A0A5K4FFE6_SCHMA Loading...

Similar to tetraspanin TE736

AlphaFold DB , UniProt , Accession A0A5K4FFE6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 228 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
1M42.9Very low69.9Low221 Ų221104.3 Ų104.3100%1.08954%0.535SS*.  0104.30-169.2168.9167.700107.8L3M1-L3 PolarHBondContact O-N 3.03Å
2K46.4Very low71.6Confident212 Ų212109.8 Ų109.892%0.92254%0.544SS*.  trans-74.5106.2175-80.5-179.9177177.40106.9
3L50.3Low73Confident57 Ų57106.4 Ų106.430%0.29853%0.529SS..  trans-56.9141.6170.7-108.173.5000109M1 E7 Q8 N11M1-L3 PolarHBondContact O-N 3.03Å; L3-E7 HydrophobicContact CB-CB 4.2Å; L3-E7 HydrophobicContact CD2-CB 3.51Å; L3-E7 HydrophobicContact CG-CB 3.75Å; L3-Q8 HydrophobicContact CB-CG 3.66Å; L3-Q8 HydrophobicContact CD2-CG 4.26Å; L3-Q8 PolarHBondContact O-NE2 3.32Å; L3-N11 VanDerWaalsContact CD2-ND2 3.34Å; L3-N11 WeakPolarHBondContact CD2-ND2 3.24Å
4S69.4Low74.4Confident57 Ų5799.7 Ų99.740%0.39950%0.495SS..  trans-58.7148.717065.20000110N6 E7 Q8S4-N6 PolarHBondContact O-N 3.46Å; S4-E7 PolarHBondContact N-OE2 3.38Å; S4-E7 PolarHBondContact O-N 2.97Å; S4-E7 VanDerWaalsContact OG-CD 3.31Å; S4-E7 VanDerWaalsContact OG-CG 3.24Å; S4-E7 WeakPolarHBondContact OG-CG 3.44Å; S4-E7 PolarHBondContact OG-N 2.85Å; S4-E7 PolarHBondContact OG-OE2 3.1Å; S4-Q8 PolarHBondContact O-N 3.2Å; S4-Q8 VanDerWaalsContact O-N 3.12Å
5L65.1Low75.7Confident155 Ų15598.3 Ų98.381%0.81249%0.489SS*.Hα-helixtrans-51.8-33.4178.4-78.4163.4000112.2G9L5-G9 PolarHBondContact O-N 3.24Å; L5-G9 VanDerWaalsContact O-N 3.17Å
6N77.8Confident77Confident108 Ų10898.9 Ų98.958%0.57849%0.493SS*.Hα-helixtrans-65-48.5176.1-170.229.2000112.2S4 Q8 G9 W10S4-N6 PolarHBondContact O-N 3.46Å; N6-Q8 VanDerWaalsContact C-N 3.32Å; N6-Q8 PolarHBondContact O-N 3.28Å; N6-G9 PolarHBondContact O-N 3.46Å; N6-W10 PolarHBondContact O-N 3.34Å; N6-W10 VanDerWaalsContact O-N 3.1Å; N6-W10 PolarHBondContact OD1-NE1 3.25Å
7E77.8Confident78.1Confident90 Ų9095.1 Ų95.142%0.42147%0.474SS..Hα-helixtrans-64.7-36.5179.1-69.4165.7144.900112.3L3 S4 G9 W10 N11L3-E7 HydrophobicContact CB-CB 4.2Å; L3-E7 HydrophobicContact CD2-CB 3.51Å; L3-E7 HydrophobicContact CG-CB 3.75Å; S4-E7 PolarHBondContact N-OE2 3.38Å; S4-E7 PolarHBondContact O-N 2.97Å; S4-E7 VanDerWaalsContact OG-CD 3.31Å; S4-E7 VanDerWaalsContact OG-CG 3.24Å; S4-E7 WeakPolarHBondContact OG-CG 3.44Å; S4-E7 PolarHBondContact OG-N 2.85Å; S4-E7 PolarHBondContact OG-OE2 3.1Å; E7-G9 VanDerWaalsContact C-N 3.31Å; E7-G9 PolarHBondContact O-N 3.04Å; E7-W10 PolarHBondContact O-N 2.92Å; E7-N11 PolarHBondContact O-N 2.96Å
8Q82Confident79.2Confident75 Ų7589.8 Ų89.835%0.3545%0.448SS..Hα-helixtrans-63.1-40.3175.2-61.9-17722.200111.3L3 S4 N6 N11 R12L3-Q8 HydrophobicContact CB-CG 3.66Å; L3-Q8 HydrophobicContact CD2-CG 4.26Å; L3-Q8 PolarHBondContact O-NE2 3.32Å; S4-Q8 PolarHBondContact O-N 3.2Å; S4-Q8 VanDerWaalsContact O-N 3.12Å; N6-Q8 VanDerWaalsContact C-N 3.32Å; N6-Q8 PolarHBondContact O-N 3.28Å; Q8-N11 PolarHBondContact O-N 3.04Å; Q8-R12 WeakPolarHBondContact O-CG 3.33Å; Q8-R12 PolarHBondContact O-N 2.94Å; Q8-R12 VanDerWaalsContact O-N 3.08Å
9G85.2Confident80.1Confident41 Ų4185.9 Ų85.942%0.42343%0.433SS..Hα-helixtrans-59.6-49.7175.300000112.2L5 N6 E7 N11 R12 L13L5-G9 PolarHBondContact O-N 3.24Å; L5-G9 VanDerWaalsContact O-N 3.17Å; N6-G9 PolarHBondContact O-N 3.46Å; E7-G9 VanDerWaalsContact C-N 3.31Å; E7-G9 PolarHBondContact O-N 3.04Å; G9-N11 PolarHBondContact O-N 3.15Å; G9-R12 PolarHBondContact O-N 3.41Å; G9-L13 PolarHBondContact O-N 3.37Å
10W84.7Confident81Confident66 Ų6684.6 Ų84.625%0.2543%0.43CS..Hα-helixtrans-61-45.3177.8-73.2110.9000112.6N6 E7 R12 L13 F14 I208 M212N6-W10 PolarHBondContact O-N 3.34Å; N6-W10 VanDerWaalsContact O-N 3.1Å; N6-W10 PolarHBondContact OD1-NE1 3.25Å; E7-W10 PolarHBondContact O-N 2.92Å; W10-R12 VanDerWaalsContact C-N 3.34Å; W10-R12 PolarHBondContact O-N 3.49Å; W10-L13 HydrophobicContact CE3-CD2 3.95Å; W10-L13 HydrophobicContact CZ3-CD2 3.79Å; W10-L13 WeakPolarHBondContact O-CB 3.47Å; W10-L13 PolarHBondContact O-N 3.02Å; W10-F14 HydrophobicContact CB-CD2 4.38Å; W10-F14 HydrophobicContact CB-CE2 4.07Å; W10-F14 WeakPolarHBondContact O-CD2 3.34Å; W10-F14 WeakPolarHBondContact O-CG 3.3Å; W10-F14 PolarHBondContact O-N 3.18Å; W10-I208 HydrophobicContact CE3-CG2 4.44Å; W10-I208 HydrophobicContact CH2-CG2 4.08Å; W10-I208 HydrophobicContact CZ3-CG2 3.61Å; W10-M212 HydrophobicContact CB-CE 4.32Å; W10-M212 HydrophobicContact CD2-CE 4.1Å; W10-M212 HydrophobicContact CD2-SD 4.13Å; W10-M212 HydrophobicContact CE3-CE 4.48Å; W10-M212 HydrophobicContact CE3-SD 3.99Å; W10-M212 HydrophobicContact CG-CE 4Å; W10-M212 HydrophobicContact CZ3-SD 4.35Å
11N87.6Confident81.8Confident65 Ų6580.8 Ų80.835%0.34841%0.41SS..Hα-helixtrans-61.7-41.8179-75-9.7000112L3 E7 Q8 G9 F14 I15L3-N11 VanDerWaalsContact CD2-ND2 3.34Å; L3-N11 WeakPolarHBondContact CD2-ND2 3.24Å; E7-N11 PolarHBondContact O-N 2.96Å; Q8-N11 PolarHBondContact O-N 3.04Å; G9-N11 PolarHBondContact O-N 3.15Å; N11-F14 PolarHBondContact O-N 3.42Å; N11-I15 VanDerWaalsContact O-CG1 3.26Å; N11-I15 WeakPolarHBondContact O-CG1 3.29Å; N11-I15 PolarHBondContact O-N 3.01Å
12R90.4Very high84.5Confident170 Ų17072.3 Ų72.364%0.64237%0.369SS*.Hα-helixtrans-62.2-43.8175.4-72.5177.5-178-1682111.9Q8 G9 W10 F14 I15 I16Q8-R12 WeakPolarHBondContact O-CG 3.33Å; Q8-R12 PolarHBondContact O-N 2.94Å; Q8-R12 VanDerWaalsContact O-N 3.08Å; G9-R12 PolarHBondContact O-N 3.41Å; W10-R12 VanDerWaalsContact C-N 3.34Å; W10-R12 PolarHBondContact O-N 3.49Å; R12-F14 PolarHBondContact O-N 2.94Å; R12-I15 PolarHBondContact O-N 3.23Å; R12-I16 WeakPolarHBondContact O-CG1 3.35Å; R12-I16 PolarHBondContact O-N 3.06Å
13L90.1Very high87Confident66 Ų6666.6 Ų66.635%0.34635%0.352SS..Hα-helixtrans-59.6-45.6175.9-179.764.4000111.5G9 W10 I15 I16 L17G9-L13 PolarHBondContact O-N 3.37Å; W10-L13 HydrophobicContact CE3-CD2 3.95Å; W10-L13 HydrophobicContact CZ3-CD2 3.79Å; W10-L13 WeakPolarHBondContact O-CB 3.47Å; W10-L13 PolarHBondContact O-N 3.02Å; L13-I15 PolarHBondContact O-N 3.17Å; L13-I16 PolarHBondContact O-N 3Å; L13-L17 HydrophobicContact CD1-CD1 3.78Å; L13-L17 HydrophobicContact CD1-CG 4.04Å; L13-L17 HydrophobicContact CG-CD1 3.88Å; L13-L17 HydrophobicContact CG-CG 4.46Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 WeakPolarHBondContact O-CG 3.41Å; L13-L17 PolarHBondContact O-N 3.1Å
14F91.9Very high89.2Confident13 Ų1364.3 Ų64.36%0.05734%0.339CS..Hα-helixtrans-60-43.7176.5-72.9-56.5000112.3W10 N11 R12 N18 I75 Y205 I209 M212W10-F14 HydrophobicContact CB-CD2 4.38Å; W10-F14 HydrophobicContact CB-CE2 4.07Å; W10-F14 WeakPolarHBondContact O-CD2 3.34Å; W10-F14 WeakPolarHBondContact O-CG 3.3Å; W10-F14 PolarHBondContact O-N 3.18Å; N11-F14 PolarHBondContact O-N 3.42Å; R12-F14 PolarHBondContact O-N 2.94Å; F14-N18 WeakPolarHBondContact O-CB 3.31Å; F14-N18 PolarHBondContact O-N 3.12Å; F14-N18 PolarHBondContact O-ND2 3.39Å; F14-I75 HydrophobicContact CB-CD1 3.96Å; F14-I75 HydrophobicContact CB-CG1 4.46Å; F14-Y205 AromaticContact CD1-CE2 3.42Å; F14-Y205 HydrophobicContact CD1-CE2 3.42Å; F14-Y205 VanDerWaalsContact CD1-CE2 3.42Å; F14-Y205 AromaticContact CD1-CZ 3.79Å; F14-Y205 WeakPolarHBondContact CD1-OH 3.42Å; F14-Y205 HydrophobicContact CE1-CD2 4.45Å; F14-Y205 AromaticContact CE1-CE2 3.61Å; F14-Y205 HydrophobicContact CE1-CE2 3.61Å; F14-I209 HydrophobicContact CE1-CD1 4.28Å; F14-I209 HydrophobicContact CE1-CG1 3.77Å; F14-I209 HydrophobicContact CZ-CG1 4.32Å; F14-M212 HydrophobicContact CE2-CE 4.06Å; F14-M212 HydrophobicContact CE2-SD 4.04Å; F14-M212 HydrophobicContact CZ-CE 4.24Å; F14-M212 HydrophobicContact CZ-SD 3.62Å
15I94.2Very high90.6Very high79 Ų7961.8 Ų61.841%0.40532%0.321SS..Hα-helixtrans-61.2-47.7177.7-69.4171.2000110.8N11 R12 L13 G19 Y72 I75N11-I15 VanDerWaalsContact O-CG1 3.26Å; N11-I15 WeakPolarHBondContact O-CG1 3.29Å; N11-I15 PolarHBondContact O-N 3.01Å; R12-I15 PolarHBondContact O-N 3.23Å; L13-I15 PolarHBondContact O-N 3.17Å; I15-G19 PolarHBondContact O-N 2.91Å; I15-Y72 HydrophobicContact CG2-CE1 4.2Å; I15-Y72 PolarHBondContact O-OH 3.4Å; I15-I75 HydrophobicContact CG1-CD1 3.62Å
16I96.1Very high92.2Very high108 Ų10858.9 Ų58.955%0.55431%0.306SS*.Hα-helixtrans-64.6-50-177.6-68.2167000110.1R12 L13 G19 T20R12-I16 WeakPolarHBondContact O-CG1 3.35Å; R12-I16 PolarHBondContact O-N 3.06Å; L13-I16 PolarHBondContact O-N 3Å; I16-G19 PolarHBondContact O-N 3.27Å; I16-T20 HydrophobicContact CG2-CG2 4.48Å; I16-T20 WeakPolarHBondContact O-CG2 3.33Å; I16-T20 PolarHBondContact O-N 2.95Å; I16-T20 PolarHBondContact O-OG1 3.18Å
17L96.4Very high93.2Very high33 Ų3356.9 Ų56.917%0.17330%0.298CS..Hα-helixtrans-63.6-46.8-177.3-72.3175.4000112.2L13 G19 T20 F21 I201 Y205L13-L17 HydrophobicContact CD1-CD1 3.78Å; L13-L17 HydrophobicContact CD1-CG 4.04Å; L13-L17 HydrophobicContact CG-CD1 3.88Å; L13-L17 HydrophobicContact CG-CG 4.46Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 WeakPolarHBondContact O-CG 3.41Å; L13-L17 PolarHBondContact O-N 3.1Å; L17-G19 VanDerWaalsContact C-N 3.26Å; L17-G19 PolarHBondContact O-N 3.47Å; L17-T20 WeakPolarHBondContact CA-OG1 3.34Å; L17-T20 PolarHBondContact O-N 3.25Å; L17-T20 VanDerWaalsContact O-N 3.16Å; L17-T20 PolarHBondContact O-OG1 2.99Å; L17-F21 HydrophobicContact CB-CE2 4.15Å; L17-F21 HydrophobicContact CB-CZ 4.27Å; L17-F21 HydrophobicContact CD2-CZ 4.47Å; L17-F21 WeakPolarHBondContact O-CD2 3.45Å; L17-F21 WeakPolarHBondContact O-CG 2.99Å; L17-F21 PolarHBondContact O-N 2.93Å; L17-I201 HydrophobicContact CD2-CG2 4.3Å; L17-Y205 HydrophobicContact CB-CD2 4.3Å; L17-Y205 HydrophobicContact CB-CE2 4.15Å; L17-Y205 HydrophobicContact CD1-CD2 3.36Å; L17-Y205 HydrophobicContact CD1-CE2 3.83Å; L17-Y205 HydrophobicContact CD1-CG 4.28Å; L17-Y205 HydrophobicContact CG-CD2 4.46Å
18N96.6Very high94.1Very high1 Ų152.6 Ų52.61%0.00528%0.278CS..Hα-helixtrans-63.9-33.3176.8-72.3-72.8000112.2F14 F21 L22 Y72 H86 Y205F14-N18 WeakPolarHBondContact O-CB 3.31Å; F14-N18 PolarHBondContact O-N 3.12Å; F14-N18 PolarHBondContact O-ND2 3.39Å; N18-F21 PolarHBondContact O-N 3.43Å; N18-L22 WeakPolarHBondContact O-CB 3.44Å; N18-L22 PolarHBondContact O-N 3.46Å; N18-Y72 HydrophobicContact CB-CD2 4.45Å; N18-Y72 HydrophobicContact CB-CE2 4.21Å; N18-H86 PolarHBondContact OD1-CE1 2.93Å; N18-Y205 PolarHBondContact ND2-OH 3.32Å
19G97.5Very high94.8Very high15 Ų1549.5 Ų49.516%0.15526%0.264CS..Hα-helixtrans-64.1-45.5172.100000112.8I15 I16 L17 F21 L22 V23 Y72I15-G19 PolarHBondContact O-N 2.91Å; I16-G19 PolarHBondContact O-N 3.27Å; L17-G19 VanDerWaalsContact C-N 3.26Å; L17-G19 PolarHBondContact O-N 3.47Å; G19-F21 VanDerWaalsContact C-N 3.32Å; G19-F21 PolarHBondContact O-N 3.34Å; G19-L22 PolarHBondContact O-N 3.34Å; G19-V23 WeakPolarHBondContact O-CG2 3.35Å; G19-V23 PolarHBondContact O-N 3.48Å; G19-Y72 WeakPolarHBondContact CA-OH 3.39Å; G19-Y72 PolarHBondContact N-OH 3.05Å; G19-Y72 VanDerWaalsContact N-OH 3.1Å
20T97.9Very high95.3Very high60 Ų6049.5 Ų49.537%0.36826%0.264SS..Hα-helixtrans-62.8-40175.459.90000111.9I16 L17 V23 Y24I16-T20 HydrophobicContact CG2-CG2 4.48Å; I16-T20 WeakPolarHBondContact O-CG2 3.33Å; I16-T20 PolarHBondContact O-N 2.95Å; I16-T20 PolarHBondContact O-OG1 3.18Å; L17-T20 WeakPolarHBondContact CA-OG1 3.34Å; L17-T20 PolarHBondContact O-N 3.25Å; L17-T20 VanDerWaalsContact O-N 3.16Å; L17-T20 PolarHBondContact O-OG1 2.99Å; T20-V23 PolarHBondContact O-N 3.47Å; T20-Y24 WeakPolarHBondContact O-CB 3.49Å; T20-Y24 PolarHBondContact O-N 3.48Å
21F98.2Very high95.9Very high4 Ų448.9 Ų48.92%0.01827%0.265CS..Hα-helixtrans-66.3-36.8176.9-61.2-24.4000112.3L17 N18 G19 S25 A68 L90 F198 I201 K202 Y205L17-F21 HydrophobicContact CB-CE2 4.15Å; L17-F21 HydrophobicContact CB-CZ 4.27Å; L17-F21 HydrophobicContact CD2-CZ 4.47Å; L17-F21 WeakPolarHBondContact O-CD2 3.45Å; L17-F21 WeakPolarHBondContact O-CG 2.99Å; L17-F21 PolarHBondContact O-N 2.93Å; N18-F21 PolarHBondContact O-N 3.43Å; G19-F21 VanDerWaalsContact C-N 3.32Å; G19-F21 PolarHBondContact O-N 3.34Å; F21-S25 WeakPolarHBondContact O-CB 3.39Å; F21-S25 PolarHBondContact O-N 3Å; F21-S25 PolarHBondContact O-OG 2.92Å; F21-A68 HydrophobicContact CB-CB 4.47Å; F21-L90 HydrophobicContact CD2-CD1 4.37Å; F21-F198 AromaticContact CD1-CD1 3.96Å; F21-F198 HydrophobicContact CD1-CD1 3.96Å; F21-F198 HydrophobicContact CD1-CE1 4.22Å; F21-F198 HydrophobicContact CE1-CD1 4.19Å; F21-I201 HydrophobicContact CE1-CG2 3.8Å; F21-I201 HydrophobicContact CZ-CG2 3.97Å; F21-K202 HydrophobicContact CD1-CG 4.14Å; F21-K202 HydrophobicContact CD2-CG 4.5Å; F21-K202 HydrophobicContact CE1-CG 3.71Å; F21-K202 HydrophobicContact CE2-CG 4.1Å; F21-K202 HydrophobicContact CZ-CG 3.69Å; F21-Y205 AromaticContact CE2-CD1 3.84Å; F21-Y205 HydrophobicContact CE2-CD1 3.84Å; F21-Y205 HydrophobicContact CE2-CE1 4.06Å; F21-Y205 HydrophobicContact CE2-CG 4.09Å; F21-Y205 HydrophobicContact CZ-CD1 4.46Å; F21-Y205 HydrophobicContact CZ-CG 4.37Å
22L98.5Very high96.3Very high44 Ų4445.8 Ų45.823%0.2325%0.249CC..Hα-helixtrans-63.7-50.7175.3-177.260.1000111.2N18 G19 Y24 S25 L26 I65 A68 Y72N18-L22 WeakPolarHBondContact O-CB 3.44Å; N18-L22 PolarHBondContact O-N 3.46Å; G19-L22 PolarHBondContact O-N 3.34Å; L22-Y24 PolarHBondContact O-N 3.44Å; L22-S25 PolarHBondContact O-N 3.5Å; L22-L26 HydrophobicContact CD1-CD1 4.49Å; L22-L26 HydrophobicContact CG-CD1 4.3Å; L22-L26 WeakPolarHBondContact O-CG 3.31Å; L22-L26 PolarHBondContact O-N 3.27Å; L22-I65 HydrophobicContact CD1-CB 4.29Å; L22-I65 HydrophobicContact CD1-CG1 4.17Å; L22-I65 HydrophobicContact CD1-CG2 3.92Å; L22-A68 HydrophobicContact CB-CB 3.76Å; L22-A68 HydrophobicContact CD1-CB 4.19Å; L22-Y72 HydrophobicContact CD2-CE2 4.4Å
23V98.5Very high96.6Very high92 Ų9242.1 Ų42.156%0.55824%0.241SC*.Hα-helixtrans-61.2-45.9178.8174.30000110.7G19 T20 S25 L26 V27G19-V23 WeakPolarHBondContact O-CG2 3.35Å; G19-V23 PolarHBondContact O-N 3.48Å; T20-V23 PolarHBondContact O-N 3.47Å; V23-S25 PolarHBondContact O-N 3.22Å; V23-L26 PolarHBondContact O-N 3.4Å; V23-V27 HydrophobicContact CG1-CG2 4.49Å; V23-V27 WeakPolarHBondContact O-CG2 3.32Å; V23-V27 PolarHBondContact O-N 3.08Å
24Y98.2Very high96.8Very high9 Ų943.1 Ų43.14%0.03524%0.243CC..Hα-helixtrans-55.2-48.8174.9162.9-110.5000112.4T20 L22 L26 V27 L28 E97 L194 C195 F198T20-Y24 WeakPolarHBondContact O-CB 3.49Å; T20-Y24 PolarHBondContact O-N 3.48Å; L22-Y24 PolarHBondContact O-N 3.44Å; Y24-L26 VanDerWaalsContact C-N 3.32Å; Y24-L26 PolarHBondContact O-N 3.01Å; Y24-V27 PolarHBondContact O-N 3.31Å; Y24-L28 HydrophobicContact CD1-CD1 4.43Å; Y24-L28 HydrophobicContact CD2-CD1 4.48Å; Y24-L28 HydrophobicContact CD2-CG 4.16Å; Y24-L28 HydrophobicContact CE1-CD1 3.67Å; Y24-L28 HydrophobicContact CE1-CG 4.36Å; Y24-L28 HydrophobicContact CE2-CD1 3.7Å; Y24-L28 HydrophobicContact CE2-CD2 3.87Å; Y24-L28 HydrophobicContact CE2-CG 3.62Å; Y24-L28 PolarHBondContact O-N 3.21Å; Y24-L28 VanDerWaalsContact OH-CD1 3.25Å; Y24-L28 WeakPolarHBondContact OH-CD1 3.45Å; Y24-E97 VanDerWaalsContact OH-CD 3.23Å; Y24-E97 PolarHBondContact OH-OE2 3.31Å; Y24-E97 VanDerWaalsContact OH-OE2 3.07Å; Y24-L194 HydrophobicContact CE2-CB 3.93Å; Y24-C195 WeakPolarHBondContact OH-CA 3.38Å; Y24-F198 HydrophobicContact CD1-CB 4.17Å; Y24-F198 AromaticContact CD1-CD1 3.79Å; Y24-F198 HydrophobicContact CD1-CD1 3.79Å; Y24-F198 HydrophobicContact CD1-CE1 4.3Å; Y24-F198 AromaticContact CD1-CG 3.91Å; Y24-F198 HydrophobicContact CD1-CG 3.91Å; Y24-F198 HydrophobicContact CD2-CB 4.41Å; Y24-F198 HydrophobicContact CD2-CD1 4.08Å; Y24-F198 AromaticContact CD2-CD2 3.5Å; Y24-F198 HydrophobicContact CD2-CD2 3.5Å; Y24-F198 VanDerWaalsContact CD2-CD2 3.5Å; Y24-F198 HydrophobicContact CD2-CE1 4.21Å; Y24-F198 AromaticContact CD2-CE2 3.65Å; Y24-F198 HydrophobicContact CD2-CE2 3.65Å; Y24-F198 AromaticContact CD2-CG 3.73Å; Y24-F198 HydrophobicContact CD2-CG 3.73Å; Y24-F198 HydrophobicContact CD2-CZ 4.01Å; Y24-F198 HydrophobicContact CE1-CB 3.74Å; Y24-F198 HydrophobicContact CE1-CD1 4.24Å; Y24-F198 AromaticContact CE1-CG 3.95Å; Y24-F198 HydrophobicContact CE1-CG 3.95Å; Y24-F198 HydrophobicContact CE2-CB 4.03Å; Y24-F198 AromaticContact CE2-CD2 3.61Å; Y24-F198 HydrophobicContact CE2-CD2 3.61Å; Y24-F198 HydrophobicContact CE2-CE2 4.2Å; Y24-F198 AromaticContact CE2-CG 3.8Å; Y24-F198 HydrophobicContact CE2-CG 3.8Å; Y24-F198 HydrophobicContact CG-CB 4.46Å; Y24-F198 AromaticContact CG-CD1 3.67Å; Y24-F198 HydrophobicContact CG-CD1 3.67Å; Y24-F198 AromaticContact CG-CD2 3.98Å; Y24-F198 HydrophobicContact CG-CD2 3.98Å; Y24-F198 AromaticContact CG-CE1 3.78Å; Y24-F198 HydrophobicContact CG-CE1 3.78Å; Y24-F198 HydrophobicContact CG-CE2 4.09Å; Y24-F198 AromaticContact CG-CG 3.76Å; Y24-F198 HydrophobicContact CG-CG 3.76Å; Y24-F198 AromaticContact CG-CZ 3.99Å; Y24-F198 HydrophobicContact CG-CZ 3.99Å; Y24-F198 AromaticContact CZ-CG 3.87Å
25S98.6Very high97Very high3 Ų342.5 Ų42.52%0.02124%0.24CC..Hα-helixtrans-64.6-36.8-178.5-56.60000112.1F21 L22 V23 L28 C29 G61 G64F21-S25 WeakPolarHBondContact O-CB 3.39Å; F21-S25 PolarHBondContact O-N 3Å; F21-S25 PolarHBondContact O-OG 2.92Å; L22-S25 PolarHBondContact O-N 3.5Å; V23-S25 PolarHBondContact O-N 3.22Å; S25-L28 PolarHBondContact O-N 2.84Å; S25-C29 PolarHBondContact O-N 3.02Å; S25-C29 VanDerWaalsContact O-N 3.07Å; S25-C29 PolarHBondContact O-SG 3.41Å; S25-G61 WeakPolarHBondContact CB-O 3.35Å; S25-G64 WeakPolarHBondContact OG-CA 3.44Å
26L98.3Very high97Very high95 Ų9541.6 Ų41.650%0.49723%0.234SC..Hα-helixtrans-65.9-41.7173.7-70.9168.4000112L22 V23 Y24 C29 G30 I65L22-L26 HydrophobicContact CD1-CD1 4.49Å; L22-L26 HydrophobicContact CG-CD1 4.3Å; L22-L26 WeakPolarHBondContact O-CG 3.31Å; L22-L26 PolarHBondContact O-N 3.27Å; V23-L26 PolarHBondContact O-N 3.4Å; Y24-L26 VanDerWaalsContact C-N 3.32Å; Y24-L26 PolarHBondContact O-N 3.01Å; L26-C29 PolarHBondContact O-N 3.01Å; L26-G30 PolarHBondContact O-N 3.4Å; L26-I65 HydrophobicContact CD2-CD1 3.7Å; L26-I65 HydrophobicContact CD2-CG1 4.31Å; L26-I65 HydrophobicContact CG-CD1 4.31Å; L26-I65 HydrophobicContact CG-CG1 4.45Å
27V97.7Very high97Very high65 Ų6540.3 Ų40.339%0.39423%0.229SC..Hα-helixtrans-62.5-44.6175.8170.30000110.7V23 Y24 C29 G30 L31V23-V27 HydrophobicContact CG1-CG2 4.49Å; V23-V27 WeakPolarHBondContact O-CG2 3.32Å; V23-V27 PolarHBondContact O-N 3.08Å; Y24-V27 PolarHBondContact O-N 3.31Å; V27-C29 PolarHBondContact O-N 3.46Å; V27-G30 PolarHBondContact O-N 2.9Å; V27-L31 HydrophobicContact CG1-CD1 3.86Å; V27-L31 HydrophobicContact CG1-CG 4.21Å; V27-L31 WeakPolarHBondContact O-CG 3.26Å; V27-L31 PolarHBondContact O-N 3.35Å
28L96.8Very high97Very high0 Ų039.3 Ų39.30%022%0.223CC..Hα-helixtrans-57.7-49.2175.6-76.9-172000112.3Y24 S25 S32 I57 I191Y24-L28 HydrophobicContact CD1-CD1 4.43Å; Y24-L28 HydrophobicContact CD2-CD1 4.48Å; Y24-L28 HydrophobicContact CD2-CG 4.16Å; Y24-L28 HydrophobicContact CE1-CD1 3.67Å; Y24-L28 HydrophobicContact CE1-CG 4.36Å; Y24-L28 HydrophobicContact CE2-CD1 3.7Å; Y24-L28 HydrophobicContact CE2-CD2 3.87Å; Y24-L28 HydrophobicContact CE2-CG 3.62Å; Y24-L28 PolarHBondContact O-N 3.21Å; Y24-L28 VanDerWaalsContact OH-CD1 3.25Å; Y24-L28 WeakPolarHBondContact OH-CD1 3.45Å; S25-L28 PolarHBondContact O-N 2.84Å; L28-S32 VanDerWaalsContact O-CB 3.26Å; L28-S32 WeakPolarHBondContact O-CB 3.31Å; L28-S32 PolarHBondContact O-N 3.41Å; L28-S32 PolarHBondContact O-OG 3.21Å; L28-I57 HydrophobicContact CB-CG2 3.95Å; L28-I57 HydrophobicContact CD1-CG2 4.19Å; L28-I57 HydrophobicContact CD2-CG2 4.07Å; L28-I57 HydrophobicContact CG-CG2 4.31Å; L28-I191 HydrophobicContact CD2-CG1 4.4Å; L28-I191 HydrophobicContact CD2-CG2 3.86Å
29C97.3Very high96.9Very high11 Ų1139.3 Ų39.37%0.07422%0.223CC..Hα-helixtrans-59.5-48.2176.6-73.80000111.1S25 L26 V27 S32 I33 G61S25-C29 PolarHBondContact O-N 3.02Å; S25-C29 VanDerWaalsContact O-N 3.07Å; S25-C29 PolarHBondContact O-SG 3.41Å; L26-C29 PolarHBondContact O-N 3.01Å; V27-C29 PolarHBondContact O-N 3.46Å; C29-S32 PolarHBondContact O-N 3.45Å; C29-I33 HydrophobicContact CB-CD1 4.49Å; C29-I33 WeakPolarHBondContact O-CB 3.44Å; C29-I33 WeakPolarHBondContact O-CD1 3.31Å; C29-I33 WeakPolarHBondContact O-CG1 3.35Å; C29-I33 PolarHBondContact O-N 3.04Å; C29-G61 VanDerWaalsContact SG-C 3.6Å
30G96.4Very high96.8Very high41 Ų4140.6 Ų40.642%0.42323%0.23SC..Hα-helixtrans-60.9-47.9-177.800000113.2L26 V27 K34L26-G30 PolarHBondContact O-N 3.4Å; V27-G30 PolarHBondContact O-N 2.9Å; G30-K34 WeakPolarHBondContact O-CB 3.41Å; G30-K34 PolarHBondContact O-N 3.45Å
31L96.3Very high96.7Very high52 Ų5241.4 Ų41.427%0.27223%0.229SC..Hα-helixtrans-65.5-41.5178.2-64.3178.4000111.6V27 K34 V35 Y187 I191V27-L31 HydrophobicContact CG1-CD1 3.86Å; V27-L31 HydrophobicContact CG1-CG 4.21Å; V27-L31 WeakPolarHBondContact O-CG 3.26Å; V27-L31 PolarHBondContact O-N 3.35Å; L31-K34 WeakPolarHBondContact O-CB 3.46Å; L31-K34 PolarHBondContact O-N 2.9Å; L31-V35 WeakPolarHBondContact O-CG2 3.48Å; L31-V35 PolarHBondContact O-N 3.02Å; L31-Y187 HydrophobicContact CD2-CD1 4.18Å; L31-Y187 HydrophobicContact CD2-CE1 4.44Å; L31-I191 HydrophobicContact CB-CD1 3.84Å; L31-I191 HydrophobicContact CB-CG1 4.36Å; L31-I191 HydrophobicContact CD1-CD1 4.36Å; L31-I191 HydrophobicContact CD1-CG1 3.98Å
32S96.1Very high96.7Very high0 Ų041.2 Ų41.20%023%0.228CC..Hα-helixtrans-69.1-40.8-178.8-54.70000112.1L28 C29 K34 V35 Q36 I54 I57 I58L28-S32 VanDerWaalsContact O-CB 3.26Å; L28-S32 WeakPolarHBondContact O-CB 3.31Å; L28-S32 PolarHBondContact O-N 3.41Å; L28-S32 PolarHBondContact O-OG 3.21Å; C29-S32 PolarHBondContact O-N 3.45Å; S32-K34 VanDerWaalsContact C-N 3.3Å; S32-K34 PolarHBondContact O-N 3.3Å; S32-V35 PolarHBondContact O-N 2.73Å; S32-Q36 WeakPolarHBondContact O-CB 3.37Å; S32-Q36 PolarHBondContact O-N 3.41Å; S32-I54 WeakPolarHBondContact O-CG2 3.26Å; S32-I57 WeakPolarHBondContact OG-CG2 3.4Å; S32-I58 VanDerWaalsContact CB-CG1 3.47Å
33I96.3Very high96.5Very high93 Ų9340.7 Ų40.748%0.47723%0.226SC..Hα-helixtrans-62.1-41.1173.1-69.7165.5000110C29 V35 Q36 D37 I58C29-I33 HydrophobicContact CB-CD1 4.49Å; C29-I33 WeakPolarHBondContact O-CB 3.44Å; C29-I33 WeakPolarHBondContact O-CD1 3.31Å; C29-I33 WeakPolarHBondContact O-CG1 3.35Å; C29-I33 PolarHBondContact O-N 3.04Å; I33-V35 PolarHBondContact O-N 2.96Å; I33-Q36 PolarHBondContact O-N 3.02Å; I33-D37 WeakPolarHBondContact O-CB 3.33Å; I33-D37 PolarHBondContact O-N 3.49Å; I33-I58 HydrophobicContact CG1-CD1 4.17Å; I33-I58 HydrophobicContact CG1-CG1 4.38Å
34K95.7Very high96.5Very high87 Ų8739.9 Ų39.938%0.37822%0.216SC..Hα-helixtrans-61.2-44.6178.1-178.555.4-179.8152.50112.3G30 L31 S32 Q36 D37 D38G30-K34 WeakPolarHBondContact O-CB 3.41Å; G30-K34 PolarHBondContact O-N 3.45Å; L31-K34 WeakPolarHBondContact O-CB 3.46Å; L31-K34 PolarHBondContact O-N 2.9Å; S32-K34 VanDerWaalsContact C-N 3.3Å; S32-K34 PolarHBondContact O-N 3.3Å; K34-Q36 VanDerWaalsContact C-N 3.33Å; K34-Q36 PolarHBondContact O-N 2.95Å; K34-D37 PolarHBondContact O-N 3.38Å; K34-D38 WeakPolarHBondContact CE-OD1 3.44Å; K34-D38 IonicContact NZ-OD1 3.99Å; K34-D38 PolarHBondContact NZ-OD1 3.44Å; K34-D38 IonicContact NZ-OD2 2.91Å; K34-D38 PolarHBondContact O-N 2.89Å
35V95.5Very high96.5Very high1 Ų139.4 Ų39.41%0.00621%0.214CC..Hα-helixtrans-61.8-43.3175.3175.30000111.1L31 S32 I33 D38 L39 I54 V184 Y187L31-V35 WeakPolarHBondContact O-CG2 3.48Å; L31-V35 PolarHBondContact O-N 3.02Å; S32-V35 PolarHBondContact O-N 2.73Å; I33-V35 PolarHBondContact O-N 2.96Å; V35-D38 PolarHBondContact O-N 2.96Å; V35-L39 HydrophobicContact CG1-CD1 4.18Å; V35-L39 WeakPolarHBondContact O-CG 3.45Å; V35-L39 PolarHBondContact O-N 3.35Å; V35-L39 VanDerWaalsContact O-N 3.07Å; V35-I54 HydrophobicContact CB-CD1 4.08Å; V35-I54 HydrophobicContact CG1-CD1 3.83Å; V35-I54 HydrophobicContact CG1-CG1 4.07Å; V35-I54 HydrophobicContact CG2-CD1 4.45Å; V35-V184 HydrophobicContact CG1-CG1 4.27Å; V35-V184 HydrophobicContact CG1-CG2 4.28Å; V35-Y187 VanDerWaalsContact CG2-CB 3.42Å; V35-Y187 HydrophobicContact CG2-CD1 4.41Å; V35-Y187 HydrophobicContact CG2-CD2 3.72Å; V35-Y187 HydrophobicContact CG2-CG 3.6Å
36Q95.1Very high96.4Very high59 Ų5939.3 Ų39.328%0.27621%0.213SC..Hα-helixtrans-63.7-40.6178.9-175.761.769.600112.3S32 I33 K34 S40 I54S32-Q36 WeakPolarHBondContact O-CB 3.37Å; S32-Q36 PolarHBondContact O-N 3.41Å; I33-Q36 PolarHBondContact O-N 3.02Å; K34-Q36 VanDerWaalsContact C-N 3.33Å; K34-Q36 PolarHBondContact O-N 2.95Å; Q36-S40 WeakPolarHBondContact O-CB 3.23Å; Q36-S40 PolarHBondContact O-N 3.33Å; Q36-I54 HydrophobicContact CB-CG2 4.12Å
37D95.4Very high96.2Very high82 Ų8239.3 Ų39.344%0.43921%0.211SC..Hα-helixtrans-64.9-45.7177.2-177.160.4000111.5I33 K34 L39 S40I33-D37 WeakPolarHBondContact O-CB 3.33Å; I33-D37 PolarHBondContact O-N 3.49Å; K34-D37 PolarHBondContact O-N 3.38Å; D37-L39 PolarHBondContact O-N 2.83Å; D37-S40 WeakPolarHBondContact O-CB 3.18Å; D37-S40 PolarHBondContact O-N 2.94Å; D37-S40 VanDerWaalsContact O-N 3.11Å; D37-S40 PolarHBondContact O-OG 3.24Å
38D95.2Very high95.9Very high11 Ų1144 Ų446%0.05922%0.221CC..Hα-helixtrans-60.3-43.3176.2-71.5-10.9000111.9K34 V35 S40 F42 H183K34-D38 WeakPolarHBondContact CE-OD1 3.44Å; K34-D38 IonicContact NZ-OD1 3.99Å; K34-D38 PolarHBondContact NZ-OD1 3.44Å; K34-D38 IonicContact NZ-OD2 2.91Å; K34-D38 PolarHBondContact O-N 2.89Å; V35-D38 PolarHBondContact O-N 2.96Å; D38-S40 VanDerWaalsContact C-N 3.31Å; D38-S40 PolarHBondContact O-N 3.35Å; D38-F42 WeakPolarHBondContact O-CD2 3.47Å; D38-F42 WeakPolarHBondContact O-CE2 3.45Å; D38-H183 IonicContact OD2-CE1 3.52Å; D38-H183 IonicContact OD2-NE2 2.84Å; D38-H183 PolarHBondContact OD2-NE2 3.36Å
39L95.9Very high95.8Very high2 Ų245.5 Ų45.51%0.0123%0.229CC..Hα-helixtrans-68.3-30.9176-71.8174.4000112.6V35 D37 Q41 F42 L46 F111 L180 V184V35-L39 HydrophobicContact CG1-CD1 4.18Å; V35-L39 WeakPolarHBondContact O-CG 3.45Å; V35-L39 PolarHBondContact O-N 3.35Å; V35-L39 VanDerWaalsContact O-N 3.07Å; D37-L39 PolarHBondContact O-N 2.83Å; L39-Q41 PolarHBondContact O-N 3.35Å; L39-F42 PolarHBondContact O-N 3.49Å; L39-L46 HydrophobicContact CD2-CD1 3.98Å; L39-F111 HydrophobicContact CD1-CE2 4.32Å; L39-F111 HydrophobicContact CD1-CZ 4.46Å; L39-F111 HydrophobicContact CD2-CE2 4.25Å; L39-F111 HydrophobicContact CD2-CZ 3.82Å; L39-L180 HydrophobicContact CD2-CD2 4.28Å; L39-V184 HydrophobicContact CD1-CG2 4.12Å; L39-V184 HydrophobicContact CD2-CG2 3.9Å; L39-V184 HydrophobicContact CG-CG2 4.2Å
40S95.6Very high95.5Very high42 Ų4246.7 Ų46.729%0.29424%0.238SC..Hα-helixtrans-64-25-176.8800000113.6Q36 D37 D38 F42 N43Q36-S40 WeakPolarHBondContact O-CB 3.23Å; Q36-S40 PolarHBondContact O-N 3.33Å; D37-S40 WeakPolarHBondContact O-CB 3.18Å; D37-S40 PolarHBondContact O-N 2.94Å; D37-S40 VanDerWaalsContact O-N 3.11Å; D37-S40 PolarHBondContact O-OG 3.24Å; D38-S40 VanDerWaalsContact C-N 3.31Å; D38-S40 PolarHBondContact O-N 3.35Å; S40-F42 PolarHBondContact O-N 3.3Å; S40-N43 WeakPolarHBondContact CA-ND2 3.49Å; S40-N43 WeakPolarHBondContact O-CB 3.48Å; S40-N43 VanDerWaalsContact O-CG 3.22Å; S40-N43 PolarHBondContact O-N 2.99Å; S40-N43 PolarHBondContact O-ND2 3.01Å; S40-N43 VanDerWaalsContact O-ND2 3.1Å
41Q95.9Very high95.3Very high76 Ų7645 Ų4536%0.35522%0.22SC..THydrogen-bonded Turntrans-63.9-19.7174.9-63.7177.457.700112.7L39 H138L39-Q41 PolarHBondContact O-N 3.35Å; Q41-H138 PolarHBondContact OE1-NE2 3.47Å
42F96.9Very high95Very high0 Ų046.3 Ų46.30%023%0.233CC..THydrogen-bonded Turntrans-117.320.2-177.2-47.4-65000112.5D38 L39 S40 E44 I45 L46 Q135 H138 L139 Y143 L180D38-F42 WeakPolarHBondContact O-CD2 3.47Å; D38-F42 WeakPolarHBondContact O-CE2 3.45Å; L39-F42 PolarHBondContact O-N 3.49Å; S40-F42 PolarHBondContact O-N 3.3Å; F42-E44 PolarHBondContact O-N 2.92Å; F42-E44 VanDerWaalsContact O-N 3.14Å; F42-I45 HydrophobicContact CB-CD1 4.12Å; F42-I45 HydrophobicContact CB-CG1 3.92Å; F42-I45 HydrophobicContact CD1-CD1 4.32Å; F42-I45 WeakPolarHBondContact O-CG1 3.46Å; F42-I45 PolarHBondContact O-N 3.09Å; F42-L46 HydrophobicContact CB-CD1 3.8Å; F42-L46 HydrophobicContact CB-CG 4.01Å; F42-L46 VanDerWaalsContact O-CB 3.27Å; F42-L46 WeakPolarHBondContact O-CB 3.41Å; F42-L46 PolarHBondContact O-N 2.77Å; F42-Q135 HydrophobicContact CD1-CB 4.49Å; F42-Q135 PolarHBondContact O-OE1 3.45Å; F42-H138 HydrophobicContact CE1-CB 4.32Å; F42-H138 AromaticContact CE1-CD2 3.5Å; F42-H138 AromaticContact CZ-CD2 3.81Å; F42-L139 HydrophobicContact CD1-CB 3.8Å; F42-L139 HydrophobicContact CD1-CD1 3.94Å; F42-L139 HydrophobicContact CD1-CG 4.37Å; F42-L139 HydrophobicContact CD2-CD1 3.9Å; F42-L139 HydrophobicContact CE1-CB 3.58Å; F42-L139 HydrophobicContact CE1-CD1 3.78Å; F42-L139 HydrophobicContact CE1-CG 4.29Å; F42-L139 HydrophobicContact CE2-CD1 3.75Å; F42-L139 HydrophobicContact CG-CD1 4Å; F42-L139 HydrophobicContact CZ-CB 4.26Å; F42-L139 HydrophobicContact CZ-CD1 3.7Å; F42-Y143 AromaticContact CE2-CE2 3.64Å; F42-Y143 HydrophobicContact CE2-CE2 3.64Å; F42-Y143 HydrophobicContact CZ-CD2 4.38Å; F42-Y143 AromaticContact CZ-CE2 3.66Å; F42-Y143 HydrophobicContact CZ-CE2 3.66Å; F42-L180 HydrophobicContact CD2-CD2 4.28Å; F42-L180 HydrophobicContact CE2-CD2 4.45Å
43N96Very high94.9Very high33 Ų3346.6 Ų46.618%0.17623%0.234CC..THydrogen-bonded Turntrans-56.8-31.5-171.9-90.7-25.3000114.5S40 Q47 R48S40-N43 WeakPolarHBondContact CA-ND2 3.49Å; S40-N43 WeakPolarHBondContact O-CB 3.48Å; S40-N43 VanDerWaalsContact O-CG 3.22Å; S40-N43 PolarHBondContact O-N 2.99Å; S40-N43 PolarHBondContact O-ND2 3.01Å; S40-N43 VanDerWaalsContact O-ND2 3.1Å; N43-Q47 CarbonylContact O-C 3.31Å; N43-Q47 VanDerWaalsContact O-CA 3.26Å; N43-Q47 WeakPolarHBondContact O-CA 3.34Å; N43-Q47 PolarHBondContact O-N 3.06Å; N43-R48 HydrophobicContact CB-CG 3.98Å; N43-R48 PolarHBondContact O-N 2.91Å
44E97Very high94.8Very high75 Ų7542.3 Ų42.335%0.3521%0.212SC..THydrogen-bonded Turntrans-80.7-41.6-175.2-61.8-62.9130.600110.2F42 Q47 R48 V131 Y132F42-E44 PolarHBondContact O-N 2.92Å; F42-E44 VanDerWaalsContact O-N 3.14Å; E44-Q47 PolarHBondContact O-N 3.38Å; E44-R48 IonicContact OE1-CZ 3.96Å; E44-R48 IonicContact OE1-NH2 2.7Å; E44-R48 PolarHBondContact OE1-NH2 3.47Å; E44-V131 HydrophobicContact CB-CG1 4.07Å; E44-V131 HydrophobicContact CG-CG1 3.92Å; E44-Y132 HydrophobicContact CB-CD1 4.22Å; E44-Y132 HydrophobicContact CB-CE1 3.93Å
45I97.9Very high94.7Very high0 Ų041.3 Ų41.30%022%0.215CC..THydrogen-bonded Turntrans-76.5-30.8176.264.1173.4000113.1F42 S118 L119 S122 Y132 Q135 F136 L139F42-I45 HydrophobicContact CB-CD1 4.12Å; F42-I45 HydrophobicContact CB-CG1 3.92Å; F42-I45 HydrophobicContact CD1-CD1 4.32Å; F42-I45 WeakPolarHBondContact O-CG1 3.46Å; F42-I45 PolarHBondContact O-N 3.09Å; I45-S118 CarbonylContact O-C 3.5Å; I45-L119 HydrophobicContact CB-CD2 4.26Å; I45-L119 HydrophobicContact CD1-CD2 3.78Å; I45-L119 HydrophobicContact CG1-CD2 3.99Å; I45-S122 WeakPolarHBondContact CA-OG 3.42Å; I45-S122 PolarHBondContact O-OG 2.95Å; I45-Y132 HydrophobicContact CG2-CD1 3.82Å; I45-Y132 HydrophobicContact CG2-CG 4.02Å; I45-Q135 HydrophobicContact CD1-CB 3.89Å; I45-Q135 HydrophobicContact CG1-CB 4.08Å; I45-Q135 HydrophobicContact CG2-CB 3.87Å; I45-Q135 VanDerWaalsContact N-OE1 3.08Å; I45-F136 HydrophobicContact CB-CD2 4.35Å; I45-F136 HydrophobicContact CB-CE2 4.05Å; I45-F136 HydrophobicContact CD1-CD1 4.4Å; I45-F136 HydrophobicContact CD1-CD2 4.29Å; I45-F136 HydrophobicContact CD1-CE2 4.46Å; I45-F136 HydrophobicContact CD1-CG 4.25Å; I45-F136 HydrophobicContact CG2-CD2 3.73Å; I45-F136 HydrophobicContact CG2-CE2 3.79Å; I45-L139 HydrophobicContact CD1-CB 4.49Å; I45-L139 HydrophobicContact CD1-CD2 3.88Å
46L96.5Very high94.7Very high0 Ų043.4 Ų43.40%023%0.227CC..THydrogen-bonded Turntrans-89.5-0.8174.9-68179.7000113.2L39 F42 R48 I49 A115 L119 L180L39-L46 HydrophobicContact CD2-CD1 3.98Å; F42-L46 HydrophobicContact CB-CD1 3.8Å; F42-L46 HydrophobicContact CB-CG 4.01Å; F42-L46 VanDerWaalsContact O-CB 3.27Å; F42-L46 WeakPolarHBondContact O-CB 3.41Å; F42-L46 PolarHBondContact O-N 2.77Å; L46-R48 PolarHBondContact O-N 3.26Å; L46-R48 VanDerWaalsContact O-N 3.11Å; L46-I49 VanDerWaalsContact O-CB 3.29Å; L46-I49 WeakPolarHBondContact O-CB 3.36Å; L46-I49 VanDerWaalsContact O-CD1 3.27Å; L46-I49 WeakPolarHBondContact O-CD1 3.32Å; L46-I49 VanDerWaalsContact O-CG1 3.26Å; L46-I49 WeakPolarHBondContact O-CG1 3.36Å; L46-I49 PolarHBondContact O-N 2.66Å; L46-A115 HydrophobicContact CD2-CB 4.1Å; L46-L119 HydrophobicContact CD2-CD1 4.34Å; L46-L119 HydrophobicContact CD2-CD2 3.83Å; L46-L119 HydrophobicContact CD2-CG 3.83Å; L46-L180 HydrophobicContact CD1-CD1 3.99Å; L46-L180 HydrophobicContact CD2-CD1 3.86Å; L46-L180 HydrophobicContact CG-CD1 4.38Å
47Q94.5Very high94.8Very high96 Ų9640.6 Ų40.645%0.44921%0.214SC..THydrogen-bonded Turntrans50.938.9-178.5-57.9174.4-15.700112.8N43 E44 I49 S118 N121N43-Q47 CarbonylContact O-C 3.31Å; N43-Q47 VanDerWaalsContact O-CA 3.26Å; N43-Q47 WeakPolarHBondContact O-CA 3.34Å; N43-Q47 PolarHBondContact O-N 3.06Å; E44-Q47 PolarHBondContact O-N 3.38Å; Q47-I49 PolarHBondContact O-N 2.93Å; Q47-I49 VanDerWaalsContact O-N 3.15Å; Q47-S118 PolarHBondContact OE1-OG 3.5Å; Q47-N121 PolarHBondContact NE2-ND2 2.94Å; Q47-N121 VanDerWaalsContact NE2-ND2 3.16Å
48R92.6Very high94.9Very high162 Ų16238.5 Ų38.561%0.61120%0.203SC*.THydrogen-bonded Turntrans5722.8-177.7-58.1169.7-161.3-98.3-11.9114.5N43 E44 L46 S50N43-R48 HydrophobicContact CB-CG 3.98Å; N43-R48 PolarHBondContact O-N 2.91Å; E44-R48 IonicContact OE1-CZ 3.96Å; E44-R48 IonicContact OE1-NH2 2.7Å; E44-R48 PolarHBondContact OE1-NH2 3.47Å; L46-R48 PolarHBondContact O-N 3.26Å; L46-R48 VanDerWaalsContact O-N 3.11Å; R48-S50 PolarHBondContact O-N 3.46Å
49I92.9Very high95Very high32 Ų3243.7 Ų43.716%0.16423%0.225CC..  trans-66.9130.4172.4-68.4158.1000109.3L46 Q47 F111 K114 S118L46-I49 VanDerWaalsContact O-CB 3.29Å; L46-I49 WeakPolarHBondContact O-CB 3.36Å; L46-I49 VanDerWaalsContact O-CD1 3.27Å; L46-I49 WeakPolarHBondContact O-CD1 3.32Å; L46-I49 VanDerWaalsContact O-CG1 3.26Å; L46-I49 WeakPolarHBondContact O-CG1 3.36Å; L46-I49 PolarHBondContact O-N 2.66Å; Q47-I49 PolarHBondContact O-N 2.93Å; Q47-I49 VanDerWaalsContact O-N 3.15Å; I49-F111 HydrophobicContact CG2-CD2 3.97Å; I49-F111 HydrophobicContact CG2-CE2 4.22Å; I49-K114 HydrophobicContact CD1-CB 3.8Å; I49-K114 WeakPolarHBondContact CD1-O 3.48Å; I49-K114 HydrophobicContact CG1-CB 4.35Å; I49-K114 HydrophobicContact CG2-CB 3.84Å; I49-S118 WeakPolarHBondContact CD1-OG 3.27Å
50S91.1Very high95Very high36 Ų3643.6 Ų43.625%0.25223%0.225SC..  trans-138.6154.517253.30000109.5R48 S52R48-S50 PolarHBondContact O-N 3.46Å; S50-S52 PolarHBondContact O-N 3.25Å
51P92.9Very high95.1Very high7 Ų741.6 Ų41.65%0.04521%0.211CC..  trans-61.2130.2174.3-15.426.1000110.5I53 I54 P55 F111 V184 I188P51-I53 HydrophobicContact CB-CG2 3.84Å; P51-I53 PolarHBondContact O-N 3.46Å; P51-I54 HydrophobicContact CB-CG1 4.15Å; P51-I54 HydrophobicContact CG-CG1 4.18Å; P51-I54 PolarHBondContact O-N 3.2Å; P51-P55 WeakPolarHBondContact O-CD 3.31Å; P51-F111 HydrophobicContact CB-CB 4.33Å; P51-F111 HydrophobicContact CB-CG 4.47Å; P51-F111 HydrophobicContact CG-CB 4.17Å; P51-F111 HydrophobicContact CG-CD1 4.29Å; P51-F111 HydrophobicContact CG-CD2 3.77Å; P51-F111 HydrophobicContact CG-CE2 4.25Å; P51-F111 HydrophobicContact CG-CG 3.79Å; P51-V184 HydrophobicContact CG-CG1 3.48Å; P51-V184 VanDerWaalsContact CG-CG1 3.48Å; P51-I188 HydrophobicContact CB-CD1 3.94Å; P51-I188 HydrophobicContact CG-CD1 3.99Å
52S89.6Confident95.2Very high78 Ų7842.4 Ų42.455%0.54522%0.217SC..THydrogen-bonded Turntrans-59.7-23.7-176.1-56.30000114.1S50 I54 P55 V56S50-S52 PolarHBondContact O-N 3.25Å; S52-I54 VanDerWaalsContact C-N 3.32Å; S52-I54 PolarHBondContact O-N 2.97Å; S52-P55 WeakPolarHBondContact O-CD 3.34Å; S52-P55 WeakPolarHBondContact O-CG 3.1Å; S52-V56 WeakPolarHBondContact O-CG2 3.34Å
53I93.6Very high95.3Very high7 Ų743.6 Ų43.64%0.03622%0.223CC..Hα-helixtrans-62.3-34.2174.4180160.2000113.2P51 V56 I57 I100 T104 I188 L192P51-I53 HydrophobicContact CB-CG2 3.84Å; P51-I53 PolarHBondContact O-N 3.46Å; I53-V56 PolarHBondContact O-N 3.04Å; I53-I57 HydrophobicContact CD1-CD1 3.67Å; I53-I57 HydrophobicContact CG1-CD1 3.36Å; I53-I57 HydrophobicContact CG1-CG1 3.83Å; I53-I57 WeakPolarHBondContact O-CG1 3.16Å; I53-I57 PolarHBondContact O-N 3Å; I53-I100 HydrophobicContact CB-CD1 4.35Å; I53-I100 HydrophobicContact CB-CG1 4.11Å; I53-I100 HydrophobicContact CD1-CG1 4.3Å; I53-I100 HydrophobicContact CG1-CG1 3.83Å; I53-T104 HydrophobicContact CD1-CG2 3.97Å; I53-T104 WeakPolarHBondContact CD1-OG1 3.33Å; I53-I188 HydrophobicContact CD1-CG2 4.14Å; I53-I188 HydrophobicContact CG2-CD1 3.71Å; I53-I188 HydrophobicContact CG2-CG1 4.25Å; I53-I188 HydrophobicContact CG2-CG2 4.4Å; I53-L192 HydrophobicContact CD1-CD2 3.48Å; I53-L192 VanDerWaalsContact CD1-CD2 3.48Å; I53-L192 HydrophobicContact CD1-CG 4.16Å
54I94.5Very high95.4Very high2 Ų242.2 Ų42.21%0.0122%0.217CC..Hα-helixtrans-62.3-56-174-59.7-57.7000112.8S32 V35 Q36 P51 S52 V56 I57 I58 I188S32-I54 WeakPolarHBondContact O-CG2 3.26Å; V35-I54 HydrophobicContact CB-CD1 4.08Å; V35-I54 HydrophobicContact CG1-CD1 3.83Å; V35-I54 HydrophobicContact CG1-CG1 4.07Å; V35-I54 HydrophobicContact CG2-CD1 4.45Å; Q36-I54 HydrophobicContact CB-CG2 4.12Å; P51-I54 HydrophobicContact CB-CG1 4.15Å; P51-I54 HydrophobicContact CG-CG1 4.18Å; P51-I54 PolarHBondContact O-N 3.2Å; S52-I54 VanDerWaalsContact C-N 3.32Å; S52-I54 PolarHBondContact O-N 2.97Å; I54-V56 VanDerWaalsContact C-N 3.26Å; I54-V56 PolarHBondContact O-N 3.45Å; I54-I57 PolarHBondContact O-N 3.41Å; I54-I58 HydrophobicContact CG2-CD1 4.14Å; I54-I58 WeakPolarHBondContact O-CG1 3.46Å; I54-I58 PolarHBondContact O-N 3.18Å; I54-I188 HydrophobicContact CD1-CD1 4.33Å; I54-I188 HydrophobicContact CD1-CG1 4.09Å
55P94.5Very high95.4Very high66 Ų6640.1 Ų40.143%0.42921%0.208SC..Hα-helixtrans-63.2-33.8179.324.2-34.7000112.5P51 S52 I58 F59P51-P55 WeakPolarHBondContact O-CD 3.31Å; S52-P55 WeakPolarHBondContact O-CD 3.34Å; S52-P55 WeakPolarHBondContact O-CG 3.1Å; P55-I58 PolarHBondContact O-N 3.33Å; P55-F59 WeakPolarHBondContact O-CB 3.47Å; P55-F59 PolarHBondContact O-N 3.16Å
56V96.1Very high95.4Very high45 Ų4544.5 Ų44.527%0.27323%0.23SC..Hα-helixtrans-65.5-43.8177.4178.10000110.6S52 I53 I54 F59 T60 T96 I100S52-V56 WeakPolarHBondContact O-CG2 3.34Å; I53-V56 PolarHBondContact O-N 3.04Å; I54-V56 VanDerWaalsContact C-N 3.26Å; I54-V56 PolarHBondContact O-N 3.45Å; V56-F59 WeakPolarHBondContact O-CB 3.44Å; V56-F59 PolarHBondContact O-N 2.81Å; V56-T60 HydrophobicContact CG1-CG2 4.34Å; V56-T60 WeakPolarHBondContact O-CG2 3.29Å; V56-T60 PolarHBondContact O-N 3.03Å; V56-T60 PolarHBondContact O-OG1 3.06Å; V56-T96 HydrophobicContact CG1-CG2 3.83Å; V56-I100 HydrophobicContact CB-CD1 4.16Å; V56-I100 HydrophobicContact CB-CG1 4.08Å; V56-I100 HydrophobicContact CG1-CB 3.94Å; V56-I100 HydrophobicContact CG1-CD1 4.15Å; V56-I100 HydrophobicContact CG1-CG1 3.87Å; V56-I100 HydrophobicContact CG1-CG2 4.28Å; V56-I100 HydrophobicContact CG2-CD1 4.18Å
57I96.2Very high95.5Very high1 Ų144.5 Ų44.51%0.00523%0.23CC..Hα-helixtrans-69.8-34.7179.8-69.6-172.7000112.5L28 S32 I53 I54 F59 T60 G61 I100 I191L28-I57 HydrophobicContact CB-CG2 3.95Å; L28-I57 HydrophobicContact CD1-CG2 4.19Å; L28-I57 HydrophobicContact CD2-CG2 4.07Å; L28-I57 HydrophobicContact CG-CG2 4.31Å; S32-I57 WeakPolarHBondContact OG-CG2 3.4Å; I53-I57 HydrophobicContact CD1-CD1 3.67Å; I53-I57 HydrophobicContact CG1-CD1 3.36Å; I53-I57 HydrophobicContact CG1-CG1 3.83Å; I53-I57 WeakPolarHBondContact O-CG1 3.16Å; I53-I57 PolarHBondContact O-N 3Å; I54-I57 PolarHBondContact O-N 3.41Å; I57-F59 VanDerWaalsContact C-N 3.32Å; I57-T60 WeakPolarHBondContact CA-OG1 3.44Å; I57-T60 PolarHBondContact O-N 2.94Å; I57-T60 PolarHBondContact O-OG1 3.37Å; I57-G61 PolarHBondContact O-N 3.29Å; I57-I100 HydrophobicContact CG1-CG2 4.32Å; I57-I191 HydrophobicContact CD1-CG2 3.23Å; I57-I191 HydrophobicContact CG2-CG2 4.35Å
58I97.3Very high95.7Very high38 Ų3840 Ų4020%0.19521%0.209CC..Hα-helixtrans-59.4-49170.8-65.7169.1000109.4S32 I33 I54 P55 G61 L62S32-I58 VanDerWaalsContact CB-CG1 3.47Å; I33-I58 HydrophobicContact CG1-CD1 4.17Å; I33-I58 HydrophobicContact CG1-CG1 4.38Å; I54-I58 HydrophobicContact CG2-CD1 4.14Å; I54-I58 WeakPolarHBondContact O-CG1 3.46Å; I54-I58 PolarHBondContact O-N 3.18Å; P55-I58 PolarHBondContact O-N 3.33Å; I58-G61 PolarHBondContact O-N 2.9Å; I58-L62 HydrophobicContact CG2-CD1 4.36Å; I58-L62 WeakPolarHBondContact O-CG 3.46Å; I58-L62 PolarHBondContact O-N 2.98Å
59F96.7Very high95.9Very high120 Ų12036.4 Ų36.453%0.52620%0.201SC..Hα-helixtrans-61-46.9178.8176.6-104.6000112.5P55 V56 I57 G61 L62 I63P55-F59 WeakPolarHBondContact O-CB 3.47Å; P55-F59 PolarHBondContact O-N 3.16Å; V56-F59 WeakPolarHBondContact O-CB 3.44Å; V56-F59 PolarHBondContact O-N 2.81Å; I57-F59 VanDerWaalsContact C-N 3.32Å; F59-G61 VanDerWaalsContact C-N 3.35Å; F59-G61 PolarHBondContact O-N 3.2Å; F59-L62 PolarHBondContact O-N 2.97Å; F59-I63 HydrophobicContact CD1-CD1 3.99Å; F59-I63 HydrophobicContact CE1-CD1 3.36Å; F59-I63 HydrophobicContact CE1-CG1 4.43Å; F59-I63 HydrophobicContact CE2-CD1 4.07Å; F59-I63 HydrophobicContact CZ-CD1 3.42Å; F59-I63 VanDerWaalsContact CZ-CD1 3.42Å; F59-I63 HydrophobicContact CZ-CG1 4.34Å; F59-I63 PolarHBondContact O-N 2.7Å
60T96.2Very high96Very high0 Ų035.6 Ų35.60%020%0.198CC..Hα-helixtrans-67.4-35.2178.758.50000112.4V56 I57 I63 G64 T96V56-T60 HydrophobicContact CG1-CG2 4.34Å; V56-T60 WeakPolarHBondContact O-CG2 3.29Å; V56-T60 PolarHBondContact O-N 3.03Å; V56-T60 PolarHBondContact O-OG1 3.06Å; I57-T60 WeakPolarHBondContact CA-OG1 3.44Å; I57-T60 PolarHBondContact O-N 2.94Å; I57-T60 PolarHBondContact O-OG1 3.37Å; T60-I63 PolarHBondContact O-N 3.36Å; T60-G64 PolarHBondContact O-N 3.14Å; T60-T96 VanDerWaalsContact CG2-CB 3.44Å; T60-T96 HydrophobicContact CG2-CG2 3.23Å
61G97.8Very high96.1Very high0 Ų033.9 Ų33.90%019%0.186CC..Hα-helixtrans-62.1-42.3173.400000112S25 C29 I57 I58 F59 G64 I65S25-G61 WeakPolarHBondContact CB-O 3.35Å; C29-G61 VanDerWaalsContact SG-C 3.6Å; I57-G61 PolarHBondContact O-N 3.29Å; I58-G61 PolarHBondContact O-N 2.9Å; F59-G61 VanDerWaalsContact C-N 3.35Å; F59-G61 PolarHBondContact O-N 3.2Å; G61-G64 PolarHBondContact O-N 3.27Å; G61-I65 WeakPolarHBondContact O-CG1 3.31Å; G61-I65 PolarHBondContact O-N 3.27Å
62L98.4Very high96.2Very high93 Ų9337.1 Ų37.149%0.48720%0.198SC..Hα-helixtrans-63-43.5174.3-67.5174.2000112.2I58 F59 G64 I65 I66I58-L62 HydrophobicContact CG2-CD1 4.36Å; I58-L62 WeakPolarHBondContact O-CG 3.46Å; I58-L62 PolarHBondContact O-N 2.98Å; F59-L62 PolarHBondContact O-N 2.97Å; L62-G64 VanDerWaalsContact C-N 3.3Å; L62-G64 PolarHBondContact O-N 3.13Å; L62-I65 HydrophobicContact CD2-CD1 4.5Å; L62-I65 PolarHBondContact O-N 3.33Å; L62-I66 WeakPolarHBondContact O-CG1 3.44Å; L62-I66 PolarHBondContact O-N 3.5Å
63I98.2Very high96.3Very high24 Ų2435.7 Ų35.712%0.12319%0.187CC..Hα-helixtrans-62.7-39.8173.4-66.1-179.6000110.8F59 T60 I65 I66 A67 S89 I92 A93F59-I63 HydrophobicContact CD1-CD1 3.99Å; F59-I63 HydrophobicContact CE1-CD1 3.36Å; F59-I63 HydrophobicContact CE1-CG1 4.43Å; F59-I63 HydrophobicContact CE2-CD1 4.07Å; F59-I63 HydrophobicContact CZ-CD1 3.42Å; F59-I63 VanDerWaalsContact CZ-CD1 3.42Å; F59-I63 HydrophobicContact CZ-CG1 4.34Å; F59-I63 PolarHBondContact O-N 2.7Å; T60-I63 PolarHBondContact O-N 3.36Å; I63-I65 VanDerWaalsContact C-N 3.33Å; I63-I65 PolarHBondContact O-N 3.42Å; I63-I66 WeakPolarHBondContact O-CB 3.4Å; I63-I66 PolarHBondContact O-N 2.87Å; I63-A67 WeakPolarHBondContact O-CB 3.47Å; I63-A67 PolarHBondContact O-N 3.16Å; I63-S89 WeakPolarHBondContact CG2-O 3.41Å; I63-I92 HydrophobicContact CD1-CG2 3.87Å; I63-I92 HydrophobicContact CG2-CG2 4.5Å; I63-A93 HydrophobicContact CG2-CB 4.04Å
64G98.4Very high96.1Very high5 Ų536.5 Ų36.55%0.05219%0.191CC..Hα-helixtrans-60.9-38.9177.100000113S25 T60 G61 L62 A67 A68S25-G64 WeakPolarHBondContact OG-CA 3.44Å; T60-G64 PolarHBondContact O-N 3.14Å; G61-G64 PolarHBondContact O-N 3.27Å; L62-G64 VanDerWaalsContact C-N 3.3Å; L62-G64 PolarHBondContact O-N 3.13Å; G64-A67 PolarHBondContact O-N 3.48Å; G64-A68 WeakPolarHBondContact O-CB 3.46Å; G64-A68 PolarHBondContact O-N 2.86Å
65I98.7Very high95.8Very high31 Ų3139 Ų3916%0.15920%0.204CC..Hα-helixtrans-62.3-47.1173.1-67.6164.6000110.6L22 L26 G61 L62 I63 A67 A68 I69L22-I65 HydrophobicContact CD1-CB 4.29Å; L22-I65 HydrophobicContact CD1-CG1 4.17Å; L22-I65 HydrophobicContact CD1-CG2 3.92Å; L26-I65 HydrophobicContact CD2-CD1 3.7Å; L26-I65 HydrophobicContact CD2-CG1 4.31Å; L26-I65 HydrophobicContact CG-CD1 4.31Å; L26-I65 HydrophobicContact CG-CG1 4.45Å; G61-I65 WeakPolarHBondContact O-CG1 3.31Å; G61-I65 PolarHBondContact O-N 3.27Å; L62-I65 HydrophobicContact CD2-CD1 4.5Å; L62-I65 PolarHBondContact O-N 3.33Å; I63-I65 VanDerWaalsContact C-N 3.33Å; I63-I65 PolarHBondContact O-N 3.42Å; I65-A67 VanDerWaalsContact C-N 3.31Å; I65-A67 PolarHBondContact O-N 3.39Å; I65-A68 PolarHBondContact O-N 2.69Å; I65-I69 HydrophobicContact CG2-CD1 3.76Å; I65-I69 HydrophobicContact CG2-CG1 4.45Å; I65-I69 WeakPolarHBondContact O-CG1 3.34Å; I65-I69 PolarHBondContact O-N 3.16Å
66I97.7Very high95.6Very high91 Ų9143.2 Ų43.247%0.46722%0.222SC..Hα-helixtrans-60.5-43.5176.7-64.3168.2000110.5L62 I63 A68 I69 T70L62-I66 WeakPolarHBondContact O-CG1 3.44Å; L62-I66 PolarHBondContact O-N 3.5Å; I63-I66 WeakPolarHBondContact O-CB 3.4Å; I63-I66 PolarHBondContact O-N 2.87Å; I66-A68 VanDerWaalsContact C-N 3.35Å; I66-A68 PolarHBondContact O-N 3.47Å; I66-I69 PolarHBondContact O-N 3.33Å; I66-T70 HydrophobicContact CG2-CG2 4.4Å; I66-T70 WeakPolarHBondContact O-CB 3.49Å; I66-T70 VanDerWaalsContact O-CG2 3.3Å; I66-T70 WeakPolarHBondContact O-CG2 3.35Å; I66-T70 PolarHBondContact O-N 2.9Å; I66-T70 PolarHBondContact O-OG1 3.05Å
67A98Very high95.2Very high0 Ų047.7 Ų47.70%024%0.237CC..Hα-helixtrans-61-42.4177.500000111.9I63 G64 I65 T70 G71 H86 S89 L90I63-A67 WeakPolarHBondContact O-CB 3.47Å; I63-A67 PolarHBondContact O-N 3.16Å; G64-A67 PolarHBondContact O-N 3.48Å; I65-A67 VanDerWaalsContact C-N 3.31Å; I65-A67 PolarHBondContact O-N 3.39Å; A67-T70 WeakPolarHBondContact CA-OG1 3.38Å; A67-T70 PolarHBondContact O-OG1 2.91Å; A67-G71 PolarHBondContact O-N 3.42Å; A67-H86 PolarHBondContact O-CE1 2.86Å; A67-H86 PolarHBondContact O-ND1 2.95Å; A67-S89 VanDerWaalsContact CA-OG 3.31Å; A67-S89 WeakPolarHBondContact CA-OG 3.31Å; A67-S89 WeakPolarHBondContact CB-OG 3.5Å; A67-L90 HydrophobicContact CB-CB 4.08Å; A67-L90 HydrophobicContact CB-CD1 4.08Å
68A97.9Very high94.6Very high2 Ų254.8 Ų54.82%0.01727%0.27CS..Hα-helixtrans-69.4-42.9178.800000112.6F21 L22 G64 I65 I66 G71 Y72F21-A68 HydrophobicContact CB-CB 4.47Å; L22-A68 HydrophobicContact CB-CB 3.76Å; L22-A68 HydrophobicContact CD1-CB 4.19Å; G64-A68 WeakPolarHBondContact O-CB 3.46Å; G64-A68 PolarHBondContact O-N 2.86Å; I65-A68 PolarHBondContact O-N 2.69Å; I66-A68 VanDerWaalsContact C-N 3.35Å; I66-A68 PolarHBondContact O-N 3.47Å; A68-G71 WeakPolarHBondContact O-CA 3.47Å; A68-G71 PolarHBondContact O-N 2.91Å; A68-G71 VanDerWaalsContact O-N 3.16Å; A68-Y72 VanDerWaalsContact O-CD2 3.31Å; A68-Y72 WeakPolarHBondContact O-CD2 3.32Å; A68-Y72 PolarHBondContact O-N 3.02Å
69I96.4Very high94.2Very high87 Ų8755.5 Ų55.545%0.44628%0.275SS..Hα-helixtrans-61.9-46.4177.1-68.1169.2000110.5I65 I66 G71 Y72 C73I65-I69 HydrophobicContact CG2-CD1 3.76Å; I65-I69 HydrophobicContact CG2-CG1 4.45Å; I65-I69 WeakPolarHBondContact O-CG1 3.34Å; I65-I69 PolarHBondContact O-N 3.16Å; I66-I69 PolarHBondContact O-N 3.33Å; I69-G71 PolarHBondContact O-N 3.49Å; I69-Y72 WeakPolarHBondContact O-CB 3.45Å; I69-Y72 PolarHBondContact O-N 3.34Å; I69-Y72 VanDerWaalsContact O-N 3.08Å; I69-C73 PolarHBondContact O-N 3.37Å; I69-C73 PolarHBondContact O-SG 2.88Å
70T95.8Very high93.9Very high14 Ų1457.1 Ų57.19%0.08628%0.284CS..Hα-helixtrans-63.7-30.9176.953.20000112.1I66 A67 C73 K74 I82 L85 H86I66-T70 HydrophobicContact CG2-CG2 4.4Å; I66-T70 WeakPolarHBondContact O-CB 3.49Å; I66-T70 VanDerWaalsContact O-CG2 3.3Å; I66-T70 WeakPolarHBondContact O-CG2 3.35Å; I66-T70 PolarHBondContact O-N 2.9Å; I66-T70 PolarHBondContact O-OG1 3.05Å; A67-T70 WeakPolarHBondContact CA-OG1 3.38Å; A67-T70 PolarHBondContact O-OG1 2.91Å; T70-C73 PolarHBondContact O-N 3.21Å; T70-K74 WeakPolarHBondContact O-CB 3.36Å; T70-K74 PolarHBondContact O-N 3.35Å; T70-I82 WeakPolarHBondContact O-CG2 3.3Å; T70-L85 HydrophobicContact CG2-CD2 3.62Å; T70-L85 HydrophobicContact CG2-CG 3.95Å; T70-H86 WeakPolarHBondContact OG1-CA 3.21Å
71G94.1Very high93.8Very high1 Ų163.1 Ų63.11%0.0131%0.314CS..Hα-helixtrans-60.9-42.9169.600000113.3A67 A68 I69 K74 H86A67-G71 PolarHBondContact O-N 3.42Å; A68-G71 WeakPolarHBondContact O-CA 3.47Å; A68-G71 PolarHBondContact O-N 2.91Å; A68-G71 VanDerWaalsContact O-N 3.16Å; I69-G71 PolarHBondContact O-N 3.49Å; G71-K74 WeakPolarHBondContact O-CB 3.47Å; G71-H86 WeakPolarHBondContact CA-ND1 2.89Å; G71-H86 PolarHBondContact N-ND1 3.44Å
72Y93.7Very high93.6Very high75 Ų7564.8 Ų64.829%0.29432%0.323SS..Hα-helixtrans-66.9-44.1172-75.7-65.8000112.7I15 N18 G19 L22 A68 I69 K74 I75 L76I15-Y72 HydrophobicContact CG2-CE1 4.2Å; I15-Y72 PolarHBondContact O-OH 3.4Å; N18-Y72 HydrophobicContact CB-CD2 4.45Å; N18-Y72 HydrophobicContact CB-CE2 4.21Å; G19-Y72 WeakPolarHBondContact CA-OH 3.39Å; G19-Y72 PolarHBondContact N-OH 3.05Å; G19-Y72 VanDerWaalsContact N-OH 3.1Å; L22-Y72 HydrophobicContact CD2-CE2 4.4Å; A68-Y72 VanDerWaalsContact O-CD2 3.31Å; A68-Y72 WeakPolarHBondContact O-CD2 3.32Å; A68-Y72 PolarHBondContact O-N 3.02Å; I69-Y72 WeakPolarHBondContact O-CB 3.45Å; I69-Y72 PolarHBondContact O-N 3.34Å; I69-Y72 VanDerWaalsContact O-N 3.08Å; Y72-K74 PolarHBondContact O-N 2.75Å; Y72-I75 WeakPolarHBondContact O-CB 3.21Å; Y72-I75 PolarHBondContact O-N 2.68Å; Y72-L76 PolarHBondContact O-N 3.09Å
73C92.7Very high93.3Very high47 Ų4760.9 Ų60.932%0.31830%0.303SS..Hα-helixtrans-58.9-37178-660000112.1I69 T70 I75 L76 K77 I82I69-C73 PolarHBondContact O-N 3.37Å; I69-C73 PolarHBondContact O-SG 2.88Å; T70-C73 PolarHBondContact O-N 3.21Å; C73-I75 VanDerWaalsContact C-N 3.27Å; C73-I75 PolarHBondContact O-N 3.1Å; C73-L76 PolarHBondContact O-N 3.17Å; C73-K77 PolarHBondContact O-N 2.98Å; C73-I82 HydrophobicContact CB-CD1 4.39Å; C73-I82 HydrophobicContact CB-CG2 3.86Å
74K89.1Confident93.1Very high25 Ų2564.3 Ų64.311%0.10932%0.321CS..Hα-helixtrans-57.5-39.9175.4177.3-169.8170-165.10111.9T70 G71 Y72 K77 Q78 I82 T83T70-K74 WeakPolarHBondContact O-CB 3.36Å; T70-K74 PolarHBondContact O-N 3.35Å; G71-K74 WeakPolarHBondContact O-CB 3.47Å; Y72-K74 PolarHBondContact O-N 2.75Å; K74-K77 CarbonylContact O-C 3.31Å; K74-K77 VanDerWaalsContact O-C 3.31Å; K74-Q78 PolarHBondContact O-N 2.6Å; K74-I82 HydrophobicContact CB-CG2 4.09Å; K74-T83 HydrophobicContact CD-CG2 4.38Å
75I88.5Confident93Very high55 Ų5568.1 Ų68.128%0.28234%0.34SS..Hα-helixtrans-71.4-39.2-179.2-60.2163.6000110.8F14 I15 Y72 C73F14-I75 HydrophobicContact CB-CD1 3.96Å; F14-I75 HydrophobicContact CB-CG1 4.46Å; I15-I75 HydrophobicContact CG1-CD1 3.62Å; Y72-I75 WeakPolarHBondContact O-CB 3.21Å; Y72-I75 PolarHBondContact O-N 2.68Å; C73-I75 VanDerWaalsContact C-N 3.27Å; C73-I75 PolarHBondContact O-N 3.1Å
76L89.1Confident92.9Very high154 Ų15466.7 Ų66.781%0.80633%0.332SS*.Hα-helixtrans-72-39.4178.9-63.1175.5000112.2Y72 C73Y72-L76 PolarHBondContact O-N 3.09Å; C73-L76 PolarHBondContact O-N 3.17Å
77K88.6Confident92.8Very high138 Ų13863.9 Ų63.960%0.632%0.318SS*.SBendtrans-138.6104.3-179.2-174176.7-177.7176.80109.6C73 K74 N79C73-K77 PolarHBondContact O-N 2.98Å; K74-K77 CarbonylContact O-C 3.31Å; K74-K77 VanDerWaalsContact O-C 3.31Å; K77-N79 PolarHBondContact O-N 2.92Å
78Q84.3Confident92.8Very high150 Ų15068.1 Ų68.170%0.70134%0.34SS*.  trans-65.799.1173.7-172.164.518.300109.5K74K74-Q78 PolarHBondContact O-N 2.6Å
79N88.9Confident92.8Very high53 Ų5368.5 Ų68.528%0.28334%0.342SS..  trans-133.2133177.8-178.9-7.8000108.7K77 I81 I82 T83K77-N79 PolarHBondContact O-N 2.92Å; N79-I81 VanDerWaalsContact C-N 3.28Å; N79-I81 PolarHBondContact O-N 3.25Å; N79-I81 PolarHBondContact OD1-N 2.72Å; N79-I82 HydrophobicContact CB-CB 4.28Å; N79-I82 HydrophobicContact CB-CD1 3.88Å; N79-I82 HydrophobicContact CB-CG1 3.94Å; N79-I82 PolarHBondContact O-N 3.43Å; N79-T83 PolarHBondContact O-N 3.26Å; N79-T83 PolarHBondContact O-OG1 2.84Å
80Q89.6Confident92.9Very high155 Ų15564.5 Ų64.572%0.72432%0.321SS*.Hα-helixtrans-58.3-41178.2-70.7-177.5-34.500111.8I82 T83 I84Q80-I82 PolarHBondContact O-N 2.98Å; Q80-T83 WeakPolarHBondContact O-CB 3.41Å; Q80-T83 PolarHBondContact O-N 2.91Å; Q80-I84 VanDerWaalsContact O-CG1 3.31Å; Q80-I84 WeakPolarHBondContact O-CG1 3.37Å; Q80-I84 PolarHBondContact O-N 3.44Å
81I93.9Very high93Very high125 Ų12565.8 Ų65.864%0.64133%0.331SS*.Hα-helixtrans-62.2-45.1179.9-61.9174.2000110.9N79 T83 I84 L85N79-I81 VanDerWaalsContact C-N 3.28Å; N79-I81 PolarHBondContact O-N 3.25Å; N79-I81 PolarHBondContact OD1-N 2.72Å; I81-T83 VanDerWaalsContact C-N 3.31Å; I81-T83 PolarHBondContact O-N 3.46Å; I81-I84 PolarHBondContact O-N 3.33Å; I81-L85 WeakPolarHBondContact O-CB 3.14Å; I81-L85 PolarHBondContact O-N 2.98Å
82I93.9Very high93.2Very high35 Ų3569.4 Ų69.418%0.17935%0.349CS..Hα-helixtrans-64.4-40178.3-59.9177.5000110.5T70 C73 K74 N79 Q80 L85 H86T70-I82 WeakPolarHBondContact O-CG2 3.3Å; C73-I82 HydrophobicContact CB-CD1 4.39Å; C73-I82 HydrophobicContact CB-CG2 3.86Å; K74-I82 HydrophobicContact CB-CG2 4.09Å; N79-I82 HydrophobicContact CB-CB 4.28Å; N79-I82 HydrophobicContact CB-CD1 3.88Å; N79-I82 HydrophobicContact CB-CG1 3.94Å; N79-I82 PolarHBondContact O-N 3.43Å; Q80-I82 PolarHBondContact O-N 2.98Å; I82-L85 PolarHBondContact O-N 3.08Å; I82-H86 WeakPolarHBondContact O-CB 3.46Å; I82-H86 PolarHBondContact O-N 2.97Å
83T91.9Very high93.4Very high11 Ų1165.9 Ų65.97%0.06734%0.335CS..Hα-helixtrans-63.6-44.8177.7-57.60000111.5K74 N79 Q80 I81 H86 I87 I213K74-T83 HydrophobicContact CD-CG2 4.38Å; N79-T83 PolarHBondContact O-N 3.26Å; N79-T83 PolarHBondContact O-OG1 2.84Å; Q80-T83 WeakPolarHBondContact O-CB 3.41Å; Q80-T83 PolarHBondContact O-N 2.91Å; I81-T83 VanDerWaalsContact C-N 3.31Å; I81-T83 PolarHBondContact O-N 3.46Å; T83-H86 PolarHBondContact O-N 2.93Å; T83-I87 HydrophobicContact CG2-CD1 4.06Å; T83-I87 WeakPolarHBondContact O-CG1 3.28Å; T83-I87 PolarHBondContact O-N 3.01Å; T83-I213 HydrophobicContact CG2-CD1 3.92Å
84I94.1Very high93.6Very high96 Ų9664 Ų6449%0.49232%0.322SS..Hα-helixtrans-62.9-46177.1-69.6165.9000110.3Q80 I81 H86 I87 I88Q80-I84 VanDerWaalsContact O-CG1 3.31Å; Q80-I84 WeakPolarHBondContact O-CG1 3.37Å; Q80-I84 PolarHBondContact O-N 3.44Å; I81-I84 PolarHBondContact O-N 3.33Å; I84-H86 VanDerWaalsContact C-N 3.33Å; I84-H86 PolarHBondContact O-N 3.19Å; I84-I87 PolarHBondContact O-N 3.2Å; I84-I88 HydrophobicContact CG2-CD1 3.56Å; I84-I88 HydrophobicContact CG2-CG1 4.24Å; I84-I88 WeakPolarHBondContact O-CG1 3.33Å; I84-I88 PolarHBondContact O-N 3.44Å
85L95.6Very high94Very high86 Ų8667 Ų6745%0.4534%0.343SS..Hα-helixtrans-60.1-42.3178.4-177.761.8000112.1T70 I81 I82 S89T70-L85 HydrophobicContact CG2-CD2 3.62Å; T70-L85 HydrophobicContact CG2-CG 3.95Å; I81-L85 WeakPolarHBondContact O-CB 3.14Å; I81-L85 PolarHBondContact O-N 2.98Å; I82-L85 PolarHBondContact O-N 3.08Å; L85-S89 WeakPolarHBondContact O-CB 3.41Å; L85-S89 PolarHBondContact O-N 3.4Å; L85-S89 PolarHBondContact O-OG 3.07Å
86H96.2Very high94.5Very high0 Ų066.1 Ų66.10%034%0.34CS..Hα-helixtrans-60.7-47174.7174.564.3000112N18 A67 T70 G71 I82 T83 I84 S89 L90 Y205N18-H86 PolarHBondContact OD1-CE1 2.93Å; A67-H86 PolarHBondContact O-CE1 2.86Å; A67-H86 PolarHBondContact O-ND1 2.95Å; T70-H86 WeakPolarHBondContact OG1-CA 3.21Å; G71-H86 WeakPolarHBondContact CA-ND1 2.89Å; G71-H86 PolarHBondContact N-ND1 3.44Å; I82-H86 WeakPolarHBondContact O-CB 3.46Å; I82-H86 PolarHBondContact O-N 2.97Å; T83-H86 PolarHBondContact O-N 2.93Å; I84-H86 VanDerWaalsContact C-N 3.33Å; I84-H86 PolarHBondContact O-N 3.19Å; H86-S89 PolarHBondContact O-OG 3.3Å; H86-L90 WeakPolarHBondContact O-CB 3.3Å; H86-L90 PolarHBondContact O-N 3.44Å; H86-Y205 AromaticContact CE1-CE1 3.98Å; H86-Y205 AromaticContact NE2-CE1 3.41Å; H86-Y205 WeakPolarHBondContact NE2-CE1 3.42Å; H86-Y205 AromaticContact NE2-CZ 3.73Å; H86-Y205 PolarHBondContact NE2-OH 2.94Å; H86-Y205 VanDerWaalsContact NE2-OH 3.09Å
87I97Very high94.8Very high33 Ų3358.9 Ų58.917%0.16930%0.302CS..Hα-helixtrans-63.3-46.5179.2-68.5167.4000110.9T83 I84 S91 L206 I209 I213T83-I87 HydrophobicContact CG2-CD1 4.06Å; T83-I87 WeakPolarHBondContact O-CG1 3.28Å; T83-I87 PolarHBondContact O-N 3.01Å; I84-I87 PolarHBondContact O-N 3.2Å; I87-S91 VanDerWaalsContact O-CB 3.23Å; I87-S91 WeakPolarHBondContact O-CB 3.49Å; I87-S91 PolarHBondContact O-N 3.34Å; I87-S91 PolarHBondContact O-OG 2.9Å; I87-L206 HydrophobicContact CG2-CD2 4.32Å; I87-I209 HydrophobicContact CD1-CG2 3.81Å; I87-I209 HydrophobicContact CG1-CG2 4.01Å; I87-I213 HydrophobicContact CD1-CD1 3.57Å
88I98Very high95.1Very high89 Ų8955.8 Ų55.846%0.45629%0.292SS..Hα-helixtrans-63.1-52.6-178.5-69.3173.3000110.6I84 L90 S91 I92I84-I88 HydrophobicContact CG2-CD1 3.56Å; I84-I88 HydrophobicContact CG2-CG1 4.24Å; I84-I88 WeakPolarHBondContact O-CG1 3.33Å; I84-I88 PolarHBondContact O-N 3.44Å; I88-L90 PolarHBondContact O-N 3.46Å; I88-S91 PolarHBondContact O-N 3.06Å; I88-I92 HydrophobicContact CG2-CD1 3.77Å; I88-I92 HydrophobicContact CG2-CG1 4.5Å; I88-I92 WeakPolarHBondContact O-CG1 3.39Å; I88-I92 PolarHBondContact O-N 3.48Å
89S97.8Very high95.7Very high9 Ų952.5 Ų52.56%0.06328%0.284CS..Hα-helixtrans-62-43.8-178.653.90000112.3I63 A67 L85 H86 S91 I92 A93I63-S89 WeakPolarHBondContact CG2-O 3.41Å; A67-S89 VanDerWaalsContact CA-OG 3.31Å; A67-S89 WeakPolarHBondContact CA-OG 3.31Å; A67-S89 WeakPolarHBondContact CB-OG 3.5Å; L85-S89 WeakPolarHBondContact O-CB 3.41Å; L85-S89 PolarHBondContact O-N 3.4Å; L85-S89 PolarHBondContact O-OG 3.07Å; H86-S89 PolarHBondContact O-OG 3.3Å; S89-S91 VanDerWaalsContact C-N 3.33Å; S89-S91 PolarHBondContact O-N 3.22Å; S89-I92 PolarHBondContact O-N 3.41Å; S89-A93 WeakPolarHBondContact O-CB 3.38Å; S89-A93 PolarHBondContact O-N 3.45Å
90L98.1Very high96Very high3 Ų351.3 Ų51.32%0.01628%0.278CS..Hα-helixtrans-66.6-35.6177.7-167.666.7000112.3F21 A67 H86 I88 T94 K202 Y205 L206F21-L90 HydrophobicContact CD2-CD1 4.37Å; A67-L90 HydrophobicContact CB-CB 4.08Å; A67-L90 HydrophobicContact CB-CD1 4.08Å; H86-L90 WeakPolarHBondContact O-CB 3.3Å; H86-L90 PolarHBondContact O-N 3.44Å; I88-L90 PolarHBondContact O-N 3.46Å; L90-T94 WeakPolarHBondContact O-CB 3.25Å; L90-T94 PolarHBondContact O-N 2.95Å; L90-T94 PolarHBondContact O-OG1 3.05Å; L90-K202 HydrophobicContact CD1-CD 3.63Å; L90-K202 HydrophobicContact CD1-CG 4.02Å; L90-K202 HydrophobicContact CG-CD 4.46Å; L90-Y205 HydrophobicContact CD2-CD1 3.41Å; L90-Y205 VanDerWaalsContact CD2-CD1 3.41Å; L90-Y205 HydrophobicContact CD2-CE1 3.45Å; L90-Y205 VanDerWaalsContact CD2-CE1 3.45Å; L90-L206 HydrophobicContact CB-CD2 4.2Å; L90-L206 HydrophobicContact CD2-CD2 3.89Å; L90-L206 HydrophobicContact CD2-CG 3.92Å; L90-L206 HydrophobicContact CG-CD1 4.34Å; L90-L206 HydrophobicContact CG-CD2 4.27Å; L90-L206 HydrophobicContact CG-CG 4.27Å
91S98.1Very high96.3Very high41 Ų4143.9 Ų43.929%0.28724%0.243SC..Hα-helixtrans-66-46.5175.3-59.40000111.2I87 I88 S89 A93 T94 V95I87-S91 VanDerWaalsContact O-CB 3.23Å; I87-S91 WeakPolarHBondContact O-CB 3.49Å; I87-S91 PolarHBondContact O-N 3.34Å; I87-S91 PolarHBondContact O-OG 2.9Å; I88-S91 PolarHBondContact O-N 3.06Å; S89-S91 VanDerWaalsContact C-N 3.33Å; S89-S91 PolarHBondContact O-N 3.22Å; S91-A93 PolarHBondContact O-N 3.39Å; S91-T94 PolarHBondContact O-N 2.75Å; S91-V95 WeakPolarHBondContact O-CG2 3.47Å; S91-V95 PolarHBondContact O-N 2.85Å
92I98.1Very high96.3Very high78 Ų7841.4 Ų41.440%0.423%0.23SC..Hα-helixtrans-59.2-48.1176.7-68.3167.9000110.5I63 I88 S89 T94 T96I63-I92 HydrophobicContact CD1-CG2 3.87Å; I63-I92 HydrophobicContact CG2-CG2 4.5Å; I88-I92 HydrophobicContact CG2-CD1 3.77Å; I88-I92 HydrophobicContact CG2-CG1 4.5Å; I88-I92 WeakPolarHBondContact O-CG1 3.39Å; I88-I92 PolarHBondContact O-N 3.48Å; S89-I92 PolarHBondContact O-N 3.41Å; I92-T94 VanDerWaalsContact C-N 3.34Å; I92-T94 PolarHBondContact O-N 3.44Å; I92-T96 WeakPolarHBondContact O-CB 3.32Å; I92-T96 PolarHBondContact O-N 3.28Å; I92-T96 PolarHBondContact O-OG1 2.69Å
93A97.5Very high96.3Very high0 Ų041 Ų410%024%0.236CC..Hα-helixtrans-59.2-44.6177.600000111.9I63 S89 S91 E97I63-A93 HydrophobicContact CG2-CB 4.04Å; S89-A93 WeakPolarHBondContact O-CB 3.38Å; S89-A93 PolarHBondContact O-N 3.45Å; S91-A93 PolarHBondContact O-N 3.39Å; A93-E97 WeakPolarHBondContact O-CB 3.43Å; A93-E97 WeakPolarHBondContact O-CG 3.37Å; A93-E97 PolarHBondContact O-N 3.02Å
94T98.1Very high96.4Very high7 Ų741.8 Ų41.84%0.04324%0.24CC..Hα-helixtrans-66.7-45.3-178.7-55.60000112.5L90 S91 I92 L98 K202 S203L90-T94 WeakPolarHBondContact O-CB 3.25Å; L90-T94 PolarHBondContact O-N 2.95Å; L90-T94 PolarHBondContact O-OG1 3.05Å; S91-T94 PolarHBondContact O-N 2.75Å; I92-T94 VanDerWaalsContact C-N 3.34Å; I92-T94 PolarHBondContact O-N 3.44Å; T94-L98 WeakPolarHBondContact O-CB 3.36Å; T94-L98 PolarHBondContact O-N 2.94Å; T94-L98 VanDerWaalsContact O-N 3.09Å; T94-K202 HydrophobicContact CG2-CB 4.14Å; T94-K202 VanDerWaalsContact OG1-CB 3.31Å; T94-K202 WeakPolarHBondContact OG1-CB 3.28Å; T94-S203 WeakPolarHBondContact CG2-OG 3.37Å
95V98Very high96.3Very high88 Ų8842.5 Ų42.553%0.53324%0.244SC..Hα-helixtrans-63.9-45.2177.7171.50000110.3S91 L98 C99S91-V95 WeakPolarHBondContact O-CG2 3.47Å; S91-V95 PolarHBondContact O-N 2.85Å; V95-L98 PolarHBondContact O-N 3.48Å; V95-C99 WeakPolarHBondContact O-CB 3.38Å; V95-C99 PolarHBondContact O-N 2.97Å; V95-C99 PolarHBondContact O-SG 3.07Å
96T97Very high96.2Very high38 Ų3845.5 Ų45.523%0.23326%0.257CS..Hα-helixtrans-67.2-40.8-177.1-490000111.7V56 T60 I92 C99 I100V56-T96 HydrophobicContact CG1-CG2 3.83Å; T60-T96 VanDerWaalsContact CG2-CB 3.44Å; T60-T96 HydrophobicContact CG2-CG2 3.23Å; I92-T96 WeakPolarHBondContact O-CB 3.32Å; I92-T96 PolarHBondContact O-N 3.28Å; I92-T96 PolarHBondContact O-OG1 2.69Å; T96-C99 PolarHBondContact O-N 2.9Å; T96-I100 WeakPolarHBondContact O-CB 3.37Å; T96-I100 VanDerWaalsContact O-CG2 3.3Å; T96-I100 WeakPolarHBondContact O-CG2 3.49Å; T96-I100 PolarHBondContact O-N 2.7Å
97E96.4Very high95.9Very high1 Ų148.6 Ų48.61%0.00528%0.276CS..Hα-helixtrans-61.9-43.4174.2-81.9173.4-147.900112.6Y24 A93 I100 A101 C195 S199 K202Y24-E97 VanDerWaalsContact OH-CD 3.23Å; Y24-E97 PolarHBondContact OH-OE2 3.31Å; Y24-E97 VanDerWaalsContact OH-OE2 3.07Å; A93-E97 WeakPolarHBondContact O-CB 3.43Å; A93-E97 WeakPolarHBondContact O-CG 3.37Å; A93-E97 PolarHBondContact O-N 3.02Å; E97-I100 WeakPolarHBondContact O-CG2 3.3Å; E97-A101 WeakPolarHBondContact O-CB 3.4Å; E97-A101 PolarHBondContact O-N 2.92Å; E97-C195 HydrophobicContact CB-CB 4.5Å; E97-S199 WeakPolarHBondContact CB-OG 3.43Å; E97-S199 PolarHBondContact OE2-OG 3.11Å; E97-K202 IonicContact OE1-NZ 2.75Å; E97-K202 PolarHBondContact OE1-NZ 2.95Å; E97-K202 VanDerWaalsContact OE2-CE 3.29Å; E97-K202 WeakPolarHBondContact OE2-CE 3.42Å; E97-K202 IonicContact OE2-NZ 2.6Å; E97-K202 PolarHBondContact OE2-NZ 3.27Å
98L96Very high95.6Very high73 Ų7352.2 Ų52.238%0.38230%0.302SS..Hα-helixtrans-64.5-45.6177.2-175.463.8000111.1T94 V95 A101 I102 F196T94-L98 WeakPolarHBondContact O-CB 3.36Å; T94-L98 PolarHBondContact O-N 2.94Å; T94-L98 VanDerWaalsContact O-N 3.09Å; V95-L98 PolarHBondContact O-N 3.48Å; L98-A101 PolarHBondContact O-N 2.84Å; L98-I102 HydrophobicContact CD1-CD1 3.83Å; L98-I102 HydrophobicContact CD1-CG1 4.33Å; L98-I102 HydrophobicContact CG-CD1 3.87Å; L98-I102 WeakPolarHBondContact O-CB 3.41Å; L98-I102 VanDerWaalsContact O-CG1 3.27Å; L98-I102 WeakPolarHBondContact O-CG1 3.44Å; L98-I102 PolarHBondContact O-N 2.79Å; L98-F196 HydrophobicContact CD1-CD1 4.32Å; L98-F196 HydrophobicContact CD1-CE1 4.18Å
99C96.5Very high95.2Very high81 Ų8150.2 Ų50.255%0.54729%0.292SS..Hα-helixtrans-61.9-46.9178.3-71.90000112.2V95 T96 G103V95-C99 WeakPolarHBondContact O-CB 3.38Å; V95-C99 PolarHBondContact O-N 2.97Å; V95-C99 PolarHBondContact O-SG 3.07Å; T96-C99 PolarHBondContact O-N 2.9Å; C99-G103 PolarHBondContact O-N 3.03Å
100I95.2Very high94.9Very high28 Ų2853.9 Ų53.914%0.14431%0.308CS..Hα-helixtrans-70.5-35.3-178.8-16661.3000112.1I53 V56 I57 T96 E97 G103 T104I53-I100 HydrophobicContact CB-CD1 4.35Å; I53-I100 HydrophobicContact CB-CG1 4.11Å; I53-I100 HydrophobicContact CD1-CG1 4.3Å; I53-I100 HydrophobicContact CG1-CG1 3.83Å; V56-I100 HydrophobicContact CB-CD1 4.16Å; V56-I100 HydrophobicContact CB-CG1 4.08Å; V56-I100 HydrophobicContact CG1-CB 3.94Å; V56-I100 HydrophobicContact CG1-CD1 4.15Å; V56-I100 HydrophobicContact CG1-CG1 3.87Å; V56-I100 HydrophobicContact CG1-CG2 4.28Å; V56-I100 HydrophobicContact CG2-CD1 4.18Å; I57-I100 HydrophobicContact CG1-CG2 4.32Å; T96-I100 WeakPolarHBondContact O-CB 3.37Å; T96-I100 VanDerWaalsContact O-CG2 3.3Å; T96-I100 WeakPolarHBondContact O-CG2 3.49Å; T96-I100 PolarHBondContact O-N 2.7Å; E97-I100 WeakPolarHBondContact O-CG2 3.3Å; I100-G103 PolarHBondContact O-N 3.15Å; I100-T104 WeakPolarHBondContact O-CB 3.33Å; I100-T104 PolarHBondContact O-N 2.85Å; I100-T104 PolarHBondContact O-OG1 3.28Å
101A94.6Very high94.8Very high0 Ų054 Ų540%031%0.309CS..Hα-helixtrans-66.7-45.7177.800000111.5E97 L98 I105 L192 C195 F196E97-A101 WeakPolarHBondContact O-CB 3.4Å; E97-A101 PolarHBondContact O-N 2.92Å; L98-A101 PolarHBondContact O-N 2.84Å; A101-I105 WeakPolarHBondContact O-CG1 3.21Å; A101-I105 PolarHBondContact O-N 3.44Å; A101-L192 HydrophobicContact CB-CD2 4.07Å; A101-C195 HydrophobicContact CB-CB 4.22Å; A101-F196 HydrophobicContact CB-CD2 4.14Å; A101-F196 HydrophobicContact CB-CE1 4.05Å; A101-F196 HydrophobicContact CB-CE2 3.61Å; A101-F196 HydrophobicContact CB-CZ 3.56Å
102I94.5Very high94.7Very high72 Ų7255.4 Ų55.437%0.36931%0.308SS..Hα-helixtrans-64.7-46.9174-65.8170.4000110.5L98 T104 I105 M106 F196L98-I102 HydrophobicContact CD1-CD1 3.83Å; L98-I102 HydrophobicContact CD1-CG1 4.33Å; L98-I102 HydrophobicContact CG-CD1 3.87Å; L98-I102 WeakPolarHBondContact O-CB 3.41Å; L98-I102 VanDerWaalsContact O-CG1 3.27Å; L98-I102 WeakPolarHBondContact O-CG1 3.44Å; L98-I102 PolarHBondContact O-N 2.79Å; I102-T104 VanDerWaalsContact C-N 3.29Å; I102-T104 PolarHBondContact O-N 3.19Å; I102-I105 PolarHBondContact O-N 2.79Å; I102-I105 VanDerWaalsContact O-N 3.17Å; I102-M106 HydrophobicContact CG2-CG 4.08Å; I102-M106 HydrophobicContact CG2-SD 3.53Å; I102-M106 VanDerWaalsContact CG2-SD 3.53Å; I102-M106 WeakPolarHBondContact O-CG 3.35Å; I102-M106 PolarHBondContact O-N 3.47Å; I102-F196 HydrophobicContact CG1-CE1 3.99Å; I102-F196 HydrophobicContact CG1-CZ 4.15Å
103G94.4Very high94.6Very high28 Ų2855.8 Ų55.829%0.28931%0.314SS..Hα-helixtrans-59.1-38.6-178.500000113.1C99 I100 M106 T107C99-G103 PolarHBondContact O-N 3.03Å; I100-G103 PolarHBondContact O-N 3.15Å; G103-M106 PolarHBondContact O-N 2.95Å; G103-T107 VanDerWaalsContact O-CB 3.28Å; G103-T107 WeakPolarHBondContact O-CB 3.35Å; G103-T107 PolarHBondContact O-N 3.33Å; G103-T107 PolarHBondContact O-OG1 3.47Å
104T93.4Very high94.6Very high27 Ų2760.2 Ų60.217%0.16633%0.334CS..Hα-helixtrans-70.2-35.2178.7-59.60000112.3I53 I100 I102 I188 L192I53-T104 HydrophobicContact CD1-CG2 3.97Å; I53-T104 WeakPolarHBondContact CD1-OG1 3.33Å; I100-T104 WeakPolarHBondContact O-CB 3.33Å; I100-T104 PolarHBondContact O-N 2.85Å; I100-T104 PolarHBondContact O-OG1 3.28Å; I102-T104 VanDerWaalsContact C-N 3.29Å; I102-T104 PolarHBondContact O-N 3.19Å; T104-I188 HydrophobicContact CG2-CG2 4.43Å; T104-L192 HydrophobicContact CG2-CD1 4Å; T104-L192 HydrophobicContact CG2-CD2 4.21Å
105I92.3Very high94.5Very high111 Ų11159.9 Ų59.957%0.56933%0.332SS*.Hα-helixtrans-72.3-38.8175.4-68.3174.9000111.3A101 I102 F196A101-I105 WeakPolarHBondContact O-CG1 3.21Å; A101-I105 PolarHBondContact O-N 3.44Å; I102-I105 PolarHBondContact O-N 2.79Å; I102-I105 VanDerWaalsContact O-N 3.17Å; I105-F196 HydrophobicContact CD1-CE2 3.52Å; I105-F196 HydrophobicContact CD1-CZ 3.79Å
106M93.2Very high94.5Very high148 Ų14857 Ų5773%0.72931%0.313SS*.Hα-helixtrans-80.2-23.6-175.2-68.8-172.871.900113.7I102 G103I102-M106 HydrophobicContact CG2-CG 4.08Å; I102-M106 HydrophobicContact CG2-SD 3.53Å; I102-M106 VanDerWaalsContact CG2-SD 3.53Å; I102-M106 WeakPolarHBondContact O-CG 3.35Å; I102-M106 PolarHBondContact O-N 3.47Å; G103-M106 PolarHBondContact O-N 2.95Å
107T89.9Confident94.5Very high65 Ų6558.7 Ų58.740%0.39933%0.326SS..SBendtrans-88.9134.3-177.9-51.90000109.7G103 E110G103-T107 VanDerWaalsContact O-CB 3.28Å; G103-T107 WeakPolarHBondContact O-CB 3.35Å; G103-T107 PolarHBondContact O-N 3.33Å; G103-T107 PolarHBondContact O-OG1 3.47Å; T107-E110 HydrophobicContact CG2-CG 3.98Å
108P90Very high94.6Very high109 Ų10958.9 Ų58.971%0.70833%0.328SS*.  trans-51.8157.8169.6-24.733.9000111.3E110P108-E110 PolarHBondContact O-N 3.07Å
109N91.1Very high94.7Very high48 Ų4855.4 Ų55.426%0.25731%0.31SS..  trans-6980.5-177.9-167.2-9.3000111.9F111 Y112 T113 N181 Y185N109-F111 PolarHBondContact O-N 3.16Å; N109-F111 PolarHBondContact OD1-N 3.44Å; N109-Y112 PolarHBondContact O-N 3.35Å; N109-Y112 PolarHBondContact OD1-N 3.33Å; N109-Y112 VanDerWaalsContact OD1-N 3.14Å; N109-T113 PolarHBondContact O-N 3.48Å; N109-T113 PolarHBondContact O-OG1 2.84Å; N109-N181 PolarHBondContact ND2-ND2 3.34Å; N109-N181 PolarHBondContact ND2-OD1 3.2Å; N109-Y185 WeakPolarHBondContact ND2-CE2 3.41Å; N109-Y185 PolarHBondContact OD1-OH 3.23Å; N109-Y185 VanDerWaalsContact OD1-OH 3.09Å
110E91.2Very high94.7Very high85 Ų8555 Ų5540%0.39730%0.3SS..Hα-helixtrans-63-34.2-179.6-71.2-167.2-179.700111.2T107 P108 T113 K114T107-E110 HydrophobicContact CG2-CG 3.98Å; P108-E110 PolarHBondContact O-N 3.07Å; E110-T113 PolarHBondContact O-N 3.17Å; E110-K114 HydrophobicContact CB-CD 4.48Å; E110-K114 VanDerWaalsContact O-CB 3.3Å; E110-K114 WeakPolarHBondContact O-CB 3.34Å; E110-K114 VanDerWaalsContact O-CG 3.27Å; E110-K114 WeakPolarHBondContact O-CG 3.43Å; E110-K114 PolarHBondContact O-N 3.29Å; E110-K114 IonicContact OE2-NZ 2.72Å; E110-K114 PolarHBondContact OE2-NZ 3.48Å
111F94.4Very high94.7Very high7 Ų757.2 Ų57.23%0.03131%0.312CS..Hα-helixtrans-60-49.1177.2175.2-107.4000110.6L39 I49 P51 N109 T113 K114 A115 V184L39-F111 HydrophobicContact CD1-CE2 4.32Å; L39-F111 HydrophobicContact CD1-CZ 4.46Å; L39-F111 HydrophobicContact CD2-CE2 4.25Å; L39-F111 HydrophobicContact CD2-CZ 3.82Å; I49-F111 HydrophobicContact CG2-CD2 3.97Å; I49-F111 HydrophobicContact CG2-CE2 4.22Å; P51-F111 HydrophobicContact CB-CB 4.33Å; P51-F111 HydrophobicContact CB-CG 4.47Å; P51-F111 HydrophobicContact CG-CB 4.17Å; P51-F111 HydrophobicContact CG-CD1 4.29Å; P51-F111 HydrophobicContact CG-CD2 3.77Å; P51-F111 HydrophobicContact CG-CE2 4.25Å; P51-F111 HydrophobicContact CG-CG 3.79Å; N109-F111 PolarHBondContact O-N 3.16Å; N109-F111 PolarHBondContact OD1-N 3.44Å; F111-T113 VanDerWaalsContact C-N 3.31Å; F111-T113 PolarHBondContact O-N 2.83Å; F111-K114 PolarHBondContact O-N 3.42Å; F111-A115 HydrophobicContact CE2-CB 4.35Å; F111-A115 HydrophobicContact CZ-CB 4.31Å; F111-A115 WeakPolarHBondContact O-CB 3.38Å; F111-A115 PolarHBondContact O-N 3.32Å; F111-V184 HydrophobicContact CD1-CG1 4.46Å; F111-V184 HydrophobicContact CE1-CB 4.16Å; F111-V184 HydrophobicContact CE1-CG1 4.37Å; F111-V184 HydrophobicContact CE1-CG2 3.85Å; F111-V184 HydrophobicContact CZ-CG2 3.99Å
112Y97Very high94.8Very high70 Ų7057.2 Ų57.228%0.27531%0.312SS..Hα-helixtrans-55.1-48.2175.9-178-84.2000111.8N109 N116 T177 E178 N181N109-Y112 PolarHBondContact O-N 3.35Å; N109-Y112 PolarHBondContact OD1-N 3.33Å; N109-Y112 VanDerWaalsContact OD1-N 3.14Å; Y112-N116 WeakPolarHBondContact O-CB 3.45Å; Y112-N116 PolarHBondContact O-N 3.43Å; Y112-T177 HydrophobicContact CD1-CG2 4.15Å; Y112-T177 HydrophobicContact CD2-CG2 3.63Å; Y112-T177 HydrophobicContact CE1-CG2 4.11Å; Y112-T177 HydrophobicContact CE2-CG2 3.61Å; Y112-T177 HydrophobicContact CG-CG2 3.9Å; Y112-T177 VanDerWaalsContact O-CG2 3.24Å; Y112-T177 WeakPolarHBondContact O-CG2 3.45Å; Y112-E178 HydrophobicContact CE2-CB 4.35Å; Y112-E178 VanDerWaalsContact CE2-OE2 3.29Å; Y112-E178 WeakPolarHBondContact CE2-OE2 3.19Å; Y112-N181 HydrophobicContact CD2-CB 3.88Å
113T96.4Very high94.9Very high85 Ų8553.9 Ų53.952%0.52130%0.295SS..Hα-helixtrans-65.7-48.1-176.3-53.20000111.5N109 E110 F111 N116 S117N109-T113 PolarHBondContact O-N 3.48Å; N109-T113 PolarHBondContact O-OG1 2.84Å; E110-T113 PolarHBondContact O-N 3.17Å; F111-T113 VanDerWaalsContact C-N 3.31Å; F111-T113 PolarHBondContact O-N 2.83Å; T113-N116 PolarHBondContact O-N 3.48Å; T113-S117 PolarHBondContact O-N 3.15Å; T113-S117 VanDerWaalsContact O-N 3.08Å; T113-S117 PolarHBondContact O-OG 3.29Å
114K96.2Very high94.9Very high94 Ų9457.3 Ų57.341%0.40930%0.303SS..Hα-helixtrans-66.7-43.9-179.9-69.3173.3177.3163.50111.2I49 E110 F111 N116 S117 S118I49-K114 HydrophobicContact CD1-CB 3.8Å; I49-K114 WeakPolarHBondContact CD1-O 3.48Å; I49-K114 HydrophobicContact CG1-CB 4.35Å; I49-K114 HydrophobicContact CG2-CB 3.84Å; E110-K114 HydrophobicContact CB-CD 4.48Å; E110-K114 VanDerWaalsContact O-CB 3.3Å; E110-K114 WeakPolarHBondContact O-CB 3.34Å; E110-K114 VanDerWaalsContact O-CG 3.27Å; E110-K114 WeakPolarHBondContact O-CG 3.43Å; E110-K114 PolarHBondContact O-N 3.29Å; E110-K114 IonicContact OE2-NZ 2.72Å; E110-K114 PolarHBondContact OE2-NZ 3.48Å; F111-K114 PolarHBondContact O-N 3.42Å; K114-N116 VanDerWaalsContact C-N 3.33Å; K114-N116 PolarHBondContact O-N 2.92Å; K114-S117 PolarHBondContact O-N 2.97Å; K114-S118 PolarHBondContact O-N 3.32Å; K114-S118 PolarHBondContact O-OG 3.07Å
115A97.4Very high95Very high0 Ų060.9 Ų60.90%031%0.314CS..Hα-helixtrans-59.7-44176.300000111.3L46 F111 S117 S118 L119 T177L46-A115 HydrophobicContact CD2-CB 4.1Å; F111-A115 HydrophobicContact CE2-CB 4.35Å; F111-A115 HydrophobicContact CZ-CB 4.31Å; F111-A115 WeakPolarHBondContact O-CB 3.38Å; F111-A115 PolarHBondContact O-N 3.32Å; A115-S117 PolarHBondContact O-N 3.29Å; A115-S118 PolarHBondContact O-N 2.92Å; A115-L119 WeakPolarHBondContact O-CB 3.32Å; A115-L119 VanDerWaalsContact O-CG 3.27Å; A115-L119 WeakPolarHBondContact O-CG 3.32Å; A115-L119 PolarHBondContact O-N 3.41Å; A115-T177 HydrophobicContact CB-CG2 4.45Å
116N97.6Very high95.1Very high27 Ų2756.2 Ų56.214%0.14429%0.29CS..Hα-helixtrans-59.8-48.6175.8-17935.5000112.1Y112 T113 K114 S118 L119 Q120 S148 L149 T177Y112-N116 WeakPolarHBondContact O-CB 3.45Å; Y112-N116 PolarHBondContact O-N 3.43Å; T113-N116 PolarHBondContact O-N 3.48Å; K114-N116 VanDerWaalsContact C-N 3.33Å; K114-N116 PolarHBondContact O-N 2.92Å; N116-S118 VanDerWaalsContact C-N 3.33Å; N116-S118 PolarHBondContact O-N 3.06Å; N116-L119 PolarHBondContact O-N 3.42Å; N116-Q120 WeakPolarHBondContact O-CB 3.31Å; N116-Q120 WeakPolarHBondContact O-CG 3.44Å; N116-Q120 PolarHBondContact O-N 3.17Å; N116-S148 PolarHBondContact O-OG 3.22Å; N116-S148 PolarHBondContact OD1-OG 3.4Å; N116-L149 WeakPolarHBondContact OD1-CD2 3.29Å; N116-L149 VanDerWaalsContact OD1-CG 3.24Å; N116-L149 WeakPolarHBondContact OD1-CG 3.1Å; N116-T177 WeakPolarHBondContact CA-OG1 3.41Å; N116-T177 HydrophobicContact CB-CG2 3.68Å
117S97Very high95.1Very high73 Ų7354 Ų5451%0.5128%0.277SS..Hα-helixtrans-59.8-43.5179.3-65.50000112T113 K114 A115 N121T113-S117 PolarHBondContact O-N 3.15Å; T113-S117 VanDerWaalsContact O-N 3.08Å; T113-S117 PolarHBondContact O-OG 3.29Å; K114-S117 PolarHBondContact O-N 2.97Å; A115-S117 PolarHBondContact O-N 3.29Å; S117-N121 WeakPolarHBondContact O-CB 3.15Å; S117-N121 PolarHBondContact O-N 3.38Å
118S97.6Very high95.3Very high6 Ų657.5 Ų57.54%0.04229%0.289CS..Hα-helixtrans-72.1-39.5179.6-65.60000112.9I45 Q47 I49 K114 A115 N116 N121 S122I45-S118 CarbonylContact O-C 3.5Å; Q47-S118 PolarHBondContact OE1-OG 3.5Å; I49-S118 WeakPolarHBondContact CD1-OG 3.27Å; K114-S118 PolarHBondContact O-N 3.32Å; K114-S118 PolarHBondContact O-OG 3.07Å; A115-S118 PolarHBondContact O-N 2.92Å; N116-S118 VanDerWaalsContact C-N 3.33Å; N116-S118 PolarHBondContact O-N 3.06Å; S118-N121 PolarHBondContact O-N 3.06Å; S118-S122 WeakPolarHBondContact O-CB 3.27Å; S118-S122 PolarHBondContact O-N 3.45Å; S118-S122 PolarHBondContact O-OG 3.06Å
119L97.9Very high95.6Very high0 Ų056.1 Ų56.10%027%0.273CS..Hα-helixtrans-62.8-46.1173.1-72.2178.2000111.1I45 L46 A115 N116 N121 S122 L123 F136 L139 S148 C176 L180I45-L119 HydrophobicContact CB-CD2 4.26Å; I45-L119 HydrophobicContact CD1-CD2 3.78Å; I45-L119 HydrophobicContact CG1-CD2 3.99Å; L46-L119 HydrophobicContact CD2-CD1 4.34Å; L46-L119 HydrophobicContact CD2-CD2 3.83Å; L46-L119 HydrophobicContact CD2-CG 3.83Å; A115-L119 WeakPolarHBondContact O-CB 3.32Å; A115-L119 VanDerWaalsContact O-CG 3.27Å; A115-L119 WeakPolarHBondContact O-CG 3.32Å; A115-L119 PolarHBondContact O-N 3.41Å; N116-L119 PolarHBondContact O-N 3.42Å; L119-N121 VanDerWaalsContact C-N 3.33Å; L119-N121 PolarHBondContact O-N 3.4Å; L119-S122 PolarHBondContact O-N 3.24Å; L119-L123 VanDerWaalsContact O-CB 3.28Å; L119-L123 WeakPolarHBondContact O-CB 3.35Å; L119-L123 PolarHBondContact O-N 3.23Å; L119-F136 HydrophobicContact CB-CZ 4.3Å; L119-F136 HydrophobicContact CD2-CE1 3.91Å; L119-F136 HydrophobicContact CD2-CZ 3.87Å; L119-F136 WeakPolarHBondContact O-CZ 3.26Å; L119-L139 HydrophobicContact CD2-CD2 4.11Å; L119-S148 VanDerWaalsContact CB-OG 3.3Å; L119-S148 WeakPolarHBondContact CB-OG 3.34Å; L119-C176 HydrophobicContact CD1-CB 4.13Å; L119-L180 HydrophobicContact CD1-CD1 4.22Å
120Q97Very high95.8Very high72 Ų7258.8 Ų58.834%0.33629%0.293SS..Hα-helixtrans-59.9-43.2176-77.8-153.3-18.200112.3N116 L123 H124 S148N116-Q120 WeakPolarHBondContact O-CB 3.31Å; N116-Q120 WeakPolarHBondContact O-CG 3.44Å; N116-Q120 PolarHBondContact O-N 3.17Å; Q120-L123 PolarHBondContact O-N 3.01Å; Q120-H124 PolarHBondContact O-ND1 3.29Å; Q120-S148 VanDerWaalsContact CG-CB 3.43Å; Q120-S148 WeakPolarHBondContact CG-OG 3.39Å
121N95.8Very high96.1Very high75 Ų7558 Ų5840%0.40129%0.294SS..Hα-helixtrans-64.1-47.5178.2-17454.7000111.6Q47 S117 S118 L119 L123 H124 Y125Q47-N121 PolarHBondContact NE2-ND2 2.94Å; Q47-N121 VanDerWaalsContact NE2-ND2 3.16Å; S117-N121 WeakPolarHBondContact O-CB 3.15Å; S117-N121 PolarHBondContact O-N 3.38Å; S118-N121 PolarHBondContact O-N 3.06Å; L119-N121 VanDerWaalsContact C-N 3.33Å; L119-N121 PolarHBondContact O-N 3.4Å; N121-L123 VanDerWaalsContact C-N 3.27Å; N121-L123 PolarHBondContact O-N 3.22Å; N121-H124 WeakPolarHBondContact O-CB 3.41Å; N121-H124 PolarHBondContact O-N 2.75Å; N121-Y125 WeakPolarHBondContact O-CD2 3.39Å
122S96.7Very high96.3Very high0 Ų059.5 Ų59.50%030%0.3CS..Hα-helixtrans-64.9-31.6179.3-58.90000112.4I45 S118 L119 H124 Y125 Y126 Y132I45-S122 WeakPolarHBondContact CA-OG 3.42Å; I45-S122 PolarHBondContact O-OG 2.95Å; S118-S122 WeakPolarHBondContact O-CB 3.27Å; S118-S122 PolarHBondContact O-N 3.45Å; S118-S122 PolarHBondContact O-OG 3.06Å; L119-S122 PolarHBondContact O-N 3.24Å; S122-H124 VanDerWaalsContact C-N 3.26Å; S122-H124 PolarHBondContact O-N 3.37Å; S122-Y125 CarbonylContact O-C 3.48Å; S122-Y125 PolarHBondContact O-N 2.67Å; S122-Y125 VanDerWaalsContact O-N 3.09Å; S122-Y126 PolarHBondContact O-N 3.09Å; S122-Y132 WeakPolarHBondContact O-CD2 3.19Å
123L96.2Very high96.3Very high1 Ų157.9 Ų57.91%0.00530%0.297CS..Hα-helixtrans-63-30.4177.7-167.367.8000112.7L119 Q120 N121 Y125 Y126 F136 D153 Y154 T157 N159L119-L123 VanDerWaalsContact O-CB 3.28Å; L119-L123 WeakPolarHBondContact O-CB 3.35Å; L119-L123 PolarHBondContact O-N 3.23Å; Q120-L123 PolarHBondContact O-N 3.01Å; N121-L123 VanDerWaalsContact C-N 3.27Å; N121-L123 PolarHBondContact O-N 3.22Å; L123-Y125 PolarHBondContact O-N 3.14Å; L123-Y126 HydrophobicContact CD1-CG 4.45Å; L123-Y126 WeakPolarHBondContact O-CB 3.43Å; L123-Y126 PolarHBondContact O-N 3.09Å; L123-Y126 VanDerWaalsContact O-N 3.13Å; L123-F136 HydrophobicContact CB-CE2 4.34Å; L123-F136 HydrophobicContact CB-CZ 4.02Å; L123-F136 HydrophobicContact CD1-CD1 4.43Å; L123-F136 HydrophobicContact CD1-CE1 4.09Å; L123-F136 HydrophobicContact CD1-CE2 4.24Å; L123-F136 HydrophobicContact CD1-CZ 3.99Å; L123-D153 HydrophobicContact CD2-CB 3.49Å; L123-D153 VanDerWaalsContact CD2-CB 3.49Å; L123-Y154 HydrophobicContact CD1-CD1 3.96Å; L123-Y154 HydrophobicContact CD1-CE1 3.45Å; L123-Y154 VanDerWaalsContact CD1-CE1 3.45Å; L123-Y154 HydrophobicContact CD1-CE2 4.1Å; L123-Y154 HydrophobicContact CD1-CG 4.46Å; L123-T157 HydrophobicContact CD2-CG2 4.31Å; L123-T157 HydrophobicContact CG-CG2 4.3Å; L123-N159 PolarHBondContact O-ND2 3.5Å
124H95.2Very high96.3Very high101 Ų10160.3 Ų60.347%0.46830%0.302SS..THydrogen-bonded Turntrans-60.5-27.9175.4-74.269.4000112.6Q120 N121 S122Q120-H124 PolarHBondContact O-ND1 3.29Å; N121-H124 WeakPolarHBondContact O-CB 3.41Å; N121-H124 PolarHBondContact O-N 2.75Å; S122-H124 VanDerWaalsContact C-N 3.26Å; S122-H124 PolarHBondContact O-N 3.37Å
125Y94.7Very high96.4Very high102 Ų10257 Ų5740%0.429%0.289SS..THydrogen-bonded Turntrans-106.711.9-178-59.2-75.9000112.4N121 S122 L123 E127 Q128 H129N121-Y125 WeakPolarHBondContact O-CD2 3.39Å; S122-Y125 CarbonylContact O-C 3.48Å; S122-Y125 PolarHBondContact O-N 2.67Å; S122-Y125 VanDerWaalsContact O-N 3.09Å; L123-Y125 PolarHBondContact O-N 3.14Å; Y125-E127 PolarHBondContact O-N 3.28Å; Y125-Q128 PolarHBondContact O-N 2.72Å; Y125-H129 PolarHBondContact O-N 3.14Å
126Y95.3Very high96.5Very high13 Ų1357 Ų575%0.05129%0.289CS..THydrogen-bonded Turntrans-51.1-56.4-174.1170.3-98000112S122 L123 Q128 T133 F136 N137 Y154 N159 P162S122-Y126 PolarHBondContact O-N 3.09Å; L123-Y126 HydrophobicContact CD1-CG 4.45Å; L123-Y126 WeakPolarHBondContact O-CB 3.43Å; L123-Y126 PolarHBondContact O-N 3.09Å; L123-Y126 VanDerWaalsContact O-N 3.13Å; Y126-Q128 VanDerWaalsContact C-N 3.28Å; Y126-Q128 PolarHBondContact O-N 3.36Å; Y126-T133 HydrophobicContact CE2-CG2 4.22Å; Y126-T133 PolarHBondContact O-OG1 3.28Å; Y126-F136 HydrophobicContact CD2-CB 3.79Å; Y126-F136 AromaticContact CD2-CD2 3.86Å; Y126-F136 HydrophobicContact CD2-CD2 3.86Å; Y126-F136 HydrophobicContact CD2-CG 4.02Å; Y126-F136 HydrophobicContact CE2-CB 3.64Å; Y126-F136 HydrophobicContact CE2-CG 4.35Å; Y126-N137 PolarHBondContact OH-OD1 3.06Å; Y126-Y154 HydrophobicContact CD1-CD1 4.34Å; Y126-Y154 AromaticContact CD1-CE1 3.73Å; Y126-Y154 HydrophobicContact CD1-CE1 3.73Å; Y126-Y154 HydrophobicContact CD2-CE1 4.09Å; Y126-Y154 AromaticContact CE1-CE1 3.86Å; Y126-Y154 HydrophobicContact CE1-CE1 3.86Å; Y126-Y154 HydrophobicContact CE2-CE1 4.17Å; Y126-Y154 AromaticContact CG-CE1 3.9Å; Y126-Y154 HydrophobicContact CG-CE1 3.9Å; Y126-N159 HydrophobicContact CD1-CB 4.38Å; Y126-P162 HydrophobicContact CE1-CB 4.5Å; Y126-P162 VanDerWaalsContact OH-CB 3.28Å; Y126-P162 WeakPolarHBondContact OH-CB 3.34Å
127E93.2Very high96.5Very high100 Ų10057.6 Ų57.647%0.46729%0.292SS..THydrogen-bonded Turntrans-74.6-17-179.2-64.7-175.2171.300113.3Y125 N159 S160Y125-E127 PolarHBondContact O-N 3.28Å; E127-N159 HydrophobicContact CG-CB 4.3Å; E127-N159 WeakPolarHBondContact CG-OD1 3.27Å; E127-S160 PolarHBondContact OE1-N 3.42Å; E127-S160 PolarHBondContact OE1-OG 3.32Å
128Q93.8Very high96.5Very high139 Ų13957.3 Ų57.365%0.6528%0.282SS*.THydrogen-bonded Turntrans-89.7-25.5-175.8-62.2177.210.200112.7Y125 Y126Y125-Q128 PolarHBondContact O-N 2.72Å; Y126-Q128 VanDerWaalsContact C-N 3.28Å; Y126-Q128 PolarHBondContact O-N 3.36Å
129H95.5Very high96.5Very high81 Ų8157 Ų5738%0.37528%0.28SS..  trans-117.8105.3-175.8-72.261.4000109.3Y125 V131 Y132 T133Y125-H129 PolarHBondContact O-N 3.14Å; H129-V131 PolarHBondContact O-N 3.03Å; H129-V131 VanDerWaalsContact O-N 3.13Å; H129-Y132 HydrophobicContact CB-CD1 4.36Å; H129-Y132 HydrophobicContact CB-CD2 3.76Å; H129-Y132 HydrophobicContact CB-CE2 4.34Å; H129-Y132 HydrophobicContact CB-CG 3.76Å; H129-Y132 WeakPolarHBondContact O-CA 3.29Å; H129-Y132 WeakPolarHBondContact O-CB 3.49Å; H129-Y132 PolarHBondContact O-N 2.93Å; H129-T133 PolarHBondContact O-N 3.37Å
130P96.4Very high96.6Very high103 Ų10357 Ų5767%0.66928%0.28SS*.Hα-helixtrans-53.8-37.2-178-2935.2000113.7Y132 T133 E134P130-Y132 VanDerWaalsContact C-N 3.35Å; P130-Y132 PolarHBondContact O-N 3.29Å; P130-T133 WeakPolarHBondContact O-CB 3.36Å; P130-T133 PolarHBondContact O-N 3.01Å; P130-E134 WeakPolarHBondContact O-CB 3.17Å; P130-E134 PolarHBondContact O-N 2.87Å
131V97.4Very high96.5Very high69 Ų6958.3 Ų58.342%0.41829%0.286SS..Hα-helixtrans-65.7-36.8177.2-178.50000111.7E44 H129 Q135E44-V131 HydrophobicContact CB-CG1 4.07Å; E44-V131 HydrophobicContact CG-CG1 3.92Å; H129-V131 PolarHBondContact O-N 3.03Å; H129-V131 VanDerWaalsContact O-N 3.13Å; V131-Q135 WeakPolarHBondContact O-CB 3.5Å; V131-Q135 WeakPolarHBondContact O-CG 3.33Å; V131-Q135 PolarHBondContact O-N 3.44Å
132Y97.2Very high96.5Very high38 Ų3858.8 Ų58.815%0.14929%0.289CS..Hα-helixtrans-69.2-42.3174.7-68.7-0.7000110.7E44 I45 S122 H129 P130 E134 Q135 F136E44-Y132 HydrophobicContact CB-CD1 4.22Å; E44-Y132 HydrophobicContact CB-CE1 3.93Å; I45-Y132 HydrophobicContact CG2-CD1 3.82Å; I45-Y132 HydrophobicContact CG2-CG 4.02Å; S122-Y132 WeakPolarHBondContact O-CD2 3.19Å; H129-Y132 HydrophobicContact CB-CD1 4.36Å; H129-Y132 HydrophobicContact CB-CD2 3.76Å; H129-Y132 HydrophobicContact CB-CE2 4.34Å; H129-Y132 HydrophobicContact CB-CG 3.76Å; H129-Y132 WeakPolarHBondContact O-CA 3.29Å; H129-Y132 WeakPolarHBondContact O-CB 3.49Å; H129-Y132 PolarHBondContact O-N 2.93Å; P130-Y132 VanDerWaalsContact C-N 3.35Å; P130-Y132 PolarHBondContact O-N 3.29Å; Y132-E134 VanDerWaalsContact C-N 3.33Å; Y132-E134 PolarHBondContact O-N 2.89Å; Y132-Q135 PolarHBondContact O-N 2.72Å; Y132-F136 WeakPolarHBondContact O-CB 3.22Å; Y132-F136 WeakPolarHBondContact O-CD2 3.38Å; Y132-F136 PolarHBondContact O-N 2.85Å
133T97.4Very high96.5Very high36 Ų3661.1 Ų61.122%0.22130%0.298CS..Hα-helixtrans-55.1-50.3173.5-71.50000111Y126 H129 P130 N137Y126-T133 HydrophobicContact CE2-CG2 4.22Å; Y126-T133 PolarHBondContact O-OG1 3.28Å; H129-T133 PolarHBondContact O-N 3.37Å; P130-T133 WeakPolarHBondContact O-CB 3.36Å; P130-T133 PolarHBondContact O-N 3.01Å; T133-N137 WeakPolarHBondContact CG2-ND2 3.09Å; T133-N137 WeakPolarHBondContact O-CB 3.24Å; T133-N137 PolarHBondContact O-N 3.29Å; T133-N137 PolarHBondContact O-ND2 3.12Å
134E97.8Very high96.5Very high136 Ų13666.1 Ų66.164%0.63632%0.32SS*.Hα-helixtrans-59.7-52.2179.6-176.2-178.3178.400112.1P130 Y132 F136 N137 H138P130-E134 WeakPolarHBondContact O-CB 3.17Å; P130-E134 PolarHBondContact O-N 2.87Å; Y132-E134 VanDerWaalsContact C-N 3.33Å; Y132-E134 PolarHBondContact O-N 2.89Å; E134-F136 PolarHBondContact O-N 3.42Å; E134-N137 PolarHBondContact O-N 3.32Å; E134-H138 WeakPolarHBondContact O-CB 3.43Å; E134-H138 PolarHBondContact O-N 2.88Å
135Q98.1Very high96.7Very high25 Ų2561.3 Ų61.312%0.11730%0.297CS..Hα-helixtrans-66.8-38.3-177.9-72-1745.400112.7F42 I45 V131 Y132 L139F42-Q135 HydrophobicContact CD1-CB 4.49Å; F42-Q135 PolarHBondContact O-OE1 3.45Å; I45-Q135 HydrophobicContact CD1-CB 3.89Å; I45-Q135 HydrophobicContact CG1-CB 4.08Å; I45-Q135 HydrophobicContact CG2-CB 3.87Å; I45-Q135 VanDerWaalsContact N-OE1 3.08Å; V131-Q135 WeakPolarHBondContact O-CB 3.5Å; V131-Q135 WeakPolarHBondContact O-CG 3.33Å; V131-Q135 PolarHBondContact O-N 3.44Å; Y132-Q135 PolarHBondContact O-N 2.72Å; Q135-L139 WeakPolarHBondContact O-CB 3.5Å; Q135-L139 PolarHBondContact O-N 3.3Å
136F98.1Very high96.8Very high0 Ų056.5 Ų56.50%028%0.278CS..Hα-helixtrans-64.6-43.9173.4-94.7-73.1000111.4I45 L119 L123 Y126 Y132 E134 L139 Q140I45-F136 HydrophobicContact CB-CD2 4.35Å; I45-F136 HydrophobicContact CB-CE2 4.05Å; I45-F136 HydrophobicContact CD1-CD1 4.4Å; I45-F136 HydrophobicContact CD1-CD2 4.29Å; I45-F136 HydrophobicContact CD1-CE2 4.46Å; I45-F136 HydrophobicContact CD1-CG 4.25Å; I45-F136 HydrophobicContact CG2-CD2 3.73Å; I45-F136 HydrophobicContact CG2-CE2 3.79Å; L119-F136 HydrophobicContact CB-CZ 4.3Å; L119-F136 HydrophobicContact CD2-CE1 3.91Å; L119-F136 HydrophobicContact CD2-CZ 3.87Å; L119-F136 WeakPolarHBondContact O-CZ 3.26Å; L123-F136 HydrophobicContact CB-CE2 4.34Å; L123-F136 HydrophobicContact CB-CZ 4.02Å; L123-F136 HydrophobicContact CD1-CD1 4.43Å; L123-F136 HydrophobicContact CD1-CE1 4.09Å; L123-F136 HydrophobicContact CD1-CE2 4.24Å; L123-F136 HydrophobicContact CD1-CZ 3.99Å; Y126-F136 HydrophobicContact CD2-CB 3.79Å; Y126-F136 AromaticContact CD2-CD2 3.86Å; Y126-F136 HydrophobicContact CD2-CD2 3.86Å; Y126-F136 HydrophobicContact CD2-CG 4.02Å; Y126-F136 HydrophobicContact CE2-CB 3.64Å; Y126-F136 HydrophobicContact CE2-CG 4.35Å; Y132-F136 WeakPolarHBondContact O-CB 3.22Å; Y132-F136 WeakPolarHBondContact O-CD2 3.38Å; Y132-F136 PolarHBondContact O-N 2.85Å; E134-F136 PolarHBondContact O-N 3.42Å; F136-L139 PolarHBondContact O-N 2.9Å; F136-Q140 WeakPolarHBondContact O-CB 3.41Å; F136-Q140 WeakPolarHBondContact O-CG 3.27Å; F136-Q140 PolarHBondContact O-N 2.82Å
137N97.9Very high96.9Very high39 Ų3955.9 Ų55.921%0.20928%0.276CS..Hα-helixtrans-61.5-47.3178.6-72.7-23.5000111.4Y126 T133 E134 L139 Q140 E141 S164Y126-N137 PolarHBondContact OH-OD1 3.06Å; T133-N137 WeakPolarHBondContact CG2-ND2 3.09Å; T133-N137 WeakPolarHBondContact O-CB 3.24Å; T133-N137 PolarHBondContact O-N 3.29Å; T133-N137 PolarHBondContact O-ND2 3.12Å; E134-N137 PolarHBondContact O-N 3.32Å; N137-L139 VanDerWaalsContact C-N 3.33Å; N137-L139 PolarHBondContact O-N 2.96Å; N137-Q140 PolarHBondContact O-N 3.43Å; N137-E141 WeakPolarHBondContact O-CB 3.3Å; N137-E141 WeakPolarHBondContact O-CG 3.37Å; N137-E141 PolarHBondContact O-N 3.38Å; N137-S164 WeakPolarHBondContact OD1-CB 3.27Å; N137-S164 PolarHBondContact OD1-OG 3.41Å
138H97.9Very high97Very high68 Ų6851.1 Ų51.132%0.31525%0.254SS..Hα-helixtrans-60.1-42.9175.9-171.662.6000111.9Q41 F42 E134 N142Q41-H138 PolarHBondContact OE1-NE2 3.47Å; F42-H138 HydrophobicContact CE1-CB 4.32Å; F42-H138 AromaticContact CE1-CD2 3.5Å; F42-H138 AromaticContact CZ-CD2 3.81Å; E134-H138 WeakPolarHBondContact O-CB 3.43Å; E134-H138 PolarHBondContact O-N 2.88Å; H138-N142 PolarHBondContact CD2-ND2 3.37Å; H138-N142 PolarHBondContact CE1-ND2 3.28Å; H138-N142 PolarHBondContact ND1-ND2 3.49Å; H138-N142 PolarHBondContact NE2-ND2 3.01Å; H138-N142 VanDerWaalsContact NE2-ND2 3.11Å; H138-N142 VanDerWaalsContact O-CB 3.27Å; H138-N142 WeakPolarHBondContact O-CB 3.29Å; H138-N142 PolarHBondContact O-N 3Å; H138-N142 VanDerWaalsContact O-N 3.09Å; H138-N142 PolarHBondContact O-ND2 3.37Å
139L97.9Very high97.2Very high0 Ų047.1 Ų47.10%024%0.236CC..Hα-helixtrans-62.4-46.9178.3-176.567.4000111.6F42 I45 L119 Q135 F136 N137 Y143 C176 L180F42-L139 HydrophobicContact CD1-CB 3.8Å; F42-L139 HydrophobicContact CD1-CD1 3.94Å; F42-L139 HydrophobicContact CD1-CG 4.37Å; F42-L139 HydrophobicContact CD2-CD1 3.9Å; F42-L139 HydrophobicContact CE1-CB 3.58Å; F42-L139 HydrophobicContact CE1-CD1 3.78Å; F42-L139 HydrophobicContact CE1-CG 4.29Å; F42-L139 HydrophobicContact CE2-CD1 3.75Å; F42-L139 HydrophobicContact CG-CD1 4Å; F42-L139 HydrophobicContact CZ-CB 4.26Å; F42-L139 HydrophobicContact CZ-CD1 3.7Å; I45-L139 HydrophobicContact CD1-CB 4.49Å; I45-L139 HydrophobicContact CD1-CD2 3.88Å; L119-L139 HydrophobicContact CD2-CD2 4.11Å; Q135-L139 WeakPolarHBondContact O-CB 3.5Å; Q135-L139 PolarHBondContact O-N 3.3Å; F136-L139 PolarHBondContact O-N 2.9Å; N137-L139 VanDerWaalsContact C-N 3.33Å; N137-L139 PolarHBondContact O-N 2.96Å; L139-Y143 HydrophobicContact CD1-CD2 3.51Å; L139-Y143 HydrophobicContact CD1-CE2 3.84Å; L139-Y143 HydrophobicContact CD1-CG 4.5Å; L139-Y143 HydrophobicContact CG-CD2 4.41Å; L139-Y143 WeakPolarHBondContact O-CB 3.48Å; L139-Y143 WeakPolarHBondContact O-CD2 3.43Å; L139-Y143 PolarHBondContact O-N 3.48Å; L139-C176 HydrophobicContact CD2-CB 3.62Å; L139-C176 HydrophobicContact CG-CB 4.16Å; L139-L180 HydrophobicContact CD1-CD1 3.91Å; L139-L180 HydrophobicContact CD1-CD2 3.56Å; L139-L180 HydrophobicContact CD1-CG 3.71Å; L139-L180 HydrophobicContact CD2-CD1 3.97Å; L139-L180 HydrophobicContact CD2-CG 4.49Å
140Q98.1Very high97.3Very high0 Ų047 Ų470%024%0.238CC..Hα-helixtrans-68.5-40.6-176.4-69.5178.4154.200112.1F136 N137 K144 C145 Y154 S164 C165 C176F136-Q140 WeakPolarHBondContact O-CB 3.41Å; F136-Q140 WeakPolarHBondContact O-CG 3.27Å; F136-Q140 PolarHBondContact O-N 2.82Å; N137-Q140 PolarHBondContact O-N 3.43Å; Q140-K144 VanDerWaalsContact O-CA 3.25Å; Q140-K144 WeakPolarHBondContact O-CA 3.34Å; Q140-K144 PolarHBondContact O-N 3.06Å; Q140-C145 WeakPolarHBondContact CA-O 3.41Å; Q140-C145 VanDerWaalsContact CB-O 3.23Å; Q140-C145 WeakPolarHBondContact CB-O 3.29Å; Q140-C145 VanDerWaalsContact CG-O 3.26Å; Q140-C145 WeakPolarHBondContact CG-O 3.31Å; Q140-C145 PolarHBondContact O-N 2.86Å; Q140-Y154 PolarHBondContact NE2-OH 3.42Å; Q140-Y154 PolarHBondContact OE1-OH 3.47Å; Q140-S164 WeakPolarHBondContact CB-O 3.44Å; Q140-S164 PolarHBondContact NE2-OG 3.49Å; Q140-C165 PolarHBondContact NE2-SG 3.02Å; Q140-C165 PolarHBondContact OE1-SG 3.21Å; Q140-C176 VanDerWaalsContact CG-SG 3.54Å
141E96.1Very high97.1Very high99 Ų9946.1 Ų46.146%0.46322%0.224SC..Hα-helixtrans-67.9-42.8178.1-75.6172.1-165.200112.5N137 K144N137-E141 WeakPolarHBondContact O-CB 3.3Å; N137-E141 WeakPolarHBondContact O-CG 3.37Å; N137-E141 PolarHBondContact O-N 3.38Å; E141-K144 WeakPolarHBondContact O-CD 2.95Å; E141-K144 VanDerWaalsContact O-CE 3.24Å; E141-K144 WeakPolarHBondContact O-CE 3.26Å; E141-K144 PolarHBondContact O-NZ 3.08Å
142N95.8Very high97Very high84 Ų8444 Ų4445%0.44921%0.211SC..Hα-helixtrans-74.2-40.5-177.1-70.9-28.9000112.9H138H138-N142 PolarHBondContact CD2-ND2 3.37Å; H138-N142 PolarHBondContact CE1-ND2 3.28Å; H138-N142 PolarHBondContact ND1-ND2 3.49Å; H138-N142 PolarHBondContact NE2-ND2 3.01Å; H138-N142 VanDerWaalsContact NE2-ND2 3.11Å; H138-N142 VanDerWaalsContact O-CB 3.27Å; H138-N142 WeakPolarHBondContact O-CB 3.29Å; H138-N142 PolarHBondContact O-N 3Å; H138-N142 VanDerWaalsContact O-N 3.09Å; H138-N142 PolarHBondContact O-ND2 3.37Å
143Y96.5Very high96.9Very high49 Ų4942.4 Ų42.419%0.19221%0.205CC..Hα-helixtrans-105.15.3-174.1-62-78.1000113.8F42 L139 C145 L180 H183F42-Y143 AromaticContact CE2-CE2 3.64Å; F42-Y143 HydrophobicContact CE2-CE2 3.64Å; F42-Y143 HydrophobicContact CZ-CD2 4.38Å; F42-Y143 AromaticContact CZ-CE2 3.66Å; F42-Y143 HydrophobicContact CZ-CE2 3.66Å; L139-Y143 HydrophobicContact CD1-CD2 3.51Å; L139-Y143 HydrophobicContact CD1-CE2 3.84Å; L139-Y143 HydrophobicContact CD1-CG 4.5Å; L139-Y143 HydrophobicContact CG-CD2 4.41Å; L139-Y143 WeakPolarHBondContact O-CB 3.48Å; L139-Y143 WeakPolarHBondContact O-CD2 3.43Å; L139-Y143 PolarHBondContact O-N 3.48Å; Y143-C145 VanDerWaalsContact C-N 3.29Å; Y143-C145 PolarHBondContact O-N 3.26Å; Y143-L180 HydrophobicContact CE2-CD2 4.44Å; Y143-H183 HydrophobicContact CD1-CB 4.19Å; Y143-H183 HydrophobicContact CE1-CB 3.79Å; Y143-H183 AromaticContact CE1-CD2 3.77Å; Y143-H183 AromaticContact CE1-CE1 3.96Å; Y143-H183 AromaticContact CE1-CG 3.44Å; Y143-H183 VanDerWaalsContact CE1-CG 3.44Å; Y143-H183 AromaticContact CE1-ND1 3.62Å; Y143-H183 AromaticContact CZ-CD2 3.99Å; Y143-H183 PolarHBondContact OH-NE2 2.9Å
144K96.7Very high96.7Very high107 Ų10740.8 Ų40.847%0.46520%0.195SC..THydrogen-bonded Turntrans52.949.6175.1-52.2-61.2177.5-163.70111.2Q140 E141 Y172Q140-K144 VanDerWaalsContact O-CA 3.25Å; Q140-K144 WeakPolarHBondContact O-CA 3.34Å; Q140-K144 PolarHBondContact O-N 3.06Å; E141-K144 WeakPolarHBondContact O-CD 2.95Å; E141-K144 VanDerWaalsContact O-CE 3.24Å; E141-K144 WeakPolarHBondContact O-CE 3.26Å; E141-K144 PolarHBondContact O-NZ 3.08Å; K144-Y172 HydrophobicContact CB-CD1 3.87Å; K144-Y172 HydrophobicContact CB-CE1 3.69Å; K144-Y172 HydrophobicContact CB-CG 4.39Å; K144-Y172 HydrophobicContact CD-CE1 3.62Å; K144-Y172 HydrophobicContact CD-CE2 4.23Å; K144-Y172 VanDerWaalsContact CD-CZ 3.41Å; K144-Y172 WeakPolarHBondContact CD-OH 3.27Å; K144-Y172 HydrophobicContact CG-CE1 4.2Å; K144-Y172 PolarHBondContact NZ-OH 3.5Å; K144-Y172 WeakPolarHBondContact O-CB 3.1Å
145C98Very high96.4Very high0 Ų043.3 Ų43.30%020%0.199CC..  trans-126.8166.1-176.466.40000110.8Q140 Y143 Y172 V174 C176 A179Q140-C145 WeakPolarHBondContact CA-O 3.41Å; Q140-C145 VanDerWaalsContact CB-O 3.23Å; Q140-C145 WeakPolarHBondContact CB-O 3.29Å; Q140-C145 VanDerWaalsContact CG-O 3.26Å; Q140-C145 WeakPolarHBondContact CG-O 3.31Å; Q140-C145 PolarHBondContact O-N 2.86Å; Y143-C145 VanDerWaalsContact C-N 3.29Å; Y143-C145 PolarHBondContact O-N 3.26Å; C145-Y172 WeakPolarHBondContact O-CD2 3.15Å; C145-V174 CarbonylContact C-O 3.49Å; C145-V174 WeakPolarHBondContact CA-O 3.1Å; C145-V174 WeakPolarHBondContact CB-O 3.46Å; C145-C176 VanDerWaalsContact C-SG 3.59Å; C145-C176 HydrophobicContact CB-CB 3.93Å; C145-C176 WeakPolarHBondContact CB-SG 3.31Å; C145-C176 WeakPolarHBondContact SG-CA 3.44Å; C145-C176 WeakPolarHBondContact SG-CB 3.41Å; C145-C176 CovalentContact SG-SG 2.05Å; C145-C176 PolarHBondContact SG-SG 3.42Å; C145-A179 HydrophobicContact CB-CB 3.71Å
146C97.9Very high96Very high0 Ų050.1 Ų50.10%022%0.223CC..  trans-146.4131.4176.8-175.50000112.9L150 F151 C165 Y172 V174C146-L150 CarbonylContact O-C 3.55Å; C146-L150 VanDerWaalsContact O-C 3.31Å; C146-F151 HydrophobicContact CB-CB 4.08Å; C146-F151 PolarHBondContact O-N 3.15Å; C146-F151 VanDerWaalsContact SG-CA 3.52Å; C146-F151 WeakPolarHBondContact SG-CB 3.34Å; C146-C165 WeakPolarHBondContact CA-SG 3.46Å; C146-C165 HydrophobicContact CB-CB 3.76Å; C146-C165 WeakPolarHBondContact CB-SG 3.24Å; C146-C165 WeakPolarHBondContact SG-CB 3.44Å; C146-C165 CovalentContact SG-SG 2.03Å; C146-C165 PolarHBondContact SG-SG 3.42Å; C146-Y172 WeakPolarHBondContact CB-O 3.34Å; C146-V174 PolarHBondContact N-O 2.94Å
147G96.7Very high95.5Very high0 Ų051 Ų510%023%0.229CC..SBendtrans66.5-170-177.200000112.4C176G147-C176 VanDerWaalsContact O-CB 3.25Å; G147-C176 WeakPolarHBondContact O-CB 3.3Å; G147-C176 PolarHBondContact O-N 3.28Å; G147-C176 PolarHBondContact O-SG 2.85Å
148S96.8Very high95Very high0 Ų056.3 Ų56.30%026%0.257CS..SBendtrans-75.5-56.4177.7-170.10000111.2N116 L119 Q120 D153 G175 C176 T177N116-S148 PolarHBondContact O-OG 3.22Å; N116-S148 PolarHBondContact OD1-OG 3.4Å; L119-S148 VanDerWaalsContact CB-OG 3.3Å; L119-S148 WeakPolarHBondContact CB-OG 3.34Å; Q120-S148 VanDerWaalsContact CG-CB 3.43Å; Q120-S148 WeakPolarHBondContact CG-OG 3.39Å; S148-D153 PolarHBondContact N-OD2 2.76Å; S148-G175 CarbonylContact O-C 3.58Å; S148-C176 PolarHBondContact O-N 3.2Å; S148-T177 WeakPolarHBondContact O-CB 3.25Å; S148-T177 PolarHBondContact O-N 3.02Å; S148-T177 PolarHBondContact O-OG1 2.87Å; S148-T177 PolarHBondContact OG-OG1 2.05Å
149L97.8Very high94.5Very high55 Ų5554 Ų5429%0.28825%0.247SC..SBendtrans-111.3-40.9177.5-66.3178.6000111.3N116 D153 G175N116-L149 WeakPolarHBondContact OD1-CD2 3.29Å; N116-L149 VanDerWaalsContact OD1-CG 3.24Å; N116-L149 WeakPolarHBondContact OD1-CG 3.1Å; L149-D153 PolarHBondContact N-OD2 2.86Å; L149-G175 WeakPolarHBondContact O-CA 3.37Å; L149-G175 PolarHBondContact O-N 3.02Å
150L95.9Very high94.1Very high78 Ų7857.7 Ų57.741%0.40827%0.273SS..SBendtrans-145158.9179.7-61.2104.3000111.3C146 T152 D153C146-L150 CarbonylContact O-C 3.55Å; C146-L150 VanDerWaalsContact O-C 3.31Å; L150-T152 PolarHBondContact O-N 2.93Å; L150-D153 PolarHBondContact N-OD2 3.45Å; L150-D153 VanDerWaalsContact N-OD2 3.11Å; L150-D153 VanDerWaalsContact O-CB 3.26Å; L150-D153 WeakPolarHBondContact O-CB 3.36Å; L150-D153 PolarHBondContact O-N 3.07Å
151F93.7Very high93.8Very high85 Ų8561.1 Ų61.137%0.37329%0.291SS..THydrogen-bonded Turntrans-56.3-26.4174.472-90.3000114.1C146 D153 Y154 L161 I171C146-F151 HydrophobicContact CB-CB 4.08Å; C146-F151 PolarHBondContact O-N 3.15Å; C146-F151 VanDerWaalsContact SG-CA 3.52Å; C146-F151 WeakPolarHBondContact SG-CB 3.34Å; F151-D153 PolarHBondContact O-N 2.95Å; F151-Y154 PolarHBondContact O-N 3.1Å; F151-L161 HydrophobicContact CB-CD1 4.21Å; F151-I171 HydrophobicContact CB-CG2 3.62Å; F151-I171 HydrophobicContact CD1-CG2 4.31Å; F151-I171 HydrophobicContact CD2-CG2 4.42Å; F151-I171 HydrophobicContact CG-CG2 3.88Å
152T94.6Very high93.7Very high24 Ų2456.9 Ų56.915%0.14727%0.272CS..Hα-helixtrans-68-13177.855.20000113.6L150 Y154 R155 R156L150-T152 PolarHBondContact O-N 2.93Å; T152-Y154 VanDerWaalsContact C-N 3.27Å; T152-Y154 PolarHBondContact O-N 3.35Å; T152-R155 PolarHBondContact O-N 3.21Å; T152-R156 PolarHBondContact O-N 2.93Å; T152-R156 VanDerWaalsContact O-N 3.16Å
153D95.2Very high93.6Very high5 Ų558.2 Ų58.23%0.02728%0.283CS..Hα-helixtrans-62.6-35.8179.1-65.3-21.2000111.1L123 S148 L149 L150 F151 R155 R156 T157L123-D153 HydrophobicContact CD2-CB 3.49Å; L123-D153 VanDerWaalsContact CD2-CB 3.49Å; S148-D153 PolarHBondContact N-OD2 2.76Å; L149-D153 PolarHBondContact N-OD2 2.86Å; L150-D153 PolarHBondContact N-OD2 3.45Å; L150-D153 VanDerWaalsContact N-OD2 3.11Å; L150-D153 VanDerWaalsContact O-CB 3.26Å; L150-D153 WeakPolarHBondContact O-CB 3.36Å; L150-D153 PolarHBondContact O-N 3.07Å; F151-D153 PolarHBondContact O-N 2.95Å; D153-R155 VanDerWaalsContact C-N 3.32Å; D153-R155 PolarHBondContact O-N 2.95Å; D153-R156 WeakPolarHBondContact O-CB 3.42Å; D153-R156 PolarHBondContact O-N 3.1Å; D153-R156 VanDerWaalsContact O-N 3.08Å; D153-R156 IonicContact OD1-CZ 2.94Å; D153-R156 IonicContact OD1-NH1 3.92Å; D153-R156 PolarHBondContact OD1-NH1 3.5Å; D153-T157 PolarHBondContact O-N 2.84Å; D153-T157 PolarHBondContact O-OG1 3.42Å
154Y94.1Very high93.6Very high2 Ų256 Ų561%0.00828%0.275CS..Hα-helixtrans-57.1-43.9173.2-79.5-81.1000112.5L123 Y126 Q140 F151 T152 R156 T157 N158 N159 S160 L161 P162 C165L123-Y154 HydrophobicContact CD1-CD1 3.96Å; L123-Y154 HydrophobicContact CD1-CE1 3.45Å; L123-Y154 VanDerWaalsContact CD1-CE1 3.45Å; L123-Y154 HydrophobicContact CD1-CE2 4.1Å; L123-Y154 HydrophobicContact CD1-CG 4.46Å; Y126-Y154 HydrophobicContact CD1-CD1 4.34Å; Y126-Y154 AromaticContact CD1-CE1 3.73Å; Y126-Y154 HydrophobicContact CD1-CE1 3.73Å; Y126-Y154 HydrophobicContact CD2-CE1 4.09Å; Y126-Y154 AromaticContact CE1-CE1 3.86Å; Y126-Y154 HydrophobicContact CE1-CE1 3.86Å; Y126-Y154 HydrophobicContact CE2-CE1 4.17Å; Y126-Y154 AromaticContact CG-CE1 3.9Å; Y126-Y154 HydrophobicContact CG-CE1 3.9Å; Q140-Y154 PolarHBondContact NE2-OH 3.42Å; Q140-Y154 PolarHBondContact OE1-OH 3.47Å; F151-Y154 PolarHBondContact O-N 3.1Å; T152-Y154 VanDerWaalsContact C-N 3.27Å; T152-Y154 PolarHBondContact O-N 3.35Å; Y154-R156 VanDerWaalsContact C-N 3.33Å; Y154-R156 PolarHBondContact O-N 2.98Å; Y154-T157 CarbonylContact O-C 3.37Å; Y154-T157 PolarHBondContact O-N 3.31Å; Y154-T157 PolarHBondContact O-OG1 3.44Å; Y154-T157 VanDerWaalsContact O-OG1 3.08Å; Y154-N158 PolarHBondContact O-N 3.42Å; Y154-N159 CarbonylContact C-O 3.5Å; Y154-N159 HydrophobicContact CD1-CB 3.75Å; Y154-N159 PolarHBondContact O-N 2.7Å; Y154-S160 WeakPolarHBondContact CD1-O 3.45Å; Y154-L161 HydrophobicContact CD2-CD1 4.04Å; Y154-L161 HydrophobicContact CG-CD1 4.5Å; Y154-P162 HydrophobicContact CD1-CG 4.46Å; Y154-P162 HydrophobicContact CE1-CG 3.79Å; Y154-P162 HydrophobicContact CE2-CG 3.86Å; Y154-P162 VanDerWaalsContact CZ-CG 3.47Å; Y154-C165 VanDerWaalsContact CE2-SG 3.52Å
155R91.1Very high93.6Very high189 Ų18951 Ų5171%0.71325%0.253SS*.Hα-helixtrans-66.1-36.7177.3-173.8178.465-172.4-0.7111.7T152 D153 T157 N158T152-R155 PolarHBondContact O-N 3.21Å; D153-R155 VanDerWaalsContact C-N 3.32Å; D153-R155 PolarHBondContact O-N 2.95Å; R155-T157 PolarHBondContact O-N 3.37Å; R155-N158 PolarHBondContact O-N 2.97Å
156R90.1Very high93.3Very high168 Ų16855.3 Ų55.363%0.63427%0.272SS*.Hα-helixtrans-67.7-27.5178.1-68.8174.2177.7152.4-5.9112.3T152 D153 Y154T152-R156 PolarHBondContact O-N 2.93Å; T152-R156 VanDerWaalsContact O-N 3.16Å; D153-R156 WeakPolarHBondContact O-CB 3.42Å; D153-R156 PolarHBondContact O-N 3.1Å; D153-R156 VanDerWaalsContact O-N 3.08Å; D153-R156 IonicContact OD1-CZ 2.94Å; D153-R156 IonicContact OD1-NH1 3.92Å; D153-R156 PolarHBondContact OD1-NH1 3.5Å; Y154-R156 VanDerWaalsContact C-N 3.33Å; Y154-R156 PolarHBondContact O-N 2.98Å
157T86.1Confident92.9Very high19 Ų1959.6 Ų59.612%0.11730%0.295CS..THydrogen-bonded Turntrans-97.615.1177.461.40000113.1L123 D153 Y154 R155 N159L123-T157 HydrophobicContact CD2-CG2 4.31Å; L123-T157 HydrophobicContact CG-CG2 4.3Å; D153-T157 PolarHBondContact O-N 2.84Å; D153-T157 PolarHBondContact O-OG1 3.42Å; Y154-T157 CarbonylContact O-C 3.37Å; Y154-T157 PolarHBondContact O-N 3.31Å; Y154-T157 PolarHBondContact O-OG1 3.44Å; Y154-T157 VanDerWaalsContact O-OG1 3.08Å; R155-T157 PolarHBondContact O-N 3.37Å; T157-N159 PolarHBondContact O-N 3.27Å; T157-N159 PolarHBondContact OG1-ND2 2.86Å
158N88.3Confident92.3Very high150 Ų15066.5 Ų66.580%0.80233%0.332SS*.THydrogen-bonded Turntrans56.425.3-178.4-60.1-42.6000115Y154 R155Y154-N158 PolarHBondContact O-N 3.42Å; R155-N158 PolarHBondContact O-N 2.97Å
159N86.5Confident91.7Very high20 Ų2075.5 Ų75.511%0.10737%0.371CS..PPolyproline II helixtrans-96.7152.3175.6-65.1-45.1000110.7L123 Y126 E127 Y154 T157L123-N159 PolarHBondContact O-ND2 3.5Å; Y126-N159 HydrophobicContact CD1-CB 4.38Å; E127-N159 HydrophobicContact CG-CB 4.3Å; E127-N159 WeakPolarHBondContact CG-OD1 3.27Å; Y154-N159 CarbonylContact C-O 3.5Å; Y154-N159 HydrophobicContact CD1-CB 3.75Å; Y154-N159 PolarHBondContact O-N 2.7Å; T157-N159 PolarHBondContact O-N 3.27Å; T157-N159 PolarHBondContact OG1-ND2 2.86Å
160S89.8Confident91.4Very high77 Ų7780.7 Ų80.754%0.53839%0.391SS..PPolyproline II helixtrans-69.3147.3167.4600000111.2E127 Y154 P162E127-S160 PolarHBondContact OE1-N 3.42Å; E127-S160 PolarHBondContact OE1-OG 3.32Å; Y154-S160 WeakPolarHBondContact CD1-O 3.45Å; S160-P162 WeakPolarHBondContact O-CD 3.44Å
161L92.6Very high91.3Very high72 Ų7280.5 Ų80.538%0.37739%0.39SS..PPolyproline II helixtrans-70.3120175.6-17574.2000108.9F151 Y154 C165 I171F151-L161 HydrophobicContact CB-CD1 4.21Å; Y154-L161 HydrophobicContact CD2-CD1 4.04Å; Y154-L161 HydrophobicContact CG-CD1 4.5Å; L161-C165 HydrophobicContact CD1-CB 4.01Å; L161-C165 HydrophobicContact CG-CB 4.27Å; L161-I171 HydrophobicContact CD2-CD1 3.63Å; L161-I171 HydrophobicContact CD2-CG1 4Å; L161-I171 HydrophobicContact CD2-CG2 4.47Å
162P94Very high91.4Very high11 Ų1177.9 Ų77.97%0.07138%0.378CS..PPolyproline II helixtrans-75.4157.7-17432-37.3000112.1Y126 Y154 S160 S164 C165Y126-P162 HydrophobicContact CE1-CB 4.5Å; Y126-P162 VanDerWaalsContact OH-CB 3.28Å; Y126-P162 WeakPolarHBondContact OH-CB 3.34Å; Y154-P162 HydrophobicContact CD1-CG 4.46Å; Y154-P162 HydrophobicContact CE1-CG 3.79Å; Y154-P162 HydrophobicContact CE2-CG 3.86Å; Y154-P162 VanDerWaalsContact CZ-CG 3.47Å; S160-P162 WeakPolarHBondContact O-CD 3.44Å; P162-S164 PolarHBondContact O-N 2.86Å; P162-C165 HydrophobicContact CG-CB 4.07Å; P162-C165 WeakPolarHBondContact O-CB 3.36Å; P162-C165 PolarHBondContact O-N 3.11Å
163V93.8Very high91.4Very high111 Ų11180.7 Ų80.767%0.67340%0.404SS*.G310 helixtrans-64.6-32177.8179.40000111.5C165 K166V163-C165 PolarHBondContact O-N 2.96Å; V163-C165 VanDerWaalsContact O-N 3.14Å; V163-K166 VanDerWaalsContact O-CG 3.23Å; V163-K166 WeakPolarHBondContact O-CG 3.26Å; V163-K166 PolarHBondContact O-N 2.68Å
164S96.3Very high91.5Very high4 Ų483.8 Ų83.83%0.02842%0.423CS..G310 helixtrans-61.2-17.8176.257.60000114.3N137 Q140 P162 K166 Y172N137-S164 WeakPolarHBondContact OD1-CB 3.27Å; N137-S164 PolarHBondContact OD1-OG 3.41Å; Q140-S164 WeakPolarHBondContact CB-O 3.44Å; Q140-S164 PolarHBondContact NE2-OG 3.49Å; P162-S164 PolarHBondContact O-N 2.86Å; S164-K166 VanDerWaalsContact C-N 3.31Å; S164-K166 PolarHBondContact O-N 2.88Å; S164-Y172 WeakPolarHBondContact O-CE2 3.04Å
165C95.6Very high91.7Very high0 Ų083.9 Ų83.90%042%0.424CS..G310 helixtrans-81.7-1.3179.2-96.40000114.8Q140 C146 Y154 L161 P162 V163 Y172Q140-C165 PolarHBondContact NE2-SG 3.02Å; Q140-C165 PolarHBondContact OE1-SG 3.21Å; C146-C165 WeakPolarHBondContact CA-SG 3.46Å; C146-C165 HydrophobicContact CB-CB 3.76Å; C146-C165 WeakPolarHBondContact CB-SG 3.24Å; C146-C165 WeakPolarHBondContact SG-CB 3.44Å; C146-C165 CovalentContact SG-SG 2.03Å; C146-C165 PolarHBondContact SG-SG 3.42Å; Y154-C165 VanDerWaalsContact CE2-SG 3.52Å; L161-C165 HydrophobicContact CD1-CB 4.01Å; L161-C165 HydrophobicContact CG-CB 4.27Å; P162-C165 HydrophobicContact CG-CB 4.07Å; P162-C165 WeakPolarHBondContact O-CB 3.36Å; P162-C165 PolarHBondContact O-N 3.11Å; V163-C165 PolarHBondContact O-N 2.96Å; V163-C165 VanDerWaalsContact O-N 3.14Å; C165-Y172 WeakPolarHBondContact O-CD2 3.33Å; C165-Y172 PolarHBondContact O-N 2.95Å
166K93.3Very high92Very high91 Ų9174.9 Ų74.940%0.39639%0.39SS..EExtended strand (participates in β ladder)trans-136.6152.7-174.757.1174.5-178.41770112.3V163 S164 F170 I171V163-K166 VanDerWaalsContact O-CG 3.23Å; V163-K166 WeakPolarHBondContact O-CG 3.26Å; V163-K166 PolarHBondContact O-N 2.68Å; S164-K166 VanDerWaalsContact C-N 3.31Å; S164-K166 PolarHBondContact O-N 2.88Å; K166-F170 CarbonylContact C-O 3.45Å; K166-F170 WeakPolarHBondContact CA-O 3.45Å; K166-F170 VanDerWaalsContact CB-O 3.28Å; K166-F170 WeakPolarHBondContact CB-O 3.42Å; K166-I171 HydrophobicContact CB-CG1 4.45Å
167D89.6Confident92.4Very high91 Ų9166.9 Ų66.949%0.48736%0.36SS..EExtended strand (participates in β ladder)trans-112112.4166.9-16818.5000108.4K169 F170 Y172D167-K169 PolarHBondContact O-N 3.16Å; D167-F170 PolarHBondContact N-O 2.87Å; D167-F170 PolarHBondContact O-N 3.11Å; D167-Y172 HydrophobicContact CB-CE1 3.88Å
168D83.3Confident93Very high144 Ų14470 Ų7077%0.7737%0.373SS*.THydrogen-bonded Turntrans48.1-90.3-168.8-69.3-33.9000113.7
169K83.4Confident93.4Very high190 Ų19063.4 Ų63.483%0.82634%0.34SS*.THydrogen-bonded Turntrans-108.8-11.6-176-64.2-176.2-179.5178.30113.8D167D167-K169 PolarHBondContact O-N 3.16Å
170F92.6Very high93.9Very high164 Ų16462.5 Ų62.572%0.71934%0.335SS*.EExtended strand (participates in β ladder)trans-105.9125.5-172.8-62.1-76.2000111.2K166 D167K166-F170 CarbonylContact C-O 3.45Å; K166-F170 WeakPolarHBondContact CA-O 3.45Å; K166-F170 VanDerWaalsContact CB-O 3.28Å; K166-F170 WeakPolarHBondContact CB-O 3.42Å; D167-F170 PolarHBondContact N-O 2.87Å; D167-F170 PolarHBondContact O-N 3.11Å
171I94.5Very high94.3Very high74 Ų7459.7 Ų59.738%0.37931%0.314SS..EExtended strand (participates in β ladder)trans-78.3135.4173.2-59.2167.3000108.1F151 L161 K166 A173F151-I171 HydrophobicContact CB-CG2 3.62Å; F151-I171 HydrophobicContact CD1-CG2 4.31Å; F151-I171 HydrophobicContact CD2-CG2 4.42Å; F151-I171 HydrophobicContact CG-CG2 3.88Å; L161-I171 HydrophobicContact CD2-CD1 3.63Å; L161-I171 HydrophobicContact CD2-CG1 4Å; L161-I171 HydrophobicContact CD2-CG2 4.47Å; K166-I171 HydrophobicContact CB-CG1 4.45Å; I171-A173 PolarHBondContact O-N 3.1Å
172Y96Very high94.5Very high29 Ų2963.6 Ų63.611%0.11433%0.328CS..  trans-63.5124.7174.6-58.3-54.3000110.5K144 C145 C146 S164 C165 D167K144-Y172 HydrophobicContact CB-CD1 3.87Å; K144-Y172 HydrophobicContact CB-CE1 3.69Å; K144-Y172 HydrophobicContact CB-CG 4.39Å; K144-Y172 HydrophobicContact CD-CE1 3.62Å; K144-Y172 HydrophobicContact CD-CE2 4.23Å; K144-Y172 VanDerWaalsContact CD-CZ 3.41Å; K144-Y172 WeakPolarHBondContact CD-OH 3.27Å; K144-Y172 HydrophobicContact CG-CE1 4.2Å; K144-Y172 PolarHBondContact NZ-OH 3.5Å; K144-Y172 WeakPolarHBondContact O-CB 3.1Å; C145-Y172 WeakPolarHBondContact O-CD2 3.15Å; C146-Y172 WeakPolarHBondContact CB-O 3.34Å; S164-Y172 WeakPolarHBondContact O-CE2 3.04Å; C165-Y172 WeakPolarHBondContact O-CD2 3.33Å; C165-Y172 PolarHBondContact O-N 2.95Å; D167-Y172 HydrophobicContact CB-CE1 3.88Å
173A93.8Very high94.6Very high84 Ų8464.7 Ų64.769%0.69433%0.332SS*.  trans-82.8-17-178.200000113.4I171I171-A173 PolarHBondContact O-N 3.1Å
174V96.8Very high94.7Very high70 Ų7059.4 Ų59.442%0.42430%0.3SS..SBendtrans-87.1130.4-177.3-178.10000109.7C145 C146 E178 A179C145-V174 CarbonylContact C-O 3.49Å; C145-V174 WeakPolarHBondContact CA-O 3.1Å; C145-V174 WeakPolarHBondContact CB-O 3.46Å; C146-V174 PolarHBondContact N-O 2.94Å; V174-E178 HydrophobicContact CG1-CB 4.08Å; V174-E178 HydrophobicContact CG1-CG 4.13Å; V174-A179 HydrophobicContact CG1-CB 4.23Å
175G98Very high94.7Very high4 Ų461.5 Ų61.54%0.04131%0.307CS..  trans-70.8147.5171.900000112.5S148 L149 T177 E178 A179S148-G175 CarbonylContact O-C 3.58Å; L149-G175 WeakPolarHBondContact O-CA 3.37Å; L149-G175 PolarHBondContact O-N 3.02Å; G175-T177 PolarHBondContact O-N 3.11Å; G175-E178 PolarHBondContact O-N 3.33Å; G175-E178 VanDerWaalsContact O-N 3.1Å; G175-A179 PolarHBondContact O-N 2.91Å; G175-A179 VanDerWaalsContact O-N 3.1Å
176C98.4Very high94.7Very high0 Ų068.3 Ų68.30%034%0.337CS..Hα-helixtrans-67.4-22.4-177.4-66.40000114L119 L139 Q140 C145 G147 S148 L180L119-C176 HydrophobicContact CD1-CB 4.13Å; L139-C176 HydrophobicContact CD2-CB 3.62Å; L139-C176 HydrophobicContact CG-CB 4.16Å; Q140-C176 VanDerWaalsContact CG-SG 3.54Å; C145-C176 VanDerWaalsContact C-SG 3.59Å; C145-C176 HydrophobicContact CB-CB 3.93Å; C145-C176 WeakPolarHBondContact CB-SG 3.31Å; C145-C176 WeakPolarHBondContact SG-CA 3.44Å; C145-C176 WeakPolarHBondContact SG-CB 3.41Å; C145-C176 CovalentContact SG-SG 2.05Å; C145-C176 PolarHBondContact SG-SG 3.42Å; G147-C176 VanDerWaalsContact O-CB 3.25Å; G147-C176 WeakPolarHBondContact O-CB 3.3Å; G147-C176 PolarHBondContact O-N 3.28Å; G147-C176 PolarHBondContact O-SG 2.85Å; S148-C176 PolarHBondContact O-N 3.2Å; C176-L180 VanDerWaalsContact O-CB 3.29Å; C176-L180 WeakPolarHBondContact O-CB 3.34Å; C176-L180 WeakPolarHBondContact O-CG 3.32Å; C176-L180 PolarHBondContact O-N 3.34Å
177T98.1Very high94.8Very high0 Ų066.5 Ų66.50%033%0.328CS..Hα-helixtrans-59.7-49.8169.5-53.90000111.1Y112 A115 N116 S148 G175 N181Y112-T177 HydrophobicContact CD1-CG2 4.15Å; Y112-T177 HydrophobicContact CD2-CG2 3.63Å; Y112-T177 HydrophobicContact CE1-CG2 4.11Å; Y112-T177 HydrophobicContact CE2-CG2 3.61Å; Y112-T177 HydrophobicContact CG-CG2 3.9Å; Y112-T177 VanDerWaalsContact O-CG2 3.24Å; Y112-T177 WeakPolarHBondContact O-CG2 3.45Å; A115-T177 HydrophobicContact CB-CG2 4.45Å; N116-T177 WeakPolarHBondContact CA-OG1 3.41Å; N116-T177 HydrophobicContact CB-CG2 3.68Å; S148-T177 WeakPolarHBondContact O-CB 3.25Å; S148-T177 PolarHBondContact O-N 3.02Å; S148-T177 PolarHBondContact O-OG1 2.87Å; S148-T177 PolarHBondContact OG-OG1 2.05Å; G175-T177 PolarHBondContact O-N 3.11Å; T177-N181 VanDerWaalsContact O-CB 3.22Å; T177-N181 WeakPolarHBondContact O-CB 3.35Å; T177-N181 PolarHBondContact O-N 3.25Å
178E97.9Very high95.1Very high84 Ų8462.2 Ų62.239%0.39331%0.305SS..Hα-helixtrans-67-41.9-179.1179.158.4-152.300111Y112 V174 G175 N181 K182Y112-E178 HydrophobicContact CE2-CB 4.35Å; Y112-E178 VanDerWaalsContact CE2-OE2 3.29Å; Y112-E178 WeakPolarHBondContact CE2-OE2 3.19Å; V174-E178 HydrophobicContact CG1-CB 4.08Å; V174-E178 HydrophobicContact CG1-CG 4.13Å; G175-E178 PolarHBondContact O-N 3.33Å; G175-E178 VanDerWaalsContact O-N 3.1Å; E178-N181 PolarHBondContact O-N 2.99Å; E178-K182 VanDerWaalsContact O-CB 3.31Å; E178-K182 WeakPolarHBondContact O-CB 3.49Å; E178-K182 PolarHBondContact O-N 3.42Å
179A98Very high95.6Very high12 Ų1259.7 Ų59.710%0.09929%0.292CS..Hα-helixtrans-63.9-44.417900000112.3C145 V174 G175 K182 H183C145-A179 HydrophobicContact CB-CB 3.71Å; V174-A179 HydrophobicContact CG1-CB 4.23Å; G175-A179 PolarHBondContact O-N 2.91Å; G175-A179 VanDerWaalsContact O-N 3.1Å; A179-K182 PolarHBondContact O-N 2.8Å; A179-H183 WeakPolarHBondContact O-CB 3.37Å; A179-H183 PolarHBondContact O-N 2.88Å
180L97Very high96.2Very high1 Ų153.7 Ų53.71%0.00527%0.272CS..Hα-helixtrans-62.8-46.1173.8-81.8172.5000111.7L39 F42 L46 L119 L139 Y143 C176 K182 H183 V184L39-L180 HydrophobicContact CD2-CD2 4.28Å; F42-L180 HydrophobicContact CD2-CD2 4.28Å; F42-L180 HydrophobicContact CE2-CD2 4.45Å; L46-L180 HydrophobicContact CD1-CD1 3.99Å; L46-L180 HydrophobicContact CD2-CD1 3.86Å; L46-L180 HydrophobicContact CG-CD1 4.38Å; L119-L180 HydrophobicContact CD1-CD1 4.22Å; L139-L180 HydrophobicContact CD1-CD1 3.91Å; L139-L180 HydrophobicContact CD1-CD2 3.56Å; L139-L180 HydrophobicContact CD1-CG 3.71Å; L139-L180 HydrophobicContact CD2-CD1 3.97Å; L139-L180 HydrophobicContact CD2-CG 4.49Å; Y143-L180 HydrophobicContact CE2-CD2 4.44Å; C176-L180 VanDerWaalsContact O-CB 3.29Å; C176-L180 WeakPolarHBondContact O-CB 3.34Å; C176-L180 WeakPolarHBondContact O-CG 3.32Å; C176-L180 PolarHBondContact O-N 3.34Å; L180-K182 VanDerWaalsContact C-N 3.33Å; L180-K182 PolarHBondContact O-N 2.89Å; L180-H183 PolarHBondContact O-N 3.18Å; L180-V184 WeakPolarHBondContact O-CB 3.41Å; L180-V184 VanDerWaalsContact O-CG2 3.31Å; L180-V184 WeakPolarHBondContact O-CG2 3.28Å; L180-V184 PolarHBondContact O-N 2.87Å
181N96.8Very high96.4Very high18 Ų1845.9 Ų45.910%0.09624%0.238CC..Hα-helixtrans-57.7-48.4177.9-177.165000111.2N109 Y112 T177 E178 H183 V184 Y185N109-N181 PolarHBondContact ND2-ND2 3.34Å; N109-N181 PolarHBondContact ND2-OD1 3.2Å; Y112-N181 HydrophobicContact CD2-CB 3.88Å; T177-N181 VanDerWaalsContact O-CB 3.22Å; T177-N181 WeakPolarHBondContact O-CB 3.35Å; T177-N181 PolarHBondContact O-N 3.25Å; E178-N181 PolarHBondContact O-N 2.99Å; N181-H183 VanDerWaalsContact C-N 3.34Å; N181-H183 PolarHBondContact O-N 3.42Å; N181-V184 PolarHBondContact O-N 3.41Å; N181-Y185 WeakPolarHBondContact O-CB 3.42Å; N181-Y185 WeakPolarHBondContact O-CD2 3.5Å; N181-Y185 PolarHBondContact O-N 3.36Å; N181-Y185 WeakPolarHBondContact OD1-CD2 3.39Å; N181-Y185 WeakPolarHBondContact OD1-CE2 3.24Å
182K97.1Very high96.4Very high154 Ų15443.2 Ų43.267%0.6722%0.224SC*.Hα-helixtrans-60.5-41.6176.7-175176.6-178.4177.60112.4E178 A179 L180 K186E178-K182 VanDerWaalsContact O-CB 3.31Å; E178-K182 WeakPolarHBondContact O-CB 3.49Å; E178-K182 PolarHBondContact O-N 3.42Å; A179-K182 PolarHBondContact O-N 2.8Å; L180-K182 VanDerWaalsContact C-N 3.33Å; L180-K182 PolarHBondContact O-N 2.89Å; K182-K186 WeakPolarHBondContact O-CB 3.12Å; K182-K186 PolarHBondContact O-N 2.88Å; K182-K186 VanDerWaalsContact O-N 3.12Å
183H96.2Very high96.4Very high33 Ų3344.2 Ų44.215%0.15324%0.239CC..Hα-helixtrans-63.1-45.5176.6-18069.1000112.1D38 Y143 A179 L180 N181 K186 Y187D38-H183 IonicContact OD2-CE1 3.52Å; D38-H183 IonicContact OD2-NE2 2.84Å; D38-H183 PolarHBondContact OD2-NE2 3.36Å; Y143-H183 HydrophobicContact CD1-CB 4.19Å; Y143-H183 HydrophobicContact CE1-CB 3.79Å; Y143-H183 AromaticContact CE1-CD2 3.77Å; Y143-H183 AromaticContact CE1-CE1 3.96Å; Y143-H183 AromaticContact CE1-CG 3.44Å; Y143-H183 VanDerWaalsContact CE1-CG 3.44Å; Y143-H183 AromaticContact CE1-ND1 3.62Å; Y143-H183 AromaticContact CZ-CD2 3.99Å; Y143-H183 PolarHBondContact OH-NE2 2.9Å; A179-H183 WeakPolarHBondContact O-CB 3.37Å; A179-H183 PolarHBondContact O-N 2.88Å; L180-H183 PolarHBondContact O-N 3.18Å; N181-H183 VanDerWaalsContact C-N 3.34Å; N181-H183 PolarHBondContact O-N 3.42Å; H183-K186 VanDerWaalsContact O-CB 3.29Å; H183-K186 WeakPolarHBondContact O-CB 3.48Å; H183-Y187 AromaticContact CE1-CE2 3.85Å; H183-Y187 WeakPolarHBondContact O-CD2 3.44Å
184V96.4Very high96.6Very high0 Ų042.9 Ų42.90%022%0.219CC..Hα-helixtrans-65.9-48179.8165.90000111.3V35 L39 P51 F111 L180 N181 K186 Y187 I188V35-V184 HydrophobicContact CG1-CG1 4.27Å; V35-V184 HydrophobicContact CG1-CG2 4.28Å; L39-V184 HydrophobicContact CD1-CG2 4.12Å; L39-V184 HydrophobicContact CD2-CG2 3.9Å; L39-V184 HydrophobicContact CG-CG2 4.2Å; P51-V184 HydrophobicContact CG-CG1 3.48Å; P51-V184 VanDerWaalsContact CG-CG1 3.48Å; F111-V184 HydrophobicContact CD1-CG1 4.46Å; F111-V184 HydrophobicContact CE1-CB 4.16Å; F111-V184 HydrophobicContact CE1-CG1 4.37Å; F111-V184 HydrophobicContact CE1-CG2 3.85Å; F111-V184 HydrophobicContact CZ-CG2 3.99Å; L180-V184 WeakPolarHBondContact O-CB 3.41Å; L180-V184 VanDerWaalsContact O-CG2 3.31Å; L180-V184 WeakPolarHBondContact O-CG2 3.28Å; L180-V184 PolarHBondContact O-N 2.87Å; N181-V184 PolarHBondContact O-N 3.41Å; V184-K186 VanDerWaalsContact C-N 3.26Å; V184-K186 PolarHBondContact O-N 3.39Å; V184-Y187 PolarHBondContact O-N 3.22Å; V184-I188 HydrophobicContact CG1-CD1 3.43Å; V184-I188 VanDerWaalsContact CG1-CD1 3.43Å; V184-I188 HydrophobicContact CG1-CG1 4.17Å; V184-I188 PolarHBondContact O-N 2.87Å; V184-I188 VanDerWaalsContact O-N 3.14Å
185Y95.7Very high96.6Very high48 Ų4839.5 Ų39.519%0.18820%0.199CC..Hα-helixtrans-69.9-22-177.8-84.7-97.1000113.7N109 N181 Y187 I188 D189N109-Y185 WeakPolarHBondContact ND2-CE2 3.41Å; N109-Y185 PolarHBondContact OD1-OH 3.23Å; N109-Y185 VanDerWaalsContact OD1-OH 3.09Å; N181-Y185 WeakPolarHBondContact O-CB 3.42Å; N181-Y185 WeakPolarHBondContact O-CD2 3.5Å; N181-Y185 PolarHBondContact O-N 3.36Å; N181-Y185 WeakPolarHBondContact OD1-CD2 3.39Å; N181-Y185 WeakPolarHBondContact OD1-CE2 3.24Å; Y185-Y187 PolarHBondContact O-N 2.86Å; Y185-Y187 VanDerWaalsContact O-N 3.09Å; Y185-I188 HydrophobicContact CD1-CB 4.31Å; Y185-I188 HydrophobicContact CD1-CG2 4.3Å; Y185-I188 HydrophobicContact CE1-CG2 4.34Å; Y185-I188 PolarHBondContact O-N 3.3Å; Y185-D189 WeakPolarHBondContact O-CB 3.49Å; Y185-D189 VanDerWaalsContact O-CG 3.32Å; Y185-D189 PolarHBondContact O-N 3.32Å
186K96.3Very high96.6Very high144 Ų14442.2 Ų42.263%0.62621%0.21SC*.Hα-helixtrans-52.3-31167.6-174.4-175.5175.1-174.80112.9K182 H183 V184 P190K182-K186 WeakPolarHBondContact O-CB 3.12Å; K182-K186 PolarHBondContact O-N 2.88Å; K182-K186 VanDerWaalsContact O-N 3.12Å; H183-K186 VanDerWaalsContact O-CB 3.29Å; H183-K186 WeakPolarHBondContact O-CB 3.48Å; V184-K186 VanDerWaalsContact C-N 3.26Å; V184-K186 PolarHBondContact O-N 3.39Å; K186-P190 VanDerWaalsContact O-CD 3.32Å; K186-P190 WeakPolarHBondContact O-CD 3.23Å; K186-P190 WeakPolarHBondContact O-CG 3.22Å
187Y95.7Very high96.5Very high52 Ų5246.7 Ų46.720%0.20423%0.233CC..Hα-helixtrans-96.9-38175.8-64.6-83.9000112.7L31 V35 H183 V184 Y185 P190 I191L31-Y187 HydrophobicContact CD2-CD1 4.18Å; L31-Y187 HydrophobicContact CD2-CE1 4.44Å; V35-Y187 VanDerWaalsContact CG2-CB 3.42Å; V35-Y187 HydrophobicContact CG2-CD1 4.41Å; V35-Y187 HydrophobicContact CG2-CD2 3.72Å; V35-Y187 HydrophobicContact CG2-CG 3.6Å; H183-Y187 AromaticContact CE1-CE2 3.85Å; H183-Y187 WeakPolarHBondContact O-CD2 3.44Å; V184-Y187 PolarHBondContact O-N 3.22Å; Y185-Y187 PolarHBondContact O-N 2.86Å; Y185-Y187 VanDerWaalsContact O-N 3.09Å; Y187-P190 VanDerWaalsContact O-CD 3.32Å; Y187-P190 WeakPolarHBondContact O-CD 3.48Å; Y187-P190 VanDerWaalsContact O-CG 3.31Å; Y187-P190 WeakPolarHBondContact O-CG 3.26Å; Y187-I191 WeakPolarHBondContact O-CB 3.25Å; Y187-I191 VanDerWaalsContact O-CD1 3.27Å; Y187-I191 WeakPolarHBondContact O-CD1 3.26Å; Y187-I191 WeakPolarHBondContact O-CG1 3.47Å; Y187-I191 PolarHBondContact O-N 3.45Å
188I94.8Very high96.5Very high1 Ų148.4 Ų48.41%0.00524%0.241CC..Hα-helixtrans-64.9-43.2-178.2-66.4176.3000111.7P51 I53 I54 T104 V184 Y185 I191 L192P51-I188 HydrophobicContact CB-CD1 3.94Å; P51-I188 HydrophobicContact CG-CD1 3.99Å; I53-I188 HydrophobicContact CD1-CG2 4.14Å; I53-I188 HydrophobicContact CG2-CD1 3.71Å; I53-I188 HydrophobicContact CG2-CG1 4.25Å; I53-I188 HydrophobicContact CG2-CG2 4.4Å; I54-I188 HydrophobicContact CD1-CD1 4.33Å; I54-I188 HydrophobicContact CD1-CG1 4.09Å; T104-I188 HydrophobicContact CG2-CG2 4.43Å; V184-I188 HydrophobicContact CG1-CD1 3.43Å; V184-I188 VanDerWaalsContact CG1-CD1 3.43Å; V184-I188 HydrophobicContact CG1-CG1 4.17Å; V184-I188 PolarHBondContact O-N 2.87Å; V184-I188 VanDerWaalsContact O-N 3.14Å; Y185-I188 HydrophobicContact CD1-CB 4.31Å; Y185-I188 HydrophobicContact CD1-CG2 4.3Å; Y185-I188 HydrophobicContact CE1-CG2 4.34Å; Y185-I188 PolarHBondContact O-N 3.3Å; I188-I191 WeakPolarHBondContact O-CB 3.04Å; I188-I191 PolarHBondContact O-N 3.14Å; I188-I191 VanDerWaalsContact O-N 3.15Å; I188-L192 HydrophobicContact CG2-CD1 3.82Å; I188-L192 HydrophobicContact CG2-CG 3.96Å; I188-L192 WeakPolarHBondContact O-CG 3.14Å; I188-L192 PolarHBondContact O-N 3.33Å
189D94.7Very high96.5Very high92 Ų9244.6 Ų44.649%0.49222%0.223SC..Hα-helixtrans-58.2-51.2-177.2-68.5-18.2000113.5Y185 I191 L192 A193Y185-D189 WeakPolarHBondContact O-CB 3.49Å; Y185-D189 VanDerWaalsContact O-CG 3.32Å; Y185-D189 PolarHBondContact O-N 3.32Å; D189-I191 VanDerWaalsContact C-N 3.31Å; D189-I191 PolarHBondContact O-N 3.28Å; D189-L192 PolarHBondContact O-N 3.06Å; D189-A193 PolarHBondContact O-N 3.09Å; D189-A193 VanDerWaalsContact O-N 3.16Å
190P95.5Very high96.5Very high63 Ų6349 Ų4941%0.40924%0.244SC..Hα-helixtrans-66.2-32.9175.424.1-32.9000112.6K186 Y187 A193 L194K186-P190 VanDerWaalsContact O-CD 3.32Å; K186-P190 WeakPolarHBondContact O-CD 3.23Å; K186-P190 WeakPolarHBondContact O-CG 3.22Å; Y187-P190 VanDerWaalsContact O-CD 3.32Å; Y187-P190 WeakPolarHBondContact O-CD 3.48Å; Y187-P190 VanDerWaalsContact O-CG 3.31Å; Y187-P190 WeakPolarHBondContact O-CG 3.26Å; P190-A193 PolarHBondContact O-N 2.96Å; P190-L194 VanDerWaalsContact O-CG 3.3Å; P190-L194 WeakPolarHBondContact O-CG 3.37Å; P190-L194 PolarHBondContact O-N 3.05Å
191I95.7Very high96.5Very high1 Ų152 Ų521%0.00526%0.259CS..Hα-helixtrans-61.7-46.2174.6-73.8169.2000110.7L28 L31 I57 Y187 I188 D189 A193 L194 C195L28-I191 HydrophobicContact CD2-CG1 4.4Å; L28-I191 HydrophobicContact CD2-CG2 3.86Å; L31-I191 HydrophobicContact CB-CD1 3.84Å; L31-I191 HydrophobicContact CB-CG1 4.36Å; L31-I191 HydrophobicContact CD1-CD1 4.36Å; L31-I191 HydrophobicContact CD1-CG1 3.98Å; I57-I191 HydrophobicContact CD1-CG2 3.23Å; I57-I191 HydrophobicContact CG2-CG2 4.35Å; Y187-I191 WeakPolarHBondContact O-CB 3.25Å; Y187-I191 VanDerWaalsContact O-CD1 3.27Å; Y187-I191 WeakPolarHBondContact O-CD1 3.26Å; Y187-I191 WeakPolarHBondContact O-CG1 3.47Å; Y187-I191 PolarHBondContact O-N 3.45Å; I188-I191 WeakPolarHBondContact O-CB 3.04Å; I188-I191 PolarHBondContact O-N 3.14Å; I188-I191 VanDerWaalsContact O-N 3.15Å; D189-I191 VanDerWaalsContact C-N 3.31Å; D189-I191 PolarHBondContact O-N 3.28Å; I191-A193 VanDerWaalsContact C-N 3.35Å; I191-A193 PolarHBondContact O-N 3.08Å; I191-L194 PolarHBondContact O-N 3.2Å; I191-C195 PolarHBondContact O-N 3.17Å; I191-C195 PolarHBondContact O-SG 2.98Å
192L96Very high96.6Very high17 Ų1751.4 Ų51.49%0.08926%0.256CS..Hα-helixtrans-58.1-47.4177.4-74.2174.8000111.3I53 A101 T104 I188 D189 L194 C195 F196I53-L192 HydrophobicContact CD1-CD2 3.48Å; I53-L192 VanDerWaalsContact CD1-CD2 3.48Å; I53-L192 HydrophobicContact CD1-CG 4.16Å; A101-L192 HydrophobicContact CB-CD2 4.07Å; T104-L192 HydrophobicContact CG2-CD1 4Å; T104-L192 HydrophobicContact CG2-CD2 4.21Å; I188-L192 HydrophobicContact CG2-CD1 3.82Å; I188-L192 HydrophobicContact CG2-CG 3.96Å; I188-L192 WeakPolarHBondContact O-CG 3.14Å; I188-L192 PolarHBondContact O-N 3.33Å; D189-L192 PolarHBondContact O-N 3.06Å; L192-L194 VanDerWaalsContact C-N 3.32Å; L192-L194 PolarHBondContact O-N 3.16Å; L192-C195 PolarHBondContact O-N 2.92Å; L192-F196 WeakPolarHBondContact O-CD2 3.22Å; L192-F196 PolarHBondContact O-N 3Å
193A96.5Very high96.6Very high51 Ų5146.4 Ų46.442%0.42124%0.24SC..Hα-helixtrans-57.9-44.8176.900000111.8D189 P190 I191 F196 I197D189-A193 PolarHBondContact O-N 3.09Å; D189-A193 VanDerWaalsContact O-N 3.16Å; P190-A193 PolarHBondContact O-N 2.96Å; I191-A193 VanDerWaalsContact C-N 3.35Å; I191-A193 PolarHBondContact O-N 3.08Å; A193-F196 PolarHBondContact O-N 3.35Å; A193-I197 VanDerWaalsContact O-CG1 3.32Å; A193-I197 WeakPolarHBondContact O-CG1 3.39Å; A193-I197 PolarHBondContact O-N 2.9Å; A193-I197 VanDerWaalsContact O-N 3.14Å
194L96.6Very high96.7Very high55 Ų5549.3 Ų49.329%0.28826%0.256SS..Hα-helixtrans-64.1-43.5176.2-68.5171.4000112Y24 P190 I191 L192 F196 I197 F198Y24-L194 HydrophobicContact CE2-CB 3.93Å; P190-L194 VanDerWaalsContact O-CG 3.3Å; P190-L194 WeakPolarHBondContact O-CG 3.37Å; P190-L194 PolarHBondContact O-N 3.05Å; I191-L194 PolarHBondContact O-N 3.2Å; L192-L194 VanDerWaalsContact C-N 3.32Å; L192-L194 PolarHBondContact O-N 3.16Å; L194-F196 VanDerWaalsContact C-N 3.33Å; L194-F196 PolarHBondContact O-N 2.92Å; L194-I197 PolarHBondContact O-N 3.32Å; L194-F198 HydrophobicContact CB-CD2 4.49Å; L194-F198 HydrophobicContact CD2-CD2 4.44Å; L194-F198 HydrophobicContact CD2-CE2 4.1Å; L194-F198 WeakPolarHBondContact O-CB 3.34Å; L194-F198 WeakPolarHBondContact O-CD2 3.27Å; L194-F198 PolarHBondContact O-N 2.98Å
195C97.5Very high96.7Very high0 Ų049.6 Ų49.60%026%0.257CS..Hα-helixtrans-56.9-43.5176.7-71.90000112.4Y24 E97 A101 I191 L192 S199Y24-C195 WeakPolarHBondContact OH-CA 3.38Å; E97-C195 HydrophobicContact CB-CB 4.5Å; A101-C195 HydrophobicContact CB-CB 4.22Å; I191-C195 PolarHBondContact O-N 3.17Å; I191-C195 PolarHBondContact O-SG 2.98Å; L192-C195 PolarHBondContact O-N 2.92Å; C195-S199 WeakPolarHBondContact O-CB 3.34Å; C195-S199 PolarHBondContact O-N 2.92Å; C195-S199 PolarHBondContact O-OG 3.41Å
196F97Very high96.8Very high61 Ų6148 Ų4827%0.26825%0.252SS..Hα-helixtrans-64.3-49175.6-78.9-67.8000112.4L98 A101 I102 I105 L192 A193 L194 S199 I200L98-F196 HydrophobicContact CD1-CD1 4.32Å; L98-F196 HydrophobicContact CD1-CE1 4.18Å; A101-F196 HydrophobicContact CB-CD2 4.14Å; A101-F196 HydrophobicContact CB-CE1 4.05Å; A101-F196 HydrophobicContact CB-CE2 3.61Å; A101-F196 HydrophobicContact CB-CZ 3.56Å; I102-F196 HydrophobicContact CG1-CE1 3.99Å; I102-F196 HydrophobicContact CG1-CZ 4.15Å; I105-F196 HydrophobicContact CD1-CE2 3.52Å; I105-F196 HydrophobicContact CD1-CZ 3.79Å; L192-F196 WeakPolarHBondContact O-CD2 3.22Å; L192-F196 PolarHBondContact O-N 3Å; A193-F196 PolarHBondContact O-N 3.35Å; L194-F196 VanDerWaalsContact C-N 3.33Å; L194-F196 PolarHBondContact O-N 2.92Å; F196-S199 PolarHBondContact O-N 2.95Å; F196-I200 WeakPolarHBondContact O-CG1 3.48Å; F196-I200 PolarHBondContact O-N 3.41Å; F196-I200 VanDerWaalsContact O-N 3.16Å
197I97.8Very high96.8Very high94 Ų9446.8 Ų46.848%0.48225%0.251SS..Hα-helixtrans-60.2-51.1-178.6-67.9167.3000110.4A193 L194 S199 I200 I201A193-I197 VanDerWaalsContact O-CG1 3.32Å; A193-I197 WeakPolarHBondContact O-CG1 3.39Å; A193-I197 PolarHBondContact O-N 2.9Å; A193-I197 VanDerWaalsContact O-N 3.14Å; L194-I197 PolarHBondContact O-N 3.32Å; I197-S199 PolarHBondContact O-N 3.29Å; I197-I200 PolarHBondContact O-N 3.43Å; I197-I201 HydrophobicContact CG2-CD1 3.88Å; I197-I201 WeakPolarHBondContact O-CG1 3.15Å; I197-I201 PolarHBondContact O-N 2.89Å; I197-I201 VanDerWaalsContact O-N 3.13Å
198F98Very high96.7Very high36 Ų3646.6 Ų46.616%0.15825%0.253CS..Hα-helixtrans-71.1-30.7-178.1-83-91.5000112.7F21 Y24 L194 I200 I201 K202F21-F198 AromaticContact CD1-CD1 3.96Å; F21-F198 HydrophobicContact CD1-CD1 3.96Å; F21-F198 HydrophobicContact CD1-CE1 4.22Å; F21-F198 HydrophobicContact CE1-CD1 4.19Å; Y24-F198 HydrophobicContact CD1-CB 4.17Å; Y24-F198 AromaticContact CD1-CD1 3.79Å; Y24-F198 HydrophobicContact CD1-CD1 3.79Å; Y24-F198 HydrophobicContact CD1-CE1 4.3Å; Y24-F198 AromaticContact CD1-CG 3.91Å; Y24-F198 HydrophobicContact CD1-CG 3.91Å; Y24-F198 HydrophobicContact CD2-CB 4.41Å; Y24-F198 HydrophobicContact CD2-CD1 4.08Å; Y24-F198 AromaticContact CD2-CD2 3.5Å; Y24-F198 HydrophobicContact CD2-CD2 3.5Å; Y24-F198 VanDerWaalsContact CD2-CD2 3.5Å; Y24-F198 HydrophobicContact CD2-CE1 4.21Å; Y24-F198 AromaticContact CD2-CE2 3.65Å; Y24-F198 HydrophobicContact CD2-CE2 3.65Å; Y24-F198 AromaticContact CD2-CG 3.73Å; Y24-F198 HydrophobicContact CD2-CG 3.73Å; Y24-F198 HydrophobicContact CD2-CZ 4.01Å; Y24-F198 HydrophobicContact CE1-CB 3.74Å; Y24-F198 HydrophobicContact CE1-CD1 4.24Å; Y24-F198 AromaticContact CE1-CG 3.95Å; Y24-F198 HydrophobicContact CE1-CG 3.95Å; Y24-F198 HydrophobicContact CE2-CB 4.03Å; Y24-F198 AromaticContact CE2-CD2 3.61Å; Y24-F198 HydrophobicContact CE2-CD2 3.61Å; Y24-F198 HydrophobicContact CE2-CE2 4.2Å; Y24-F198 AromaticContact CE2-CG 3.8Å; Y24-F198 HydrophobicContact CE2-CG 3.8Å; Y24-F198 HydrophobicContact CG-CB 4.46Å; Y24-F198 AromaticContact CG-CD1 3.67Å; Y24-F198 HydrophobicContact CG-CD1 3.67Å; Y24-F198 AromaticContact CG-CD2 3.98Å; Y24-F198 HydrophobicContact CG-CD2 3.98Å; Y24-F198 AromaticContact CG-CE1 3.78Å; Y24-F198 HydrophobicContact CG-CE1 3.78Å; Y24-F198 HydrophobicContact CG-CE2 4.09Å; Y24-F198 AromaticContact CG-CG 3.76Å; Y24-F198 HydrophobicContact CG-CG 3.76Å; Y24-F198 AromaticContact CG-CZ 3.99Å; Y24-F198 HydrophobicContact CG-CZ 3.99Å; Y24-F198 AromaticContact CZ-CG 3.87Å; L194-F198 HydrophobicContact CB-CD2 4.49Å; L194-F198 HydrophobicContact CD2-CD2 4.44Å; L194-F198 HydrophobicContact CD2-CE2 4.1Å; L194-F198 WeakPolarHBondContact O-CB 3.34Å; L194-F198 WeakPolarHBondContact O-CD2 3.27Å; L194-F198 PolarHBondContact O-N 2.98Å; F198-I200 VanDerWaalsContact C-N 3.33Å; F198-I200 PolarHBondContact O-N 2.82Å; F198-I201 PolarHBondContact O-N 3.19Å; F198-K202 VanDerWaalsContact O-CB 3.31Å; F198-K202 WeakPolarHBondContact O-CB 3.36Å; F198-K202 WeakPolarHBondContact O-CE 3.41Å; F198-K202 VanDerWaalsContact O-CG 3.26Å; F198-K202 WeakPolarHBondContact O-CG 3.48Å; F198-K202 PolarHBondContact O-N 3.13Å
199S97.6Very high96.6Very high3 Ų346.7 Ų46.72%0.02125%0.254CS..Hα-helixtrans-62.8-39.5173.1-70.40000112.2E97 C195 F196 I197 S203E97-S199 WeakPolarHBondContact CB-OG 3.43Å; E97-S199 PolarHBondContact OE2-OG 3.11Å; C195-S199 WeakPolarHBondContact O-CB 3.34Å; C195-S199 PolarHBondContact O-N 2.92Å; C195-S199 PolarHBondContact O-OG 3.41Å; F196-S199 PolarHBondContact O-N 2.95Å; I197-S199 PolarHBondContact O-N 3.29Å; S199-S203 VanDerWaalsContact O-CB 3.32Å; S199-S203 WeakPolarHBondContact O-CB 2.97Å; S199-S203 PolarHBondContact O-N 3.09Å; S199-S203 PolarHBondContact O-OG 3.09Å
200I97.7Very high96.5Very high106 Ų10646.6 Ų46.654%0.54425%0.252SS..Hα-helixtrans-65.2-48.3174.8-65.9166.6000110.3F196 I197 F198 K202 S203 I204F196-I200 WeakPolarHBondContact O-CG1 3.48Å; F196-I200 PolarHBondContact O-N 3.41Å; F196-I200 VanDerWaalsContact O-N 3.16Å; I197-I200 PolarHBondContact O-N 3.43Å; F198-I200 VanDerWaalsContact C-N 3.33Å; F198-I200 PolarHBondContact O-N 2.82Å; I200-K202 PolarHBondContact O-N 3.34Å; I200-S203 PolarHBondContact O-N 2.92Å; I200-I204 HydrophobicContact CG2-CD1 3.99Å; I200-I204 WeakPolarHBondContact O-CG1 3.42Å; I200-I204 PolarHBondContact O-N 3.32Å
201I98Very high96.3Very high64 Ų6450.3 Ų50.333%0.32826%0.258SS..Hα-helixtrans-60.5-46180-64.2168.3000110.8L17 F21 I197 F198 S203 I204 Y205L17-I201 HydrophobicContact CD2-CG2 4.3Å; F21-I201 HydrophobicContact CE1-CG2 3.8Å; F21-I201 HydrophobicContact CZ-CG2 3.97Å; I197-I201 HydrophobicContact CG2-CD1 3.88Å; I197-I201 WeakPolarHBondContact O-CG1 3.15Å; I197-I201 PolarHBondContact O-N 2.89Å; I197-I201 VanDerWaalsContact O-N 3.13Å; F198-I201 PolarHBondContact O-N 3.19Å; I201-S203 PolarHBondContact O-N 3.48Å; I201-I204 PolarHBondContact O-N 3.3Å; I201-Y205 VanDerWaalsContact O-CB 3.31Å; I201-Y205 WeakPolarHBondContact O-CB 3.42Å; I201-Y205 PolarHBondContact O-N 2.93Å
202K98.2Very high96Very high5 Ų553 Ų532%0.02227%0.271CS..Hα-helixtrans-64.2-38.4177.7-73.8-177.5-68.3168.10112.3F21 L90 T94 E97 F198 I200 Y205 L206F21-K202 HydrophobicContact CD1-CG 4.14Å; F21-K202 HydrophobicContact CD2-CG 4.5Å; F21-K202 HydrophobicContact CE1-CG 3.71Å; F21-K202 HydrophobicContact CE2-CG 4.1Å; F21-K202 HydrophobicContact CZ-CG 3.69Å; L90-K202 HydrophobicContact CD1-CD 3.63Å; L90-K202 HydrophobicContact CD1-CG 4.02Å; L90-K202 HydrophobicContact CG-CD 4.46Å; T94-K202 HydrophobicContact CG2-CB 4.14Å; T94-K202 VanDerWaalsContact OG1-CB 3.31Å; T94-K202 WeakPolarHBondContact OG1-CB 3.28Å; E97-K202 IonicContact OE1-NZ 2.75Å; E97-K202 PolarHBondContact OE1-NZ 2.95Å; E97-K202 VanDerWaalsContact OE2-CE 3.29Å; E97-K202 WeakPolarHBondContact OE2-CE 3.42Å; E97-K202 IonicContact OE2-NZ 2.6Å; E97-K202 PolarHBondContact OE2-NZ 3.27Å; F198-K202 VanDerWaalsContact O-CB 3.31Å; F198-K202 WeakPolarHBondContact O-CB 3.36Å; F198-K202 WeakPolarHBondContact O-CE 3.41Å; F198-K202 VanDerWaalsContact O-CG 3.26Å; F198-K202 WeakPolarHBondContact O-CG 3.48Å; F198-K202 PolarHBondContact O-N 3.13Å; I200-K202 PolarHBondContact O-N 3.34Å; K202-Y205 PolarHBondContact O-N 2.85Å; K202-L206 WeakPolarHBondContact O-CB 3.45Å; K202-L206 WeakPolarHBondContact O-CG 3.39Å; K202-L206 PolarHBondContact O-N 3.48Å
203S97.8Very high95.6Very high49 Ų4955.8 Ų55.834%0.34329%0.286SS..Hα-helixtrans-63-47.3176.7-61.80000111.5T94 S199 I200 I201 Y205 L206 L207T94-S203 WeakPolarHBondContact CG2-OG 3.37Å; S199-S203 VanDerWaalsContact O-CB 3.32Å; S199-S203 WeakPolarHBondContact O-CB 2.97Å; S199-S203 PolarHBondContact O-N 3.09Å; S199-S203 PolarHBondContact O-OG 3.09Å; I200-S203 PolarHBondContact O-N 2.92Å; I201-S203 PolarHBondContact O-N 3.48Å; S203-Y205 VanDerWaalsContact C-N 3.32Å; S203-Y205 PolarHBondContact O-N 3.45Å; S203-L206 PolarHBondContact O-N 3.45Å; S203-L207 WeakPolarHBondContact O-CG 3.28Å; S203-L207 PolarHBondContact O-N 2.98Å
204I97.5Very high95.2Very high93 Ų9359 Ų5948%0.47729%0.292SS..Hα-helixtrans-60.6-44.8175.8-66168.2000110.4I200 I201 L206 L207 I208I200-I204 HydrophobicContact CG2-CD1 3.99Å; I200-I204 WeakPolarHBondContact O-CG1 3.42Å; I200-I204 PolarHBondContact O-N 3.32Å; I201-I204 PolarHBondContact O-N 3.3Å; I204-L206 PolarHBondContact O-N 3.48Å; I204-L207 PolarHBondContact O-N 2.91Å; I204-I208 HydrophobicContact CG2-CD1 3.98Å; I204-I208 WeakPolarHBondContact O-CG1 3.38Å; I204-I208 PolarHBondContact O-N 3.34Å
205Y97.1Very high94.8Very high7 Ų764.5 Ų64.53%0.02731%0.309CS..Hα-helixtrans-61.6-42178.1173.2-100000113F14 L17 N18 F21 H86 L90 I201 K202 S203 I208 I209F14-Y205 AromaticContact CD1-CE2 3.42Å; F14-Y205 HydrophobicContact CD1-CE2 3.42Å; F14-Y205 VanDerWaalsContact CD1-CE2 3.42Å; F14-Y205 AromaticContact CD1-CZ 3.79Å; F14-Y205 WeakPolarHBondContact CD1-OH 3.42Å; F14-Y205 HydrophobicContact CE1-CD2 4.45Å; F14-Y205 AromaticContact CE1-CE2 3.61Å; F14-Y205 HydrophobicContact CE1-CE2 3.61Å; L17-Y205 HydrophobicContact CB-CD2 4.3Å; L17-Y205 HydrophobicContact CB-CE2 4.15Å; L17-Y205 HydrophobicContact CD1-CD2 3.36Å; L17-Y205 HydrophobicContact CD1-CE2 3.83Å; L17-Y205 HydrophobicContact CD1-CG 4.28Å; L17-Y205 HydrophobicContact CG-CD2 4.46Å; N18-Y205 PolarHBondContact ND2-OH 3.32Å; F21-Y205 AromaticContact CE2-CD1 3.84Å; F21-Y205 HydrophobicContact CE2-CD1 3.84Å; F21-Y205 HydrophobicContact CE2-CE1 4.06Å; F21-Y205 HydrophobicContact CE2-CG 4.09Å; F21-Y205 HydrophobicContact CZ-CD1 4.46Å; F21-Y205 HydrophobicContact CZ-CG 4.37Å; H86-Y205 AromaticContact CE1-CE1 3.98Å; H86-Y205 AromaticContact NE2-CE1 3.41Å; H86-Y205 WeakPolarHBondContact NE2-CE1 3.42Å; H86-Y205 AromaticContact NE2-CZ 3.73Å; H86-Y205 PolarHBondContact NE2-OH 2.94Å; H86-Y205 VanDerWaalsContact NE2-OH 3.09Å; L90-Y205 HydrophobicContact CD2-CD1 3.41Å; L90-Y205 VanDerWaalsContact CD2-CD1 3.41Å; L90-Y205 HydrophobicContact CD2-CE1 3.45Å; L90-Y205 VanDerWaalsContact CD2-CE1 3.45Å; I201-Y205 VanDerWaalsContact O-CB 3.31Å; I201-Y205 WeakPolarHBondContact O-CB 3.42Å; I201-Y205 PolarHBondContact O-N 2.93Å; K202-Y205 PolarHBondContact O-N 2.85Å; S203-Y205 VanDerWaalsContact C-N 3.32Å; S203-Y205 PolarHBondContact O-N 3.45Å; Y205-I208 PolarHBondContact O-N 3.47Å; Y205-I209 HydrophobicContact CD1-CD1 3.77Å; Y205-I209 HydrophobicContact CE1-CD1 3.2Å; Y205-I209 HydrophobicContact CE1-CG1 4.35Å; Y205-I209 HydrophobicContact CE2-CD1 4.1Å; Y205-I209 HydrophobicContact CG-CD1 4.42Å; Y205-I209 VanDerWaalsContact CZ-CD1 3.4Å; Y205-I209 WeakPolarHBondContact O-CG1 3.45Å; Y205-I209 PolarHBondContact O-N 3.14Å
206L97.1Very high94.1Very high15 Ų1567.9 Ų67.98%0.07933%0.333CS..Hα-helixtrans-61.9-44.4174.2-80.1168000111.6I87 L90 K202 S203 I204 I208 I209 I210I87-L206 HydrophobicContact CG2-CD2 4.32Å; L90-L206 HydrophobicContact CB-CD2 4.2Å; L90-L206 HydrophobicContact CD2-CD2 3.89Å; L90-L206 HydrophobicContact CD2-CG 3.92Å; L90-L206 HydrophobicContact CG-CD1 4.34Å; L90-L206 HydrophobicContact CG-CD2 4.27Å; L90-L206 HydrophobicContact CG-CG 4.27Å; K202-L206 WeakPolarHBondContact O-CB 3.45Å; K202-L206 WeakPolarHBondContact O-CG 3.39Å; K202-L206 PolarHBondContact O-N 3.48Å; S203-L206 PolarHBondContact O-N 3.45Å; I204-L206 PolarHBondContact O-N 3.48Å; L206-I208 VanDerWaalsContact C-N 3.32Å; L206-I208 PolarHBondContact O-N 3.26Å; L206-I209 PolarHBondContact O-N 3.21Å; L206-I210 VanDerWaalsContact O-CG1 3.29Å; L206-I210 WeakPolarHBondContact O-CG1 3.34Å; L206-I210 PolarHBondContact O-N 3.2Å
207L96.4Very high93.4Very high117 Ų11768.8 Ų68.861%0.61335%0.347SS*.Hα-helixtrans-60.2-42.1176.5-69.2173.4000111.8S203 I204 I210 W211S203-L207 WeakPolarHBondContact O-CG 3.28Å; S203-L207 PolarHBondContact O-N 2.98Å; I204-L207 PolarHBondContact O-N 2.91Å; L207-I210 PolarHBondContact O-N 2.03Å; L207-W211 VanDerWaalsContact O-CB 3.3Å; L207-W211 WeakPolarHBondContact O-CB 3.44Å; L207-W211 PolarHBondContact O-N 3.21Å
208I93.7Very high92.4Very high49 Ų4969.7 Ų69.725%0.25135%0.352SS..Hα-helixtrans-61.3-45.9175.3-69.5167.7000110.8W10 I204 Y205 L206 W211 M212W10-I208 HydrophobicContact CE3-CG2 4.44Å; W10-I208 HydrophobicContact CH2-CG2 4.08Å; W10-I208 HydrophobicContact CZ3-CG2 3.61Å; I204-I208 HydrophobicContact CG2-CD1 3.98Å; I204-I208 WeakPolarHBondContact O-CG1 3.38Å; I204-I208 PolarHBondContact O-N 3.34Å; Y205-I208 PolarHBondContact O-N 3.47Å; L206-I208 VanDerWaalsContact C-N 3.32Å; L206-I208 PolarHBondContact O-N 3.26Å; I208-W211 PolarHBondContact O-N 3.46Å; I208-M212 HydrophobicContact CG2-CG 4.49Å; I208-M212 HydrophobicContact CG2-SD 4.11Å; I208-M212 VanDerWaalsContact O-CG 3.31Å; I208-M212 WeakPolarHBondContact O-CG 3.39Å; I208-M212 PolarHBondContact O-N 2.86Å
209I92.3Very high90.8Very high2 Ų271.1 Ų71.11%0.0138%0.377CS..Hα-helixtrans-60.7-48.2178.1-71.1168.3000110.9F14 I87 Y205 L206 W211 M212 I213F14-I209 HydrophobicContact CE1-CD1 4.28Å; F14-I209 HydrophobicContact CE1-CG1 3.77Å; F14-I209 HydrophobicContact CZ-CG1 4.32Å; I87-I209 HydrophobicContact CD1-CG2 3.81Å; I87-I209 HydrophobicContact CG1-CG2 4.01Å; Y205-I209 HydrophobicContact CD1-CD1 3.77Å; Y205-I209 HydrophobicContact CE1-CD1 3.2Å; Y205-I209 HydrophobicContact CE1-CG1 4.35Å; Y205-I209 HydrophobicContact CE2-CD1 4.1Å; Y205-I209 HydrophobicContact CG-CD1 4.42Å; Y205-I209 VanDerWaalsContact CZ-CD1 3.4Å; Y205-I209 WeakPolarHBondContact O-CG1 3.45Å; Y205-I209 PolarHBondContact O-N 3.14Å; L206-I209 PolarHBondContact O-N 3.21Å; I209-W211 VanDerWaalsContact C-N 3.32Å; I209-W211 PolarHBondContact O-N 3.3Å; I209-M212 PolarHBondContact O-N 3.08Å; I209-I213 HydrophobicContact CG2-CD1 3.7Å; I209-I213 HydrophobicContact CG2-CG1 4.38Å; I209-I213 WeakPolarHBondContact O-CG1 3.38Å; I209-I213 PolarHBondContact O-N 3.27Å
210I92.6Very high89Confident91 Ų9178.1 Ų78.147%0.46741%0.407SS..Hα-helixtrans-61.2-44.8-179.1-68.3165.6000109.9L206 L207 M212 I213 H214L206-I210 VanDerWaalsContact O-CG1 3.29Å; L206-I210 WeakPolarHBondContact O-CG1 3.34Å; L206-I210 PolarHBondContact O-N 3.2Å; L207-I210 PolarHBondContact O-N 2.03Å; I210-M212 PolarHBondContact O-N 3.26Å; I210-I213 PolarHBondContact O-N 3.22Å; I210-H214 WeakPolarHBondContact O-CB 3.47Å; I210-H214 PolarHBondContact O-N 2.61Å
211W91.8Very high86.5Confident140 Ų14078.3 Ų78.353%0.5341%0.409SS..Hα-helixtrans-60.2-44.2176.3176.878.2000112.5L207 I208 I209 I213 H214 R215L207-W211 VanDerWaalsContact O-CB 3.3Å; L207-W211 WeakPolarHBondContact O-CB 3.44Å; L207-W211 PolarHBondContact O-N 3.21Å; I208-W211 PolarHBondContact O-N 3.46Å; I209-W211 VanDerWaalsContact C-N 3.32Å; I209-W211 PolarHBondContact O-N 3.3Å; W211-I213 PolarHBondContact O-N 3.44Å; W211-H214 PolarHBondContact O-N 2.99Å; W211-R215 WeakPolarHBondContact O-CB 3.23Å; W211-R215 PolarHBondContact O-N 3.03Å
212M88.3Confident84.3Confident57 Ų5780 Ų8028%0.28143%0.425SS..Hα-helixtrans-63-40.7176.3-73.2179.375.900112.4W10 F14 I208 I209 I210 S216W10-M212 HydrophobicContact CB-CE 4.32Å; W10-M212 HydrophobicContact CD2-CE 4.1Å; W10-M212 HydrophobicContact CD2-SD 4.13Å; W10-M212 HydrophobicContact CE3-CE 4.48Å; W10-M212 HydrophobicContact CE3-SD 3.99Å; W10-M212 HydrophobicContact CG-CE 4Å; W10-M212 HydrophobicContact CZ3-SD 4.35Å; F14-M212 HydrophobicContact CE2-CE 4.06Å; F14-M212 HydrophobicContact CE2-SD 4.04Å; F14-M212 HydrophobicContact CZ-CE 4.24Å; F14-M212 HydrophobicContact CZ-SD 3.62Å; I208-M212 HydrophobicContact CG2-CG 4.49Å; I208-M212 HydrophobicContact CG2-SD 4.11Å; I208-M212 VanDerWaalsContact O-CG 3.31Å; I208-M212 WeakPolarHBondContact O-CG 3.39Å; I208-M212 PolarHBondContact O-N 2.86Å; I209-M212 PolarHBondContact O-N 3.08Å; I210-M212 PolarHBondContact O-N 3.26Å; M212-S216 PolarHBondContact O-N 2.63Å
213I88.1Confident82Confident76 Ų7688.6 Ų88.639%0.3946%0.458SS..Hα-helixtrans-64.4-46.1176.9-69.9169.7000110.3T83 I87 I209 I210 W211 R215 S216 S217T83-I213 HydrophobicContact CG2-CD1 3.92Å; I87-I213 HydrophobicContact CD1-CD1 3.57Å; I209-I213 HydrophobicContact CG2-CD1 3.7Å; I209-I213 HydrophobicContact CG2-CG1 4.38Å; I209-I213 WeakPolarHBondContact O-CG1 3.38Å; I209-I213 PolarHBondContact O-N 3.27Å; I210-I213 PolarHBondContact O-N 3.22Å; W211-I213 PolarHBondContact O-N 3.44Å; I213-R215 PolarHBondContact O-N 3.39Å; I213-S216 PolarHBondContact O-N 2.93Å; I213-S217 PolarHBondContact O-N 2.85Å
214H88.6Confident79.5Confident119 Ų11991.3 Ų91.355%0.55147%0.473SS*.Hα-helixtrans-62-43.5178.9-168.3-84000111.8I210 W211 S216 S217 N218I210-H214 WeakPolarHBondContact O-CB 3.47Å; I210-H214 PolarHBondContact O-N 2.61Å; W211-H214 PolarHBondContact O-N 2.99Å; H214-S216 VanDerWaalsContact C-N 3.31Å; H214-S216 PolarHBondContact O-N 3.18Å; H214-S217 PolarHBondContact O-N 2.81Å; H214-S217 VanDerWaalsContact O-N 3.15Å; H214-N218 PolarHBondContact CE1-ND2 3.38Å; H214-N218 PolarHBondContact ND1-ND2 2.91Å; H214-N218 PolarHBondContact O-N 3.19Å
215R87.2Confident77Confident170 Ų17094.1 Ų94.164%0.64249%0.488SS*.Hα-helixtrans-60.1-40.8174.5-177.6176.2178.5159.21.5112.1W211 I213 S217 G219W211-R215 WeakPolarHBondContact O-CB 3.23Å; W211-R215 PolarHBondContact O-N 3.03Å; I213-R215 PolarHBondContact O-N 3.39Å; R215-S217 VanDerWaalsContact C-N 3.32Å; R215-G219 PolarHBondContact O-N 3.28Å
216S83.1Confident74.3Confident72 Ų72101.9 Ų101.950%0.50352%0.524SS..Hα-helixtrans-68.6-30.1176.6-177.30000113M212 I213 H214M212-S216 PolarHBondContact O-N 2.63Å; I213-S216 PolarHBondContact O-N 2.93Å; H214-S216 VanDerWaalsContact C-N 3.31Å; H214-S216 PolarHBondContact O-N 3.18Å
217S82.1Confident71.5Confident80 Ų80106.7 Ų106.756%0.55956%0.558SS**Hα-helixtrans-72-44.4177-165.50000111.3I213 H214 R215 G219 K220I213-S217 PolarHBondContact O-N 2.85Å; H214-S217 PolarHBondContact O-N 2.81Å; H214-S217 VanDerWaalsContact O-N 3.15Å; R215-S217 VanDerWaalsContact C-N 3.32Å; S217-G219 VanDerWaalsContact C-N 3.26Å; S217-G219 PolarHBondContact O-N 3.03Å; S217-K220 PolarHBondContact O-N 3.13Å
218N78.3Confident68.9Low112 Ų112110.3 Ų110.360%0.59959%0.591SS**Hα-helixtrans-69.7-21.9-179.8-70.52.2000113.6H214 K220H214-N218 PolarHBondContact CE1-ND2 3.38Å; H214-N218 PolarHBondContact ND1-ND2 2.91Å; H214-N218 PolarHBondContact O-N 3.19Å; N218-K220 VanDerWaalsContact C-N 3.34Å
219G63.7Low67.6Low66 Ų66113.4 Ų113.468%0.6861%0.608SS**THydrogen-bonded Turntrans-81.9-8.6176.200000114.6R215 S217R215-G219 PolarHBondContact O-N 3.28Å; S217-G219 VanDerWaalsContact C-N 3.26Å; S217-G219 PolarHBondContact O-N 3.03Å
220K59.2Low66.3Low150 Ų150119.2 Ų119.265%0.65264%0.639SS**SBendtrans-94.899.7171.4-68.7-176.6179.1-174.80107.4S217 N218S217-K220 PolarHBondContact O-N 3.13Å; N218-K220 VanDerWaalsContact C-N 3.34Å
221D45.3Very low64.9Low110 Ų110120.8 Ų120.859%0.58865%0.649SS**  trans-54.8126.9176.3-82.6-40.6000110.2Y223 T224D221-Y223 PolarHBondContact O-N 2.81Å; D221-T224 PolarHBondContact O-N 2.88Å; D221-T224 VanDerWaalsContact O-N 3.1Å; D221-T224 PolarHBondContact O-OG1 2.76Å
222P51.9Low63.3Low101 Ų101119.6 Ų119.666%0.65666%0.656SS**G310 helixtrans-59.6-19.7-179.820.3-29.5000112.9T224 L225P222-T224 PolarHBondContact O-N 3.36Å; P222-L225 PolarHBondContact O-N 2.89Å
223Y49.4Very low61.7Low185 Ų185123.6 Ų123.673%0.72568%0.679SS**G310 helixtrans-69-8.7176.9-60.9-72.3000114.9D221D221-Y223 PolarHBondContact O-N 2.81Å
224T46.7Very low60Low106 Ų106126.7 Ų126.765%0.6570%0.699SS**G310 helixtrans-87.6-5.117546.40000114.3D221 P222D221-T224 PolarHBondContact O-N 2.88Å; D221-T224 VanDerWaalsContact O-N 3.1Å; D221-T224 PolarHBondContact O-OG1 2.76Å; P222-T224 PolarHBondContact O-N 3.36Å
225L45.1Very low57.9Low152 Ų152127.3 Ų127.380%0.79671%0.709SS**SBendtrans-94.1-12.2175.2-113.991.6000114.7P222P222-L225 PolarHBondContact O-N 2.89Å
226E38.9Very low55.7Low169 Ų169124 Ų12479%0.7971%0.714SS**THydrogen-bonded Turntrans-93.27.2-178.2-73.4-170.3151.700114.6
227C38.9Very low53.4Low116 Ų116128.3 Ų128.378%0.78473%0.732SS**THydrogen-bonded Turntrans-111.118177.5-74.70000115
228C41.1Very low50.8Low193 Ų193132.7 Ų132.7100%1.30475%0.748SS**  trans-135.70172.2-77.20000111.9

Retrieved 228 of 228 residues in 75.4 ms (Link to these results)

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