-40175-171.976.9000111.9V176 C182 E183 K184 T231V176-D180 PolarHBondContact O-N 2.88Å; D180-C182 VanDerWaalsContact C-N 3.34Å; D180-C182 PolarHBondContact O-N 3.49Å; D180-E183 PolarHBondContact O-N 3.37Å; D180-K184 WeakPolarHBondContact O-CB 3.5Å; D180-K184 PolarHBondContact O-N 3.34Å; D180-K184 WeakPolarHBondContact OD1-CE 3.48Å; D180-K184 IonicContact OD1-NZ 2.7Å; D180-K184 PolarHBondContact OD1-NZ 2.85Å; D180-K184 WeakPolarHBondContact OD2-CD 3.42Å; D180-K184 WeakPolarHBondContact OD2-CE 3.44Å; D180-K184 IonicContact OD2-NZ 2.81Å; D180-K184 PolarHBondContact OD2-NZ 3.43Å; D180-T231 HydrophobicContact CB-CG2 3.29Å; D180-T231 WeakPolarHBondContact OD2-CG2 3.47Å
181G97Very high97.4Very high0 Ų043.9 Ų43.90%021%0.211CC..Hα-helixtrans-59-43.5173.800000112.4I177 F178 F179 Q185 R186I177-G181 PolarHBondContact O-N 3.48Å; F178-G181 PolarHBondContact O-N 2.85Å; F179-G181 VanDerWaalsContact C-N 3.31Å; F179-G181 PolarHBondContact O-N 3.27Å; G181-Q185 CarbonylContact O-C 3.52Å; G181-Q185 WeakPolarHBondContact O-CA 3.46Å; G181-Q185 PolarHBondContact O-N 2.73Å; G181-Q185 VanDerWaalsContact O-N 3.09Å; G181-R186 PolarHBondContact O-N 3.48Å
182C96.7Very high97.3Very high2 Ų245.2 Ų45.21%0.01422%0.222CC..Hα-helixtrans-68.2-40.8175.5-68.40000113.1Y91 F178 F179 D180 Q185Y91-C182 HydrophobicContact CD1-CB 3.99Å; Y91-C182 HydrophobicContact CE1-CB 3.46Å; Y91-C182 VanDerWaalsContact CE1-CB 3.46Å; Y91-C182 HydrophobicContact CE2-CB 4.17Å; F178-C182 VanDerWaalsContact CE1-SG 3.54Å; F178-C182 PolarHBondContact O-N 3Å; F178-C182 PolarHBondContact O-SG 3.39Å; F178-C182 VanDerWaalsContact O-SG 3.35Å; F179-C182 PolarHBondContact O-N 3.15Å; D180-C182 VanDerWaalsContact C-N 3.34Å; D180-C182 PolarHBondContact O-N 3.49Å; C182-Q185 PolarHBondContact O-N 3.32Å; C182-Q185 PolarHBondContact O-NE2 3.38Å
183E95.2Very high97.3Very high72 Ų7244.7 Ų44.734%0.33622%0.219SC..Hα-helixtrans-66.2-44.7178.8-76.9-71.1111.300111.5Y91 K95 I114 F179 D180 Q185Y91-E183 HydrophobicContact CE2-CG 4.22Å; Y91-E183 PolarHBondContact OH-OE1 3.19Å; K95-E183 IonicContact NZ-OE1 2.85Å; K95-E183 PolarHBondContact NZ-OE1 2.69Å; K95-E183 IonicContact NZ-OE2 3.97Å; I114-E183 HydrophobicContact CG1-CG 3.85Å; F179-E183 WeakPolarHBondContact O-CG 3.34Å; F179-E183 PolarHBondContact O-N 3.03Å; D180-E183 PolarHBondContact O-N 3.37Å; E183-Q185 VanDerWaalsContact C-N 3.3Å; E183-Q185 PolarHBondContact O-N 3.02Å
184K95.5Very high97.3Very high99 Ų9944.2 Ų44.243%0.4322%0.219SC..THydrogen-bonded Turntrans-876.2-179.6-63.7179.9-174.21480114D180 R186D180-K184 WeakPolarHBondContact O-CB 3.5Å; D180-K184 PolarHBondContact O-N 3.34Å; D180-K184 WeakPolarHBondContact OD1-CE 3.48Å; D180-K184 IonicContact OD1-NZ 2.7Å; D180-K184 PolarHBondContact OD1-NZ 2.85Å; D180-K184 WeakPolarHBondContact OD2-CD 3.42Å; D180-K184 WeakPolarHBondContact OD2-CE 3.44Å; D180-K184 IonicContact OD2-NZ 2.81Å; D180-K184 PolarHBondContact OD2-NZ 3.43Å; K184-R186 HydrophobicContact CB-CG 3.97Å; K184-R186 PolarHBondContact O-N 2.9Å; K184-R186 VanDerWaalsContact O-N 3.15Å
185Q94.9Very high97.3Very high113 Ų11346.9 Ų46.953%0.52824%0.241SC..THydrogen-bonded Turntrans53.831.3-176.2-61.5-67.4-56.800113.5G181 C182 E183 W187G181-Q185 CarbonylContact O-C 3.52Å; G181-Q185 WeakPolarHBondContact O-CA 3.46Å; G181-Q185 PolarHBondContact O-N 2.73Å; G181-Q185 VanDerWaalsContact O-N 3.09Å; C182-Q185 PolarHBondContact O-N 3.32Å; C182-Q185 PolarHBondContact O-NE2 3.38Å; E183-Q185 VanDerWaalsContact C-N 3.3Å; E183-Q185 PolarHBondContact O-N 3.02Å; Q185-W187 PolarHBondContact O-N 3.49Å; Q185-W187 VanDerWaalsContact OE1-CZ2 3.3Å
186R96.1Very high97.3Very high150 Ų15048.1 Ų48.157%0.56625%0.249SC*.  trans-9175177.7-67178.7178.4-171.9-3.6109.8G181 K184 L188 A189 V190G181-R186 PolarHBondContact O-N 3.48Å; K184-R186 HydrophobicContact CB-CG 3.97Å; K184-R186 PolarHBondContact O-N 2.9Å; K184-R186 VanDerWaalsContact O-N 3.15Å; R186-L188 PolarHBondContact O-N 3.44Å; R186-L188 VanDerWaalsContact O-N 3.14Å; R186-A189 HydrophobicContact CB-CB 4.31Å; R186-A189 WeakPolarHBondContact O-CB 3.33Å; R186-A189 PolarHBondContact O-N 3.5Å; R186-V190 PolarHBondContact O-N 3.22Å
187W96.2Very high97.4Very high134 Ų13447.5 Ų47.551%0.50825%0.245SC..Hα-helixtrans-59.5-26-177.7-60.6105.3000114.1F88 Q185 A189 V190 A191F88-W187 HydrophobicContact CE2-CH2 4.3Å; F88-W187 HydrophobicContact CE2-CZ3 4.35Å; Q185-W187 PolarHBondContact O-N 3.49Å; Q185-W187 VanDerWaalsContact OE1-CZ2 3.3Å; W187-A189 VanDerWaalsContact C-N 3.31Å; W187-A189 PolarHBondContact O-N 3.31Å; W187-V190 HydrophobicContact CE3-CG2 4.38Å; W187-V190 PolarHBondContact O-N 2.84Å; W187-A191 WeakPolarHBondContact O-CB 3.43Å; W187-A191 PolarHBondContact O-N 2.94Å
188L97.4Very high97.4Very high157 Ų15749.4 Ų49.482%0.82226%0.255SS*.Hα-helixtrans-61.9-37.2171.9-67.3175.8000112.5R186 A192R186-L188 PolarHBondContact O-N 3.44Å; R186-L188 VanDerWaalsContact O-N 3.14Å; L188-A192 WeakPolarHBondContact O-CB 3.47Å; L188-A192 PolarHBondContact O-N 3.02Å
189A97.1Very high97.4Very high13 Ų1353.3 Ų53.311%0.10728%0.275CS..Hα-helixtrans-68.5-40.3176.200000111.2I177 R186 W187 A192 V193 W227I177-A189 HydrophobicContact CG2-CB 4.29Å; R186-A189 HydrophobicContact CB-CB 4.31Å; R186-A189 WeakPolarHBondContact O-CB 3.33Å; R186-A189 PolarHBondContact O-N 3.5Å; W187-A189 VanDerWaalsContact C-N 3.31Å; W187-A189 PolarHBondContact O-N 3.31Å; A189-A192 PolarHBondContact O-N 3.07Å; A189-V193 WeakPolarHBondContact O-CG2 3.42Å; A189-V193 PolarHBondContact O-N 2.65Å; A189-W227 HydrophobicContact CB-CH2 4.17Å; A189-W227 HydrophobicContact CB-CZ2 3.81Å
190V97.9Very high97.4Very high16 Ų1653.2 Ų53.210%0.09728%0.275CS..Hα-helixtrans-61.7-49174.5178.80000110.5F178 R186 W187 A192 V193 V194F178-V190 HydrophobicContact CD2-CG1 4.02Å; F178-V190 HydrophobicContact CE2-CG1 3.56Å; F178-V190 HydrophobicContact CZ-CG1 3.92Å; R186-V190 PolarHBondContact O-N 3.22Å; W187-V190 HydrophobicContact CE3-CG2 4.38Å; W187-V190 PolarHBondContact O-N 2.84Å; V190-A192 VanDerWaalsContact C-N 3.3Å; V190-A192 PolarHBondContact O-N 3.02Å; V190-V193 WeakPolarHBondContact O-CB 3.38Å; V190-V193 PolarHBondContact O-N 3.2Å; V190-V193 VanDerWaalsContact O-N 3.15Å; V190-V194 WeakPolarHBondContact O-CG2 3.32Å; V190-V194 PolarHBondContact O-N 3.34Å; V190-V194 VanDerWaalsContact O-N 3.09Å
191A97.9Very high97.4Very high56 Ų5652.6 Ų52.646%0.46327%0.273SS..Hα-helixtrans-60.2-39.417700000112.2W187 V193 V194 A195W187-A191 WeakPolarHBondContact O-CB 3.43Å; W187-A191 PolarHBondContact O-N 2.94Å; A191-V193 VanDerWaalsContact C-N 3.35Å; A191-V193 PolarHBondContact O-N 3.05Å; A191-V194 PolarHBondContact O-N 3.47Å; A191-A195 VanDerWaalsContact O-CB 3.31Å; A191-A195 WeakPolarHBondContact O-CB 3.38Å; A191-A195 PolarHBondContact O-N 3.39Å
192A98.2Very high97.4Very high29 Ų2955 Ų5524%0.2429%0.29CS..Hα-helixtrans-63.8-37.8175.600000112.5L188 A189 V190 A195 T196 W227L188-A192 WeakPolarHBondContact O-CB 3.47Å; L188-A192 PolarHBondContact O-N 3.02Å; A189-A192 PolarHBondContact O-N 3.07Å; V190-A192 VanDerWaalsContact C-N 3.3Å; V190-A192 PolarHBondContact O-N 3.02Å; A192-A195 PolarHBondContact O-N 3.44Å; A192-T196 WeakPolarHBondContact O-CB 3.18Å; A192-T196 VanDerWaalsContact O-CG2 3.31Å; A192-T196 WeakPolarHBondContact O-CG2 3.24Å; A192-T196 PolarHBondContact O-N 2.96Å; A192-T196 PolarHBondContact O-OG1 3.23Å; A192-W227 HydrophobicContact CB-CH2 3.82Å; A192-W227 HydrophobicContact CB-CZ3 3.91Å
193V98.6Very high97.4Very high0 Ų056.1 Ų56.10%030%0.296CS..Hα-helixtrans-61.4-49.4173167.70000110.7W174 I177 F178 A189 V190 A191 A195 T196 H197 M224W174-V193 HydrophobicContact CB-CG1 3.62Å; W174-V193 HydrophobicContact CG-CG1 3.73Å; I177-V193 HydrophobicContact CB-CG2 3.93Å; I177-V193 HydrophobicContact CG2-CG2 3.67Å; F178-V193 HydrophobicContact CB-CG1 4.4Å; F178-V193 HydrophobicContact CB-CG2 4.46Å; F178-V193 HydrophobicContact CD2-CB 4.3Å; F178-V193 HydrophobicContact CD2-CG1 3.91Å; A189-V193 WeakPolarHBondContact O-CG2 3.42Å; A189-V193 PolarHBondContact O-N 2.65Å; V190-V193 WeakPolarHBondContact O-CB 3.38Å; V190-V193 PolarHBondContact O-N 3.2Å; V190-V193 VanDerWaalsContact O-N 3.15Å; A191-V193 VanDerWaalsContact C-N 3.35Å; A191-V193 PolarHBondContact O-N 3.05Å; V193-A195 PolarHBondContact O-N 3.44Å; V193-T196 PolarHBondContact O-N 3.12Å; V193-T196 PolarHBondContact O-OG1 2.84Å; V193-T196 VanDerWaalsContact O-OG1 3.04Å; V193-H197 WeakPolarHBondContact O-CB 3.48Å; V193-H197 PolarHBondContact O-N 3.18Å; V193-M224 HydrophobicContact CG2-CE 4.22Å
194V98.6Very high97.5Very high31 Ų3154.7 Ų54.719%0.18829%0.292CS..Hα-helixtrans-60.8-45.4178.2-178.50000111.1L81 E84 V190 A191 H197 L198L81-V194 HydrophobicContact CD2-CG1 4.05Å; E84-V194 HydrophobicContact CB-CG2 4.01Å; E84-V194 HydrophobicContact CG-CB 4.41Å; E84-V194 HydrophobicContact CG-CG1 4.32Å; E84-V194 HydrophobicContact CG-CG2 3.93Å; V190-V194 WeakPolarHBondContact O-CG2 3.32Å; V190-V194 PolarHBondContact O-N 3.34Å; V190-V194 VanDerWaalsContact O-N 3.09Å; A191-V194 PolarHBondContact O-N 3.47Å; V194-H197 PolarHBondContact O-N 3.12Å; V194-L198 HydrophobicContact CG1-CD1 4.22Å; V194-L198 WeakPolarHBondContact O-CG 3.42Å; V194-L198 PolarHBondContact O-N 2.86Å
195A98.5Very high97.5Very high56 Ų5654 Ų5446%0.46329%0.289SS..Hα-helixtrans-63.7-43.418000000112.3A191 A192 V193 L198 L199A191-A195 VanDerWaalsContact O-CB 3.31Å; A191-A195 WeakPolarHBondContact O-CB 3.38Å; A191-A195 PolarHBondContact O-N 3.39Å; A192-A195 PolarHBondContact O-N 3.44Å; V193-A195 PolarHBondContact O-N 3.44Å; A195-L198 PolarHBondContact O-N 3.11Å; A195-L199 WeakPolarHBondContact O-CB 3.5Å; A195-L199 PolarHBondContact O-N 3.03Å
196T98.6Very high97.5Very high27 Ų2753.1 Ų53.117%0.16629%0.285CS..Hα-helixtrans-68.7-34177.5510000112.1W174 A192 V193 L199 V200 I220 M224W174-T196 PolarHBondContact NE1-OG1 3.33Å; A192-T196 WeakPolarHBondContact O-CB 3.18Å; A192-T196 VanDerWaalsContact O-CG2 3.31Å; A192-T196 WeakPolarHBondContact O-CG2 3.24Å; A192-T196 PolarHBondContact O-N 2.96Å; A192-T196 PolarHBondContact O-OG1 3.23Å; V193-T196 PolarHBondContact O-N 3.12Å; V193-T196 PolarHBondContact O-OG1 2.84Å; V193-T196 VanDerWaalsContact O-OG1 3.04Å; T196-L199 PolarHBondContact O-N 3.48Å; T196-V200 WeakPolarHBondContact O-CB 3.42Å; T196-V200 WeakPolarHBondContact O-CG2 3.37Å; T196-V200 PolarHBondContact O-N 2.87Å; T196-I220 HydrophobicContact CG2-CG2 4.49Å; T196-M224 HydrophobicContact CG2-SD 4.16Å
197H98.7Very high97.3Very high5 Ų549.3 Ų49.32%0.02328%0.276CS..Hα-helixtrans-66.5-43.7173.4-169.7-174.4000112.1V80 Q83 E84 H171 W174 V193 V194 L199 S201V80-H197 HydrophobicContact CG1-CB 4.07Å; Q83-H197 PolarHBondContact OE1-CE1 3.42Å; E84-H197 IonicContact OE1-CE1 2.71Å; E84-H197 IonicContact OE1-CG 2.71Å; E84-H197 IonicContact OE1-ND1 3.56Å; E84-H197 PolarHBondContact OE1-ND1 3.22Å; H171-H197 AromaticContact CE1-CE1 3.56Å; H171-H197 AromaticContact CE1-NE2 3.72Å; W174-H197 HydrophobicContact CD2-CB 4.3Å; W174-H197 HydrophobicContact CE3-CB 4.17Å; W174-H197 AromaticContact CE3-CG 3.97Å; W174-H197 HydrophobicContact CH2-CB 3.76Å; W174-H197 AromaticContact CH2-CD2 3.48Å; W174-H197 VanDerWaalsContact CH2-CD2 3.48Å; W174-H197 WeakPolarHBondContact CH2-CD2 3.31Å; W174-H197 AromaticContact CH2-CG 3.74Å; W174-H197 VanDerWaalsContact CZ2-CA 3.41Å; W174-H197 HydrophobicContact CZ2-CB 3.84Å; W174-H197 HydrophobicContact CZ3-CB 3.92Å; W174-H197 AromaticContact CZ3-CD2 3.32Å; W174-H197 WeakPolarHBondContact CZ3-CD2 3.39Å; W174-H197 AromaticContact CZ3-CG 3.52Å; W174-H197 AromaticContact CZ3-NE2 3.85Å; V193-H197 WeakPolarHBondContact O-CB 3.48Å; V193-H197 PolarHBondContact O-N 3.18Å; V194-H197 PolarHBondContact O-N 3.12Å; H197-L199 VanDerWaalsContact C-N 3.34Å; H197-L199 PolarHBondContact O-N 3.32Å; H197-S201 WeakPolarHBondContact O-CB 3.41Å; H197-S201 PolarHBondContact O-N 2.61Å; H197-S201 PolarHBondContact O-OG 3.05Å
198L98.5Very high97Very high43 Ų4347.4 Ų47.423%0.22528%0.28CS..Hα-helixtrans-61.6-42.2172.6-76.5169.7000111.9V77 V80 L81 V194 A195 S201 S202V77-L198 HydrophobicContact CB-CD2 4.46Å; V77-L198 HydrophobicContact CG1-CD2 4.08Å; V77-L198 HydrophobicContact CG2-CD2 4.45Å; V80-L198 HydrophobicContact CB-CD2 3.8Å; V80-L198 HydrophobicContact CB-CG 4.49Å; V80-L198 HydrophobicContact CG1-CD2 3.6Å; V80-L198 HydrophobicContact CG1-CG 3.74Å; V80-L198 HydrophobicContact CG2-CD2 4.41Å; L81-L198 HydrophobicContact CD2-CD1 4.29Å; V194-L198 HydrophobicContact CG1-CD1 4.22Å; V194-L198 WeakPolarHBondContact O-CG 3.42Å; V194-L198 PolarHBondContact O-N 2.86Å; A195-L198 PolarHBondContact O-N 3.11Å; L198-S201 PolarHBondContact O-N 3.23Å; L198-S202 WeakPolarHBondContact O-CB 3.46Å; L198-S202 PolarHBondContact O-N 3.42Å; L198-S202 PolarHBondContact O-OG 3.2Å
199L98.3Very high96.9Very high85 Ų8545.5 Ų45.545%0.44527%0.268SS..Hα-helixtrans-62.4-51.2178.7177.160.3000111.3A195 T196 H197 S201 S202 L203 I220A195-L199 WeakPolarHBondContact O-CB 3.5Å; A195-L199 PolarHBondContact O-N 3.03Å; T196-L199 PolarHBondContact O-N 3.48Å; H197-L199 VanDerWaalsContact C-N 3.34Å; H197-L199 PolarHBondContact O-N 3.32Å; L199-S201 VanDerWaalsContact C-N 3.32Å; L199-S201 PolarHBondContact O-N 3.12Å; L199-S202 PolarHBondContact O-N 3.49Å; L199-S202 VanDerWaalsContact O-N 3.11Å; L199-L203 HydrophobicContact CD1-CG 4.45Å; L199-L203 HydrophobicContact CG-CD1 4.4Å; L199-L203 WeakPolarHBondContact O-CG 3.49Å; L199-L203 PolarHBondContact O-N 3.09Å; L199-I220 HydrophobicContact CD2-CD1 3.66Å; L199-I220 HydrophobicContact CG-CD1 3.99Å
200V98.3Very high96.7Very high0 Ų047.1 Ų47.10%027%0.271CS..Hα-helixtrans-61.4-41.4178.5171.20000111.3M163 I167 L170 W174 T196 S202 L203 T204 T217 I220M163-V200 HydrophobicContact CE-CG1 3.88Å; I167-V200 HydrophobicContact CD1-CG1 3.54Å; L170-V200 HydrophobicContact CD1-CB 4.45Å; L170-V200 HydrophobicContact CD1-CG1 3.94Å; L170-V200 HydrophobicContact CD1-CG2 3.93Å; W174-V200 HydrophobicContact CH2-CB 4.26Å; W174-V200 HydrophobicContact CZ2-CB 4.45Å; W174-V200 HydrophobicContact CZ2-CG2 4.26Å; T196-V200 WeakPolarHBondContact O-CB 3.42Å; T196-V200 WeakPolarHBondContact O-CG2 3.37Å; T196-V200 PolarHBondContact O-N 2.87Å; V200-S202 VanDerWaalsContact C-N 3.31Å; V200-S202 PolarHBondContact O-N 3.28Å; V200-L203 WeakPolarHBondContact O-CB 3.31Å; V200-L203 PolarHBondContact O-N 3.31Å; V200-T204 PolarHBondContact O-N 3.44Å; V200-T217 HydrophobicContact CG1-CG2 3.82Å; V200-I220 HydrophobicContact CG2-CB 4.25Å; V200-I220 HydrophobicContact CG2-CD1 3.81Å; V200-I220 HydrophobicContact CG2-CG2 3.87Å
201S97.9Very high96.6Very high16 Ų1651.8 Ų51.811%0.11230%0.3CS..Hα-helixtrans-62-41174.6-56.20000111.4V80 H197 L198 L199 T204V80-S201 VanDerWaalsContact CG2-OG 3.28Å; V80-S201 WeakPolarHBondContact CG2-OG 3.44Å; H197-S201 WeakPolarHBondContact O-CB 3.41Å; H197-S201 PolarHBondContact O-N 2.61Å; H197-S201 PolarHBondContact O-OG 3.05Å; L198-S201 PolarHBondContact O-N 3.23Å; L199-S201 VanDerWaalsContact C-N 3.32Å; L199-S201 PolarHBondContact O-N 3.12Å; S201-T204 WeakPolarHBondContact O-CB 3.38Å; S201-T204 PolarHBondContact O-N 2.98Å; S201-T204 PolarHBondContact O-OG1 2.87Å
202S96.9Very high96.4Very high51 Ų5151.4 Ų51.436%0.35729%0.293SS..Hα-helixtrans-70-32.6178.7-55.40000112.9L198 L199 V200 T204 F205L198-S202 WeakPolarHBondContact O-CB 3.46Å; L198-S202 PolarHBondContact O-N 3.42Å; L198-S202 PolarHBondContact O-OG 3.2Å; L199-S202 PolarHBondContact O-N 3.49Å; L199-S202 VanDerWaalsContact O-N 3.11Å; V200-S202 VanDerWaalsContact C-N 3.31Å; V200-S202 PolarHBondContact O-N 3.28Å; S202-T204 PolarHBondContact O-N 3.49Å; S202-F205 WeakPolarHBondContact O-CB 3.28Å; S202-F205 WeakPolarHBondContact O-CD2 3.27Å; S202-F205 PolarHBondContact O-N 2.7Å; S202-F205 VanDerWaalsContact O-N 3.09Å
203L97.2Very high96.3Very high25 Ų2550.1 Ų50.113%0.13128%0.282CS..Hα-helixtrans-60.2-30.8173.9-73.8169.4000111.3L199 V200 F205 Q206 S213 P216 I220L199-L203 HydrophobicContact CD1-CG 4.45Å; L199-L203 HydrophobicContact CG-CD1 4.4Å; L199-L203 WeakPolarHBondContact O-CG 3.49Å; L199-L203 PolarHBondContact O-N 3.09Å; V200-L203 WeakPolarHBondContact O-CB 3.31Å; V200-L203 PolarHBondContact O-N 3.31Å; L203-F205 PolarHBondContact O-N 3.44Å; L203-Q206 VanDerWaalsContact O-CB 3.27Å; L203-Q206 WeakPolarHBondContact O-CB 3.35Å; L203-Q206 PolarHBondContact O-N 2.86Å; L203-S213 WeakPolarHBondContact O-CB 3.36Å; L203-S213 PolarHBondContact O-OG 2.77Å; L203-P216 HydrophobicContact CD1-CB 3.79Å; L203-P216 HydrophobicContact CD2-CB 4.16Å; L203-I220 HydrophobicContact CD1-CD1 3.79Å
204T95.9Very high96.3Very high42 Ų4251.7 Ų51.726%0.25829%0.291SS..G310 helixtrans-64.1-23.1176.772.40000113.7M163 V200 S201 S202 Q206 N207M163-T204 HydrophobicContact CE-CG2 3.38Å; M163-T204 HydrophobicContact SD-CG2 4.36Å; V200-T204 PolarHBondContact O-N 3.44Å; S201-T204 WeakPolarHBondContact O-CB 3.38Å; S201-T204 PolarHBondContact O-N 2.98Å; S201-T204 PolarHBondContact O-OG1 2.87Å; S202-T204 PolarHBondContact O-N 3.49Å; T204-Q206 PolarHBondContact O-N 3.41Å; T204-N207 VanDerWaalsContact O-CB 3.28Å; T204-N207 WeakPolarHBondContact O-CB 3.49Å; T204-N207 PolarHBondContact O-N 2.96Å; T204-N207 VanDerWaalsContact O-N 3.12Å; T204-N207 PolarHBondContact O-ND2 2.86Å
205F95.8Very high96.2Very high86 Ų8653.9 Ų53.938%0.37730%0.304SS..G310 helixtrans-69.2-15.4174.8-57.4-39.9000113.6I73 V76 S202 L203 N207I73-F205 HydrophobicContact CB-CE2 4.5Å; I73-F205 HydrophobicContact CB-CZ 4.38Å; I73-F205 HydrophobicContact CG1-CE2 4.2Å; I73-F205 HydrophobicContact CG1-CZ 4.16Å; I73-F205 HydrophobicContact CG2-CE2 4.07Å; I73-F205 HydrophobicContact CG2-CZ 4.35Å; V76-F205 HydrophobicContact CB-CE1 4.24Å; V76-F205 HydrophobicContact CB-CZ 3.74Å; V76-F205 HydrophobicContact CG1-CE1 4.26Å; V76-F205 HydrophobicContact CG1-CZ 3.68Å; V76-F205 HydrophobicContact CG2-CE1 3.95Å; V76-F205 HydrophobicContact CG2-CZ 3.98Å; S202-F205 WeakPolarHBondContact O-CB 3.28Å; S202-F205 WeakPolarHBondContact O-CD2 3.27Å; S202-F205 PolarHBondContact O-N 2.7Å; S202-F205 VanDerWaalsContact O-N 3.09Å; L203-F205 PolarHBondContact O-N 3.44Å; F205-N207 PolarHBondContact O-N 2.78Å
206Q94.3Very high96.2Very high94 Ų9453.2 Ų53.244%0.43930%0.295SS..G310 helixtrans-74.6-14.5173.7-62.2-89.4-4.900111.7L203 T204 Q209L203-Q206 VanDerWaalsContact O-CB 3.27Å; L203-Q206 WeakPolarHBondContact O-CB 3.35Å; L203-Q206 PolarHBondContact O-N 2.86Å; T204-Q206 PolarHBondContact O-N 3.41Å; Q206-Q209 WeakPolarHBondContact O-CA 3.32Å; Q206-Q209 VanDerWaalsContact O-CB 3.31Å; Q206-Q209 WeakPolarHBondContact O-CB 3.31Å; Q206-Q209 PolarHBondContact O-N 3.07Å
207N92Very high96.2Very high70 Ų7051.9 Ų51.937%0.37429%0.287SS..THydrogen-bonded Turntrans-58.1131.3173.9-70.7-22.8000109.4T204 F205 S213T204-N207 VanDerWaalsContact O-CB 3.28Å; T204-N207 WeakPolarHBondContact O-CB 3.49Å; T204-N207 PolarHBondContact O-N 2.96Å; T204-N207 VanDerWaalsContact O-N 3.12Å; T204-N207 PolarHBondContact O-ND2 2.86Å; F205-N207 PolarHBondContact O-N 2.78Å; N207-S213 VanDerWaalsContact OD1-CB 3.28Å; N207-S213 WeakPolarHBondContact OD1-CB 3.33Å; N207-S213 PolarHBondContact OD1-OG 2.97Å; N207-S213 VanDerWaalsContact OD1-OG 3.12Å
208P91.1Very high96.2Very high93 Ų9354.4 Ų54.460%0.60430%0.296SS*.THydrogen-bonded Turncis-91.16.223.335.1-37000116.8Y210P208-Y210 VanDerWaalsContact C-N 3.3Å; P208-Y210 WeakPolarHBondContact O-CD2 3.45Å; P208-Y210 PolarHBondContact O-N 3.22Å
209Q94.2Very high96.2Very high118 Ų11856.5 Ų56.555%0.55131%0.307SS*.  trans-7480.4175.5-60-175.9-5.400111.3Q206 V211 S212 S213Q206-Q209 WeakPolarHBondContact O-CA 3.32Å; Q206-Q209 VanDerWaalsContact O-CB 3.31Å; Q206-Q209 WeakPolarHBondContact O-CB 3.31Å; Q206-Q209 PolarHBondContact O-N 3.07Å; Q209-V211 VanDerWaalsContact C-N 3.29Å; Q209-V211 PolarHBondContact O-N 3.4Å; Q209-S212 PolarHBondContact O-N 2.86Å; Q209-S212 VanDerWaalsContact O-N 3.12Å; Q209-S213 PolarHBondContact O-N 3.31Å
210Y93.8Very high96.2Very high47 Ų4753.7 Ų53.718%0.18429%0.292CS..Hα-helixtrans-61.3-32.2-173.4-57.8-57.7000114.1P208 S212 S213 L214P208-Y210 VanDerWaalsContact C-N 3.3Å; P208-Y210 WeakPolarHBondContact O-CD2 3.45Å; P208-Y210 PolarHBondContact O-N 3.22Å; Y210-S212 VanDerWaalsContact C-N 3.33Å; Y210-S212 PolarHBondContact O-N 3.43Å; Y210-S213 PolarHBondContact O-N 3.43Å; Y210-L214 WeakPolarHBondContact O-CA 3.15Å; Y210-L214 WeakPolarHBondContact O-CB 3.28Å; Y210-L214 PolarHBondContact O-N 2.99Å
211V95.1Very high96.2Very high114 Ų11454.8 Ų54.869%0.69130%0.298SS*.Hα-helixtrans-62.1-44.1176.9177.40000110.5Q209 S213 V215 P216Q209-V211 VanDerWaalsContact C-N 3.29Å; Q209-V211 PolarHBondContact O-N 3.4Å; V211-S213 VanDerWaalsContact C-N 3.29Å; V211-S213 PolarHBondContact O-N 3.43Å; V211-V215 HydrophobicContact CG1-CG2 4.45Å; V211-V215 WeakPolarHBondContact O-CB 3.28Å; V211-P216 VanDerWaalsContact O-CD 3.32Å; V211-P216 WeakPolarHBondContact O-CD 3.29Å
212S94.6Very high96.2Very high48 Ų4860.6 Ų60.634%0.33632%0.321SS..Hα-helixtrans-71.7-21.2179.9-52.60000113.6Q209 Y210 P216Q209-S212 PolarHBondContact O-N 2.86Å; Q209-S212 VanDerWaalsContact O-N 3.12Å; Y210-S212 VanDerWaalsContact C-N 3.33Å; Y210-S212 PolarHBondContact O-N 3.43Å; S212-P216 WeakPolarHBondContact O-CG 3.49Å
213S96.3Very high96.3Very high1 Ų164.5 Ų64.51%0.00733%0.332CS..Hα-helixtrans-100.2-55.5-177.1174.80000112.4L203 N207 Q209 Y210 V211 T217L203-S213 WeakPolarHBondContact O-CB 3.36Å; L203-S213 PolarHBondContact O-OG 2.77Å; N207-S213 VanDerWaalsContact OD1-CB 3.28Å; N207-S213 WeakPolarHBondContact OD1-CB 3.33Å; N207-S213 PolarHBondContact OD1-OG 2.97Å; N207-S213 VanDerWaalsContact OD1-OG 3.12Å; Q209-S213 PolarHBondContact O-N 3.31Å; Y210-S213 PolarHBondContact O-N 3.43Å; V211-S213 VanDerWaalsContact C-N 3.29Å; V211-S213 PolarHBondContact O-N 3.43Å; S213-T217 WeakPolarHBondContact O-CB 3.5Å; S213-T217 PolarHBondContact O-N 3.21Å; S213-T217 PolarHBondContact O-OG1 2.92Å
214L96.9Very high96.4Very high34 Ų3463.7 Ų63.718%0.17833%0.327CS..Hα-helixtrans-75.8-46.3-170.4-162.268.9000111.7F162 M163 Y210 T217 Y218F162-L214 HydrophobicContact CB-CD1 4.24Å; F162-L214 HydrophobicContact CB-CD2 4.17Å; M163-L214 HydrophobicContact CB-CD1 4Å; M163-L214 HydrophobicContact SD-CD1 4.07Å; Y210-L214 WeakPolarHBondContact O-CA 3.15Å; Y210-L214 WeakPolarHBondContact O-CB 3.28Å; Y210-L214 PolarHBondContact O-N 2.99Å; L214-T217 WeakPolarHBondContact O-CB 3.44Å; L214-T217 PolarHBondContact O-N 2.82Å; L214-Y218 HydrophobicContact CD1-CD2 4.19Å; L214-Y218 HydrophobicContact CD1-CE2 3.77Å; L214-Y218 HydrophobicContact CG-CD2 4.05Å; L214-Y218 HydrophobicContact CG-CE2 3.95Å; L214-Y218 WeakPolarHBondContact O-CD2 3.29Å; L214-Y218 PolarHBondContact O-N 3.31Å
215V97.5Very high96.5Very high77 Ų7762.4 Ų62.447%0.46732%0.323SS..Hα-helixtrans-61.7-49.3-177.1177.60000111.3V211 T217 Y218 I219V211-V215 HydrophobicContact CG1-CG2 4.45Å; V211-V215 WeakPolarHBondContact O-CB 3.28Å; V215-T217 VanDerWaalsContact C-N 3.32Å; V215-T217 PolarHBondContact O-N 2.8Å; V215-Y218 PolarHBondContact O-N 3.25Å; V215-I219 HydrophobicContact CG1-CD1 4.03Å; V215-I219 WeakPolarHBondContact O-CG1 3.31Å; V215-I219 PolarHBondContact O-N 3.05Å
216P98.1Very high96.6Very high41 Ų4160.9 Ų60.927%0.26632%0.32SS..Hα-helixtrans-61.2-37.6174.8-26.638.5000113.3L203 V211 S212 Y218 I219 I220L203-P216 HydrophobicContact CD1-CB 3.79Å; L203-P216 HydrophobicContact CD2-CB 4.16Å; V211-P216 VanDerWaalsContact O-CD 3.32Å; V211-P216 WeakPolarHBondContact O-CD 3.29Å; S212-P216 WeakPolarHBondContact O-CG 3.49Å; P216-Y218 VanDerWaalsContact C-N 3.33Å; P216-Y218 PolarHBondContact O-N 3.25Å; P216-I219 PolarHBondContact O-N 3.27Å; P216-I220 VanDerWaalsContact O-CG1 3.31Å; P216-I220 WeakPolarHBondContact O-CG1 3.41Å; P216-I220 PolarHBondContact O-N 2.97Å
217T98.4Very high96.8Very high0 Ų061 Ų610%032%0.317CS..Hα-helixtrans-59.2-43.4175.5-640000111.8M163 A166 L170 V200 S213 L214 V215 I220 M221M163-T217 HydrophobicContact CE-CG2 3.83Å; M163-T217 HydrophobicContact SD-CG2 4.01Å; A166-T217 HydrophobicContact CB-CG2 3.86Å; L170-T217 HydrophobicContact CD1-CG2 4.18Å; V200-T217 HydrophobicContact CG1-CG2 3.82Å; S213-T217 WeakPolarHBondContact O-CB 3.5Å; S213-T217 PolarHBondContact O-N 3.21Å; S213-T217 PolarHBondContact O-OG1 2.92Å; L214-T217 WeakPolarHBondContact O-CB 3.44Å; L214-T217 PolarHBondContact O-N 2.82Å; V215-T217 VanDerWaalsContact C-N 3.32Å; V215-T217 PolarHBondContact O-N 2.8Å; T217-I220 PolarHBondContact O-N 3.46Å; T217-M221 WeakPolarHBondContact O-CB 3.34Å; T217-M221 PolarHBondContact O-N 3.29Å
218Y98.5Very high97Very high57 Ų5758 Ų5822%0.22430%0.301CS..Hα-helixtrans-68.7-35.5177.3-89.1-103.4000113F162 M165 A166 L214 V215 P216 M221 F222F162-Y218 WeakPolarHBondContact CA-OH 3.46Å; F162-Y218 HydrophobicContact CB-CE2 4.28Å; F162-Y218 WeakPolarHBondContact CB-OH 3.48Å; F162-Y218 VanDerWaalsContact CD1-OH 3.26Å; F162-Y218 WeakPolarHBondContact CD1-OH 3.45Å; F162-Y218 PolarHBondContact O-OH 3.08Å; M165-Y218 HydrophobicContact CE-CE1 3.71Å; M165-Y218 WeakPolarHBondContact CE-OH 3.42Å; A166-Y218 HydrophobicContact CB-CD2 4.29Å; A166-Y218 HydrophobicContact CB-CE2 3.81Å; L214-Y218 HydrophobicContact CD1-CD2 4.19Å; L214-Y218 HydrophobicContact CD1-CE2 3.77Å; L214-Y218 HydrophobicContact CG-CD2 4.05Å; L214-Y218 HydrophobicContact CG-CE2 3.95Å; L214-Y218 WeakPolarHBondContact O-CD2 3.29Å; L214-Y218 PolarHBondContact O-N 3.31Å; V215-Y218 PolarHBondContact O-N 3.25Å; P216-Y218 VanDerWaalsContact C-N 3.33Å; P216-Y218 PolarHBondContact O-N 3.25Å; Y218-M221 HydrophobicContact CD1-CE 3.48Å; Y218-M221 VanDerWaalsContact CD1-CE 3.48Å; Y218-M221 HydrophobicContact CE1-CE 3.67Å; Y218-M221 HydrophobicContact CG-CE 4.23Å; Y218-M221 PolarHBondContact O-N 3.44Å; Y218-F222 WeakPolarHBondContact O-CB 3.39Å; Y218-F222 PolarHBondContact O-N 3.29Å
219I98.5Very high97.3Very high88 Ų8857.8 Ų57.845%0.45129%0.291SS..Hα-helixtrans-62.1-47.8173.1-67.6168.8000110V215 P216 M221 F222 F223V215-I219 HydrophobicContact CG1-CD1 4.03Å; V215-I219 WeakPolarHBondContact O-CG1 3.31Å; V215-I219 PolarHBondContact O-N 3.05Å; P216-I219 PolarHBondContact O-N 3.27Å; I219-M221 PolarHBondContact O-N 3.49Å; I219-F222 PolarHBondContact O-N 3.25Å; I219-F223 HydrophobicContact CG2-CD2 3.78Å; I219-F223 HydrophobicContact CG2-CE2 3.51Å; I219-F223 WeakPolarHBondContact O-CD2 3.42Å; I219-F223 PolarHBondContact O-N 3.31Å; I219-F223 VanDerWaalsContact O-N 3.11Å
220I98.6Very high97.3Very high25 Ų2557.6 Ų57.613%0.12829%0.286CS..Hα-helixtrans-61.1-46.2176.5-65.9164.5000110.3L170 T196 L199 V200 L203 P216 T217 F222 F223 M224L170-I220 HydrophobicContact CD2-CG2 4.27Å; T196-I220 HydrophobicContact CG2-CG2 4.49Å; L199-I220 HydrophobicContact CD2-CD1 3.66Å; L199-I220 HydrophobicContact CG-CD1 3.99Å; V200-I220 HydrophobicContact CG2-CB 4.25Å; V200-I220 HydrophobicContact CG2-CD1 3.81Å; V200-I220 HydrophobicContact CG2-CG2 3.87Å; L203-I220 HydrophobicContact CD1-CD1 3.79Å; P216-I220 VanDerWaalsContact O-CG1 3.31Å; P216-I220 WeakPolarHBondContact O-CG1 3.41Å; P216-I220 PolarHBondContact O-N 2.97Å; T217-I220 PolarHBondContact O-N 3.46Å; I220-F222 VanDerWaalsContact C-N 3.3Å; I220-F222 PolarHBondContact O-N 3.16Å; I220-F223 PolarHBondContact O-N 3.45Å; I220-M224 HydrophobicContact CG2-CG 4.02Å; I220-M224 WeakPolarHBondContact O-CB 3.48Å; I220-M224 VanDerWaalsContact O-CG 3.3Å; I220-M224 WeakPolarHBondContact O-CG 3.45Å; I220-M224 PolarHBondContact O-N 3.41Å
221M98.6Very high97.4Very high23 Ų2356.1 Ų56.111%0.11328%0.282CS..Hα-helixtrans-56.2-43.9176.7-178.6-172.669.500112A166 L169 L170 F173 T217 Y218 I219 M224 G225A166-M221 HydrophobicContact CB-SD 3.92Å; L169-M221 HydrophobicContact CB-CG 4.36Å; L169-M221 HydrophobicContact CB-SD 3.89Å; L169-M221 HydrophobicContact CD1-SD 3.78Å; L169-M221 HydrophobicContact CG-SD 4.45Å; L170-M221 HydrophobicContact CD1-CB 4.31Å; L170-M221 HydrophobicContact CD2-CB 4.11Å; L170-M221 HydrophobicContact CD2-CG 4.49Å; L170-M221 HydrophobicContact CG-CB 3.97Å; L170-M221 HydrophobicContact CG-CG 4.14Å; F173-M221 HydrophobicContact CD2-CG 4.37Å; F173-M221 HydrophobicContact CE2-CG 3.91Å; T217-M221 WeakPolarHBondContact O-CB 3.34Å; T217-M221 PolarHBondContact O-N 3.29Å; Y218-M221 HydrophobicContact CD1-CE 3.48Å; Y218-M221 VanDerWaalsContact CD1-CE 3.48Å; Y218-M221 HydrophobicContact CE1-CE 3.67Å; Y218-M221 HydrophobicContact CG-CE 4.23Å; Y218-M221 PolarHBondContact O-N 3.44Å; I219-M221 PolarHBondContact O-N 3.49Å; M221-M224 PolarHBondContact O-N 2.85Å; M221-G225 PolarHBondContact O-N 2.99Å
222F98.5Very high97.2Very high139 Ų13953 Ų5361%0.6127%0.269SS*.Hα-helixtrans-60.5-50176.9177-99.7000111.6Y218 I219 I220 M224 G225 V226Y218-F222 WeakPolarHBondContact O-CB 3.39Å; Y218-F222 PolarHBondContact O-N 3.29Å; I219-F222 PolarHBondContact O-N 3.25Å; I220-F222 VanDerWaalsContact C-N 3.3Å; I220-F222 PolarHBondContact O-N 3.16Å; F222-M224 PolarHBondContact O-N 2.99Å; F222-G225 PolarHBondContact O-N 2.72Å; F222-V226 HydrophobicContact CD1-CG2 4.45Å; F222-V226 HydrophobicContact CE1-CG2 4.06Å; F222-V226 HydrophobicContact CE2-CG2 4.3Å; F222-V226 HydrophobicContact CZ-CG2 3.98Å; F222-V226 WeakPolarHBondContact O-CG2 3.31Å; F222-V226 PolarHBondContact O-N 3.46Å
223F98.5Very high97Very high132 Ų13252.9 Ų52.958%0.57927%0.274SS*.Hα-helixtrans-64.8-40.8179.4-73.9-63.3000113I219 I220 G225 V226 W227I219-F223 HydrophobicContact CG2-CD2 3.78Å; I219-F223 HydrophobicContact CG2-CE2 3.51Å; I219-F223 WeakPolarHBondContact O-CD2 3.42Å; I219-F223 PolarHBondContact O-N 3.31Å; I219-F223 VanDerWaalsContact O-N 3.11Å; I220-F223 PolarHBondContact O-N 3.45Å; F223-G225 VanDerWaalsContact C-N 3.32Å; F223-G225 PolarHBondContact O-N 3.29Å; F223-V226 PolarHBondContact O-N 2.81Å; F223-W227 WeakPolarHBondContact O-CB 3.43Å; F223-W227 PolarHBondContact O-N 3.47Å
224M98.6Very high96.6Very high8 Ų853.4 Ų53.44%0.03928%0.28CS..Hα-helixtrans-65.4-37.1175-66.5-52.2-76.100111.6L170 F173 I177 V193 T196 I220 M221 F222 W227 A228L170-M224 HydrophobicContact CD2-CB 3.97Å; L170-M224 HydrophobicContact CD2-CG 4Å; F173-M224 HydrophobicContact CB-CB 4.22Å; F173-M224 HydrophobicContact CD2-CB 4.41Å; I177-M224 HydrophobicContact CD1-CE 3.49Å; I177-M224 VanDerWaalsContact CD1-CE 3.49Å; I177-M224 HydrophobicContact CD1-SD 4.41Å; V193-M224 HydrophobicContact CG2-CE 4.22Å; T196-M224 HydrophobicContact CG2-SD 4.16Å; I220-M224 HydrophobicContact CG2-CG 4.02Å; I220-M224 WeakPolarHBondContact O-CB 3.48Å; I220-M224 VanDerWaalsContact O-CG 3.3Å; I220-M224 WeakPolarHBondContact O-CG 3.45Å; I220-M224 PolarHBondContact O-N 3.41Å; M221-M224 PolarHBondContact O-N 2.85Å; F222-M224 PolarHBondContact O-N 2.99Å; M224-W227 HydrophobicContact CE-CE3 4.16Å; M224-W227 HydrophobicContact CE-CZ3 4.41Å; M224-W227 PolarHBondContact O-N 3.33Å; M224-W227 HydrophobicContact SD-CE3 3.94Å; M224-W227 HydrophobicContact SD-CZ3 4.39Å; M224-A228 VanDerWaalsContact O-CB 3.32Å; M224-A228 WeakPolarHBondContact O-CB 3.38Å; M224-A228 PolarHBondContact O-N 2.94Å
225G98.3Very high96.3Very high15 Ų1553.5 Ų53.516%0.15528%0.284CS..Hα-helixtrans-63.9-44.2173.700000112.7M221 F222 F223 W227 A228 F229M221-G225 PolarHBondContact O-N 2.99Å; F222-G225 PolarHBondContact O-N 2.72Å; F223-G225 VanDerWaalsContact C-N 3.32Å; F223-G225 PolarHBondContact O-N 3.29Å; G225-W227 PolarHBondContact O-N 2.87Å; G225-A228 PolarHBondContact O-N 3.41Å; G225-F229 WeakPolarHBondContact O-CB 3.43Å; G225-F229 PolarHBondContact O-N 3.38Å
226V97.9Very high95.8Very high54 Ų5455.7 Ų55.733%0.32729%0.292SS..Hα-helixtrans-60.8-45.3174.2172.20000110.7F222 F223 F229 Y230F222-V226 HydrophobicContact CD1-CG2 4.45Å; F222-V226 HydrophobicContact CE1-CG2 4.06Å; F222-V226 HydrophobicContact CE2-CG2 4.3Å; F222-V226 HydrophobicContact CZ-CG2 3.98Å; F222-V226 WeakPolarHBondContact O-CG2 3.31Å; F222-V226 PolarHBondContact O-N 3.46Å; F223-V226 PolarHBondContact O-N 2.81Å; V226-F229 WeakPolarHBondContact O-CB 3.45Å; V226-F229 PolarHBondContact O-N 3.49Å; V226-Y230 HydrophobicContact CG1-CD2 3.86Å; V226-Y230 HydrophobicContact CG1-CE2 3.6Å; V226-Y230 WeakPolarHBondContact O-CD2 3.44Å; V226-Y230 PolarHBondContact O-N 3.48Å; V226-Y230 VanDerWaalsContact O-N 3.15Å
227W98.1Very high95.1Very high98 Ų9861.9 Ų61.937%0.37131%0.31SS..Hα-helixtrans-64.1-44.3177.5-173.35.3000111.7I177 A189 A192 F223 M224 G225 F229 Y230 T231I177-W227 HydrophobicContact CD1-CB 3.92Å; I177-W227 HydrophobicContact CD1-CD2 3.84Å; I177-W227 HydrophobicContact CD1-CE3 4.03Å; I177-W227 HydrophobicContact CD1-CG 3.82Å; I177-W227 HydrophobicContact CG1-CD2 4.33Å; I177-W227 HydrophobicContact CG1-CG 4.22Å; I177-W227 HydrophobicContact CG2-CD2 4.2Å; I177-W227 HydrophobicContact CG2-CE3 4.47Å; I177-W227 HydrophobicContact CG2-CH2 4.24Å; I177-W227 HydrophobicContact CG2-CZ2 3.93Å; I177-W227 HydrophobicContact CG2-CZ3 4.49Å; A189-W227 HydrophobicContact CB-CH2 4.17Å; A189-W227 HydrophobicContact CB-CZ2 3.81Å; A192-W227 HydrophobicContact CB-CH2 3.82Å; A192-W227 HydrophobicContact CB-CZ3 3.91Å; F223-W227 WeakPolarHBondContact O-CB 3.43Å; F223-W227 PolarHBondContact O-N 3.47Å; M224-W227 HydrophobicContact CE-CE3 4.16Å; M224-W227 HydrophobicContact CE-CZ3 4.41Å; M224-W227 PolarHBondContact O-N 3.33Å; M224-W227 HydrophobicContact SD-CE3 3.94Å; M224-W227 HydrophobicContact SD-CZ3 4.39Å; G225-W227 PolarHBondContact O-N 2.87Å; W227-F229 VanDerWaalsContact C-N 3.31Å; W227-F229 PolarHBondContact O-N 3.5Å; W227-Y230 PolarHBondContact O-N 2.75Å; W227-T231 VanDerWaalsContact CD1-OG1 3.24Å; W227-T231 PolarHBondContact NE1-OG1 3.5Å; W227-T231 WeakPolarHBondContact O-CB 3.22Å; W227-T231 PolarHBondContact O-N 3.16Å; W227-T231 PolarHBondContact O-OG1 3.32Å
228A97.7Very high94.5Very high6 Ų665.7 Ų65.75%0.0533%0.33CS..Hα-helixtrans-59.7-40.5175.400000111.9F173 V176 I177 M224 G225 T231 A232F173-A228 HydrophobicContact CB-CB 3.96Å; F173-A228 HydrophobicContact CD1-CB 3.95Å; F173-A228 HydrophobicContact CG-CB 4.22Å; V176-A228 HydrophobicContact CB-CB 4.28Å; V176-A228 HydrophobicContact CG1-CB 4.22Å; I177-A228 HydrophobicContact CD1-CB 4.23Å; I177-A228 HydrophobicContact CG1-CB 4.19Å; M224-A228 VanDerWaalsContact O-CB 3.32Å; M224-A228 WeakPolarHBondContact O-CB 3.38Å; M224-A228 PolarHBondContact O-N 2.94Å; G225-A228 PolarHBondContact O-N 3.41Å; A228-T231 PolarHBondContact O-N 3.48Å; A228-A232 WeakPolarHBondContact O-CB 3.41Å; A228-A232 PolarHBondContact O-N 3.02Å
229F96.2Very high93.8Very high88 Ų8867 Ų6739%0.38634%0.341SS..Hα-helixtrans-59.1-49.6176175.5-100.7000112.4G225 V226 W227 T231 A232 G233 G234G225-F229 WeakPolarHBondContact O-CB 3.43Å; G225-F229 PolarHBondContact O-N 3.38Å; V226-F229 WeakPolarHBondContact O-CB 3.45Å; V226-F229 PolarHBondContact O-N 3.49Å; W227-F229 VanDerWaalsContact C-N 3.31Å; W227-F229 PolarHBondContact O-N 3.5Å; F229-T231 VanDerWaalsContact C-N 3.33Å; F229-T231 PolarHBondContact O-N 2.91Å; F229-A232 PolarHBondContact O-N 3.14Å; F229-G233 PolarHBondContact O-N 3.33Å; F229-G234 WeakPolarHBondContact O-CA 3.39Å; F229-G234 PolarHBondContact O-N 3.33Å
230Y95.6Very high93.2Very high114 Ų11470 Ų7045%0.44735%0.351SS..Hα-helixtrans-65.4-38176.3-75.5-67.9000112.3V226 W227 A232 G233 G234V226-Y230 HydrophobicContact CG1-CD2 3.86Å; V226-Y230 HydrophobicContact CG1-CE2 3.6Å; V226-Y230 WeakPolarHBondContact O-CD2 3.44Å; V226-Y230 PolarHBondContact O-N 3.48Å; V226-Y230 VanDerWaalsContact O-N 3.15Å; W227-Y230 PolarHBondContact O-N 2.75Å; Y230-A232 VanDerWaalsContact C-N 3.29Å; Y230-A232 PolarHBondContact O-N 2.97Å; Y230-G233 PolarHBondContact O-N 3.31Å; Y230-G234 VanDerWaalsContact CD1-O 3.25Å; Y230-G234 WeakPolarHBondContact CD1-O 3.46Å
231T94.6Very high92.4Very high17 Ų1770.7 Ų70.710%0.10435%0.354CS..Hα-helixtrans-63.3-36.9178.3-57.70000111.6V176 D180 W227 A228 F229 G233V176-T231 HydrophobicContact CG1-CG2 4.37Å; D180-T231 HydrophobicContact CB-CG2 3.29Å; D180-T231 WeakPolarHBondContact OD2-CG2 3.47Å; W227-T231 VanDerWaalsContact CD1-OG1 3.24Å; W227-T231 PolarHBondContact NE1-OG1 3.5Å; W227-T231 WeakPolarHBondContact O-CB 3.22Å; W227-T231 PolarHBondContact O-N 3.16Å; W227-T231 PolarHBondContact O-OG1 3.32Å; A228-T231 PolarHBondContact O-N 3.48Å; F229-T231 VanDerWaalsContact C-N 3.33Å; F229-T231 PolarHBondContact O-N 2.91Å; T231-G233 PolarHBondContact O-N 2.82Å
232A92Very high91.6Very high49 Ų4973.6 Ų73.641%0.40538%0.376SS..THydrogen-bonded Turntrans-73.4-7175.800000114.1R115 A228 F229 Y230R115-A232 PolarHBondContact NH1-O 3.45Å; A228-A232 WeakPolarHBondContact O-CB 3.41Å; A228-A232 PolarHBondContact O-N 3.02Å; F229-A232 PolarHBondContact O-N 3.14Å; Y230-A232 VanDerWaalsContact C-N 3.29Å; Y230-A232 PolarHBondContact O-N 2.97Å
233G89.3Confident90.9Very high44 Ų4473.5 Ų73.545%0.45438%0.381SS..THydrogen-bonded Turntrans102.310.8-179.500000114.6F229 Y230 T231 N238F229-G233 PolarHBondContact O-N 3.33Å; Y230-G233 PolarHBondContact O-N 3.31Å; T231-G233 PolarHBondContact O-N 2.82Å; G233-N238 PolarHBondContact O-ND2 2.98Å
234G88.6Confident90.3Very high13 Ų1370.3 Ų70.313%0.13437%0.373CS..  trans-66.7151.9172.700000112.6F229 Y230F229-G234 WeakPolarHBondContact O-CA 3.39Å; F229-G234 PolarHBondContact O-N 3.33Å; Y230-G234 VanDerWaalsContact CD1-O 3.25Å; Y230-G234 WeakPolarHBondContact CD1-O 3.46Å
235S90.3Very high89.1Confident35 Ų3575.1 Ų75.125%0.24541%0.406CS..  trans-150.5161.3172.380.40000110.6R237 N238 L239S235-R237 PolarHBondContact O-N 3.5Å; S235-R237 PolarHBondContact OG-N 3.19Å; S235-N238 PolarHBondContact O-N 2.73Å; S235-N238 VanDerWaalsContact O-N 3.08Å; S235-N238 PolarHBondContact OG-N 2.98Å; S235-N238 VanDerWaalsContact OG-N 3.09Å; S235-N238 PolarHBondContact OG-OD1 2.91Å; S235-L239 PolarHBondContact O-N 3.46Å
236L86.2Confident87.5Confident124 Ų12480.7 Ų80.765%0.64943%0.426SS*.Hα-helixtrans-58.6-30.5172.8-69175.3000112.1L239 K240L236-L239 PolarHBondContact O-N 3Å; L236-K240 WeakPolarHBondContact O-CB 3.39Å; L236-K240 PolarHBondContact O-N 3.02Å
237R84.9Confident85.5Confident170 Ų17082 Ų8264%0.64243%0.431SS*.Hα-helixtrans-66-46.7174.1-176.3-178.5177.1179-1110.9S235 L239 K240 L241S235-R237 PolarHBondContact O-N 3.5Å; S235-R237 PolarHBondContact OG-N 3.19Å; R237-L239 VanDerWaalsContact C-N 3.27Å; R237-L239 PolarHBondContact O-N 3.38Å; R237-K240 PolarHBondContact O-N 3.48Å; R237-L241 HydrophobicContact CG-CD1 4.04Å; R237-L241 WeakPolarHBondContact O-CB 3.32Å; R237-L241 VanDerWaalsContact O-CG 3.3Å; R237-L241 WeakPolarHBondContact O-CG 3.47Å; R237-L241 PolarHBondContact O-N 2.92Å
238N85Confident83.3Confident80 Ų8085.6 Ų85.643%0.42845%0.45SS..Hα-helixtrans-61.8-40177.7-60.620000110.4G233 S235 L241 C242G233-N238 PolarHBondContact O-ND2 2.98Å; S235-N238 PolarHBondContact O-N 2.73Å; S235-N238 VanDerWaalsContact O-N 3.08Å; S235-N238 PolarHBondContact OG-N 2.98Å; S235-N238 VanDerWaalsContact OG-N 3.09Å; S235-N238 PolarHBondContact OG-OD1 2.91Å; N238-L241 PolarHBondContact O-N 3.24Å; N238-C242 WeakPolarHBondContact O-CB 3.4Å; N238-C242 PolarHBondContact O-N 3.46Å
239L84.6Confident81.2Confident85 Ų8591 Ų9145%0.44548%0.477SS..Hα-helixtrans-63.8-46176.7-168.770.3000111.5S235 L236 R237 L241 C242 L243S235-L239 PolarHBondContact O-N 3.46Å; L236-L239 PolarHBondContact O-N 3Å; R237-L239 VanDerWaalsContact C-N 3.27Å; R237-L239 PolarHBondContact O-N 3.38Å; L239-L241 VanDerWaalsContact C-N 3.32Å; L239-L241 PolarHBondContact O-N 3.1Å; L239-C242 PolarHBondContact O-N 2.97Å; L239-L243 HydrophobicContact CG-CD1 4.21Å; L239-L243 WeakPolarHBondContact O-CB 3.06Å; L239-L243 VanDerWaalsContact O-CG 3.32Å; L239-L243 WeakPolarHBondContact O-CG 3.47Å; L239-L243 PolarHBondContact O-N 2.92Å
240K84.4Confident79Confident150 Ų15090.8 Ų90.865%0.65248%0.477SS*.Hα-helixtrans-61.4-40.5175.8-172.3177.5-177.7177.60111.9L236 R237 T244L236-K240 WeakPolarHBondContact O-CB 3.39Å; L236-K240 PolarHBondContact O-N 3.02Å; R237-K240 PolarHBondContact O-N 3.48Å; K240-T244 WeakPolarHBondContact O-CB 3.47Å; K240-T244 WeakPolarHBondContact O-CG2 3.4Å; K240-T244 PolarHBondContact O-N 3.05Å; K240-T244 PolarHBondContact O-OG1 3.47Å
241L81.9Confident76.9Confident40 Ų4091.2 Ų91.221%0.20949%0.486CS..Hα-helixtrans-66.2-42.8177.7-73.3169000112R237 N238 L239 T244 C245 K246R237-L241 HydrophobicContact CG-CD1 4.04Å; R237-L241 WeakPolarHBondContact O-CB 3.32Å; R237-L241 VanDerWaalsContact O-CG 3.3Å; R237-L241 WeakPolarHBondContact O-CG 3.47Å; R237-L241 PolarHBondContact O-N 2.92Å; N238-L241 PolarHBondContact O-N 3.24Å; L239-L241 VanDerWaalsContact C-N 3.32Å; L239-L241 PolarHBondContact O-N 3.1Å; L241-T244 PolarHBondContact O-N 2.73Å; L241-T244 PolarHBondContact O-OG1 3.17Å; L241-C245 PolarHBondContact O-N 3.04Å; L241-K246 HydrophobicContact CD2-CB 4.19Å; L241-K246 PolarHBondContact O-N 3.23Å
242C81.9Confident74.9Confident85 Ų8596.5 Ų96.557%0.57451%0.513SS*.Hα-helixtrans-60.2-49.2174.3-176.80000111.4N238 L239 T244 C245N238-C242 WeakPolarHBondContact O-CB 3.4Å; N238-C242 PolarHBondContact O-N 3.46Å; L239-C242 PolarHBondContact O-N 2.97Å; C242-T244 VanDerWaalsContact C-N 3.3Å; C242-T244 PolarHBondContact O-N 3.39Å; C242-C245 PolarHBondContact O-N 3.25Å; C242-C245 VanDerWaalsContact O-N 3.16Å
243L83.9Confident73.1Confident136 Ų13697.1 Ų97.171%0.71252%0.518SS*.Hα-helixtrans-64.4-31.8178.9-72.4170.9000113.5L239L239-L243 HydrophobicContact CG-CD1 4.21Å; L239-L243 WeakPolarHBondContact O-CB 3.06Å; L239-L243 VanDerWaalsContact O-CG 3.32Å; L239-L243 WeakPolarHBondContact O-CG 3.47Å; L239-L243 PolarHBondContact O-N 2.92Å
244T86Confident71.2Confident66 Ų66100.7 Ų100.741%0.40553%0.527SS..THydrogen-bonded Turntrans-90.5-1.1178.654.70000113.2K240 L241 C242 K246K240-T244 WeakPolarHBondContact O-CB 3.47Å; K240-T244 WeakPolarHBondContact O-CG2 3.4Å; K240-T244 PolarHBondContact O-N 3.05Å; K240-T244 PolarHBondContact O-OG1 3.47Å; L241-T244 PolarHBondContact O-N 2.73Å; L241-T244 PolarHBondContact O-OG1 3.17Å; C242-T244 VanDerWaalsContact C-N 3.3Å; C242-T244 PolarHBondContact O-N 3.39Å; T244-K246 PolarHBondContact O-N 3.41Å
245C72.6Confident69.2Low109 Ų109108 Ų10874%0.73656%0.557SS**THydrogen-bonded Turntrans48.525.4-174.2-600000114.3L241 C242 D247L241-C245 PolarHBondContact O-N 3.04Å; C242-C245 PolarHBondContact O-N 3.25Å; C242-C245 VanDerWaalsContact O-N 3.16Å; C245-D247 PolarHBondContact O-N 3.22Å
246K65.5Low66.5Low131 Ų131116.3 Ų116.357%0.5758%0.583SS**THydrogen-bonded Turntrans-819-179-74.7-174.1174.4-173.60113.6L241 T244 K248 D249L241-K246 HydrophobicContact CD2-CB 4.19Å; L241-K246 PolarHBondContact O-N 3.23Å; T244-K246 PolarHBondContact O-N 3.41Å; K246-K248 VanDerWaalsContact C-N 3.27Å; K246-K248 PolarHBondContact O-N 3.05Å; K246-D249 PolarHBondContact O-N 3.4Å
247D55.8Low64.1Low82 Ų82116.4 Ų116.444%0.43959%0.591SS.*THydrogen-bonded Turntrans-69.6-22.9-171.9-141.59.2000113.4C245 D249 F250 L251C245-D247 PolarHBondContact O-N 3.22Å; D247-D249 PolarHBondContact O-N 3.19Å; D247-F250 PolarHBondContact O-N 3.32Å; D247-L251 PolarHBondContact O-N 3.48Å
248K52.7Low61.9Low174 Ų174123.4 Ų123.476%0.75762%0.617SS**Hα-helixtrans-60.5-32.2176.9-71.5-171.3176.9-177.90112.9K246K246-K248 VanDerWaalsContact C-N 3.27Å; K246-K248 PolarHBondContact O-N 3.05Å
249D52.5Low60.7Low118 Ų118125.6 Ų125.663%0.63163%0.627SS**Hα-helixtrans-79.3-22.2-178.5-62.6-29.7000112.5K246 D247 A253K246-D249 PolarHBondContact O-N 3.4Å; D247-D249 PolarHBondContact O-N 3.19Å; D249-A253 WeakPolarHBondContact O-CB 3.29Å; D249-A253 PolarHBondContact O-N 3.02Å
250F50.2Low59.5Low85 Ų85127.7 Ų127.737%0.37364%0.636SS.*Hα-helixtrans-84.1-39.9-175.8-171.6-103.6000113.1D247 L252 A253 N254D247-F250 PolarHBondContact O-N 3.32Å; F250-L252 PolarHBondContact O-N 3.3Å; F250-A253 PolarHBondContact O-N 3.46Å; F250-A253 VanDerWaalsContact O-N 3.16Å; F250-N254 WeakPolarHBondContact CZ-ND2 3.37Å; F250-N254 PolarHBondContact O-N 3.26Å; F250-N254 VanDerWaalsContact O-N 3.13Å
251L52.8Low58.1Low122 Ų122126.4 Ų126.464%0.63964%0.635SS**Hα-helixtrans-63-32.1174.1-72.5171.3000112D247D247-L251 PolarHBondContact O-N 3.48Å
252L52.2Low56.7Low129 Ų129131.5 Ų131.568%0.67566%0.661SS**Hα-helixtrans-75.5-31.1173.7-72.7167.7000113F250F250-L252 PolarHBondContact O-N 3.3Å
253A53Low55.1Low62 Ų62134.4 Ų134.451%0.51267%0.666SS.*Hα-helixtrans-76.2-31.9-179.500000113.4D249 F250D249-A253 WeakPolarHBondContact O-CB 3.29Å; D249-A253 PolarHBondContact O-N 3.02Å; F250-A253 PolarHBondContact O-N 3.46Å; F250-A253 VanDerWaalsContact O-N 3.16Å
254N49.6Very low53.2Low118 Ų118134.3 Ų134.363%0.63166%0.663SS**THydrogen-bonded Turntrans-85.6-7.1-179.8-98.1-3.9000114.7F250F250-N254 WeakPolarHBondContact CZ-ND2 3.37Å; F250-N254 PolarHBondContact O-N 3.26Å; F250-N254 VanDerWaalsContact O-N 3.13Å
255H46.6Very low50.8Low166 Ų166139.2 Ų139.277%0.76968%0.681SS**THydrogen-bonded Turntrans-88.51.9173.2-101.8-63.4000114.1P257H255-P257 WeakPolarHBondContact O-CD 3.49Å
256R34.3Very low49.2Very low211 Ų211141.5 Ų141.580%0.79668%0.677SS**SBendtrans-77.8118.3168.8-76.3-170.4-171.4-174.13.3109.1R258R256-R258 PolarHBondContact O-N 3.32Å
257P36.2Very low47.8Very low126 Ų126142.4 Ų142.482%0.81869%0.686SS**  trans-62132.417527.1-31.3000108.4H255H255-P257 WeakPolarHBondContact O-CD 3.49Å
258R37.7Very low47.1Very low316 Ų316147.9 Ų147.9100%1.19271%0.708SS**  trans-84.20156.7-81.5-172.9176.9179.6-1108.4R256R256-R258 PolarHBondContact O-N 3.32Å

Retrieved 258 of 258 residues in 352.4 ms (Link to these results)

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