G4LW52_SCHMA Loading...

Tetraspanin, putative

AlphaFold DB , UniProt , Accession G4LW52, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 224 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
1M38.9Very low69.2Low242 Ų242122.8 Ų122.8100%1.19262%0.623SS**  0116.90-67.1171.6-161.800108.6K3M1-K3 PolarHBondContact O-N 3.15Å; M1-K3 VanDerWaalsContact O-N 3.15Å
2K44.2Very low70.8Confident211 Ų211117.1 Ų117.192%0.91760%0.599SS**  trans-63113.5170.5-89.3179.3173.1176.60107.4I4K2-I4 PolarHBondContact O-N 2.87Å; K2-I4 VanDerWaalsContact O-N 3.12Å
3K57.4Low72.4Confident176 Ų176119 Ų11977%0.76560%0.6SS**  trans-58.8117.2169-90.1179.3175.2174.50106.5M1 S5M1-K3 PolarHBondContact O-N 3.15Å; M1-K3 VanDerWaalsContact O-N 3.15Å; K3-S5 VanDerWaalsContact C-N 3.26Å; K3-S5 PolarHBondContact O-N 3.12Å
4I60.4Low73.8Confident116 Ų116114.8 Ų114.860%0.59558%0.579SS**  trans-6694.7169-59.3171.5000105.7K2 F6K2-I4 PolarHBondContact O-N 2.87Å; K2-I4 VanDerWaalsContact O-N 3.12Å; I4-F6 HydrophobicContact CG2-CD1 4.5Å; I4-F6 HydrophobicContact CG2-CD2 3.87Å; I4-F6 HydrophobicContact CG2-CE1 4.11Å; I4-F6 HydrophobicContact CG2-CE2 3.41Å; I4-F6 VanDerWaalsContact CG2-CE2 3.41Å; I4-F6 HydrophobicContact CG2-CG 4.4Å; I4-F6 HydrophobicContact CG2-CZ 3.55Å
5S65.4Low75Confident95 Ų95108.7 Ų108.766%0.66455%0.548SS*.  trans-97.1100.8167.3620000107.1K3 S7K3-S5 VanDerWaalsContact C-N 3.26Å; K3-S5 PolarHBondContact O-N 3.12Å; S5-S7 PolarHBondContact O-N 3.28Å
6F72.2Confident76.1Confident97 Ų97106.2 Ų106.243%0.42554%0.535SS..  trans-65.1132.6166-66.9-72.9000108.3I4 V10 I14I4-F6 HydrophobicContact CG2-CD1 4.5Å; I4-F6 HydrophobicContact CG2-CD2 3.87Å; I4-F6 HydrophobicContact CG2-CE1 4.11Å; I4-F6 HydrophobicContact CG2-CE2 3.41Å; I4-F6 VanDerWaalsContact CG2-CE2 3.41Å; I4-F6 HydrophobicContact CG2-CG 4.4Å; I4-F6 HydrophobicContact CG2-CZ 3.55Å; F6-V10 HydrophobicContact CD1-CG1 3.78Å; F6-I14 HydrophobicContact CD1-CD1 4.25Å; F6-I14 HydrophobicContact CE1-CD1 4.15Å
7S81.7Confident77.3Confident53 Ų53105.1 Ų105.137%0.37154%0.535SS..  trans-63.1150.3168.2670000109S5 E9 V10 W11S5-S7 PolarHBondContact O-N 3.28Å; S7-E9 PolarHBondContact O-N 3.37Å; S7-E9 VanDerWaalsContact O-N 3.15Å; S7-V10 PolarHBondContact O-N 3.15Å; S7-V10 VanDerWaalsContact OG-CG2 3.23Å; S7-V10 WeakPolarHBondContact OG-CG2 3.23Å; S7-V10 PolarHBondContact OG-N 3.35Å; S7-W11 PolarHBondContact O-N 3.12Å
8P80.6Confident78.3Confident107 Ų107101.1 Ų101.170%0.69552%0.517SS*.Hα-helixtrans-52.5-37.8178.3-27.835.2000112.8W11 T12P8-W11 PolarHBondContact O-N 3.02Å; P8-T12 PolarHBondContact O-N 2.79Å; P8-T12 PolarHBondContact O-OG1 3.32Å; P8-T12 VanDerWaalsContact O-OG1 3.13Å
9E86.6Confident79.2Confident145 Ų14595.8 Ų95.868%0.67849%0.49SS*.Hα-helixtrans-64.4-43.5177.4-62.2-179.2-179.800113.1S7 W11 T12 K13S7-E9 PolarHBondContact O-N 3.37Å; S7-E9 VanDerWaalsContact O-N 3.15Å; E9-W11 VanDerWaalsContact C-N 3.33Å; E9-T12 PolarHBondContact O-N 3.38Å; E9-K13 WeakPolarHBondContact O-CG 3.45Å; E9-K13 PolarHBondContact O-N 3.07Å; E9-K13 VanDerWaalsContact O-N 3.15Å
10V88.5Confident80.1Confident62 Ų6293.6 Ų93.638%0.37648%0.483SS..Hα-helixtrans-65.7-41.4177.5170.90000110F6 S7 T12 K13 I14F6-V10 HydrophobicContact CD1-CG1 3.78Å; S7-V10 PolarHBondContact O-N 3.15Å; S7-V10 VanDerWaalsContact OG-CG2 3.23Å; S7-V10 WeakPolarHBondContact OG-CG2 3.23Å; S7-V10 PolarHBondContact OG-N 3.35Å; V10-T12 PolarHBondContact O-N 3.05Å; V10-K13 PolarHBondContact O-N 3.07Å; V10-I14 HydrophobicContact CG1-CD1 3.8Å; V10-I14 HydrophobicContact CG1-CG1 4.44Å; V10-I14 WeakPolarHBondContact O-CG1 3.36Å; V10-I14 PolarHBondContact O-N 2.98Å
11W85.5Confident80.9Confident47 Ų4793.1 Ų93.118%0.17848%0.481CS..Hα-helixtrans-61.5-44.9176.7-178.2-108.4000112.3S7 P8 E9 K13 I14 F15 I208 M212S7-W11 PolarHBondContact O-N 3.12Å; P8-W11 PolarHBondContact O-N 3.02Å; E9-W11 VanDerWaalsContact C-N 3.33Å; W11-K13 VanDerWaalsContact C-N 3.33Å; W11-K13 PolarHBondContact O-N 3.32Å; W11-I14 HydrophobicContact CZ3-CG2 4.42Å; W11-I14 PolarHBondContact O-N 3.18Å; W11-F15 WeakPolarHBondContact O-CB 3.48Å; W11-F15 PolarHBondContact O-N 3.48Å; W11-I208 HydrophobicContact CH2-CB 4.34Å; W11-I208 HydrophobicContact CH2-CG2 3.56Å; W11-I208 HydrophobicContact CZ3-CG2 3.55Å; W11-M212 HydrophobicContact CD2-CE 3.61Å; W11-M212 HydrophobicContact CD2-SD 3.84Å; W11-M212 HydrophobicContact CE3-CE 3.93Å; W11-M212 HydrophobicContact CE3-SD 4Å; W11-M212 HydrophobicContact CG-CE 4.42Å; W11-M212 HydrophobicContact CG-SD 4.36Å; W11-M212 HydrophobicContact CH2-CE 3.41Å; W11-M212 VanDerWaalsContact CH2-CE 3.41Å; W11-M212 HydrophobicContact CH2-SD 4.44Å; W11-M212 HydrophobicContact CZ2-CE 3.02Å; W11-M212 HydrophobicContact CZ2-SD 4.3Å; W11-M212 HydrophobicContact CZ3-CE 3.84Å; W11-M212 HydrophobicContact CZ3-SD 4.29Å
12T88.6Confident83.7Confident54 Ų5481.8 Ų81.833%0.33143%0.425SS..Hα-helixtrans-59.5-41.5176.5-63.30000112.4P8 E9 V10 F15 I16 L76P8-T12 PolarHBondContact O-N 2.79Å; P8-T12 PolarHBondContact O-OG1 3.32Å; P8-T12 VanDerWaalsContact O-OG1 3.13Å; E9-T12 PolarHBondContact O-N 3.38Å; V10-T12 PolarHBondContact O-N 3.05Å; T12-F15 PolarHBondContact O-N 3.36Å; T12-I16 HydrophobicContact CG2-CD1 3.98Å; T12-I16 WeakPolarHBondContact O-CG1 3.29Å; T12-I16 PolarHBondContact O-N 3.37Å; T12-L76 HydrophobicContact CG2-CD1 4Å; T12-L76 HydrophobicContact CG2-CD2 3.99Å
13K91.3Very high86.2Confident142 Ų14274 Ų7462%0.61739%0.393SS*.Hα-helixtrans-64.3-46.4176.7-70.6177.8-176.2178.30111.9E9 V10 W11 F15 I16 V17E9-K13 WeakPolarHBondContact O-CG 3.45Å; E9-K13 PolarHBondContact O-N 3.07Å; E9-K13 VanDerWaalsContact O-N 3.15Å; V10-K13 PolarHBondContact O-N 3.07Å; W11-K13 VanDerWaalsContact C-N 3.33Å; W11-K13 PolarHBondContact O-N 3.32Å; K13-F15 VanDerWaalsContact C-N 3.33Å; K13-F15 PolarHBondContact O-N 3Å; K13-I16 PolarHBondContact O-N 3.39Å; K13-V17 WeakPolarHBondContact O-CG2 3.32Å; K13-V17 PolarHBondContact O-N 3.15Å
14I91.5Very high88.2Confident60 Ų6069.5 Ų69.531%0.30838%0.38SS..Hα-helixtrans-59.4-46.5176.6-68168.9000110.3F6 V10 W11 I16 V17 V18F6-I14 HydrophobicContact CD1-CD1 4.25Å; F6-I14 HydrophobicContact CE1-CD1 4.15Å; V10-I14 HydrophobicContact CG1-CD1 3.8Å; V10-I14 HydrophobicContact CG1-CG1 4.44Å; V10-I14 WeakPolarHBondContact O-CG1 3.36Å; V10-I14 PolarHBondContact O-N 2.98Å; W11-I14 HydrophobicContact CZ3-CG2 4.42Å; W11-I14 PolarHBondContact O-N 3.18Å; I14-I16 PolarHBondContact O-N 2.92Å; I14-V17 PolarHBondContact O-N 3.02Å; I14-V18 HydrophobicContact CG2-CG2 4.09Å; I14-V18 WeakPolarHBondContact O-CB 3.43Å; I14-V18 VanDerWaalsContact O-CG2 3.28Å; I14-V18 WeakPolarHBondContact O-CG2 3.46Å; I14-V18 PolarHBondContact O-N 3.3Å
15F92Very high90Very high23 Ų2366 Ų6610%0.10136%0.36CS..Hα-helixtrans-56.2-47.9178.1178.1-81.8000112W11 T12 K13 N19 G72 L76 Y205W11-F15 WeakPolarHBondContact O-CB 3.48Å; W11-F15 PolarHBondContact O-N 3.48Å; T12-F15 PolarHBondContact O-N 3.36Å; K13-F15 VanDerWaalsContact C-N 3.33Å; K13-F15 PolarHBondContact O-N 3Å; F15-N19 WeakPolarHBondContact CE1-ND2 3.42Å; F15-N19 WeakPolarHBondContact CZ-ND2 3.33Å; F15-N19 WeakPolarHBondContact O-CB 3.35Å; F15-N19 PolarHBondContact O-N 3.19Å; F15-N19 PolarHBondContact O-ND2 3.2Å; F15-G72 WeakPolarHBondContact CZ-O 3.3Å; F15-L76 HydrophobicContact CD1-CD1 4.48Å; F15-L76 HydrophobicContact CD1-CD2 4.19Å; F15-L76 HydrophobicContact CE1-CB 4.06Å; F15-L76 HydrophobicContact CE1-CD2 4.41Å; F15-Y205 HydrophobicContact CD2-CE2 4.07Å; F15-Y205 WeakPolarHBondContact CD2-OH 3.34Å; F15-Y205 WeakPolarHBondContact CE2-OH 3.12Å
16I93.5Very high91.6Very high69 Ų6961.5 Ų61.535%0.35433%0.329SS..Hα-helixtrans-61-50.4179.5-71.7167.4000110.2T12 K13 I14 V18 N19 S20 F73 L76T12-I16 HydrophobicContact CG2-CD1 3.98Å; T12-I16 WeakPolarHBondContact O-CG1 3.29Å; T12-I16 PolarHBondContact O-N 3.37Å; K13-I16 PolarHBondContact O-N 3.39Å; I14-I16 PolarHBondContact O-N 2.92Å; I16-V18 PolarHBondContact O-N 3.39Å; I16-N19 PolarHBondContact O-N 3.43Å; I16-S20 WeakPolarHBondContact O-CB 3.35Å; I16-S20 PolarHBondContact O-N 3.3Å; I16-S20 PolarHBondContact O-OG 3.4Å; I16-S20 VanDerWaalsContact O-OG 3.08Å; I16-F73 HydrophobicContact CB-CE1 4.44Å; I16-F73 HydrophobicContact CG1-CE1 4.4Å; I16-F73 HydrophobicContact CG2-CE1 4.19Å; I16-L76 HydrophobicContact CD1-CD2 3.94Å; I16-L76 HydrophobicContact CG1-CD2 3.77Å
17V95.3Very high92.8Very high87 Ų8762.7 Ų62.753%0.52734%0.335SS..Hα-helixtrans-60.9-47-178.7172.50000111.2K13 I14 S20 L21K13-V17 WeakPolarHBondContact O-CG2 3.32Å; K13-V17 PolarHBondContact O-N 3.15Å; I14-V17 PolarHBondContact O-N 3.02Å; V17-S20 PolarHBondContact O-N 3.3Å; V17-L21 HydrophobicContact CG1-CD1 4.18Å; V17-L21 WeakPolarHBondContact O-CG 3.4Å; V17-L21 PolarHBondContact O-N 3.41Å
18V95.2Very high93.6Very high34 Ų3463.3 Ų63.321%0.20633%0.333CS..Hα-helixtrans-65.7-43.2-178.5171.40000111.5I14 I16 S20 L21 F22 Y205I14-V18 HydrophobicContact CG2-CG2 4.09Å; I14-V18 WeakPolarHBondContact O-CB 3.43Å; I14-V18 VanDerWaalsContact O-CG2 3.28Å; I14-V18 WeakPolarHBondContact O-CG2 3.46Å; I14-V18 PolarHBondContact O-N 3.3Å; I16-V18 PolarHBondContact O-N 3.39Å; V18-S20 PolarHBondContact O-N 3Å; V18-L21 WeakPolarHBondContact O-CB 3.38Å; V18-L21 PolarHBondContact O-N 3.06Å; V18-F22 HydrophobicContact CG1-CD1 4.5Å; V18-F22 HydrophobicContact CG1-CD2 4.11Å; V18-F22 HydrophobicContact CG1-CE1 3.86Å; V18-F22 HydrophobicContact CG1-CE2 3.41Å; V18-F22 VanDerWaalsContact CG1-CE2 3.41Å; V18-F22 HydrophobicContact CG1-CZ 3.26Å; V18-F22 VanDerWaalsContact O-CG 3.29Å; V18-F22 WeakPolarHBondContact O-CG 3.38Å; V18-F22 PolarHBondContact O-N 3.5Å; V18-Y205 HydrophobicContact CB-CD2 4.46Å; V18-Y205 HydrophobicContact CG1-CD2 3.73Å; V18-Y205 HydrophobicContact CG1-CE2 4.3Å; V18-Y205 HydrophobicContact CG1-CG 4.13Å
19N95.6Very high94.5Very high0 Ų058.2 Ų58.20%030%0.3CS..Hα-helixtrans-66.4-36.9176.3-82.4-86.9000112.4F15 I16 F22 I23 F73 H87 Y205F15-N19 WeakPolarHBondContact CE1-ND2 3.42Å; F15-N19 WeakPolarHBondContact CZ-ND2 3.33Å; F15-N19 WeakPolarHBondContact O-CB 3.35Å; F15-N19 PolarHBondContact O-N 3.19Å; F15-N19 PolarHBondContact O-ND2 3.2Å; I16-N19 PolarHBondContact O-N 3.43Å; N19-F22 PolarHBondContact O-N 3.13Å; N19-I23 PolarHBondContact O-N 2.99Å; N19-I23 VanDerWaalsContact O-N 3.07Å; N19-F73 HydrophobicContact CB-CE1 4.24Å; N19-F73 HydrophobicContact CB-CE2 3.83Å; N19-F73 HydrophobicContact CB-CZ 3.62Å; N19-H87 PolarHBondContact OD1-CE1 3.39Å; N19-Y205 PolarHBondContact ND2-OH 2.87Å
20S96.8Very high95Very high52 Ų5253.5 Ų53.536%0.36428%0.277SS..Hα-helixtrans-62.2-43.4172.5-67.60000111.4I16 V17 V18 F22 I23 V24I16-S20 WeakPolarHBondContact O-CB 3.35Å; I16-S20 PolarHBondContact O-N 3.3Å; I16-S20 PolarHBondContact O-OG 3.4Å; I16-S20 VanDerWaalsContact O-OG 3.08Å; V17-S20 PolarHBondContact O-N 3.3Å; V18-S20 PolarHBondContact O-N 3Å; S20-F22 VanDerWaalsContact C-N 3.33Å; S20-F22 PolarHBondContact O-N 3.11Å; S20-I23 PolarHBondContact O-N 3.26Å; S20-V24 WeakPolarHBondContact O-CG2 3.15Å; S20-V24 PolarHBondContact O-N 3.41Å; S20-V24 VanDerWaalsContact O-N 3.12Å
21L97.2Very high95.5Very high83 Ų8352.6 Ų52.644%0.43528%0.276SS..Hα-helixtrans-61.3-41.4175-71.8171.6000111.8V17 V18 I23 V24 F25V17-L21 HydrophobicContact CG1-CD1 4.18Å; V17-L21 WeakPolarHBondContact O-CG 3.4Å; V17-L21 PolarHBondContact O-N 3.41Å; V18-L21 WeakPolarHBondContact O-CB 3.38Å; V18-L21 PolarHBondContact O-N 3.06Å; L21-I23 PolarHBondContact O-N 3.4Å; L21-V24 PolarHBondContact O-N 3.01Å; L21-F25 HydrophobicContact CB-CD2 4.47Å; L21-F25 HydrophobicContact CB-CE2 4.42Å; L21-F25 WeakPolarHBondContact O-CD2 3.34Å; L21-F25 PolarHBondContact O-N 3.31Å
22F97.7Very high96.1Very high4 Ų452.5 Ų52.52%0.01828%0.279CS..Hα-helixtrans-60.6-43.5176-65.1-22.7000112.4V18 N19 S20 V24 F25 S26 S69 L91 L201 Q202 Y205V18-F22 HydrophobicContact CG1-CD1 4.5Å; V18-F22 HydrophobicContact CG1-CD2 4.11Å; V18-F22 HydrophobicContact CG1-CE1 3.86Å; V18-F22 HydrophobicContact CG1-CE2 3.41Å; V18-F22 VanDerWaalsContact CG1-CE2 3.41Å; V18-F22 HydrophobicContact CG1-CZ 3.26Å; V18-F22 VanDerWaalsContact O-CG 3.29Å; V18-F22 WeakPolarHBondContact O-CG 3.38Å; V18-F22 PolarHBondContact O-N 3.5Å; N19-F22 PolarHBondContact O-N 3.13Å; S20-F22 VanDerWaalsContact C-N 3.33Å; S20-F22 PolarHBondContact O-N 3.11Å; F22-V24 VanDerWaalsContact C-N 3.32Å; F22-V24 PolarHBondContact O-N 2.96Å; F22-F25 PolarHBondContact O-N 3.07Å; F22-S26 VanDerWaalsContact O-CB 3.23Å; F22-S26 WeakPolarHBondContact O-CB 3.28Å; F22-S26 PolarHBondContact O-N 3.03Å; F22-S26 PolarHBondContact O-OG 3.14Å; F22-S69 WeakPolarHBondContact CB-OG 3.34Å; F22-L91 HydrophobicContact CD2-CD1 4.08Å; F22-L91 HydrophobicContact CD2-CD2 4.21Å; F22-L91 HydrophobicContact CE2-CD1 3.92Å; F22-L201 HydrophobicContact CE1-CB 3.92Å; F22-Q202 HydrophobicContact CD1-CG 4.05Å; F22-Q202 HydrophobicContact CD2-CG 4.47Å; F22-Q202 HydrophobicContact CE1-CG 3.67Å; F22-Q202 HydrophobicContact CE2-CG 4.12Å; F22-Q202 HydrophobicContact CG-CG 4.45Å; F22-Q202 HydrophobicContact CZ-CB 4.32Å; F22-Q202 HydrophobicContact CZ-CG 3.71Å; F22-Y205 AromaticContact CE2-CD1 3.88Å; F22-Y205 HydrophobicContact CE2-CD1 3.88Å; F22-Y205 HydrophobicContact CE2-CE1 4.34Å; F22-Y205 AromaticContact CE2-CG 3.96Å; F22-Y205 HydrophobicContact CE2-CG 3.96Å; F22-Y205 HydrophobicContact CZ-CD1 4.38Å; F22-Y205 HydrophobicContact CZ-CG 4.13Å
23I98.1Very high96.6Very high48 Ų4850 Ų5025%0.24626%0.263CS..Hα-helixtrans-58.4-46.1174.4-68.3179.6000110.8N19 S20 L21 S26 F27 S69 F73N19-I23 PolarHBondContact O-N 2.99Å; N19-I23 VanDerWaalsContact O-N 3.07Å; S20-I23 PolarHBondContact O-N 3.26Å; L21-I23 PolarHBondContact O-N 3.4Å; I23-S26 PolarHBondContact O-N 3.41Å; I23-F27 WeakPolarHBondContact O-CB 3.47Å; I23-F27 PolarHBondContact O-N 3.04Å; I23-S69 VanDerWaalsContact CG1-CB 3.47Å; I23-F73 HydrophobicContact CD1-CD2 4.26Å; I23-F73 HydrophobicContact CD1-CE2 3.66Å
24V98.2Very high96.9Very high81 Ų8146.7 Ų46.749%0.49125%0.252SS..Hα-helixtrans-61.2-50.9-179.5172.90000111.1S20 L21 F22 S26 F27 I28S20-V24 WeakPolarHBondContact O-CG2 3.15Å; S20-V24 PolarHBondContact O-N 3.41Å; S20-V24 VanDerWaalsContact O-N 3.12Å; L21-V24 PolarHBondContact O-N 3.01Å; F22-V24 VanDerWaalsContact C-N 3.32Å; F22-V24 PolarHBondContact O-N 2.96Å; V24-S26 PolarHBondContact O-N 3.46Å; V24-F27 PolarHBondContact O-N 2.9Å; V24-I28 HydrophobicContact CG1-CD1 3.91Å; V24-I28 WeakPolarHBondContact O-CG1 3.34Å; V24-I28 PolarHBondContact O-N 3.47Å
25F98.2Very high97.2Very high42 Ų4246.2 Ų46.218%0.18425%0.254CS..Hα-helixtrans-63-42178.6-76.3-64.8000112.5L21 F22 F27 I28 M29 L194 L197 T198 L201L21-F25 HydrophobicContact CB-CD2 4.47Å; L21-F25 HydrophobicContact CB-CE2 4.42Å; L21-F25 WeakPolarHBondContact O-CD2 3.34Å; L21-F25 PolarHBondContact O-N 3.31Å; F22-F25 PolarHBondContact O-N 3.07Å; F25-F27 VanDerWaalsContact C-N 3.33Å; F25-F27 PolarHBondContact O-N 2.86Å; F25-I28 PolarHBondContact O-N 3.44Å; F25-M29 WeakPolarHBondContact O-CG 3.35Å; F25-M29 PolarHBondContact O-N 2.95Å; F25-L194 HydrophobicContact CD1-CD2 4.07Å; F25-L194 HydrophobicContact CE1-CD2 4.26Å; F25-L197 HydrophobicContact CE1-CD2 3.95Å; F25-L197 HydrophobicContact CZ-CD2 4.02Å; F25-T198 HydrophobicContact CB-CG2 3.5Å; F25-T198 VanDerWaalsContact CB-CG2 3.5Å; F25-T198 HydrophobicContact CD1-CG2 4.27Å; F25-T198 HydrophobicContact CD2-CG2 4.38Å; F25-T198 HydrophobicContact CG-CG2 3.83Å; F25-L201 HydrophobicContact CE2-CD1 4.14Å
26S98.5Very high97.5Very high2 Ų245.1 Ų45.11%0.01425%0.249CC..Hα-helixtrans-63.5-37.7177-69.20000112.5F22 I23 V24 F30 G62 G65F22-S26 VanDerWaalsContact O-CB 3.23Å; F22-S26 WeakPolarHBondContact O-CB 3.28Å; F22-S26 PolarHBondContact O-N 3.03Å; F22-S26 PolarHBondContact O-OG 3.14Å; I23-S26 PolarHBondContact O-N 3.41Å; V24-S26 PolarHBondContact O-N 3.46Å; S26-F30 VanDerWaalsContact O-CB 3.3Å; S26-F30 WeakPolarHBondContact O-CB 3.32Å; S26-F30 PolarHBondContact O-N 3.34Å; S26-G62 WeakPolarHBondContact CB-O 3.33Å; S26-G62 WeakPolarHBondContact O-CA 3.36Å; S26-G65 WeakPolarHBondContact OG-CA 3.27Å
27F98.5Very high97.7Very high122 Ų12243.9 Ų43.954%0.53524%0.243SC..Hα-helixtrans-67.6-42174.3-177.4-99.4000112.4I23 V24 F25 F30 A31 I66I23-F27 WeakPolarHBondContact O-CB 3.47Å; I23-F27 PolarHBondContact O-N 3.04Å; V24-F27 PolarHBondContact O-N 2.9Å; F25-F27 VanDerWaalsContact C-N 3.33Å; F25-F27 PolarHBondContact O-N 2.86Å; F27-F30 PolarHBondContact O-N 2.96Å; F27-A31 WeakPolarHBondContact O-CB 3.42Å; F27-A31 PolarHBondContact O-N 2.79Å; F27-I66 HydrophobicContact CB-CD1 4.36Å; F27-I66 HydrophobicContact CD2-CD1 4.43Å
28I98.6Very high97.8Very high65 Ų6543.4 Ų43.433%0.33324%0.237SC..Hα-helixtrans-60.2-48.3175.2-68.2166.5000110.4V24 F25 F30 A31 L32 L194V24-I28 HydrophobicContact CG1-CD1 3.91Å; V24-I28 WeakPolarHBondContact O-CG1 3.34Å; V24-I28 PolarHBondContact O-N 3.47Å; F25-I28 PolarHBondContact O-N 3.44Å; I28-F30 VanDerWaalsContact C-N 3.33Å; I28-F30 PolarHBondContact O-N 3.06Å; I28-A31 PolarHBondContact O-N 3.24Å; I28-L32 HydrophobicContact CG2-CD1 3.75Å; I28-L32 HydrophobicContact CG2-CG 4.22Å; I28-L32 WeakPolarHBondContact O-CB 3.45Å; I28-L32 WeakPolarHBondContact O-CG 3.43Å; I28-L32 PolarHBondContact O-N 2.82Å; I28-L194 HydrophobicContact CG2-CD1 3.87Å
29M98.5Very high97.8Very high1 Ų143.2 Ų43.21%0.00524%0.237CC..Hα-helixtrans-60.7-42.5177.4-72.1-169.7-60.200112.1F25 G33 V58 L191 L194 T198F25-M29 WeakPolarHBondContact O-CG 3.35Å; F25-M29 PolarHBondContact O-N 2.95Å; M29-G33 PolarHBondContact O-N 3.34Å; M29-V58 HydrophobicContact CB-CB 4.4Å; M29-L191 HydrophobicContact CG-CD2 4.5Å; M29-L194 HydrophobicContact CG-CB 4Å; M29-L194 HydrophobicContact CG-CD1 4.14Å; M29-L194 HydrophobicContact SD-CB 4.12Å; M29-T198 HydrophobicContact CE-CG2 4.05Å; M29-T198 HydrophobicContact SD-CG2 4.41Å
30F98.5Very high97.7Very high46 Ų4643.5 Ų43.520%0.20224%0.238CC..Hα-helixtrans-59.6-50.4175.8177-103.2000112S26 F27 I28 G33 I34 I59 L63S26-F30 VanDerWaalsContact O-CB 3.3Å; S26-F30 WeakPolarHBondContact O-CB 3.32Å; S26-F30 PolarHBondContact O-N 3.34Å; F27-F30 PolarHBondContact O-N 2.96Å; I28-F30 VanDerWaalsContact C-N 3.33Å; I28-F30 PolarHBondContact O-N 3.06Å; F30-G33 PolarHBondContact O-N 2.97Å; F30-I34 HydrophobicContact CD1-CD1 4.04Å; F30-I34 HydrophobicContact CD2-CD1 4.28Å; F30-I34 HydrophobicContact CE1-CD1 3.47Å; F30-I34 VanDerWaalsContact CE1-CD1 3.47Å; F30-I34 HydrophobicContact CE2-CD1 3.75Å; F30-I34 HydrophobicContact CG-CD1 4.43Å; F30-I34 HydrophobicContact CZ-CD1 3.32Å; F30-I34 HydrophobicContact CZ-CG1 4.5Å; F30-I34 WeakPolarHBondContact O-CG1 2.85Å; F30-I34 PolarHBondContact O-N 3.28Å; F30-I59 HydrophobicContact CD2-CB 4.47Å; F30-I59 HydrophobicContact CD2-CG2 3.83Å; F30-I59 HydrophobicContact CE2-CG2 3.71Å; F30-L63 HydrophobicContact CD2-CD1 4.39Å; F30-L63 HydrophobicContact CD2-CD2 3.85Å; F30-L63 HydrophobicContact CD2-CG 3.65Å; F30-L63 HydrophobicContact CE2-CD1 3.79Å; F30-L63 HydrophobicContact CE2-CD2 3.44Å; F30-L63 VanDerWaalsContact CE2-CD2 3.44Å; F30-L63 HydrophobicContact CE2-CG 3.44Å; F30-L63 VanDerWaalsContact CE2-CG 3.44Å; F30-L63 HydrophobicContact CZ-CD2 3.9Å; F30-L63 HydrophobicContact CZ-CG 4.37Å
31A98.5Very high97.6Very high42 Ų4245.3 Ų45.335%0.34724%0.243SC..Hα-helixtrans-66-45.4-178.300000112.5F27 I28 I34 S35F27-A31 WeakPolarHBondContact O-CB 3.42Å; F27-A31 PolarHBondContact O-N 2.79Å; I28-A31 PolarHBondContact O-N 3.24Å; A31-I34 PolarHBondContact O-N 3.47Å; A31-S35 WeakPolarHBondContact O-CB 3.43Å; A31-S35 PolarHBondContact O-N 3.47Å
32L98.5Very high97.5Very high46 Ų4645.9 Ų45.924%0.24124%0.242CC..Hα-helixtrans-65-39.8177.5-69.9179.9000111.7I28 S35 A36 Y187 I190 L191 L194I28-L32 HydrophobicContact CG2-CD1 3.75Å; I28-L32 HydrophobicContact CG2-CG 4.22Å; I28-L32 WeakPolarHBondContact O-CB 3.45Å; I28-L32 WeakPolarHBondContact O-CG 3.43Å; I28-L32 PolarHBondContact O-N 2.82Å; L32-S35 PolarHBondContact O-N 3.46Å; L32-A36 WeakPolarHBondContact O-CB 3.45Å; L32-A36 PolarHBondContact O-N 2.89Å; L32-Y187 HydrophobicContact CD2-CE1 4.12Å; L32-I190 HydrophobicContact CD1-CG2 4Å; L32-L191 HydrophobicContact CB-CD2 3.94Å; L32-L191 HydrophobicContact CD1-CD2 4.39Å; L32-L194 HydrophobicContact CD1-CD1 4.01Å
33G98.5Very high97.2Very high0 Ų045.9 Ų45.90%024%0.242CC..Hα-helixtrans-59.8-48.1174.700000112.4M29 F30 L37M29-G33 PolarHBondContact O-N 3.34Å; F30-G33 PolarHBondContact O-N 2.97Å; G33-L37 VanDerWaalsContact O-CB 3.25Å; G33-L37 WeakPolarHBondContact O-CB 3.49Å; G33-L37 PolarHBondContact O-N 3.24Å
34I98.5Very high96.9Very high73 Ų7347.3 Ų47.337%0.37425%0.25SS..Hα-helixtrans-60.8-49.5176-70.8176.5000110.7F30 A31 A36 L37 D38 I59F30-I34 HydrophobicContact CD1-CD1 4.04Å; F30-I34 HydrophobicContact CD2-CD1 4.28Å; F30-I34 HydrophobicContact CE1-CD1 3.47Å; F30-I34 VanDerWaalsContact CE1-CD1 3.47Å; F30-I34 HydrophobicContact CE2-CD1 3.75Å; F30-I34 HydrophobicContact CG-CD1 4.43Å; F30-I34 HydrophobicContact CZ-CD1 3.32Å; F30-I34 HydrophobicContact CZ-CG1 4.5Å; F30-I34 WeakPolarHBondContact O-CG1 2.85Å; F30-I34 PolarHBondContact O-N 3.28Å; A31-I34 PolarHBondContact O-N 3.47Å; I34-A36 VanDerWaalsContact C-N 3.34Å; I34-A36 PolarHBondContact O-N 2.93Å; I34-L37 PolarHBondContact O-N 3.2Å; I34-D38 VanDerWaalsContact O-CB 3.26Å; I34-D38 WeakPolarHBondContact O-CB 3.29Å; I34-D38 PolarHBondContact O-N 2.97Å; I34-I59 HydrophobicContact CG1-CD1 3.89Å; I34-I59 HydrophobicContact CG1-CG1 3.93Å; I34-I59 HydrophobicContact CG1-CG2 4.38Å
35S97.8Very high96.3Very high51 Ų5146.6 Ų46.636%0.35725%0.246SC..Hα-helixtrans-60.2-43.4-176.9-174.50000112.2A31 L32 T39A31-S35 WeakPolarHBondContact O-CB 3.43Å; A31-S35 PolarHBondContact O-N 3.47Å; L32-S35 PolarHBondContact O-N 3.46Å; S35-T39 WeakPolarHBondContact O-CB 3.4Å; S35-T39 PolarHBondContact O-N 3.29Å; S35-T39 PolarHBondContact O-OG1 3.45Å
36A97.9Very high96Very high0 Ų044.6 Ų44.60%024%0.237CC..Hα-helixtrans-66.3-46.2177.300000111.6L32 I34 T39 L40 F55 Y187L32-A36 WeakPolarHBondContact O-CB 3.45Å; L32-A36 PolarHBondContact O-N 2.89Å; I34-A36 VanDerWaalsContact C-N 3.34Å; I34-A36 PolarHBondContact O-N 2.93Å; A36-T39 PolarHBondContact O-N 3.34Å; A36-L40 PolarHBondContact O-N 3.4Å; A36-F55 HydrophobicContact CB-CD1 3.61Å; A36-F55 HydrophobicContact CB-CD2 4.08Å; A36-F55 HydrophobicContact CB-CE1 3.63Å; A36-F55 HydrophobicContact CB-CE2 4.06Å; A36-F55 HydrophobicContact CB-CG 3.87Å; A36-F55 HydrophobicContact CB-CZ 3.86Å; A36-Y187 HydrophobicContact CB-CD1 3.78Å; A36-Y187 HydrophobicContact CB-CE1 4.42Å; A36-Y187 HydrophobicContact CB-CG 4.18Å
37L96.9Very high95.6Very high43 Ų4344.7 Ų44.723%0.22524%0.238CC..Hα-helixtrans-64.9-46.6-178.7-173.760.2000111.9G33 I34 T39 L40 L41 P51 F55 I59G33-L37 VanDerWaalsContact O-CB 3.25Å; G33-L37 WeakPolarHBondContact O-CB 3.49Å; G33-L37 PolarHBondContact O-N 3.24Å; I34-L37 PolarHBondContact O-N 3.2Å; L37-T39 VanDerWaalsContact C-N 3.3Å; L37-T39 PolarHBondContact O-N 3.48Å; L37-L40 PolarHBondContact O-N 3.06Å; L37-L41 HydrophobicContact CD1-CD1 4Å; L37-L41 HydrophobicContact CD1-CG 4.09Å; L37-L41 HydrophobicContact CD2-CD1 4.48Å; L37-L41 HydrophobicContact CG-CD1 3.8Å; L37-L41 HydrophobicContact CG-CG 4.3Å; L37-L41 WeakPolarHBondContact O-CB 3.29Å; L37-L41 VanDerWaalsContact O-CG 3.28Å; L37-L41 WeakPolarHBondContact O-CG 3.48Å; L37-L41 PolarHBondContact O-N 2.96Å; L37-P51 HydrophobicContact CD1-CB 3.7Å; L37-P51 HydrophobicContact CD1-CG 3.75Å; L37-F55 HydrophobicContact CB-CB 4.19Å; L37-I59 HydrophobicContact CB-CD1 4.42Å; L37-I59 HydrophobicContact CD2-CD1 3.77Å
38D96.7Very high95.3Very high76 Ų7644.6 Ų44.641%0.40624%0.239SC..Hα-helixtrans-60.8-39.6178177.561.4000111.8I34 K42I34-D38 VanDerWaalsContact O-CB 3.26Å; I34-D38 WeakPolarHBondContact O-CB 3.29Å; I34-D38 PolarHBondContact O-N 2.97Å; D38-K42 VanDerWaalsContact O-CG 3.31Å; D38-K42 WeakPolarHBondContact O-CG 3.17Å; D38-K42 PolarHBondContact O-N 2.95Å; D38-K42 WeakPolarHBondContact OD1-CE 3.48Å; D38-K42 IonicContact OD1-NZ 3.84Å; D38-K42 WeakPolarHBondContact OD2-CE 3.48Å; D38-K42 IonicContact OD2-NZ 2.64Å; D38-K42 PolarHBondContact OD2-NZ 3.08Å
39T95.7Very high95Very high31 Ų3142.5 Ų42.519%0.1923%0.229CC..Hα-helixtrans-64.7-42179-59.20000112S35 A36 L37 H43 F143 F183S35-T39 WeakPolarHBondContact O-CB 3.4Å; S35-T39 PolarHBondContact O-N 3.29Å; S35-T39 PolarHBondContact O-OG1 3.45Å; A36-T39 PolarHBondContact O-N 3.34Å; L37-T39 VanDerWaalsContact C-N 3.3Å; L37-T39 PolarHBondContact O-N 3.48Å; T39-H43 PolarHBondContact O-ND1 2.99Å; T39-F143 HydrophobicContact CG2-CE2 4.17Å; T39-F143 HydrophobicContact CG2-CZ 3.73Å; T39-F183 HydrophobicContact CG2-CE1 3.91Å; T39-F183 HydrophobicContact CG2-CE2 4.27Å; T39-F183 HydrophobicContact CG2-CZ 3.7Å
40L94.6Very high94.8Very high6 Ų646.2 Ų46.23%0.03126%0.26CS..Hα-helixtrans-75.1-39.9179.5-67.3177.5000112.5A36 L37 K42 H43 P51 F55 I180 F183 A184A36-L40 PolarHBondContact O-N 3.4Å; L37-L40 PolarHBondContact O-N 3.06Å; L40-K42 PolarHBondContact O-N 3.25Å; L40-H43 PolarHBondContact O-N 3.35Å; L40-P51 HydrophobicContact CB-CG 4.37Å; L40-P51 HydrophobicContact CD1-CB 4.15Å; L40-F55 HydrophobicContact CD1-CD2 4.04Å; L40-F55 HydrophobicContact CD1-CE2 3.56Å; L40-I180 HydrophobicContact CD2-CG2 4.23Å; L40-F183 HydrophobicContact CD2-CD1 4.18Å; L40-F183 HydrophobicContact CD2-CE1 4.36Å; L40-F183 HydrophobicContact CG-CE1 4.3Å; L40-A184 HydrophobicContact CD1-CB 4.41Å
41L94.6Very high94.7Very high90 Ų9045.5 Ų45.547%0.47126%0.26SS..Hα-helixtrans-65-25.3-179.8-71.9177.5000113.2L37 H43 N44 P51L37-L41 HydrophobicContact CD1-CD1 4Å; L37-L41 HydrophobicContact CD1-CG 4.09Å; L37-L41 HydrophobicContact CD2-CD1 4.48Å; L37-L41 HydrophobicContact CG-CD1 3.8Å; L37-L41 HydrophobicContact CG-CG 4.3Å; L37-L41 WeakPolarHBondContact O-CB 3.29Å; L37-L41 VanDerWaalsContact O-CG 3.28Å; L37-L41 WeakPolarHBondContact O-CG 3.48Å; L37-L41 PolarHBondContact O-N 2.96Å; L41-H43 PolarHBondContact O-N 2.93Å; L41-N44 WeakPolarHBondContact O-CB 3.24Å; L41-N44 PolarHBondContact O-N 3.43Å; L41-P51 HydrophobicContact CD2-CG 3.95Å; L41-P51 HydrophobicContact CG-CG 4.4Å
42K93.6Very high94.6Very high94 Ų9444.3 Ų44.341%0.40925%0.249SC..THydrogen-bonded Turntrans-64.6-14.1173.1-78.6170-171.6164.80114.5D38 L40D38-K42 VanDerWaalsContact O-CG 3.31Å; D38-K42 WeakPolarHBondContact O-CG 3.17Å; D38-K42 PolarHBondContact O-N 2.95Å; D38-K42 WeakPolarHBondContact OD1-CE 3.48Å; D38-K42 IonicContact OD1-NZ 3.84Å; D38-K42 WeakPolarHBondContact OD2-CE 3.48Å; D38-K42 IonicContact OD2-NZ 2.64Å; D38-K42 PolarHBondContact OD2-NZ 3.08Å; L40-K42 PolarHBondContact O-N 3.25Å
43H92.5Very high94.6Very high5 Ų545.3 Ų45.32%0.02326%0.263CS..THydrogen-bonded Turntrans-12121.8-175.9-55.297.5000112.3T39 L40 L41 T45 I46 I47 E135T39-H43 PolarHBondContact O-ND1 2.99Å; L40-H43 PolarHBondContact O-N 3.35Å; L41-H43 PolarHBondContact O-N 2.93Å; H43-T45 VanDerWaalsContact C-N 3.31Å; H43-T45 PolarHBondContact O-N 3.5Å; H43-I46 WeakPolarHBondContact O-CG1 3.32Å; H43-I47 HydrophobicContact CB-CD1 3.69Å; H43-I47 HydrophobicContact CB-CG1 4.26Å; H43-I47 WeakPolarHBondContact O-CB 3.29Å; H43-I47 WeakPolarHBondContact O-CG1 3.2Å; H43-I47 PolarHBondContact O-N 3.06Å; H43-E135 VanDerWaalsContact CA-CD 3.41Å; H43-E135 WeakPolarHBondContact CA-OE1 3.17Å; H43-E135 HydrophobicContact CB-CG 4.44Å
44N91.8Very high94.6Very high78 Ų7845.4 Ų45.442%0.41726%0.264SS..Hα-helixtrans-68.8-22.5-172.4-171.655.6000114.1L41 Q48 E135L41-N44 WeakPolarHBondContact O-CB 3.24Å; L41-N44 PolarHBondContact O-N 3.43Å; N44-Q48 WeakPolarHBondContact O-CA 3.22Å; N44-Q48 WeakPolarHBondContact O-CG 3.29Å; N44-Q48 PolarHBondContact O-N 3.03Å; N44-E135 PolarHBondContact N-OE1 3.47Å
45T86.4Confident94.6Very high66 Ų6641.9 Ų41.941%0.40525%0.246SC..Hα-helixtrans-71.8-34-177.4-43.30000112H43 Q48 E135H43-T45 VanDerWaalsContact C-N 3.31Å; H43-T45 PolarHBondContact O-N 3.5Å; T45-Q48 VanDerWaalsContact O-CG 3.29Å; T45-Q48 WeakPolarHBondContact O-CG 3.31Å; T45-Q48 PolarHBondContact O-NE2 3.18Å; T45-E135 WeakPolarHBondContact CA-OE2 3.25Å; T45-E135 WeakPolarHBondContact CB-OE2 3.35Å; T45-E135 PolarHBondContact N-OE1 2.87Å; T45-E135 PolarHBondContact N-OE2 2.86Å; T45-E135 PolarHBondContact OG1-OE1 3.47Å
46I90.8Very high94.6Very high0 Ų041.2 Ų41.20%025%0.247CC..Hα-helixtrans-96.2-34.4179.363.5-173.5000112.6H43 S119 L120 S123 Y132 E135 F136 L139H43-I46 WeakPolarHBondContact O-CG1 3.32Å; I46-S119 PolarHBondContact O-OG 3.5Å; I46-L120 HydrophobicContact CB-CD2 4.43Å; I46-L120 HydrophobicContact CD1-CD2 4.36Å; I46-L120 HydrophobicContact CG1-CD2 4.18Å; I46-S123 WeakPolarHBondContact O-CB 3.34Å; I46-S123 PolarHBondContact O-OG 3.03Å; I46-Y132 HydrophobicContact CG2-CD1 3.77Å; I46-Y132 HydrophobicContact CG2-CE1 4.43Å; I46-Y132 HydrophobicContact CG2-CG 4.39Å; I46-E135 HydrophobicContact CD1-CB 4.17Å; I46-E135 HydrophobicContact CD1-CG 3.94Å; I46-E135 HydrophobicContact CG1-CG 4.16Å; I46-E135 VanDerWaalsContact CG1-OE2 3.32Å; I46-E135 WeakPolarHBondContact CG1-OE2 3.2Å; I46-E135 HydrophobicContact CG2-CB 4.06Å; I46-E135 VanDerWaalsContact CG2-OE2 3.31Å; I46-E135 WeakPolarHBondContact CG2-OE2 3.4Å; I46-E135 PolarHBondContact N-OE2 2.71Å; I46-F136 HydrophobicContact CB-CD2 4.43Å; I46-F136 HydrophobicContact CB-CE2 4.1Å; I46-F136 HydrophobicContact CB-CZ 4.45Å; I46-F136 HydrophobicContact CD1-CD1 4.29Å; I46-F136 HydrophobicContact CD1-CD2 4.39Å; I46-F136 HydrophobicContact CD1-CE1 4.5Å; I46-F136 HydrophobicContact CD1-CG 4.22Å; I46-F136 HydrophobicContact CG2-CD2 3.69Å; I46-F136 HydrophobicContact CG2-CE2 3.71Å; I46-F136 HydrophobicContact CG2-CG 4.48Å; I46-L139 HydrophobicContact CD1-CB 4.13Å; I46-L139 HydrophobicContact CD1-CD2 3.58Å; I46-L139 HydrophobicContact CD1-CG 4.46Å
47I90.7Very high94.6Very high4 Ų443 Ų432%0.02126%0.258CS..Hα-helixtrans-80.3-42.6179.1-63173.6000110.1H43 V49 V116 S119 L120 I180H43-I47 HydrophobicContact CB-CD1 3.69Å; H43-I47 HydrophobicContact CB-CG1 4.26Å; H43-I47 WeakPolarHBondContact O-CB 3.29Å; H43-I47 WeakPolarHBondContact O-CG1 3.2Å; H43-I47 PolarHBondContact O-N 3.06Å; I47-V49 HydrophobicContact CG2-CB 3.76Å; I47-V49 HydrophobicContact CG2-CG2 3.89Å; I47-V49 WeakPolarHBondContact O-CG2 3.35Å; I47-V49 PolarHBondContact O-N 3.18Å; I47-V116 HydrophobicContact CG2-CG2 4.2Å; I47-S119 VanDerWaalsContact C-OG 3.29Å; I47-S119 WeakPolarHBondContact O-CB 3.36Å; I47-S119 PolarHBondContact O-OG 3.14Å; I47-L120 HydrophobicContact CG1-CD2 4.25Å; I47-I180 HydrophobicContact CD1-CD1 4.36Å; I47-I180 HydrophobicContact CD1-CG1 4.45Å; I47-I180 HydrophobicContact CD1-CG2 3.89Å
48Q91.1Very high94.7Very high119 Ų11941 Ų4156%0.55625%0.248SC*.  trans47.420.3179.8-56.1-173.40.700115.5N44 T45N44-Q48 WeakPolarHBondContact O-CA 3.22Å; N44-Q48 WeakPolarHBondContact O-CG 3.29Å; N44-Q48 PolarHBondContact O-N 3.03Å; T45-Q48 VanDerWaalsContact O-CG 3.29Å; T45-Q48 WeakPolarHBondContact O-CG 3.31Å; T45-Q48 PolarHBondContact O-NE2 3.18Å
49V93.3Very high94.8Very high21 Ų2138.8 Ų38.813%0.12724%0.236CC..SBendtrans-109.6131.6178-175.60000107.3I47 Y112 D115 V116I47-V49 HydrophobicContact CG2-CB 3.76Å; I47-V49 HydrophobicContact CG2-CG2 3.89Å; I47-V49 WeakPolarHBondContact O-CG2 3.35Å; I47-V49 PolarHBondContact O-N 3.18Å; V49-Y112 HydrophobicContact CB-CE2 4.36Å; V49-Y112 HydrophobicContact CG1-CD2 3.86Å; V49-Y112 HydrophobicContact CG1-CE2 3.7Å; V49-D115 HydrophobicContact CB-CB 4.48Å; V49-D115 HydrophobicContact CG1-CB 3.68Å; V49-D115 HydrophobicContact CG2-CB 3.89Å; V49-V116 HydrophobicContact CG2-CG2 4.49Å
50A94.5Very high94.9Very high79 Ų7942.7 Ų42.765%0.65325%0.25SS*.PPolyproline II helixtrans-58.5130.6174.300000110Y112A50-Y112 WeakPolarHBondContact O-CE2 3.34Å
51P95.7Very high95.1Very high32 Ų3242.5 Ų42.521%0.20825%0.249CC..PPolyproline II helixtrans-56150.5175.6-26.134.9000111.8L37 L40 L41 A53 F55L37-P51 HydrophobicContact CD1-CB 3.7Å; L37-P51 HydrophobicContact CD1-CG 3.75Å; L40-P51 HydrophobicContact CB-CG 4.37Å; L40-P51 HydrophobicContact CD1-CB 4.15Å; L41-P51 HydrophobicContact CD2-CG 3.95Å; L41-P51 HydrophobicContact CG-CG 4.4Å; P51-A53 PolarHBondContact O-N 3.35Å; P51-F55 HydrophobicContact CB-CD2 4.37Å
52P97.5Very high95.3Very high17 Ų1738.2 Ų38.211%0.1123%0.226CC..PPolyproline II helixtrans-48.9129.1175.3-28.835.6000111.8I54 F55 Y112 A184P52-I54 HydrophobicContact CB-CG2 3.99Å; P52-I54 PolarHBondContact O-N 2.94Å; P52-F55 HydrophobicContact CB-CD2 4.12Å; P52-F55 HydrophobicContact CB-CE2 3.93Å; P52-F55 HydrophobicContact CB-CZ 4.4Å; P52-F55 HydrophobicContact CG-CD2 4.19Å; P52-F55 HydrophobicContact CG-CE2 3.64Å; P52-F55 HydrophobicContact CG-CZ 4.23Å; P52-F55 PolarHBondContact O-N 3.43Å; P52-Y112 HydrophobicContact CG-CD1 3.97Å; P52-Y112 HydrophobicContact CG-CD2 3.89Å; P52-Y112 HydrophobicContact CG-CE1 4.07Å; P52-Y112 HydrophobicContact CG-CE2 4Å; P52-Y112 HydrophobicContact CG-CG 3.88Å; P52-A184 HydrophobicContact CG-CB 4.42Å
53A97.5Very high95.5Very high66 Ų6637.2 Ų37.255%0.54523%0.225SC..Hα-helixtrans-55.1-28.6-174.600000113P51 F55 G56 T57 I101P51-A53 PolarHBondContact O-N 3.35Å; A53-F55 VanDerWaalsContact C-N 3.25Å; A53-F55 PolarHBondContact O-N 2.99Å; A53-G56 PolarHBondContact O-N 3.23Å; A53-T57 PolarHBondContact O-N 3.04Å; A53-T57 VanDerWaalsContact O-N 3.11Å; A53-T57 PolarHBondContact O-OG1 3.33Å; A53-T57 VanDerWaalsContact O-OG1 3.13Å; A53-I101 HydrophobicContact CB-CD1 4.14Å
54I98.5Very high95.8Very high2 Ų238.4 Ų38.41%0.0123%0.233CC..Hα-helixtrans-53.5-41.2177.7-169.2167000112.5P52 G56 T57 V58 I101 A105 L191 I192P52-I54 HydrophobicContact CB-CG2 3.99Å; P52-I54 PolarHBondContact O-N 2.94Å; I54-G56 PolarHBondContact O-N 2.97Å; I54-T57 PolarHBondContact O-N 3.32Å; I54-V58 HydrophobicContact CG1-CG1 3.8Å; I54-V58 WeakPolarHBondContact O-CG1 3.43Å; I54-V58 VanDerWaalsContact O-CG2 3.27Å; I54-V58 WeakPolarHBondContact O-CG2 3.26Å; I54-V58 PolarHBondContact O-N 2.81Å; I54-I101 HydrophobicContact CB-CD1 4.47Å; I54-I101 HydrophobicContact CB-CG1 3.96Å; I54-I101 HydrophobicContact CG1-CG1 3.99Å; I54-A105 HydrophobicContact CB-CB 3.98Å; I54-A105 HydrophobicContact CD1-CB 3.78Å; I54-A105 HydrophobicContact CG1-CB 4.39Å; I54-A105 HydrophobicContact CG2-CB 4.38Å; I54-L191 HydrophobicContact CD1-CB 3.7Å; I54-L191 HydrophobicContact CG1-CB 4.19Å; I54-I192 HydrophobicContact CD1-CG1 3.66Å
55F98.4Very high96.1Very high0 Ų034.7 Ų34.70%021%0.213CC..Hα-helixtrans-61.8-45.2-176.9-57.9-35.8000112A36 L37 L40 P51 P52 A53 V58 I59 L191A36-F55 HydrophobicContact CB-CD1 3.61Å; A36-F55 HydrophobicContact CB-CD2 4.08Å; A36-F55 HydrophobicContact CB-CE1 3.63Å; A36-F55 HydrophobicContact CB-CE2 4.06Å; A36-F55 HydrophobicContact CB-CG 3.87Å; A36-F55 HydrophobicContact CB-CZ 3.86Å; L37-F55 HydrophobicContact CB-CB 4.19Å; L40-F55 HydrophobicContact CD1-CD2 4.04Å; L40-F55 HydrophobicContact CD1-CE2 3.56Å; P51-F55 HydrophobicContact CB-CD2 4.37Å; P52-F55 HydrophobicContact CB-CD2 4.12Å; P52-F55 HydrophobicContact CB-CE2 3.93Å; P52-F55 HydrophobicContact CB-CZ 4.4Å; P52-F55 HydrophobicContact CG-CD2 4.19Å; P52-F55 HydrophobicContact CG-CE2 3.64Å; P52-F55 HydrophobicContact CG-CZ 4.23Å; P52-F55 PolarHBondContact O-N 3.43Å; A53-F55 VanDerWaalsContact C-N 3.25Å; A53-F55 PolarHBondContact O-N 2.99Å; F55-V58 WeakPolarHBondContact O-CG2 3.43Å; F55-I59 WeakPolarHBondContact O-CD1 3.46Å; F55-I59 WeakPolarHBondContact O-CG1 3.4Å; F55-I59 PolarHBondContact O-N 3.37Å; F55-L191 HydrophobicContact CD1-CD1 3.53Å; F55-L191 HydrophobicContact CE1-CD1 3.75Å
56G98Very high96.6Very high37 Ų3733.5 Ų33.538%0.38120%0.204SC..Hα-helixtrans-66.9-42.9175.900000112.7A53 I54 I59 F60A53-G56 PolarHBondContact O-N 3.23Å; I54-G56 PolarHBondContact O-N 2.97Å; G56-I59 PolarHBondContact O-N 2.84Å; G56-F60 PolarHBondContact O-N 3.45Å
57T98.3Very high97Very high38 Ų3838.7 Ų38.723%0.23323%0.23CC..Hα-helixtrans-69.6-35.1-177.7-52.70000112.8A53 I54 I59 F60 T61 I101A53-T57 PolarHBondContact O-N 3.04Å; A53-T57 VanDerWaalsContact O-N 3.11Å; A53-T57 PolarHBondContact O-OG1 3.33Å; A53-T57 VanDerWaalsContact O-OG1 3.13Å; I54-T57 PolarHBondContact O-N 3.32Å; T57-I59 VanDerWaalsContact C-N 3.34Å; T57-F60 PolarHBondContact O-N 2.96Å; T57-T61 HydrophobicContact CG2-CG2 4.2Å; T57-T61 WeakPolarHBondContact O-CG2 3.23Å; T57-T61 PolarHBondContact O-N 3.33Å; T57-T61 PolarHBondContact O-OG1 3.46Å; T57-I101 HydrophobicContact CG2-CB 3.86Å; T57-I101 HydrophobicContact CG2-CD1 4.25Å; T57-I101 HydrophobicContact CG2-CG1 3.91Å; T57-I101 HydrophobicContact CG2-CG2 4.09Å; T57-I101 WeakPolarHBondContact OG1-CD1 3.42Å
58V98.6Very high97.3Very high0 Ų038.8 Ų38.80%023%0.232CC..Hα-helixtrans-71.4-29.1176.8-63.30000112.9M29 I54 F55 T61 G62 L191M29-V58 HydrophobicContact CB-CB 4.4Å; I54-V58 HydrophobicContact CG1-CG1 3.8Å; I54-V58 WeakPolarHBondContact O-CG1 3.43Å; I54-V58 VanDerWaalsContact O-CG2 3.27Å; I54-V58 WeakPolarHBondContact O-CG2 3.26Å; I54-V58 PolarHBondContact O-N 2.81Å; F55-V58 WeakPolarHBondContact O-CG2 3.43Å; V58-T61 WeakPolarHBondContact CA-OG1 3.32Å; V58-T61 PolarHBondContact O-OG1 3.49Å; V58-G62 WeakPolarHBondContact O-CA 3.24Å; V58-G62 PolarHBondContact O-N 3.39Å; V58-L191 HydrophobicContact CB-CD2 4.37Å; V58-L191 HydrophobicContact CG1-CB 4.48Å; V58-L191 HydrophobicContact CG1-CD2 4.34Å; V58-L191 HydrophobicContact CG2-CD1 3.77Å; V58-L191 HydrophobicContact CG2-CD2 3.94Å; V58-L191 HydrophobicContact CG2-CG 4.44Å
59I98.6Very high97.5Very high30 Ų3033.1 Ų33.115%0.15421%0.205CC..Hα-helixtrans-62.3-49.7170.7-65.5166.5000109F30 I34 L37 F55 G56 T57 G62 L63F30-I59 HydrophobicContact CD2-CB 4.47Å; F30-I59 HydrophobicContact CD2-CG2 3.83Å; F30-I59 HydrophobicContact CE2-CG2 3.71Å; I34-I59 HydrophobicContact CG1-CD1 3.89Å; I34-I59 HydrophobicContact CG1-CG1 3.93Å; I34-I59 HydrophobicContact CG1-CG2 4.38Å; L37-I59 HydrophobicContact CB-CD1 4.42Å; L37-I59 HydrophobicContact CD2-CD1 3.77Å; F55-I59 WeakPolarHBondContact O-CD1 3.46Å; F55-I59 WeakPolarHBondContact O-CG1 3.4Å; F55-I59 PolarHBondContact O-N 3.37Å; G56-I59 PolarHBondContact O-N 2.84Å; T57-I59 VanDerWaalsContact C-N 3.34Å; I59-G62 PolarHBondContact O-N 2.98Å; I59-L63 WeakPolarHBondContact O-CG 3.46Å; I59-L63 PolarHBondContact O-N 3.48Å
60F98.4Very high97.6Very high113 Ų11334.5 Ų34.550%0.49622%0.216SC..Hα-helixtrans-63-52.1179.5177.7-102.9000112.5G56 T57 G62 L63 V64 L97G56-F60 PolarHBondContact O-N 3.45Å; T57-F60 PolarHBondContact O-N 2.96Å; F60-G62 VanDerWaalsContact C-N 3.31Å; F60-G62 PolarHBondContact O-N 2.82Å; F60-L63 PolarHBondContact O-N 3.12Å; F60-V64 HydrophobicContact CD1-CG2 4.33Å; F60-V64 HydrophobicContact CE1-CG2 3.89Å; F60-V64 HydrophobicContact CE2-CG2 4.13Å; F60-V64 HydrophobicContact CZ-CG2 3.78Å; F60-V64 WeakPolarHBondContact O-CG2 3.16Å; F60-V64 PolarHBondContact O-N 3.47Å; F60-L97 HydrophobicContact CD1-CD1 4Å; F60-L97 HydrophobicContact CE1-CD1 3.71Å
61T98.2Very high97.7Very high1 Ų132.3 Ų32.31%0.00619%0.194CC..Hα-helixtrans-66.9-31.6-179.653.60000112.4T57 V58 V64 G65 L97 N98T57-T61 HydrophobicContact CG2-CG2 4.2Å; T57-T61 WeakPolarHBondContact O-CG2 3.23Å; T57-T61 PolarHBondContact O-N 3.33Å; T57-T61 PolarHBondContact O-OG1 3.46Å; V58-T61 WeakPolarHBondContact CA-OG1 3.32Å; V58-T61 PolarHBondContact O-OG1 3.49Å; T61-V64 PolarHBondContact O-N 3.07Å; T61-G65 PolarHBondContact O-N 3.07Å; T61-L97 HydrophobicContact CG2-CB 3.5Å; T61-L97 HydrophobicContact CG2-CD1 3.86Å; T61-L97 HydrophobicContact CG2-CG 4.35Å; T61-N98 PolarHBondContact OG1-OD1 2.89Å
62G98.4Very high97.5Very high0 Ų030.9 Ų30.90%019%0.186CC..Hα-helixtrans-60-48.7169.800000112S26 V58 I59 F60 G65 I66S26-G62 WeakPolarHBondContact CB-O 3.33Å; S26-G62 WeakPolarHBondContact O-CA 3.36Å; V58-G62 WeakPolarHBondContact O-CA 3.24Å; V58-G62 PolarHBondContact O-N 3.39Å; I59-G62 PolarHBondContact O-N 2.98Å; F60-G62 VanDerWaalsContact C-N 3.31Å; F60-G62 PolarHBondContact O-N 2.82Å; G62-G65 PolarHBondContact O-N 3.38Å; G62-I66 VanDerWaalsContact O-CG1 3.3Å; G62-I66 WeakPolarHBondContact O-CG1 3.4Å; G62-I66 PolarHBondContact O-N 3.32Å
63L98.3Very high97.2Very high74 Ų7431.9 Ų31.939%0.38719%0.188SC..Hα-helixtrans-61.3-47.3175-73.2174.4000112.4F30 I59 F60 G65 I66 I67F30-L63 HydrophobicContact CD2-CD1 4.39Å; F30-L63 HydrophobicContact CD2-CD2 3.85Å; F30-L63 HydrophobicContact CD2-CG 3.65Å; F30-L63 HydrophobicContact CE2-CD1 3.79Å; F30-L63 HydrophobicContact CE2-CD2 3.44Å; F30-L63 VanDerWaalsContact CE2-CD2 3.44Å; F30-L63 HydrophobicContact CE2-CG 3.44Å; F30-L63 VanDerWaalsContact CE2-CG 3.44Å; F30-L63 HydrophobicContact CZ-CD2 3.9Å; F30-L63 HydrophobicContact CZ-CG 4.37Å; I59-L63 WeakPolarHBondContact O-CG 3.46Å; I59-L63 PolarHBondContact O-N 3.48Å; F60-L63 PolarHBondContact O-N 3.12Å; L63-G65 VanDerWaalsContact C-N 3.29Å; L63-G65 PolarHBondContact O-N 3.3Å; L63-I66 PolarHBondContact O-N 3.34Å; L63-I67 WeakPolarHBondContact O-CG1 3.21Å; L63-I67 PolarHBondContact O-N 3.19Å
64V98.1Very high96.7Very high30 Ų3032.6 Ų32.618%0.18218%0.182CC..Hα-helixtrans-58.7-43.2177.2172.30000110.7F60 T61 I67 A68 A94F60-V64 HydrophobicContact CD1-CG2 4.33Å; F60-V64 HydrophobicContact CE1-CG2 3.89Å; F60-V64 HydrophobicContact CE2-CG2 4.13Å; F60-V64 HydrophobicContact CZ-CG2 3.78Å; F60-V64 WeakPolarHBondContact O-CG2 3.16Å; F60-V64 PolarHBondContact O-N 3.47Å; T61-V64 PolarHBondContact O-N 3.07Å; V64-I67 PolarHBondContact O-N 3.19Å; V64-A68 WeakPolarHBondContact O-CB 3.4Å; V64-A68 PolarHBondContact O-N 3.35Å; V64-A94 HydrophobicContact CG1-CB 4.33Å
65G98.2Very high96Very high0 Ų033.1 Ų33.10%019%0.188CC..Hα-helixtrans-65-40.6178.700000113.5S26 T61 G62 L63 S69S26-G65 WeakPolarHBondContact OG-CA 3.27Å; T61-G65 PolarHBondContact O-N 3.07Å; G62-G65 PolarHBondContact O-N 3.38Å; L63-G65 VanDerWaalsContact C-N 3.29Å; L63-G65 PolarHBondContact O-N 3.3Å; G65-S69 VanDerWaalsContact O-CB 3.24Å; G65-S69 WeakPolarHBondContact O-CB 3.23Å; G65-S69 PolarHBondContact O-N 3.46Å; G65-S69 PolarHBondContact O-OG 3.11Å
66I98.2Very high95.3Very high40 Ų4035.5 Ų35.521%0.20520%0.201CC..Hα-helixtrans-61.4-48.7174.1-68.5163.3000110.2F27 G62 L63 S70F27-I66 HydrophobicContact CB-CD1 4.36Å; F27-I66 HydrophobicContact CD2-CD1 4.43Å; G62-I66 VanDerWaalsContact O-CG1 3.3Å; G62-I66 WeakPolarHBondContact O-CG1 3.4Å; G62-I66 PolarHBondContact O-N 3.32Å; L63-I66 PolarHBondContact O-N 3.34Å; I66-S70 VanDerWaalsContact O-CB 3.29Å; I66-S70 WeakPolarHBondContact O-CB 3.28Å; I66-S70 PolarHBondContact O-N 3.05Å; I66-S70 PolarHBondContact O-OG 3.45Å
67I97.8Very high94.5Very high109 Ų10942.8 Ų42.856%0.55922%0.217SC*.Hα-helixtrans-64.1-51-179.5-65.9166.9000110.3L63 V64 S69 S70 V71L63-I67 WeakPolarHBondContact O-CG1 3.21Å; L63-I67 PolarHBondContact O-N 3.19Å; V64-I67 PolarHBondContact O-N 3.19Å; I67-S69 VanDerWaalsContact C-N 3.33Å; I67-S69 PolarHBondContact O-N 3.34Å; I67-S70 PolarHBondContact O-N 2.9Å; I67-V71 HydrophobicContact CG2-CG2 4.38Å; I67-V71 VanDerWaalsContact O-CG2 3.3Å; I67-V71 WeakPolarHBondContact O-CG2 3.47Å; I67-V71 PolarHBondContact O-N 3.21Å
68A97.4Very high93.7Very high6 Ų649.9 Ų49.95%0.0524%0.239CC..Hα-helixtrans-59.3-43.6-178.200000111.7V64 V71 G72 H87 L91V64-A68 WeakPolarHBondContact O-CB 3.4Å; V64-A68 PolarHBondContact O-N 3.35Å; A68-V71 PolarHBondContact O-N 2.97Å; A68-G72 PolarHBondContact O-N 2.89Å; A68-H87 PolarHBondContact O-ND1 3.02Å; A68-L91 HydrophobicContact CB-CD2 4.15Å; A68-L91 HydrophobicContact CB-CG 4.31Å
69S96.8Very high92.7Very high0 Ų058.8 Ų58.80%028%0.278CS..Hα-helixtrans-70.1-36.9178.9-53.10000112F22 I23 G65 I67 G72 F73F22-S69 WeakPolarHBondContact CB-OG 3.34Å; I23-S69 VanDerWaalsContact CG1-CB 3.47Å; G65-S69 VanDerWaalsContact O-CB 3.24Å; G65-S69 WeakPolarHBondContact O-CB 3.23Å; G65-S69 PolarHBondContact O-N 3.46Å; G65-S69 PolarHBondContact O-OG 3.11Å; I67-S69 VanDerWaalsContact C-N 3.33Å; I67-S69 PolarHBondContact O-N 3.34Å; S69-G72 WeakPolarHBondContact O-CA 3.15Å; S69-G72 PolarHBondContact O-N 3.43Å; S69-G72 VanDerWaalsContact O-N 3.11Å; S69-F73 VanDerWaalsContact O-CD2 3.26Å; S69-F73 WeakPolarHBondContact O-CD2 3.45Å; S69-F73 PolarHBondContact O-N 3.03Å
70S95.4Very high91.9Very high51 Ų5162.6 Ų62.636%0.35730%0.296SS..Hα-helixtrans-63.4-43.3174-59.80000112I66 I67 G72 F73 L74I66-S70 VanDerWaalsContact O-CB 3.29Å; I66-S70 WeakPolarHBondContact O-CB 3.28Å; I66-S70 PolarHBondContact O-N 3.05Å; I66-S70 PolarHBondContact O-OG 3.45Å; I67-S70 PolarHBondContact O-N 2.9Å; S70-G72 PolarHBondContact O-N 2.94Å; S70-F73 PolarHBondContact O-N 2.88Å; S70-L74 PolarHBondContact O-N 3.01Å
71V94.6Very high91.1Very high33 Ų3365.1 Ų65.120%0.231%0.307CS..Hα-helixtrans-61.6-32.2172.8173.20000111.1I67 A68 F73 L74 G75 I83 V86 H87I67-V71 HydrophobicContact CG2-CG2 4.38Å; I67-V71 VanDerWaalsContact O-CG2 3.3Å; I67-V71 WeakPolarHBondContact O-CG2 3.47Å; I67-V71 PolarHBondContact O-N 3.21Å; A68-V71 PolarHBondContact O-N 2.97Å; V71-F73 PolarHBondContact O-N 2.74Å; V71-L74 WeakPolarHBondContact O-CB 3.4Å; V71-L74 PolarHBondContact O-N 3.43Å; V71-G75 PolarHBondContact O-N 3.36Å; V71-I83 HydrophobicContact CG1-CG2 3.61Å; V71-I83 WeakPolarHBondContact O-CG2 3.32Å; V71-V86 HydrophobicContact CG1-CB 4.47Å; V71-V86 HydrophobicContact CG1-CG1 4.18Å; V71-H87 HydrophobicContact CG1-CB 4.4Å
72G92.3Very high90.6Very high2 Ų271.6 Ų71.62%0.02134%0.339CS..Hα-helixtrans-56.2-46.1172.600000113F15 A68 S69 S70 L74 G75 L76F15-G72 WeakPolarHBondContact CZ-O 3.3Å; A68-G72 PolarHBondContact O-N 2.89Å; S69-G72 WeakPolarHBondContact O-CA 3.15Å; S69-G72 PolarHBondContact O-N 3.43Å; S69-G72 VanDerWaalsContact O-N 3.11Å; S70-G72 PolarHBondContact O-N 2.94Å; G72-L74 PolarHBondContact O-N 3.42Å; G72-G75 PolarHBondContact O-N 3.21Å; G72-L76 PolarHBondContact O-N 3.48Å
73F90.8Very high90.2Very high37 Ų3773.4 Ų73.416%0.16235%0.348CS..Hα-helixtrans-62.5-41175-68-71.9000112.5I16 N19 I23 S69 S70 V71 G75 L76 W77I16-F73 HydrophobicContact CB-CE1 4.44Å; I16-F73 HydrophobicContact CG1-CE1 4.4Å; I16-F73 HydrophobicContact CG2-CE1 4.19Å; N19-F73 HydrophobicContact CB-CE1 4.24Å; N19-F73 HydrophobicContact CB-CE2 3.83Å; N19-F73 HydrophobicContact CB-CZ 3.62Å; I23-F73 HydrophobicContact CD1-CD2 4.26Å; I23-F73 HydrophobicContact CD1-CE2 3.66Å; S69-F73 VanDerWaalsContact O-CD2 3.26Å; S69-F73 WeakPolarHBondContact O-CD2 3.45Å; S69-F73 PolarHBondContact O-N 3.03Å; S70-F73 PolarHBondContact O-N 2.88Å; V71-F73 PolarHBondContact O-N 2.74Å; F73-G75 VanDerWaalsContact C-N 3.28Å; F73-G75 PolarHBondContact O-N 2.79Å; F73-L76 WeakPolarHBondContact O-CB 3.36Å; F73-L76 PolarHBondContact O-N 3.37Å; F73-W77 PolarHBondContact O-N 2.98Å
74L88.3Confident89.7Confident82 Ų8272 Ų7243%0.42935%0.348SS..Hα-helixtrans-62.8-36.5174.9-61178.5000112S70 V71 G72 W77 R78 I83S70-L74 PolarHBondContact O-N 3.01Å; V71-L74 WeakPolarHBondContact O-CB 3.4Å; V71-L74 PolarHBondContact O-N 3.43Å; G72-L74 PolarHBondContact O-N 3.42Å; L74-W77 HydrophobicContact CD2-CE3 3.97Å; L74-W77 HydrophobicContact CD2-CZ3 4.01Å; L74-W77 PolarHBondContact O-N 3.06Å; L74-R78 PolarHBondContact O-N 3.48Å; L74-I83 HydrophobicContact CB-CG2 4.45Å
75G83.3Confident89.3Confident12 Ų1275.7 Ų75.712%0.12436%0.361CS..Hα-helixtrans-63.9-40.4175.800000112.4V71 G72 F73 W77 K79 I83V71-G75 PolarHBondContact O-N 3.36Å; G72-G75 PolarHBondContact O-N 3.21Å; F73-G75 VanDerWaalsContact C-N 3.28Å; F73-G75 PolarHBondContact O-N 2.79Å; G75-W77 VanDerWaalsContact C-N 3.34Å; G75-W77 PolarHBondContact O-N 3.02Å; G75-K79 WeakPolarHBondContact O-CA 3.34Å; G75-K79 PolarHBondContact O-N 3.37Å; G75-I83 VanDerWaalsContact CA-CG2 3.41Å
76L84.1Confident89.2Confident51 Ų5179.8 Ų79.827%0.26739%0.386SS..Hα-helixtrans-62.1-40.4175.1-174.868.9000111.9T12 F15 I16 G72 F73T12-L76 HydrophobicContact CG2-CD1 4Å; T12-L76 HydrophobicContact CG2-CD2 3.99Å; F15-L76 HydrophobicContact CD1-CD1 4.48Å; F15-L76 HydrophobicContact CD1-CD2 4.19Å; F15-L76 HydrophobicContact CE1-CB 4.06Å; F15-L76 HydrophobicContact CE1-CD2 4.41Å; I16-L76 HydrophobicContact CD1-CD2 3.94Å; I16-L76 HydrophobicContact CG1-CD2 3.77Å; G72-L76 PolarHBondContact O-N 3.48Å; F73-L76 WeakPolarHBondContact O-CB 3.36Å; F73-L76 PolarHBondContact O-N 3.37Å
77W79.8Confident89Confident189 Ų18978 Ų7872%0.71638%0.377SS*.Hα-helixtrans-75.4-45.8-179.3-64-21.3000113.5F73 L74 G75F73-W77 PolarHBondContact O-N 2.98Å; L74-W77 HydrophobicContact CD2-CE3 3.97Å; L74-W77 HydrophobicContact CD2-CZ3 4.01Å; L74-W77 PolarHBondContact O-N 3.06Å; G75-W77 VanDerWaalsContact C-N 3.34Å; G75-W77 PolarHBondContact O-N 3.02Å
78R83.3Confident88.9Confident188 Ų18874 Ų7471%0.70936%0.356SS*.Hα-helixtrans-84.2-13.4-176-67.5-163.7176-146.61.2113.9L74 M80 I83L74-R78 PolarHBondContact O-N 3.48Å; R78-M80 HydrophobicContact CB-CG 3.9Å; R78-M80 PolarHBondContact O-N 2.92Å; R78-I83 HydrophobicContact CB-CD1 4.06Å; R78-I83 HydrophobicContact CG-CD1 4.49Å
79K76.5Confident88.8Confident187 Ų18778.8 Ų78.881%0.81338%0.379SS*.  trans51.527.2-176.5-58.7-176.2-179.8179.70114G75G75-K79 WeakPolarHBondContact O-CA 3.34Å; G75-K79 PolarHBondContact O-N 3.37Å
80M81.3Confident88.8Confident110 Ų11079.4 Ų79.454%0.54239%0.386SS..  trans-88.3120.3-179.2-66.5-67.6-80.200110.2R78 M82 I83 A84R78-M80 HydrophobicContact CB-CG 3.9Å; R78-M80 PolarHBondContact O-N 2.92Å; M80-M82 PolarHBondContact O-N 2.95Å; M80-I83 HydrophobicContact CB-CB 4.41Å; M80-I83 HydrophobicContact CB-CD1 3.9Å; M80-I83 HydrophobicContact CB-CG1 3.91Å; M80-I83 HydrophobicContact CG-CD1 4.27Å; M80-I83 PolarHBondContact O-N 3.47Å; M80-A84 PolarHBondContact O-N 2.88Å
81K82.6Confident88.9Confident165 Ų16577 Ų7772%0.71737%0.369SS*.Hα-helixtrans-51.7-41178.6-69.2-174.9176.5-173.20112.4I83 A84 F85K81-I83 VanDerWaalsContact C-N 3.34Å; K81-I83 PolarHBondContact O-N 3.23Å; K81-A84 WeakPolarHBondContact O-CB 3.29Å; K81-A84 PolarHBondContact O-N 3.41Å; K81-F85 HydrophobicContact CB-CE2 4.47Å; K81-F85 WeakPolarHBondContact O-CD2 3.36Å; K81-F85 PolarHBondContact O-N 2.81Å
82M87.9Confident89.1Confident137 Ų13776.6 Ų76.668%0.67537%0.372SS*.Hα-helixtrans-59.8-39.4179-67.4-57.8-69.500113.3M80 F85 V86M80-M82 PolarHBondContact O-N 2.95Å; M82-F85 PolarHBondContact O-N 3.32Å; M82-V86 WeakPolarHBondContact O-CG2 3.38Å; M82-V86 PolarHBondContact O-N 3.35Å
83I89.1Confident89.4Confident39 Ų3980.5 Ų80.520%0.239%0.391CS..Hα-helixtrans-69.2-39179.9-59178.5000110.3V71 L74 G75 R78 M80 K81 F85 V86 H87V71-I83 HydrophobicContact CG1-CG2 3.61Å; V71-I83 WeakPolarHBondContact O-CG2 3.32Å; L74-I83 HydrophobicContact CB-CG2 4.45Å; G75-I83 VanDerWaalsContact CA-CG2 3.41Å; R78-I83 HydrophobicContact CB-CD1 4.06Å; R78-I83 HydrophobicContact CG-CD1 4.49Å; M80-I83 HydrophobicContact CB-CB 4.41Å; M80-I83 HydrophobicContact CB-CD1 3.9Å; M80-I83 HydrophobicContact CB-CG1 3.91Å; M80-I83 HydrophobicContact CG-CD1 4.27Å; M80-I83 PolarHBondContact O-N 3.47Å; K81-I83 VanDerWaalsContact C-N 3.34Å; K81-I83 PolarHBondContact O-N 3.23Å; I83-F85 VanDerWaalsContact C-N 3.34Å; I83-F85 PolarHBondContact O-N 2.75Å; I83-V86 PolarHBondContact O-N 3.06Å; I83-H87 WeakPolarHBondContact O-CB 3.3Å; I83-H87 PolarHBondContact O-N 2.89Å
84A87.8Confident89.7Confident45 Ų4578.8 Ų78.837%0.37238%0.384SS..Hα-helixtrans-62-41.1174.400000111.8M80 K81 H87 M88M80-A84 PolarHBondContact O-N 2.88Å; K81-A84 WeakPolarHBondContact O-CB 3.29Å; K81-A84 PolarHBondContact O-N 3.41Å; A84-H87 WeakPolarHBondContact O-CB 3.3Å; A84-H87 PolarHBondContact O-N 3.49Å; A84-M88 WeakPolarHBondContact O-CB 3.33Å; A84-M88 WeakPolarHBondContact O-CG 3.33Å; A84-M88 PolarHBondContact O-N 3.02Å
85F91.1Very high90.2Very high107 Ų10775.5 Ų75.547%0.46937%0.368SS..Hα-helixtrans-63.9-44.3175-79-66.8000112.9K81 M82 I83 H87 M88 I89K81-F85 HydrophobicContact CB-CE2 4.47Å; K81-F85 WeakPolarHBondContact O-CD2 3.36Å; K81-F85 PolarHBondContact O-N 2.81Å; M82-F85 PolarHBondContact O-N 3.32Å; I83-F85 VanDerWaalsContact C-N 3.34Å; I83-F85 PolarHBondContact O-N 2.75Å; F85-H87 VanDerWaalsContact C-N 3.32Å; F85-H87 PolarHBondContact O-N 3.2Å; F85-M88 PolarHBondContact O-N 2.93Å; F85-I89 WeakPolarHBondContact O-CB 3.3Å; F85-I89 VanDerWaalsContact O-CG1 3.28Å; F85-I89 WeakPolarHBondContact O-CG1 3.4Å; F85-I89 PolarHBondContact O-N 3.39Å
86V94.1Very high90.9Very high85 Ų8581.5 Ų81.552%0.51539%0.39SS..Hα-helixtrans-59.9-43.9176.71730000111.2V71 M82 I83 I89 G90V71-V86 HydrophobicContact CG1-CB 4.47Å; V71-V86 HydrophobicContact CG1-CG1 4.18Å; M82-V86 WeakPolarHBondContact O-CG2 3.38Å; M82-V86 PolarHBondContact O-N 3.35Å; I83-V86 PolarHBondContact O-N 3.06Å; V86-I89 PolarHBondContact O-N 3.38Å; V86-G90 PolarHBondContact O-N 3.06Å
87H95Very high91.6Very high4 Ų481.4 Ų81.42%0.01939%0.39CS..Hα-helixtrans-57-50174.1165.467.4000112.1N19 A68 V71 I83 A84 F85 G90 L91 Y205N19-H87 PolarHBondContact OD1-CE1 3.39Å; A68-H87 PolarHBondContact O-ND1 3.02Å; V71-H87 HydrophobicContact CG1-CB 4.4Å; I83-H87 WeakPolarHBondContact O-CB 3.3Å; I83-H87 PolarHBondContact O-N 2.89Å; A84-H87 WeakPolarHBondContact O-CB 3.3Å; A84-H87 PolarHBondContact O-N 3.49Å; F85-H87 VanDerWaalsContact C-N 3.32Å; F85-H87 PolarHBondContact O-N 3.2Å; H87-G90 PolarHBondContact O-N 3.49Å; H87-L91 WeakPolarHBondContact CE1-CD1 3.34Å; H87-L91 PolarHBondContact O-N 3.39Å; H87-Y205 AromaticContact NE2-CE1 3.4Å; H87-Y205 WeakPolarHBondContact NE2-CE1 3.46Å; H87-Y205 AromaticContact NE2-CZ 3.54Å; H87-Y205 PolarHBondContact NE2-OH 3.27Å
88M95Very high92.5Very high25 Ų2572.4 Ų72.412%0.12336%0.356CS..Hα-helixtrans-64-42-179.5-69.8-69.8-67.800112.6A84 F85 G92 Y205 L206 S209 I210A84-M88 WeakPolarHBondContact O-CB 3.33Å; A84-M88 WeakPolarHBondContact O-CG 3.33Å; A84-M88 PolarHBondContact O-N 3.02Å; F85-M88 PolarHBondContact O-N 2.93Å; M88-G92 PolarHBondContact O-N 3.07Å; M88-Y205 HydrophobicContact SD-CE1 4.22Å; M88-L206 HydrophobicContact CB-CD2 4.31Å; M88-L206 HydrophobicContact CE-CB 4.23Å; M88-L206 HydrophobicContact CE-CD2 3.33Å; M88-L206 HydrophobicContact CE-CG 4.38Å; M88-L206 HydrophobicContact SD-CD2 3.51Å; M88-L206 VanDerWaalsContact SD-CD2 3.51Å; M88-S209 VanDerWaalsContact CE-CB 3.5Å; M88-I210 HydrophobicContact CE-CD1 4.4Å; M88-I210 HydrophobicContact CE-CG1 3.84Å
89I96.5Very high93.2Very high105 Ų10566.8 Ų66.854%0.53834%0.339SS..Hα-helixtrans-64.4-45.5176.8-69166.9000110.3F85 V86 L91 G92 I93F85-I89 WeakPolarHBondContact O-CB 3.3Å; F85-I89 VanDerWaalsContact O-CG1 3.28Å; F85-I89 WeakPolarHBondContact O-CG1 3.4Å; F85-I89 PolarHBondContact O-N 3.39Å; V86-I89 PolarHBondContact O-N 3.38Å; I89-L91 PolarHBondContact O-N 2.86Å; I89-G92 PolarHBondContact O-N 2.98Å; I89-G92 VanDerWaalsContact O-N 3.16Å; I89-I93 HydrophobicContact CG2-CD1 3.95Å; I89-I93 WeakPolarHBondContact O-CG1 3.41Å; I89-I93 PolarHBondContact O-N 3.38Å
90G96.9Very high94.2Very high13 Ų1360.6 Ų60.613%0.13432%0.319CS..Hα-helixtrans-60.4-45.5178.500000112.7V86 H87 G92 I93 A94V86-G90 PolarHBondContact O-N 3.06Å; H87-G90 PolarHBondContact O-N 3.49Å; G90-G92 VanDerWaalsContact C-N 3.34Å; G90-I93 PolarHBondContact O-N 2.74Å; G90-A94 PolarHBondContact O-N 3.45Å
91L97.5Very high95.1Very high0 Ų056.1 Ų56.10%030%0.297CS..Hα-helixtrans-64.6-37.3173.8-72.6-173.4000112.4F22 A68 H87 I89 A94 T95 Q202 Y205 L206F22-L91 HydrophobicContact CD2-CD1 4.08Å; F22-L91 HydrophobicContact CD2-CD2 4.21Å; F22-L91 HydrophobicContact CE2-CD1 3.92Å; A68-L91 HydrophobicContact CB-CD2 4.15Å; A68-L91 HydrophobicContact CB-CG 4.31Å; H87-L91 WeakPolarHBondContact CE1-CD1 3.34Å; H87-L91 PolarHBondContact O-N 3.39Å; I89-L91 PolarHBondContact O-N 2.86Å; L91-A94 PolarHBondContact O-N 2.92Å; L91-T95 WeakPolarHBondContact O-CB 3.36Å; L91-T95 PolarHBondContact O-N 2.71Å; L91-T95 PolarHBondContact O-OG1 2.98Å; L91-Q202 HydrophobicContact CD2-CG 4.48Å; L91-Y205 HydrophobicContact CD1-CD1 3.84Å; L91-Y205 HydrophobicContact CD1-CE1 3.58Å; L91-L206 HydrophobicContact CB-CD1 4.43Å; L91-L206 HydrophobicContact CB-CD2 4.05Å
92G98Very high95.8Very high26 Ų2648.2 Ų48.227%0.26826%0.263SS..Hα-helixtrans-61.6-44.9175.800000112.6M88 I89 G90 T95 F96M88-G92 PolarHBondContact O-N 3.07Å; I89-G92 PolarHBondContact O-N 2.98Å; I89-G92 VanDerWaalsContact O-N 3.16Å; G90-G92 VanDerWaalsContact C-N 3.34Å; G92-T95 PolarHBondContact O-N 3.34Å; G92-F96 WeakPolarHBondContact O-CB 3.4Å; G92-F96 PolarHBondContact O-N 3.16Å
93I98Very high96.3Very high83 Ų8346.5 Ų46.543%0.42626%0.255SS..Hα-helixtrans-61.9-47.6175.2-67.5167.5000110.5I89 G90 T95 F96 L97I89-I93 HydrophobicContact CG2-CD1 3.95Å; I89-I93 WeakPolarHBondContact O-CG1 3.41Å; I89-I93 PolarHBondContact O-N 3.38Å; G90-I93 PolarHBondContact O-N 2.74Å; I93-T95 VanDerWaalsContact C-N 3.35Å; I93-T95 PolarHBondContact O-N 2.91Å; I93-F96 PolarHBondContact O-N 3.46Å; I93-L97 HydrophobicContact CG2-CD1 3.88Å; I93-L97 HydrophobicContact CG2-CG 4.42Å; I93-L97 WeakPolarHBondContact O-CG 3.41Å; I93-L97 PolarHBondContact O-N 3.28Å
94A98Very high96.8Very high1 Ų146.9 Ų46.91%0.00826%0.264CS..Hα-helixtrans-60.1-44.217800000112V64 G90 L91 L97 N98V64-A94 HydrophobicContact CG1-CB 4.33Å; G90-A94 PolarHBondContact O-N 3.45Å; L91-A94 PolarHBondContact O-N 2.92Å; A94-L97 PolarHBondContact O-N 3.12Å; A94-N98 VanDerWaalsContact O-CB 3.3Å; A94-N98 WeakPolarHBondContact O-CB 3.43Å; A94-N98 VanDerWaalsContact O-CG 3.27Å; A94-N98 PolarHBondContact O-N 3.4Å; A94-N98 PolarHBondContact O-ND2 3.46Å
95T98.1Very high97.3Very high14 Ų1445.1 Ų45.19%0.08625%0.249CC..Hα-helixtrans-59.3-49.5177.5-57.90000111L91 G92 I93 N98 I99 A199 Q202L91-T95 WeakPolarHBondContact O-CB 3.36Å; L91-T95 PolarHBondContact O-N 2.71Å; L91-T95 PolarHBondContact O-OG1 2.98Å; G92-T95 PolarHBondContact O-N 3.34Å; I93-T95 VanDerWaalsContact C-N 3.35Å; I93-T95 PolarHBondContact O-N 2.91Å; T95-N98 PolarHBondContact O-N 3.44Å; T95-I99 HydrophobicContact CG2-CD1 4.1Å; T95-I99 WeakPolarHBondContact O-CG1 3.46Å; T95-I99 PolarHBondContact O-N 3.46Å; T95-I99 VanDerWaalsContact O-N 3.12Å; T95-A199 HydrophobicContact CG2-CB 4.13Å; T95-Q202 VanDerWaalsContact OG1-CB 3.22Å; T95-Q202 WeakPolarHBondContact OG1-CB 3.37Å; T95-Q202 PolarHBondContact OG1-OE1 3.38Å; T95-Q202 VanDerWaalsContact OG1-OE1 3.06Å
96F98.3Very high97.6Very high137 Ų13744 Ų4460%0.60125%0.251SS*.Hα-helixtrans-61-49.4-179.4176.2-105.3000111.7G92 I93 N98 I99 C100G92-F96 WeakPolarHBondContact O-CB 3.4Å; G92-F96 PolarHBondContact O-N 3.16Å; I93-F96 PolarHBondContact O-N 3.46Å; F96-N98 PolarHBondContact O-N 3.29Å; F96-I99 PolarHBondContact O-N 2.96Å; F96-C100 PolarHBondContact O-N 3.02Å; F96-C100 PolarHBondContact O-SG 3.31Å; F96-C100 VanDerWaalsContact O-SG 3.37Å
97L98.5Very high97.8Very high49 Ų4943.8 Ų43.826%0.25726%0.259SS..Hα-helixtrans-63.3-39.9179.3-69.8175.7000112.3F60 T61 I93 A94 I99 C100 I101F60-L97 HydrophobicContact CD1-CD1 4Å; F60-L97 HydrophobicContact CE1-CD1 3.71Å; T61-L97 HydrophobicContact CG2-CB 3.5Å; T61-L97 HydrophobicContact CG2-CD1 3.86Å; T61-L97 HydrophobicContact CG2-CG 4.35Å; I93-L97 HydrophobicContact CG2-CD1 3.88Å; I93-L97 HydrophobicContact CG2-CG 4.42Å; I93-L97 WeakPolarHBondContact O-CG 3.41Å; I93-L97 PolarHBondContact O-N 3.28Å; A94-L97 PolarHBondContact O-N 3.12Å; L97-I99 VanDerWaalsContact C-N 3.34Å; L97-I99 PolarHBondContact O-N 3.42Å; L97-C100 PolarHBondContact O-N 3.38Å; L97-I101 WeakPolarHBondContact O-CB 3.4Å; L97-I101 VanDerWaalsContact O-CG2 3.26Å; L97-I101 WeakPolarHBondContact O-CG2 3.44Å; L97-I101 PolarHBondContact O-N 2.97Å
98N98.5Very high97.9Very high1 Ų147.1 Ų47.11%0.00528%0.279CS..Hα-helixtrans-61.4-40.5176.8-81.2-20.2000112.4T61 A94 T95 F96 A102 C195 T198 A199T61-N98 PolarHBondContact OG1-OD1 2.89Å; A94-N98 VanDerWaalsContact O-CB 3.3Å; A94-N98 WeakPolarHBondContact O-CB 3.43Å; A94-N98 VanDerWaalsContact O-CG 3.27Å; A94-N98 PolarHBondContact O-N 3.4Å; A94-N98 PolarHBondContact O-ND2 3.46Å; T95-N98 PolarHBondContact O-N 3.44Å; F96-N98 PolarHBondContact O-N 3.29Å; N98-A102 WeakPolarHBondContact O-CB 3.42Å; N98-A102 PolarHBondContact O-N 2.84Å; N98-C195 HydrophobicContact CB-CB 4.06Å; N98-T198 PolarHBondContact ND2-OG1 3.25Å; N98-A199 HydrophobicContact CB-CB 4.38Å
99I98.5Very high97.9Very high70 Ų7047.8 Ų47.836%0.35928%0.282SS..Hα-helixtrans-65.7-50.1175.8-66.2166.5000110.1T95 F96 L97 I101 A102 I103 A199T95-I99 HydrophobicContact CG2-CD1 4.1Å; T95-I99 WeakPolarHBondContact O-CG1 3.46Å; T95-I99 PolarHBondContact O-N 3.46Å; T95-I99 VanDerWaalsContact O-N 3.12Å; F96-I99 PolarHBondContact O-N 2.96Å; L97-I99 VanDerWaalsContact C-N 3.34Å; L97-I99 PolarHBondContact O-N 3.42Å; I99-I101 PolarHBondContact O-N 3.3Å; I99-A102 PolarHBondContact O-N 3.48Å; I99-I103 HydrophobicContact CG2-CD1 3.82Å; I99-I103 WeakPolarHBondContact O-CG1 3.18Å; I99-I103 PolarHBondContact O-N 3.04Å; I99-I103 VanDerWaalsContact O-N 3.14Å; I99-A199 HydrophobicContact CD1-CB 4.22Å; I99-A199 HydrophobicContact CG1-CB 3.7Å
100C98.5Very high97.8Very high57 Ų5748.7 Ų48.739%0.38529%0.288SS..Hα-helixtrans-59.1-47-178.9-69.30000111.9F96 L97 I103 A104F96-C100 PolarHBondContact O-N 3.02Å; F96-C100 PolarHBondContact O-SG 3.31Å; F96-C100 VanDerWaalsContact O-SG 3.37Å; L97-C100 PolarHBondContact O-N 3.38Å; C100-I103 PolarHBondContact O-N 3.42Å; C100-A104 WeakPolarHBondContact O-CB 3.32Å; C100-A104 PolarHBondContact O-N 3.11Å
101I98.6Very high97.8Very high15 Ų1553.3 Ų53.38%0.07731%0.306CS..Hα-helixtrans-72-35.9-177.2-164.765.1000112.6A53 I54 T57 L97 I99 I103 A104 A105A53-I101 HydrophobicContact CB-CD1 4.14Å; I54-I101 HydrophobicContact CB-CD1 4.47Å; I54-I101 HydrophobicContact CB-CG1 3.96Å; I54-I101 HydrophobicContact CG1-CG1 3.99Å; T57-I101 HydrophobicContact CG2-CB 3.86Å; T57-I101 HydrophobicContact CG2-CD1 4.25Å; T57-I101 HydrophobicContact CG2-CG1 3.91Å; T57-I101 HydrophobicContact CG2-CG2 4.09Å; T57-I101 WeakPolarHBondContact OG1-CD1 3.42Å; L97-I101 WeakPolarHBondContact O-CB 3.4Å; L97-I101 VanDerWaalsContact O-CG2 3.26Å; L97-I101 WeakPolarHBondContact O-CG2 3.44Å; L97-I101 PolarHBondContact O-N 2.97Å; I99-I101 PolarHBondContact O-N 3.3Å; I101-I103 VanDerWaalsContact C-N 3.33Å; I101-I103 PolarHBondContact O-N 3.32Å; I101-A104 PolarHBondContact O-N 2.82Å; I101-A105 WeakPolarHBondContact O-CB 3.38Å; I101-A105 PolarHBondContact O-N 2.95Å
102A98.6Very high97.8Very high0 Ų054.3 Ų54.30%031%0.31CS..Hα-helixtrans-62.9-42.7176.900000111.1N98 I99 V106 I192 C195 F196N98-A102 WeakPolarHBondContact O-CB 3.42Å; N98-A102 PolarHBondContact O-N 2.84Å; I99-A102 PolarHBondContact O-N 3.48Å; A102-V106 WeakPolarHBondContact O-CG2 3.18Å; A102-V106 PolarHBondContact O-N 3.22Å; A102-I192 HydrophobicContact CB-CG2 4.35Å; A102-C195 HydrophobicContact CB-CB 3.9Å; A102-F196 HydrophobicContact CB-CD1 4.31Å; A102-F196 HydrophobicContact CB-CD2 3.94Å; A102-F196 HydrophobicContact CB-CE1 3.97Å; A102-F196 HydrophobicContact CB-CE2 3.58Å; A102-F196 HydrophobicContact CB-CG 4.3Å; A102-F196 HydrophobicContact CB-CZ 3.59Å
103I98.4Very high97.7Very high101 Ų10154.6 Ų54.652%0.51831%0.31SS..Hα-helixtrans-65.1-47.7175-64.4167.3000110.9I99 C100 I101 A105 V106 A107 F196I99-I103 HydrophobicContact CG2-CD1 3.82Å; I99-I103 WeakPolarHBondContact O-CG1 3.18Å; I99-I103 PolarHBondContact O-N 3.04Å; I99-I103 VanDerWaalsContact O-N 3.14Å; C100-I103 PolarHBondContact O-N 3.42Å; I101-I103 VanDerWaalsContact C-N 3.33Å; I101-I103 PolarHBondContact O-N 3.32Å; I103-A105 VanDerWaalsContact C-N 3.32Å; I103-A105 PolarHBondContact O-N 3.39Å; I103-V106 PolarHBondContact O-N 3.38Å; I103-A107 PolarHBondContact O-N 3.44Å; I103-F196 HydrophobicContact CG1-CE1 4.44Å; I103-F196 HydrophobicContact CG1-CZ 4.14Å
104A98.4Very high97.7Very high46 Ų4653.5 Ų53.538%0.3831%0.309SS..Hα-helixtrans-62-39.7-179.600000112.1C100 I101 A107 T108C100-A104 WeakPolarHBondContact O-CB 3.32Å; C100-A104 PolarHBondContact O-N 3.11Å; I101-A104 PolarHBondContact O-N 2.82Å; A104-A107 PolarHBondContact O-N 3.45Å; A104-T108 WeakPolarHBondContact O-CG2 3.17Å; A104-T108 PolarHBondContact O-N 3.5Å; A104-T108 VanDerWaalsContact O-N 3.07Å; A104-T108 PolarHBondContact O-OG1 3.3Å; A104-T108 VanDerWaalsContact O-OG1 3.06Å
105A98.3Very high97.7Very high8 Ų856.3 Ų56.37%0.06632%0.324CS..Hα-helixtrans-65.2-42.6178.900000112.1I54 I101 I103 A107 T108 Q109 I192I54-A105 HydrophobicContact CB-CB 3.98Å; I54-A105 HydrophobicContact CD1-CB 3.78Å; I54-A105 HydrophobicContact CG1-CB 4.39Å; I54-A105 HydrophobicContact CG2-CB 4.38Å; I101-A105 WeakPolarHBondContact O-CB 3.38Å; I101-A105 PolarHBondContact O-N 2.95Å; I103-A105 VanDerWaalsContact C-N 3.32Å; I103-A105 PolarHBondContact O-N 3.39Å; A105-A107 PolarHBondContact O-N 3.34Å; A105-T108 PolarHBondContact O-N 3Å; A105-Q109 WeakPolarHBondContact O-CB 3.45Å; A105-Q109 PolarHBondContact O-N 2.9Å; A105-I192 HydrophobicContact CB-CD1 3.82Å; A105-I192 HydrophobicContact CB-CG1 3.85Å
106V98.1Very high97.6Very high83 Ų8355.6 Ų55.650%0.50332%0.32SS..Hα-helixtrans-58.2-38.6173.2171.60000111A102 I103 I192A102-V106 WeakPolarHBondContact O-CG2 3.18Å; A102-V106 PolarHBondContact O-N 3.22Å; I103-V106 PolarHBondContact O-N 3.38Å; V106-I192 HydrophobicContact CG2-CD1 3.84Å; V106-I192 HydrophobicContact CG2-CG1 4.45Å; V106-I192 HydrophobicContact CG2-CG2 4Å
107A97.9Very high97.6Very high82 Ų8253.9 Ų53.968%0.67831%0.314SS*.Hα-helixtrans-76.7-27.5-176.800000114.6I103 A104 A105I103-A107 PolarHBondContact O-N 3.44Å; A104-A107 PolarHBondContact O-N 3.45Å; A105-A107 PolarHBondContact O-N 3.34Å
108T96.9Very high97.5Very high73 Ų7356.6 Ų56.645%0.44833%0.325SS..Hα-helixtrans-103-0.7-174.757.10000114.3A104 A105 Q111 Y112A104-T108 WeakPolarHBondContact O-CG2 3.17Å; A104-T108 PolarHBondContact O-N 3.5Å; A104-T108 VanDerWaalsContact O-N 3.07Å; A104-T108 PolarHBondContact O-OG1 3.3Å; A104-T108 VanDerWaalsContact O-OG1 3.06Å; A105-T108 PolarHBondContact O-N 3Å; T108-Q111 WeakPolarHBondContact O-CB 3.26Å; T108-Q111 PolarHBondContact O-N 2.79Å; T108-Y112 PolarHBondContact O-N 2.95Å; T108-Y112 VanDerWaalsContact O-N 3.09Å
109Q94.7Very high97.4Very high40 Ų4057.3 Ų57.319%0.18733%0.33CS..Hα-helixtrans-62.7-49.6-172.2-172.6174.2-87.600114A105 Q111 Y112 A113 Q185 N189A105-Q109 WeakPolarHBondContact O-CB 3.45Å; A105-Q109 PolarHBondContact O-N 2.9Å; Q109-Q111 VanDerWaalsContact C-N 3.27Å; Q109-Q111 PolarHBondContact O-N 2.93Å; Q109-Y112 PolarHBondContact O-N 3.47Å; Q109-A113 PolarHBondContact O-N 3Å; Q109-Q185 VanDerWaalsContact NE2-CD 3.25Å; Q109-N189 PolarHBondContact OE1-OD1 3.29Å; Q109-N189 VanDerWaalsContact OE1-OD1 3.13Å
110D95.9Very high97.3Very high124 Ų12454 Ų5466%0.66331%0.313SS*.Hα-helixtrans-66.2-34.3179.5-62.6-30.3000111.3A113 S114D110-A113 PolarHBondContact O-N 3.46Å; D110-S114 PolarHBondContact O-N 2.81Å; D110-S114 VanDerWaalsContact O-N 3.08Å
111Q97.2Very high97.3Very high109 Ų10953.9 Ų53.951%0.50931%0.309SS..Hα-helixtrans-62.2-44.4175.5-175.161.847.700111T108 Q109 A113 S114 D115T108-Q111 WeakPolarHBondContact O-CB 3.26Å; T108-Q111 PolarHBondContact O-N 2.79Å; Q109-Q111 VanDerWaalsContact C-N 3.27Å; Q109-Q111 PolarHBondContact O-N 2.93Å; Q111-A113 VanDerWaalsContact C-N 3.33Å; Q111-A113 PolarHBondContact O-N 2.95Å; Q111-S114 WeakPolarHBondContact O-CB 3.41Å; Q111-S114 PolarHBondContact O-N 3.48Å; Q111-D115 PolarHBondContact NE2-OD1 3.44Å; Q111-D115 VanDerWaalsContact O-CG 3.24Å; Q111-D115 PolarHBondContact O-N 3.36Å
112Y96.1Very high97.1Very high21 Ų2157.5 Ų57.58%0.08233%0.328CS..Hα-helixtrans-60.2-42.4177.8-179.3-98.8000112.1V49 A50 P52 T108 Q109 S114 D115 V116 A184V49-Y112 HydrophobicContact CB-CE2 4.36Å; V49-Y112 HydrophobicContact CG1-CD2 3.86Å; V49-Y112 HydrophobicContact CG1-CE2 3.7Å; A50-Y112 WeakPolarHBondContact O-CE2 3.34Å; P52-Y112 HydrophobicContact CG-CD1 3.97Å; P52-Y112 HydrophobicContact CG-CD2 3.89Å; P52-Y112 HydrophobicContact CG-CE1 4.07Å; P52-Y112 HydrophobicContact CG-CE2 4Å; P52-Y112 HydrophobicContact CG-CG 3.88Å; T108-Y112 PolarHBondContact O-N 2.95Å; T108-Y112 VanDerWaalsContact O-N 3.09Å; Q109-Y112 PolarHBondContact O-N 3.47Å; Y112-S114 VanDerWaalsContact C-N 3.33Å; Y112-S114 PolarHBondContact O-N 3.13Å; Y112-D115 PolarHBondContact O-N 2.89Å; Y112-V116 HydrophobicContact CD1-CG2 4.13Å; Y112-V116 HydrophobicContact CE1-CG2 3.59Å; Y112-V116 HydrophobicContact CE2-CG2 4.03Å; Y112-V116 WeakPolarHBondContact O-CG2 3.47Å; Y112-V116 PolarHBondContact O-N 2.88Å; Y112-A184 HydrophobicContact CD1-CB 3.91Å; Y112-A184 HydrophobicContact CE1-CB 3.33Å
113A97Very high96.9Very high32 Ų3257.7 Ų57.726%0.26433%0.33SS..Hα-helixtrans-61.2-42.2176.100000111.9Q109 D110 Q111 Q117 A181Q109-A113 PolarHBondContact O-N 3Å; D110-A113 PolarHBondContact O-N 3.46Å; Q111-A113 VanDerWaalsContact C-N 3.33Å; Q111-A113 PolarHBondContact O-N 2.95Å; A113-Q117 WeakPolarHBondContact O-CB 3.35Å; A113-Q117 PolarHBondContact O-N 3.05Å; A113-A181 HydrophobicContact CB-CB 4.05Å
114S97.8Very high96.8Very high60 Ų6053 Ų5342%0.4231%0.305SS..Hα-helixtrans-63.4-41.6175.2-176.90000112.6D110 Q111 Y112 Q117 Q118D110-S114 PolarHBondContact O-N 2.81Å; D110-S114 VanDerWaalsContact O-N 3.08Å; Q111-S114 WeakPolarHBondContact O-CB 3.41Å; Q111-S114 PolarHBondContact O-N 3.48Å; Y112-S114 VanDerWaalsContact C-N 3.33Å; Y112-S114 PolarHBondContact O-N 3.13Å; S114-Q117 WeakPolarHBondContact O-CB 3.34Å; S114-Q117 PolarHBondContact O-N 3.44Å; S114-Q118 PolarHBondContact O-N 3.35Å
115D97Very high96.7Very high60 Ų6053.1 Ų53.132%0.32130%0.303SS..Hα-helixtrans-66.6-43.4-180-66.2-19.2000111V49 Q111 Y112 Q117 Q118 S119V49-D115 HydrophobicContact CB-CB 4.48Å; V49-D115 HydrophobicContact CG1-CB 3.68Å; V49-D115 HydrophobicContact CG2-CB 3.89Å; Q111-D115 PolarHBondContact NE2-OD1 3.44Å; Q111-D115 VanDerWaalsContact O-CG 3.24Å; Q111-D115 PolarHBondContact O-N 3.36Å; Y112-D115 PolarHBondContact O-N 2.89Å; D115-Q117 VanDerWaalsContact C-N 3.33Å; D115-Q117 PolarHBondContact O-N 3.37Å; D115-Q118 PolarHBondContact O-N 3.05Å; D115-S119 WeakPolarHBondContact O-CB 3.41Å; D115-S119 PolarHBondContact O-N 3.42Å
116V97.3Very high96.5Very high0 Ų055.2 Ų55.20%031%0.314CS..Hα-helixtrans-60.3-44.5174.1168.90000110.8I47 V49 Y112 S119 L120 I180I47-V116 HydrophobicContact CG2-CG2 4.2Å; V49-V116 HydrophobicContact CG2-CG2 4.49Å; Y112-V116 HydrophobicContact CD1-CG2 4.13Å; Y112-V116 HydrophobicContact CE1-CG2 3.59Å; Y112-V116 HydrophobicContact CE2-CG2 4.03Å; Y112-V116 WeakPolarHBondContact O-CG2 3.47Å; Y112-V116 PolarHBondContact O-N 2.88Å; V116-S119 PolarHBondContact O-N 3.34Å; V116-L120 HydrophobicContact CG1-CD1 3.84Å; V116-L120 HydrophobicContact CG1-CG 4.43Å; V116-L120 WeakPolarHBondContact O-CB 3.41Å; V116-L120 PolarHBondContact O-N 2.96Å; V116-I180 HydrophobicContact CG1-CB 4.27Å; V116-I180 HydrophobicContact CG1-CG2 3.78Å; V116-I180 HydrophobicContact CG2-CG2 4.32Å
117Q97.5Very high96.4Very high101 Ų10152.4 Ų52.447%0.47229%0.294SS..Hα-helixtrans-56.8-53.3176.5173.6177.2-50.500111.2A113 S114 D115 S119 L121 I177A113-Q117 WeakPolarHBondContact O-CB 3.35Å; A113-Q117 PolarHBondContact O-N 3.05Å; S114-Q117 WeakPolarHBondContact O-CB 3.34Å; S114-Q117 PolarHBondContact O-N 3.44Å; D115-Q117 VanDerWaalsContact C-N 3.33Å; D115-Q117 PolarHBondContact O-N 3.37Å; Q117-S119 VanDerWaalsContact C-N 3.3Å; Q117-S119 PolarHBondContact O-N 3.19Å; Q117-L121 HydrophobicContact CG-CD1 3.95Å; Q117-L121 WeakPolarHBondContact O-CB 3.46Å; Q117-L121 VanDerWaalsContact O-CG 3.28Å; Q117-L121 WeakPolarHBondContact O-CG 3.31Å; Q117-L121 PolarHBondContact O-N 2.9Å; Q117-L121 VanDerWaalsContact O-N 3.11Å; Q117-I177 HydrophobicContact CB-CD1 4.35Å; Q117-I177 HydrophobicContact CB-CG2 3.79Å; Q117-I177 HydrophobicContact CG-CD1 4.11Å; Q117-I177 HydrophobicContact CG-CG2 4.28Å
118Q96.9Very high96.2Very high106 Ų10654.5 Ų54.550%0.49529%0.294SS..Hα-helixtrans-62.1-39.4-178.4-177.357.773.600111.9S114 D115 N122S114-Q118 PolarHBondContact O-N 3.35Å; D115-Q118 PolarHBondContact O-N 3.05Å; Q118-N122 PolarHBondContact NE2-ND2 3.36Å; Q118-N122 PolarHBondContact NE2-OD1 3.19Å; Q118-N122 VanDerWaalsContact NE2-OD1 3.12Å; Q118-N122 PolarHBondContact O-N 3.33Å; Q118-N122 PolarHBondContact O-ND2 3.19Å
119S96.4Very high96.1Very high15 Ų1555.5 Ų55.511%0.10529%0.294CS..Hα-helixtrans-70.8-48.5-178.3-1690000112.8I46 I47 D115 V116 Q117 L121 N122 S123I46-S119 PolarHBondContact O-OG 3.5Å; I47-S119 VanDerWaalsContact C-OG 3.29Å; I47-S119 WeakPolarHBondContact O-CB 3.36Å; I47-S119 PolarHBondContact O-OG 3.14Å; D115-S119 WeakPolarHBondContact O-CB 3.41Å; D115-S119 PolarHBondContact O-N 3.42Å; V116-S119 PolarHBondContact O-N 3.34Å; Q117-S119 VanDerWaalsContact C-N 3.3Å; Q117-S119 PolarHBondContact O-N 3.19Å; S119-L121 VanDerWaalsContact C-N 3.33Å; S119-L121 PolarHBondContact O-N 3.32Å; S119-N122 PolarHBondContact O-N 3.41Å; S119-N122 VanDerWaalsContact O-N 3.08Å; S119-S123 WeakPolarHBondContact O-CB 3.27Å; S119-S123 PolarHBondContact O-N 3.41Å; S119-S123 PolarHBondContact O-OG 3.5Å; S119-S123 VanDerWaalsContact O-OG 3.13Å
120L97Very high96Very high0 Ų059 Ų590%032%0.317CS..Hα-helixtrans-65.1-36.6179.4-74.6175.6000112.3I46 I47 V116 N122 S123 I124 F136 L139 A148 C176 I177I46-L120 HydrophobicContact CB-CD2 4.43Å; I46-L120 HydrophobicContact CD1-CD2 4.36Å; I46-L120 HydrophobicContact CG1-CD2 4.18Å; I47-L120 HydrophobicContact CG1-CD2 4.25Å; V116-L120 HydrophobicContact CG1-CD1 3.84Å; V116-L120 HydrophobicContact CG1-CG 4.43Å; V116-L120 WeakPolarHBondContact O-CB 3.41Å; V116-L120 PolarHBondContact O-N 2.96Å; L120-N122 VanDerWaalsContact C-N 3.28Å; L120-N122 PolarHBondContact O-N 3.4Å; L120-S123 PolarHBondContact O-N 2.94Å; L120-I124 PolarHBondContact O-N 2.83Å; L120-F136 HydrophobicContact CD2-CE1 4.11Å; L120-F136 HydrophobicContact CD2-CZ 4.12Å; L120-L139 HydrophobicContact CD2-CD2 4.22Å; L120-A148 HydrophobicContact CB-CB 4.06Å; L120-C176 HydrophobicContact CD1-CB 4.41Å; L120-I177 HydrophobicContact CB-CD1 4.11Å; L120-I177 HydrophobicContact CB-CG1 3.66Å; L120-I177 HydrophobicContact CD1-CB 4.39Å; L120-I177 HydrophobicContact CD1-CG1 3.62Å; L120-I177 HydrophobicContact CG-CG1 4.26Å
121L96.6Very high95.9Very high56 Ų5656 Ų5629%0.29331%0.307SS..Hα-helixtrans-60.7-35.3172.3-79.1174.6000112.9Q117 S119 I124 A148 T149 I177Q117-L121 HydrophobicContact CG-CD1 3.95Å; Q117-L121 WeakPolarHBondContact O-CB 3.46Å; Q117-L121 VanDerWaalsContact O-CG 3.28Å; Q117-L121 WeakPolarHBondContact O-CG 3.31Å; Q117-L121 PolarHBondContact O-N 2.9Å; Q117-L121 VanDerWaalsContact O-N 3.11Å; S119-L121 VanDerWaalsContact C-N 3.33Å; S119-L121 PolarHBondContact O-N 3.32Å; L121-I124 WeakPolarHBondContact O-CG2 3.38Å; L121-A148 HydrophobicContact CD2-CB 4.16Å; L121-T149 HydrophobicContact CD2-CG2 3.66Å; L121-I177 HydrophobicContact CD2-CD1 4.42Å; L121-I177 HydrophobicContact CG-CD1 3.96Å
122N94.7Very high95.7Very high90 Ų9052.4 Ų52.448%0.48129%0.289SS..Hα-helixtrans-77.1-43.7176.4-70.4-19.4000111.2Q118 S119 L120 I124 S125Q118-N122 PolarHBondContact NE2-ND2 3.36Å; Q118-N122 PolarHBondContact NE2-OD1 3.19Å; Q118-N122 VanDerWaalsContact NE2-OD1 3.12Å; Q118-N122 PolarHBondContact O-N 3.33Å; Q118-N122 PolarHBondContact O-ND2 3.19Å; S119-N122 PolarHBondContact O-N 3.41Å; S119-N122 VanDerWaalsContact O-N 3.08Å; L120-N122 VanDerWaalsContact C-N 3.28Å; L120-N122 PolarHBondContact O-N 3.4Å; N122-I124 PolarHBondContact O-N 3.41Å; N122-S125 PolarHBondContact O-N 3.39Å; N122-S125 PolarHBondContact O-OG 2.95Å
123S95.8Very high95.7Very high5 Ų552.5 Ų52.54%0.03529%0.292CS..Hα-helixtrans-68.3-31.7-174.4-69.20000113.5I46 S119 L120 S125 N126 Y132I46-S123 WeakPolarHBondContact O-CB 3.34Å; I46-S123 PolarHBondContact O-OG 3.03Å; S119-S123 WeakPolarHBondContact O-CB 3.27Å; S119-S123 PolarHBondContact O-N 3.41Å; S119-S123 PolarHBondContact O-OG 3.5Å; S119-S123 VanDerWaalsContact O-OG 3.13Å; L120-S123 PolarHBondContact O-N 2.94Å; S123-S125 PolarHBondContact O-N 3.45Å; S123-N126 PolarHBondContact O-N 2.92Å; S123-Y132 WeakPolarHBondContact O-CD1 3.39Å
124I96.1Very high95.7Very high2 Ų255.6 Ų55.61%0.0131%0.307CS..G310 helixtrans-61.4-30.5-179.2-169.762.1000112.6L120 L121 N122 N126 Y127 F136 A148 D153 Y154 Y157 M159L120-I124 PolarHBondContact O-N 2.83Å; L121-I124 WeakPolarHBondContact O-CG2 3.38Å; N122-I124 PolarHBondContact O-N 3.41Å; I124-N126 PolarHBondContact O-N 3.24Å; I124-Y127 VanDerWaalsContact O-CB 3.3Å; I124-Y127 WeakPolarHBondContact O-CB 3.2Å; I124-Y127 PolarHBondContact O-N 3.39Å; I124-Y127 VanDerWaalsContact O-N 3.16Å; I124-F136 HydrophobicContact CB-CZ 3.99Å; I124-F136 HydrophobicContact CD1-CD1 4.25Å; I124-F136 HydrophobicContact CD1-CE1 3.88Å; I124-F136 HydrophobicContact CD1-CE2 4.32Å; I124-F136 HydrophobicContact CD1-CZ 3.92Å; I124-A148 HydrophobicContact CB-CB 4.31Å; I124-A148 HydrophobicContact CG2-CB 4.21Å; I124-D153 HydrophobicContact CG1-CB 4.02Å; I124-Y154 HydrophobicContact CD1-CD1 4.39Å; I124-Y154 HydrophobicContact CD1-CE1 3.73Å; I124-Y154 HydrophobicContact CD1-CE2 4.29Å; I124-Y157 HydrophobicContact CG2-CD2 4.45Å; I124-Y157 HydrophobicContact CG2-CE2 3.79Å; I124-M159 VanDerWaalsContact O-CE 3.25Å; I124-M159 WeakPolarHBondContact O-CE 3.21Å
125S95.2Very high95.6Very high48 Ų4853.6 Ų53.634%0.33629%0.291SS..G310 helixtrans-62.7-24.3175.770.60000113.2N122 S123 Y157N122-S125 PolarHBondContact O-N 3.39Å; N122-S125 PolarHBondContact O-OG 2.95Å; S123-S125 PolarHBondContact O-N 3.45Å; S125-Y157 VanDerWaalsContact CB-CE1 3.46Å
126N95.2Very high95.6Very high53 Ų5350.7 Ų50.728%0.28328%0.276SS..G310 helixtrans-95.78.4-179.6-67-59.8000113.3S123 I124 N128 Q129 Y132S123-N126 PolarHBondContact O-N 2.92Å; I124-N126 PolarHBondContact O-N 3.24Å; N126-N128 PolarHBondContact O-N 3.32Å; N126-N128 VanDerWaalsContact O-N 3.08Å; N126-Q129 VanDerWaalsContact O-CB 3.29Å; N126-Q129 WeakPolarHBondContact O-CB 3.4Å; N126-Q129 WeakPolarHBondContact O-CG 3.46Å; N126-Q129 PolarHBondContact O-N 3.06Å; N126-Q129 PolarHBondContact OD1-NE2 3.39Å; N126-Y132 HydrophobicContact CB-CD1 3.84Å; N126-Y132 HydrophobicContact CB-CD2 3.94Å; N126-Y132 HydrophobicContact CB-CE1 3.96Å; N126-Y132 HydrophobicContact CB-CE2 4.03Å; N126-Y132 HydrophobicContact CB-CG 3.85Å; N126-Y132 WeakPolarHBondContact O-CB 3.04Å
127Y95.7Very high95.6Very high23 Ų2353.1 Ų53.19%0.0929%0.289CS..THydrogen-bonded Turntrans-53-34.8-175.7176-89.6000114I124 Q129 S133 F136 D137 Y154 M159 P162I124-Y127 VanDerWaalsContact O-CB 3.3Å; I124-Y127 WeakPolarHBondContact O-CB 3.2Å; I124-Y127 PolarHBondContact O-N 3.39Å; I124-Y127 VanDerWaalsContact O-N 3.16Å; Y127-Q129 PolarHBondContact O-N 3.42Å; Y127-Q129 VanDerWaalsContact O-N 3.09Å; Y127-Q129 VanDerWaalsContact O-O 3.1Å; Y127-S133 WeakPolarHBondContact O-CB 3.49Å; Y127-S133 PolarHBondContact O-N 2.87Å; Y127-S133 PolarHBondContact O-OG 3.3Å; Y127-F136 HydrophobicContact CD2-CB 3.73Å; Y127-F136 HydrophobicContact CD2-CD2 4.02Å; Y127-F136 HydrophobicContact CD2-CG 4.02Å; Y127-F136 HydrophobicContact CE2-CB 3.74Å; Y127-F136 HydrophobicContact CE2-CG 4.5Å; Y127-D137 PolarHBondContact OH-OD1 3.41Å; Y127-Y154 HydrophobicContact CD1-CD1 4.44Å; Y127-Y154 AromaticContact CD1-CE1 3.77Å; Y127-Y154 HydrophobicContact CD1-CE1 3.77Å; Y127-Y154 AromaticContact CD2-CE1 3.67Å; Y127-Y154 HydrophobicContact CD2-CE1 3.67Å; Y127-Y154 WeakPolarHBondContact CD2-OH 3.01Å; Y127-Y154 HydrophobicContact CE1-CE1 4.08Å; Y127-Y154 AromaticContact CE2-CE1 3.96Å; Y127-Y154 HydrophobicContact CE2-CE1 3.96Å; Y127-Y154 VanDerWaalsContact CE2-OH 3.3Å; Y127-Y154 WeakPolarHBondContact CE2-OH 3.13Å; Y127-Y154 AromaticContact CG-CE1 3.59Å; Y127-Y154 HydrophobicContact CG-CE1 3.59Å; Y127-M159 HydrophobicContact CD1-SD 3.93Å; Y127-M159 HydrophobicContact CG-SD 4.3Å; Y127-P162 HydrophobicContact CE2-CG 4.36Å; Y127-P162 WeakPolarHBondContact OH-CB 3.38Å
128N94Very high95.5Very high127 Ų12752.8 Ų52.868%0.67929%0.286SS*.THydrogen-bonded Turntrans-63.4-13.8177.3-74-29.4000114.1N126N126-N128 PolarHBondContact O-N 3.32Å; N126-N128 VanDerWaalsContact O-N 3.08Å
129Q94.4Very high95.5Very high94 Ų9447.8 Ų47.844%0.43926%0.263SS..SBendtrans-77.3137.1171.2-58.1-177.62700109.8N126 Y127 S131 Y132 S133N126-Q129 VanDerWaalsContact O-CB 3.29Å; N126-Q129 WeakPolarHBondContact O-CB 3.4Å; N126-Q129 WeakPolarHBondContact O-CG 3.46Å; N126-Q129 PolarHBondContact O-N 3.06Å; N126-Q129 PolarHBondContact OD1-NE2 3.39Å; Y127-Q129 PolarHBondContact O-N 3.42Å; Y127-Q129 VanDerWaalsContact O-N 3.09Å; Y127-Q129 VanDerWaalsContact O-O 3.1Å; Q129-S131 VanDerWaalsContact C-N 3.29Å; Q129-S131 PolarHBondContact O-N 2.97Å; Q129-Y132 HydrophobicContact CB-CD2 3.95Å; Q129-Y132 PolarHBondContact O-N 3.21Å; Q129-Y132 VanDerWaalsContact O-N 3.12Å; Q129-S133 PolarHBondContact O-N 3.06Å; Q129-S133 PolarHBondContact O-OG 3.38Å
130T92.8Very high95.6Very high112 Ų11247 Ų4769%0.68726%0.258SS*.Hα-helixtrans-56.5-39-174-49.50000113.4S133 V134T130-S133 WeakPolarHBondContact CA-OG 3.42Å; T130-S133 PolarHBondContact O-OG 2.91Å; T130-S133 VanDerWaalsContact O-OG 3.14Å; T130-V134 HydrophobicContact CG2-CG2 4.45Å; T130-V134 WeakPolarHBondContact O-CB 3.37Å; T130-V134 WeakPolarHBondContact O-CG2 3.26Å; T130-V134 PolarHBondContact O-N 3.43Å
131S92.3Very high95.6Very high62 Ų6250.4 Ų50.443%0.43428%0.278SS..Hα-helixtrans-65.7-41.617948.30000112.7Q129 E135Q129-S131 VanDerWaalsContact C-N 3.29Å; Q129-S131 PolarHBondContact O-N 2.97Å; S131-E135 PolarHBondContact O-N 3.26Å
132Y94.8Very high95.5Very high34 Ų3450.7 Ų50.713%0.13329%0.285CS..Hα-helixtrans-72.6-46.1179.7-74.3-100.5000111.3I46 S123 N126 Q129 V134 E135 F136I46-Y132 HydrophobicContact CG2-CD1 3.77Å; I46-Y132 HydrophobicContact CG2-CE1 4.43Å; I46-Y132 HydrophobicContact CG2-CG 4.39Å; S123-Y132 WeakPolarHBondContact O-CD1 3.39Å; N126-Y132 HydrophobicContact CB-CD1 3.84Å; N126-Y132 HydrophobicContact CB-CD2 3.94Å; N126-Y132 HydrophobicContact CB-CE1 3.96Å; N126-Y132 HydrophobicContact CB-CE2 4.03Å; N126-Y132 HydrophobicContact CB-CG 3.85Å; N126-Y132 WeakPolarHBondContact O-CB 3.04Å; Q129-Y132 HydrophobicContact CB-CD2 3.95Å; Q129-Y132 PolarHBondContact O-N 3.21Å; Q129-Y132 VanDerWaalsContact O-N 3.12Å; Y132-V134 PolarHBondContact O-N 3.5Å; Y132-E135 PolarHBondContact O-N 3.41Å; Y132-F136 HydrophobicContact CD1-CE2 4.48Å; Y132-F136 WeakPolarHBondContact O-CB 3.23Å; Y132-F136 WeakPolarHBondContact O-CD2 3.49Å; Y132-F136 PolarHBondContact O-N 2.99Å
133S95.7Very high95.6Very high22 Ų2247.6 Ų47.615%0.15427%0.267CS..Hα-helixtrans-58.3-45.7178.539.10000112.5Y127 Q129 T130 E135 F136 D137Y127-S133 WeakPolarHBondContact O-CB 3.49Å; Y127-S133 PolarHBondContact O-N 2.87Å; Y127-S133 PolarHBondContact O-OG 3.3Å; Q129-S133 PolarHBondContact O-N 3.06Å; Q129-S133 PolarHBondContact O-OG 3.38Å; T130-S133 WeakPolarHBondContact CA-OG 3.42Å; T130-S133 PolarHBondContact O-OG 2.91Å; T130-S133 VanDerWaalsContact O-OG 3.14Å; S133-E135 VanDerWaalsContact C-N 3.33Å; S133-E135 PolarHBondContact O-N 2.86Å; S133-F136 PolarHBondContact O-N 3.13Å; S133-D137 VanDerWaalsContact O-CB 3.25Å; S133-D137 WeakPolarHBondContact O-CB 3.4Å; S133-D137 PolarHBondContact O-N 3.24Å
134V96Very high95.6Very high97 Ų9754.8 Ų54.859%0.58829%0.294SS*.Hα-helixtrans-59.3-43.2179.3168.90000111.9T130 Y132 K138T130-V134 HydrophobicContact CG2-CG2 4.45Å; T130-V134 WeakPolarHBondContact O-CB 3.37Å; T130-V134 WeakPolarHBondContact O-CG2 3.26Å; T130-V134 PolarHBondContact O-N 3.43Å; Y132-V134 PolarHBondContact O-N 3.5Å; V134-K138 WeakPolarHBondContact O-CB 3.46Å; V134-K138 PolarHBondContact O-N 3.29Å; V134-K138 VanDerWaalsContact O-N 3.17Å
135E95.4Very high95.7Very high18 Ų1854.7 Ų54.78%0.08429%0.294CS..Hα-helixtrans-79.2-36.1-177.1-157.2177.5-135.900112.3H43 N44 T45 I46 S131 Y132 S133 K138 L139H43-E135 VanDerWaalsContact CA-CD 3.41Å; H43-E135 WeakPolarHBondContact CA-OE1 3.17Å; H43-E135 HydrophobicContact CB-CG 4.44Å; N44-E135 PolarHBondContact N-OE1 3.47Å; T45-E135 WeakPolarHBondContact CA-OE2 3.25Å; T45-E135 WeakPolarHBondContact CB-OE2 3.35Å; T45-E135 PolarHBondContact N-OE1 2.87Å; T45-E135 PolarHBondContact N-OE2 2.86Å; T45-E135 PolarHBondContact OG1-OE1 3.47Å; I46-E135 HydrophobicContact CD1-CB 4.17Å; I46-E135 HydrophobicContact CD1-CG 3.94Å; I46-E135 HydrophobicContact CG1-CG 4.16Å; I46-E135 VanDerWaalsContact CG1-OE2 3.32Å; I46-E135 WeakPolarHBondContact CG1-OE2 3.2Å; I46-E135 HydrophobicContact CG2-CB 4.06Å; I46-E135 VanDerWaalsContact CG2-OE2 3.31Å; I46-E135 WeakPolarHBondContact CG2-OE2 3.4Å; I46-E135 PolarHBondContact N-OE2 2.71Å; S131-E135 PolarHBondContact O-N 3.26Å; Y132-E135 PolarHBondContact O-N 3.41Å; S133-E135 VanDerWaalsContact C-N 3.33Å; S133-E135 PolarHBondContact O-N 2.86Å; E135-K138 PolarHBondContact O-N 3.25Å; E135-L139 VanDerWaalsContact O-CB 3.27Å; E135-L139 WeakPolarHBondContact O-CB 3.45Å; E135-L139 PolarHBondContact O-N 3.39Å
136F97.1Very high95.9Very high0 Ų052.4 Ų52.40%028%0.278CS..Hα-helixtrans-62.4-44.4169.8-93-72.2000111.4I46 L120 I124 Y127 Y132 S133 K138 L139 Q140I46-F136 HydrophobicContact CB-CD2 4.43Å; I46-F136 HydrophobicContact CB-CE2 4.1Å; I46-F136 HydrophobicContact CB-CZ 4.45Å; I46-F136 HydrophobicContact CD1-CD1 4.29Å; I46-F136 HydrophobicContact CD1-CD2 4.39Å; I46-F136 HydrophobicContact CD1-CE1 4.5Å; I46-F136 HydrophobicContact CD1-CG 4.22Å; I46-F136 HydrophobicContact CG2-CD2 3.69Å; I46-F136 HydrophobicContact CG2-CE2 3.71Å; I46-F136 HydrophobicContact CG2-CG 4.48Å; L120-F136 HydrophobicContact CD2-CE1 4.11Å; L120-F136 HydrophobicContact CD2-CZ 4.12Å; I124-F136 HydrophobicContact CB-CZ 3.99Å; I124-F136 HydrophobicContact CD1-CD1 4.25Å; I124-F136 HydrophobicContact CD1-CE1 3.88Å; I124-F136 HydrophobicContact CD1-CE2 4.32Å; I124-F136 HydrophobicContact CD1-CZ 3.92Å; Y127-F136 HydrophobicContact CD2-CB 3.73Å; Y127-F136 HydrophobicContact CD2-CD2 4.02Å; Y127-F136 HydrophobicContact CD2-CG 4.02Å; Y127-F136 HydrophobicContact CE2-CB 3.74Å; Y127-F136 HydrophobicContact CE2-CG 4.5Å; Y132-F136 HydrophobicContact CD1-CE2 4.48Å; Y132-F136 WeakPolarHBondContact O-CB 3.23Å; Y132-F136 WeakPolarHBondContact O-CD2 3.49Å; Y132-F136 PolarHBondContact O-N 2.99Å; S133-F136 PolarHBondContact O-N 3.13Å; F136-K138 VanDerWaalsContact C-N 3.27Å; F136-K138 PolarHBondContact O-N 3.06Å; F136-L139 PolarHBondContact O-N 3.07Å; F136-Q140 WeakPolarHBondContact O-CB 3.13Å; F136-Q140 WeakPolarHBondContact O-CG 3.26Å; F136-Q140 PolarHBondContact O-N 3.29Å
137D97.4Very high96Very high51 Ų5149.9 Ų49.927%0.27327%0.265SS..Hα-helixtrans-60.1-40.7178.5-78.6-20.2000111.6Y127 S133 T141 S164Y127-D137 PolarHBondContact OH-OD1 3.41Å; S133-D137 VanDerWaalsContact O-CB 3.25Å; S133-D137 WeakPolarHBondContact O-CB 3.4Å; S133-D137 PolarHBondContact O-N 3.24Å; D137-T141 WeakPolarHBondContact O-CB 3.43Å; D137-T141 WeakPolarHBondContact O-CG2 3.31Å; D137-T141 PolarHBondContact O-N 3.4Å; D137-T141 VanDerWaalsContact O-N 3.16Å; D137-T141 PolarHBondContact O-OG1 3.19Å; D137-S164 WeakPolarHBondContact O-CB 3.29Å; D137-S164 VanDerWaalsContact OD1-CB 3.24Å; D137-S164 WeakPolarHBondContact OD1-CB 3.19Å; D137-S164 PolarHBondContact OD1-OG 3.27Å
138K96.4Very high96.1Very high94 Ų9448.8 Ų48.841%0.40926%0.26SS..Hα-helixtrans-67.9-43.3174.7-173.2178.9178.7-175.60112.3V134 E135 F136 T141 S142V134-K138 WeakPolarHBondContact O-CB 3.46Å; V134-K138 PolarHBondContact O-N 3.29Å; V134-K138 VanDerWaalsContact O-N 3.17Å; E135-K138 PolarHBondContact O-N 3.25Å; F136-K138 VanDerWaalsContact C-N 3.27Å; F136-K138 PolarHBondContact O-N 3.06Å; K138-T141 PolarHBondContact O-OG1 2.84Å; K138-T141 VanDerWaalsContact O-OG1 3.07Å; K138-S142 VanDerWaalsContact O-CB 3.22Å; K138-S142 WeakPolarHBondContact O-CB 3.29Å; K138-S142 PolarHBondContact O-N 3.19Å; K138-S142 PolarHBondContact O-OG 3.25Å
139L96.8Very high96.2Very high0 Ų046.3 Ų46.30%025%0.25CS..Hα-helixtrans-59.2-50.4177.8176.762.2000110.8I46 L120 E135 F136 T141 S142 F143 C176 I180I46-L139 HydrophobicContact CD1-CB 4.13Å; I46-L139 HydrophobicContact CD1-CD2 3.58Å; I46-L139 HydrophobicContact CD1-CG 4.46Å; L120-L139 HydrophobicContact CD2-CD2 4.22Å; E135-L139 VanDerWaalsContact O-CB 3.27Å; E135-L139 WeakPolarHBondContact O-CB 3.45Å; E135-L139 PolarHBondContact O-N 3.39Å; F136-L139 PolarHBondContact O-N 3.07Å; L139-T141 PolarHBondContact O-N 2.72Å; L139-S142 PolarHBondContact O-N 3.05Å; L139-F143 HydrophobicContact CD1-CD2 3.61Å; L139-F143 HydrophobicContact CD1-CE2 4.07Å; L139-F143 HydrophobicContact CD1-CG 4.29Å; L139-F143 WeakPolarHBondContact O-CB 3.42Å; L139-F143 PolarHBondContact O-N 3.11Å; L139-C176 HydrophobicContact CD2-CB 3.71Å; L139-C176 HydrophobicContact CG-CB 4.13Å; L139-I180 HydrophobicContact CD1-CD1 3.48Å; L139-I180 VanDerWaalsContact CD1-CD1 3.48Å; L139-I180 HydrophobicContact CD1-CG1 3.63Å
140Q97.9Very high96.4Very high0 Ų042.9 Ų42.90%024%0.236CC..Hα-helixtrans-63.7-39.7-176.9-70177.3150.800112.6F136 Y144 C145 Y154 S164 C165F136-Q140 WeakPolarHBondContact O-CB 3.13Å; F136-Q140 WeakPolarHBondContact O-CG 3.26Å; F136-Q140 PolarHBondContact O-N 3.29Å; Q140-Y144 WeakPolarHBondContact O-CA 3.03Å; Q140-Y144 PolarHBondContact O-N 3.28Å; Q140-C145 WeakPolarHBondContact CA-O 3.33Å; Q140-C145 WeakPolarHBondContact CB-O 3.49Å; Q140-C145 VanDerWaalsContact CG-O 3.29Å; Q140-C145 WeakPolarHBondContact CG-O 3.28Å; Q140-C145 PolarHBondContact O-N 2.85Å; Q140-Y154 PolarHBondContact NE2-OH 3Å; Q140-Y154 PolarHBondContact OE1-OH 3.28Å; Q140-S164 PolarHBondContact NE2-OG 2.85Å; Q140-C165 PolarHBondContact NE2-SG 2.97Å; Q140-C165 VanDerWaalsContact NE2-SG 3.39Å; Q140-C165 PolarHBondContact OE1-SG 3.49Å
141T96.5Very high96.5Very high70 Ų7040.3 Ų40.343%0.42921%0.214SC..Hα-helixtrans-74.1-31.6175.449.60000113.1D137 K138 L139D137-T141 WeakPolarHBondContact O-CB 3.43Å; D137-T141 WeakPolarHBondContact O-CG2 3.31Å; D137-T141 PolarHBondContact O-N 3.4Å; D137-T141 VanDerWaalsContact O-N 3.16Å; D137-T141 PolarHBondContact O-OG1 3.19Å; K138-T141 PolarHBondContact O-OG1 2.84Å; K138-T141 VanDerWaalsContact O-OG1 3.07Å; L139-T141 PolarHBondContact O-N 2.72Å
142S95Very high96.8Very high62 Ų6245 Ų4543%0.43422%0.223SC..Hα-helixtrans-79.1-35.5-179-57.70000112.9K138 L139K138-S142 VanDerWaalsContact O-CB 3.22Å; K138-S142 WeakPolarHBondContact O-CB 3.29Å; K138-S142 PolarHBondContact O-N 3.19Å; K138-S142 PolarHBondContact O-OG 3.25Å; L139-S142 PolarHBondContact O-N 3.05Å
143F96.6Very high96.9Very high26 Ų2643.8 Ų43.811%0.11422%0.219CC..Hα-helixtrans-109.13.7-175.2-75.9-93.4000113.8T39 L139 C145 E179 I180 F183T39-F143 HydrophobicContact CG2-CE2 4.17Å; T39-F143 HydrophobicContact CG2-CZ 3.73Å; L139-F143 HydrophobicContact CD1-CD2 3.61Å; L139-F143 HydrophobicContact CD1-CE2 4.07Å; L139-F143 HydrophobicContact CD1-CG 4.29Å; L139-F143 WeakPolarHBondContact O-CB 3.42Å; L139-F143 PolarHBondContact O-N 3.11Å; F143-C145 PolarHBondContact O-N 2.86Å; F143-E179 HydrophobicContact CB-CB 4.04Å; F143-E179 HydrophobicContact CD1-CB 4.1Å; F143-E179 HydrophobicContact CG-CB 4.46Å; F143-I180 HydrophobicContact CD1-CD1 4.24Å; F143-I180 HydrophobicContact CD2-CD1 4.01Å; F143-I180 HydrophobicContact CE1-CD1 3.89Å; F143-I180 HydrophobicContact CE2-CD1 3.62Å; F143-I180 HydrophobicContact CG-CD1 4.29Å; F143-I180 HydrophobicContact CZ-CD1 3.55Å; F143-F183 HydrophobicContact CE1-CB 3.78Å; F143-F183 HydrophobicContact CE1-CD1 4.49Å; F143-F183 AromaticContact CE1-CD2 3.94Å; F143-F183 HydrophobicContact CE1-CD2 3.94Å; F143-F183 AromaticContact CE1-CG 3.82Å; F143-F183 HydrophobicContact CE1-CG 3.82Å; F143-F183 HydrophobicContact CZ-CD2 4.36Å; F143-F183 HydrophobicContact CZ-CG 4.23Å
144Y97.1Very high96.9Very high155 Ų15542.8 Ų42.861%0.60821%0.211SC*.THydrogen-bonded Turntrans55.139.7178.9-51-88.2000112.8Q140 Y172Q140-Y144 WeakPolarHBondContact O-CA 3.03Å; Q140-Y144 PolarHBondContact O-N 3.28Å; Y144-Y172 VanDerWaalsContact C-CG 3.48Å; Y144-Y172 AromaticContact CD1-CE1 3.91Å; Y144-Y172 HydrophobicContact CD1-CE1 3.91Å; Y144-Y172 AromaticContact CD1-CZ 3.79Å; Y144-Y172 VanDerWaalsContact CD1-OH 3.26Å; Y144-Y172 WeakPolarHBondContact CD1-OH 3.38Å; Y144-Y172 HydrophobicContact CG-CE1 4.33Å; Y144-Y172 WeakPolarHBondContact O-CB 3.25Å; Y144-Y172 VanDerWaalsContact O-CD1 3.29Å; Y144-Y172 WeakPolarHBondContact O-CD1 3.27Å
145C98.1Very high96.8Very high0 Ų046 Ų460%021%0.213CC..  trans-119.9166.9-177.962.60000111.3Q140 F143 Y172 T174 C176 E179Q140-C145 WeakPolarHBondContact CA-O 3.33Å; Q140-C145 WeakPolarHBondContact CB-O 3.49Å; Q140-C145 VanDerWaalsContact CG-O 3.29Å; Q140-C145 WeakPolarHBondContact CG-O 3.28Å; Q140-C145 PolarHBondContact O-N 2.85Å; F143-C145 PolarHBondContact O-N 2.86Å; C145-Y172 WeakPolarHBondContact O-CD2 3.37Å; C145-T174 CarbonylContact C-O 3.49Å; C145-T174 WeakPolarHBondContact CA-O 3.08Å; C145-C176 HydrophobicContact CB-CB 3.9Å; C145-C176 WeakPolarHBondContact CB-SG 3.35Å; C145-C176 WeakPolarHBondContact SG-CA 3.43Å; C145-C176 WeakPolarHBondContact SG-CB 3.21Å; C145-C176 CovalentContact SG-SG 2.04Å; C145-C176 PolarHBondContact SG-SG 3.36Å; C145-E179 HydrophobicContact CB-CB 4.4Å; C145-E179 HydrophobicContact CB-CG 3.87Å
146C98.1Very high96.8Very high0 Ų051.8 Ų51.80%024%0.24CC..  trans-143.3131.6174.8-171.90000112.5S150 Y151 C165 T174C146-S150 CarbonylContact O-C 3.34Å; C146-S150 VanDerWaalsContact O-CA 3.27Å; C146-S150 WeakPolarHBondContact O-CA 3.35Å; C146-Y151 PolarHBondContact O-N 3.48Å; C146-Y151 VanDerWaalsContact SG-CA 3.55Å; C146-Y151 WeakPolarHBondContact SG-CB 3.25Å; C146-C165 VanDerWaalsContact CA-SG 3.54Å; C146-C165 HydrophobicContact CB-CB 3.67Å; C146-C165 WeakPolarHBondContact CB-SG 3.27Å; C146-C165 WeakPolarHBondContact SG-CB 3.14Å; C146-C165 CovalentContact SG-SG 2.03Å; C146-C165 PolarHBondContact SG-SG 2.98Å; C146-T174 PolarHBondContact N-O 3.46Å
147G97.6Very high96.6Very high0 Ų056.1 Ų56.10%026%0.257CS..SBendtrans67.9-168.9-176.100000112.7C176G147-C176 VanDerWaalsContact O-CB 3.25Å; G147-C176 WeakPolarHBondContact O-CB 3.16Å; G147-C176 PolarHBondContact O-N 3.16Å; G147-C176 PolarHBondContact O-SG 3.48Å
148A97.4Very high96.4Very high0 Ų062.8 Ų62.80%029%0.286CS..SBendtrans-79.1-58.6174.900000110.1L120 L121 I124 D153 G175 C176 I177L120-A148 HydrophobicContact CB-CB 4.06Å; L121-A148 HydrophobicContact CD2-CB 4.16Å; I124-A148 HydrophobicContact CB-CB 4.31Å; I124-A148 HydrophobicContact CG2-CB 4.21Å; A148-D153 WeakPolarHBondContact CA-OD2 3.42Å; A148-D153 WeakPolarHBondContact CB-OD2 3.48Å; A148-D153 PolarHBondContact N-OD2 3.08Å; A148-G175 CarbonylContact O-C 3.54Å; A148-G175 WeakPolarHBondContact O-CA 3.41Å; A148-C176 PolarHBondContact O-N 2.96Å; A148-C176 VanDerWaalsContact O-N 3.08Å; A148-I177 HydrophobicContact CB-CD1 3.8Å; A148-I177 HydrophobicContact CB-CG1 4.33Å; A148-I177 WeakPolarHBondContact O-CB 3.38Å; A148-I177 WeakPolarHBondContact O-CD1 3.38Å; A148-I177 VanDerWaalsContact O-CG1 3.25Å; A148-I177 WeakPolarHBondContact O-CG1 3.33Å; A148-I177 PolarHBondContact O-N 3.16Å
149T97.7Very high96.4Very high76 Ų7659 Ų5947%0.46627%0.271SS..SBendtrans-100.4-33.9177.969.70000112.5L121 D153 G175 I177L121-T149 HydrophobicContact CD2-CG2 3.66Å; T149-D153 PolarHBondContact N-OD2 3.18Å; T149-D153 PolarHBondContact OG1-OD1 3.34Å; T149-D153 PolarHBondContact OG1-OD2 2.9Å; T149-G175 VanDerWaalsContact C-CA 3.42Å; T149-G175 WeakPolarHBondContact O-CA 3.48Å; T149-G175 PolarHBondContact O-N 2.96Å; T149-I177 HydrophobicContact CG2-CD1 4.04Å
150S97.6Very high96.2Very high21 Ų2168 Ų6815%0.14731%0.31CS..  trans-168.9171.2175.968.50000111.1C146 R152 D153C146-S150 CarbonylContact O-C 3.34Å; C146-S150 VanDerWaalsContact O-CA 3.27Å; C146-S150 WeakPolarHBondContact O-CA 3.35Å; S150-R152 PolarHBondContact O-N 3.42Å; S150-R152 WeakPolarHBondContact OG-CB 3.4Å; S150-R152 PolarHBondContact OG-N 2.94Å; S150-D153 PolarHBondContact N-OD2 2.64Å; S150-D153 WeakPolarHBondContact O-CB 3.43Å; S150-D153 PolarHBondContact O-N 3.03Å
151Y96.3Very high96.1Very high59 Ų5969.2 Ų69.223%0.23132%0.316CS..THydrogen-bonded Turntrans-54.8-16.5171.872.2-90.9000114.6C146 D153 I161 T171C146-Y151 PolarHBondContact O-N 3.48Å; C146-Y151 VanDerWaalsContact SG-CA 3.55Å; C146-Y151 WeakPolarHBondContact SG-CB 3.25Å; Y151-D153 VanDerWaalsContact C-N 3.29Å; Y151-D153 PolarHBondContact O-N 3.34Å; Y151-I161 HydrophobicContact CD2-CD1 3.79Å; Y151-T171 HydrophobicContact CG-CG2 4.14Å
152R96.7Very high96.1Very high160 Ų16066.2 Ų66.260%0.60430%0.297SS*.Hα-helixtrans-72.1-22.3179.4-59.7-178.9179.2-171.91.6112.6S150 Y154 R155 Q156S150-R152 PolarHBondContact O-N 3.42Å; S150-R152 WeakPolarHBondContact OG-CB 3.4Å; S150-R152 PolarHBondContact OG-N 2.94Å; R152-Y154 PolarHBondContact O-N 2.9Å; R152-R155 WeakPolarHBondContact O-CB 3.38Å; R152-R155 PolarHBondContact O-N 2.04Å; R152-Q156 PolarHBondContact O-N 3.27Å; R152-Q156 VanDerWaalsContact O-N 3.1Å
153D97Very high96.2Very high9 Ų968.6 Ų68.65%0.04831%0.311CS..Hα-helixtrans-57.7-40179.9-59.6-20000111I124 A148 T149 S150 Y151 R155 Q156 Y157I124-D153 HydrophobicContact CG1-CB 4.02Å; A148-D153 WeakPolarHBondContact CA-OD2 3.42Å; A148-D153 WeakPolarHBondContact CB-OD2 3.48Å; A148-D153 PolarHBondContact N-OD2 3.08Å; T149-D153 PolarHBondContact N-OD2 3.18Å; T149-D153 PolarHBondContact OG1-OD1 3.34Å; T149-D153 PolarHBondContact OG1-OD2 2.9Å; S150-D153 PolarHBondContact N-OD2 2.64Å; S150-D153 WeakPolarHBondContact O-CB 3.43Å; S150-D153 PolarHBondContact O-N 3.03Å; Y151-D153 VanDerWaalsContact C-N 3.29Å; Y151-D153 PolarHBondContact O-N 3.34Å; D153-R155 VanDerWaalsContact C-N 3.3Å; D153-R155 PolarHBondContact O-N 3.25Å; D153-Q156 WeakPolarHBondContact O-CB 3.37Å; D153-Q156 PolarHBondContact O-N 3.4Å; D153-Q156 VanDerWaalsContact O-N 3.15Å; D153-Y157 VanDerWaalsContact O-CD2 3.25Å; D153-Y157 WeakPolarHBondContact O-CD2 3.35Å; D153-Y157 PolarHBondContact O-N 3.09Å
154Y96.5Very high96.2Very high0 Ų068 Ų680%031%0.31CS..Hα-helixtrans-57.6-42.6174.8-71.8-69.1000112.4I124 Y127 Q140 R152 Q156 Y157 Q158 M159 P162I124-Y154 HydrophobicContact CD1-CD1 4.39Å; I124-Y154 HydrophobicContact CD1-CE1 3.73Å; I124-Y154 HydrophobicContact CD1-CE2 4.29Å; Y127-Y154 HydrophobicContact CD1-CD1 4.44Å; Y127-Y154 AromaticContact CD1-CE1 3.77Å; Y127-Y154 HydrophobicContact CD1-CE1 3.77Å; Y127-Y154 AromaticContact CD2-CE1 3.67Å; Y127-Y154 HydrophobicContact CD2-CE1 3.67Å; Y127-Y154 WeakPolarHBondContact CD2-OH 3.01Å; Y127-Y154 HydrophobicContact CE1-CE1 4.08Å; Y127-Y154 AromaticContact CE2-CE1 3.96Å; Y127-Y154 HydrophobicContact CE2-CE1 3.96Å; Y127-Y154 VanDerWaalsContact CE2-OH 3.3Å; Y127-Y154 WeakPolarHBondContact CE2-OH 3.13Å; Y127-Y154 AromaticContact CG-CE1 3.59Å; Y127-Y154 HydrophobicContact CG-CE1 3.59Å; Q140-Y154 PolarHBondContact NE2-OH 3Å; Q140-Y154 PolarHBondContact OE1-OH 3.28Å; R152-Y154 PolarHBondContact O-N 2.9Å; Y154-Q156 VanDerWaalsContact C-N 3.34Å; Y154-Q156 PolarHBondContact O-N 3.4Å; Y154-Y157 CarbonylContact O-C 3.53Å; Y154-Y157 PolarHBondContact O-N 3.4Å; Y154-Q158 PolarHBondContact O-N 3.01Å; Y154-M159 CarbonylContact C-O 3.55Å; Y154-M159 HydrophobicContact CD1-CB 4.02Å; Y154-M159 HydrophobicContact CD1-CE 3.84Å; Y154-M159 HydrophobicContact CD1-SD 4.45Å; Y154-M159 HydrophobicContact CE1-CE 4.31Å; Y154-M159 WeakPolarHBondContact O-CA 3.22Å; Y154-M159 WeakPolarHBondContact O-CB 3.34Å; Y154-M159 PolarHBondContact O-N 3.32Å; Y154-P162 HydrophobicContact CE1-CG 4.2Å; Y154-P162 VanDerWaalsContact CE2-CD 3.4Å; Y154-P162 HydrophobicContact CE2-CG 3.87Å; Y154-P162 VanDerWaalsContact CZ-CD 3.5Å
155R93.9Very high96.3Very high165 Ų16560.6 Ų60.662%0.62328%0.281SS*.Hα-helixtrans-68.3-35.3178.9-62.4-174.7-172.71761.7111.9R152 D153 Y157 Q158R152-R155 WeakPolarHBondContact O-CB 3.38Å; R152-R155 PolarHBondContact O-N 2.04Å; D153-R155 VanDerWaalsContact C-N 3.3Å; D153-R155 PolarHBondContact O-N 3.25Å; R155-Y157 PolarHBondContact O-N 3.3Å; R155-Q158 PolarHBondContact O-N 2.96Å
156Q94.9Very high96.1Very high139 Ų13966.7 Ų66.765%0.6530%0.304SS*.Hα-helixtrans-58.6-36.8175.8179.3177.1-24.400111.6R152 D153 Y154R152-Q156 PolarHBondContact O-N 3.27Å; R152-Q156 VanDerWaalsContact O-N 3.1Å; D153-Q156 WeakPolarHBondContact O-CB 3.37Å; D153-Q156 PolarHBondContact O-N 3.4Å; D153-Q156 VanDerWaalsContact O-N 3.15Å; Y154-Q156 VanDerWaalsContact C-N 3.34Å; Y154-Q156 PolarHBondContact O-N 3.4Å
157Y93Very high95.9Very high91 Ų9170.8 Ų70.836%0.35733%0.329SS..THydrogen-bonded Turntrans-94.216.8175.8-65.1-74000113.9I124 S125 D153 Y154 R155 M159I124-Y157 HydrophobicContact CG2-CD2 4.45Å; I124-Y157 HydrophobicContact CG2-CE2 3.79Å; S125-Y157 VanDerWaalsContact CB-CE1 3.46Å; D153-Y157 VanDerWaalsContact O-CD2 3.25Å; D153-Y157 WeakPolarHBondContact O-CD2 3.35Å; D153-Y157 PolarHBondContact O-N 3.09Å; Y154-Y157 CarbonylContact O-C 3.53Å; Y154-Y157 PolarHBondContact O-N 3.4Å; R155-Y157 PolarHBondContact O-N 3.3Å; Y157-M159 HydrophobicContact CD2-CE 4.19Å; Y157-M159 HydrophobicContact CG-CE 4.15Å; Y157-M159 WeakPolarHBondContact O-CG 3.5Å; Y157-M159 PolarHBondContact O-N 2.92Å; Y157-M159 VanDerWaalsContact O-N 3.12Å
158Q94.1Very high95.6Very high191 Ų19174.2 Ų74.289%0.89337%0.365SS*.THydrogen-bonded Turntrans56.826.3-179.2-55.5-179.9-26.100114Y154 R155Y154-Q158 PolarHBondContact O-N 3.01Å; R155-Q158 PolarHBondContact O-N 2.96Å
159M94.8Very high95.3Very high16 Ų1683.5 Ų83.58%0.07941%0.408CS..PPolyproline II helixtrans-95.4154.2176.7-60.7-171.6-75.900111.3I124 Y127 Y154 Y157I124-M159 VanDerWaalsContact O-CE 3.25Å; I124-M159 WeakPolarHBondContact O-CE 3.21Å; Y127-M159 HydrophobicContact CD1-SD 3.93Å; Y127-M159 HydrophobicContact CG-SD 4.3Å; Y154-M159 CarbonylContact C-O 3.55Å; Y154-M159 HydrophobicContact CD1-CB 4.02Å; Y154-M159 HydrophobicContact CD1-CE 3.84Å; Y154-M159 HydrophobicContact CD1-SD 4.45Å; Y154-M159 HydrophobicContact CE1-CE 4.31Å; Y154-M159 WeakPolarHBondContact O-CA 3.22Å; Y154-M159 WeakPolarHBondContact O-CB 3.34Å; Y154-M159 PolarHBondContact O-N 3.32Å; Y157-M159 HydrophobicContact CD2-CE 4.19Å; Y157-M159 HydrophobicContact CG-CE 4.15Å; Y157-M159 WeakPolarHBondContact O-CG 3.5Å; Y157-M159 PolarHBondContact O-N 2.92Å; Y157-M159 VanDerWaalsContact O-N 3.12Å
160K94.5Very high95.1Very high189 Ų18986.3 Ų86.382%0.82242%0.419SS*.PPolyproline II helixtrans-78143.1170.6-66.3-179.1-178.6176.60109.4
161I95.6Very high95.1Very high25 Ų2587.6 Ų87.613%0.12843%0.426CS..PPolyproline II helixtrans-63124.7170.9-59.2169.9000107.7Y151 C165 T171Y151-I161 HydrophobicContact CD2-CD1 3.79Å; I161-C165 HydrophobicContact CG2-CB 3.76Å; I161-T171 HydrophobicContact CG2-CG2 3.95Å
162P96.3Very high95.1Very high6 Ų686.8 Ų86.84%0.03942%0.423CS..PPolyproline II helixtrans-74.5157.3-174.631.2-36.6000112.5Y127 Y154 S164 C165Y127-P162 HydrophobicContact CE2-CG 4.36Å; Y127-P162 WeakPolarHBondContact OH-CB 3.38Å; Y154-P162 HydrophobicContact CE1-CG 4.2Å; Y154-P162 VanDerWaalsContact CE2-CD 3.4Å; Y154-P162 HydrophobicContact CE2-CG 3.87Å; Y154-P162 VanDerWaalsContact CZ-CD 3.5Å; P162-S164 WeakPolarHBondContact CG-OG 3.37Å; P162-S164 PolarHBondContact O-N 3.26Å; P162-C165 HydrophobicContact CG-CB 4.43Å; P162-C165 WeakPolarHBondContact O-CB 3.33Å; P162-C165 PolarHBondContact O-N 3.01Å; P162-C165 VanDerWaalsContact O-N 3.15Å
163P96.4Very high95Very high113 Ų11382.7 Ų82.773%0.73442%0.423SS*.G310 helixtrans-59.2-29.7176.4-2434.6000113.6C165 R166P163-C165 PolarHBondContact O-N 3.04Å; P163-R166 PolarHBondContact O-N 3.08Å
164S97.3Very high95Very high13 Ų1384.5 Ų84.59%0.09144%0.435CS..G310 helixtrans-60.9-22176.853.90000114D137 Q140 P162 R166D137-S164 WeakPolarHBondContact O-CB 3.29Å; D137-S164 VanDerWaalsContact OD1-CB 3.24Å; D137-S164 WeakPolarHBondContact OD1-CB 3.19Å; D137-S164 PolarHBondContact OD1-OG 3.27Å; Q140-S164 PolarHBondContact NE2-OG 2.85Å; P162-S164 WeakPolarHBondContact CG-OG 3.37Å; P162-S164 PolarHBondContact O-N 3.26Å; S164-R166 VanDerWaalsContact C-N 3.28Å; S164-R166 PolarHBondContact O-N 3.26Å
165C97.7Very high95.1Very high0 Ų084.6 Ų84.60%044%0.436CS..G310 helixtrans-81.1-1.5174.4-75.90000114.2Q140 C146 I161 P162 P163 T171 Y172Q140-C165 PolarHBondContact NE2-SG 2.97Å; Q140-C165 VanDerWaalsContact NE2-SG 3.39Å; Q140-C165 PolarHBondContact OE1-SG 3.49Å; C146-C165 VanDerWaalsContact CA-SG 3.54Å; C146-C165 HydrophobicContact CB-CB 3.67Å; C146-C165 WeakPolarHBondContact CB-SG 3.27Å; C146-C165 WeakPolarHBondContact SG-CB 3.14Å; C146-C165 CovalentContact SG-SG 2.03Å; C146-C165 PolarHBondContact SG-SG 2.98Å; I161-C165 HydrophobicContact CG2-CB 3.76Å; P162-C165 HydrophobicContact CG-CB 4.43Å; P162-C165 WeakPolarHBondContact O-CB 3.33Å; P162-C165 PolarHBondContact O-N 3.01Å; P162-C165 VanDerWaalsContact O-N 3.15Å; P163-C165 PolarHBondContact O-N 3.04Å; C165-T171 HydrophobicContact CB-CG2 4.11Å; C165-T171 WeakPolarHBondContact O-CA 3.49Å; C165-Y172 WeakPolarHBondContact O-CD2 3.37Å; C165-Y172 PolarHBondContact O-N 3.28Å
166R95.7Very high95.3Very high128 Ų12876.8 Ų76.848%0.48341%0.406SS..EExtended strand (participates in β ladder)trans-118.8144.9-167.7-62.4-176.3179.5172.11113.4P163 S164 L170P163-R166 PolarHBondContact O-N 3.08Å; S164-R166 VanDerWaalsContact C-N 3.28Å; S164-R166 PolarHBondContact O-N 3.26Å; R166-L170 CarbonylContact C-O 2.97Å; R166-L170 WeakPolarHBondContact CA-O 3.02Å; R166-L170 WeakPolarHBondContact CB-O 3.45Å
167V92.9Very high95.4Very high86 Ų8671 Ų7152%0.52138%0.38SS..EExtended strand (participates in β ladder)trans-120.3100.8163.9-175.70000107.5E169 L170 Y172V167-E169 PolarHBondContact O-N 2.98Å; V167-L170 PolarHBondContact N-O 3.35Å; V167-L170 PolarHBondContact O-N 2.94Å; V167-L170 VanDerWaalsContact O-N 3.16Å; V167-Y172 HydrophobicContact CG2-CE1 3.61Å; V167-Y172 HydrophobicContact CG2-CE2 4.49Å; V167-Y172 VanDerWaalsContact CG2-CZ 3.47Å; V167-Y172 WeakPolarHBondContact CG2-OH 3.47Å
168G91.1Very high95.6Very high72 Ų7273.2 Ų73.274%0.74239%0.393SS*.THydrogen-bonded Turntrans61.5-120.2-168.500000110.8
169E90.6Very high95.8Very high195 Ų19567.3 Ų67.391%0.91137%0.366SS*.THydrogen-bonded Turntrans-89.5-12.6178.9-60.9-170163.100113.7V167V167-E169 PolarHBondContact O-N 2.98Å
170L94.7Very high95.9Very high135 Ų13566.6 Ų66.671%0.70736%0.362SS*.EExtended strand (participates in β ladder)trans-83.3145.7-178.8-61.6176000110.8R166 V167R166-L170 CarbonylContact C-O 2.97Å; R166-L170 WeakPolarHBondContact CA-O 3.02Å; R166-L170 WeakPolarHBondContact CB-O 3.45Å; V167-L170 PolarHBondContact N-O 3.35Å; V167-L170 PolarHBondContact O-N 2.94Å; V167-L170 VanDerWaalsContact O-N 3.16Å
171T96.2Very high96Very high48 Ų4858.3 Ų58.329%0.29433%0.329SS..EExtended strand (participates in β ladder)trans-114.9136.2174.4-56.70000108.9Y151 I161 C165 A173Y151-T171 HydrophobicContact CG-CG2 4.14Å; I161-T171 HydrophobicContact CG2-CG2 3.95Å; C165-T171 HydrophobicContact CB-CG2 4.11Å; C165-T171 WeakPolarHBondContact O-CA 3.49Å; T171-A173 PolarHBondContact O-N 3.38Å
172Y96.9Very high96.1Very high42 Ų4258.8 Ų58.817%0.16534%0.34CS..  trans-58.9131.4175.7-55.8-59.6000110.8Y144 C145 C165 V167Y144-Y172 VanDerWaalsContact C-CG 3.48Å; Y144-Y172 AromaticContact CD1-CE1 3.91Å; Y144-Y172 HydrophobicContact CD1-CE1 3.91Å; Y144-Y172 AromaticContact CD1-CZ 3.79Å; Y144-Y172 VanDerWaalsContact CD1-OH 3.26Å; Y144-Y172 WeakPolarHBondContact CD1-OH 3.38Å; Y144-Y172 HydrophobicContact CG-CE1 4.33Å; Y144-Y172 WeakPolarHBondContact O-CB 3.25Å; Y144-Y172 VanDerWaalsContact O-CD1 3.29Å; Y144-Y172 WeakPolarHBondContact O-CD1 3.27Å; C145-Y172 WeakPolarHBondContact O-CD2 3.37Å; C165-Y172 WeakPolarHBondContact O-CD2 3.37Å; C165-Y172 PolarHBondContact O-N 3.28Å; V167-Y172 HydrophobicContact CG2-CE1 3.61Å; V167-Y172 HydrophobicContact CG2-CE2 4.49Å; V167-Y172 VanDerWaalsContact CG2-CZ 3.47Å; V167-Y172 WeakPolarHBondContact CG2-OH 3.47Å
173A95.5Very high96.1Very high73 Ų7360 Ų6060%0.60335%0.345SS*.  trans-83.9-34.2179.400000112T171T171-A173 PolarHBondContact O-N 3.38Å
174T97Very high96.2Very high48 Ų4854.6 Ų54.629%0.29431%0.31SS..SBendtrans-73.2137.6-176.1-44.80000111.9C145 C146 E178 E179C145-T174 CarbonylContact C-O 3.49Å; C145-T174 WeakPolarHBondContact CA-O 3.08Å; C146-T174 PolarHBondContact N-O 3.46Å; T174-E178 HydrophobicContact CG2-CB 4.1Å; T174-E178 HydrophobicContact CG2-CG 4.27Å; T174-E179 HydrophobicContact CG2-CG 4.07Å; T174-E179 WeakPolarHBondContact CG2-OE1 3.04Å
175G97.9Very high96.2Very high2 Ų256.2 Ų56.22%0.02132%0.316CS..  trans-78.8150.3174.300000112.8A148 T149 I177 E178A148-G175 CarbonylContact O-C 3.54Å; A148-G175 WeakPolarHBondContact O-CA 3.41Å; T149-G175 VanDerWaalsContact C-CA 3.42Å; T149-G175 WeakPolarHBondContact O-CA 3.48Å; T149-G175 PolarHBondContact O-N 2.96Å; G175-I177 PolarHBondContact O-N 2.8Å; G175-E178 PolarHBondContact O-N 3.23Å
176C97.9Very high96.2Very high0 Ų061.9 Ų61.90%034%0.343CS..Hα-helixtrans-70.1-16.7-179.2-62.20000114.2L120 L139 C145 G147 A148 I180L120-C176 HydrophobicContact CD1-CB 4.41Å; L139-C176 HydrophobicContact CD2-CB 3.71Å; L139-C176 HydrophobicContact CG-CB 4.13Å; C145-C176 HydrophobicContact CB-CB 3.9Å; C145-C176 WeakPolarHBondContact CB-SG 3.35Å; C145-C176 WeakPolarHBondContact SG-CA 3.43Å; C145-C176 WeakPolarHBondContact SG-CB 3.21Å; C145-C176 CovalentContact SG-SG 2.04Å; C145-C176 PolarHBondContact SG-SG 3.36Å; G147-C176 VanDerWaalsContact O-CB 3.25Å; G147-C176 WeakPolarHBondContact O-CB 3.16Å; G147-C176 PolarHBondContact O-N 3.16Å; G147-C176 PolarHBondContact O-SG 3.48Å; A148-C176 PolarHBondContact O-N 2.96Å; A148-C176 VanDerWaalsContact O-N 3.08Å; C176-I180 WeakPolarHBondContact O-CB 3.36Å; C176-I180 WeakPolarHBondContact O-CG1 3.43Å; C176-I180 PolarHBondContact O-N 2.69Å
177I97.8Very high96.3Very high17 Ų1758.4 Ų58.49%0.08733%0.33CS..Hα-helixtrans-61.9-48171.4-69.2164.8000110.5Q117 L120 L121 A148 T149 G175 A181Q117-I177 HydrophobicContact CB-CD1 4.35Å; Q117-I177 HydrophobicContact CB-CG2 3.79Å; Q117-I177 HydrophobicContact CG-CD1 4.11Å; Q117-I177 HydrophobicContact CG-CG2 4.28Å; L120-I177 HydrophobicContact CB-CD1 4.11Å; L120-I177 HydrophobicContact CB-CG1 3.66Å; L120-I177 HydrophobicContact CD1-CB 4.39Å; L120-I177 HydrophobicContact CD1-CG1 3.62Å; L120-I177 HydrophobicContact CG-CG1 4.26Å; L121-I177 HydrophobicContact CD2-CD1 4.42Å; L121-I177 HydrophobicContact CG-CD1 3.96Å; A148-I177 HydrophobicContact CB-CD1 3.8Å; A148-I177 HydrophobicContact CB-CG1 4.33Å; A148-I177 WeakPolarHBondContact O-CB 3.38Å; A148-I177 WeakPolarHBondContact O-CD1 3.38Å; A148-I177 VanDerWaalsContact O-CG1 3.25Å; A148-I177 WeakPolarHBondContact O-CG1 3.33Å; A148-I177 PolarHBondContact O-N 3.16Å; T149-I177 HydrophobicContact CG2-CD1 4.04Å; G175-I177 PolarHBondContact O-N 2.8Å; I177-A181 WeakPolarHBondContact O-CB 3.5Å; I177-A181 PolarHBondContact O-N 2.94Å
178E97.5Very high96.6Very high138 Ų13854.6 Ų54.665%0.64531%0.307SS*.Hα-helixtrans-63.4-45-178.2-176171-177.800111T174 G175 G182T174-E178 HydrophobicContact CG2-CB 4.1Å; T174-E178 HydrophobicContact CG2-CG 4.27Å; G175-E178 PolarHBondContact O-N 3.23Å; E178-G182 WeakPolarHBondContact O-CA 3.16Å; E178-G182 PolarHBondContact O-N 3.19Å
179E97.3Very high96.9Very high68 Ų6855 Ų5532%0.31829%0.293SS..Hα-helixtrans-68.2-42.7-179.8-65.8-60155.300113F143 C145 T174 F183F143-E179 HydrophobicContact CB-CB 4.04Å; F143-E179 HydrophobicContact CD1-CB 4.1Å; F143-E179 HydrophobicContact CG-CB 4.46Å; C145-E179 HydrophobicContact CB-CB 4.4Å; C145-E179 HydrophobicContact CB-CG 3.87Å; T174-E179 HydrophobicContact CG2-CG 4.07Å; T174-E179 WeakPolarHBondContact CG2-OE1 3.04Å; E179-F183 VanDerWaalsContact O-CB 3.23Å; E179-F183 WeakPolarHBondContact O-CB 3.28Å; E179-F183 PolarHBondContact O-N 3.43Å
180I96.7Very high97.3Very high0 Ų049.6 Ų49.60%027%0.269CS..Hα-helixtrans-72.4-45.3-179.6-72.5-69.5000111.9L40 I47 V116 L139 F143 C176 G182 F183 A184L40-I180 HydrophobicContact CD2-CG2 4.23Å; I47-I180 HydrophobicContact CD1-CD1 4.36Å; I47-I180 HydrophobicContact CD1-CG1 4.45Å; I47-I180 HydrophobicContact CD1-CG2 3.89Å; V116-I180 HydrophobicContact CG1-CB 4.27Å; V116-I180 HydrophobicContact CG1-CG2 3.78Å; V116-I180 HydrophobicContact CG2-CG2 4.32Å; L139-I180 HydrophobicContact CD1-CD1 3.48Å; L139-I180 VanDerWaalsContact CD1-CD1 3.48Å; L139-I180 HydrophobicContact CD1-CG1 3.63Å; F143-I180 HydrophobicContact CD1-CD1 4.24Å; F143-I180 HydrophobicContact CD2-CD1 4.01Å; F143-I180 HydrophobicContact CE1-CD1 3.89Å; F143-I180 HydrophobicContact CE2-CD1 3.62Å; F143-I180 HydrophobicContact CG-CD1 4.29Å; F143-I180 HydrophobicContact CZ-CD1 3.55Å; C176-I180 WeakPolarHBondContact O-CB 3.36Å; C176-I180 WeakPolarHBondContact O-CG1 3.43Å; C176-I180 PolarHBondContact O-N 2.69Å; I180-G182 VanDerWaalsContact C-N 3.32Å; I180-F183 PolarHBondContact O-N 3.07Å; I180-A184 PolarHBondContact O-N 2.85Å
181A96.9Very high97.5Very high16 Ų1643.1 Ų43.113%0.13224%0.235CC..Hα-helixtrans-62.6-44.3175.500000110A113 I177 F183 A184 Q185A113-A181 HydrophobicContact CB-CB 4.05Å; I177-A181 WeakPolarHBondContact O-CB 3.5Å; I177-A181 PolarHBondContact O-N 2.94Å; A181-F183 PolarHBondContact O-N 2.77Å; A181-A184 PolarHBondContact O-N 3.19Å; A181-Q185 WeakPolarHBondContact O-CB 3.35Å; A181-Q185 PolarHBondContact O-N 2.85Å
182G97.3Very high97.6Very high35 Ų3541.5 Ų41.536%0.36122%0.224SC..Hα-helixtrans-59.7-43.3176.300000113.3E178 I180 Q185 Q186E178-G182 WeakPolarHBondContact O-CA 3.16Å; E178-G182 PolarHBondContact O-N 3.19Å; I180-G182 VanDerWaalsContact C-N 3.32Å; G182-Q185 WeakPolarHBondContact O-CB 3.4Å; G182-Q185 PolarHBondContact O-N 3.43Å; G182-Q186 VanDerWaalsContact O-CB 3.31Å; G182-Q186 WeakPolarHBondContact O-CB 3.24Å; G182-Q186 PolarHBondContact O-N 3.04Å
183F97.4Very high97.7Very high30 Ų3041.5 Ų41.513%0.13224%0.237CC..Hα-helixtrans-60.6-52.7174.6171.8-92.2000112.1T39 L40 F143 E179 I180 A181 Q185 Q186 Y187T39-F183 HydrophobicContact CG2-CE1 3.91Å; T39-F183 HydrophobicContact CG2-CE2 4.27Å; T39-F183 HydrophobicContact CG2-CZ 3.7Å; L40-F183 HydrophobicContact CD2-CD1 4.18Å; L40-F183 HydrophobicContact CD2-CE1 4.36Å; L40-F183 HydrophobicContact CG-CE1 4.3Å; F143-F183 HydrophobicContact CE1-CB 3.78Å; F143-F183 HydrophobicContact CE1-CD1 4.49Å; F143-F183 AromaticContact CE1-CD2 3.94Å; F143-F183 HydrophobicContact CE1-CD2 3.94Å; F143-F183 AromaticContact CE1-CG 3.82Å; F143-F183 HydrophobicContact CE1-CG 3.82Å; F143-F183 HydrophobicContact CZ-CD2 4.36Å; F143-F183 HydrophobicContact CZ-CG 4.23Å; E179-F183 VanDerWaalsContact O-CB 3.23Å; E179-F183 WeakPolarHBondContact O-CB 3.28Å; E179-F183 PolarHBondContact O-N 3.43Å; I180-F183 PolarHBondContact O-N 3.07Å; A181-F183 PolarHBondContact O-N 2.77Å; F183-Q185 VanDerWaalsContact C-N 3.28Å; F183-Q185 PolarHBondContact O-N 3.36Å; F183-Q186 PolarHBondContact O-N 2.96Å; F183-Y187 AromaticContact CD2-CD2 3.92Å; F183-Y187 HydrophobicContact CD2-CD2 3.92Å; F183-Y187 AromaticContact CD2-CE2 3.74Å; F183-Y187 HydrophobicContact CD2-CE2 3.74Å; F183-Y187 HydrophobicContact CE1-CD2 4.39Å; F183-Y187 AromaticContact CE2-CD2 3.65Å; F183-Y187 HydrophobicContact CE2-CD2 3.65Å; F183-Y187 AromaticContact CE2-CE2 3.21Å; F183-Y187 HydrophobicContact CE2-CE2 3.21Å; F183-Y187 AromaticContact CE2-CZ 3.85Å; F183-Y187 HydrophobicContact CG-CD2 4.41Å; F183-Y187 AromaticContact CZ-CD2 3.9Å; F183-Y187 HydrophobicContact CZ-CD2 3.9Å; F183-Y187 AromaticContact CZ-CE2 3.74Å; F183-Y187 HydrophobicContact CZ-CE2 3.74Å; F183-Y187 HydrophobicContact CZ-CG 4.44Å; F183-Y187 WeakPolarHBondContact O-CD2 3.48Å; F183-Y187 PolarHBondContact O-N 3.25Å
184A97.4Very high97.8Very high1 Ų139.3 Ų39.31%0.00822%0.215CC..Hα-helixtrans-62.2-39.8-179.500000111.4L40 P52 Y112 I180 A181 S188L40-A184 HydrophobicContact CD1-CB 4.41Å; P52-A184 HydrophobicContact CG-CB 4.42Å; Y112-A184 HydrophobicContact CD1-CB 3.91Å; Y112-A184 HydrophobicContact CE1-CB 3.33Å; I180-A184 PolarHBondContact O-N 2.85Å; A181-A184 PolarHBondContact O-N 3.19Å; A184-S188 WeakPolarHBondContact O-CB 3.25Å; A184-S188 PolarHBondContact O-N 3.28Å; A184-S188 PolarHBondContact O-OG 2.96Å
185Q97.6Very high97.9Very high46 Ų4637 Ų3722%0.21520%0.201CC..Hα-helixtrans-60.5-49.6175.4175.958.374.500112.3Q109 A181 G182 F183 S188 N189Q109-Q185 VanDerWaalsContact NE2-CD 3.25Å; A181-Q185 WeakPolarHBondContact O-CB 3.35Å; A181-Q185 PolarHBondContact O-N 2.85Å; G182-Q185 WeakPolarHBondContact O-CB 3.4Å; G182-Q185 PolarHBondContact O-N 3.43Å; F183-Q185 VanDerWaalsContact C-N 3.28Å; F183-Q185 PolarHBondContact O-N 3.36Å; Q185-S188 PolarHBondContact O-N 3.06Å; Q185-N189 PolarHBondContact NE2-ND2 3.07Å; Q185-N189 PolarHBondContact NE2-OD1 3.42Å; Q185-N189 WeakPolarHBondContact O-CB 3.43Å; Q185-N189 VanDerWaalsContact O-CG 3.29Å; Q185-N189 PolarHBondContact O-N 3.36Å; Q185-N189 PolarHBondContact O-ND2 2.9Å
186Q97.8Very high97.9Very high120 Ų12040.6 Ų40.656%0.56122%0.216SC*.Hα-helixtrans-63.3-48.1-178.9-177.1179.64.900111.4G182 F183 N189 I190G182-Q186 VanDerWaalsContact O-CB 3.31Å; G182-Q186 WeakPolarHBondContact O-CB 3.24Å; G182-Q186 PolarHBondContact O-N 3.04Å; F183-Q186 PolarHBondContact O-N 2.96Å; Q186-N189 PolarHBondContact O-N 3.21Å; Q186-I190 HydrophobicContact CG-CD1 4.23Å; Q186-I190 WeakPolarHBondContact O-CG1 2.95Å; Q186-I190 PolarHBondContact O-N 3.05Å; Q186-I190 VanDerWaalsContact O-N 3.11Å
187Y98.1Very high97.9Very high55 Ų5544.4 Ų44.422%0.21624%0.236CC..Hα-helixtrans-65-40.9178-88.3-103000112L32 A36 F183 N189 I190 L191L32-Y187 HydrophobicContact CD2-CE1 4.12Å; A36-Y187 HydrophobicContact CB-CD1 3.78Å; A36-Y187 HydrophobicContact CB-CE1 4.42Å; A36-Y187 HydrophobicContact CB-CG 4.18Å; F183-Y187 AromaticContact CD2-CD2 3.92Å; F183-Y187 HydrophobicContact CD2-CD2 3.92Å; F183-Y187 AromaticContact CD2-CE2 3.74Å; F183-Y187 HydrophobicContact CD2-CE2 3.74Å; F183-Y187 HydrophobicContact CE1-CD2 4.39Å; F183-Y187 AromaticContact CE2-CD2 3.65Å; F183-Y187 HydrophobicContact CE2-CD2 3.65Å; F183-Y187 AromaticContact CE2-CE2 3.21Å; F183-Y187 HydrophobicContact CE2-CE2 3.21Å; F183-Y187 AromaticContact CE2-CZ 3.85Å; F183-Y187 HydrophobicContact CG-CD2 4.41Å; F183-Y187 AromaticContact CZ-CD2 3.9Å; F183-Y187 HydrophobicContact CZ-CD2 3.9Å; F183-Y187 AromaticContact CZ-CE2 3.74Å; F183-Y187 HydrophobicContact CZ-CE2 3.74Å; F183-Y187 HydrophobicContact CZ-CG 4.44Å; F183-Y187 WeakPolarHBondContact O-CD2 3.48Å; F183-Y187 PolarHBondContact O-N 3.25Å; Y187-N189 PolarHBondContact O-N 3.23Å; Y187-I190 PolarHBondContact O-N 2.73Å; Y187-L191 WeakPolarHBondContact O-CB 3.46Å; Y187-L191 WeakPolarHBondContact O-CG 3.5Å; Y187-L191 PolarHBondContact O-N 2.87Å
188S98.4Very high97.9Very high6 Ų643.6 Ų43.64%0.04223%0.232CC..Hα-helixtrans-60.7-45.5176-62.60000111.1A184 Q185 I190 L191 I192A184-S188 WeakPolarHBondContact O-CB 3.25Å; A184-S188 PolarHBondContact O-N 3.28Å; A184-S188 PolarHBondContact O-OG 2.96Å; Q185-S188 PolarHBondContact O-N 3.06Å; S188-I190 PolarHBondContact O-N 2.77Å; S188-L191 PolarHBondContact O-N 3.11Å; S188-I192 WeakPolarHBondContact O-CB 3.4Å; S188-I192 WeakPolarHBondContact O-CD1 3.31Å; S188-I192 WeakPolarHBondContact O-CG1 3.02Å; S188-I192 PolarHBondContact O-N 2.96Å
189N98.5Very high98Very high81 Ų8137.3 Ų37.343%0.43320%0.204SC..Hα-helixtrans-60.7-44177.8-76.6-15.8000113.1Q109 Q185 Q186 Y187 L191 I192 G193Q109-N189 PolarHBondContact OE1-OD1 3.29Å; Q109-N189 VanDerWaalsContact OE1-OD1 3.13Å; Q185-N189 PolarHBondContact NE2-ND2 3.07Å; Q185-N189 PolarHBondContact NE2-OD1 3.42Å; Q185-N189 WeakPolarHBondContact O-CB 3.43Å; Q185-N189 VanDerWaalsContact O-CG 3.29Å; Q185-N189 PolarHBondContact O-N 3.36Å; Q185-N189 PolarHBondContact O-ND2 2.9Å; Q186-N189 PolarHBondContact O-N 3.21Å; Y187-N189 PolarHBondContact O-N 3.23Å; N189-L191 VanDerWaalsContact C-N 3.33Å; N189-L191 PolarHBondContact O-N 3.39Å; N189-I192 PolarHBondContact O-N 3.26Å; N189-G193 PolarHBondContact O-N 3.26Å
190I98.6Very high98Very high80 Ų8039.4 Ų39.441%0.4122%0.216SC..Hα-helixtrans-60.4-46.8176.4-68.2167000109.9L32 Q186 Y187 S188 G193 L194L32-I190 HydrophobicContact CD1-CG2 4Å; Q186-I190 HydrophobicContact CG-CD1 4.23Å; Q186-I190 WeakPolarHBondContact O-CG1 2.95Å; Q186-I190 PolarHBondContact O-N 3.05Å; Q186-I190 VanDerWaalsContact O-N 3.11Å; Y187-I190 PolarHBondContact O-N 2.73Å; S188-I190 PolarHBondContact O-N 2.77Å; I190-G193 PolarHBondContact O-N 2.52Å; I190-L194 HydrophobicContact CG2-CD1 4.17Å; I190-L194 WeakPolarHBondContact O-CG 3.32Å; I190-L194 PolarHBondContact O-N 2.8Å
191L98.7Very high98Very high0 Ų042.6 Ų42.60%023%0.232CC..Hα-helixtrans-66.7-40.9179.7-72172.4000112.7M29 L32 I54 F55 V58 Y187 S188 N189 G193 L194 C195M29-L191 HydrophobicContact CG-CD2 4.5Å; L32-L191 HydrophobicContact CB-CD2 3.94Å; L32-L191 HydrophobicContact CD1-CD2 4.39Å; I54-L191 HydrophobicContact CD1-CB 3.7Å; I54-L191 HydrophobicContact CG1-CB 4.19Å; F55-L191 HydrophobicContact CD1-CD1 3.53Å; F55-L191 HydrophobicContact CE1-CD1 3.75Å; V58-L191 HydrophobicContact CB-CD2 4.37Å; V58-L191 HydrophobicContact CG1-CB 4.48Å; V58-L191 HydrophobicContact CG1-CD2 4.34Å; V58-L191 HydrophobicContact CG2-CD1 3.77Å; V58-L191 HydrophobicContact CG2-CD2 3.94Å; V58-L191 HydrophobicContact CG2-CG 4.44Å; Y187-L191 WeakPolarHBondContact O-CB 3.46Å; Y187-L191 WeakPolarHBondContact O-CG 3.5Å; Y187-L191 PolarHBondContact O-N 2.87Å; S188-L191 PolarHBondContact O-N 3.11Å; N189-L191 VanDerWaalsContact C-N 3.33Å; N189-L191 PolarHBondContact O-N 3.39Å; L191-G193 VanDerWaalsContact C-N 3.3Å; L191-G193 PolarHBondContact O-N 3.37Å; L191-L194 HydrophobicContact CD2-CD1 4.48Å; L191-L194 PolarHBondContact O-N 3.39Å; L191-C195 WeakPolarHBondContact O-CB 2.97Å; L191-C195 PolarHBondContact O-N 3.22Å; L191-C195 PolarHBondContact O-SG 3.21Å; L191-C195 VanDerWaalsContact O-SG 3.34Å
192I98.7Very high98.1Very high14 Ų1441.9 Ų41.97%0.07223%0.226CC..Hα-helixtrans-55.9-47.9173.9-72.7160.8000109.9I54 A102 A105 V106 S188 N189 L194 C195 F196I54-I192 HydrophobicContact CD1-CG1 3.66Å; A102-I192 HydrophobicContact CB-CG2 4.35Å; A105-I192 HydrophobicContact CB-CD1 3.82Å; A105-I192 HydrophobicContact CB-CG1 3.85Å; V106-I192 HydrophobicContact CG2-CD1 3.84Å; V106-I192 HydrophobicContact CG2-CG1 4.45Å; V106-I192 HydrophobicContact CG2-CG2 4Å; S188-I192 WeakPolarHBondContact O-CB 3.4Å; S188-I192 WeakPolarHBondContact O-CD1 3.31Å; S188-I192 WeakPolarHBondContact O-CG1 3.02Å; S188-I192 PolarHBondContact O-N 2.96Å; N189-I192 PolarHBondContact O-N 3.26Å; I192-L194 PolarHBondContact O-N 3.12Å; I192-C195 PolarHBondContact O-N 3.25Å; I192-F196 HydrophobicContact CG2-CD2 3.78Å; I192-F196 HydrophobicContact CG2-CE2 3.66Å; I192-F196 WeakPolarHBondContact O-CD2 3.3Å; I192-F196 PolarHBondContact O-N 3.02Å
193G98.5Very high98Very high41 Ų4141.8 Ų41.842%0.42323%0.225SC..Hα-helixtrans-59.8-45.2176.700000112.7N189 I190 L191 F196 L197N189-G193 PolarHBondContact O-N 3.26Å; I190-G193 PolarHBondContact O-N 2.52Å; L191-G193 VanDerWaalsContact C-N 3.3Å; L191-G193 PolarHBondContact O-N 3.37Å; G193-F196 PolarHBondContact O-N 3.17Å; G193-L197 VanDerWaalsContact O-CB 3.31Å; G193-L197 WeakPolarHBondContact O-CB 3.38Å; G193-L197 PolarHBondContact O-N 3.41Å
194L98.6Very high98Very high27 Ų2744.6 Ų44.614%0.14125%0.245CC..Hα-helixtrans-64.2-41.4176.3-70.5174.2000112.4F25 I28 M29 L32 I190 L191 I192 L197 T198F25-L194 HydrophobicContact CD1-CD2 4.07Å; F25-L194 HydrophobicContact CE1-CD2 4.26Å; I28-L194 HydrophobicContact CG2-CD1 3.87Å; M29-L194 HydrophobicContact CG-CB 4Å; M29-L194 HydrophobicContact CG-CD1 4.14Å; M29-L194 HydrophobicContact SD-CB 4.12Å; L32-L194 HydrophobicContact CD1-CD1 4.01Å; I190-L194 HydrophobicContact CG2-CD1 4.17Å; I190-L194 WeakPolarHBondContact O-CG 3.32Å; I190-L194 PolarHBondContact O-N 2.8Å; L191-L194 HydrophobicContact CD2-CD1 4.48Å; L191-L194 PolarHBondContact O-N 3.39Å; I192-L194 PolarHBondContact O-N 3.12Å; L194-L197 PolarHBondContact O-N 2.03Å; L194-T198 WeakPolarHBondContact O-CB 3.29Å; L194-T198 VanDerWaalsContact O-CG2 3.23Å; L194-T198 WeakPolarHBondContact O-CG2 3.44Å; L194-T198 PolarHBondContact O-N 3.08Å; L194-T198 PolarHBondContact O-OG1 3.19Å
195C98.7Very high97.9Very high0 Ų045.1 Ų45.10%025%0.247CC..Hα-helixtrans-61-47.2176.4-75.60000111.8N98 A102 L191 I192 T198 A199N98-C195 HydrophobicContact CB-CB 4.06Å; A102-C195 HydrophobicContact CB-CB 3.9Å; L191-C195 WeakPolarHBondContact O-CB 2.97Å; L191-C195 PolarHBondContact O-N 3.22Å; L191-C195 PolarHBondContact O-SG 3.21Å; L191-C195 VanDerWaalsContact O-SG 3.34Å; I192-C195 PolarHBondContact O-N 3.25Å; C195-T198 PolarHBondContact O-OG1 3.39Å; C195-T198 VanDerWaalsContact O-OG1 3.07Å; C195-A199 WeakPolarHBondContact O-CB 3.4Å; C195-A199 PolarHBondContact O-N 3.15Å
196F98.5Very high97.9Very high78 Ų7844 Ų4434%0.34224%0.242SC..Hα-helixtrans-66.3-43.9176.8-77.6-57000112.5A102 I103 I192 G193 A199 I200A102-F196 HydrophobicContact CB-CD1 4.31Å; A102-F196 HydrophobicContact CB-CD2 3.94Å; A102-F196 HydrophobicContact CB-CE1 3.97Å; A102-F196 HydrophobicContact CB-CE2 3.58Å; A102-F196 HydrophobicContact CB-CG 4.3Å; A102-F196 HydrophobicContact CB-CZ 3.59Å; I103-F196 HydrophobicContact CG1-CE1 4.44Å; I103-F196 HydrophobicContact CG1-CZ 4.14Å; I192-F196 HydrophobicContact CG2-CD2 3.78Å; I192-F196 HydrophobicContact CG2-CE2 3.66Å; I192-F196 WeakPolarHBondContact O-CD2 3.3Å; I192-F196 PolarHBondContact O-N 3.02Å; G193-F196 PolarHBondContact O-N 3.17Å; F196-A199 PolarHBondContact O-N 3.35Å; F196-I200 VanDerWaalsContact O-CG1 3.29Å; F196-I200 WeakPolarHBondContact O-CG1 3.12Å; F196-I200 PolarHBondContact O-N 2.51Å
197L98.2Very high97.7Very high79 Ų7940.1 Ų40.141%0.41423%0.234SC..Hα-helixtrans-59.9-49.8178.5176.861.2000111.2F25 G193 L194 I200 L201F25-L197 HydrophobicContact CE1-CD2 3.95Å; F25-L197 HydrophobicContact CZ-CD2 4.02Å; G193-L197 VanDerWaalsContact O-CB 3.31Å; G193-L197 WeakPolarHBondContact O-CB 3.38Å; G193-L197 PolarHBondContact O-N 3.41Å; L194-L197 PolarHBondContact O-N 2.03Å; L197-I200 PolarHBondContact O-N 3.36Å; L197-L201 HydrophobicContact CD1-CD1 4.14Å; L197-L201 HydrophobicContact CD1-CG 4.37Å; L197-L201 HydrophobicContact CG-CD1 4.19Å; L197-L201 WeakPolarHBondContact O-CG 3.45Å; L197-L201 PolarHBondContact O-N 2.88Å
198T97.7Very high97.4Very high1 Ų140.3 Ų40.31%0.00624%0.239CC..Hα-helixtrans-64.3-41.6178.953.60000111.7F25 M29 N98 L194 C195 I200 L201 Q202F25-T198 HydrophobicContact CB-CG2 3.5Å; F25-T198 VanDerWaalsContact CB-CG2 3.5Å; F25-T198 HydrophobicContact CD1-CG2 4.27Å; F25-T198 HydrophobicContact CD2-CG2 4.38Å; F25-T198 HydrophobicContact CG-CG2 3.83Å; M29-T198 HydrophobicContact CE-CG2 4.05Å; M29-T198 HydrophobicContact SD-CG2 4.41Å; N98-T198 PolarHBondContact ND2-OG1 3.25Å; L194-T198 WeakPolarHBondContact O-CB 3.29Å; L194-T198 VanDerWaalsContact O-CG2 3.23Å; L194-T198 WeakPolarHBondContact O-CG2 3.44Å; L194-T198 PolarHBondContact O-N 3.08Å; L194-T198 PolarHBondContact O-OG1 3.19Å; C195-T198 PolarHBondContact O-OG1 3.39Å; C195-T198 VanDerWaalsContact O-OG1 3.07Å; T198-I200 PolarHBondContact O-N 2.94Å; T198-L201 PolarHBondContact O-N 2.66Å; T198-Q202 VanDerWaalsContact O-CB 3.29Å; T198-Q202 WeakPolarHBondContact O-CB 3.25Å; T198-Q202 VanDerWaalsContact O-CG 3.24Å; T198-Q202 WeakPolarHBondContact O-CG 3.41Å; T198-Q202 PolarHBondContact O-N 2.98Å
199A98.2Very high97.1Very high6 Ų640.5 Ų40.55%0.0524%0.24CC..Hα-helixtrans-62.3-40.1177.200000112.9T95 N98 I99 C195 F196 G203T95-A199 HydrophobicContact CG2-CB 4.13Å; N98-A199 HydrophobicContact CB-CB 4.38Å; I99-A199 HydrophobicContact CD1-CB 4.22Å; I99-A199 HydrophobicContact CG1-CB 3.7Å; C195-A199 WeakPolarHBondContact O-CB 3.4Å; C195-A199 PolarHBondContact O-N 3.15Å; F196-A199 PolarHBondContact O-N 3.35Å; A199-G203 PolarHBondContact O-N 2.84Å
200I98.1Very high96.7Very high111 Ų11140.8 Ų40.857%0.56924%0.24SC*.Hα-helixtrans-64.8-48.8175.4-68.6165.4000110.4F196 L197 T198 Q202 G203 V204F196-I200 VanDerWaalsContact O-CG1 3.29Å; F196-I200 WeakPolarHBondContact O-CG1 3.12Å; F196-I200 PolarHBondContact O-N 2.51Å; L197-I200 PolarHBondContact O-N 3.36Å; T198-I200 PolarHBondContact O-N 2.94Å; I200-Q202 PolarHBondContact O-N 3.48Å; I200-G203 PolarHBondContact O-N 2.82Å; I200-V204 WeakPolarHBondContact O-CG2 3.21Å; I200-V204 PolarHBondContact O-N 3.45Å
201L97.3Very high96.3Very high68 Ų6843.3 Ų43.336%0.35625%0.245SC..Hα-helixtrans-62.4-43.9-179.7-67.7174.1000111.9F22 F25 L197 T198 Y205F22-L201 HydrophobicContact CE1-CB 3.92Å; F25-L201 HydrophobicContact CE2-CD1 4.14Å; L197-L201 HydrophobicContact CD1-CD1 4.14Å; L197-L201 HydrophobicContact CD1-CG 4.37Å; L197-L201 HydrophobicContact CG-CD1 4.19Å; L197-L201 WeakPolarHBondContact O-CG 3.45Å; L197-L201 PolarHBondContact O-N 2.88Å; T198-L201 PolarHBondContact O-N 2.66Å; L201-Y205 WeakPolarHBondContact O-CB 3.48Å; L201-Y205 PolarHBondContact O-N 2.93Å
202Q97.2Very high95.8Very high1 Ų145.7 Ų45.71%0.00526%0.256CS..Hα-helixtrans-66.3-43.7175.9-71.5173.4-17.900111.4F22 L91 T95 T198 I200 V204 Y205 L206F22-Q202 HydrophobicContact CD1-CG 4.05Å; F22-Q202 HydrophobicContact CD2-CG 4.47Å; F22-Q202 HydrophobicContact CE1-CG 3.67Å; F22-Q202 HydrophobicContact CE2-CG 4.12Å; F22-Q202 HydrophobicContact CG-CG 4.45Å; F22-Q202 HydrophobicContact CZ-CB 4.32Å; F22-Q202 HydrophobicContact CZ-CG 3.71Å; L91-Q202 HydrophobicContact CD2-CG 4.48Å; T95-Q202 VanDerWaalsContact OG1-CB 3.22Å; T95-Q202 WeakPolarHBondContact OG1-CB 3.37Å; T95-Q202 PolarHBondContact OG1-OE1 3.38Å; T95-Q202 VanDerWaalsContact OG1-OE1 3.06Å; T198-Q202 VanDerWaalsContact O-CB 3.29Å; T198-Q202 WeakPolarHBondContact O-CB 3.25Å; T198-Q202 VanDerWaalsContact O-CG 3.24Å; T198-Q202 WeakPolarHBondContact O-CG 3.41Å; T198-Q202 PolarHBondContact O-N 2.98Å; I200-Q202 PolarHBondContact O-N 3.48Å; Q202-V204 PolarHBondContact O-N 3.4Å; Q202-Y205 PolarHBondContact O-N 3.32Å; Q202-L206 WeakPolarHBondContact O-CB 3.33Å; Q202-L206 WeakPolarHBondContact O-CG 3.38Å; Q202-L206 PolarHBondContact O-N 3.25Å
203G96.9Very high95.1Very high33 Ų3348.3 Ų48.334%0.3427%0.27SS..Hα-helixtrans-59.5-44.9177.800000112.8A199 I200 L206 G207A199-G203 PolarHBondContact O-N 2.84Å; I200-G203 PolarHBondContact O-N 2.82Å; G203-L206 PolarHBondContact O-N 3.15Å; G203-G207 PolarHBondContact O-N 3.31Å
204V96.6Very high94.6Very high89 Ų8954.7 Ų54.754%0.53928%0.281SS..Hα-helixtrans-62.8-47.1174.8171.80000110.9I200 Q202 L206 G207 I208I200-V204 WeakPolarHBondContact O-CG2 3.21Å; I200-V204 PolarHBondContact O-N 3.45Å; Q202-V204 PolarHBondContact O-N 3.4Å; V204-L206 PolarHBondContact O-N 3.5Å; V204-G207 PolarHBondContact O-N 2.98Å; V204-I208 HydrophobicContact CG1-CD1 3.85Å; V204-I208 WeakPolarHBondContact O-CG1 3.45Å; V204-I208 PolarHBondContact O-N 2.85Å
205Y96Very high93.9Very high11 Ų1157.5 Ų57.54%0.04329%0.292CS..Hα-helixtrans-60.5-44.1178.2169.3-95000112.7F15 V18 N19 F22 H87 M88 L91 L201 Q202 I208 S209F15-Y205 HydrophobicContact CD2-CE2 4.07Å; F15-Y205 WeakPolarHBondContact CD2-OH 3.34Å; F15-Y205 WeakPolarHBondContact CE2-OH 3.12Å; V18-Y205 HydrophobicContact CB-CD2 4.46Å; V18-Y205 HydrophobicContact CG1-CD2 3.73Å; V18-Y205 HydrophobicContact CG1-CE2 4.3Å; V18-Y205 HydrophobicContact CG1-CG 4.13Å; N19-Y205 PolarHBondContact ND2-OH 2.87Å; F22-Y205 AromaticContact CE2-CD1 3.88Å; F22-Y205 HydrophobicContact CE2-CD1 3.88Å; F22-Y205 HydrophobicContact CE2-CE1 4.34Å; F22-Y205 AromaticContact CE2-CG 3.96Å; F22-Y205 HydrophobicContact CE2-CG 3.96Å; F22-Y205 HydrophobicContact CZ-CD1 4.38Å; F22-Y205 HydrophobicContact CZ-CG 4.13Å; H87-Y205 AromaticContact NE2-CE1 3.4Å; H87-Y205 WeakPolarHBondContact NE2-CE1 3.46Å; H87-Y205 AromaticContact NE2-CZ 3.54Å; H87-Y205 PolarHBondContact NE2-OH 3.27Å; M88-Y205 HydrophobicContact SD-CE1 4.22Å; L91-Y205 HydrophobicContact CD1-CD1 3.84Å; L91-Y205 HydrophobicContact CD1-CE1 3.58Å; L201-Y205 WeakPolarHBondContact O-CB 3.48Å; L201-Y205 PolarHBondContact O-N 2.93Å; Q202-Y205 PolarHBondContact O-N 3.32Å; Y205-I208 PolarHBondContact O-N 2.96Å; Y205-S209 WeakPolarHBondContact O-CB 3.29Å; Y205-S209 PolarHBondContact O-N 2.99Å; Y205-S209 PolarHBondContact O-OG 3.46Å
206L95.9Very high93.1Very high22 Ų2261 Ų6112%0.11532%0.317CS..Hα-helixtrans-63.5-44.1176.9-71.8172.4000110.6M88 L91 Q202 G203 V204 S209 I210M88-L206 HydrophobicContact CB-CD2 4.31Å; M88-L206 HydrophobicContact CE-CB 4.23Å; M88-L206 HydrophobicContact CE-CD2 3.33Å; M88-L206 HydrophobicContact CE-CG 4.38Å; M88-L206 HydrophobicContact SD-CD2 3.51Å; M88-L206 VanDerWaalsContact SD-CD2 3.51Å; L91-L206 HydrophobicContact CB-CD1 4.43Å; L91-L206 HydrophobicContact CB-CD2 4.05Å; Q202-L206 WeakPolarHBondContact O-CB 3.33Å; Q202-L206 WeakPolarHBondContact O-CG 3.38Å; Q202-L206 PolarHBondContact O-N 3.25Å; G203-L206 PolarHBondContact O-N 3.15Å; V204-L206 PolarHBondContact O-N 3.5Å; L206-S209 PolarHBondContact O-N 3.23Å; L206-I210 WeakPolarHBondContact O-CB 3.34Å; L206-I210 VanDerWaalsContact O-CG1 3.27Å; L206-I210 WeakPolarHBondContact O-CG1 3.17Å; L206-I210 PolarHBondContact O-N 2.73Å
207G94.5Very high92.3Very high39 Ų3961.5 Ų61.540%0.40232%0.323SS..Hα-helixtrans-59.6-46.5177.100000112.9G203 V204 W211G203-G207 PolarHBondContact O-N 3.31Å; V204-G207 PolarHBondContact O-N 2.98Å; G207-W211 VanDerWaalsContact O-CB 3.29Å; G207-W211 WeakPolarHBondContact O-CB 3.37Å; G207-W211 PolarHBondContact O-N 3.1Å
208I92.5Very high91.4Very high60 Ų6063.1 Ų63.131%0.30833%0.332SS..Hα-helixtrans-64.2-43.3176.3-64167.5000110.7W11 V204 Y205 W211 M212W11-I208 HydrophobicContact CH2-CB 4.34Å; W11-I208 HydrophobicContact CH2-CG2 3.56Å; W11-I208 HydrophobicContact CZ3-CG2 3.55Å; V204-I208 HydrophobicContact CG1-CD1 3.85Å; V204-I208 WeakPolarHBondContact O-CG1 3.45Å; V204-I208 PolarHBondContact O-N 2.85Å; Y205-I208 PolarHBondContact O-N 2.96Å; I208-W211 PolarHBondContact O-N 3.45Å; I208-M212 HydrophobicContact CG2-CE 4.12Å; I208-M212 WeakPolarHBondContact O-CG 3.3Å; I208-M212 PolarHBondContact O-N 3.03Å
209S90.6Very high90.2Very high10 Ų1065.1 Ų65.17%0.0735%0.353CS..Hα-helixtrans-62.4-46.5-179.8-62.10000112M88 Y205 L206 M212 I213M88-S209 VanDerWaalsContact CE-CB 3.5Å; Y205-S209 WeakPolarHBondContact O-CB 3.29Å; Y205-S209 PolarHBondContact O-N 2.99Å; Y205-S209 PolarHBondContact O-OG 3.46Å; L206-S209 PolarHBondContact O-N 3.23Å; S209-M212 PolarHBondContact O-N 3.37Å; S209-I213 WeakPolarHBondContact O-CG1 3.49Å; S209-I213 PolarHBondContact O-N 2.84Å; S209-I213 VanDerWaalsContact O-N 3.11Å
210I91.5Very high88.7Confident86 Ų8669.2 Ų69.244%0.44138%0.377SS..Hα-helixtrans-62.5-43.9175.4-68.3166.1000110.6M88 L206 M212 I213 R214M88-I210 HydrophobicContact CE-CD1 4.4Å; M88-I210 HydrophobicContact CE-CG1 3.84Å; L206-I210 WeakPolarHBondContact O-CB 3.34Å; L206-I210 VanDerWaalsContact O-CG1 3.27Å; L206-I210 WeakPolarHBondContact O-CG1 3.17Å; L206-I210 PolarHBondContact O-N 2.73Å; I210-M212 VanDerWaalsContact C-N 3.34Å; I210-M212 PolarHBondContact O-N 3.13Å; I210-I213 PolarHBondContact O-N 3.08Å; I210-R214 HydrophobicContact CG2-CG 4.41Å; I210-R214 WeakPolarHBondContact O-CG 3.36Å; I210-R214 PolarHBondContact O-N 3.43Å
211W90.3Very high86.7Confident134 Ų13467.3 Ų67.351%0.50838%0.378SS..Hα-helixtrans-59.6-42.4179.217675.5000112.5G207 I208 K215G207-W211 VanDerWaalsContact O-CB 3.29Å; G207-W211 WeakPolarHBondContact O-CB 3.37Å; G207-W211 PolarHBondContact O-N 3.1Å; I208-W211 PolarHBondContact O-N 3.45Å; W211-K215 HydrophobicContact CH2-CD 4.39Å; W211-K215 HydrophobicContact CZ2-CD 4.36Å; W211-K215 WeakPolarHBondContact O-CB 3.43Å; W211-K215 PolarHBondContact O-N 3.42Å
212M86.7Confident84.7Confident49 Ų4973.1 Ų73.124%0.24140%0.401CS..Hα-helixtrans-69.7-37.3176.9-64.6-175-66.900113.1W11 I208 S209 I210 K215 S216W11-M212 HydrophobicContact CD2-CE 3.61Å; W11-M212 HydrophobicContact CD2-SD 3.84Å; W11-M212 HydrophobicContact CE3-CE 3.93Å; W11-M212 HydrophobicContact CE3-SD 4Å; W11-M212 HydrophobicContact CG-CE 4.42Å; W11-M212 HydrophobicContact CG-SD 4.36Å; W11-M212 HydrophobicContact CH2-CE 3.41Å; W11-M212 VanDerWaalsContact CH2-CE 3.41Å; W11-M212 HydrophobicContact CH2-SD 4.44Å; W11-M212 HydrophobicContact CZ2-CE 3.02Å; W11-M212 HydrophobicContact CZ2-SD 4.3Å; W11-M212 HydrophobicContact CZ3-CE 3.84Å; W11-M212 HydrophobicContact CZ3-SD 4.29Å; I208-M212 HydrophobicContact CG2-CE 4.12Å; I208-M212 WeakPolarHBondContact O-CG 3.3Å; I208-M212 PolarHBondContact O-N 3.03Å; S209-M212 PolarHBondContact O-N 3.37Å; I210-M212 VanDerWaalsContact C-N 3.34Å; I210-M212 PolarHBondContact O-N 3.13Å; M212-K215 PolarHBondContact O-N 2.76Å; M212-S216 PolarHBondContact O-N 3.49Å
213I86Confident83.1Confident70 Ų7077.7 Ų77.736%0.35943%0.433SS..Hα-helixtrans-60.6-49.2176.4-69.4166.9000109.5S209 I210 K215 S216 D217S209-I213 WeakPolarHBondContact O-CG1 3.49Å; S209-I213 PolarHBondContact O-N 2.84Å; S209-I213 VanDerWaalsContact O-N 3.11Å; I210-I213 PolarHBondContact O-N 3.08Å; I213-K215 PolarHBondContact O-N 3.18Å; I213-S216 WeakPolarHBondContact O-CB 3.42Å; I213-S216 PolarHBondContact O-N 3.14Å; I213-S216 VanDerWaalsContact O-N 3.07Å; I213-D217 PolarHBondContact O-N 3.35Å
214R86.9Confident81.1Confident174 Ų17482.7 Ų82.766%0.65747%0.471SS*.Hα-helixtrans-60.1-44.2178.4-66.6178.786.1165.48.1112.3I210 S216 D217 D218I210-R214 HydrophobicContact CG2-CG 4.41Å; I210-R214 WeakPolarHBondContact O-CG 3.36Å; I210-R214 PolarHBondContact O-N 3.43Å; R214-S216 VanDerWaalsContact C-N 3.25Å; R214-S216 PolarHBondContact O-N 2.95Å; R214-D217 PolarHBondContact O-N 3.09Å; R214-D217 VanDerWaalsContact O-N 3.14Å; R214-D218 VanDerWaalsContact O-CG 3.29Å; R214-D218 PolarHBondContact O-N 3.16Å
215K84.4Confident80.3Confident86 Ų8682.4 Ų82.437%0.37447%0.468SS..Hα-helixtrans-61.3-34176.1-176.7-179.1174.7-171.70112.7W211 M212 I213 G219W211-K215 HydrophobicContact CH2-CD 4.39Å; W211-K215 HydrophobicContact CZ2-CD 4.36Å; W211-K215 WeakPolarHBondContact O-CB 3.43Å; W211-K215 PolarHBondContact O-N 3.42Å; M212-K215 PolarHBondContact O-N 2.76Å; I213-K215 PolarHBondContact O-N 3.18Å; K215-G219 PolarHBondContact O-N 2.93Å
216S81.9Confident79.5Confident75 Ų7586.1 Ų86.152%0.52449%0.49SS..Hα-helixtrans-68.4-42174.8-171.90000111.4M212 I213 R214 G219 V220M212-S216 PolarHBondContact O-N 3.49Å; I213-S216 WeakPolarHBondContact O-CB 3.42Å; I213-S216 PolarHBondContact O-N 3.14Å; I213-S216 VanDerWaalsContact O-N 3.07Å; R214-S216 VanDerWaalsContact C-N 3.25Å; R214-S216 PolarHBondContact O-N 2.95Å; S216-G219 PolarHBondContact O-N 2.89Å; S216-V220 WeakPolarHBondContact O-CG2 3.5Å; S216-V220 PolarHBondContact O-N 3.12Å
217D80.5Confident78.6Confident87 Ų8789.7 Ų89.747%0.46551%0.511SS..Hα-helixtrans-68-42.5179.3-65.8-23.4000111.5I213 R214 G219 V220 A221I213-D217 PolarHBondContact O-N 3.35Å; R214-D217 PolarHBondContact O-N 3.09Å; R214-D217 VanDerWaalsContact O-N 3.14Å; D217-G219 VanDerWaalsContact C-N 3.28Å; D217-G219 PolarHBondContact O-N 3.08Å; D217-V220 PolarHBondContact O-N 3.12Å; D217-A221 PolarHBondContact O-N 2.78Å
218D80Confident77.7Confident113 Ų11392.6 Ų92.660%0.60452%0.517SS*.Hα-helixtrans-60.8-37.4174.5-65.7-23.9000112R214 A221 F222R214-D218 VanDerWaalsContact O-CG 3.29Å; R214-D218 PolarHBondContact O-N 3.16Å; D218-A221 PolarHBondContact O-N 3.26Å; D218-F222 PolarHBondContact O-N 3.03Å; D218-F222 VanDerWaalsContact O-N 3.07Å
219G71.8Confident76.7Confident43 Ų4394.7 Ų94.744%0.44353%0.53SS..Hα-helixtrans-65.1-37.5176.800000112.9K215 S216 D217 S223K215-G219 PolarHBondContact O-N 2.93Å; S216-G219 PolarHBondContact O-N 2.89Å; D217-G219 VanDerWaalsContact C-N 3.28Å; D217-G219 PolarHBondContact O-N 3.08Å; G219-S223 PolarHBondContact O-N 3.49Å; G219-S223 PolarHBondContact O-OG 3.03Å
220V66.9Low75.8Confident92 Ų92100.3 Ų100.356%0.55856%0.561SS**Hα-helixtrans-68.2-43.1174174.20000110.4S216 D217 F222 S223 A224S216-V220 WeakPolarHBondContact O-CG2 3.5Å; S216-V220 PolarHBondContact O-N 3.12Å; D217-V220 PolarHBondContact O-N 3.12Å; V220-F222 VanDerWaalsContact C-N 3.32Å; V220-F222 PolarHBondContact O-N 3.28Å; V220-S223 WeakPolarHBondContact CA-OG 3.25Å; V220-S223 PolarHBondContact O-N 3.21Å; V220-S223 VanDerWaalsContact O-N 3.12Å; V220-S223 PolarHBondContact O-OG 3.34Å; V220-A224 PolarHBondContact O-N 3.21Å
221A57Low74.7Confident72 Ų72101.4 Ų101.460%0.59557%0.57SS**Hα-helixtrans-63.7-32179.600000113.8D217 D218D217-A221 PolarHBondContact O-N 2.78Å; D218-A221 PolarHBondContact O-N 3.26Å
222F55Low73.5Confident190 Ų19098.8 Ų98.883%0.83357%0.574SS**Hα-helixtrans-79.2-19.5174.9-174.2-97.5000113.4D218 V220D218-F222 PolarHBondContact O-N 3.03Å; D218-F222 VanDerWaalsContact O-N 3.07Å; V220-F222 VanDerWaalsContact C-N 3.32Å; V220-F222 PolarHBondContact O-N 3.28Å
223S64.7Low72.4Confident96 Ų96103 Ų10367%0.67160%0.602SS**Hα-helixtrans-91-11.1-179.665.80000114.8G219 V220G219-S223 PolarHBondContact O-N 3.49Å; G219-S223 PolarHBondContact O-OG 3.03Å; V220-S223 WeakPolarHBondContact CA-OG 3.25Å; V220-S223 PolarHBondContact O-N 3.21Å; V220-S223 VanDerWaalsContact O-N 3.12Å; V220-S223 PolarHBondContact O-OG 3.34Å
224A53.9Low71.2Confident138 Ų138106 Ų106100%1.14162%0.624SS**  trans-95.40176.600000110.7V220V220-A224 PolarHBondContact O-N 3.21Å

Retrieved 224 of 224 residues in 51.6 ms (Link to these results)

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