A0A5K4FCU7_SCHMA Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession A0A5K4FCU7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 225 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
1M58.5Low74.9Confident214 Ų214114.4 Ų114.4100%1.05458%0.58SS**  0-47.10-161.8160.616600112.1C3 I4 S5M1-C3 PolarHBondContact O-N 3.17Å; M1-I4 PolarHBondContact O-N 2.88Å; M1-I4 VanDerWaalsContact O-N 3.17Å; M1-S5 PolarHBondContact O-N 3.09Å
2M57.3Low75.9Confident159 Ų159113.2 Ų113.278%0.78357%0.571SS**Hα-helixtrans-59.6-39.9-176.8-161.9163.874.300115.9I4 S5 L6M2-I4 VanDerWaalsContact C-N 3.26Å; M2-I4 PolarHBondContact O-N 3.33Å; M2-S5 PolarHBondContact O-N 3.32Å; M2-S5 PolarHBondContact O-OG 3.05Å; M2-L6 PolarHBondContact O-N 3.43Å; M2-L6 VanDerWaalsContact O-N 3.09Å
3C65.6Low77Confident106 Ų106115.5 Ų115.572%0.71657%0.574SS**Hα-helixtrans-66-29.1176.9-56.80000113.1M1 S7M1-C3 PolarHBondContact O-N 3.17Å; C3-S7 WeakPolarHBondContact O-CB 3.33Å; C3-S7 PolarHBondContact O-N 2.98Å; C3-S7 PolarHBondContact O-OG 3.28Å
4I70.2Confident78.1Confident103 Ų103111.2 Ų111.253%0.52855%0.554SS.*Hα-helixtrans-77.3-35179.3-61.1173.5000110.5M1 M2 S7 K8M1-I4 PolarHBondContact O-N 2.88Å; M1-I4 VanDerWaalsContact O-N 3.17Å; M2-I4 VanDerWaalsContact C-N 3.26Å; M2-I4 PolarHBondContact O-N 3.33Å; I4-S7 WeakPolarHBondContact CA-OG 3.45Å; I4-S7 PolarHBondContact O-OG 3.33Å; I4-K8 WeakPolarHBondContact O-CG 3.41Å; I4-K8 PolarHBondContact O-N 3.2Å
5S72.6Confident79Confident52 Ų52105.9 Ų105.936%0.36453%0.526SS..Hα-helixtrans-69.2-46.1174.955.70000111.4M1 M2 S7 K8 E9M1-S5 PolarHBondContact O-N 3.09Å; M2-S5 PolarHBondContact O-N 3.32Å; M2-S5 PolarHBondContact O-OG 3.05Å; S5-S7 VanDerWaalsContact C-N 3.3Å; S5-S7 PolarHBondContact O-N 2.98Å; S5-K8 PolarHBondContact O-N 3.08Å; S5-K8 VanDerWaalsContact O-N 3.11Å; S5-E9 PolarHBondContact O-N 3.11Å
6L74.6Confident79.8Confident120 Ų120103.7 Ų103.763%0.62852%0.516SS*.Hα-helixtrans-58.6-42.6178.4-175.665.3000112M2 F10M2-L6 PolarHBondContact O-N 3.43Å; M2-L6 VanDerWaalsContact O-N 3.09Å; L6-F10 WeakPolarHBondContact O-CB 3.49Å; L6-F10 PolarHBondContact O-N 3.21Å; L6-F10 VanDerWaalsContact O-N 3.08Å
7S83.7Confident80.7Confident50 Ų50102.9 Ų102.935%0.3552%0.518SS..Hα-helixtrans-65.4-39176.954.50000112.7C3 I4 S5 F10 W11C3-S7 WeakPolarHBondContact O-CB 3.33Å; C3-S7 PolarHBondContact O-N 2.98Å; C3-S7 PolarHBondContact O-OG 3.28Å; I4-S7 WeakPolarHBondContact CA-OG 3.45Å; I4-S7 PolarHBondContact O-OG 3.33Å; S5-S7 VanDerWaalsContact C-N 3.3Å; S5-S7 PolarHBondContact O-N 2.98Å; S7-F10 PolarHBondContact O-N 3.4Å; S7-W11 PolarHBondContact O-N 3.31Å
8K81.6Confident81.5Confident131 Ų13199.4 Ų99.457%0.5750%0.501SS*.Hα-helixtrans-63.9-47.8177-75.8177.5180-174.30112.4I4 S5 F10 W11 Q12I4-K8 WeakPolarHBondContact O-CG 3.41Å; I4-K8 PolarHBondContact O-N 3.2Å; S5-K8 PolarHBondContact O-N 3.08Å; S5-K8 VanDerWaalsContact O-N 3.11Å; K8-F10 VanDerWaalsContact C-N 3.29Å; K8-F10 PolarHBondContact O-N 3.44Å; K8-W11 PolarHBondContact O-N 3.07Å; K8-Q12 WeakPolarHBondContact O-CG 3.37Å; K8-Q12 PolarHBondContact O-N 3.46Å
9E85.2Confident82.2Confident103 Ų10394.2 Ų94.248%0.48148%0.475SS..Hα-helixtrans-61.6-40178.7-70.6176.2-165.300111.6S5 Q12 K13S5-E9 PolarHBondContact O-N 3.11Å; E9-Q12 PolarHBondContact O-N 3.43Å; E9-K13 WeakPolarHBondContact O-CG 3.42Å; E9-K13 PolarHBondContact O-N 3.29Å
10F88.9Confident82.8Confident120 Ų12092.3 Ų92.353%0.52647%0.468SS..Hα-helixtrans-60.2-49.2175.1177.9-102000112.1L6 S7 K8 Q12 K13 I14L6-F10 WeakPolarHBondContact O-CB 3.49Å; L6-F10 PolarHBondContact O-N 3.21Å; L6-F10 VanDerWaalsContact O-N 3.08Å; S7-F10 PolarHBondContact O-N 3.4Å; K8-F10 VanDerWaalsContact C-N 3.29Å; K8-F10 PolarHBondContact O-N 3.44Å; F10-Q12 PolarHBondContact O-N 2.96Å; F10-K13 PolarHBondContact O-N 3.05Å; F10-I14 HydrophobicContact CD1-CD1 3.96Å; F10-I14 HydrophobicContact CE1-CD1 3.34Å; F10-I14 HydrophobicContact CE1-CG1 4.49Å; F10-I14 HydrophobicContact CE2-CD1 4.11Å; F10-I14 HydrophobicContact CZ-CD1 3.44Å; F10-I14 VanDerWaalsContact CZ-CD1 3.44Å; F10-I14 HydrophobicContact CZ-CG1 4.44Å; F10-I14 PolarHBondContact O-N 3.39Å; F10-I14 VanDerWaalsContact O-N 3.12Å
11W85.4Confident83.5Confident100 Ų10091.1 Ų91.138%0.37946%0.463SS..Hα-helixtrans-64-38.1178-77.8116.5000113S7 K8 I14 F15 I209 M213S7-W11 PolarHBondContact O-N 3.31Å; K8-W11 PolarHBondContact O-N 3.07Å; W11-I14 PolarHBondContact O-N 3.43Å; W11-F15 WeakPolarHBondContact O-CB 3.44Å; W11-F15 PolarHBondContact O-N 3.46Å; W11-I209 HydrophobicContact CE3-CG2 4.11Å; W11-I209 HydrophobicContact CH2-CD1 4.17Å; W11-I209 HydrophobicContact CH2-CG2 3.86Å; W11-I209 HydrophobicContact CZ3-CD1 4.09Å; W11-I209 HydrophobicContact CZ3-CG2 3.52Å; W11-M213 HydrophobicContact CB-SD 4.43Å; W11-M213 HydrophobicContact CD2-SD 4.32Å; W11-M213 HydrophobicContact CG-SD 4.3Å
12Q87.7Confident85.3Confident100 Ų10081 Ų8147%0.46741%0.413SS..Hα-helixtrans-62.1-43.8175.6-76.1175.4-3200111.8K8 E9 F10 F15 I16K8-Q12 WeakPolarHBondContact O-CG 3.37Å; K8-Q12 PolarHBondContact O-N 3.46Å; E9-Q12 PolarHBondContact O-N 3.43Å; F10-Q12 PolarHBondContact O-N 2.96Å; Q12-F15 PolarHBondContact O-N 2.71Å; Q12-I16 VanDerWaalsContact O-CG1 3.28Å; Q12-I16 WeakPolarHBondContact O-CG1 3.39Å; Q12-I16 PolarHBondContact O-N 3.08Å
13K90.4Very high87.2Confident143 Ų14375.2 Ų75.262%0.62239%0.385SS*.Hα-helixtrans-61.3-46.5176.4-73177.2-178.6177.70111.7E9 F10 F15 I16 T17E9-K13 WeakPolarHBondContact O-CG 3.42Å; E9-K13 PolarHBondContact O-N 3.29Å; F10-K13 PolarHBondContact O-N 3.05Å; K13-F15 VanDerWaalsContact C-N 3.34Å; K13-F15 PolarHBondContact O-N 2.99Å; K13-I16 PolarHBondContact O-N 3.28Å; K13-T17 WeakPolarHBondContact O-CB 3.33Å; K13-T17 PolarHBondContact O-N 3.25Å; K13-T17 PolarHBondContact O-OG1 3.12Å
14I91.3Very high88.7Confident56 Ų5674.7 Ų74.729%0.28737%0.374SS..Hα-helixtrans-59-46.5176.4-72177.3000111.1F10 W11 I16 T17 L18F10-I14 HydrophobicContact CD1-CD1 3.96Å; F10-I14 HydrophobicContact CE1-CD1 3.34Å; F10-I14 HydrophobicContact CE1-CG1 4.49Å; F10-I14 HydrophobicContact CE2-CD1 4.11Å; F10-I14 HydrophobicContact CZ-CD1 3.44Å; F10-I14 VanDerWaalsContact CZ-CD1 3.44Å; F10-I14 HydrophobicContact CZ-CG1 4.44Å; F10-I14 PolarHBondContact O-N 3.39Å; F10-I14 VanDerWaalsContact O-N 3.12Å; W11-I14 PolarHBondContact O-N 3.43Å; I14-I16 PolarHBondContact O-N 3Å; I14-T17 PolarHBondContact O-N 3.21Å; I14-L18 HydrophobicContact CG2-CD1 3.67Å; I14-L18 HydrophobicContact CG2-CG 4.24Å; I14-L18 WeakPolarHBondContact O-CB 3.42Å; I14-L18 WeakPolarHBondContact O-CG 3.48Å; I14-L18 PolarHBondContact O-N 3.48Å
15F91.5Very high90Very high31 Ų3169.9 Ų69.914%0.13635%0.35CS..Hα-helixtrans-61.2-44.7-179.9-174.1-82.7000111.6W11 Q12 K13 N19 G72 L76 H87 Y206W11-F15 WeakPolarHBondContact O-CB 3.44Å; W11-F15 PolarHBondContact O-N 3.46Å; Q12-F15 PolarHBondContact O-N 2.71Å; K13-F15 VanDerWaalsContact C-N 3.34Å; K13-F15 PolarHBondContact O-N 2.99Å; F15-N19 VanDerWaalsContact CD1-ND2 3.27Å; F15-N19 WeakPolarHBondContact CD1-ND2 3.39Å; F15-N19 WeakPolarHBondContact CE1-ND2 3.46Å; F15-N19 WeakPolarHBondContact CZ-ND2 3.41Å; F15-N19 WeakPolarHBondContact O-CB 3.34Å; F15-N19 PolarHBondContact O-N 3.08Å; F15-N19 PolarHBondContact O-ND2 3.3Å; F15-G72 WeakPolarHBondContact CE1-O 3.44Å; F15-L76 HydrophobicContact CD1-CD1 3.84Å; F15-L76 HydrophobicContact CD1-CD2 3.63Å; F15-L76 HydrophobicContact CD1-CG 3.82Å; F15-L76 HydrophobicContact CE1-CD1 4.13Å; F15-L76 HydrophobicContact CE1-CD2 3.97Å; F15-L76 HydrophobicContact CE1-CG 3.82Å; F15-L76 HydrophobicContact CG-CD2 4.34Å; F15-H87 AromaticContact CZ-NE2 3.93Å; F15-Y206 AromaticContact CD2-CE2 3.63Å; F15-Y206 HydrophobicContact CD2-CE2 3.63Å; F15-Y206 AromaticContact CD2-CZ 3.93Å; F15-Y206 WeakPolarHBondContact CD2-OH 3.37Å; F15-Y206 AromaticContact CE2-CE2 3.88Å; F15-Y206 HydrophobicContact CE2-CE2 3.88Å; F15-Y206 AromaticContact CE2-CZ 3.66Å; F15-Y206 WeakPolarHBondContact CE2-OH 3.41Å; F15-Y206 HydrophobicContact CG-CE2 4.37Å; F15-Y206 WeakPolarHBondContact CZ-OH 3.26Å
16I92.5Very high91.2Very high71 Ų7167.4 Ų67.436%0.36433%0.332SS..Hα-helixtrans-59.1-50.7175.6-71.9166.9000110.5Q12 K13 I14 L18 N19 T20 Y73 L76Q12-I16 VanDerWaalsContact O-CG1 3.28Å; Q12-I16 WeakPolarHBondContact O-CG1 3.39Å; Q12-I16 PolarHBondContact O-N 3.08Å; K13-I16 PolarHBondContact O-N 3.28Å; I14-I16 PolarHBondContact O-N 3Å; I16-L18 PolarHBondContact O-N 3.11Å; I16-N19 PolarHBondContact O-N 2.98Å; I16-T20 PolarHBondContact O-N 3.04Å; I16-T20 PolarHBondContact O-OG1 2.93Å; I16-Y73 HydrophobicContact CG2-CE1 4.19Å; I16-Y73 PolarHBondContact O-OH 3.44Å; I16-L76 HydrophobicContact CD1-CD1 4Å; I16-L76 HydrophobicContact CG1-CD1 3.32Å
17T94.3Very high92.3Very high91 Ų9165 Ų6556%0.55832%0.32SS*.Hα-helixtrans-61.3-44.6-178.4-59.60000112K13 I14 T20 L21K13-T17 WeakPolarHBondContact O-CB 3.33Å; K13-T17 PolarHBondContact O-N 3.25Å; K13-T17 PolarHBondContact O-OG1 3.12Å; I14-T17 PolarHBondContact O-N 3.21Å; T17-T20 WeakPolarHBondContact O-CB 3.29Å; T17-T20 PolarHBondContact O-N 3.21Å; T17-L21 WeakPolarHBondContact O-CB 3.33Å; T17-L21 PolarHBondContact O-N 2.98Å
18L95.2Very high92.9Very high39 Ų3966.5 Ų66.520%0.20432%0.323CS..Hα-helixtrans-67.4-41.1179.4-71.3175.4000112I14 I16 T20 L21 F22 I202 Y206I14-L18 HydrophobicContact CG2-CD1 3.67Å; I14-L18 HydrophobicContact CG2-CG 4.24Å; I14-L18 WeakPolarHBondContact O-CB 3.42Å; I14-L18 WeakPolarHBondContact O-CG 3.48Å; I14-L18 PolarHBondContact O-N 3.48Å; I16-L18 PolarHBondContact O-N 3.11Å; L18-T20 VanDerWaalsContact C-N 3.34Å; L18-T20 PolarHBondContact O-N 3.13Å; L18-L21 HydrophobicContact CD2-CD2 4.44Å; L18-L21 WeakPolarHBondContact O-CB 3.49Å; L18-L21 PolarHBondContact O-N 3.33Å; L18-F22 HydrophobicContact CB-CE2 4.06Å; L18-F22 HydrophobicContact CB-CZ 4.26Å; L18-F22 WeakPolarHBondContact O-CD2 3.27Å; L18-F22 WeakPolarHBondContact O-CG 3.28Å; L18-F22 PolarHBondContact O-N 3.3Å; L18-I202 HydrophobicContact CD2-CG2 4.06Å; L18-Y206 HydrophobicContact CB-CD2 4.19Å; L18-Y206 HydrophobicContact CB-CE2 4.37Å; L18-Y206 HydrophobicContact CD1-CD2 3.69Å; L18-Y206 HydrophobicContact CD1-CE2 4.47Å; L18-Y206 HydrophobicContact CD1-CG 4.48Å
19N94.9Very high93.6Very high1 Ų160.3 Ų60.31%0.00530%0.296CS..Hα-helixtrans-65.2-36.7174.6-78.8-84.7000112.1F15 I16 L21 F22 I23 S69 Y73 H87 Y206F15-N19 VanDerWaalsContact CD1-ND2 3.27Å; F15-N19 WeakPolarHBondContact CD1-ND2 3.39Å; F15-N19 WeakPolarHBondContact CE1-ND2 3.46Å; F15-N19 WeakPolarHBondContact CZ-ND2 3.41Å; F15-N19 WeakPolarHBondContact O-CB 3.34Å; F15-N19 PolarHBondContact O-N 3.08Å; F15-N19 PolarHBondContact O-ND2 3.3Å; I16-N19 PolarHBondContact O-N 2.98Å; N19-L21 VanDerWaalsContact C-N 3.32Å; N19-L21 PolarHBondContact O-N 2.92Å; N19-F22 PolarHBondContact O-N 3.09Å; N19-I23 WeakPolarHBondContact O-CG1 3.38Å; N19-I23 PolarHBondContact O-N 3.39Å; N19-S69 PolarHBondContact OD1-O 3.39Å; N19-Y73 HydrophobicContact CB-CE2 4.07Å; N19-H87 PolarHBondContact OD1-CE1 3.49Å; N19-Y206 PolarHBondContact ND2-OH 3.34Å; N19-Y206 PolarHBondContact OD1-OH 2.93Å
20T95.6Very high94.1Very high56 Ų5657.3 Ų57.334%0.34428%0.283SS..Hα-helixtrans-58.7-48.7171-51.70000110.3I16 T17 L18 F22 I23 L24 Y73I16-T20 PolarHBondContact O-N 3.04Å; I16-T20 PolarHBondContact O-OG1 2.93Å; T17-T20 WeakPolarHBondContact O-CB 3.29Å; T17-T20 PolarHBondContact O-N 3.21Å; L18-T20 VanDerWaalsContact C-N 3.34Å; L18-T20 PolarHBondContact O-N 3.13Å; T20-F22 VanDerWaalsContact C-N 3.3Å; T20-F22 PolarHBondContact O-N 3.35Å; T20-I23 PolarHBondContact O-N 3.35Å; T20-L24 HydrophobicContact CG2-CD1 4.29Å; T20-L24 WeakPolarHBondContact O-CG 3.42Å; T20-L24 PolarHBondContact O-N 3.23Å; T20-Y73 VanDerWaalsContact CA-OH 3.29Å; T20-Y73 WeakPolarHBondContact CA-OH 3.3Å; T20-Y73 WeakPolarHBondContact CB-OH 3.49Å; T20-Y73 PolarHBondContact N-OH 3.46Å; T20-Y73 PolarHBondContact OG1-OH 3.24Å
21L96.6Very high94.4Very high68 Ų6855.9 Ų55.936%0.35628%0.28SS..Hα-helixtrans-60.9-40.5-178.9-176.265.1000111.4T17 L18 N19 L24 F25 F199T17-L21 WeakPolarHBondContact O-CB 3.33Å; T17-L21 PolarHBondContact O-N 2.98Å; L18-L21 HydrophobicContact CD2-CD2 4.44Å; L18-L21 WeakPolarHBondContact O-CB 3.49Å; L18-L21 PolarHBondContact O-N 3.33Å; N19-L21 VanDerWaalsContact C-N 3.32Å; N19-L21 PolarHBondContact O-N 2.92Å; L21-L24 PolarHBondContact O-N 3.25Å; L21-F25 WeakPolarHBondContact O-CB 3.36Å; L21-F25 PolarHBondContact O-N 3.17Å; L21-F199 HydrophobicContact CD1-CE1 4.32Å; L21-F199 HydrophobicContact CD1-CZ 4.22Å; L21-F199 HydrophobicContact CD2-CE1 4.24Å; L21-F199 HydrophobicContact CG-CE1 3.84Å; L21-F199 HydrophobicContact CG-CZ 4.22Å
22F96.9Very high94.9Very high0 Ų052.2 Ų52.20%027%0.268CS..Hα-helixtrans-67.3-38.2175.9-60.7-32.5000113L18 N19 T20 F25 N26 S69 M91 F199 I202 Q203 Y206L18-F22 HydrophobicContact CB-CE2 4.06Å; L18-F22 HydrophobicContact CB-CZ 4.26Å; L18-F22 WeakPolarHBondContact O-CD2 3.27Å; L18-F22 WeakPolarHBondContact O-CG 3.28Å; L18-F22 PolarHBondContact O-N 3.3Å; N19-F22 PolarHBondContact O-N 3.09Å; T20-F22 VanDerWaalsContact C-N 3.3Å; T20-F22 PolarHBondContact O-N 3.35Å; F22-F25 PolarHBondContact O-N 3.01Å; F22-N26 WeakPolarHBondContact O-CB 3.44Å; F22-N26 PolarHBondContact O-N 3.46Å; F22-N26 PolarHBondContact O-ND2 3.42Å; F22-S69 WeakPolarHBondContact CB-OG 3.36Å; F22-M91 HydrophobicContact CD2-SD 4.38Å; F22-F199 HydrophobicContact CD1-CD1 4.12Å; F22-F199 HydrophobicContact CD1-CE1 4.46Å; F22-F199 HydrophobicContact CE1-CD1 4.39Å; F22-I202 HydrophobicContact CE1-CG2 3.86Å; F22-I202 HydrophobicContact CZ-CG2 4.08Å; F22-Q203 HydrophobicContact CD1-CG 4.02Å; F22-Q203 HydrophobicContact CE1-CG 3.58Å; F22-Q203 HydrophobicContact CE2-CG 4.44Å; F22-Q203 HydrophobicContact CZ-CB 4.45Å; F22-Q203 HydrophobicContact CZ-CG 3.82Å; F22-Y206 AromaticContact CE2-CD1 3.66Å; F22-Y206 HydrophobicContact CE2-CD1 3.66Å; F22-Y206 HydrophobicContact CE2-CD2 4.09Å; F22-Y206 AromaticContact CE2-CE1 3.94Å; F22-Y206 HydrophobicContact CE2-CE1 3.94Å; F22-Y206 HydrophobicContact CE2-CE2 4.33Å; F22-Y206 AromaticContact CE2-CG 3.72Å; F22-Y206 HydrophobicContact CE2-CG 3.72Å; F22-Y206 HydrophobicContact CZ-CD1 4.24Å; F22-Y206 HydrophobicContact CZ-CG 4.04Å
23I97.3Very high95.2Very high38 Ų3847.5 Ų47.520%0.19525%0.246CC..Hα-helixtrans-61.2-49.2172.5-70.3179.8000110.3N19 T20 F25 N26 I27 S69 Y73N19-I23 WeakPolarHBondContact O-CG1 3.38Å; N19-I23 PolarHBondContact O-N 3.39Å; T20-I23 PolarHBondContact O-N 3.35Å; I23-F25 VanDerWaalsContact C-N 3.31Å; I23-F25 PolarHBondContact O-N 3.31Å; I23-N26 PolarHBondContact O-N 3.05Å; I23-I27 HydrophobicContact CG2-CD1 3.77Å; I23-I27 HydrophobicContact CG2-CG1 4.38Å; I23-I27 WeakPolarHBondContact O-CG1 3.37Å; I23-I27 PolarHBondContact O-N 3.02Å; I23-S69 VanDerWaalsContact CG1-CB 3.43Å; I23-Y73 HydrophobicContact CD1-CD2 4.09Å; I23-Y73 HydrophobicContact CD1-CE2 3.6Å
24L97.1Very high95.5Very high95 Ų9544 Ų4450%0.49723%0.233SC..Hα-helixtrans-59.4-44.4-179.9-67.8175.6000111.7T20 L21 I27 I28T20-L24 HydrophobicContact CG2-CD1 4.29Å; T20-L24 WeakPolarHBondContact O-CG 3.42Å; T20-L24 PolarHBondContact O-N 3.23Å; L21-L24 PolarHBondContact O-N 3.25Å; L24-I27 PolarHBondContact O-N 2.57Å; L24-I28 WeakPolarHBondContact O-CG1 3.5Å; L24-I28 PolarHBondContact O-N 3.35Å
25F97.3Very high95.6Very high2 Ų244.3 Ų44.31%0.00924%0.235CC..Hα-helixtrans-59.1-48.2174.6162.9-110.6000112.4L21 F22 I23 I27 I28 L29 E98 L195 F199L21-F25 WeakPolarHBondContact O-CB 3.36Å; L21-F25 PolarHBondContact O-N 3.17Å; F22-F25 PolarHBondContact O-N 3.01Å; I23-F25 VanDerWaalsContact C-N 3.31Å; I23-F25 PolarHBondContact O-N 3.31Å; F25-I27 VanDerWaalsContact C-N 3.3Å; F25-I27 PolarHBondContact O-N 2.96Å; F25-I28 WeakPolarHBondContact O-CB 3.34Å; F25-I28 PolarHBondContact O-N 2.97Å; F25-I28 VanDerWaalsContact O-N 3.07Å; F25-L29 HydrophobicContact CD1-CD1 4.37Å; F25-L29 HydrophobicContact CD2-CD2 4.35Å; F25-L29 HydrophobicContact CD2-CG 4.19Å; F25-L29 HydrophobicContact CE1-CD1 3.7Å; F25-L29 HydrophobicContact CE1-CG 4.29Å; F25-L29 HydrophobicContact CE2-CD1 3.93Å; F25-L29 HydrophobicContact CE2-CD2 3.68Å; F25-L29 HydrophobicContact CE2-CG 3.77Å; F25-L29 HydrophobicContact CZ-CD1 3.45Å; F25-L29 VanDerWaalsContact CZ-CD1 3.45Å; F25-L29 HydrophobicContact CZ-CD2 4.02Å; F25-L29 HydrophobicContact CZ-CG 3.86Å; F25-L29 WeakPolarHBondContact O-CG 3.46Å; F25-L29 PolarHBondContact O-N 3.47Å; F25-E98 VanDerWaalsContact CE1-OE1 3.31Å; F25-E98 WeakPolarHBondContact CE1-OE1 3.36Å; F25-L195 HydrophobicContact CD2-CB 4.46Å; F25-L195 HydrophobicContact CE2-CB 3.92Å; F25-F199 HydrophobicContact CB-CD1 3.68Å; F25-F199 HydrophobicContact CB-CE1 3.31Å; F25-F199 HydrophobicContact CB-CE2 4.37Å; F25-F199 HydrophobicContact CB-CG 4.33Å; F25-F199 HydrophobicContact CB-CZ 3.71Å; F25-F199 HydrophobicContact CD1-CB 4.14Å; F25-F199 AromaticContact CD1-CD1 3.66Å; F25-F199 HydrophobicContact CD1-CD1 3.66Å; F25-F199 HydrophobicContact CD1-CE1 4.22Å; F25-F199 AromaticContact CD1-CG 3.94Å; F25-F199 HydrophobicContact CD1-CG 3.94Å; F25-F199 HydrophobicContact CD2-CB 4.17Å; F25-F199 AromaticContact CD2-CD1 3.81Å; F25-F199 HydrophobicContact CD2-CD1 3.81Å; F25-F199 AromaticContact CD2-CD2 3.55Å; F25-F199 HydrophobicContact CD2-CD2 3.55Å; F25-F199 HydrophobicContact CD2-CE1 4.01Å; F25-F199 AromaticContact CD2-CE2 3.79Å; F25-F199 HydrophobicContact CD2-CE2 3.79Å; F25-F199 AromaticContact CD2-CG 3.55Å; F25-F199 HydrophobicContact CD2-CG 3.55Å; F25-F199 HydrophobicContact CD2-CZ 4.02Å; F25-F199 HydrophobicContact CE1-CB 3.76Å; F25-F199 HydrophobicContact CE1-CD1 4.18Å; F25-F199 HydrophobicContact CE1-CG 4.05Å; F25-F199 HydrophobicContact CE2-CB 3.82Å; F25-F199 HydrophobicContact CE2-CD1 4.33Å; F25-F199 AromaticContact CE2-CD2 3.76Å; F25-F199 HydrophobicContact CE2-CD2 3.76Å; F25-F199 HydrophobicContact CE2-CE2 4.41Å; F25-F199 AromaticContact CE2-CG 3.7Å; F25-F199 HydrophobicContact CE2-CG 3.7Å; F25-F199 HydrophobicContact CG-CB 4.3Å; F25-F199 AromaticContact CG-CD1 3.42Å; F25-F199 HydrophobicContact CG-CD1 3.42Å; F25-F199 VanDerWaalsContact CG-CD1 3.42Å; F25-F199 HydrophobicContact CG-CD2 4.08Å; F25-F199 AromaticContact CG-CE1 3.6Å; F25-F199 HydrophobicContact CG-CE1 3.6Å; F25-F199 HydrophobicContact CG-CE2 4.25Å; F25-F199 AromaticContact CG-CG 3.67Å; F25-F199 HydrophobicContact CG-CG 3.67Å; F25-F199 HydrophobicContact CG-CZ 4.02Å; F25-F199 HydrophobicContact CZ-CB 3.58Å; F25-F199 HydrophobicContact CZ-CD1 4.48Å; F25-F199 HydrophobicContact CZ-CD2 4.41Å; F25-F199 AromaticContact CZ-CG 3.92Å; F25-F199 HydrophobicContact CZ-CG 3.92Å
26N97.9Very high95.7Very high0 Ų043.2 Ų43.20%023%0.231CC..Hα-helixtrans-65-32.1179-82.5-70.5000113F22 I23 L29 L30 G62 G65 C66F22-N26 WeakPolarHBondContact O-CB 3.44Å; F22-N26 PolarHBondContact O-N 3.46Å; F22-N26 PolarHBondContact O-ND2 3.42Å; I23-N26 PolarHBondContact O-N 3.05Å; N26-L29 PolarHBondContact O-N 3.47Å; N26-L30 WeakPolarHBondContact O-CB 3.42Å; N26-L30 PolarHBondContact O-N 3.35Å; N26-G62 WeakPolarHBondContact CB-O 3.48Å; N26-G65 WeakPolarHBondContact OD1-CA 3.47Å; N26-C66 WeakPolarHBondContact CB-SG 3.22Å
27I97.7Very high95.8Very high71 Ų7142.1 Ų42.136%0.36422%0.224SC..Hα-helixtrans-65.7-42.9170.6-69.1169.2000110.7I23 L24 F25 L30 I31I23-I27 HydrophobicContact CG2-CD1 3.77Å; I23-I27 HydrophobicContact CG2-CG1 4.38Å; I23-I27 WeakPolarHBondContact O-CG1 3.37Å; I23-I27 PolarHBondContact O-N 3.02Å; L24-I27 PolarHBondContact O-N 2.57Å; F25-I27 VanDerWaalsContact C-N 3.3Å; F25-I27 PolarHBondContact O-N 2.96Å; I27-L30 WeakPolarHBondContact O-CB 3.44Å; I27-L30 PolarHBondContact O-N 2.95Å; I27-I31 HydrophobicContact CG2-CD1 3.89Å; I27-I31 WeakPolarHBondContact O-CG1 3.42Å; I27-I31 PolarHBondContact O-N 3.34Å
28I96.3Very high95.9Very high80 Ų8041.8 Ų41.841%0.4122%0.219SC..Hα-helixtrans-61.5-45.3175.8-68.2163.8000110.3L24 F25 L30 I31 L32 L195L24-I28 WeakPolarHBondContact O-CG1 3.5Å; L24-I28 PolarHBondContact O-N 3.35Å; F25-I28 WeakPolarHBondContact O-CB 3.34Å; F25-I28 PolarHBondContact O-N 2.97Å; F25-I28 VanDerWaalsContact O-N 3.07Å; I28-L30 VanDerWaalsContact C-N 3.31Å; I28-L30 PolarHBondContact O-N 3.45Å; I28-I31 PolarHBondContact O-N 2.94Å; I28-L32 HydrophobicContact CG2-CD1 3.87Å; I28-L32 HydrophobicContact CG2-CG 4.29Å; I28-L32 VanDerWaalsContact O-CG 3.31Å; I28-L32 WeakPolarHBondContact O-CG 3.41Å; I28-L32 PolarHBondContact O-N 3.38Å; I28-L195 HydrophobicContact CG2-CD1 4.07Å
29L95Very high95.8Very high1 Ų140.5 Ų40.51%0.00521%0.212CC..Hα-helixtrans-57.9-44.4175.3-66.9-169.6000111.9F25 N26 L32 G33 F192F25-L29 HydrophobicContact CD1-CD1 4.37Å; F25-L29 HydrophobicContact CD2-CD2 4.35Å; F25-L29 HydrophobicContact CD2-CG 4.19Å; F25-L29 HydrophobicContact CE1-CD1 3.7Å; F25-L29 HydrophobicContact CE1-CG 4.29Å; F25-L29 HydrophobicContact CE2-CD1 3.93Å; F25-L29 HydrophobicContact CE2-CD2 3.68Å; F25-L29 HydrophobicContact CE2-CG 3.77Å; F25-L29 HydrophobicContact CZ-CD1 3.45Å; F25-L29 VanDerWaalsContact CZ-CD1 3.45Å; F25-L29 HydrophobicContact CZ-CD2 4.02Å; F25-L29 HydrophobicContact CZ-CG 3.86Å; F25-L29 WeakPolarHBondContact O-CG 3.46Å; F25-L29 PolarHBondContact O-N 3.47Å; N26-L29 PolarHBondContact O-N 3.47Å; L29-L32 PolarHBondContact O-N 3.4Å; L29-G33 PolarHBondContact O-N 3.36Å; L29-F192 HydrophobicContact CD1-CE2 4.5Å; L29-F192 HydrophobicContact CD2-CD2 3.58Å; L29-F192 HydrophobicContact CD2-CE2 3.75Å
30L96.1Very high95.7Very high41 Ų4140.7 Ų40.722%0.21521%0.214CC..Hα-helixtrans-59.6-47.5177.2178.960.3000111.4N26 I27 I28 G33 I34 I59N26-L30 WeakPolarHBondContact O-CB 3.42Å; N26-L30 PolarHBondContact O-N 3.35Å; I27-L30 WeakPolarHBondContact O-CB 3.44Å; I27-L30 PolarHBondContact O-N 2.95Å; I28-L30 VanDerWaalsContact C-N 3.31Å; I28-L30 PolarHBondContact O-N 3.45Å; L30-G33 PolarHBondContact O-N 3.24Å; L30-I34 HydrophobicContact CD1-CD1 3.87Å; L30-I34 HydrophobicContact CD1-CG1 4.27Å; L30-I34 HydrophobicContact CG-CD1 3.87Å; L30-I34 VanDerWaalsContact O-CG1 3.25Å; L30-I34 WeakPolarHBondContact O-CG1 3.43Å; L30-I34 PolarHBondContact O-N 3Å; L30-I59 HydrophobicContact CD1-CB 4.35Å; L30-I59 HydrophobicContact CD1-CG2 3.66Å
31I96.3Very high95.7Very high89 Ų8941.8 Ų41.846%0.45622%0.217SC..Hα-helixtrans-62.1-47.5178.6-67.9165.9000111I27 I28 G33 I34 I35I27-I31 HydrophobicContact CG2-CD1 3.89Å; I27-I31 WeakPolarHBondContact O-CG1 3.42Å; I27-I31 PolarHBondContact O-N 3.34Å; I28-I31 PolarHBondContact O-N 2.94Å; I31-G33 VanDerWaalsContact C-N 3.3Å; I31-G33 PolarHBondContact O-N 2.89Å; I31-I34 PolarHBondContact O-N 3.07Å; I31-I35 HydrophobicContact CG2-CD1 3.76Å; I31-I35 HydrophobicContact CG2-CG1 4.42Å; I31-I35 WeakPolarHBondContact O-CG1 3.44Å; I31-I35 PolarHBondContact O-N 2.92Å
32L94.3Very high95.6Very high24 Ų2443.5 Ų43.513%0.12622%0.221CC..Hα-helixtrans-60.5-41.9177.9-69.4172.5000111.5I28 L29 T36 Y188 V191 L195I28-L32 HydrophobicContact CG2-CD1 3.87Å; I28-L32 HydrophobicContact CG2-CG 4.29Å; I28-L32 VanDerWaalsContact O-CG 3.31Å; I28-L32 WeakPolarHBondContact O-CG 3.41Å; I28-L32 PolarHBondContact O-N 3.38Å; L29-L32 PolarHBondContact O-N 3.4Å; L32-T36 WeakPolarHBondContact O-CB 3.44Å; L32-T36 PolarHBondContact O-N 3.01Å; L32-T36 VanDerWaalsContact O-N 3.09Å; L32-T36 PolarHBondContact O-OG1 2.94Å; L32-Y188 HydrophobicContact CD2-CD1 3.81Å; L32-Y188 HydrophobicContact CD2-CE1 4.44Å; L32-V191 HydrophobicContact CD1-CG1 4.37Å; L32-L195 HydrophobicContact CD1-CD1 4.28Å
33G94.9Very high95.5Very high1 Ų143.5 Ų43.51%0.0122%0.221CC..Hα-helixtrans-61-47.1175.800000112.1L29 L30 I31 T36 H37L29-G33 PolarHBondContact O-N 3.36Å; L30-G33 PolarHBondContact O-N 3.24Å; I31-G33 VanDerWaalsContact C-N 3.3Å; I31-G33 PolarHBondContact O-N 2.89Å; G33-T36 PolarHBondContact O-N 3.44Å; G33-H37 WeakPolarHBondContact O-CB 3.12Å; G33-H37 PolarHBondContact O-N 2.94Å
34I96.4Very high95.4Very high68 Ų6844 Ų4435%0.34923%0.226SC..Hα-helixtrans-63.1-49178.8-68.6165.1000111.3L30 I31 T36 H37 D38 I59L30-I34 HydrophobicContact CD1-CD1 3.87Å; L30-I34 HydrophobicContact CD1-CG1 4.27Å; L30-I34 HydrophobicContact CG-CD1 3.87Å; L30-I34 VanDerWaalsContact O-CG1 3.25Å; L30-I34 WeakPolarHBondContact O-CG1 3.43Å; L30-I34 PolarHBondContact O-N 3Å; I31-I34 PolarHBondContact O-N 3.07Å; I34-T36 VanDerWaalsContact C-N 3.3Å; I34-T36 PolarHBondContact O-N 3.48Å; I34-H37 WeakPolarHBondContact O-CB 2.81Å; I34-H37 PolarHBondContact O-N 3.22Å; I34-D38 WeakPolarHBondContact O-CB 3.14Å; I34-D38 PolarHBondContact O-N 3.14Å; I34-I59 HydrophobicContact CG1-CD1 4.24Å; I34-I59 HydrophobicContact CG1-CG1 4.41Å
35I94.6Very high95.3Very high64 Ų6441.8 Ų41.833%0.32822%0.217SC..Hα-helixtrans-58.1-45.3179.7-69.3169.7000110.8I31 T39 Y188I31-I35 HydrophobicContact CG2-CD1 3.76Å; I31-I35 HydrophobicContact CG2-CG1 4.42Å; I31-I35 WeakPolarHBondContact O-CG1 3.44Å; I31-I35 PolarHBondContact O-N 2.92Å; I35-T39 WeakPolarHBondContact O-CB 3.49Å; I35-T39 PolarHBondContact O-N 2.92Å; I35-T39 PolarHBondContact O-OG1 3.03Å; I35-Y188 HydrophobicContact CG2-CE1 4.19Å
36T93.3Very high95.2Very high8 Ų841.7 Ų41.75%0.04922%0.216CC..Hα-helixtrans-66.5-42.8179.9-51.90000111.1L32 G33 I34 T39 L40 I55 I185L32-T36 WeakPolarHBondContact O-CB 3.44Å; L32-T36 PolarHBondContact O-N 3.01Å; L32-T36 VanDerWaalsContact O-N 3.09Å; L32-T36 PolarHBondContact O-OG1 2.94Å; G33-T36 PolarHBondContact O-N 3.44Å; I34-T36 VanDerWaalsContact C-N 3.3Å; I34-T36 PolarHBondContact O-N 3.48Å; T36-T39 PolarHBondContact O-N 3.38Å; T36-L40 HydrophobicContact CG2-CD1 3.97Å; T36-L40 WeakPolarHBondContact O-CG 3.48Å; T36-L40 PolarHBondContact O-N 3.09Å; T36-I55 HydrophobicContact CG2-CD1 3.71Å; T36-I55 HydrophobicContact CG2-CG1 4.42Å; T36-I185 HydrophobicContact CG2-CD1 4.35Å; T36-I185 HydrophobicContact CG2-CG2 4.26Å
37H94.8Very high95Very high48 Ų4842.5 Ų42.522%0.22222%0.221CC..Hα-helixtrans-60.3-51.5177.1-175.6-98.3000112G33 I34 T39 L40 L41 I55 I59G33-H37 WeakPolarHBondContact O-CB 3.12Å; G33-H37 PolarHBondContact O-N 2.94Å; I34-H37 WeakPolarHBondContact O-CB 2.81Å; I34-H37 PolarHBondContact O-N 3.22Å; H37-T39 VanDerWaalsContact C-N 3.3Å; H37-T39 PolarHBondContact O-N 3.42Å; H37-L40 PolarHBondContact O-N 3.36Å; H37-L41 WeakPolarHBondContact CE1-CD1 3.47Å; H37-L41 WeakPolarHBondContact ND1-CD1 3.4Å; H37-L41 WeakPolarHBondContact O-CB 3.15Å; H37-L41 WeakPolarHBondContact O-CG 3.43Å; H37-L41 PolarHBondContact O-N 2.9Å; H37-I55 HydrophobicContact CB-CG2 3.6Å; H37-I59 HydrophobicContact CB-CD1 3.98Å
38D94.8Very high94.5Very high84 Ų8443.9 Ų43.945%0.44923%0.225SC..Hα-helixtrans-63.9-37.4-178.7-73.71.2000111.4I34 L41 K42I34-D38 WeakPolarHBondContact O-CB 3.14Å; I34-D38 PolarHBondContact O-N 3.14Å; D38-L41 PolarHBondContact O-N 3.39Å; D38-K42 WeakPolarHBondContact O-CG 3.19Å; D38-K42 PolarHBondContact O-N 3.45Å
39T93.9Very high93.8Very high11 Ų1141.7 Ų41.77%0.06722%0.22CC..Hα-helixtrans-63.5-46175-56.50000111.4I35 T36 H37 K42 Y43 F181 Y184 I185I35-T39 WeakPolarHBondContact O-CB 3.49Å; I35-T39 PolarHBondContact O-N 2.92Å; I35-T39 PolarHBondContact O-OG1 3.03Å; T36-T39 PolarHBondContact O-N 3.38Å; H37-T39 VanDerWaalsContact C-N 3.3Å; H37-T39 PolarHBondContact O-N 3.42Å; T39-K42 PolarHBondContact O-N 3.2Å; T39-Y43 HydrophobicContact CG2-CE2 4.28Å; T39-Y43 WeakPolarHBondContact O-CD2 3.31Å; T39-Y43 WeakPolarHBondContact O-CE2 3.4Å; T39-F181 HydrophobicContact CG2-CE2 4.1Å; T39-Y184 HydrophobicContact CG2-CE1 4.05Å; T39-I185 HydrophobicContact CG2-CD1 3.96Å
40L93.7Very high93.2Very high6 Ų647.2 Ų47.23%0.03126%0.255CS..Hα-helixtrans-67.6-37.8179.3-72.9163.1000111.9T36 H37 K42 Y43 T44 L47 V51 I55 F112 F181 I185T36-L40 HydrophobicContact CG2-CD1 3.97Å; T36-L40 WeakPolarHBondContact O-CG 3.48Å; T36-L40 PolarHBondContact O-N 3.09Å; H37-L40 PolarHBondContact O-N 3.36Å; L40-K42 VanDerWaalsContact C-N 3.26Å; L40-K42 PolarHBondContact O-N 2.8Å; L40-Y43 PolarHBondContact O-N 3.09Å; L40-Y43 VanDerWaalsContact O-N 3.11Å; L40-T44 PolarHBondContact O-N 3.42Å; L40-L47 HydrophobicContact CD2-CD1 4.11Å; L40-V51 HydrophobicContact CB-CG1 4.31Å; L40-V51 HydrophobicContact CB-CG2 4.12Å; L40-V51 HydrophobicContact CD1-CG1 4.08Å; L40-I55 HydrophobicContact CD1-CD1 4.45Å; L40-I55 HydrophobicContact CD1-CG1 3.92Å; L40-F112 HydrophobicContact CD2-CE2 4.3Å; L40-F112 HydrophobicContact CD2-CZ 4.26Å; L40-F181 HydrophobicContact CD2-CE1 4.16Å; L40-F181 HydrophobicContact CD2-CZ 3.98Å; L40-I185 HydrophobicContact CD2-CD1 4.47Å; L40-I185 HydrophobicContact CG-CD1 4.35Å
41L94.8Very high92.6Very high79 Ų7946.4 Ų46.441%0.41425%0.252SS..Hα-helixtrans-56.7-38.8178.6-83-176.9000113H37 D38 Y43 T44 V51H37-L41 WeakPolarHBondContact CE1-CD1 3.47Å; H37-L41 WeakPolarHBondContact ND1-CD1 3.4Å; H37-L41 WeakPolarHBondContact O-CB 3.15Å; H37-L41 WeakPolarHBondContact O-CG 3.43Å; H37-L41 PolarHBondContact O-N 2.9Å; D38-L41 PolarHBondContact O-N 3.39Å; L41-Y43 PolarHBondContact O-N 3.45Å; L41-Y43 VanDerWaalsContact O-N 3.15Å; L41-T44 HydrophobicContact CD2-CG2 4.18Å; L41-T44 PolarHBondContact O-N 2.84Å; L41-T44 PolarHBondContact O-OG1 2.63Å; L41-V51 HydrophobicContact CD2-CG2 3.73Å; L41-V51 HydrophobicContact CG-CG2 4.13Å
42K94.8Very high92.1Very high103 Ų10344.5 Ų44.545%0.44825%0.246SC..THydrogen-bonded Turntrans-58.6-24.6178.5-70.4174.5179-177.20114D38 T39 L40 E136 E143D38-K42 WeakPolarHBondContact O-CG 3.19Å; D38-K42 PolarHBondContact O-N 3.45Å; T39-K42 PolarHBondContact O-N 3.2Å; L40-K42 VanDerWaalsContact C-N 3.26Å; L40-K42 PolarHBondContact O-N 2.8Å; K42-E136 WeakPolarHBondContact O-CG 3.39Å; K42-E143 IonicContact NZ-OE1 2.72Å; K42-E143 PolarHBondContact NZ-OE1 3Å; K42-E143 IonicContact NZ-OE2 3.25Å
43Y95.3Very high91.9Very high1 Ų148 Ų480%0.00427%0.268CS..THydrogen-bonded Turntrans-121.817.8-171.7-50.7-61.9000112.9T39 L40 L41 T45 I46 L47 E136 L140 E143 F144 F181T39-Y43 HydrophobicContact CG2-CE2 4.28Å; T39-Y43 WeakPolarHBondContact O-CD2 3.31Å; T39-Y43 WeakPolarHBondContact O-CE2 3.4Å; L40-Y43 PolarHBondContact O-N 3.09Å; L40-Y43 VanDerWaalsContact O-N 3.11Å; L41-Y43 PolarHBondContact O-N 3.45Å; L41-Y43 VanDerWaalsContact O-N 3.15Å; Y43-T45 VanDerWaalsContact C-N 3.25Å; Y43-T45 PolarHBondContact O-N 3.41Å; Y43-I46 HydrophobicContact CD1-CD1 4.08Å; Y43-I46 HydrophobicContact CG-CD1 4.39Å; Y43-I46 VanDerWaalsContact O-CG1 3.3Å; Y43-I46 WeakPolarHBondContact O-CG1 3.42Å; Y43-I46 PolarHBondContact O-N 2.79Å; Y43-L47 VanDerWaalsContact O-CB 3.3Å; Y43-L47 WeakPolarHBondContact O-CB 3.32Å; Y43-L47 VanDerWaalsContact O-CG 3.23Å; Y43-L47 WeakPolarHBondContact O-CG 3.41Å; Y43-L47 PolarHBondContact O-N 3.26Å; Y43-E136 WeakPolarHBondContact CA-OE2 3.25Å; Y43-L140 HydrophobicContact CD1-CB 4.04Å; Y43-L140 HydrophobicContact CD1-CD1 4.1Å; Y43-L140 HydrophobicContact CD2-CD1 4.08Å; Y43-L140 HydrophobicContact CE1-CB 3.7Å; Y43-L140 HydrophobicContact CE1-CD1 3.88Å; Y43-L140 HydrophobicContact CE1-CG 4.42Å; Y43-L140 HydrophobicContact CE2-CD1 3.83Å; Y43-L140 HydrophobicContact CG-CD1 4.2Å; Y43-E143 VanDerWaalsContact OH-CD 3.31Å; Y43-E143 PolarHBondContact OH-OE2 3.02Å; Y43-F144 HydrophobicContact CE2-CE2 4.05Å; Y43-F181 AromaticContact CD2-CE2 3.58Å; Y43-F181 HydrophobicContact CD2-CE2 3.58Å; Y43-F181 AromaticContact CD2-CZ 3.83Å; Y43-F181 HydrophobicContact CD2-CZ 3.83Å; Y43-F181 HydrophobicContact CE2-CD2 4.44Å; Y43-F181 AromaticContact CE2-CE2 3.68Å; Y43-F181 HydrophobicContact CE2-CE2 3.68Å; Y43-F181 HydrophobicContact CE2-CZ 4.38Å
44T94.3Very high91.6Very high47 Ų4749.4 Ų49.429%0.28828%0.275SS..THydrogen-bonded Turntrans-60.2-32.9-174.942.90000113.4L40 L41 Q48 V51L40-T44 PolarHBondContact O-N 3.42Å; L41-T44 HydrophobicContact CD2-CG2 4.18Å; L41-T44 PolarHBondContact O-N 2.84Å; L41-T44 PolarHBondContact O-OG1 2.63Å; T44-Q48 PolarHBondContact O-N 2.93Å; T44-V51 HydrophobicContact CG2-CG2 4.07Å
45T94.5Very high91.4Very high50 Ų5046.6 Ų46.631%0.30726%0.26SS..THydrogen-bonded Turntrans-72.9-44.4-178.5-48.10000111Y43 Q48 Q132 Y133 E136Y43-T45 VanDerWaalsContact C-N 3.25Å; Y43-T45 PolarHBondContact O-N 3.41Å; T45-Q48 PolarHBondContact O-N 2.93Å; T45-Q132 HydrophobicContact CG2-CB 4.34Å; T45-Q132 HydrophobicContact CG2-CG 3.75Å; T45-Y133 HydrophobicContact CG2-CD2 3.88Å; T45-Y133 HydrophobicContact CG2-CE2 3.62Å; T45-E136 WeakPolarHBondContact CA-OE2 3.45Å; T45-E136 VanDerWaalsContact CB-CD 3.44Å; T45-E136 WeakPolarHBondContact CB-OE1 3.48Å; T45-E136 VanDerWaalsContact CB-OE2 3.22Å; T45-E136 WeakPolarHBondContact CB-OE2 3.34Å; T45-E136 PolarHBondContact N-OE2 3.4Å; T45-E136 PolarHBondContact OG1-OE1 3.31Å
46I95.7Very high91.3Very high0 Ų046.2 Ų46.20%026%0.262CS..THydrogen-bonded Turntrans-75.9-29.6179.361.1170.1000113Y43 Q48 A119 L120 A123 Y133 E136 M137 L140Y43-I46 HydrophobicContact CD1-CD1 4.08Å; Y43-I46 HydrophobicContact CG-CD1 4.39Å; Y43-I46 VanDerWaalsContact O-CG1 3.3Å; Y43-I46 WeakPolarHBondContact O-CG1 3.42Å; Y43-I46 PolarHBondContact O-N 2.79Å; I46-Q48 PolarHBondContact O-N 3.32Å; I46-A119 CarbonylContact O-C 3.6Å; I46-L120 HydrophobicContact CD1-CD2 3.92Å; I46-L120 HydrophobicContact CG1-CD2 4.43Å; I46-A123 HydrophobicContact CB-CB 3.79Å; I46-A123 HydrophobicContact CG2-CB 4.02Å; I46-Y133 HydrophobicContact CG2-CD1 4.5Å; I46-Y133 HydrophobicContact CG2-CG 4.2Å; I46-E136 HydrophobicContact CB-CB 4.49Å; I46-E136 HydrophobicContact CD1-CB 4.1Å; I46-E136 HydrophobicContact CG1-CB 4.12Å; I46-E136 HydrophobicContact CG2-CB 3.66Å; I46-E136 PolarHBondContact N-OE2 2.83Å; I46-M137 HydrophobicContact CD1-SD 4.35Å; I46-L140 HydrophobicContact CD1-CB 4.36Å; I46-L140 HydrophobicContact CD1-CD2 3.97Å
47L93.9Very high91.3Very high17 Ų1750.1 Ų50.19%0.08928%0.281CS..THydrogen-bonded Turntrans-75.1-9.4174.1-67.9175.9000112.4L40 Y43 A49 T116 A119 L120 F181L40-L47 HydrophobicContact CD2-CD1 4.11Å; Y43-L47 VanDerWaalsContact O-CB 3.3Å; Y43-L47 WeakPolarHBondContact O-CB 3.32Å; Y43-L47 VanDerWaalsContact O-CG 3.23Å; Y43-L47 WeakPolarHBondContact O-CG 3.41Å; Y43-L47 PolarHBondContact O-N 3.26Å; L47-A49 WeakPolarHBondContact O-CB 3.31Å; L47-A49 PolarHBondContact O-N 3.01Å; L47-T116 HydrophobicContact CD2-CG2 3.84Å; L47-A119 WeakPolarHBondContact O-CB 3.31Å; L47-L120 HydrophobicContact CD2-CD2 4.49Å; L47-F181 HydrophobicContact CD1-CE1 3.94Å; L47-F181 HydrophobicContact CD1-CZ 4.2Å; L47-F181 HydrophobicContact CD2-CE1 4.33Å
48Q87.3Confident91.3Very high99 Ų9948.3 Ų48.346%0.46327%0.273SS..THydrogen-bonded Turntrans5120178.4-61.2-177.3-22.200114.2T44 T45 I46 Y133T44-Q48 PolarHBondContact O-N 2.93Å; T45-Q48 PolarHBondContact O-N 2.93Å; I46-Q48 PolarHBondContact O-N 3.32Å; Q48-Y133 PolarHBondContact NE2-OH 3Å
49A81.2Confident91.3Very high35 Ų3546.1 Ų46.129%0.28926%0.261SS..SBendtrans-139.1139.2-172.400000108.5L47L47-A49 WeakPolarHBondContact O-CB 3.31Å; L47-A49 PolarHBondContact O-N 3.01Å
50P81.5Confident91.5Very high116 Ų11651.5 Ų51.575%0.75328%0.283SS*.PPolyproline II helixtrans-60.1154.9166.529.4-34.2000109.2
51V84.1Confident91.6Very high25 Ų2551.3 Ų51.315%0.15228%0.282CS..PPolyproline II helixtrans-49.9130.2171.4-179.70000108.7L40 L41 T44 V53 I55L40-V51 HydrophobicContact CB-CG1 4.31Å; L40-V51 HydrophobicContact CB-CG2 4.12Å; L40-V51 HydrophobicContact CD1-CG1 4.08Å; L41-V51 HydrophobicContact CD2-CG2 3.73Å; L41-V51 HydrophobicContact CG-CG2 4.13Å; T44-V51 HydrophobicContact CG2-CG2 4.07Å; V51-V53 PolarHBondContact O-N 2.9Å; V51-I55 HydrophobicContact CG1-CB 3.84Å; V51-I55 HydrophobicContact CG1-CG1 4.03Å; V51-I55 HydrophobicContact CG1-CG2 4.2Å
52P87Confident91.7Very high49 Ų4947.6 Ų47.632%0.31826%0.263SS..PPolyproline II helixtrans-53.6133.4-179.3-26.434.5000110.8L54 I55 P56P52-L54 PolarHBondContact O-N 3.22Å; P52-I55 HydrophobicContact CB-CG1 4.47Å; P52-I55 PolarHBondContact O-N 3.45Å; P52-P56 VanDerWaalsContact O-CD 3.25Å; P52-P56 WeakPolarHBondContact O-CD 3.28Å
53V88.6Confident91.8Very high97 Ų9745.3 Ų45.359%0.58826%0.259SS*.THydrogen-bonded Turntrans-54.2-26.5-176.2173.70000113V51 I55 P56 M57V51-V53 PolarHBondContact O-N 2.9Å; V53-I55 VanDerWaalsContact C-N 3.27Å; V53-I55 PolarHBondContact O-N 3.47Å; V53-P56 VanDerWaalsContact O-CD 3.25Å; V53-P56 WeakPolarHBondContact O-CD 3.46Å; V53-P56 VanDerWaalsContact O-CG 3.31Å; V53-P56 WeakPolarHBondContact O-CG 3.28Å; V53-M57 HydrophobicContact CG1-CE 3.37Å; V53-M57 HydrophobicContact CG1-CG 4.34Å; V53-M57 HydrophobicContact CG1-SD 3.98Å; V53-M57 VanDerWaalsContact O-CG 3.31Å; V53-M57 WeakPolarHBondContact O-CG 3.44Å; V53-M57 PolarHBondContact O-N 3.4Å
54L89.3Confident91.9Very high30 Ų3048.3 Ų48.316%0.15727%0.271CS..Hα-helixtrans-58.4-36.1175.1-64175.3000113P52 M57 I58 T104 M108P52-L54 PolarHBondContact O-N 3.22Å; L54-M57 WeakPolarHBondContact O-CB 3.39Å; L54-M57 PolarHBondContact O-N 3.5Å; L54-I58 VanDerWaalsContact O-CG1 3.31Å; L54-I58 WeakPolarHBondContact O-CG1 3.37Å; L54-I58 PolarHBondContact O-N 3.19Å; L54-T104 HydrophobicContact CD1-CG2 4.07Å; L54-T104 HydrophobicContact CD2-CG2 4.02Å; L54-M108 HydrophobicContact CD1-SD 3.7Å
55I91.5Very high92.1Very high9 Ų946.1 Ų46.15%0.04626%0.257CS..Hα-helixtrans-66.5-52.8-176.1-54.4-55.5000112.4T36 H37 L40 V51 P52 V53 M57 I58 I59T36-I55 HydrophobicContact CG2-CD1 3.71Å; T36-I55 HydrophobicContact CG2-CG1 4.42Å; H37-I55 HydrophobicContact CB-CG2 3.6Å; L40-I55 HydrophobicContact CD1-CD1 4.45Å; L40-I55 HydrophobicContact CD1-CG1 3.92Å; V51-I55 HydrophobicContact CG1-CB 3.84Å; V51-I55 HydrophobicContact CG1-CG1 4.03Å; V51-I55 HydrophobicContact CG1-CG2 4.2Å; P52-I55 HydrophobicContact CB-CG1 4.47Å; P52-I55 PolarHBondContact O-N 3.45Å; V53-I55 VanDerWaalsContact C-N 3.27Å; V53-I55 PolarHBondContact O-N 3.47Å; I55-M57 PolarHBondContact O-N 3.01Å; I55-I58 HydrophobicContact CD1-CD1 4.34Å; I55-I58 WeakPolarHBondContact O-CB 3.38Å; I55-I58 PolarHBondContact O-N 3.22Å; I55-I58 VanDerWaalsContact O-N 3.13Å; I55-I59 PolarHBondContact O-N 2.97Å
56P93.5Very high92.2Very high57 Ų5745 Ų4537%0.3725%0.252SS..Hα-helixtrans-63.9-28.1173.523.5-32.3000112.9P52 V53 I58 I59 F60P52-P56 VanDerWaalsContact O-CD 3.25Å; P52-P56 WeakPolarHBondContact O-CD 3.28Å; V53-P56 VanDerWaalsContact O-CD 3.25Å; V53-P56 WeakPolarHBondContact O-CD 3.46Å; V53-P56 VanDerWaalsContact O-CG 3.31Å; V53-P56 WeakPolarHBondContact O-CG 3.28Å; P56-I58 VanDerWaalsContact C-N 3.35Å; P56-I59 PolarHBondContact O-N 3.47Å; P56-F60 WeakPolarHBondContact O-CB 3.33Å; P56-F60 PolarHBondContact O-N 3.35Å
57M93.7Very high92.3Very high89 Ų8949.8 Ų49.844%0.43828%0.276SS..Hα-helixtrans-64.6-36.7172.4-73176.8175.600112.6V53 L54 I55 F60 T61 I101V53-M57 HydrophobicContact CG1-CE 3.37Å; V53-M57 HydrophobicContact CG1-CG 4.34Å; V53-M57 HydrophobicContact CG1-SD 3.98Å; V53-M57 VanDerWaalsContact O-CG 3.31Å; V53-M57 WeakPolarHBondContact O-CG 3.44Å; V53-M57 PolarHBondContact O-N 3.4Å; L54-M57 WeakPolarHBondContact O-CB 3.39Å; L54-M57 PolarHBondContact O-N 3.5Å; I55-M57 PolarHBondContact O-N 3.01Å; M57-F60 PolarHBondContact O-N 2.99Å; M57-T61 WeakPolarHBondContact O-CB 3.47Å; M57-T61 PolarHBondContact O-N 2.85Å; M57-T61 PolarHBondContact O-OG1 3.24Å; M57-I101 HydrophobicContact CB-CD1 3.86Å
58I93.8Very high92.4Very high11 Ų1149 Ų496%0.05627%0.272CS..Hα-helixtrans-61.7-47.6174.2-69.3163.6000110.5L54 I55 P56 F60 T61 G62 I101 F192L54-I58 VanDerWaalsContact O-CG1 3.31Å; L54-I58 WeakPolarHBondContact O-CG1 3.37Å; L54-I58 PolarHBondContact O-N 3.19Å; I55-I58 HydrophobicContact CD1-CD1 4.34Å; I55-I58 WeakPolarHBondContact O-CB 3.38Å; I55-I58 PolarHBondContact O-N 3.22Å; I55-I58 VanDerWaalsContact O-N 3.13Å; P56-I58 VanDerWaalsContact C-N 3.35Å; I58-F60 PolarHBondContact O-N 3.38Å; I58-T61 PolarHBondContact O-N 2.92Å; I58-G62 PolarHBondContact O-N 2.83Å; I58-I101 HydrophobicContact CD1-CG2 4.15Å; I58-I101 HydrophobicContact CG1-CD1 4.44Å; I58-I101 HydrophobicContact CG1-CG2 3.72Å; I58-F192 HydrophobicContact CB-CE2 4.31Å; I58-F192 HydrophobicContact CD1-CD1 4.29Å; I58-F192 HydrophobicContact CD1-CD2 4.27Å; I58-F192 HydrophobicContact CD1-CE1 4.08Å; I58-F192 HydrophobicContact CD1-CE2 4.05Å; I58-F192 HydrophobicContact CD1-CG 4.42Å; I58-F192 HydrophobicContact CD1-CZ 3.97Å; I58-F192 HydrophobicContact CG1-CD2 4.39Å; I58-F192 HydrophobicContact CG1-CE1 4.25Å; I58-F192 HydrophobicContact CG1-CE2 3.72Å; I58-F192 HydrophobicContact CG1-CZ 3.67Å; I58-F192 HydrophobicContact CG2-CD2 4.03Å; I58-F192 HydrophobicContact CG2-CE2 3.7Å; I58-F192 HydrophobicContact CG2-CZ 4.49Å
59I96Very high92.8Very high38 Ų3844.3 Ų44.320%0.19525%0.25CS..Hα-helixtrans-58.9-48.9177.7-64.7174.3000110.3L30 I34 H37 I55 P56 T61 G62 C63L30-I59 HydrophobicContact CD1-CB 4.35Å; L30-I59 HydrophobicContact CD1-CG2 3.66Å; I34-I59 HydrophobicContact CG1-CD1 4.24Å; I34-I59 HydrophobicContact CG1-CG1 4.41Å; H37-I59 HydrophobicContact CB-CD1 3.98Å; I55-I59 PolarHBondContact O-N 2.97Å; P56-I59 PolarHBondContact O-N 3.47Å; I59-T61 VanDerWaalsContact C-N 3.33Å; I59-T61 PolarHBondContact O-N 3.38Å; I59-G62 PolarHBondContact O-N 2.85Å; I59-C63 PolarHBondContact O-N 3.48Å; I59-C63 PolarHBondContact O-SG 2.95Å
60F96.4Very high93.4Very high124 Ų12448.6 Ų48.654%0.54426%0.262SS..Hα-helixtrans-58.1-45.5177.4174.1-97.5000112P56 M57 I58 C63 Y64P56-F60 WeakPolarHBondContact O-CB 3.33Å; P56-F60 PolarHBondContact O-N 3.35Å; M57-F60 PolarHBondContact O-N 2.99Å; I58-F60 PolarHBondContact O-N 3.38Å; F60-C63 PolarHBondContact O-N 3Å; F60-Y64 WeakPolarHBondContact O-CB 3.34Å; F60-Y64 PolarHBondContact O-N 3.43Å
61T95.8Very high94Very high2 Ų244.4 Ų44.41%0.01223%0.233CC..Hα-helixtrans-65-42.4-178.9-54.60000111.3M57 I58 I59 C63 Y64 G65 V94 I97 E98M57-T61 WeakPolarHBondContact O-CB 3.47Å; M57-T61 PolarHBondContact O-N 2.85Å; M57-T61 PolarHBondContact O-OG1 3.24Å; I58-T61 PolarHBondContact O-N 2.92Å; I59-T61 VanDerWaalsContact C-N 3.33Å; I59-T61 PolarHBondContact O-N 3.38Å; T61-C63 PolarHBondContact O-N 3.37Å; T61-Y64 PolarHBondContact O-N 3.47Å; T61-G65 PolarHBondContact O-N 3.15Å; T61-V94 HydrophobicContact CG2-CG1 4.22Å; T61-I97 HydrophobicContact CG2-CB 4.41Å; T61-I97 HydrophobicContact CG2-CG2 4.03Å; T61-I97 WeakPolarHBondContact OG1-CG2 3.34Å; T61-E98 HydrophobicContact CG2-CG 3.73Å
62G96.8Very high94.3Very high0 Ų043.2 Ų43.20%023%0.227CC..Hα-helixtrans-60.8-43.2174.200000112.6N26 I58 I59 C66N26-G62 WeakPolarHBondContact CB-O 3.48Å; I58-G62 PolarHBondContact O-N 2.83Å; I59-G62 PolarHBondContact O-N 2.85Å; G62-C66 PolarHBondContact O-N 3.43Å; G62-C66 PolarHBondContact O-SG 3.33Å
63C97.9Very high94.4Very high55 Ų5543.6 Ų43.637%0.37222%0.222SC..Hα-helixtrans-63.9-49.5175.2-72.90000112.2I59 F60 T61 G65 C66 I67I59-C63 PolarHBondContact O-N 3.48Å; I59-C63 PolarHBondContact O-SG 2.95Å; F60-C63 PolarHBondContact O-N 3Å; T61-C63 PolarHBondContact O-N 3.37Å; C63-G65 PolarHBondContact O-N 2.98Å; C63-C66 WeakPolarHBondContact O-CB 3.43Å; C63-C66 PolarHBondContact O-N 2.71Å; C63-I67 WeakPolarHBondContact O-CG1 3.44Å; C63-I67 PolarHBondContact O-N 2.95Å; C63-I67 VanDerWaalsContact O-N 3.15Å
64Y97.7Very high94.3Very high65 Ų6542.7 Ų42.726%0.25521%0.213SC..Hα-helixtrans-65-39.9-178.9-177.5-122.2000111.8F60 T61 I67 A68 S90 I93 V94F60-Y64 WeakPolarHBondContact O-CB 3.34Å; F60-Y64 PolarHBondContact O-N 3.43Å; T61-Y64 PolarHBondContact O-N 3.47Å; Y64-I67 PolarHBondContact O-N 2.84Å; Y64-A68 VanDerWaalsContact O-CB 3.31Å; Y64-A68 WeakPolarHBondContact O-CB 3.34Å; Y64-A68 PolarHBondContact O-N 3.37Å; Y64-S90 WeakPolarHBondContact OH-CA 3.31Å; Y64-S90 VanDerWaalsContact OH-CB 3.3Å; Y64-S90 WeakPolarHBondContact OH-CB 3.25Å; Y64-I93 HydrophobicContact CE1-CB 4.19Å; Y64-I93 HydrophobicContact CE1-CG2 3.86Å; Y64-V94 HydrophobicContact CD1-CG2 3.34Å; Y64-V94 HydrophobicContact CE1-CG2 3.63Å; Y64-V94 HydrophobicContact CG-CG2 4.27Å
65G97.8Very high94Very high0 Ų042.2 Ų42.20%022%0.216CC..Hα-helixtrans-64.6-37.4175.100000113.4N26 T61 C63 A68 S69N26-G65 WeakPolarHBondContact OD1-CA 3.47Å; T61-G65 PolarHBondContact O-N 3.15Å; C63-G65 PolarHBondContact O-N 2.98Å; G65-A68 PolarHBondContact O-N 2.77Å; G65-S69 WeakPolarHBondContact O-CB 3.35Å; G65-S69 PolarHBondContact O-N 2.86Å; G65-S69 PolarHBondContact O-OG 3.42Å
66C97.4Very high93.5Very high28 Ų2844.3 Ų44.319%0.18923%0.227CC..Hα-helixtrans-58.8-48.8170.1-72.80000111.5N26 G62 C63 S69 F70N26-C66 WeakPolarHBondContact CB-SG 3.22Å; G62-C66 PolarHBondContact O-N 3.43Å; G62-C66 PolarHBondContact O-SG 3.33Å; C63-C66 WeakPolarHBondContact O-CB 3.43Å; C63-C66 PolarHBondContact O-N 2.71Å; C66-S69 PolarHBondContact O-N 3Å; C66-F70 WeakPolarHBondContact O-CB 3.42Å; C66-F70 PolarHBondContact O-N 3.39Å
67I96.9Very high92.6Very high100 Ų10052.3 Ų52.351%0.51325%0.25SC..Hα-helixtrans-62.5-47.8179.4-65.4167.2000110.4C63 Y64 S69 F70 I71C63-I67 WeakPolarHBondContact O-CG1 3.44Å; C63-I67 PolarHBondContact O-N 2.95Å; C63-I67 VanDerWaalsContact O-N 3.15Å; Y64-I67 PolarHBondContact O-N 2.84Å; I67-S69 VanDerWaalsContact C-N 3.3Å; I67-S69 PolarHBondContact O-N 3.15Å; I67-F70 WeakPolarHBondContact O-CB 3.3Å; I67-F70 PolarHBondContact O-N 3.49Å; I67-F70 VanDerWaalsContact O-N 3.14Å; I67-I71 HydrophobicContact CG2-CD1 4.11Å; I67-I71 WeakPolarHBondContact O-CG1 3.25Å; I67-I71 PolarHBondContact O-N 3.33Å
68A96.5Very high91.8Very high1 Ų154 Ų541%0.00825%0.254CS..Hα-helixtrans-59.8-40179.600000112.1Y64 G65 I71 G72 H87 S90 M91 V94Y64-A68 VanDerWaalsContact O-CB 3.31Å; Y64-A68 WeakPolarHBondContact O-CB 3.34Å; Y64-A68 PolarHBondContact O-N 3.37Å; G65-A68 PolarHBondContact O-N 2.77Å; A68-I71 PolarHBondContact O-N 2.99Å; A68-G72 PolarHBondContact O-N 3.4Å; A68-H87 PolarHBondContact O-ND1 2.93Å; A68-S90 VanDerWaalsContact CB-OG 3.31Å; A68-S90 WeakPolarHBondContact CB-OG 3.33Å; A68-M91 HydrophobicContact CB-CE 3.22Å; A68-V94 HydrophobicContact CB-CG2 4.35Å
69S95.9Very high90.6Very high0 Ų058.7 Ų58.70%029%0.286CS..Hα-helixtrans-70.7-36.2176.2-55.20000111.6N19 F22 I23 G65 C66 I67 G72 M91N19-S69 PolarHBondContact OD1-O 3.39Å; F22-S69 WeakPolarHBondContact CB-OG 3.36Å; I23-S69 VanDerWaalsContact CG1-CB 3.43Å; G65-S69 WeakPolarHBondContact O-CB 3.35Å; G65-S69 PolarHBondContact O-N 2.86Å; G65-S69 PolarHBondContact O-OG 3.42Å; C66-S69 PolarHBondContact O-N 3Å; I67-S69 VanDerWaalsContact C-N 3.3Å; I67-S69 PolarHBondContact O-N 3.15Å; S69-G72 WeakPolarHBondContact O-CA 3.47Å; S69-G72 PolarHBondContact O-N 2.91Å; S69-G72 VanDerWaalsContact O-N 3.09Å; S69-M91 WeakPolarHBondContact OG-CE 3.3Å
70F94.3Very high89.9Confident124 Ų12461 Ų6154%0.54430%0.297SS..Hα-helixtrans-64.6-39.3174.7-172.3-103.6000112.6C66 I67 G72 Y73 I74C66-F70 WeakPolarHBondContact O-CB 3.42Å; C66-F70 PolarHBondContact O-N 3.39Å; I67-F70 WeakPolarHBondContact O-CB 3.3Å; I67-F70 PolarHBondContact O-N 3.49Å; I67-F70 VanDerWaalsContact O-N 3.14Å; F70-G72 PolarHBondContact O-N 2.94Å; F70-Y73 WeakPolarHBondContact O-CB 3.37Å; F70-Y73 PolarHBondContact O-N 2.79Å; F70-I74 HydrophobicContact CD1-CD1 3.97Å; F70-I74 HydrophobicContact CD1-CG1 4.41Å; F70-I74 HydrophobicContact CE1-CD1 3.79Å; F70-I74 HydrophobicContact CE1-CG1 4.18Å; F70-I74 PolarHBondContact O-N 3.49Å
71I93.3Very high89.4Confident28 Ų2857.1 Ų57.114%0.14428%0.282CS..Hα-helixtrans-58.1-32.4172.5-64.7165.5000110.7I67 A68 Y73 I74 G75 I83 L86 H87I67-I71 HydrophobicContact CG2-CD1 4.11Å; I67-I71 WeakPolarHBondContact O-CG1 3.25Å; I67-I71 PolarHBondContact O-N 3.33Å; A68-I71 PolarHBondContact O-N 2.99Å; I71-Y73 VanDerWaalsContact C-N 3.35Å; I71-Y73 PolarHBondContact O-N 2.93Å; I71-I74 PolarHBondContact O-N 2.96Å; I71-G75 PolarHBondContact O-N 3.04Å; I71-I83 HydrophobicContact CG2-CG2 3.96Å; I71-L86 HydrophobicContact CD1-CD2 4Å; I71-L86 HydrophobicContact CD1-CG 4.23Å; I71-L86 HydrophobicContact CG2-CD2 4.16Å; I71-L86 HydrophobicContact CG2-CG 4.35Å; I71-H87 HydrophobicContact CG2-CB 4.03Å
72G90.5Very high89Confident1 Ų162.7 Ų62.71%0.0131%0.311CS..Hα-helixtrans-55.7-45.7172.600000112.7F15 A68 S69 F70 I74 G75 L76 H87F15-G72 WeakPolarHBondContact CE1-O 3.44Å; A68-G72 PolarHBondContact O-N 3.4Å; S69-G72 WeakPolarHBondContact O-CA 3.47Å; S69-G72 PolarHBondContact O-N 2.91Å; S69-G72 VanDerWaalsContact O-N 3.09Å; F70-G72 PolarHBondContact O-N 2.94Å; G72-I74 PolarHBondContact O-N 3.49Å; G72-G75 PolarHBondContact O-N 3.42Å; G72-L76 PolarHBondContact O-N 3.07Å; G72-H87 WeakPolarHBondContact CA-ND1 3.45Å; G72-H87 PolarHBondContact N-ND1 3.2Å
73Y88.5Confident88.8Confident57 Ų5764 Ų6422%0.22432%0.318CS..Hα-helixtrans-60.7-44.9174.6-77.1-73.4000112.9I16 N19 T20 I23 F70 I71 G75 L76I16-Y73 HydrophobicContact CG2-CE1 4.19Å; I16-Y73 PolarHBondContact O-OH 3.44Å; N19-Y73 HydrophobicContact CB-CE2 4.07Å; T20-Y73 VanDerWaalsContact CA-OH 3.29Å; T20-Y73 WeakPolarHBondContact CA-OH 3.3Å; T20-Y73 WeakPolarHBondContact CB-OH 3.49Å; T20-Y73 PolarHBondContact N-OH 3.46Å; T20-Y73 PolarHBondContact OG1-OH 3.24Å; I23-Y73 HydrophobicContact CD1-CD2 4.09Å; I23-Y73 HydrophobicContact CD1-CE2 3.6Å; F70-Y73 WeakPolarHBondContact O-CB 3.37Å; F70-Y73 PolarHBondContact O-N 2.79Å; I71-Y73 VanDerWaalsContact C-N 3.35Å; I71-Y73 PolarHBondContact O-N 2.93Å; Y73-G75 PolarHBondContact O-N 2.77Å; Y73-L76 HydrophobicContact CD1-CD1 4.48Å; Y73-L76 WeakPolarHBondContact O-CB 3.3Å; Y73-L76 PolarHBondContact O-N 3.36Å; Y73-L76 VanDerWaalsContact O-N 3.13Å
74I87Confident88.4Confident77 Ų7762.9 Ų62.940%0.39531%0.312SS..Hα-helixtrans-60.5-39.3178.3-58.7175.2000110.2F70 I71 G72 L76 W77 K78 I83F70-I74 HydrophobicContact CD1-CD1 3.97Å; F70-I74 HydrophobicContact CD1-CG1 4.41Å; F70-I74 HydrophobicContact CE1-CD1 3.79Å; F70-I74 HydrophobicContact CE1-CG1 4.18Å; F70-I74 PolarHBondContact O-N 3.49Å; I71-I74 PolarHBondContact O-N 2.96Å; G72-I74 PolarHBondContact O-N 3.49Å; I74-L76 PolarHBondContact O-N 3.06Å; I74-W77 PolarHBondContact O-N 3.38Å; I74-W77 VanDerWaalsContact O-N 3.08Å; I74-K78 PolarHBondContact O-N 3.07Å; I74-I83 HydrophobicContact CG2-CD1 4.34Å; I74-I83 HydrophobicContact CG2-CG2 4.48Å
75G83.2Confident88.1Confident21 Ų2164.4 Ų64.422%0.21633%0.325CS..Hα-helixtrans-61.6-26.8177.800000114.4I71 G72 Y73 I83I71-G75 PolarHBondContact O-N 3.04Å; G72-G75 PolarHBondContact O-N 3.42Å; Y73-G75 PolarHBondContact O-N 2.77Å; G75-I83 VanDerWaalsContact CA-CG2 3.47Å
76L80.9Confident88Confident52 Ų5268.8 Ų68.827%0.27235%0.347SS..Hα-helixtrans-71.7-34.9173.6-67.7170.1000112.4F15 I16 G72 Y73 I74F15-L76 HydrophobicContact CD1-CD1 3.84Å; F15-L76 HydrophobicContact CD1-CD2 3.63Å; F15-L76 HydrophobicContact CD1-CG 3.82Å; F15-L76 HydrophobicContact CE1-CD1 4.13Å; F15-L76 HydrophobicContact CE1-CD2 3.97Å; F15-L76 HydrophobicContact CE1-CG 3.82Å; F15-L76 HydrophobicContact CG-CD2 4.34Å; I16-L76 HydrophobicContact CD1-CD1 4Å; I16-L76 HydrophobicContact CG1-CD1 3.32Å; G72-L76 PolarHBondContact O-N 3.07Å; Y73-L76 HydrophobicContact CD1-CD1 4.48Å; Y73-L76 WeakPolarHBondContact O-CB 3.3Å; Y73-L76 PolarHBondContact O-N 3.36Å; Y73-L76 VanDerWaalsContact O-N 3.13Å; I74-L76 PolarHBondContact O-N 3.06Å
77W75.2Confident87.9Confident225 Ų22567.7 Ų67.785%0.85234%0.339SS*.Hα-helixtrans-87.5-33.9-173.3-65.725.4000111.4I74I74-W77 PolarHBondContact O-N 3.38Å; I74-W77 VanDerWaalsContact O-N 3.08Å
78K76.7Confident87.8Confident124 Ų12463.6 Ų63.654%0.53932%0.318SS..SBendtrans-120.390.3177.1-163.9179.4-172.4-173.90109.2I74 M80 I83I74-K78 PolarHBondContact O-N 3.07Å; K78-M80 HydrophobicContact CD-CG 4.48Å; K78-M80 HydrophobicContact CD-SD 3.87Å; K78-M80 WeakPolarHBondContact CE-SD 3.49Å; K78-M80 HydrophobicContact CG-CG 4.08Å; K78-M80 HydrophobicContact CG-SD 4.13Å; K78-M80 PolarHBondContact O-N 3.11Å; K78-I83 HydrophobicContact CB-CD1 4Å; K78-I83 HydrophobicContact CD-CD1 4.07Å; K78-I83 HydrophobicContact CG-CD1 4.22Å
79P68.7Low87.8Confident111 Ų11165.9 Ų65.972%0.72133%0.334SS*.  trans-72.973.6-17530.7-36.1000111.4
80M81.3Confident87.8Confident86 Ų8666 Ų6642%0.42434%0.335SS..  trans-103.3130.2170.4-68.1-177.574.900108.7K78 L82 I83 A84K78-M80 HydrophobicContact CD-CG 4.48Å; K78-M80 HydrophobicContact CD-SD 3.87Å; K78-M80 WeakPolarHBondContact CE-SD 3.49Å; K78-M80 HydrophobicContact CG-CG 4.08Å; K78-M80 HydrophobicContact CG-SD 4.13Å; K78-M80 PolarHBondContact O-N 3.11Å; M80-L82 PolarHBondContact O-N 3.38Å; M80-I83 HydrophobicContact CB-CD1 4.1Å; M80-I83 HydrophobicContact CB-CG1 4.13Å; M80-I83 HydrophobicContact CG-CD1 4.46Å; M80-I83 PolarHBondContact O-N 3.32Å; M80-I83 HydrophobicContact SD-CD1 4.35Å; M80-A84 PolarHBondContact O-N 2.94Å
81N84.4Confident87.9Confident42 Ų4260.1 Ų60.123%0.22531%0.31CS..Hα-helixtrans-55-30.9177.1-61.5-14.1000111.5L85 M218 K221N81-L85 WeakPolarHBondContact O-CB 3.29Å; N81-L85 PolarHBondContact O-N 3.48Å; N81-M218 HydrophobicContact CB-SD 3.93Å; N81-M218 PolarHBondContact ND2-SD 2.86Å; N81-K221 PolarHBondContact ND2-NZ 3.33Å; N81-K221 VanDerWaalsContact ND2-NZ 3.11Å; N81-K221 PolarHBondContact OD1-NZ 3.32Å
82L88.9Confident88.1Confident119 Ų11960.7 Ų60.762%0.62332%0.316SS*.Hα-helixtrans-65-41.6176.4-174.663.7000113.4M80 L85 L86M80-L82 PolarHBondContact O-N 3.38Å; L82-L85 PolarHBondContact O-N 3.19Å; L82-L86 WeakPolarHBondContact O-CB 3.4Å; L82-L86 PolarHBondContact O-N 3.46Å
83I90.8Very high88.4Confident28 Ų2864.5 Ų64.514%0.14434%0.335CS..Hα-helixtrans-70.1-40.8179.8-61.2171.5000109.8I71 I74 G75 K78 M80 L85 L86 H87I71-I83 HydrophobicContact CG2-CG2 3.96Å; I74-I83 HydrophobicContact CG2-CD1 4.34Å; I74-I83 HydrophobicContact CG2-CG2 4.48Å; G75-I83 VanDerWaalsContact CA-CG2 3.47Å; K78-I83 HydrophobicContact CB-CD1 4Å; K78-I83 HydrophobicContact CD-CD1 4.07Å; K78-I83 HydrophobicContact CG-CD1 4.22Å; M80-I83 HydrophobicContact CB-CD1 4.1Å; M80-I83 HydrophobicContact CB-CG1 4.13Å; M80-I83 HydrophobicContact CG-CD1 4.46Å; M80-I83 PolarHBondContact O-N 3.32Å; M80-I83 HydrophobicContact SD-CD1 4.35Å; I83-L85 VanDerWaalsContact C-N 3.35Å; I83-L86 PolarHBondContact O-N 3.49Å; I83-H87 WeakPolarHBondContact O-CB 3.48Å; I83-H87 PolarHBondContact O-N 3.46Å
84A90.4Very high88.8Confident32 Ų3261.8 Ų61.826%0.26432%0.324SS..Hα-helixtrans-61.4-43.2173.700000111.7M80 H87 I88 L214M80-A84 PolarHBondContact O-N 2.94Å; A84-H87 PolarHBondContact O-N 3.11Å; A84-I88 WeakPolarHBondContact O-CB 3.23Å; A84-I88 VanDerWaalsContact O-CG1 3.28Å; A84-I88 WeakPolarHBondContact O-CG1 3.31Å; A84-I88 PolarHBondContact O-N 3.47Å; A84-L214 HydrophobicContact CB-CD1 4.05Å
85L92.4Very high89.3Confident97 Ų9758.7 Ų58.751%0.50831%0.309SS..Hα-helixtrans-62.5-45.8176.1-176.964.2000111.6N81 L82 I83 H87 I88 S89N81-L85 WeakPolarHBondContact O-CB 3.29Å; N81-L85 PolarHBondContact O-N 3.48Å; L82-L85 PolarHBondContact O-N 3.19Å; I83-L85 VanDerWaalsContact C-N 3.35Å; L85-H87 VanDerWaalsContact C-N 3.34Å; L85-H87 PolarHBondContact O-N 3.23Å; L85-I88 PolarHBondContact O-N 3.04Å; L85-S89 WeakPolarHBondContact O-CB 3.45Å; L85-S89 PolarHBondContact O-N 3.48Å; L85-S89 PolarHBondContact O-OG 3.02Å; L85-S89 VanDerWaalsContact O-OG 3.07Å
86L94.3Very high90Very high92 Ų9263.4 Ų63.448%0.48233%0.328SS..Hα-helixtrans-60.9-42.8177.9-178.365.9000112I71 L82 I83 S89 S90I71-L86 HydrophobicContact CD1-CD2 4Å; I71-L86 HydrophobicContact CD1-CG 4.23Å; I71-L86 HydrophobicContact CG2-CD2 4.16Å; I71-L86 HydrophobicContact CG2-CG 4.35Å; L82-L86 WeakPolarHBondContact O-CB 3.4Å; L82-L86 PolarHBondContact O-N 3.46Å; I83-L86 PolarHBondContact O-N 3.49Å; L86-S89 PolarHBondContact O-OG 3.26Å; L86-S89 VanDerWaalsContact O-OG 3.11Å; L86-S90 VanDerWaalsContact O-CB 3.28Å; L86-S90 WeakPolarHBondContact O-CB 3.47Å; L86-S90 PolarHBondContact O-N 3.48Å; L86-S90 PolarHBondContact O-OG 2.93Å
87H95Very high90.7Very high4 Ų463.3 Ų63.32%0.01933%0.328CS..Hα-helixtrans-62.9-49.7175.5172.264.9000111.6F15 N19 A68 I71 G72 I83 A84 L85 S90 M91 Y206F15-H87 AromaticContact CZ-NE2 3.93Å; N19-H87 PolarHBondContact OD1-CE1 3.49Å; A68-H87 PolarHBondContact O-ND1 2.93Å; I71-H87 HydrophobicContact CG2-CB 4.03Å; G72-H87 WeakPolarHBondContact CA-ND1 3.45Å; G72-H87 PolarHBondContact N-ND1 3.2Å; I83-H87 WeakPolarHBondContact O-CB 3.48Å; I83-H87 PolarHBondContact O-N 3.46Å; A84-H87 PolarHBondContact O-N 3.11Å; L85-H87 VanDerWaalsContact C-N 3.34Å; L85-H87 PolarHBondContact O-N 3.23Å; H87-S90 PolarHBondContact O-N 2.93Å; H87-S90 PolarHBondContact O-OG 3.07Å; H87-M91 VanDerWaalsContact CE1-CG 3.43Å; H87-M91 WeakPolarHBondContact CE1-CG 3.29Å; H87-M91 WeakPolarHBondContact O-CB 3.19Å; H87-M91 WeakPolarHBondContact O-CG 3.46Å; H87-M91 PolarHBondContact O-N 3.04Å; H87-Y206 PolarHBondContact CE1-OH 3.19Å; H87-Y206 AromaticContact NE2-CE1 3.48Å; H87-Y206 WeakPolarHBondContact NE2-CE1 3.06Å; H87-Y206 AromaticContact NE2-CZ 3.46Å; H87-Y206 PolarHBondContact NE2-OH 2.96Å
88I95.4Very high91.7Very high14 Ų1452.7 Ų52.77%0.07229%0.287CS..Hα-helixtrans-62.4-46.8179.7-69.8168.7000110.7A84 L85 S90 M91 C92 L207 I211 L214A84-I88 WeakPolarHBondContact O-CB 3.23Å; A84-I88 VanDerWaalsContact O-CG1 3.28Å; A84-I88 WeakPolarHBondContact O-CG1 3.31Å; A84-I88 PolarHBondContact O-N 3.47Å; L85-I88 PolarHBondContact O-N 3.04Å; I88-S90 PolarHBondContact O-N 2.96Å; I88-M91 PolarHBondContact O-N 3.48Å; I88-C92 WeakPolarHBondContact O-CB 3.33Å; I88-C92 PolarHBondContact O-N 2.79Å; I88-C92 PolarHBondContact O-SG 2.92Å; I88-L207 HydrophobicContact CG2-CD2 4.26Å; I88-I211 HydrophobicContact CD1-CG1 4.47Å; I88-I211 HydrophobicContact CG2-CD1 4.22Å; I88-I211 HydrophobicContact CG2-CG1 3.72Å; I88-L214 HydrophobicContact CD1-CB 4.21Å; I88-L214 HydrophobicContact CD1-CD2 3.82Å
89S96.2Very high92.6Very high49 Ų4949.9 Ų49.934%0.34328%0.278SS..Hα-helixtrans-64.3-40.6-179.363.50000112.2L85 L86 C92 I93L85-S89 WeakPolarHBondContact O-CB 3.45Å; L85-S89 PolarHBondContact O-N 3.48Å; L85-S89 PolarHBondContact O-OG 3.02Å; L85-S89 VanDerWaalsContact O-OG 3.07Å; L86-S89 PolarHBondContact O-OG 3.26Å; L86-S89 VanDerWaalsContact O-OG 3.11Å; S89-C92 PolarHBondContact O-N 3.25Å; S89-I93 WeakPolarHBondContact O-CD1 3.41Å; S89-I93 VanDerWaalsContact O-CG1 3.29Å; S89-I93 WeakPolarHBondContact O-CG1 3.44Å; S89-I93 PolarHBondContact O-N 3.39Å; S89-I93 VanDerWaalsContact O-N 3.11Å
90S97.1Very high93.9Very high3 Ų347 Ų472%0.02126%0.263CS..Hα-helixtrans-68.9-43.3178.554.80000112.2Y64 A68 L86 H87 I88 C92 I93 V94Y64-S90 WeakPolarHBondContact OH-CA 3.31Å; Y64-S90 VanDerWaalsContact OH-CB 3.3Å; Y64-S90 WeakPolarHBondContact OH-CB 3.25Å; A68-S90 VanDerWaalsContact CB-OG 3.31Å; A68-S90 WeakPolarHBondContact CB-OG 3.33Å; L86-S90 VanDerWaalsContact O-CB 3.28Å; L86-S90 WeakPolarHBondContact O-CB 3.47Å; L86-S90 PolarHBondContact O-N 3.48Å; L86-S90 PolarHBondContact O-OG 2.93Å; H87-S90 PolarHBondContact O-N 2.93Å; H87-S90 PolarHBondContact O-OG 3.07Å; I88-S90 PolarHBondContact O-N 2.96Å; S90-C92 PolarHBondContact O-N 3.42Å; S90-I93 PolarHBondContact O-N 3.27Å; S90-V94 VanDerWaalsContact O-CG2 3.3Å; S90-V94 WeakPolarHBondContact O-CG2 3.32Å; S90-V94 PolarHBondContact O-N 2.97Å
91M96Very high94.6Very high1 Ų143.2 Ų43.21%0.00525%0.245CC..Hα-helixtrans-59.9-43172.9-76.7-76.3103.700112.1F22 A68 S69 H87 I88 I93 V94 T95 L207F22-M91 HydrophobicContact CD2-SD 4.38Å; A68-M91 HydrophobicContact CB-CE 3.22Å; S69-M91 WeakPolarHBondContact OG-CE 3.3Å; H87-M91 VanDerWaalsContact CE1-CG 3.43Å; H87-M91 WeakPolarHBondContact CE1-CG 3.29Å; H87-M91 WeakPolarHBondContact O-CB 3.19Å; H87-M91 WeakPolarHBondContact O-CG 3.46Å; H87-M91 PolarHBondContact O-N 3.04Å; I88-M91 PolarHBondContact O-N 3.48Å; M91-I93 VanDerWaalsContact C-N 3.31Å; M91-I93 PolarHBondContact O-N 2.89Å; M91-V94 HydrophobicContact CE-CG2 4.43Å; M91-V94 PolarHBondContact O-N 3.37Å; M91-T95 PolarHBondContact O-N 3.12Å; M91-T95 PolarHBondContact O-OG1 3.19Å; M91-L207 HydrophobicContact CB-CD2 3.6Å; M91-L207 HydrophobicContact CB-CG 4.45Å
92C97.3Very high95.1Very high40 Ų4041.2 Ų41.227%0.2723%0.234SC..Hα-helixtrans-57.2-45.1174.1-73.20000111.9I88 S89 S90 T95 L96I88-C92 WeakPolarHBondContact O-CB 3.33Å; I88-C92 PolarHBondContact O-N 2.79Å; I88-C92 PolarHBondContact O-SG 2.92Å; S89-C92 PolarHBondContact O-N 3.25Å; S90-C92 PolarHBondContact O-N 3.42Å; C92-T95 PolarHBondContact O-N 3.28Å; C92-L96 VanDerWaalsContact O-CG 3.26Å; C92-L96 WeakPolarHBondContact O-CG 3.25Å; C92-L96 PolarHBondContact O-N 3.44Å
93I97.2Very high95.5Very high80 Ų8038.5 Ų38.541%0.4122%0.222SC..Hα-helixtrans-63-45.6178.5-68.1163.9000110.6Y64 S89 S90 M91 L96 I97Y64-I93 HydrophobicContact CE1-CB 4.19Å; Y64-I93 HydrophobicContact CE1-CG2 3.86Å; S89-I93 WeakPolarHBondContact O-CD1 3.41Å; S89-I93 VanDerWaalsContact O-CG1 3.29Å; S89-I93 WeakPolarHBondContact O-CG1 3.44Å; S89-I93 PolarHBondContact O-N 3.39Å; S89-I93 VanDerWaalsContact O-N 3.11Å; S90-I93 PolarHBondContact O-N 3.27Å; M91-I93 VanDerWaalsContact C-N 3.31Å; M91-I93 PolarHBondContact O-N 2.89Å; I93-L96 PolarHBondContact O-N 3.31Å; I93-I97 HydrophobicContact CG2-CD1 3.73Å; I93-I97 HydrophobicContact CG2-CG1 4.44Å; I93-I97 VanDerWaalsContact O-CG1 3.3Å; I93-I97 WeakPolarHBondContact O-CG1 3.37Å; I93-I97 PolarHBondContact O-N 3.16Å
94V97.3Very high95.7Very high0 Ų039.7 Ų39.70%023%0.231CC..Hα-helixtrans-57.4-52177.3171.30000110.7T61 Y64 A68 S90 M91 L96 I97 E98T61-V94 HydrophobicContact CG2-CG1 4.22Å; Y64-V94 HydrophobicContact CD1-CG2 3.34Å; Y64-V94 HydrophobicContact CE1-CG2 3.63Å; Y64-V94 HydrophobicContact CG-CG2 4.27Å; A68-V94 HydrophobicContact CB-CG2 4.35Å; S90-V94 VanDerWaalsContact O-CG2 3.3Å; S90-V94 WeakPolarHBondContact O-CG2 3.32Å; S90-V94 PolarHBondContact O-N 2.97Å; M91-V94 HydrophobicContact CE-CG2 4.43Å; M91-V94 PolarHBondContact O-N 3.37Å; V94-L96 VanDerWaalsContact C-N 3.31Å; V94-L96 PolarHBondContact O-N 2.89Å; V94-I97 PolarHBondContact O-N 3.39Å; V94-I97 VanDerWaalsContact O-N 3.14Å; V94-E98 HydrophobicContact CG1-CG 4.3Å; V94-E98 WeakPolarHBondContact CG1-OE1 3.4Å; V94-E98 WeakPolarHBondContact O-CG 3.29Å; V94-E98 PolarHBondContact O-N 2.63Å
95T96.8Very high95.8Very high12 Ų1238.6 Ų38.67%0.07422%0.222CC..Hα-helixtrans-58.8-41180-55.20000112.2M91 C92 E98 I99 A200 Q203M91-T95 PolarHBondContact O-N 3.12Å; M91-T95 PolarHBondContact O-OG1 3.19Å; C92-T95 PolarHBondContact O-N 3.28Å; T95-E98 PolarHBondContact O-N 3.33Å; T95-I99 HydrophobicContact CG2-CD1 4.01Å; T95-I99 VanDerWaalsContact O-CG1 3.28Å; T95-I99 WeakPolarHBondContact O-CG1 3.26Å; T95-I99 PolarHBondContact O-N 2.83Å; T95-A200 HydrophobicContact CG2-CB 4.18Å; T95-Q203 HydrophobicContact CG2-CB 4.33Å; T95-Q203 PolarHBondContact OG1-OE1 3.48Å
96L97.1Very high95.9Very high120 Ų12036.6 Ų36.663%0.62822%0.219SC*.Hα-helixtrans-65.2-41.6177.7-71173000112.1C92 I93 V94 A100C92-L96 VanDerWaalsContact O-CG 3.26Å; C92-L96 WeakPolarHBondContact O-CG 3.25Å; C92-L96 PolarHBondContact O-N 3.44Å; I93-L96 PolarHBondContact O-N 3.31Å; V94-L96 VanDerWaalsContact C-N 3.31Å; V94-L96 PolarHBondContact O-N 2.89Å; L96-A100 WeakPolarHBondContact O-CB 3.47Å; L96-A100 PolarHBondContact O-N 2.77Å
97I96.1Very high95.8Very high50 Ų5037.7 Ų37.726%0.25623%0.229SC..Hα-helixtrans-65.3-44.2176.3-66.1168.2000110.3T61 I93 V94 I99 A100 I101T61-I97 HydrophobicContact CG2-CB 4.41Å; T61-I97 HydrophobicContact CG2-CG2 4.03Å; T61-I97 WeakPolarHBondContact OG1-CG2 3.34Å; I93-I97 HydrophobicContact CG2-CD1 3.73Å; I93-I97 HydrophobicContact CG2-CG1 4.44Å; I93-I97 VanDerWaalsContact O-CG1 3.3Å; I93-I97 WeakPolarHBondContact O-CG1 3.37Å; I93-I97 PolarHBondContact O-N 3.16Å; V94-I97 PolarHBondContact O-N 3.39Å; V94-I97 VanDerWaalsContact O-N 3.14Å; I97-I99 PolarHBondContact O-N 3.36Å; I97-A100 PolarHBondContact O-N 3.43Å; I97-I101 HydrophobicContact CG2-CD1 3.56Å; I97-I101 HydrophobicContact CG2-CG1 4.1Å; I97-I101 VanDerWaalsContact O-CG1 3.32Å; I97-I101 WeakPolarHBondContact O-CG1 3.41Å; I97-I101 PolarHBondContact O-N 2.93Å
98E95.7Very high95.7Very high2 Ų240.3 Ų40.31%0.00924%0.242CC..Hα-helixtrans-58.6-45.2177.8-73.7174.1-176.800112F25 T61 V94 T95 I101 A102 Q203F25-E98 VanDerWaalsContact CE1-OE1 3.31Å; F25-E98 WeakPolarHBondContact CE1-OE1 3.36Å; T61-E98 HydrophobicContact CG2-CG 3.73Å; V94-E98 HydrophobicContact CG1-CG 4.3Å; V94-E98 WeakPolarHBondContact CG1-OE1 3.4Å; V94-E98 WeakPolarHBondContact O-CG 3.29Å; V94-E98 PolarHBondContact O-N 2.63Å; T95-E98 PolarHBondContact O-N 3.33Å; E98-I101 PolarHBondContact O-N 3.42Å; E98-A102 WeakPolarHBondContact O-CB 3.18Å; E98-A102 PolarHBondContact O-N 3.44Å; E98-Q203 PolarHBondContact OE2-NE2 3.5Å; E98-Q203 PolarHBondContact OE2-OE1 2.82Å; E98-Q203 VanDerWaalsContact OE2-OE1 3.12Å
99I96.7Very high95.4Very high66 Ų6642.6 Ų42.634%0.33825%0.25SS..Hα-helixtrans-62.7-43.5175.8-66.9166.5000110.8T95 I97 A102 T103 A200T95-I99 HydrophobicContact CG2-CD1 4.01Å; T95-I99 VanDerWaalsContact O-CG1 3.28Å; T95-I99 WeakPolarHBondContact O-CG1 3.26Å; T95-I99 PolarHBondContact O-N 2.83Å; I97-I99 PolarHBondContact O-N 3.36Å; I99-A102 PolarHBondContact O-N 2.95Å; I99-T103 HydrophobicContact CG2-CG2 4.29Å; I99-T103 WeakPolarHBondContact O-CB 3.38Å; I99-T103 VanDerWaalsContact O-CG2 3.26Å; I99-T103 WeakPolarHBondContact O-CG2 3.3Å; I99-T103 PolarHBondContact O-N 3.49Å; I99-T103 PolarHBondContact O-OG1 3.3Å; I99-A200 HydrophobicContact CD1-CB 4.14Å; I99-A200 HydrophobicContact CG1-CB 3.82Å
100A96.3Very high95.2Very high50 Ų5045.8 Ų45.841%0.41326%0.263SS..Hα-helixtrans-63.9-45.5179.700000112.3L96 I97 T103 T104L96-A100 WeakPolarHBondContact O-CB 3.47Å; L96-A100 PolarHBondContact O-N 2.77Å; I97-A100 PolarHBondContact O-N 3.43Å; A100-T103 PolarHBondContact O-OG1 3.29Å; A100-T104 VanDerWaalsContact O-CB 3.27Å; A100-T104 WeakPolarHBondContact O-CB 3.28Å; A100-T104 PolarHBondContact O-N 3.35Å; A100-T104 PolarHBondContact O-OG1 3.14Å
101I94.7Very high95Very high6 Ų651.1 Ų51.13%0.03129%0.288CS..Hα-helixtrans-66.2-44.6177.4-62.4171.5000110.3M57 I58 I97 E98 T104 S105 F192M57-I101 HydrophobicContact CB-CD1 3.86Å; I58-I101 HydrophobicContact CD1-CG2 4.15Å; I58-I101 HydrophobicContact CG1-CD1 4.44Å; I58-I101 HydrophobicContact CG1-CG2 3.72Å; I97-I101 HydrophobicContact CG2-CD1 3.56Å; I97-I101 HydrophobicContact CG2-CG1 4.1Å; I97-I101 VanDerWaalsContact O-CG1 3.32Å; I97-I101 WeakPolarHBondContact O-CG1 3.41Å; I97-I101 PolarHBondContact O-N 2.93Å; E98-I101 PolarHBondContact O-N 3.42Å; I101-T104 PolarHBondContact O-N 3.26Å; I101-S105 VanDerWaalsContact O-CB 3.23Å; I101-S105 WeakPolarHBondContact O-CB 3.36Å; I101-S105 PolarHBondContact O-N 2.91Å; I101-S105 PolarHBondContact O-OG 3.48Å; I101-F192 HydrophobicContact CB-CE1 4.48Å; I101-F192 HydrophobicContact CB-CZ 4.26Å; I101-F192 HydrophobicContact CG2-CE1 3.65Å; I101-F192 HydrophobicContact CG2-CZ 3.6Å
102A95.8Very high94.8Very high0 Ų052.7 Ų52.70%030%0.295CS..Hα-helixtrans-63.2-45.1-179.500000112.1E98 I99 A106 C196 F197E98-A102 WeakPolarHBondContact O-CB 3.18Å; E98-A102 PolarHBondContact O-N 3.44Å; I99-A102 PolarHBondContact O-N 2.95Å; A102-A106 WeakPolarHBondContact O-CB 3.36Å; A102-A106 PolarHBondContact O-N 3.38Å; A102-C196 HydrophobicContact CB-CB 3.88Å; A102-F197 HydrophobicContact CB-CD2 4.31Å; A102-F197 HydrophobicContact CB-CE1 4.44Å; A102-F197 HydrophobicContact CB-CE2 3.96Å; A102-F197 HydrophobicContact CB-CZ 4.02Å
103T95.9Very high94.7Very high62 Ų6254.4 Ų54.438%0.3830%0.296SS..Hα-helixtrans-65.3-42.6177.450.20000112.1I99 A100 A106 V107 F197I99-T103 HydrophobicContact CG2-CG2 4.29Å; I99-T103 WeakPolarHBondContact O-CB 3.38Å; I99-T103 VanDerWaalsContact O-CG2 3.26Å; I99-T103 WeakPolarHBondContact O-CG2 3.3Å; I99-T103 PolarHBondContact O-N 3.49Å; I99-T103 PolarHBondContact O-OG1 3.3Å; A100-T103 PolarHBondContact O-OG1 3.29Å; T103-A106 PolarHBondContact O-N 3.02Å; T103-V107 PolarHBondContact O-N 3.33Å; T103-F197 HydrophobicContact CG2-CE1 4.04Å; T103-F197 HydrophobicContact CG2-CZ 3.73Å
104T95.2Very high94.6Very high54 Ų5454.1 Ų54.133%0.33130%0.298SS..Hα-helixtrans-67.9-42.1178.9-57.70000111L54 A100 I101 A106 V107 M108L54-T104 HydrophobicContact CD1-CG2 4.07Å; L54-T104 HydrophobicContact CD2-CG2 4.02Å; A100-T104 VanDerWaalsContact O-CB 3.27Å; A100-T104 WeakPolarHBondContact O-CB 3.28Å; A100-T104 PolarHBondContact O-N 3.35Å; A100-T104 PolarHBondContact O-OG1 3.14Å; I101-T104 PolarHBondContact O-N 3.26Å; T104-A106 VanDerWaalsContact C-N 3.29Å; T104-A106 PolarHBondContact O-N 3.32Å; T104-V107 VanDerWaalsContact O-CG2 3.26Å; T104-V107 WeakPolarHBondContact O-CG2 3.3Å; T104-V107 PolarHBondContact O-N 3.07Å; T104-M108 HydrophobicContact CG2-CG 4.2Å; T104-M108 HydrophobicContact CG2-SD 3.63Å; T104-M108 WeakPolarHBondContact O-CB 3.13Å; T104-M108 VanDerWaalsContact O-CG 3.28Å; T104-M108 WeakPolarHBondContact O-CG 3.45Å; T104-M108 PolarHBondContact O-N 2.71Å
105S93.1Very high94.5Very high9 Ų957.2 Ų57.26%0.06332%0.317CS..Hα-helixtrans-64-34.7176.7-56.30000112I101 V107I101-S105 VanDerWaalsContact O-CB 3.23Å; I101-S105 WeakPolarHBondContact O-CB 3.36Å; I101-S105 PolarHBondContact O-N 2.91Å; I101-S105 PolarHBondContact O-OG 3.48Å; S105-V107 VanDerWaalsContact C-N 3.27Å; S105-V107 PolarHBondContact O-N 3.48Å
106A93.9Very high94.4Very high55 Ų5556.9 Ų56.946%0.45532%0.315SS..Hα-helixtrans-64.5-29.1178.700000113.4A102 T103 T104 I193A102-A106 WeakPolarHBondContact O-CB 3.36Å; A102-A106 PolarHBondContact O-N 3.38Å; T103-A106 PolarHBondContact O-N 3.02Å; T104-A106 VanDerWaalsContact C-N 3.29Å; T104-A106 PolarHBondContact O-N 3.32Å; A106-I193 HydrophobicContact CB-CD1 4.08Å
107V93.6Very high94.4Very high115 Ų11552.5 Ų52.570%0.69729%0.292SS*.Hα-helixtrans-98.7-14.2-177.8-590000113.8T103 T104 S105T103-V107 PolarHBondContact O-N 3.33Å; T104-V107 VanDerWaalsContact O-CG2 3.26Å; T104-V107 WeakPolarHBondContact O-CG2 3.3Å; T104-V107 PolarHBondContact O-N 3.07Å; S105-V107 VanDerWaalsContact C-N 3.27Å; S105-V107 PolarHBondContact O-N 3.48Å
108M91.4Very high94.4Very high59 Ų5954.1 Ų54.129%0.29130%0.301SS..  trans-89.22.4-173.6-76.8-169.177.400115.2L54 T104 D110 Q111 F112L54-M108 HydrophobicContact CD1-SD 3.7Å; T104-M108 HydrophobicContact CG2-CG 4.2Å; T104-M108 HydrophobicContact CG2-SD 3.63Å; T104-M108 WeakPolarHBondContact O-CB 3.13Å; T104-M108 VanDerWaalsContact O-CG 3.28Å; T104-M108 WeakPolarHBondContact O-CG 3.45Å; T104-M108 PolarHBondContact O-N 2.71Å; M108-D110 PolarHBondContact O-N 2.87Å; M108-Q111 PolarHBondContact O-N 2.96Å; M108-F112 WeakPolarHBondContact O-CB 3.36Å; M108-F112 PolarHBondContact O-N 3.28Å
109Y89.4Confident94.5Very high62 Ų6254.3 Ų54.324%0.24330%0.302CS..Hα-helixtrans-57.8-51.8-177.6174.6-103.4000113.1Q111 F112 Y113 D183 Q186Y109-Q111 VanDerWaalsContact C-N 3.28Å; Y109-Q111 PolarHBondContact O-N 3.34Å; Y109-F112 WeakPolarHBondContact O-CB 3.37Å; Y109-F112 PolarHBondContact O-N 3.09Å; Y109-F112 VanDerWaalsContact O-N 3.13Å; Y109-Y113 PolarHBondContact O-N 2.93Å; Y109-D183 PolarHBondContact OH-OD1 2.98Å; Y109-Q186 HydrophobicContact CD2-CB 4.02Å; Y109-Q186 HydrophobicContact CD2-CG 3.58Å; Y109-Q186 VanDerWaalsContact CD2-OE1 3.31Å; Y109-Q186 HydrophobicContact CE2-CB 3.75Å; Y109-Q186 HydrophobicContact CE2-CG 3.56Å
110D93Very high94.6Very high115 Ų11551.1 Ų51.162%0.61529%0.286SS*.Hα-helixtrans-64.2-36-176.9-65.7-36.2000112M108 T114M108-D110 PolarHBondContact O-N 2.87Å; D110-T114 WeakPolarHBondContact O-CB 3.45Å; D110-T114 PolarHBondContact O-N 3.42Å; D110-T114 PolarHBondContact O-OG1 3.43Å
111Q92.7Very high94.6Very high116 Ų11650.9 Ų50.954%0.54228%0.277SS..Hα-helixtrans-65-46.9174.2-176.5178.8-10.400110.7M108 Y109 Y113 T114 T115M108-Q111 PolarHBondContact O-N 2.96Å; Y109-Q111 VanDerWaalsContact C-N 3.28Å; Y109-Q111 PolarHBondContact O-N 3.34Å; Q111-Y113 VanDerWaalsContact C-N 3.34Å; Q111-Y113 PolarHBondContact O-N 2.89Å; Q111-T114 PolarHBondContact O-N 2.78Å; Q111-T115 WeakPolarHBondContact O-CB 3.2Å; Q111-T115 PolarHBondContact O-N 3.42Å; Q111-T115 PolarHBondContact O-OG1 3.01Å; Q111-T115 VanDerWaalsContact O-OG1 3.12Å
112F92.1Very high94.7Very high34 Ų3453 Ų5315%0.14929%0.289CS..Hα-helixtrans-61.1-42.8177.3177.5-109.8000112L40 M108 Y109 T116 F181 T182 I185L40-F112 HydrophobicContact CD2-CE2 4.3Å; L40-F112 HydrophobicContact CD2-CZ 4.26Å; M108-F112 WeakPolarHBondContact O-CB 3.36Å; M108-F112 PolarHBondContact O-N 3.28Å; Y109-F112 WeakPolarHBondContact O-CB 3.37Å; Y109-F112 PolarHBondContact O-N 3.09Å; Y109-F112 VanDerWaalsContact O-N 3.13Å; F112-T116 VanDerWaalsContact O-CB 3.3Å; F112-T116 WeakPolarHBondContact O-CB 3.42Å; F112-T116 PolarHBondContact O-N 3.36Å; F112-T116 PolarHBondContact O-OG1 3.33Å; F112-F181 HydrophobicContact CZ-CE1 4.32Å; F112-T182 HydrophobicContact CD1-CG2 4.18Å; F112-T182 HydrophobicContact CE1-CG2 3.98Å; F112-I185 HydrophobicContact CE1-CB 3.99Å; F112-I185 HydrophobicContact CE1-CG1 4.47Å; F112-I185 HydrophobicContact CE1-CG2 3.89Å; F112-I185 HydrophobicContact CZ-CB 4.2Å; F112-I185 HydrophobicContact CZ-CG1 4.27Å; F112-I185 HydrophobicContact CZ-CG2 3.93Å
113Y94.9Very high94.8Very high76 Ų7653 Ų5330%0.29829%0.289SS..Hα-helixtrans-58.9-51.1174.3-179.2-86.5000111.2Y109 Q111 T115 T116 H117 T178 K179 T182Y109-Y113 PolarHBondContact O-N 2.93Å; Q111-Y113 VanDerWaalsContact C-N 3.34Å; Q111-Y113 PolarHBondContact O-N 2.89Å; Y113-T115 PolarHBondContact O-N 3.03Å; Y113-T116 PolarHBondContact O-N 2.87Å; Y113-H117 HydrophobicContact CE1-CB 4.39Å; Y113-H117 WeakPolarHBondContact O-CB 3.29Å; Y113-H117 PolarHBondContact O-N 3.31Å; Y113-T178 HydrophobicContact CD2-CG2 4.17Å; Y113-T178 HydrophobicContact CE1-CG2 4.32Å; Y113-T178 HydrophobicContact CE2-CG2 3.75Å; Y113-K179 HydrophobicContact CE2-CB 4.39Å; Y113-T182 HydrophobicContact CD2-CG2 3.93Å; Y113-T182 WeakPolarHBondContact CD2-OG1 3.22Å
114T95.3Very high94.9Very high73 Ų7350 Ų5045%0.44827%0.271SS..Hα-helixtrans-63.5-42.5-177.5-570000112.1D110 Q111 H117 N118D110-T114 WeakPolarHBondContact O-CB 3.45Å; D110-T114 PolarHBondContact O-N 3.42Å; D110-T114 PolarHBondContact O-OG1 3.43Å; Q111-T114 PolarHBondContact O-N 2.78Å; T114-H117 WeakPolarHBondContact O-CB 3.49Å; T114-H117 PolarHBondContact O-N 2.99Å; T114-N118 PolarHBondContact O-N 3.12Å; T114-N118 PolarHBondContact O-ND2 2.97Å
115T94Very high95Very high66 Ų6651.9 Ų51.941%0.40527%0.274SS..Hα-helixtrans-63.1-48.2176-63.90000111.1Q111 Y113 H117 N118 A119Q111-T115 WeakPolarHBondContact O-CB 3.2Å; Q111-T115 PolarHBondContact O-N 3.42Å; Q111-T115 PolarHBondContact O-OG1 3.01Å; Q111-T115 VanDerWaalsContact O-OG1 3.12Å; Y113-T115 PolarHBondContact O-N 3.03Å; T115-H117 VanDerWaalsContact C-N 3.31Å; T115-H117 PolarHBondContact O-N 3.39Å; T115-N118 PolarHBondContact O-N 3.29Å; T115-A119 VanDerWaalsContact O-CB 3.29Å; T115-A119 WeakPolarHBondContact O-CB 3.31Å; T115-A119 PolarHBondContact O-N 2.93Å
116T95.6Very high95.1Very high4 Ų457.7 Ų57.73%0.02530%0.295CS..Hα-helixtrans-60.3-43.7177.4-59.50000111.2L47 F112 Y113 A119 L120 T178 F181 T182L47-T116 HydrophobicContact CD2-CG2 3.84Å; F112-T116 VanDerWaalsContact O-CB 3.3Å; F112-T116 WeakPolarHBondContact O-CB 3.42Å; F112-T116 PolarHBondContact O-N 3.36Å; F112-T116 PolarHBondContact O-OG1 3.33Å; Y113-T116 PolarHBondContact O-N 2.87Å; T116-A119 PolarHBondContact O-N 3.49Å; T116-L120 HydrophobicContact CG2-CD1 3.86Å; T116-L120 HydrophobicContact CG2-CG 4.23Å; T116-L120 WeakPolarHBondContact O-CB 3.44Å; T116-L120 VanDerWaalsContact O-CG 3.31Å; T116-L120 WeakPolarHBondContact O-CG 3.4Å; T116-L120 PolarHBondContact O-N 3.2Å; T116-T178 HydrophobicContact CG2-CG2 4.39Å; T116-F181 HydrophobicContact CG2-CD1 3.96Å; T116-T182 HydrophobicContact CG2-CG2 3.87Å
117H97.3Very high95.3Very high29 Ų2955.1 Ų55.113%0.13427%0.274CS..Hα-helixtrans-57.7-53179.6179.167000112.3Y113 T114 T115 A119 L120 L121 E150 T178Y113-H117 HydrophobicContact CE1-CB 4.39Å; Y113-H117 WeakPolarHBondContact O-CB 3.29Å; Y113-H117 PolarHBondContact O-N 3.31Å; T114-H117 WeakPolarHBondContact O-CB 3.49Å; T114-H117 PolarHBondContact O-N 2.99Å; T115-H117 VanDerWaalsContact C-N 3.31Å; T115-H117 PolarHBondContact O-N 3.39Å; H117-A119 PolarHBondContact O-N 3.13Å; H117-L120 PolarHBondContact O-N 3.32Å; H117-L121 WeakPolarHBondContact NE2-CD1 3.43Å; H117-L121 PolarHBondContact O-N 2.98Å; H117-E150 VanDerWaalsContact CE1-CG 3.46Å; H117-E150 WeakPolarHBondContact CE1-CG 3.31Å; H117-E150 IonicContact CE1-OE1 3.58Å; H117-E150 PolarHBondContact CE1-OE1 2.76Å; H117-E150 IonicContact NE2-OE1 3.55Å; H117-T178 HydrophobicContact CB-CG2 3.57Å
118N96.8Very high95.5Very high84 Ų8454.5 Ų54.545%0.44926%0.259SS..Hα-helixtrans-64.1-42.6180-69.4-26.7000111.4T114 T115 L121 D122T114-N118 PolarHBondContact O-N 3.12Å; T114-N118 PolarHBondContact O-ND2 2.97Å; T115-N118 PolarHBondContact O-N 3.29Å; N118-L121 PolarHBondContact O-N 3.3Å; N118-D122 PolarHBondContact O-N 3.28Å
119A97.2Very high95.7Very high5 Ų559 Ų594%0.04128%0.277CS..Hα-helixtrans-63.1-43.717900000112I46 L47 T115 T116 H117 D122 A123I46-A119 CarbonylContact O-C 3.6Å; L47-A119 WeakPolarHBondContact O-CB 3.31Å; T115-A119 VanDerWaalsContact O-CB 3.29Å; T115-A119 WeakPolarHBondContact O-CB 3.31Å; T115-A119 PolarHBondContact O-N 2.93Å; T116-A119 PolarHBondContact O-N 3.49Å; H117-A119 PolarHBondContact O-N 3.13Å; A119-D122 CarbonylContact O-C 3.52Å; A119-D122 PolarHBondContact O-N 3.05Å; A119-A123 WeakPolarHBondContact O-CB 3.32Å; A119-A123 PolarHBondContact O-N 2.85Å
120L97.9Very high96.1Very high0 Ų058.7 Ų58.70%028%0.28CS..Hα-helixtrans-68.3-35.1176.8-69.4-179.7000112.6I46 L47 T116 H117 D122 A123 V124 M137 L140 A149 C177I46-L120 HydrophobicContact CD1-CD2 3.92Å; I46-L120 HydrophobicContact CG1-CD2 4.43Å; L47-L120 HydrophobicContact CD2-CD2 4.49Å; T116-L120 HydrophobicContact CG2-CD1 3.86Å; T116-L120 HydrophobicContact CG2-CG 4.23Å; T116-L120 WeakPolarHBondContact O-CB 3.44Å; T116-L120 VanDerWaalsContact O-CG 3.31Å; T116-L120 WeakPolarHBondContact O-CG 3.4Å; T116-L120 PolarHBondContact O-N 3.2Å; H117-L120 PolarHBondContact O-N 3.32Å; L120-D122 VanDerWaalsContact C-N 3.3Å; L120-D122 PolarHBondContact O-N 3.39Å; L120-A123 WeakPolarHBondContact O-CB 3.19Å; L120-A123 PolarHBondContact O-N 3.22Å; L120-V124 WeakPolarHBondContact O-CG2 3.42Å; L120-V124 PolarHBondContact O-N 3.46Å; L120-M137 HydrophobicContact CD2-SD 4.13Å; L120-L140 HydrophobicContact CD1-CD2 4.2Å; L120-L140 HydrophobicContact CD2-CD2 3.66Å; L120-A149 HydrophobicContact CB-CB 3.75Å; L120-C177 HydrophobicContact CD1-CB 4.12Å
121L97.6Very high96.3Very high44 Ų4457.6 Ų57.623%0.2328%0.279CS..Hα-helixtrans-61.3-41.5172.4-82.1175.2000111.4H117 N118 K125 A149H117-L121 WeakPolarHBondContact NE2-CD1 3.43Å; H117-L121 PolarHBondContact O-N 2.98Å; N118-L121 PolarHBondContact O-N 3.3Å; L121-K125 WeakPolarHBondContact O-CG 3.26Å; L121-K125 PolarHBondContact O-N 3.48Å; L121-A149 HydrophobicContact CB-CB 4.36Å; L121-A149 HydrophobicContact CD2-CB 3.7Å; L121-A149 HydrophobicContact CG-CB 3.69Å
122D96.7Very high96.4Very high51 Ų5156 Ų5627%0.27327%0.272SS..Hα-helixtrans-69.7-36.5174.3-77.1-16.1000111.9N118 A119 L120 V124 K125 W126N118-D122 PolarHBondContact O-N 3.28Å; A119-D122 CarbonylContact O-C 3.52Å; A119-D122 PolarHBondContact O-N 3.05Å; L120-D122 VanDerWaalsContact C-N 3.3Å; L120-D122 PolarHBondContact O-N 3.39Å; D122-V124 VanDerWaalsContact C-N 3.31Å; D122-V124 PolarHBondContact O-N 2.75Å; D122-K125 WeakPolarHBondContact O-CB 3.36Å; D122-K125 PolarHBondContact O-N 3.46Å; D122-K125 VanDerWaalsContact O-N 3.14Å; D122-K125 IonicContact OD1-NZ 3.12Å; D122-K125 PolarHBondContact OD1-NZ 3.5Å; D122-W126 VanDerWaalsContact O-CD1 3.26Å; D122-W126 PolarHBondContact O-N 3.03Å
123A97.5Very high96.7Very high0 Ų055.6 Ų55.60%027%0.269CS..Hα-helixtrans-58.6-43.9174.500000111.8I46 A119 L120 K125 W126 F127 Y133I46-A123 HydrophobicContact CB-CB 3.79Å; I46-A123 HydrophobicContact CG2-CB 4.02Å; A119-A123 WeakPolarHBondContact O-CB 3.32Å; A119-A123 PolarHBondContact O-N 2.85Å; L120-A123 WeakPolarHBondContact O-CB 3.19Å; L120-A123 PolarHBondContact O-N 3.22Å; A123-K125 PolarHBondContact O-N 2.89Å; A123-W126 PolarHBondContact O-N 3.34Å; A123-F127 PolarHBondContact O-N 3.43Å; A123-Y133 HydrophobicContact CB-CD1 4.12Å; A123-Y133 HydrophobicContact CB-CE1 4.33Å
124V97.9Very high96.8Very high0 Ų055.6 Ų55.60%027%0.272CS..Hα-helixtrans-59.9-44.8174.7171.40000111.3L120 D122 W126 F127 M137 D154 Y155 M160L120-V124 WeakPolarHBondContact O-CG2 3.42Å; L120-V124 PolarHBondContact O-N 3.46Å; D122-V124 VanDerWaalsContact C-N 3.31Å; D122-V124 PolarHBondContact O-N 2.75Å; V124-W126 PolarHBondContact O-N 2.88Å; V124-F127 VanDerWaalsContact O-CB 3.31Å; V124-F127 WeakPolarHBondContact O-CB 3.39Å; V124-F127 PolarHBondContact O-N 2.76Å; V124-M137 HydrophobicContact CG2-CE 3.98Å; V124-D154 HydrophobicContact CG1-CB 3.93Å; V124-D154 HydrophobicContact CG2-CB 4.42Å; V124-Y155 HydrophobicContact CG1-CD1 3.86Å; V124-Y155 HydrophobicContact CG1-CD2 4.31Å; V124-Y155 HydrophobicContact CG1-CE1 3.9Å; V124-Y155 HydrophobicContact CG1-CE2 4.35Å; V124-Y155 HydrophobicContact CG1-CG 4.07Å; V124-Y155 HydrophobicContact CG2-CE2 4.22Å; V124-M160 HydrophobicContact CG1-CE 3.93Å; V124-M160 WeakPolarHBondContact O-CE 3.39Å
125K96.9Very high96.9Very high92 Ų9257.2 Ų57.240%0.428%0.277SS..Hα-helixtrans-59.8-33.4179.9-68.4171.3-165.7160.10113.2L121 D122 A123L121-K125 WeakPolarHBondContact O-CG 3.26Å; L121-K125 PolarHBondContact O-N 3.48Å; D122-K125 WeakPolarHBondContact O-CB 3.36Å; D122-K125 PolarHBondContact O-N 3.46Å; D122-K125 VanDerWaalsContact O-N 3.14Å; D122-K125 IonicContact OD1-NZ 3.12Å; D122-K125 PolarHBondContact OD1-NZ 3.5Å; A123-K125 PolarHBondContact O-N 2.89Å
126W96.2Very high97.1Very high131 Ų13154.6 Ų54.650%0.49626%0.26SS..Hα-helixtrans-1012.1-176.4-67.8106.5000113.9D122 A123 V124 Y128 K129 N130 Y133D122-W126 VanDerWaalsContact O-CD1 3.26Å; D122-W126 PolarHBondContact O-N 3.03Å; A123-W126 PolarHBondContact O-N 3.34Å; V124-W126 PolarHBondContact O-N 2.88Å; W126-Y128 PolarHBondContact O-N 2.88Å; W126-K129 HydrophobicContact CE3-CB 3.84Å; W126-K129 HydrophobicContact CE3-CD 3.69Å; W126-K129 HydrophobicContact CE3-CG 4.43Å; W126-K129 HydrophobicContact CZ3-CB 4.4Å; W126-K129 HydrophobicContact CZ3-CD 3.75Å; W126-K129 PolarHBondContact O-N 3.17Å; W126-N130 PolarHBondContact O-N 3.13Å; W126-Y133 HydrophobicContact CB-CD1 3.57Å; W126-Y133 HydrophobicContact CB-CE1 3.81Å; W126-Y133 HydrophobicContact CB-CG 4.38Å; W126-Y133 HydrophobicContact CG-CE1 4.4Å
127F97.6Very high97.2Very high2 Ų254.4 Ų54.41%0.00926%0.259CS..G310 helixtrans-48-61.5-174.7-177.6-89.5000113A123 V124 K129 E134 M137 D138 Y155 P163A123-F127 PolarHBondContact O-N 3.43Å; V124-F127 VanDerWaalsContact O-CB 3.31Å; V124-F127 WeakPolarHBondContact O-CB 3.39Å; V124-F127 PolarHBondContact O-N 2.76Å; F127-K129 PolarHBondContact O-N 2.94Å; F127-E134 HydrophobicContact CE1-CG 3.97Å; F127-E134 HydrophobicContact CE2-CB 4.49Å; F127-E134 HydrophobicContact CE2-CG 4.25Å; F127-E134 HydrophobicContact CZ-CB 4.45Å; F127-E134 HydrophobicContact CZ-CG 3.77Å; F127-M137 HydrophobicContact CD2-CB 3.76Å; F127-M137 HydrophobicContact CD2-CG 3.84Å; F127-M137 HydrophobicContact CE2-CB 3.82Å; F127-M137 HydrophobicContact CE2-CG 4Å; F127-D138 WeakPolarHBondContact CE2-OD1 3.37Å; F127-D138 WeakPolarHBondContact CZ-OD1 3.27Å; F127-Y155 HydrophobicContact CB-CE1 3.86Å; F127-Y155 AromaticContact CD1-CE1 3.94Å; F127-Y155 HydrophobicContact CD1-CE1 3.94Å; F127-Y155 HydrophobicContact CD2-CE1 4.03Å; F127-Y155 VanDerWaalsContact CD2-OH 3.26Å; F127-Y155 WeakPolarHBondContact CD2-OH 3.42Å; F127-Y155 AromaticContact CG-CE1 3.66Å; F127-Y155 HydrophobicContact CG-CE1 3.66Å; F127-P163 HydrophobicContact CD1-CG 4.21Å; F127-P163 HydrophobicContact CE1-CB 4.02Å; F127-P163 HydrophobicContact CE1-CG 3.62Å; F127-P163 HydrophobicContact CE2-CB 4.46Å; F127-P163 HydrophobicContact CE2-CG 4.07Å; F127-P163 HydrophobicContact CZ-CB 3.69Å; F127-P163 HydrophobicContact CZ-CG 3.54Å
128Y97.1Very high97.3Very high102 Ų10255.1 Ų55.140%0.426%0.263SS..G310 helixtrans-78.63.2-179.3-67-70.2000114.7W126 M160 N161W126-Y128 PolarHBondContact O-N 2.88Å; Y128-M160 HydrophobicContact CD2-CB 4.01Å; Y128-M160 HydrophobicContact CD2-CG 4.17Å; Y128-M160 HydrophobicContact CD2-SD 3.7Å; Y128-M160 HydrophobicContact CE2-CB 3.84Å; Y128-M160 HydrophobicContact CE2-SD 4.34Å; Y128-N161 WeakPolarHBondContact CE2-O 3.42Å; Y128-N161 PolarHBondContact OH-O 3.25Å
129K96.7Very high97.3Very high153 Ų15353.5 Ų53.567%0.66526%0.259SS*.G310 helixtrans-111.8-19.9-176.4-67.6179.6-178.7173.40112.6W126 F127W126-K129 HydrophobicContact CE3-CB 3.84Å; W126-K129 HydrophobicContact CE3-CD 3.69Å; W126-K129 HydrophobicContact CE3-CG 4.43Å; W126-K129 HydrophobicContact CZ3-CB 4.4Å; W126-K129 HydrophobicContact CZ3-CD 3.75Å; W126-K129 PolarHBondContact O-N 3.17Å; F127-K129 PolarHBondContact O-N 2.94Å
130N96.3Very high97.4Very high56 Ų5653.4 Ų53.430%0.29926%0.258SS..  trans-127.8110.6-178.7-176.6-35.2000109W126 Q132 Y133 E134W126-N130 PolarHBondContact O-N 3.13Å; N130-Q132 PolarHBondContact O-N 3.35Å; N130-Q132 VanDerWaalsContact O-N 3.16Å; N130-Q132 WeakPolarHBondContact OD1-CB 3.36Å; N130-Q132 PolarHBondContact OD1-N 3.49Å; N130-Y133 HydrophobicContact CB-CD2 3.92Å; N130-Y133 HydrophobicContact CB-CG 3.92Å; N130-Y133 WeakPolarHBondContact ND2-CD2 3.23Å; N130-Y133 WeakPolarHBondContact O-CB 3.47Å; N130-Y133 PolarHBondContact O-N 2.83Å; N130-Y133 PolarHBondContact OD1-N 3.25Å; N130-E134 PolarHBondContact O-N 3.46Å
131P97.2Very high97.4Very high92 Ų9253.4 Ų53.460%0.59726%0.258SS*.Hα-helixtrans-56.1-33.8-178.5-27.334.8000113.9E134 I135P131-E134 PolarHBondContact O-N 3.33Å; P131-I135 WeakPolarHBondContact O-CD1 3.46Å; P131-I135 VanDerWaalsContact O-CG1 3.23Å; P131-I135 WeakPolarHBondContact O-CG1 3.3Å; P131-I135 PolarHBondContact O-N 3.4Å
132Q96.3Very high97.4Very high82 Ų8254.7 Ų54.738%0.38327%0.265SS..Hα-helixtrans-71.6-36.1178.6-170.962.617.300111.7T45 N130 I135 E136T45-Q132 HydrophobicContact CG2-CB 4.34Å; T45-Q132 HydrophobicContact CG2-CG 3.75Å; N130-Q132 PolarHBondContact O-N 3.35Å; N130-Q132 VanDerWaalsContact O-N 3.16Å; N130-Q132 WeakPolarHBondContact OD1-CB 3.36Å; N130-Q132 PolarHBondContact OD1-N 3.49Å; Q132-I135 PolarHBondContact O-N 3.15Å; Q132-E136 PolarHBondContact NE2-OE1 3Å; Q132-E136 PolarHBondContact O-N 3.25Å
133Y97.5Very high97.4Very high26 Ų2656.3 Ų56.310%0.10227%0.271CS..Hα-helixtrans-66.5-41.8174.7-79.4-138.5000110.7T45 I46 Q48 A123 W126 N130 M137T45-Y133 HydrophobicContact CG2-CD2 3.88Å; T45-Y133 HydrophobicContact CG2-CE2 3.62Å; I46-Y133 HydrophobicContact CG2-CD1 4.5Å; I46-Y133 HydrophobicContact CG2-CG 4.2Å; Q48-Y133 PolarHBondContact NE2-OH 3Å; A123-Y133 HydrophobicContact CB-CD1 4.12Å; A123-Y133 HydrophobicContact CB-CE1 4.33Å; W126-Y133 HydrophobicContact CB-CD1 3.57Å; W126-Y133 HydrophobicContact CB-CE1 3.81Å; W126-Y133 HydrophobicContact CB-CG 4.38Å; W126-Y133 HydrophobicContact CG-CE1 4.4Å; N130-Y133 HydrophobicContact CB-CD2 3.92Å; N130-Y133 HydrophobicContact CB-CG 3.92Å; N130-Y133 WeakPolarHBondContact ND2-CD2 3.23Å; N130-Y133 WeakPolarHBondContact O-CB 3.47Å; N130-Y133 PolarHBondContact O-N 2.83Å; N130-Y133 PolarHBondContact OD1-N 3.25Å; Y133-M137 WeakPolarHBondContact O-CB 3.33Å; Y133-M137 PolarHBondContact O-N 3.42Å
134E97.8Very high97.4Very high75 Ų7557.4 Ų57.435%0.3528%0.275SS..Hα-helixtrans-56.7-51.8174.3-173.4171.8-177.700110.9F127 N130 P131 D138F127-E134 HydrophobicContact CE1-CG 3.97Å; F127-E134 HydrophobicContact CE2-CB 4.49Å; F127-E134 HydrophobicContact CE2-CG 4.25Å; F127-E134 HydrophobicContact CZ-CB 4.45Å; F127-E134 HydrophobicContact CZ-CG 3.77Å; N130-E134 PolarHBondContact O-N 3.46Å; P131-E134 PolarHBondContact O-N 3.33Å; E134-D138 WeakPolarHBondContact O-CB 3.18Å; E134-D138 PolarHBondContact O-N 3.42Å
135I97.9Very high97.4Very high107 Ų10762 Ų6255%0.54930%0.295SS..Hα-helixtrans-59.4-52.2-179.7-68.7163.8000112.1P131 Q132 S139P131-I135 WeakPolarHBondContact O-CD1 3.46Å; P131-I135 VanDerWaalsContact O-CG1 3.23Å; P131-I135 WeakPolarHBondContact O-CG1 3.3Å; P131-I135 PolarHBondContact O-N 3.4Å; Q132-I135 PolarHBondContact O-N 3.15Å; I135-S139 WeakPolarHBondContact O-CB 3.48Å; I135-S139 PolarHBondContact O-N 3.33Å
136E97.7Very high97.5Very high12 Ų1257.6 Ų57.66%0.05628%0.276CS..Hα-helixtrans-69.9-39.2-175.9-73.9-176.4-156.300112K42 Y43 T45 I46 Q132 S139 L140K42-E136 WeakPolarHBondContact O-CG 3.39Å; Y43-E136 WeakPolarHBondContact CA-OE2 3.25Å; T45-E136 WeakPolarHBondContact CA-OE2 3.45Å; T45-E136 VanDerWaalsContact CB-CD 3.44Å; T45-E136 WeakPolarHBondContact CB-OE1 3.48Å; T45-E136 VanDerWaalsContact CB-OE2 3.22Å; T45-E136 WeakPolarHBondContact CB-OE2 3.34Å; T45-E136 PolarHBondContact N-OE2 3.4Å; T45-E136 PolarHBondContact OG1-OE1 3.31Å; I46-E136 HydrophobicContact CB-CB 4.49Å; I46-E136 HydrophobicContact CD1-CB 4.1Å; I46-E136 HydrophobicContact CG1-CB 4.12Å; I46-E136 HydrophobicContact CG2-CB 3.66Å; I46-E136 PolarHBondContact N-OE2 2.83Å; Q132-E136 PolarHBondContact NE2-OE1 3Å; Q132-E136 PolarHBondContact O-N 3.25Å; E136-S139 PolarHBondContact O-N 3.31Å; E136-L140 WeakPolarHBondContact O-CB 3.45Å; E136-L140 PolarHBondContact O-N 3.48Å
137M98Very high97.6Very high0 Ų051.4 Ų51.40%025%0.253CS..Hα-helixtrans-69.9-39.8177.6-169.969.6-174.200111.2I46 L120 V124 F127 Y133 S139 L140 Q141 Y155 C177I46-M137 HydrophobicContact CD1-SD 4.35Å; L120-M137 HydrophobicContact CD2-SD 4.13Å; V124-M137 HydrophobicContact CG2-CE 3.98Å; F127-M137 HydrophobicContact CD2-CB 3.76Å; F127-M137 HydrophobicContact CD2-CG 3.84Å; F127-M137 HydrophobicContact CE2-CB 3.82Å; F127-M137 HydrophobicContact CE2-CG 4Å; Y133-M137 WeakPolarHBondContact O-CB 3.33Å; Y133-M137 PolarHBondContact O-N 3.42Å; M137-S139 VanDerWaalsContact C-N 3.31Å; M137-S139 PolarHBondContact O-N 3.3Å; M137-L140 PolarHBondContact O-N 2.88Å; M137-L140 HydrophobicContact SD-CD2 4.11Å; M137-Q141 HydrophobicContact CE-CG 3.96Å; M137-Q141 VanDerWaalsContact CE-OE1 3.25Å; M137-Q141 HydrophobicContact CG-CG 4.32Å; M137-Q141 WeakPolarHBondContact O-CB 3.25Å; M137-Q141 WeakPolarHBondContact O-CG 3.31Å; M137-Q141 PolarHBondContact O-N 3.04Å; M137-Y155 WeakPolarHBondContact CG-OH 3.48Å; M137-C177 HydrophobicContact CE-CB 4.5Å
138D98.4Very high97.6Very high43 Ų4351.3 Ų51.323%0.2325%0.252CS..Hα-helixtrans-61.9-40.6172.8-84-12.7000111.8F127 E134 N142 S165F127-D138 WeakPolarHBondContact CE2-OD1 3.37Å; F127-D138 WeakPolarHBondContact CZ-OD1 3.27Å; E134-D138 WeakPolarHBondContact O-CB 3.18Å; E134-D138 PolarHBondContact O-N 3.42Å; D138-N142 VanDerWaalsContact O-CB 3.25Å; D138-N142 WeakPolarHBondContact O-CB 3.48Å; D138-N142 PolarHBondContact O-N 3.15Å; D138-N142 PolarHBondContact O-ND2 2.92Å; D138-S165 WeakPolarHBondContact OD1-CB 3.23Å; D138-S165 PolarHBondContact OD1-OG 2.97Å
139S98Very high97.6Very high51 Ų5146.4 Ų46.436%0.35723%0.233SC..Hα-helixtrans-62-47.1174.1-169.30000111.2I135 E136 M137 N142 E143I135-S139 WeakPolarHBondContact O-CB 3.48Å; I135-S139 PolarHBondContact O-N 3.33Å; E136-S139 PolarHBondContact O-N 3.31Å; M137-S139 VanDerWaalsContact C-N 3.31Å; M137-S139 PolarHBondContact O-N 3.3Å; S139-N142 PolarHBondContact O-N 3.49Å; S139-E143 WeakPolarHBondContact O-CB 3.16Å; S139-E143 PolarHBondContact O-N 3.39Å
140L98.2Very high97.7Very high2 Ų244.8 Ų44.81%0.0123%0.228CC..Hα-helixtrans-60.2-48.6179.2-175.274.1000111.2Y43 I46 L120 E136 M137 N142 E143 F144 C177 F181Y43-L140 HydrophobicContact CD1-CB 4.04Å; Y43-L140 HydrophobicContact CD1-CD1 4.1Å; Y43-L140 HydrophobicContact CD2-CD1 4.08Å; Y43-L140 HydrophobicContact CE1-CB 3.7Å; Y43-L140 HydrophobicContact CE1-CD1 3.88Å; Y43-L140 HydrophobicContact CE1-CG 4.42Å; Y43-L140 HydrophobicContact CE2-CD1 3.83Å; Y43-L140 HydrophobicContact CG-CD1 4.2Å; I46-L140 HydrophobicContact CD1-CB 4.36Å; I46-L140 HydrophobicContact CD1-CD2 3.97Å; L120-L140 HydrophobicContact CD1-CD2 4.2Å; L120-L140 HydrophobicContact CD2-CD2 3.66Å; E136-L140 WeakPolarHBondContact O-CB 3.45Å; E136-L140 PolarHBondContact O-N 3.48Å; M137-L140 PolarHBondContact O-N 2.88Å; M137-L140 HydrophobicContact SD-CD2 4.11Å; L140-N142 PolarHBondContact O-N 3.43Å; L140-E143 PolarHBondContact O-N 2.79Å; L140-F144 HydrophobicContact CD1-CD2 3.64Å; L140-F144 HydrophobicContact CD1-CE2 3.91Å; L140-F144 HydrophobicContact CG-CD2 4.38Å; L140-F144 WeakPolarHBondContact O-CB 3.4Å; L140-F144 WeakPolarHBondContact O-CD2 3.48Å; L140-F144 PolarHBondContact O-N 2.8Å; L140-C177 HydrophobicContact CD2-CB 3.72Å; L140-C177 HydrophobicContact CG-CB 4.27Å; L140-F181 HydrophobicContact CD1-CB 4.41Å; L140-F181 HydrophobicContact CD1-CD2 3.58Å; L140-F181 HydrophobicContact CD1-CE2 4.05Å; L140-F181 HydrophobicContact CD1-CG 4.1Å
141Q98.5Very high97.8Very high0 Ų043.2 Ų43.20%022%0.222CC..Hα-helixtrans-64.2-42.7-178-70.6178.4146.700111.9M137 K145 C146 Y155 S165 C166M137-Q141 HydrophobicContact CE-CG 3.96Å; M137-Q141 VanDerWaalsContact CE-OE1 3.25Å; M137-Q141 HydrophobicContact CG-CG 4.32Å; M137-Q141 WeakPolarHBondContact O-CB 3.25Å; M137-Q141 WeakPolarHBondContact O-CG 3.31Å; M137-Q141 PolarHBondContact O-N 3.04Å; Q141-K145 VanDerWaalsContact O-CA 3.31Å; Q141-K145 WeakPolarHBondContact O-CA 3.49Å; Q141-K145 PolarHBondContact O-N 3.37Å; Q141-C146 WeakPolarHBondContact CA-O 3.28Å; Q141-C146 WeakPolarHBondContact CB-O 3.26Å; Q141-C146 WeakPolarHBondContact CG-O 3.11Å; Q141-C146 PolarHBondContact O-N 3.11Å; Q141-Y155 PolarHBondContact OE1-OH 3.04Å; Q141-S165 PolarHBondContact NE2-OG 3.28Å; Q141-C166 PolarHBondContact NE2-SG 3.21Å; Q141-C166 PolarHBondContact OE1-SG 2.83Å
142N97.3Very high97.8Very high71 Ų7142 Ų4238%0.3821%0.205SC..Hα-helixtrans-68.9-42.5177.2-79.4-46.5000112.7D138 S139 L140 K145 S165D138-N142 VanDerWaalsContact O-CB 3.25Å; D138-N142 WeakPolarHBondContact O-CB 3.48Å; D138-N142 PolarHBondContact O-N 3.15Å; D138-N142 PolarHBondContact O-ND2 2.92Å; S139-N142 PolarHBondContact O-N 3.49Å; L140-N142 PolarHBondContact O-N 3.43Å; N142-K145 WeakPolarHBondContact O-CD 3.43Å; N142-K145 WeakPolarHBondContact O-CE 3.49Å; N142-K145 PolarHBondContact O-NZ 2.7Å; N142-S165 VanDerWaalsContact ND2-CB 3.33Å; N142-S165 WeakPolarHBondContact ND2-CB 3.49Å; N142-S165 WeakPolarHBondContact OD1-CA 3.36Å; N142-S165 PolarHBondContact OD1-O 3Å
143E96.5Very high97.9Very high86 Ų8643.7 Ų43.740%0.40221%0.212SC..Hα-helixtrans-69.4-45.9-177.5-172.2163.7172.800110.8K42 Y43 S139 L140K42-E143 IonicContact NZ-OE1 2.72Å; K42-E143 PolarHBondContact NZ-OE1 3Å; K42-E143 IonicContact NZ-OE2 3.25Å; Y43-E143 VanDerWaalsContact OH-CD 3.31Å; Y43-E143 PolarHBondContact OH-OE2 3.02Å; S139-E143 WeakPolarHBondContact O-CB 3.16Å; S139-E143 PolarHBondContact O-N 3.39Å; L140-E143 PolarHBondContact O-N 2.79Å
144F97.4Very high97.9Very high22 Ų2243 Ų4310%0.09621%0.21CC..Hα-helixtrans-96.2-2-174.7-71.3-83000115Y43 L140 C146 V180 F181 Y184Y43-F144 HydrophobicContact CE2-CE2 4.05Å; L140-F144 HydrophobicContact CD1-CD2 3.64Å; L140-F144 HydrophobicContact CD1-CE2 3.91Å; L140-F144 HydrophobicContact CG-CD2 4.38Å; L140-F144 WeakPolarHBondContact O-CB 3.4Å; L140-F144 WeakPolarHBondContact O-CD2 3.48Å; L140-F144 PolarHBondContact O-N 2.8Å; F144-C146 VanDerWaalsContact C-N 3.33Å; F144-C146 PolarHBondContact O-N 3.49Å; F144-V180 HydrophobicContact CB-CG1 3.89Å; F144-V180 HydrophobicContact CD1-CG1 4.01Å; F144-V180 HydrophobicContact CG-CG1 4.39Å; F144-F181 HydrophobicContact CD2-CD2 4.34Å; F144-F181 HydrophobicContact CE1-CD2 4.42Å; F144-F181 AromaticContact CE2-CD2 3.81Å; F144-F181 HydrophobicContact CE2-CD2 3.81Å; F144-F181 HydrophobicContact CE2-CE2 4.19Å; F144-F181 AromaticContact CZ-CD2 3.86Å; F144-F181 HydrophobicContact CZ-CD2 3.86Å; F144-F181 HydrophobicContact CZ-CE2 4.23Å; F144-Y184 AromaticContact CE1-CD1 3.71Å; F144-Y184 HydrophobicContact CE1-CD1 3.71Å; F144-Y184 AromaticContact CE1-CD2 3.77Å; F144-Y184 HydrophobicContact CE1-CD2 3.77Å; F144-Y184 HydrophobicContact CE1-CE1 4.21Å; F144-Y184 HydrophobicContact CE1-CE2 4.23Å; F144-Y184 AromaticContact CE1-CG 3.47Å; F144-Y184 HydrophobicContact CE1-CG 3.47Å; F144-Y184 VanDerWaalsContact CE1-CG 3.47Å; F144-Y184 AromaticContact CZ-CD1 3.86Å; F144-Y184 HydrophobicContact CZ-CD1 3.86Å; F144-Y184 HydrophobicContact CZ-CE1 4.1Å; F144-Y184 HydrophobicContact CZ-CG 4.12Å
145K97.9Very high97.9Very high97 Ų9739.4 Ų39.442%0.42219%0.193SC..THydrogen-bonded Turntrans54.951.8177.8-49.1-65173.4-158.30111.1Q141 N142 Y173 R175Q141-K145 VanDerWaalsContact O-CA 3.31Å; Q141-K145 WeakPolarHBondContact O-CA 3.49Å; Q141-K145 PolarHBondContact O-N 3.37Å; N142-K145 WeakPolarHBondContact O-CD 3.43Å; N142-K145 WeakPolarHBondContact O-CE 3.49Å; N142-K145 PolarHBondContact O-NZ 2.7Å; K145-Y173 HydrophobicContact CB-CD1 4.29Å; K145-Y173 HydrophobicContact CB-CE1 3.89Å; K145-Y173 HydrophobicContact CB-CE2 4.36Å; K145-Y173 HydrophobicContact CD-CE1 4.18Å; K145-Y173 HydrophobicContact CD-CE2 4.24Å; K145-Y173 WeakPolarHBondContact CD-OH 3.36Å; K145-R175 PolarHBondContact O-NH2 2.9Å
146C98.4Very high97.8Very high0 Ų041.8 Ų41.80%020%0.195CC..  trans-135167.5-176.762.90000109.9Q141 F144 Y173 R175 C177 V180Q141-C146 WeakPolarHBondContact CA-O 3.28Å; Q141-C146 WeakPolarHBondContact CB-O 3.26Å; Q141-C146 WeakPolarHBondContact CG-O 3.11Å; Q141-C146 PolarHBondContact O-N 3.11Å; F144-C146 VanDerWaalsContact C-N 3.33Å; F144-C146 PolarHBondContact O-N 3.49Å; C146-Y173 WeakPolarHBondContact O-CD2 3.45Å; C146-R175 CarbonylContact C-O 3.59Å; C146-R175 VanDerWaalsContact CA-O 3.25Å; C146-R175 WeakPolarHBondContact CA-O 3.11Å; C146-R175 WeakPolarHBondContact CB-O 3.09Å; C146-C177 HydrophobicContact CB-CB 3.92Å; C146-C177 WeakPolarHBondContact CB-SG 3.4Å; C146-C177 WeakPolarHBondContact SG-CA 3.2Å; C146-C177 WeakPolarHBondContact SG-CB 3.08Å; C146-C177 CovalentContact SG-SG 2.04Å; C146-C177 PolarHBondContact SG-SG 3.48Å; C146-V180 HydrophobicContact CB-CB 4.43Å; C146-V180 HydrophobicContact CB-CG2 4.28Å
147C98.5Very high97.7Very high0 Ų050.1 Ų50.10%023%0.231CC..  trans-144.9135.2176.9-1700000111.9S151 Y152 C166 Y173 R175C147-S151 CarbonylContact O-C 3.5Å; C147-S151 VanDerWaalsContact O-CA 3.28Å; C147-S151 WeakPolarHBondContact O-CA 3.23Å; C147-Y152 PolarHBondContact O-N 3.27Å; C147-Y152 VanDerWaalsContact SG-CB 3.54Å; C147-C166 VanDerWaalsContact CA-SG 3.56Å; C147-C166 HydrophobicContact CB-CB 3.62Å; C147-C166 WeakPolarHBondContact CB-SG 3.45Å; C147-C166 WeakPolarHBondContact SG-CB 3.44Å; C147-C166 CovalentContact SG-SG 2.03Å; C147-C166 PolarHBondContact SG-SG 2.92Å; C147-Y173 WeakPolarHBondContact CB-O 3.43Å; C147-R175 PolarHBondContact N-O 3.35Å
148G98.2Very high97.5Very high0 Ų053.4 Ų53.40%025%0.249CC..SBendtrans65-168.8-177.300000112.9C177G148-C177 WeakPolarHBondContact O-CB 3.33Å; G148-C177 PolarHBondContact O-N 3.48Å; G148-C177 PolarHBondContact O-SG 3.5Å
149A98.2Very high97.4Very high0 Ų055 Ų550%028%0.275CS..SBendtrans-81.7-54177.100000110.8L120 L121 D154 G176 C177 T178L120-A149 HydrophobicContact CB-CB 3.75Å; L121-A149 HydrophobicContact CB-CB 4.36Å; L121-A149 HydrophobicContact CD2-CB 3.7Å; L121-A149 HydrophobicContact CG-CB 3.69Å; A149-D154 WeakPolarHBondContact CA-OD2 3.46Å; A149-D154 PolarHBondContact N-OD2 3.38Å; A149-G176 CarbonylContact O-C 3.52Å; A149-G176 WeakPolarHBondContact O-CA 3.35Å; A149-C177 PolarHBondContact O-N 3.37Å; A149-T178 WeakPolarHBondContact O-CB 3.3Å; A149-T178 PolarHBondContact O-N 3.21Å; A149-T178 PolarHBondContact O-OG1 2.76Å
150E98.2Very high97.3Very high119 Ų11954 Ų5456%0.55627%0.265SS*.SBendtrans-99.7-38.1176.6-63-174.216500111.9H117 D154 G176H117-E150 VanDerWaalsContact CE1-CG 3.46Å; H117-E150 WeakPolarHBondContact CE1-CG 3.31Å; H117-E150 IonicContact CE1-OE1 3.58Å; H117-E150 PolarHBondContact CE1-OE1 2.76Å; H117-E150 IonicContact NE2-OE1 3.55Å; E150-D154 PolarHBondContact N-OD2 3.08Å; E150-G176 WeakPolarHBondContact O-CA 3.01Å; E150-G176 PolarHBondContact O-N 3.33Å
151S98.2Very high97.2Very high23 Ų2359.8 Ų59.816%0.16130%0.296CS..  trans-169.6173.5178.268.50000111.3C147 F153 D154C147-S151 CarbonylContact O-C 3.5Å; C147-S151 VanDerWaalsContact O-CA 3.28Å; C147-S151 WeakPolarHBondContact O-CA 3.23Å; S151-F153 PolarHBondContact O-N 2.93Å; S151-F153 WeakPolarHBondContact OG-CB 3.3Å; S151-F153 PolarHBondContact OG-N 3.42Å; S151-D154 PolarHBondContact N-OD2 3.46Å; S151-D154 WeakPolarHBondContact O-CB 3.23Å; S151-D154 PolarHBondContact O-N 3.03Å; S151-D154 VanDerWaalsContact O-OD2 3.08Å
152Y97Very high97.2Very high65 Ų6561.1 Ų61.126%0.25530%0.303SS..THydrogen-bonded Turntrans-57.4-19.3172.670.3-92.9000114.3C147 D154 Y155 I162 V172C147-Y152 PolarHBondContact O-N 3.27Å; C147-Y152 VanDerWaalsContact SG-CB 3.54Å; Y152-D154 PolarHBondContact O-N 3.4Å; Y152-Y155 PolarHBondContact O-N 2.91Å; Y152-I162 HydrophobicContact CD2-CD1 3.7Å; Y152-I162 HydrophobicContact CE2-CD1 4.47Å; Y152-I162 HydrophobicContact CG-CD1 4.39Å; Y152-V172 HydrophobicContact CD1-CG1 4.09Å; Y152-V172 HydrophobicContact CD2-CG1 4.46Å; Y152-V172 HydrophobicContact CG-CG1 3.8Å
153F97.6Very high97.2Very high118 Ų11858 Ų5852%0.51829%0.286SS..Hα-helixtrans-65.1-20.5176.7-72.5-74.2000112.8S151 Y155 R156 K157S151-F153 PolarHBondContact O-N 2.93Å; S151-F153 WeakPolarHBondContact OG-CB 3.3Å; S151-F153 PolarHBondContact OG-N 3.42Å; F153-Y155 VanDerWaalsContact C-N 3.26Å; F153-Y155 PolarHBondContact O-N 3.43Å; F153-R156 PolarHBondContact O-N 2.63Å; F153-R156 VanDerWaalsContact O-N 3.07Å; F153-K157 WeakPolarHBondContact O-CB 3.25Å; F153-K157 PolarHBondContact O-N 3.03Å
154D98Very high97.2Very high11 Ų1162.7 Ų62.76%0.05931%0.306CS..Hα-helixtrans-59.7-38.7178.7-61.4-26.6000111.6V124 A149 E150 S151 Y152 N158V124-D154 HydrophobicContact CG1-CB 3.93Å; V124-D154 HydrophobicContact CG2-CB 4.42Å; A149-D154 WeakPolarHBondContact CA-OD2 3.46Å; A149-D154 PolarHBondContact N-OD2 3.38Å; E150-D154 PolarHBondContact N-OD2 3.08Å; S151-D154 PolarHBondContact N-OD2 3.46Å; S151-D154 WeakPolarHBondContact O-CB 3.23Å; S151-D154 PolarHBondContact O-N 3.03Å; S151-D154 VanDerWaalsContact O-OD2 3.08Å; Y152-D154 PolarHBondContact O-N 3.4Å; D154-N158 PolarHBondContact O-N 3.31Å; D154-N158 PolarHBondContact O-ND2 2.92Å
155Y98.1Very high97.2Very high0 Ų061.9 Ų61.90%030%0.303CS..Hα-helixtrans-65.6-45.6173.5-72.5-79.7000111.8V124 F127 M137 Q141 Y152 F153 K157 N158 G159 M160 P163V124-Y155 HydrophobicContact CG1-CD1 3.86Å; V124-Y155 HydrophobicContact CG1-CD2 4.31Å; V124-Y155 HydrophobicContact CG1-CE1 3.9Å; V124-Y155 HydrophobicContact CG1-CE2 4.35Å; V124-Y155 HydrophobicContact CG1-CG 4.07Å; V124-Y155 HydrophobicContact CG2-CE2 4.22Å; F127-Y155 HydrophobicContact CB-CE1 3.86Å; F127-Y155 AromaticContact CD1-CE1 3.94Å; F127-Y155 HydrophobicContact CD1-CE1 3.94Å; F127-Y155 HydrophobicContact CD2-CE1 4.03Å; F127-Y155 VanDerWaalsContact CD2-OH 3.26Å; F127-Y155 WeakPolarHBondContact CD2-OH 3.42Å; F127-Y155 AromaticContact CG-CE1 3.66Å; F127-Y155 HydrophobicContact CG-CE1 3.66Å; M137-Y155 WeakPolarHBondContact CG-OH 3.48Å; Q141-Y155 PolarHBondContact OE1-OH 3.04Å; Y152-Y155 PolarHBondContact O-N 2.91Å; F153-Y155 VanDerWaalsContact C-N 3.26Å; F153-Y155 PolarHBondContact O-N 3.43Å; Y155-K157 VanDerWaalsContact C-N 3.34Å; Y155-K157 PolarHBondContact O-N 2.83Å; Y155-N158 CarbonylContact O-C 3.57Å; Y155-N158 PolarHBondContact O-N 3.42Å; Y155-N158 VanDerWaalsContact O-N 3.11Å; Y155-G159 PolarHBondContact O-N 2.84Å; Y155-M160 HydrophobicContact CD1-CB 4.45Å; Y155-M160 HydrophobicContact CD1-CE 3.7Å; Y155-M160 HydrophobicContact CE1-CE 4.31Å; Y155-M160 WeakPolarHBondContact O-CB 3.2Å; Y155-M160 PolarHBondContact O-N 2.97Å; Y155-P163 HydrophobicContact CD1-CG 4.08Å; Y155-P163 HydrophobicContact CD2-CG 4.36Å; Y155-P163 HydrophobicContact CE1-CG 3.56Å; Y155-P163 HydrophobicContact CE2-CG 3.87Å; Y155-P163 HydrophobicContact CG-CG 4.46Å; Y155-P163 VanDerWaalsContact CZ-CG 3.44Å
156R95.8Very high97.2Very high158 Ų15857.3 Ų57.360%0.59628%0.283SS*.Hα-helixtrans-64.4-38.5-179-63.9-64.9-63.7-135.9-2.7112.1F153 N158 G159 I162F153-R156 PolarHBondContact O-N 2.63Å; F153-R156 VanDerWaalsContact O-N 3.07Å; R156-N158 PolarHBondContact O-N 3.05Å; R156-G159 PolarHBondContact O-N 3.36Å; R156-I162 HydrophobicContact CG-CD1 4.44Å; R156-I162 HydrophobicContact CG-CG1 4.32Å
157K96Very high97.1Very high186 Ų18660.2 Ų60.281%0.80930%0.297SS*.Hα-helixtrans-61.7-30.1175.4-173.8178178.7-1790112.1F153 Y155 G159F153-K157 WeakPolarHBondContact O-CB 3.25Å; F153-K157 PolarHBondContact O-N 3.03Å; Y155-K157 VanDerWaalsContact C-N 3.34Å; Y155-K157 PolarHBondContact O-N 2.83Å; K157-G159 VanDerWaalsContact C-N 3.32Å
158N94.3Very high96.8Very high70 Ų7064.2 Ų64.237%0.37432%0.321SS..THydrogen-bonded Turntrans-89.28.4174.4-71.9-65.2000113.4D154 Y155 R156 M160D154-N158 PolarHBondContact O-N 3.31Å; D154-N158 PolarHBondContact O-ND2 2.92Å; Y155-N158 CarbonylContact O-C 3.57Å; Y155-N158 PolarHBondContact O-N 3.42Å; Y155-N158 VanDerWaalsContact O-N 3.11Å; R156-N158 PolarHBondContact O-N 3.05Å; N158-M160 HydrophobicContact CB-CE 3.47Å; N158-M160 VanDerWaalsContact CB-CE 3.47Å; N158-M160 HydrophobicContact CB-CG 4.1Å; N158-M160 HydrophobicContact CB-SD 4.29Å; N158-M160 WeakPolarHBondContact O-CG 3.42Å; N158-M160 PolarHBondContact O-N 3.46Å
159G95.4Very high96.5Very high75 Ų7567.5 Ų67.577%0.77336%0.355SS*.THydrogen-bonded Turntrans69.520.6-17900000114Y155 R156 K157Y155-G159 PolarHBondContact O-N 2.84Å; R156-G159 PolarHBondContact O-N 3.36Å; K157-G159 VanDerWaalsContact C-N 3.32Å
160M96.4Very high96.2Very high30 Ų3078.8 Ų78.815%0.14840%0.399CS..  trans-105155.9-175.7-55-175.2-65.700111.8V124 Y128 Y155 N158V124-M160 HydrophobicContact CG1-CE 3.93Å; V124-M160 WeakPolarHBondContact O-CE 3.39Å; Y128-M160 HydrophobicContact CD2-CB 4.01Å; Y128-M160 HydrophobicContact CD2-CG 4.17Å; Y128-M160 HydrophobicContact CD2-SD 3.7Å; Y128-M160 HydrophobicContact CE2-CB 3.84Å; Y128-M160 HydrophobicContact CE2-SD 4.34Å; Y155-M160 HydrophobicContact CD1-CB 4.45Å; Y155-M160 HydrophobicContact CD1-CE 3.7Å; Y155-M160 HydrophobicContact CE1-CE 4.31Å; Y155-M160 WeakPolarHBondContact O-CB 3.2Å; Y155-M160 PolarHBondContact O-N 2.97Å; N158-M160 HydrophobicContact CB-CE 3.47Å; N158-M160 VanDerWaalsContact CB-CE 3.47Å; N158-M160 HydrophobicContact CB-CG 4.1Å; N158-M160 HydrophobicContact CB-SD 4.29Å; N158-M160 WeakPolarHBondContact O-CG 3.42Å; N158-M160 PolarHBondContact O-N 3.46Å
161N96.2Very high96Very high124 Ų12479.5 Ų79.566%0.66341%0.406SS*.PPolyproline II helixtrans-72.8146.7171.4-68.6-36.1000110.5Y128Y128-N161 WeakPolarHBondContact CE2-O 3.42Å; Y128-N161 PolarHBondContact OH-O 3.25Å
162I96.8Very high96Very high29 Ų2980.7 Ų80.715%0.14941%0.412CS..PPolyproline II helixtrans-68.1127.6174.6-61169.7000107.8Y152 R156 C166 M167 V172Y152-I162 HydrophobicContact CD2-CD1 3.7Å; Y152-I162 HydrophobicContact CE2-CD1 4.47Å; Y152-I162 HydrophobicContact CG-CD1 4.39Å; R156-I162 HydrophobicContact CG-CD1 4.44Å; R156-I162 HydrophobicContact CG-CG1 4.32Å; I162-C166 HydrophobicContact CG2-CB 3.69Å; I162-M167 HydrophobicContact CB-CE 3.79Å; I162-M167 HydrophobicContact CG2-CE 3.79Å; I162-M167 WeakPolarHBondContact O-CE 3.32Å; I162-V172 HydrophobicContact CD1-CG1 4.43Å; I162-V172 HydrophobicContact CD1-CG2 4.34Å; I162-V172 HydrophobicContact CG2-CG1 3.94Å; I162-V172 HydrophobicContact CG2-CG2 4.47Å
163P97.3Very high96Very high4 Ų479.4 Ų79.43%0.02641%0.407CS..PPolyproline II helixtrans-61.9152.6179.3-24.334.4000113.1F127 Y155 S165 C166F127-P163 HydrophobicContact CD1-CG 4.21Å; F127-P163 HydrophobicContact CE1-CB 4.02Å; F127-P163 HydrophobicContact CE1-CG 3.62Å; F127-P163 HydrophobicContact CE2-CB 4.46Å; F127-P163 HydrophobicContact CE2-CG 4.07Å; F127-P163 HydrophobicContact CZ-CB 3.69Å; F127-P163 HydrophobicContact CZ-CG 3.54Å; Y155-P163 HydrophobicContact CD1-CG 4.08Å; Y155-P163 HydrophobicContact CD2-CG 4.36Å; Y155-P163 HydrophobicContact CE1-CG 3.56Å; Y155-P163 HydrophobicContact CE2-CG 3.87Å; Y155-P163 HydrophobicContact CG-CG 4.46Å; Y155-P163 VanDerWaalsContact CZ-CG 3.44Å; P163-S165 PolarHBondContact O-N 2.95Å; P163-C166 WeakPolarHBondContact O-CB 3.18Å; P163-C166 PolarHBondContact O-N 2.89Å; P163-C166 VanDerWaalsContact O-N 3.1Å
164F96.7Very high95.9Very high186 Ų18677.1 Ų77.182%0.81641%0.41SS*.G310 helixtrans-63.4-29.6175.2-71.8-69.4000112.9C166 M167F164-C166 PolarHBondContact O-N 2.88Å; F164-M167 HydrophobicContact CD1-SD 4.46Å; F164-M167 PolarHBondContact O-N 3.37Å
165S97.7Very high95.9Very high5 Ų583.9 Ų83.94%0.03544%0.435CS..G310 helixtrans-62.7-17.9174.458.20000114D138 Q141 N142 P163 M167D138-S165 WeakPolarHBondContact OD1-CB 3.23Å; D138-S165 PolarHBondContact OD1-OG 2.97Å; Q141-S165 PolarHBondContact NE2-OG 3.28Å; N142-S165 VanDerWaalsContact ND2-CB 3.33Å; N142-S165 WeakPolarHBondContact ND2-CB 3.49Å; N142-S165 WeakPolarHBondContact OD1-CA 3.36Å; N142-S165 PolarHBondContact OD1-O 3Å; P163-S165 PolarHBondContact O-N 2.95Å; S165-M167 VanDerWaalsContact C-N 3.34Å
166C98Very high95.9Very high0 Ų084.2 Ų84.20%044%0.438CS..G310 helixtrans-84.8-5.7173.3-69.90000113.9Q141 C147 I162 P163 F164 V172 Y173Q141-C166 PolarHBondContact NE2-SG 3.21Å; Q141-C166 PolarHBondContact OE1-SG 2.83Å; C147-C166 VanDerWaalsContact CA-SG 3.56Å; C147-C166 HydrophobicContact CB-CB 3.62Å; C147-C166 WeakPolarHBondContact CB-SG 3.45Å; C147-C166 WeakPolarHBondContact SG-CB 3.44Å; C147-C166 CovalentContact SG-SG 2.03Å; C147-C166 PolarHBondContact SG-SG 2.92Å; I162-C166 HydrophobicContact CG2-CB 3.69Å; P163-C166 WeakPolarHBondContact O-CB 3.18Å; P163-C166 PolarHBondContact O-N 2.89Å; P163-C166 VanDerWaalsContact O-N 3.1Å; F164-C166 PolarHBondContact O-N 2.88Å; C166-V172 HydrophobicContact CB-CG1 4.24Å; C166-V172 WeakPolarHBondContact O-CA 3.33Å; C166-Y173 VanDerWaalsContact O-CD2 3.28Å; C166-Y173 WeakPolarHBondContact O-CD2 3.06Å; C166-Y173 PolarHBondContact O-N 2.8Å
167M96.1Very high96Very high62 Ų6276.7 Ų76.731%0.30541%0.41SS..EExtended strand (participates in β ladder)trans-111.2144.3-167.5-57.9-171.6-173.200113.1I162 F164 S165 L171 V172I162-M167 HydrophobicContact CB-CE 3.79Å; I162-M167 HydrophobicContact CG2-CE 3.79Å; I162-M167 WeakPolarHBondContact O-CE 3.32Å; F164-M167 HydrophobicContact CD1-SD 4.46Å; F164-M167 PolarHBondContact O-N 3.37Å; S165-M167 VanDerWaalsContact C-N 3.34Å; M167-L171 CarbonylContact C-O 3.03Å; M167-L171 WeakPolarHBondContact CA-O 3.31Å; M167-V172 HydrophobicContact CG-CG2 4.25Å
168V93.4Very high96.1Very high84 Ų8467.9 Ų67.951%0.50937%0.371SS..EExtended strand (participates in β ladder)trans-123.699.9164.4-175.30000107.9Y170 L171 Y173V168-Y170 PolarHBondContact O-N 3.28Å; V168-L171 PolarHBondContact N-O 3.37Å; V168-L171 PolarHBondContact O-N 3.48Å; V168-L171 VanDerWaalsContact O-N 3.13Å; V168-Y173 HydrophobicContact CG2-CE1 3.58Å; V168-Y173 HydrophobicContact CG2-CE2 4.44Å; V168-Y173 VanDerWaalsContact CG2-CZ 3.43Å; V168-Y173 WeakPolarHBondContact CG2-OH 3.06Å
169G91.8Very high96.3Very high68 Ų6870.6 Ų70.670%0.70138%0.38SS*.THydrogen-bonded Turntrans61.2-118-167.900000110.3
170Y90.4Very high96.4Very high237 Ų23768.4 Ų68.493%0.92935%0.352SS*.THydrogen-bonded Turntrans-94.4-4.1178.5-60.1-78.5000114.2V168V168-Y170 PolarHBondContact O-N 3.28Å
171L95.8Very high96.4Very high134 Ų13467 Ų6770%0.70235%0.345SS*.EExtended strand (participates in β ladder)trans-92.2147.1-178.3-61.3177.2000110.7M167 V168M167-L171 CarbonylContact C-O 3.03Å; M167-L171 WeakPolarHBondContact CA-O 3.31Å; V168-L171 PolarHBondContact N-O 3.37Å; V168-L171 PolarHBondContact O-N 3.48Å; V168-L171 VanDerWaalsContact O-N 3.13Å
172V96.8Very high96.3Very high48 Ų4861.1 Ų61.129%0.29131%0.313SS..EExtended strand (participates in β ladder)trans-113.7138.4177.4-177.50000109.4Y152 I162 C166 M167 A174Y152-V172 HydrophobicContact CD1-CG1 4.09Å; Y152-V172 HydrophobicContact CD2-CG1 4.46Å; Y152-V172 HydrophobicContact CG-CG1 3.8Å; I162-V172 HydrophobicContact CD1-CG1 4.43Å; I162-V172 HydrophobicContact CD1-CG2 4.34Å; I162-V172 HydrophobicContact CG2-CG1 3.94Å; I162-V172 HydrophobicContact CG2-CG2 4.47Å; C166-V172 HydrophobicContact CB-CG1 4.24Å; C166-V172 WeakPolarHBondContact O-CA 3.33Å; M167-V172 HydrophobicContact CG-CG2 4.25Å; V172-A174 PolarHBondContact O-N 3.49Å
173Y97.3Very high96.3Very high39 Ų3963.1 Ų63.115%0.15332%0.324CS..  trans-62121172.4-58.8-52.3000110.9K145 C146 C147 C166 V168K145-Y173 HydrophobicContact CB-CD1 4.29Å; K145-Y173 HydrophobicContact CB-CE1 3.89Å; K145-Y173 HydrophobicContact CB-CE2 4.36Å; K145-Y173 HydrophobicContact CD-CE1 4.18Å; K145-Y173 HydrophobicContact CD-CE2 4.24Å; K145-Y173 WeakPolarHBondContact CD-OH 3.36Å; C146-Y173 WeakPolarHBondContact O-CD2 3.45Å; C147-Y173 WeakPolarHBondContact CB-O 3.43Å; C166-Y173 VanDerWaalsContact O-CD2 3.28Å; C166-Y173 WeakPolarHBondContact O-CD2 3.06Å; C166-Y173 PolarHBondContact O-N 2.8Å; V168-Y173 HydrophobicContact CG2-CE1 3.58Å; V168-Y173 HydrophobicContact CG2-CE2 4.44Å; V168-Y173 VanDerWaalsContact CG2-CZ 3.43Å; V168-Y173 WeakPolarHBondContact CG2-OH 3.06Å
174A95.9Very high96.1Very high69 Ų6966.2 Ų66.257%0.5734%0.336SS*.  trans-79.2-23179.700000113.6V172V172-A174 PolarHBondContact O-N 3.49Å
175R97.4Very high96Very high153 Ų15357.4 Ų57.458%0.57730%0.297SS*.SBendtrans-83.1133.5-175-62.7-178.3-64.4178.13.8111.2K145 C146 C147 V180K145-R175 PolarHBondContact O-NH2 2.9Å; C146-R175 CarbonylContact C-O 3.59Å; C146-R175 VanDerWaalsContact CA-O 3.25Å; C146-R175 WeakPolarHBondContact CA-O 3.11Å; C146-R175 WeakPolarHBondContact CB-O 3.09Å; C147-R175 PolarHBondContact N-O 3.35Å; R175-V180 HydrophobicContact CB-CG2 4.15Å
176G98.2Very high95.7Very high7 Ų758.6 Ų58.67%0.07230%0.302CS..  trans-68.4145.8171.300000113.7A149 E150 T178 V180A149-G176 CarbonylContact O-C 3.52Å; A149-G176 WeakPolarHBondContact O-CA 3.35Å; E150-G176 WeakPolarHBondContact O-CA 3.01Å; E150-G176 PolarHBondContact O-N 3.33Å; G176-T178 VanDerWaalsContact C-N 3.31Å; G176-T178 PolarHBondContact O-N 2.89Å; G176-V180 WeakPolarHBondContact O-CG2 2.94Å
177C98.5Very high95.5Very high0 Ų064.9 Ų64.90%033%0.331CS..Hα-helixtrans-71.4-25.4180-65.90000113.4L120 M137 L140 C146 G148 A149 K179 F181L120-C177 HydrophobicContact CD1-CB 4.12Å; M137-C177 HydrophobicContact CE-CB 4.5Å; L140-C177 HydrophobicContact CD2-CB 3.72Å; L140-C177 HydrophobicContact CG-CB 4.27Å; C146-C177 HydrophobicContact CB-CB 3.92Å; C146-C177 WeakPolarHBondContact CB-SG 3.4Å; C146-C177 WeakPolarHBondContact SG-CA 3.2Å; C146-C177 WeakPolarHBondContact SG-CB 3.08Å; C146-C177 CovalentContact SG-SG 2.04Å; C146-C177 PolarHBondContact SG-SG 3.48Å; G148-C177 WeakPolarHBondContact O-CB 3.33Å; G148-C177 PolarHBondContact O-N 3.48Å; G148-C177 PolarHBondContact O-SG 3.5Å; A149-C177 PolarHBondContact O-N 3.37Å; C177-K179 PolarHBondContact O-N 2.94Å; C177-F181 WeakPolarHBondContact O-CB 3.18Å; C177-F181 PolarHBondContact O-N 2.04Å
178T98Very high95.3Very high1 Ų164.9 Ų64.91%0.00633%0.328CS..Hα-helixtrans-54.4-60.5177.8-54.70000110.3Y113 T116 H117 A149 G176 V180 F181 T182Y113-T178 HydrophobicContact CD2-CG2 4.17Å; Y113-T178 HydrophobicContact CE1-CG2 4.32Å; Y113-T178 HydrophobicContact CE2-CG2 3.75Å; T116-T178 HydrophobicContact CG2-CG2 4.39Å; H117-T178 HydrophobicContact CB-CG2 3.57Å; A149-T178 WeakPolarHBondContact O-CB 3.3Å; A149-T178 PolarHBondContact O-N 3.21Å; A149-T178 PolarHBondContact O-OG1 2.76Å; G176-T178 VanDerWaalsContact C-N 3.31Å; G176-T178 PolarHBondContact O-N 2.89Å; T178-V180 PolarHBondContact O-N 2.89Å; T178-F181 PolarHBondContact O-N 3.41Å; T178-T182 HydrophobicContact CG2-CG2 4.38Å; T178-T182 WeakPolarHBondContact O-CB 3.39Å; T178-T182 WeakPolarHBondContact O-CG2 3.48Å; T178-T182 PolarHBondContact O-N 3.47Å; T178-T182 PolarHBondContact O-OG1 3.49Å
179K97.2Very high95.2Very high128 Ų12862.2 Ų62.256%0.55731%0.311SS*.Hα-helixtrans-63.6-45.3-175.3-179.1166.6-176.8158.30112.1Y113 C177 F181 T182 D183Y113-K179 HydrophobicContact CE2-CB 4.39Å; C177-K179 PolarHBondContact O-N 2.94Å; K179-F181 VanDerWaalsContact C-N 3.35Å; K179-F181 PolarHBondContact O-N 3.47Å; K179-T182 WeakPolarHBondContact CA-OG1 3.5Å; K179-T182 PolarHBondContact O-N 2.94Å; K179-T182 PolarHBondContact O-OG1 3.09Å; K179-T182 VanDerWaalsContact O-OG1 3.09Å; K179-D183 WeakPolarHBondContact CG-OD2 3.25Å; K179-D183 WeakPolarHBondContact O-CB 3.28Å; K179-D183 PolarHBondContact O-N 2.86Å
180V97.7Very high95.3Very high29 Ų2963 Ų6318%0.17630%0.298CS..Hα-helixtrans-63.3-44-178.2179.20000111F144 C146 R175 G176 T178 Y184F144-V180 HydrophobicContact CB-CG1 3.89Å; F144-V180 HydrophobicContact CD1-CG1 4.01Å; F144-V180 HydrophobicContact CG-CG1 4.39Å; C146-V180 HydrophobicContact CB-CB 4.43Å; C146-V180 HydrophobicContact CB-CG2 4.28Å; R175-V180 HydrophobicContact CB-CG2 4.15Å; G176-V180 WeakPolarHBondContact O-CG2 2.94Å; T178-V180 PolarHBondContact O-N 2.89Å; V180-Y184 WeakPolarHBondContact O-CB 3.47Å; V180-Y184 PolarHBondContact O-N 3.39Å; V180-Y184 VanDerWaalsContact O-N 3.08Å
181F96.7Very high95.5Very high1 Ų155 Ų550%0.00427%0.274CS..Hα-helixtrans-69.5-44.5179.6-176.7-106.5000112T39 L40 Y43 L47 F112 T116 L140 F144 C177 T178 K179 Y184 I185T39-F181 HydrophobicContact CG2-CE2 4.1Å; L40-F181 HydrophobicContact CD2-CE1 4.16Å; L40-F181 HydrophobicContact CD2-CZ 3.98Å; Y43-F181 AromaticContact CD2-CE2 3.58Å; Y43-F181 HydrophobicContact CD2-CE2 3.58Å; Y43-F181 AromaticContact CD2-CZ 3.83Å; Y43-F181 HydrophobicContact CD2-CZ 3.83Å; Y43-F181 HydrophobicContact CE2-CD2 4.44Å; Y43-F181 AromaticContact CE2-CE2 3.68Å; Y43-F181 HydrophobicContact CE2-CE2 3.68Å; Y43-F181 HydrophobicContact CE2-CZ 4.38Å; L47-F181 HydrophobicContact CD1-CE1 3.94Å; L47-F181 HydrophobicContact CD1-CZ 4.2Å; L47-F181 HydrophobicContact CD2-CE1 4.33Å; F112-F181 HydrophobicContact CZ-CE1 4.32Å; T116-F181 HydrophobicContact CG2-CD1 3.96Å; L140-F181 HydrophobicContact CD1-CB 4.41Å; L140-F181 HydrophobicContact CD1-CD2 3.58Å; L140-F181 HydrophobicContact CD1-CE2 4.05Å; L140-F181 HydrophobicContact CD1-CG 4.1Å; F144-F181 HydrophobicContact CD2-CD2 4.34Å; F144-F181 HydrophobicContact CE1-CD2 4.42Å; F144-F181 AromaticContact CE2-CD2 3.81Å; F144-F181 HydrophobicContact CE2-CD2 3.81Å; F144-F181 HydrophobicContact CE2-CE2 4.19Å; F144-F181 AromaticContact CZ-CD2 3.86Å; F144-F181 HydrophobicContact CZ-CD2 3.86Å; F144-F181 HydrophobicContact CZ-CE2 4.23Å; C177-F181 WeakPolarHBondContact O-CB 3.18Å; C177-F181 PolarHBondContact O-N 2.04Å; T178-F181 PolarHBondContact O-N 3.41Å; K179-F181 VanDerWaalsContact C-N 3.35Å; K179-F181 PolarHBondContact O-N 3.47Å; F181-Y184 WeakPolarHBondContact O-CB 3.38Å; F181-Y184 PolarHBondContact O-N 3.28Å; F181-I185 HydrophobicContact CE1-CG1 4.15Å; F181-I185 HydrophobicContact CE2-CD1 4.44Å; F181-I185 HydrophobicContact CE2-CG1 4.29Å; F181-I185 HydrophobicContact CZ-CD1 4.29Å; F181-I185 HydrophobicContact CZ-CG1 4.03Å; F181-I185 WeakPolarHBondContact O-CG1 3.41Å; F181-I185 PolarHBondContact O-N 3.16Å
182T95.1Very high95.3Very high0 Ų049 Ų490%024%0.242CC..Hα-helixtrans-65.2-42.1179.157.10000111.7F112 Y113 T116 T178 K179 Y184 I185 Q186F112-T182 HydrophobicContact CD1-CG2 4.18Å; F112-T182 HydrophobicContact CE1-CG2 3.98Å; Y113-T182 HydrophobicContact CD2-CG2 3.93Å; Y113-T182 WeakPolarHBondContact CD2-OG1 3.22Å; T116-T182 HydrophobicContact CG2-CG2 3.87Å; T178-T182 HydrophobicContact CG2-CG2 4.38Å; T178-T182 WeakPolarHBondContact O-CB 3.39Å; T178-T182 WeakPolarHBondContact O-CG2 3.48Å; T178-T182 PolarHBondContact O-N 3.47Å; T178-T182 PolarHBondContact O-OG1 3.49Å; K179-T182 WeakPolarHBondContact CA-OG1 3.5Å; K179-T182 PolarHBondContact O-N 2.94Å; K179-T182 PolarHBondContact O-OG1 3.09Å; K179-T182 VanDerWaalsContact O-OG1 3.09Å; T182-Y184 VanDerWaalsContact C-N 3.31Å; T182-Y184 PolarHBondContact O-N 3.19Å; T182-I185 PolarHBondContact O-N 2.96Å; T182-Q186 WeakPolarHBondContact O-CB 3.22Å; T182-Q186 PolarHBondContact O-N 2.99Å
183D95.4Very high95.2Very high70 Ų7047.6 Ų47.637%0.37423%0.233SC..Hα-helixtrans-64-38.9177.7-70.3-7000110.7Y109 K179 Q186 Q187Y109-D183 PolarHBondContact OH-OD1 2.98Å; K179-D183 WeakPolarHBondContact CG-OD2 3.25Å; K179-D183 WeakPolarHBondContact O-CB 3.28Å; K179-D183 PolarHBondContact O-N 2.86Å; D183-Q186 PolarHBondContact O-N 3.27Å; D183-Q187 PolarHBondContact O-N 2.88Å
184Y95.1Very high95.2Very high69 Ų6950 Ų5027%0.27125%0.252SS..Hα-helixtrans-61.2-51.8175.2176.6-94.2000112.2T39 F144 V180 F181 T182 Q186 Q187 Y188T39-Y184 HydrophobicContact CG2-CE1 4.05Å; F144-Y184 AromaticContact CE1-CD1 3.71Å; F144-Y184 HydrophobicContact CE1-CD1 3.71Å; F144-Y184 AromaticContact CE1-CD2 3.77Å; F144-Y184 HydrophobicContact CE1-CD2 3.77Å; F144-Y184 HydrophobicContact CE1-CE1 4.21Å; F144-Y184 HydrophobicContact CE1-CE2 4.23Å; F144-Y184 AromaticContact CE1-CG 3.47Å; F144-Y184 HydrophobicContact CE1-CG 3.47Å; F144-Y184 VanDerWaalsContact CE1-CG 3.47Å; F144-Y184 AromaticContact CZ-CD1 3.86Å; F144-Y184 HydrophobicContact CZ-CD1 3.86Å; F144-Y184 HydrophobicContact CZ-CE1 4.1Å; F144-Y184 HydrophobicContact CZ-CG 4.12Å; V180-Y184 WeakPolarHBondContact O-CB 3.47Å; V180-Y184 PolarHBondContact O-N 3.39Å; V180-Y184 VanDerWaalsContact O-N 3.08Å; F181-Y184 WeakPolarHBondContact O-CB 3.38Å; F181-Y184 PolarHBondContact O-N 3.28Å; T182-Y184 VanDerWaalsContact C-N 3.31Å; T182-Y184 PolarHBondContact O-N 3.19Å; Y184-Q186 VanDerWaalsContact C-N 3.31Å; Y184-Q186 PolarHBondContact O-N 3.13Å; Y184-Q187 WeakPolarHBondContact O-CB 3.42Å; Y184-Q187 PolarHBondContact O-N 2.87Å; Y184-Y188 HydrophobicContact CD1-CE2 4.26Å; Y184-Y188 HydrophobicContact CD2-CE2 4.44Å; Y184-Y188 HydrophobicContact CE1-CD2 4.32Å; Y184-Y188 AromaticContact CE1-CE2 3.69Å; Y184-Y188 HydrophobicContact CE1-CE2 3.69Å; Y184-Y188 AromaticContact CE2-CE2 3.94Å; Y184-Y188 HydrophobicContact CE2-CE2 3.94Å; Y184-Y188 AromaticContact CZ-CE2 3.54Å; Y184-Y188 WeakPolarHBondContact O-CD2 3.22Å; Y184-Y188 PolarHBondContact OH-OH 3.37Å
185I93.4Very high95.2Very high2 Ų248.7 Ų48.71%0.0124%0.235CC..Hα-helixtrans-63.2-41.3177.9-64.4-64000110.4T36 T39 L40 F112 F181 T182 Q187 Y188 I189T36-I185 HydrophobicContact CG2-CD1 4.35Å; T36-I185 HydrophobicContact CG2-CG2 4.26Å; T39-I185 HydrophobicContact CG2-CD1 3.96Å; L40-I185 HydrophobicContact CD2-CD1 4.47Å; L40-I185 HydrophobicContact CG-CD1 4.35Å; F112-I185 HydrophobicContact CE1-CB 3.99Å; F112-I185 HydrophobicContact CE1-CG1 4.47Å; F112-I185 HydrophobicContact CE1-CG2 3.89Å; F112-I185 HydrophobicContact CZ-CB 4.2Å; F112-I185 HydrophobicContact CZ-CG1 4.27Å; F112-I185 HydrophobicContact CZ-CG2 3.93Å; F181-I185 HydrophobicContact CE1-CG1 4.15Å; F181-I185 HydrophobicContact CE2-CD1 4.44Å; F181-I185 HydrophobicContact CE2-CG1 4.29Å; F181-I185 HydrophobicContact CZ-CD1 4.29Å; F181-I185 HydrophobicContact CZ-CG1 4.03Å; F181-I185 WeakPolarHBondContact O-CG1 3.41Å; F181-I185 PolarHBondContact O-N 3.16Å; T182-I185 PolarHBondContact O-N 2.96Å; I185-Q187 VanDerWaalsContact C-N 3.27Å; I185-Q187 PolarHBondContact O-N 3.04Å; I185-Y188 PolarHBondContact O-N 3.45Å; I185-Y188 VanDerWaalsContact O-N 3.15Å; I185-I189 HydrophobicContact CG2-CD1 3.76Å; I185-I189 HydrophobicContact CG2-CG1 4.33Å; I185-I189 PolarHBondContact O-N 3.36Å; I185-I189 VanDerWaalsContact O-N 3.13Å
186Q92.1Very high95.1Very high29 Ų2941.5 Ų41.514%0.13621%0.208CC..Hα-helixtrans-62.5-33.1-179.5-176.963.7-0.700112.5Y109 T182 D183 Y184 Y188 I189 I190Y109-Q186 HydrophobicContact CD2-CB 4.02Å; Y109-Q186 HydrophobicContact CD2-CG 3.58Å; Y109-Q186 VanDerWaalsContact CD2-OE1 3.31Å; Y109-Q186 HydrophobicContact CE2-CB 3.75Å; Y109-Q186 HydrophobicContact CE2-CG 3.56Å; T182-Q186 WeakPolarHBondContact O-CB 3.22Å; T182-Q186 PolarHBondContact O-N 2.99Å; D183-Q186 PolarHBondContact O-N 3.27Å; Y184-Q186 VanDerWaalsContact C-N 3.31Å; Y184-Q186 PolarHBondContact O-N 3.13Å; Q186-Y188 VanDerWaalsContact C-N 3.32Å; Q186-Y188 PolarHBondContact O-N 3.02Å; Q186-I189 PolarHBondContact O-N 2.49Å; Q186-I190 HydrophobicContact CG-CD1 3.75Å; Q186-I190 HydrophobicContact CG-CG1 4.09Å; Q186-I190 WeakPolarHBondContact O-CB 3.43Å; Q186-I190 VanDerWaalsContact O-CG1 3.3Å; Q186-I190 WeakPolarHBondContact O-CG1 3.07Å; Q186-I190 PolarHBondContact O-N 3.29Å
187Q92.9Very high95.1Very high132 Ų13245.1 Ų45.162%0.61722%0.222SC*.Hα-helixtrans-58.8-43.2175.4-174.5178.3-800111.9D183 Y184 I185 V191D183-Q187 PolarHBondContact O-N 2.88Å; Y184-Q187 WeakPolarHBondContact O-CB 3.42Å; Y184-Q187 PolarHBondContact O-N 2.87Å; I185-Q187 VanDerWaalsContact C-N 3.27Å; I185-Q187 PolarHBondContact O-N 3.04Å; Q187-V191 WeakPolarHBondContact O-CG2 3.18Å; Q187-V191 PolarHBondContact O-N 3.48Å
188Y92Very high95Very high62 Ų6249.8 Ų49.824%0.24325%0.246CC..Hα-helixtrans-68.9-41.6175.9-69.1-83.5000111.9L32 I35 Y184 I185 Q186 I190 V191 F192L32-Y188 HydrophobicContact CD2-CD1 3.81Å; L32-Y188 HydrophobicContact CD2-CE1 4.44Å; I35-Y188 HydrophobicContact CG2-CE1 4.19Å; Y184-Y188 HydrophobicContact CD1-CE2 4.26Å; Y184-Y188 HydrophobicContact CD2-CE2 4.44Å; Y184-Y188 HydrophobicContact CE1-CD2 4.32Å; Y184-Y188 AromaticContact CE1-CE2 3.69Å; Y184-Y188 HydrophobicContact CE1-CE2 3.69Å; Y184-Y188 AromaticContact CE2-CE2 3.94Å; Y184-Y188 HydrophobicContact CE2-CE2 3.94Å; Y184-Y188 AromaticContact CZ-CE2 3.54Å; Y184-Y188 WeakPolarHBondContact O-CD2 3.22Å; Y184-Y188 PolarHBondContact OH-OH 3.37Å; I185-Y188 PolarHBondContact O-N 3.45Å; I185-Y188 VanDerWaalsContact O-N 3.15Å; Q186-Y188 VanDerWaalsContact C-N 3.32Å; Q186-Y188 PolarHBondContact O-N 3.02Å; Y188-I190 PolarHBondContact O-N 2.92Å; Y188-V191 PolarHBondContact O-N 3Å; Y188-F192 WeakPolarHBondContact O-CB 3.41Å; Y188-F192 PolarHBondContact O-N 3.44Å
189I91.8Very high94.9Very high28 Ų2850.8 Ų50.814%0.14425%0.251CS..Hα-helixtrans-62.4-42.6178.2-67.4175.9000111.1I185 Q186 F192 I193I185-I189 HydrophobicContact CG2-CD1 3.76Å; I185-I189 HydrophobicContact CG2-CG1 4.33Å; I185-I189 PolarHBondContact O-N 3.36Å; I185-I189 VanDerWaalsContact O-N 3.13Å; Q186-I189 PolarHBondContact O-N 2.49Å; I189-F192 WeakPolarHBondContact O-CB 3.43Å; I189-F192 PolarHBondContact O-N 2.81Å; I189-I193 HydrophobicContact CG2-CD1 3.6Å; I189-I193 HydrophobicContact CG2-CG1 4.17Å; I189-I193 WeakPolarHBondContact O-CB 3.22Å; I189-I193 VanDerWaalsContact O-CG1 3.23Å; I189-I193 WeakPolarHBondContact O-CG1 3.47Å; I189-I193 PolarHBondContact O-N 3Å
190I93.7Very high94.9Very high85 Ų8545.1 Ų45.144%0.43623%0.228SC..Hα-helixtrans-63.4-44.1177.9-72.2171.2000111.3Q186 Y188 F192 I193 T194Q186-I190 HydrophobicContact CG-CD1 3.75Å; Q186-I190 HydrophobicContact CG-CG1 4.09Å; Q186-I190 WeakPolarHBondContact O-CB 3.43Å; Q186-I190 VanDerWaalsContact O-CG1 3.3Å; Q186-I190 WeakPolarHBondContact O-CG1 3.07Å; Q186-I190 PolarHBondContact O-N 3.29Å; Y188-I190 PolarHBondContact O-N 2.92Å; I190-F192 VanDerWaalsContact C-N 3.33Å; I190-I193 PolarHBondContact O-N 3.46Å; I190-T194 WeakPolarHBondContact O-CB 3.3Å; I190-T194 PolarHBondContact O-N 3.33Å; I190-T194 PolarHBondContact O-OG1 3.46Å
191V93.9Very high94.9Very high69 Ų6949.1 Ų49.142%0.41825%0.247SC..Hα-helixtrans-60.5-46.4175.7171.80000110.2L32 Q187 Y188 T194 L195L32-V191 HydrophobicContact CD1-CG1 4.37Å; Q187-V191 WeakPolarHBondContact O-CG2 3.18Å; Q187-V191 PolarHBondContact O-N 3.48Å; Y188-V191 PolarHBondContact O-N 3Å; V191-T194 PolarHBondContact O-N 2.85Å; V191-L195 HydrophobicContact CG1-CD1 3.95Å; V191-L195 HydrophobicContact CG1-CG 4.45Å; V191-L195 VanDerWaalsContact O-CG 3.29Å; V191-L195 WeakPolarHBondContact O-CG 3.46Å; V191-L195 PolarHBondContact O-N 3.43Å
192F92.4Very high94.9Very high8 Ų851.6 Ų51.64%0.03526%0.26CS..Hα-helixtrans-56.2-53.8175.1165.3-92.1000112.2L29 I58 I101 Y188 I189 I190 T194 L195 C196L29-F192 HydrophobicContact CD1-CE2 4.5Å; L29-F192 HydrophobicContact CD2-CD2 3.58Å; L29-F192 HydrophobicContact CD2-CE2 3.75Å; I58-F192 HydrophobicContact CB-CE2 4.31Å; I58-F192 HydrophobicContact CD1-CD1 4.29Å; I58-F192 HydrophobicContact CD1-CD2 4.27Å; I58-F192 HydrophobicContact CD1-CE1 4.08Å; I58-F192 HydrophobicContact CD1-CE2 4.05Å; I58-F192 HydrophobicContact CD1-CG 4.42Å; I58-F192 HydrophobicContact CD1-CZ 3.97Å; I58-F192 HydrophobicContact CG1-CD2 4.39Å; I58-F192 HydrophobicContact CG1-CE1 4.25Å; I58-F192 HydrophobicContact CG1-CE2 3.72Å; I58-F192 HydrophobicContact CG1-CZ 3.67Å; I58-F192 HydrophobicContact CG2-CD2 4.03Å; I58-F192 HydrophobicContact CG2-CE2 3.7Å; I58-F192 HydrophobicContact CG2-CZ 4.49Å; I101-F192 HydrophobicContact CB-CE1 4.48Å; I101-F192 HydrophobicContact CB-CZ 4.26Å; I101-F192 HydrophobicContact CG2-CE1 3.65Å; I101-F192 HydrophobicContact CG2-CZ 3.6Å; Y188-F192 WeakPolarHBondContact O-CB 3.41Å; Y188-F192 PolarHBondContact O-N 3.44Å; I189-F192 WeakPolarHBondContact O-CB 3.43Å; I189-F192 PolarHBondContact O-N 2.81Å; I190-F192 VanDerWaalsContact C-N 3.33Å; F192-T194 VanDerWaalsContact C-N 3.29Å; F192-T194 PolarHBondContact O-N 2.88Å; F192-L195 PolarHBondContact O-N 3.39Å; F192-C196 WeakPolarHBondContact CE2-SG 3.31Å; F192-C196 WeakPolarHBondContact CZ-SG 3.41Å; F192-C196 PolarHBondContact O-N 3.47Å
193I94.9Very high94.9Very high19 Ų1951.6 Ų51.610%0.09726%0.26CS..Hα-helixtrans-56.2-46.5-179.7-71.1166.5000110.5A106 I189 I190 L195 C196 F197A106-I193 HydrophobicContact CB-CD1 4.08Å; I189-I193 HydrophobicContact CG2-CD1 3.6Å; I189-I193 HydrophobicContact CG2-CG1 4.17Å; I189-I193 WeakPolarHBondContact O-CB 3.22Å; I189-I193 VanDerWaalsContact O-CG1 3.23Å; I189-I193 WeakPolarHBondContact O-CG1 3.47Å; I189-I193 PolarHBondContact O-N 3Å; I190-I193 PolarHBondContact O-N 3.46Å; I193-L195 PolarHBondContact O-N 2.97Å; I193-C196 PolarHBondContact O-N 3.33Å; I193-F197 HydrophobicContact CG2-CD2 3.6Å; I193-F197 HydrophobicContact CG2-CE2 3.51Å; I193-F197 VanDerWaalsContact O-CD2 3.3Å; I193-F197 WeakPolarHBondContact O-CD2 3.29Å; I193-F197 PolarHBondContact O-N 3.1Å
194T96.4Very high95Very high88 Ų8849.5 Ų49.554%0.5425%0.254SS..Hα-helixtrans-61.6-45.8-179-56.20000111.1I190 V191 F192 L198I190-T194 WeakPolarHBondContact O-CB 3.3Å; I190-T194 PolarHBondContact O-N 3.33Å; I190-T194 PolarHBondContact O-OG1 3.46Å; V191-T194 PolarHBondContact O-N 2.85Å; F192-T194 VanDerWaalsContact C-N 3.29Å; F192-T194 PolarHBondContact O-N 2.88Å; T194-L198 WeakPolarHBondContact O-CB 3.46Å; T194-L198 PolarHBondContact O-N 3.12Å; T194-L198 VanDerWaalsContact O-N 3.12Å
195L96.1Very high95Very high43 Ų4351 Ų5123%0.22527%0.266CS..Hα-helixtrans-64.2-46.6177.1-69.6173.6000111.3F25 I28 L32 V191 F192 I193 F197 L198 F199F25-L195 HydrophobicContact CD2-CB 4.46Å; F25-L195 HydrophobicContact CE2-CB 3.92Å; I28-L195 HydrophobicContact CG2-CD1 4.07Å; L32-L195 HydrophobicContact CD1-CD1 4.28Å; V191-L195 HydrophobicContact CG1-CD1 3.95Å; V191-L195 HydrophobicContact CG1-CG 4.45Å; V191-L195 VanDerWaalsContact O-CG 3.29Å; V191-L195 WeakPolarHBondContact O-CG 3.46Å; V191-L195 PolarHBondContact O-N 3.43Å; F192-L195 PolarHBondContact O-N 3.39Å; I193-L195 PolarHBondContact O-N 2.97Å; L195-F197 PolarHBondContact O-N 2.9Å; L195-L198 PolarHBondContact O-N 3.13Å; L195-F199 HydrophobicContact CD2-CE2 4.35Å; L195-F199 WeakPolarHBondContact O-CB 3.19Å; L195-F199 VanDerWaalsContact O-CD2 3.3Å; L195-F199 WeakPolarHBondContact O-CD2 3.34Å; L195-F199 PolarHBondContact O-N 3.29Å
196C96.5Very high95.2Very high1 Ų151.3 Ų51.31%0.00727%0.267CS..Hα-helixtrans-59.2-45.3178.9-77.10000112.7A102 F192 I193 F199 A200A102-C196 HydrophobicContact CB-CB 3.88Å; F192-C196 WeakPolarHBondContact CE2-SG 3.31Å; F192-C196 WeakPolarHBondContact CZ-SG 3.41Å; F192-C196 PolarHBondContact O-N 3.47Å; I193-C196 PolarHBondContact O-N 3.33Å; C196-F199 PolarHBondContact O-N 3.18Å; C196-A200 WeakPolarHBondContact O-CB 3.21Å; C196-A200 PolarHBondContact O-N 2.84Å
197F96.7Very high95.4Very high84 Ų8450.5 Ų50.537%0.36826%0.264SS..Hα-helixtrans-66.2-42177.7-78.8-58.4000112.8A102 T103 I193 L195 A200 I201A102-F197 HydrophobicContact CB-CD2 4.31Å; A102-F197 HydrophobicContact CB-CE1 4.44Å; A102-F197 HydrophobicContact CB-CE2 3.96Å; A102-F197 HydrophobicContact CB-CZ 4.02Å; T103-F197 HydrophobicContact CG2-CE1 4.04Å; T103-F197 HydrophobicContact CG2-CZ 3.73Å; I193-F197 HydrophobicContact CG2-CD2 3.6Å; I193-F197 HydrophobicContact CG2-CE2 3.51Å; I193-F197 VanDerWaalsContact O-CD2 3.3Å; I193-F197 WeakPolarHBondContact O-CD2 3.29Å; I193-F197 PolarHBondContact O-N 3.1Å; L195-F197 PolarHBondContact O-N 2.9Å; F197-A200 PolarHBondContact O-N 3.33Å; F197-I201 WeakPolarHBondContact O-CG1 3.37Å; F197-I201 PolarHBondContact O-N 3.48Å
198L96.8Very high95.5Very high97 Ų9749.3 Ų49.351%0.50826%0.26SS..Hα-helixtrans-60.8-48.3177.1179.365.6000111.1T194 L195 I201 I202T194-L198 WeakPolarHBondContact O-CB 3.46Å; T194-L198 PolarHBondContact O-N 3.12Å; T194-L198 VanDerWaalsContact O-N 3.12Å; L195-L198 PolarHBondContact O-N 3.13Å; L198-I201 PolarHBondContact O-N 3.16Å; L198-I202 HydrophobicContact CG-CD1 4.43Å; L198-I202 WeakPolarHBondContact O-CG1 3.17Å; L198-I202 PolarHBondContact O-N 3.29Å
199F96.8Very high95.5Very high22 Ų2248.7 Ų48.710%0.09626%0.261CS..Hα-helixtrans-72.5-32.3-178.4-85.6-100.3000113L21 F22 F25 L195 C196 I201 I202 Q203L21-F199 HydrophobicContact CD1-CE1 4.32Å; L21-F199 HydrophobicContact CD1-CZ 4.22Å; L21-F199 HydrophobicContact CD2-CE1 4.24Å; L21-F199 HydrophobicContact CG-CE1 3.84Å; L21-F199 HydrophobicContact CG-CZ 4.22Å; F22-F199 HydrophobicContact CD1-CD1 4.12Å; F22-F199 HydrophobicContact CD1-CE1 4.46Å; F22-F199 HydrophobicContact CE1-CD1 4.39Å; F25-F199 HydrophobicContact CB-CD1 3.68Å; F25-F199 HydrophobicContact CB-CE1 3.31Å; F25-F199 HydrophobicContact CB-CE2 4.37Å; F25-F199 HydrophobicContact CB-CG 4.33Å; F25-F199 HydrophobicContact CB-CZ 3.71Å; F25-F199 HydrophobicContact CD1-CB 4.14Å; F25-F199 AromaticContact CD1-CD1 3.66Å; F25-F199 HydrophobicContact CD1-CD1 3.66Å; F25-F199 HydrophobicContact CD1-CE1 4.22Å; F25-F199 AromaticContact CD1-CG 3.94Å; F25-F199 HydrophobicContact CD1-CG 3.94Å; F25-F199 HydrophobicContact CD2-CB 4.17Å; F25-F199 AromaticContact CD2-CD1 3.81Å; F25-F199 HydrophobicContact CD2-CD1 3.81Å; F25-F199 AromaticContact CD2-CD2 3.55Å; F25-F199 HydrophobicContact CD2-CD2 3.55Å; F25-F199 HydrophobicContact CD2-CE1 4.01Å; F25-F199 AromaticContact CD2-CE2 3.79Å; F25-F199 HydrophobicContact CD2-CE2 3.79Å; F25-F199 AromaticContact CD2-CG 3.55Å; F25-F199 HydrophobicContact CD2-CG 3.55Å; F25-F199 HydrophobicContact CD2-CZ 4.02Å; F25-F199 HydrophobicContact CE1-CB 3.76Å; F25-F199 HydrophobicContact CE1-CD1 4.18Å; F25-F199 HydrophobicContact CE1-CG 4.05Å; F25-F199 HydrophobicContact CE2-CB 3.82Å; F25-F199 HydrophobicContact CE2-CD1 4.33Å; F25-F199 AromaticContact CE2-CD2 3.76Å; F25-F199 HydrophobicContact CE2-CD2 3.76Å; F25-F199 HydrophobicContact CE2-CE2 4.41Å; F25-F199 AromaticContact CE2-CG 3.7Å; F25-F199 HydrophobicContact CE2-CG 3.7Å; F25-F199 HydrophobicContact CG-CB 4.3Å; F25-F199 AromaticContact CG-CD1 3.42Å; F25-F199 HydrophobicContact CG-CD1 3.42Å; F25-F199 VanDerWaalsContact CG-CD1 3.42Å; F25-F199 HydrophobicContact CG-CD2 4.08Å; F25-F199 AromaticContact CG-CE1 3.6Å; F25-F199 HydrophobicContact CG-CE1 3.6Å; F25-F199 HydrophobicContact CG-CE2 4.25Å; F25-F199 AromaticContact CG-CG 3.67Å; F25-F199 HydrophobicContact CG-CG 3.67Å; F25-F199 HydrophobicContact CG-CZ 4.02Å; F25-F199 HydrophobicContact CZ-CB 3.58Å; F25-F199 HydrophobicContact CZ-CD1 4.48Å; F25-F199 HydrophobicContact CZ-CD2 4.41Å; F25-F199 AromaticContact CZ-CG 3.92Å; F25-F199 HydrophobicContact CZ-CG 3.92Å; L195-F199 HydrophobicContact CD2-CE2 4.35Å; L195-F199 WeakPolarHBondContact O-CB 3.19Å; L195-F199 VanDerWaalsContact O-CD2 3.3Å; L195-F199 WeakPolarHBondContact O-CD2 3.34Å; L195-F199 PolarHBondContact O-N 3.29Å; C196-F199 PolarHBondContact O-N 3.18Å; F199-I201 VanDerWaalsContact C-N 3.28Å; F199-I201 PolarHBondContact O-N 3.25Å; F199-I202 PolarHBondContact O-N 2.75Å; F199-I202 VanDerWaalsContact O-N 3.16Å; F199-Q203 WeakPolarHBondContact O-CB 3.4Å; F199-Q203 VanDerWaalsContact O-CG 3.25Å; F199-Q203 WeakPolarHBondContact O-CG 3Å; F199-Q203 PolarHBondContact O-N 2.97Å
200A96.8Very high95.6Very high10 Ų1047.7 Ų47.78%0.08326%0.257CS..Hα-helixtrans-60.7-37.2174.200000112.1T95 I99 C196 F197 G204T95-A200 HydrophobicContact CG2-CB 4.18Å; I99-A200 HydrophobicContact CD1-CB 4.14Å; I99-A200 HydrophobicContact CG1-CB 3.82Å; C196-A200 WeakPolarHBondContact O-CB 3.21Å; C196-A200 PolarHBondContact O-N 2.84Å; F197-A200 PolarHBondContact O-N 3.33Å; A200-G204 PolarHBondContact O-N 2.95Å
201I96.6Very high95.6Very high113 Ų11346.8 Ų46.858%0.57925%0.252SS*.Hα-helixtrans-65.3-46.4174.4-64.5167.6000110.4F197 L198 F199 G204 I205F197-I201 WeakPolarHBondContact O-CG1 3.37Å; F197-I201 PolarHBondContact O-N 3.48Å; L198-I201 PolarHBondContact O-N 3.16Å; F199-I201 VanDerWaalsContact C-N 3.28Å; F199-I201 PolarHBondContact O-N 3.25Å; I201-G204 PolarHBondContact O-N 2.78Å; I201-I205 HydrophobicContact CG2-CD1 4.3Å; I201-I205 WeakPolarHBondContact O-CG1 2.95Å; I201-I205 PolarHBondContact O-N 2.03Å; I201-I205 VanDerWaalsContact O-N 3.07Å
202I97Very high95.5Very high52 Ų5249 Ų4927%0.26726%0.26SS..Hα-helixtrans-63.1-46.5179.5-61.8169.4000110.6L18 F22 L198 F199 G204 I205 Y206L18-I202 HydrophobicContact CD2-CG2 4.06Å; F22-I202 HydrophobicContact CE1-CG2 3.86Å; F22-I202 HydrophobicContact CZ-CG2 4.08Å; L198-I202 HydrophobicContact CG-CD1 4.43Å; L198-I202 WeakPolarHBondContact O-CG1 3.17Å; L198-I202 PolarHBondContact O-N 3.29Å; F199-I202 PolarHBondContact O-N 2.75Å; F199-I202 VanDerWaalsContact O-N 3.16Å; I202-G204 VanDerWaalsContact C-N 3.34Å; I202-I205 PolarHBondContact O-N 2.94Å; I202-Y206 VanDerWaalsContact O-CB 3.3Å; I202-Y206 WeakPolarHBondContact O-CB 3.28Å; I202-Y206 PolarHBondContact O-N 3.35Å
203Q96.6Very high95.3Very high1 Ų152 Ų521%0.00528%0.276CS..Hα-helixtrans-61.7-40.9175.3-73171.7-6.700111.3F22 T95 E98 F199 I205 Y206 L207F22-Q203 HydrophobicContact CD1-CG 4.02Å; F22-Q203 HydrophobicContact CE1-CG 3.58Å; F22-Q203 HydrophobicContact CE2-CG 4.44Å; F22-Q203 HydrophobicContact CZ-CB 4.45Å; F22-Q203 HydrophobicContact CZ-CG 3.82Å; T95-Q203 HydrophobicContact CG2-CB 4.33Å; T95-Q203 PolarHBondContact OG1-OE1 3.48Å; E98-Q203 PolarHBondContact OE2-NE2 3.5Å; E98-Q203 PolarHBondContact OE2-OE1 2.82Å; E98-Q203 VanDerWaalsContact OE2-OE1 3.12Å; F199-Q203 WeakPolarHBondContact O-CB 3.4Å; F199-Q203 VanDerWaalsContact O-CG 3.25Å; F199-Q203 WeakPolarHBondContact O-CG 3Å; F199-Q203 PolarHBondContact O-N 2.97Å; Q203-I205 PolarHBondContact O-N 2.89Å; Q203-Y206 CarbonylContact O-C 3.41Å; Q203-Y206 WeakPolarHBondContact O-CB 3.42Å; Q203-Y206 PolarHBondContact O-N 2.85Å; Q203-L207 WeakPolarHBondContact O-CB 3.31Å; Q203-L207 VanDerWaalsContact O-CG 3.23Å; Q203-L207 WeakPolarHBondContact O-CG 2.96Å; Q203-L207 PolarHBondContact O-N 3.39Å
204G96Very high95Very high25 Ų2552.4 Ų52.426%0.25828%0.278SS..Hα-helixtrans-59.3-48.3176.900000112.3A200 I201 I202 Y206 L207 I208A200-G204 PolarHBondContact O-N 2.95Å; I201-G204 PolarHBondContact O-N 2.78Å; I202-G204 VanDerWaalsContact C-N 3.34Å; G204-Y206 VanDerWaalsContact C-N 3.35Å; G204-Y206 PolarHBondContact O-N 2.98Å; G204-L207 PolarHBondContact O-N 3.01Å; G204-I208 VanDerWaalsContact O-CG1 3.29Å; G204-I208 WeakPolarHBondContact O-CG1 3.43Å; G204-I208 PolarHBondContact O-N 3.24Å
205I96.2Very high94.7Very high100 Ų10052.1 Ų52.151%0.51327%0.273SS..Hα-helixtrans-61.4-46.1175.2-64.8168.5000110.4I201 I202 Q203 L207 I208 I209I201-I205 HydrophobicContact CG2-CD1 4.3Å; I201-I205 WeakPolarHBondContact O-CG1 2.95Å; I201-I205 PolarHBondContact O-N 2.03Å; I201-I205 VanDerWaalsContact O-N 3.07Å; I202-I205 PolarHBondContact O-N 2.94Å; Q203-I205 PolarHBondContact O-N 2.89Å; I205-L207 PolarHBondContact O-N 3.26Å; I205-I208 PolarHBondContact O-N 3.4Å; I205-I209 HydrophobicContact CG2-CD1 3.85Å; I205-I209 VanDerWaalsContact O-CG1 3.32Å; I205-I209 WeakPolarHBondContact O-CG1 3.43Å; I205-I209 PolarHBondContact O-N 2.93Å
206Y96.1Very high94.2Very high9 Ų958.2 Ų58.24%0.03529%0.293CS..Hα-helixtrans-58.6-43.1177.9168.8-97.8000113F15 L18 N19 F22 H87 I202 Q203 G204 I209 S210F15-Y206 AromaticContact CD2-CE2 3.63Å; F15-Y206 HydrophobicContact CD2-CE2 3.63Å; F15-Y206 AromaticContact CD2-CZ 3.93Å; F15-Y206 WeakPolarHBondContact CD2-OH 3.37Å; F15-Y206 AromaticContact CE2-CE2 3.88Å; F15-Y206 HydrophobicContact CE2-CE2 3.88Å; F15-Y206 AromaticContact CE2-CZ 3.66Å; F15-Y206 WeakPolarHBondContact CE2-OH 3.41Å; F15-Y206 HydrophobicContact CG-CE2 4.37Å; F15-Y206 WeakPolarHBondContact CZ-OH 3.26Å; L18-Y206 HydrophobicContact CB-CD2 4.19Å; L18-Y206 HydrophobicContact CB-CE2 4.37Å; L18-Y206 HydrophobicContact CD1-CD2 3.69Å; L18-Y206 HydrophobicContact CD1-CE2 4.47Å; L18-Y206 HydrophobicContact CD1-CG 4.48Å; N19-Y206 PolarHBondContact ND2-OH 3.34Å; N19-Y206 PolarHBondContact OD1-OH 2.93Å; F22-Y206 AromaticContact CE2-CD1 3.66Å; F22-Y206 HydrophobicContact CE2-CD1 3.66Å; F22-Y206 HydrophobicContact CE2-CD2 4.09Å; F22-Y206 AromaticContact CE2-CE1 3.94Å; F22-Y206 HydrophobicContact CE2-CE1 3.94Å; F22-Y206 HydrophobicContact CE2-CE2 4.33Å; F22-Y206 AromaticContact CE2-CG 3.72Å; F22-Y206 HydrophobicContact CE2-CG 3.72Å; F22-Y206 HydrophobicContact CZ-CD1 4.24Å; F22-Y206 HydrophobicContact CZ-CG 4.04Å; H87-Y206 PolarHBondContact CE1-OH 3.19Å; H87-Y206 AromaticContact NE2-CE1 3.48Å; H87-Y206 WeakPolarHBondContact NE2-CE1 3.06Å; H87-Y206 AromaticContact NE2-CZ 3.46Å; H87-Y206 PolarHBondContact NE2-OH 2.96Å; I202-Y206 VanDerWaalsContact O-CB 3.3Å; I202-Y206 WeakPolarHBondContact O-CB 3.28Å; I202-Y206 PolarHBondContact O-N 3.35Å; Q203-Y206 CarbonylContact O-C 3.41Å; Q203-Y206 WeakPolarHBondContact O-CB 3.42Å; Q203-Y206 PolarHBondContact O-N 2.85Å; G204-Y206 VanDerWaalsContact C-N 3.35Å; G204-Y206 PolarHBondContact O-N 2.98Å; Y206-I209 PolarHBondContact O-N 3.22Å; Y206-S210 VanDerWaalsContact O-CB 3.31Å; Y206-S210 WeakPolarHBondContact O-CB 3.47Å; Y206-S210 PolarHBondContact O-N 3.46Å; Y206-S210 PolarHBondContact O-OG 3.2Å
207L96.3Very high93.6Very high13 Ų1360.5 Ų60.57%0.06831%0.309CS..Hα-helixtrans-67.1-44.4179.2-76167.9000111.2I88 M91 Q203 G204 I205 I209 S210 I211I88-L207 HydrophobicContact CG2-CD2 4.26Å; M91-L207 HydrophobicContact CB-CD2 3.6Å; M91-L207 HydrophobicContact CB-CG 4.45Å; Q203-L207 WeakPolarHBondContact O-CB 3.31Å; Q203-L207 VanDerWaalsContact O-CG 3.23Å; Q203-L207 WeakPolarHBondContact O-CG 2.96Å; Q203-L207 PolarHBondContact O-N 3.39Å; G204-L207 PolarHBondContact O-N 3.01Å; I205-L207 PolarHBondContact O-N 3.26Å; L207-I209 VanDerWaalsContact C-N 3.33Å; L207-I209 PolarHBondContact O-N 2.99Å; L207-S210 PolarHBondContact O-N 3.23Å; L207-I211 WeakPolarHBondContact O-CB 3.36Å; L207-I211 WeakPolarHBondContact O-CD1 3.37Å; L207-I211 VanDerWaalsContact O-CG1 3.22Å; L207-I211 WeakPolarHBondContact O-CG1 3.49Å; L207-I211 PolarHBondContact O-N 3.14Å
208I95.9Very high93Very high106 Ų10660.2 Ų60.254%0.54431%0.31SS..Hα-helixtrans-56.5-50175.6-69.3165.8000110.1G204 I205 S210 I211 L212G204-I208 VanDerWaalsContact O-CG1 3.29Å; G204-I208 WeakPolarHBondContact O-CG1 3.43Å; G204-I208 PolarHBondContact O-N 3.24Å; I205-I208 PolarHBondContact O-N 3.4Å; I208-S210 VanDerWaalsContact C-N 3.35Å; I208-S210 PolarHBondContact O-N 2.78Å; I208-I211 PolarHBondContact O-N 3.47Å; I208-L212 HydrophobicContact CG2-CD1 4Å; I208-L212 VanDerWaalsContact O-CG 3.25Å; I208-L212 WeakPolarHBondContact O-CG 3.46Å; I208-L212 PolarHBondContact O-N 3.25Å
209I93.1Very high92.4Very high50 Ų5060.5 Ų60.526%0.25631%0.312SS..Hα-helixtrans-61.8-44.5179-65.9170.3000110.7W11 I205 Y206 L207 I211 L212 M213W11-I209 HydrophobicContact CE3-CG2 4.11Å; W11-I209 HydrophobicContact CH2-CD1 4.17Å; W11-I209 HydrophobicContact CH2-CG2 3.86Å; W11-I209 HydrophobicContact CZ3-CD1 4.09Å; W11-I209 HydrophobicContact CZ3-CG2 3.52Å; I205-I209 HydrophobicContact CG2-CD1 3.85Å; I205-I209 VanDerWaalsContact O-CG1 3.32Å; I205-I209 WeakPolarHBondContact O-CG1 3.43Å; I205-I209 PolarHBondContact O-N 2.93Å; Y206-I209 PolarHBondContact O-N 3.22Å; L207-I209 VanDerWaalsContact C-N 3.33Å; L207-I209 PolarHBondContact O-N 2.99Å; I209-I211 PolarHBondContact O-N 3.28Å; I209-L212 PolarHBondContact O-N 3.03Å; I209-M213 HydrophobicContact CG2-CE 4.03Å; I209-M213 HydrophobicContact CG2-CG 4.44Å; I209-M213 HydrophobicContact CG2-SD 4.38Å; I209-M213 WeakPolarHBondContact O-CG 3.39Å; I209-M213 PolarHBondContact O-N 2.99Å
210S92.7Very high91.6Very high7 Ų764.8 Ų64.85%0.04933%0.331CS..Hα-helixtrans-62.5-42-179.8-62.70000112.5Y206 L207 I208 M213 L214Y206-S210 VanDerWaalsContact O-CB 3.31Å; Y206-S210 WeakPolarHBondContact O-CB 3.47Å; Y206-S210 PolarHBondContact O-N 3.46Å; Y206-S210 PolarHBondContact O-OG 3.2Å; L207-S210 PolarHBondContact O-N 3.23Å; I208-S210 VanDerWaalsContact C-N 3.35Å; I208-S210 PolarHBondContact O-N 2.78Å; S210-M213 PolarHBondContact O-N 3.31Å; S210-L214 WeakPolarHBondContact O-CB 3.43Å; S210-L214 PolarHBondContact O-N 3.5Å
211I93.5Very high90.5Very high66 Ų6669.1 Ų69.134%0.33835%0.348SS..Hα-helixtrans-64.2-46.1176-69164000110.6I88 L207 I208 I209 M213 L214 N215I88-I211 HydrophobicContact CD1-CG1 4.47Å; I88-I211 HydrophobicContact CG2-CD1 4.22Å; I88-I211 HydrophobicContact CG2-CG1 3.72Å; L207-I211 WeakPolarHBondContact O-CB 3.36Å; L207-I211 WeakPolarHBondContact O-CD1 3.37Å; L207-I211 VanDerWaalsContact O-CG1 3.22Å; L207-I211 WeakPolarHBondContact O-CG1 3.49Å; L207-I211 PolarHBondContact O-N 3.14Å; I208-I211 PolarHBondContact O-N 3.47Å; I209-I211 PolarHBondContact O-N 3.28Å; I211-M213 VanDerWaalsContact C-N 3.32Å; I211-M213 PolarHBondContact O-N 3.42Å; I211-L214 PolarHBondContact O-N 3.06Å; I211-N215 WeakPolarHBondContact O-CB 3.42Å; I211-N215 VanDerWaalsContact O-CG 3.3Å; I211-N215 PolarHBondContact O-N 3.27Å
212L92.1Very high89.4Confident114 Ų11468.2 Ų68.260%0.59735%0.347SS*.Hα-helixtrans-60.4-42177.4-69.7173.4000111.8I208 I209 R216I208-L212 HydrophobicContact CG2-CD1 4Å; I208-L212 VanDerWaalsContact O-CG 3.25Å; I208-L212 WeakPolarHBondContact O-CG 3.46Å; I208-L212 PolarHBondContact O-N 3.25Å; I209-L212 PolarHBondContact O-N 3.03Å; L212-R216 WeakPolarHBondContact O-CB 3.36Å; L212-R216 PolarHBondContact O-N 2.8Å; L212-R216 VanDerWaalsContact O-N 3.09Å
213M88.1Confident88.2Confident73 Ų7372.7 Ų72.736%0.3637%0.371SS..Hα-helixtrans-65.6-42.6176.2-72-166.2-59.500112.3W11 I209 S210 I211 R216 S217W11-M213 HydrophobicContact CB-SD 4.43Å; W11-M213 HydrophobicContact CD2-SD 4.32Å; W11-M213 HydrophobicContact CG-SD 4.3Å; I209-M213 HydrophobicContact CG2-CE 4.03Å; I209-M213 HydrophobicContact CG2-CG 4.44Å; I209-M213 HydrophobicContact CG2-SD 4.38Å; I209-M213 WeakPolarHBondContact O-CG 3.39Å; I209-M213 PolarHBondContact O-N 2.99Å; S210-M213 PolarHBondContact O-N 3.31Å; I211-M213 VanDerWaalsContact C-N 3.32Å; I211-M213 PolarHBondContact O-N 3.42Å; M213-R216 PolarHBondContact O-N 2.78Å; M213-S217 PolarHBondContact O-N 3.07Å
214L88.6Confident86.6Confident26 Ų2678.2 Ų78.214%0.13641%0.408CS..Hα-helixtrans-63.5-47.3177.7-178.360.3000111.2A84 I88 S210 I211 R216 S217 M218A84-L214 HydrophobicContact CB-CD1 4.05Å; I88-L214 HydrophobicContact CD1-CB 4.21Å; I88-L214 HydrophobicContact CD1-CD2 3.82Å; S210-L214 WeakPolarHBondContact O-CB 3.43Å; S210-L214 PolarHBondContact O-N 3.5Å; I211-L214 PolarHBondContact O-N 3.06Å; L214-R216 VanDerWaalsContact C-N 3.31Å; L214-R216 PolarHBondContact O-N 3.12Å; L214-S217 WeakPolarHBondContact O-CA 3.46Å; L214-S217 WeakPolarHBondContact O-CB 3.48Å; L214-S217 PolarHBondContact O-N 3.02Å; L214-M218 HydrophobicContact CD1-CG 4.47Å; L214-M218 WeakPolarHBondContact O-CG 3.44Å; L214-M218 PolarHBondContact O-N 2.77Å
215N89.5Confident84.9Confident83 Ų8386.8 Ų86.844%0.44445%0.446SS..Hα-helixtrans-59.1-42.6177.8-73-13.1000111.7I211 S217 M218 N219I211-N215 WeakPolarHBondContact O-CB 3.42Å; I211-N215 VanDerWaalsContact O-CG 3.3Å; I211-N215 PolarHBondContact O-N 3.27Å; N215-S217 VanDerWaalsContact C-N 3.31Å; N215-S217 PolarHBondContact O-N 3.27Å; N215-M218 PolarHBondContact O-N 3.27Å; N215-N219 VanDerWaalsContact O-CG 3.31Å; N215-N219 PolarHBondContact O-N 2.79Å
216R87.2Confident84.3Confident171 Ų17186.1 Ų86.165%0.64544%0.443SS*.Hα-helixtrans-63.4-37.2175.3-171.3178.5-175-1722.9112.4L212 M213 L214 K220L212-R216 WeakPolarHBondContact O-CB 3.36Å; L212-R216 PolarHBondContact O-N 2.8Å; L212-R216 VanDerWaalsContact O-N 3.09Å; M213-R216 PolarHBondContact O-N 2.78Å; L214-R216 VanDerWaalsContact C-N 3.31Å; L214-R216 PolarHBondContact O-N 3.12Å; R216-K220 WeakPolarHBondContact O-CG 3.49Å; R216-K220 PolarHBondContact O-N 3.27Å
217S84.1Confident83.7Confident49 Ų4990.2 Ų90.234%0.34346%0.464SS..Hα-helixtrans-66-43.9176.1-173.80000111.6M213 L214 N215 K220 K221M213-S217 PolarHBondContact O-N 3.07Å; L214-S217 WeakPolarHBondContact O-CA 3.46Å; L214-S217 WeakPolarHBondContact O-CB 3.48Å; L214-S217 PolarHBondContact O-N 3.02Å; N215-S217 VanDerWaalsContact C-N 3.31Å; N215-S217 PolarHBondContact O-N 3.27Å; S217-K220 PolarHBondContact O-N 3.26Å; S217-K221 PolarHBondContact O-N 3.11Å
218M83.9Confident83Confident78 Ų7894.4 Ų94.438%0.38449%0.486SS..Hα-helixtrans-61.6-49.5176.8-66.9-61.5-66.300111.7N81 L214 N215 K220 K221 T222N81-M218 HydrophobicContact CB-SD 3.93Å; N81-M218 PolarHBondContact ND2-SD 2.86Å; L214-M218 HydrophobicContact CD1-CG 4.47Å; L214-M218 WeakPolarHBondContact O-CG 3.44Å; L214-M218 PolarHBondContact O-N 2.77Å; N215-M218 PolarHBondContact O-N 3.27Å; M218-K220 VanDerWaalsContact C-N 3.29Å; M218-K220 PolarHBondContact O-N 2.72Å; M218-K221 WeakPolarHBondContact O-CB 3.42Å; M218-K221 PolarHBondContact O-N 3.44Å; M218-T222 PolarHBondContact O-N 3.37Å; M218-T222 VanDerWaalsContact O-N 3.08Å; M218-T222 PolarHBondContact O-OG1 2.94Å
219N84.3Confident82.2Confident103 Ų10393.8 Ų93.855%0.55148%0.483SS*.Hα-helixtrans-61.9-36.1-178.8-69.9-8.9000112.7N215 K221 T222 L223N215-N219 VanDerWaalsContact O-CG 3.31Å; N215-N219 PolarHBondContact O-N 2.79Å; N219-K221 VanDerWaalsContact C-N 3.35Å; N219-T222 PolarHBondContact O-N 3.41Å; N219-L223 WeakPolarHBondContact O-CG 3.5Å; N219-L223 PolarHBondContact O-N 2.82Å; N219-L223 VanDerWaalsContact O-N 3.09Å
220K78.6Confident81.6Confident112 Ų11296.5 Ų96.549%0.48750%0.497SS..Hα-helixtrans-65.3-36.7174.3-77.6-178.7177.7-174.40112.7R216 S217 M218 C224R216-K220 WeakPolarHBondContact O-CG 3.49Å; R216-K220 PolarHBondContact O-N 3.27Å; S217-K220 PolarHBondContact O-N 3.26Å; M218-K220 VanDerWaalsContact C-N 3.29Å; M218-K220 PolarHBondContact O-N 2.72Å; K220-C224 PolarHBondContact O-N 3.07Å; K220-C224 PolarHBondContact O-SG 3.33Å; K220-C224 VanDerWaalsContact O-SG 3.4Å
221K74.6Confident80.8Confident101 Ų101102.5 Ų102.544%0.43953%0.527SS..Hα-helixtrans-67.3-40175.9-73.3179.9178.31780111.1N81 S217 M218 N219 C224N81-K221 PolarHBondContact ND2-NZ 3.33Å; N81-K221 VanDerWaalsContact ND2-NZ 3.11Å; N81-K221 PolarHBondContact OD1-NZ 3.32Å; S217-K221 PolarHBondContact O-N 3.11Å; M218-K221 WeakPolarHBondContact O-CB 3.42Å; M218-K221 PolarHBondContact O-N 3.44Å; N219-K221 VanDerWaalsContact C-N 3.35Å; K221-C224 PolarHBondContact O-N 2.96Å
222T73.9Confident79.9Confident94 Ų94105.1 Ų105.158%0.57754%0.54SS*.Hα-helixtrans-66.3-36.3177.8-48.20000112.9M218 N219 C224M218-T222 PolarHBondContact O-N 3.37Å; M218-T222 VanDerWaalsContact O-N 3.08Å; M218-T222 PolarHBondContact O-OG1 2.94Å; N219-T222 PolarHBondContact O-N 3.41Å; T222-C224 VanDerWaalsContact C-N 3.31Å; T222-C224 PolarHBondContact O-N 3.39Å
223L70.1Confident79Confident146 Ų146104.4 Ų104.476%0.76454%0.536SS*.Hα-helixtrans-74.6-14.8178.6-75.8163.6000114.5N219N219-L223 WeakPolarHBondContact O-CG 3.5Å; N219-L223 PolarHBondContact O-N 2.82Å; N219-L223 VanDerWaalsContact O-N 3.09Å
224C64Low78.2Confident117 Ų117107 Ų10779%0.79155%0.551SS**THydrogen-bonded Turntrans-99.57-179.9-69.80000113.5K220 K221 T222K220-C224 PolarHBondContact O-N 3.07Å; K220-C224 PolarHBondContact O-SG 3.33Å; K220-C224 VanDerWaalsContact O-SG 3.4Å; K221-C224 PolarHBondContact O-N 2.96Å; T222-C224 VanDerWaalsContact C-N 3.31Å; T222-C224 PolarHBondContact O-N 3.39Å
225I59.8Low77.3Confident204 Ų204114.4 Ų114.4100%1.04659%0.588SS**  trans-1050171.2-60.4170000107.1

Retrieved 225 of 225 residues in 160.5 ms (Link to these results)

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