G4VC95_SCHMA Loading...

CAAX prenyl protease

Proteolytically removes the C-terminal three residues of farnesylated proteins.

AlphaFold DB , UniProt , Accession G4VC95, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 473 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
1M39.2Very low59.9Low232 Ų232107.8 Ų107.8100%1.14357%0.565SS**  0123.40-87.8169.2170.300107.2
2G43.6Very low61Low46 Ų46104.3 Ų104.347%0.47457%0.574SS.*PPolyproline II helixtrans-59.7146.7165.500000109
3L49.2Very low61.7Low160 Ų160109.7 Ų109.784%0.83858%0.582SS**PPolyproline II helixtrans-55.7129.4174.3-77.5160.8000108V5L3-V5 PolarHBondContact O-N 2.71Å
4P58.6Low62.5Low64 Ų64112.1 Ų112.142%0.41659%0.586SS.*PPolyproline II helixtrans-66.1133.8-176.229.8-36.5000109.2V6 T16P4-V6 PolarHBondContact O-N 3.3Å; P4-T16 HydrophobicContact CB-CG2 3.45Å; P4-T16 VanDerWaalsContact CB-CG2 3.45Å; P4-T16 HydrophobicContact CG-CG2 3.61Å
5V60.8Low63.2Low44 Ų44105.9 Ų105.927%0.26755%0.553SS.*  trans-58.8113.6179.9175.40000109L3 L7 T16 L17 D368L3-V5 PolarHBondContact O-N 2.71Å; V5-L7 PolarHBondContact O-N 3.06Å; V5-T16 VanDerWaalsContact O-CA 3.23Å; V5-T16 WeakPolarHBondContact O-CA 3.29Å; V5-L17 PolarHBondContact O-N 3.32Å; V5-D368 HydrophobicContact CG2-CB 3.36Å
6V61.7Low64.5Low58 Ų58100.6 Ų100.635%0.35253%0.526SS..EExtended strand (participates in β ladder)trans-81.1110.2176.8-174.60000107.2P4 F8 V9 K14 M15P4-V6 PolarHBondContact O-N 3.3Å; V6-F8 WeakPolarHBondContact CG1-O 3.48Å; V6-V9 HydrophobicContact CG1-CG2 4.28Å; V6-K14 HydrophobicContact CB-CB 4.42Å; V6-K14 HydrophobicContact CG1-CB 3.76Å; V6-K14 HydrophobicContact CG1-CG 3.93Å; V6-K14 HydrophobicContact CG2-CB 3.79Å; V6-K14 HydrophobicContact CG2-CD 3.8Å; V6-K14 HydrophobicContact CG2-CG 3.91Å; V6-M15 CarbonylContact C-O 3.4Å
7L61.9Low65.7Low89 Ų8996.2 Ų96.247%0.46650%0.503SS..EExtended strand (participates in β ladder)trans-68.7-46.4174.1-70.4175.1000110.7V5 M15 L17 A20V5-L7 PolarHBondContact O-N 3.06Å; L7-M15 PolarHBondContact N-O 3.38Å; L7-L17 HydrophobicContact CD1-CB 4.07Å; L7-L17 HydrophobicContact CD1-CD1 3.93Å; L7-L17 HydrophobicContact CG-CB 4.25Å; L7-A20 HydrophobicContact CD1-CB 3.85Å
8F73.6Confident66.8Low95 Ų9592.8 Ų92.842%0.41748%0.484SS..EExtended strand (participates in β ladder)trans-161.1171.117858.6-85.6000110.3V6 M10 M15V6-F8 WeakPolarHBondContact CG1-O 3.48Å; F8-M10 HydrophobicContact CD2-CB 4.23Å; F8-M10 HydrophobicContact CE2-CB 3.92Å; F8-M10 HydrophobicContact CE2-CE 3.5Å; F8-M10 HydrophobicContact CE2-CG 4.41Å; F8-M10 HydrophobicContact CZ-CE 3.92Å; F8-M15 HydrophobicContact CD1-CB 4.26Å; F8-M15 HydrophobicContact CD2-CB 4.11Å; F8-M15 HydrophobicContact CD2-CG 4.04Å; F8-M15 HydrophobicContact CE1-CB 4.04Å; F8-M15 HydrophobicContact CE2-CB 3.92Å; F8-M15 HydrophobicContact CE2-CG 3.59Å; F8-M15 HydrophobicContact CG-CB 4.29Å; F8-M15 HydrophobicContact CZ-CB 3.86Å; F8-M15 HydrophobicContact CZ-CG 3.84Å; F8-M15 WeakPolarHBondContact O-CB 3.11Å; F8-M15 PolarHBondContact O-N 3.27Å
9V70.7Confident67.9Low88 Ų8891 Ų9153%0.53347%0.474SS..EExtended strand (participates in β ladder)trans-108.8121.6174.4179.50000108.6V6 Y13 K14V6-V9 HydrophobicContact CG1-CG2 4.28Å; V9-Y13 CarbonylContact C-O 3.59Å; V9-Y13 VanDerWaalsContact CA-O 3.3Å; V9-Y13 WeakPolarHBondContact CA-O 3.28Å; V9-K14 HydrophobicContact CG2-CG 4.29Å
10M65Low69Low89 Ų8987.9 Ų87.944%0.43846%0.462SS..EExtended strand (participates in β ladder)trans-112.5118.3176.8-158.8-166.5-7200109.1F8 G12 Y13 M15F8-M10 HydrophobicContact CD2-CB 4.23Å; F8-M10 HydrophobicContact CE2-CB 3.92Å; F8-M10 HydrophobicContact CE2-CE 3.5Å; F8-M10 HydrophobicContact CE2-CG 4.41Å; F8-M10 HydrophobicContact CZ-CE 3.92Å; M10-G12 PolarHBondContact O-N 3.22Å; M10-G12 VanDerWaalsContact O-N 3.1Å; M10-Y13 PolarHBondContact N-O 3.42Å; M10-Y13 PolarHBondContact O-N 3.22Å; M10-M15 HydrophobicContact CB-CG 3.89Å
11Y74.5Confident70.1Confident221 Ų22184.3 Ų84.387%0.86744%0.444SS*.THydrogen-bonded Turntrans49.436.8-177.6-63.1-75.6000114.2Y13Y11-Y13 VanDerWaalsContact C-N 3.34Å; Y11-Y13 PolarHBondContact O-N 3.19Å
12G73.5Confident72.6Confident66 Ų6675.2 Ų75.268%0.6840%0.398SS*.THydrogen-bonded Turntrans86.7-9.5-178.400000115.3M10M10-G12 PolarHBondContact O-N 3.22Å; M10-G12 VanDerWaalsContact O-N 3.1Å
13Y69.9Low75Confident174 Ų17476 Ų7668%0.68239%0.394SS*.EExtended strand (participates in β ladder)trans-90.2129.1176.4-64.6-85.2000111.4V9 M10 Y11 M15V9-Y13 CarbonylContact C-O 3.59Å; V9-Y13 VanDerWaalsContact CA-O 3.3Å; V9-Y13 WeakPolarHBondContact CA-O 3.28Å; M10-Y13 PolarHBondContact N-O 3.42Å; M10-Y13 PolarHBondContact O-N 3.22Å; Y11-Y13 VanDerWaalsContact C-N 3.34Å; Y11-Y13 PolarHBondContact O-N 3.19Å; Y13-M15 PolarHBondContact O-N 3.22Å; Y13-M15 VanDerWaalsContact O-N 3.15Å
14K73Confident77.2Confident144 Ų14470.9 Ų70.963%0.62637%0.365SS*.EExtended strand (participates in β ladder)trans-70.4105.1174.6-72.9175.6171.5-174.60109.4V6 V9 T16V6-K14 HydrophobicContact CB-CB 4.42Å; V6-K14 HydrophobicContact CG1-CB 3.76Å; V6-K14 HydrophobicContact CG1-CG 3.93Å; V6-K14 HydrophobicContact CG2-CB 3.79Å; V6-K14 HydrophobicContact CG2-CD 3.8Å; V6-K14 HydrophobicContact CG2-CG 3.91Å; V9-K14 HydrophobicContact CG2-CG 4.29Å; K14-T16 PolarHBondContact O-N 3.29Å
15M73.2Confident79Confident19 Ų1969.1 Ų69.19%0.09435%0.352CS..EExtended strand (participates in β ladder)trans-78.3108.7176.1-68.1-63.1-64.600109V6 L7 F8 M10 Y13 L19 V23V6-M15 CarbonylContact C-O 3.4Å; L7-M15 PolarHBondContact N-O 3.38Å; F8-M15 HydrophobicContact CD1-CB 4.26Å; F8-M15 HydrophobicContact CD2-CB 4.11Å; F8-M15 HydrophobicContact CD2-CG 4.04Å; F8-M15 HydrophobicContact CE1-CB 4.04Å; F8-M15 HydrophobicContact CE2-CB 3.92Å; F8-M15 HydrophobicContact CE2-CG 3.59Å; F8-M15 HydrophobicContact CG-CB 4.29Å; F8-M15 HydrophobicContact CZ-CB 3.86Å; F8-M15 HydrophobicContact CZ-CG 3.84Å; F8-M15 WeakPolarHBondContact O-CB 3.11Å; F8-M15 PolarHBondContact O-N 3.27Å; M10-M15 HydrophobicContact CB-CG 3.89Å; Y13-M15 PolarHBondContact O-N 3.22Å; Y13-M15 VanDerWaalsContact O-N 3.15Å; M15-L19 HydrophobicContact CE-CB 4.4Å; M15-L19 HydrophobicContact CE-CD2 3.96Å; M15-L19 HydrophobicContact CE-CG 3.77Å; M15-L19 HydrophobicContact SD-CD2 3.5Å; M15-L19 VanDerWaalsContact SD-CD2 3.5Å; M15-L19 HydrophobicContact SD-CG 4.04Å; M15-V23 HydrophobicContact CE-CG2 4.45Å
16T83.8Confident80.8Confident20 Ų2070.1 Ų70.112%0.12335%0.351CS..EExtended strand (participates in β ladder)trans-81.8160.7175.170.70000110.1P4 V5 K14 F18 L19 A20P4-T16 HydrophobicContact CB-CG2 3.45Å; P4-T16 VanDerWaalsContact CB-CG2 3.45Å; P4-T16 HydrophobicContact CG-CG2 3.61Å; V5-T16 VanDerWaalsContact O-CA 3.23Å; V5-T16 WeakPolarHBondContact O-CA 3.29Å; K14-T16 PolarHBondContact O-N 3.29Å; T16-F18 VanDerWaalsContact C-N 3.3Å; T16-F18 PolarHBondContact O-N 2.86Å; T16-L19 PolarHBondContact O-N 2.97Å; T16-L19 VanDerWaalsContact O-N 3.12Å; T16-L19 WeakPolarHBondContact OG1-CB 3.26Å; T16-L19 PolarHBondContact OG1-N 3.36Å; T16-L19 VanDerWaalsContact OG1-N 3.08Å; T16-A20 PolarHBondContact O-N 3.02Å
17L84.2Confident82.5Confident27 Ų2770.8 Ų70.814%0.14136%0.357CS..Hα-helixtrans-55.9-46.6173.4175.167.3000112.3V5 L7 L19 A20 V21 L369 F373 I393V5-L17 PolarHBondContact O-N 3.32Å; L7-L17 HydrophobicContact CD1-CB 4.07Å; L7-L17 HydrophobicContact CD1-CD1 3.93Å; L7-L17 HydrophobicContact CG-CB 4.25Å; L17-L19 VanDerWaalsContact C-N 3.31Å; L17-L19 PolarHBondContact O-N 3.44Å; L17-A20 PolarHBondContact O-N 2.78Å; L17-V21 HydrophobicContact CD1-CG2 4.29Å; L17-V21 WeakPolarHBondContact O-CG2 3.42Å; L17-V21 PolarHBondContact O-N 3.16Å; L17-L369 HydrophobicContact CD2-CB 4.27Å; L17-L369 HydrophobicContact CD2-CD1 3.28Å; L17-L369 HydrophobicContact CD2-CG 3.73Å; L17-F373 HydrophobicContact CD2-CE2 4.37Å; L17-I393 HydrophobicContact CD1-CD1 4.2Å; L17-I393 HydrophobicContact CD2-CD1 4.02Å; L17-I393 HydrophobicContact CG-CD1 4.3Å
18F86.7Confident84.1Confident35 Ų3568.5 Ų68.515%0.15434%0.344CS..Hα-helixtrans-53.1-48.8173.2172.7-90.5000111.8T16 A20 V21 F22 L91 S372 F373T16-F18 VanDerWaalsContact C-N 3.3Å; T16-F18 PolarHBondContact O-N 2.86Å; F18-A20 VanDerWaalsContact C-N 3.35Å; F18-A20 PolarHBondContact O-N 3.38Å; F18-V21 PolarHBondContact O-N 3.39Å; F18-F22 HydrophobicContact CE1-CB 4.42Å; F18-F22 HydrophobicContact CE1-CD2 4.41Å; F18-F22 HydrophobicContact CZ-CD2 4.12Å; F18-F22 VanDerWaalsContact O-CB 3.24Å; F18-F22 WeakPolarHBondContact O-CB 3.37Å; F18-F22 PolarHBondContact O-N 3.45Å; F18-L91 HydrophobicContact CE2-CB 3.87Å; F18-L91 HydrophobicContact CZ-CB 4.16Å; F18-S372 WeakPolarHBondContact CB-O 3.45Å; F18-F373 HydrophobicContact CD2-CD1 4.07Å; F18-F373 HydrophobicContact CD2-CE1 4.23Å
19L87.3Confident85.3Confident58 Ų5866.2 Ų66.230%0.30433%0.333SS..Hα-helixtrans-65.9-38.2-178.5-175.159.9000111.7M15 T16 L17 F22 V23M15-L19 HydrophobicContact CE-CB 4.4Å; M15-L19 HydrophobicContact CE-CD2 3.96Å; M15-L19 HydrophobicContact CE-CG 3.77Å; M15-L19 HydrophobicContact SD-CD2 3.5Å; M15-L19 VanDerWaalsContact SD-CD2 3.5Å; M15-L19 HydrophobicContact SD-CG 4.04Å; T16-L19 PolarHBondContact O-N 2.97Å; T16-L19 VanDerWaalsContact O-N 3.12Å; T16-L19 WeakPolarHBondContact OG1-CB 3.26Å; T16-L19 PolarHBondContact OG1-N 3.36Å; T16-L19 VanDerWaalsContact OG1-N 3.08Å; L17-L19 VanDerWaalsContact C-N 3.31Å; L17-L19 PolarHBondContact O-N 3.44Å; L19-F22 PolarHBondContact O-N 3.37Å; L19-V23 HydrophobicContact CD1-CG2 4.05Å; L19-V23 HydrophobicContact CG-CG2 4.32Å; L19-V23 WeakPolarHBondContact O-CB 3.45Å; L19-V23 WeakPolarHBondContact O-CG2 3.28Å; L19-V23 PolarHBondContact O-N 3.4Å
20A89.5Confident86.6Confident28 Ų2866.9 Ų66.923%0.23133%0.333CS..Hα-helixtrans-63.1-46.7176.100000111.8L7 T16 L17 F18 F24L7-A20 HydrophobicContact CD1-CB 3.85Å; T16-A20 PolarHBondContact O-N 3.02Å; L17-A20 PolarHBondContact O-N 2.78Å; F18-A20 VanDerWaalsContact C-N 3.35Å; F18-A20 PolarHBondContact O-N 3.38Å; A20-F24 VanDerWaalsContact O-CB 3.29Å; A20-F24 WeakPolarHBondContact O-CB 3.09Å; A20-F24 PolarHBondContact O-N 2.89Å
21V91.4Very high88.2Confident13 Ų1366.8 Ų66.88%0.07933%0.328CS..Hα-helixtrans-61.2-47.7174.9169.40000110.5L17 F18 V23 F24 L25 F373 I393L17-V21 HydrophobicContact CD1-CG2 4.29Å; L17-V21 WeakPolarHBondContact O-CG2 3.42Å; L17-V21 PolarHBondContact O-N 3.16Å; F18-V21 PolarHBondContact O-N 3.39Å; V21-V23 PolarHBondContact O-N 2.76Å; V21-F24 WeakPolarHBondContact O-CB 3.38Å; V21-F24 PolarHBondContact O-N 3.45Å; V21-L25 HydrophobicContact CG1-CD1 3.94Å; V21-L25 HydrophobicContact CG1-CG 4.41Å; V21-L25 VanDerWaalsContact O-CG 3.27Å; V21-L25 WeakPolarHBondContact O-CG 3.46Å; V21-L25 PolarHBondContact O-N 2.93Å; V21-F373 HydrophobicContact CB-CZ 4.42Å; V21-F373 HydrophobicContact CG1-CZ 4.29Å; V21-F373 HydrophobicContact CG2-CZ 4.28Å; V21-I393 HydrophobicContact CG2-CD1 4.11Å
22F92.5Very high89.3Confident42 Ų4258.9 Ų58.918%0.18430%0.299CS..Hα-helixtrans-60.7-46.9-179.2-170.4-90000112F18 L19 L25 W26 L91F18-F22 HydrophobicContact CE1-CB 4.42Å; F18-F22 HydrophobicContact CE1-CD2 4.41Å; F18-F22 HydrophobicContact CZ-CD2 4.12Å; F18-F22 VanDerWaalsContact O-CB 3.24Å; F18-F22 WeakPolarHBondContact O-CB 3.37Å; F18-F22 PolarHBondContact O-N 3.45Å; L19-F22 PolarHBondContact O-N 3.37Å; F22-L25 PolarHBondContact O-N 2.97Å; F22-W26 AromaticContact CD1-CD1 3.65Å; F22-W26 AromaticContact CE1-CD1 3.32Å; F22-W26 AromaticContact CE1-NE1 3.25Å; F22-W26 VanDerWaalsContact CE1-NE1 3.25Å; F22-W26 AromaticContact CZ-CD1 3.76Å; F22-W26 AromaticContact CZ-NE1 3.25Å; F22-W26 PolarHBondContact O-N 3.32Å; F22-W26 VanDerWaalsContact O-N 3.12Å; F22-L91 HydrophobicContact CD2-CB 4.43Å; F22-L91 HydrophobicContact CD2-CD1 4.32Å
23V93.7Very high90.5Very high62 Ų6257.2 Ų57.238%0.37628%0.275SS..Hα-helixtrans-62.5-43.8176169.40000110.7M15 L19 V21 L25 W26 C27M15-V23 HydrophobicContact CE-CG2 4.45Å; L19-V23 HydrophobicContact CD1-CG2 4.05Å; L19-V23 HydrophobicContact CG-CG2 4.32Å; L19-V23 WeakPolarHBondContact O-CB 3.45Å; L19-V23 WeakPolarHBondContact O-CG2 3.28Å; L19-V23 PolarHBondContact O-N 3.4Å; V21-V23 PolarHBondContact O-N 2.76Å; V23-L25 PolarHBondContact O-N 2.91Å; V23-W26 PolarHBondContact O-N 3.29Å; V23-C27 WeakPolarHBondContact O-CB 3.31Å; V23-C27 PolarHBondContact O-N 3.45Å; V23-C27 PolarHBondContact O-SG 3.25Å
24F95.7Very high91.9Very high52 Ų5253.8 Ų53.823%0.22826%0.262CS..Hα-helixtrans-57.7-47.9177174.1-97.3000111.9A20 V21 W26 C27 M28 P396A20-F24 VanDerWaalsContact O-CB 3.29Å; A20-F24 WeakPolarHBondContact O-CB 3.09Å; A20-F24 PolarHBondContact O-N 2.89Å; V21-F24 WeakPolarHBondContact O-CB 3.38Å; V21-F24 PolarHBondContact O-N 3.45Å; F24-W26 VanDerWaalsContact C-N 3.34Å; F24-W26 PolarHBondContact O-N 3.23Å; F24-C27 PolarHBondContact O-N 3.46Å; F24-M28 HydrophobicContact CD1-CG 4.24Å; F24-M28 HydrophobicContact CD2-CG 4.29Å; F24-M28 HydrophobicContact CE1-CG 3.63Å; F24-M28 HydrophobicContact CE2-CG 3.7Å; F24-M28 HydrophobicContact CE2-SD 3.97Å; F24-M28 HydrophobicContact CZ-CG 3.3Å; F24-M28 HydrophobicContact CZ-SD 3.85Å; F24-M28 WeakPolarHBondContact O-CG 3.25Å; F24-M28 PolarHBondContact O-N 2.97Å; F24-P396 HydrophobicContact CD1-CG 3.89Å; F24-P396 HydrophobicContact CD2-CB 4.35Å; F24-P396 HydrophobicContact CD2-CG 4.24Å; F24-P396 HydrophobicContact CE1-CB 4.08Å; F24-P396 HydrophobicContact CE1-CG 3.83Å; F24-P396 HydrophobicContact CE2-CB 3.88Å; F24-P396 HydrophobicContact CE2-CG 4.18Å; F24-P396 HydrophobicContact CG-CG 4.11Å; F24-P396 HydrophobicContact CZ-CB 3.75Å; F24-P396 HydrophobicContact CZ-CG 4.01Å
25L96.5Very high93.1Very high27 Ų2746.9 Ų46.914%0.14123%0.232CC..Hα-helixtrans-59.8-42.7178.7-67.4169.5000111.8V21 F22 V23 M28 Y29 M84 L87 L91V21-L25 HydrophobicContact CG1-CD1 3.94Å; V21-L25 HydrophobicContact CG1-CG 4.41Å; V21-L25 VanDerWaalsContact O-CG 3.27Å; V21-L25 WeakPolarHBondContact O-CG 3.46Å; V21-L25 PolarHBondContact O-N 2.93Å; F22-L25 PolarHBondContact O-N 2.97Å; V23-L25 PolarHBondContact O-N 2.91Å; L25-M28 PolarHBondContact O-N 3.21Å; L25-Y29 WeakPolarHBondContact O-CB 3.44Å; L25-Y29 PolarHBondContact O-N 3.42Å; L25-M84 HydrophobicContact CB-CE 4.04Å; L25-L87 HydrophobicContact CD1-CD2 4.13Å; L25-L91 HydrophobicContact CD1-CD1 3.82Å
26W97.8Very high94.3Very high65 Ų6547.6 Ų47.625%0.24624%0.239CC..Hα-helixtrans-65.6-42.8174.5-86.699.5000113F22 V23 F24 M28 Y29 I30 M84 I85 S88F22-W26 AromaticContact CD1-CD1 3.65Å; F22-W26 AromaticContact CE1-CD1 3.32Å; F22-W26 AromaticContact CE1-NE1 3.25Å; F22-W26 VanDerWaalsContact CE1-NE1 3.25Å; F22-W26 AromaticContact CZ-CD1 3.76Å; F22-W26 AromaticContact CZ-NE1 3.25Å; F22-W26 PolarHBondContact O-N 3.32Å; F22-W26 VanDerWaalsContact O-N 3.12Å; V23-W26 PolarHBondContact O-N 3.29Å; F24-W26 VanDerWaalsContact C-N 3.34Å; F24-W26 PolarHBondContact O-N 3.23Å; W26-M28 VanDerWaalsContact C-N 3.3Å; W26-M28 PolarHBondContact O-N 3.48Å; W26-Y29 HydrophobicContact CE3-CD1 4Å; W26-Y29 AromaticContact CZ3-CD1 3.94Å; W26-Y29 HydrophobicContact CZ3-CD1 3.94Å; W26-Y29 HydrophobicContact CZ3-CE1 4.16Å; W26-Y29 PolarHBondContact O-N 3.39Å; W26-I30 WeakPolarHBondContact O-CB 3.43Å; W26-I30 VanDerWaalsContact O-CG1 3.24Å; W26-I30 WeakPolarHBondContact O-CG1 3.49Å; W26-I30 PolarHBondContact O-N 3.49Å; W26-M84 HydrophobicContact CB-CE 4.18Å; W26-M84 HydrophobicContact CD2-CE 3.47Å; W26-M84 VanDerWaalsContact CD2-CE 3.47Å; W26-M84 HydrophobicContact CD2-CG 4.2Å; W26-M84 VanDerWaalsContact CE2-CE 3.45Å; W26-M84 HydrophobicContact CE3-CE 4.18Å; W26-M84 HydrophobicContact CE3-CG 4.05Å; W26-M84 HydrophobicContact CG-CE 3.45Å; W26-M84 VanDerWaalsContact CG-CE 3.45Å; W26-M84 HydrophobicContact CH2-CG 3.79Å; W26-M84 HydrophobicContact CZ2-CE 4.15Å; W26-M84 HydrophobicContact CZ2-CG 3.93Å; W26-M84 HydrophobicContact CZ3-CG 3.84Å; W26-I85 HydrophobicContact CH2-CD1 4.04Å; W26-I85 HydrophobicContact CZ2-CD1 4.36Å; W26-S88 VanDerWaalsContact CZ2-OG 3.23Å; W26-S88 WeakPolarHBondContact CZ2-OG 3.41Å; W26-S88 PolarHBondContact NE1-OG 3.33Å
27C98Very high94.9Very high72 Ų7249.5 Ų49.549%0.48625%0.247SC..Hα-helixtrans-59.3-43.8175.3-730000111.3V23 F24 I30 W31V23-C27 WeakPolarHBondContact O-CB 3.31Å; V23-C27 PolarHBondContact O-N 3.45Å; V23-C27 PolarHBondContact O-SG 3.25Å; F24-C27 PolarHBondContact O-N 3.46Å; C27-I30 PolarHBondContact O-N 2.97Å; C27-W31 WeakPolarHBondContact O-CB 3.4Å; C27-W31 PolarHBondContact O-N 2.93Å
28M96.6Very high95.6Very high41 Ų4151.2 Ų51.220%0.20225%0.252CS..Hα-helixtrans-65-44.2176.5-72.9-50.8-48.300112.3F24 L25 W26 I30 W31 E32 T399F24-M28 HydrophobicContact CD1-CG 4.24Å; F24-M28 HydrophobicContact CD2-CG 4.29Å; F24-M28 HydrophobicContact CE1-CG 3.63Å; F24-M28 HydrophobicContact CE2-CG 3.7Å; F24-M28 HydrophobicContact CE2-SD 3.97Å; F24-M28 HydrophobicContact CZ-CG 3.3Å; F24-M28 HydrophobicContact CZ-SD 3.85Å; F24-M28 WeakPolarHBondContact O-CG 3.25Å; F24-M28 PolarHBondContact O-N 2.97Å; L25-M28 PolarHBondContact O-N 3.21Å; W26-M28 VanDerWaalsContact C-N 3.3Å; W26-M28 PolarHBondContact O-N 3.48Å; M28-I30 VanDerWaalsContact C-N 3.35Å; M28-I30 PolarHBondContact O-N 2.89Å; M28-W31 WeakPolarHBondContact O-CB 3.34Å; M28-W31 PolarHBondContact O-N 3.28Å; M28-E32 PolarHBondContact O-N 2.83Å; M28-T399 HydrophobicContact CE-CG2 3.32Å; M28-T399 HydrophobicContact SD-CG2 3.83Å
29Y98Very high96.1Very high47 Ų4750.4 Ų50.418%0.18425%0.249CC..Hα-helixtrans-60-44175.3170.7-102.4000112.1L25 W26 W31 E32 T33 G80 F81 M84L25-Y29 WeakPolarHBondContact O-CB 3.44Å; L25-Y29 PolarHBondContact O-N 3.42Å; W26-Y29 HydrophobicContact CE3-CD1 4Å; W26-Y29 AromaticContact CZ3-CD1 3.94Å; W26-Y29 HydrophobicContact CZ3-CD1 3.94Å; W26-Y29 HydrophobicContact CZ3-CE1 4.16Å; W26-Y29 PolarHBondContact O-N 3.39Å; Y29-W31 VanDerWaalsContact C-N 3.33Å; Y29-W31 PolarHBondContact O-N 3.21Å; Y29-E32 PolarHBondContact O-N 3.49Å; Y29-T33 WeakPolarHBondContact CE2-OG1 3.34Å; Y29-T33 VanDerWaalsContact CZ-OG1 3.32Å; Y29-T33 VanDerWaalsContact O-CB 3.24Å; Y29-T33 WeakPolarHBondContact O-CB 3.27Å; Y29-T33 PolarHBondContact O-N 3.02Å; Y29-T33 PolarHBondContact O-OG1 2.9Å; Y29-G80 WeakPolarHBondContact CE2-O 3.22Å; Y29-F81 HydrophobicContact CE1-CD2 4.36Å; Y29-F81 WeakPolarHBondContact OH-CA 3.49Å; Y29-F81 VanDerWaalsContact OH-CB 3.31Å; Y29-F81 WeakPolarHBondContact OH-CB 3.3Å; Y29-F81 PolarHBondContact OH-N 3.29Å; Y29-M84 HydrophobicContact CD1-CB 4.23Å; Y29-M84 HydrophobicContact CD1-CG 3.8Å; Y29-M84 HydrophobicContact CD2-CB 3.89Å; Y29-M84 HydrophobicContact CD2-CG 4.09Å; Y29-M84 HydrophobicContact CE1-CB 4.36Å; Y29-M84 HydrophobicContact CE1-CG 4.33Å; Y29-M84 HydrophobicContact CE2-CB 4.03Å; Y29-M84 HydrophobicContact CG-CB 4Å; Y29-M84 HydrophobicContact CG-CG 3.68Å; Y29-M84 HydrophobicContact CG-SD 4.11Å
30I98.6Very high96.6Very high103 Ų10351 Ų5153%0.52825%0.247SC..Hα-helixtrans-63.2-41.7177.2-70.3165.7000110.6W26 C27 M28 T33 Y34W26-I30 WeakPolarHBondContact O-CB 3.43Å; W26-I30 VanDerWaalsContact O-CG1 3.24Å; W26-I30 WeakPolarHBondContact O-CG1 3.49Å; W26-I30 PolarHBondContact O-N 3.49Å; C27-I30 PolarHBondContact O-N 2.97Å; M28-I30 VanDerWaalsContact C-N 3.35Å; M28-I30 PolarHBondContact O-N 2.89Å; I30-T33 PolarHBondContact O-N 3.35Å; I30-Y34 WeakPolarHBondContact O-CB 3.35Å; I30-Y34 PolarHBondContact O-N 2.88Å
31W98.2Very high97Very high86 Ų8657.5 Ų57.533%0.32627%0.266SS..Hα-helixtrans-60.8-51.5176.1175.1-107.1000111.9C27 M28 Y29 T33 Y34 L35 L449 F453C27-W31 WeakPolarHBondContact O-CB 3.4Å; C27-W31 PolarHBondContact O-N 2.93Å; M28-W31 WeakPolarHBondContact O-CB 3.34Å; M28-W31 PolarHBondContact O-N 3.28Å; Y29-W31 VanDerWaalsContact C-N 3.33Å; Y29-W31 PolarHBondContact O-N 3.21Å; W31-T33 VanDerWaalsContact C-N 3.3Å; W31-T33 PolarHBondContact O-N 2.96Å; W31-Y34 HydrophobicContact CE3-CD1 4.15Å; W31-Y34 AromaticContact CZ3-CD1 4Å; W31-Y34 HydrophobicContact CZ3-CD1 4Å; W31-Y34 HydrophobicContact CZ3-CE1 4.17Å; W31-Y34 WeakPolarHBondContact O-CB 3.47Å; W31-Y34 PolarHBondContact O-N 3.22Å; W31-Y34 VanDerWaalsContact O-N 3.12Å; W31-L35 HydrophobicContact CD2-CG 4.44Å; W31-L35 HydrophobicContact CH2-CD2 4.19Å; W31-L35 HydrophobicContact CZ2-CD1 4.15Å; W31-L35 HydrophobicContact CZ2-CD2 3.87Å; W31-L35 HydrophobicContact CZ2-CG 4.22Å; W31-L35 WeakPolarHBondContact O-CG 3.4Å; W31-L35 PolarHBondContact O-N 2.93Å; W31-L449 HydrophobicContact CH2-CD2 4.08Å; W31-F453 HydrophobicContact CZ2-CE1 4.49Å; W31-F453 HydrophobicContact CZ2-CE2 4.15Å; W31-F453 HydrophobicContact CZ2-CZ 4.08Å; W31-F453 AromaticContact NE1-CE1 4Å
32E97.4Very high97.2Very high56 Ų5661.1 Ų61.126%0.26228%0.28SS..Hα-helixtrans-65.1-35.5178.9-71-52.4143.300112.6M28 Y29 L35 S36 N454M28-E32 PolarHBondContact O-N 2.83Å; Y29-E32 PolarHBondContact O-N 3.49Å; E32-L35 PolarHBondContact O-N 3.44Å; E32-S36 WeakPolarHBondContact O-CB 3.5Å; E32-S36 PolarHBondContact O-N 3.48Å; E32-S36 PolarHBondContact O-OG 3.24Å; E32-N454 PolarHBondContact OE2-ND2 3Å; E32-N454 PolarHBondContact OE2-OD1 2.91Å
33T98.6Very high97.3Very high30 Ų3059.4 Ų59.418%0.18427%0.273CS..Hα-helixtrans-63.5-43.3172.8-61.60000110.8Y29 I30 W31 S36 I37 L77Y29-T33 WeakPolarHBondContact CE2-OG1 3.34Å; Y29-T33 VanDerWaalsContact CZ-OG1 3.32Å; Y29-T33 VanDerWaalsContact O-CB 3.24Å; Y29-T33 WeakPolarHBondContact O-CB 3.27Å; Y29-T33 PolarHBondContact O-N 3.02Å; Y29-T33 PolarHBondContact O-OG1 2.9Å; I30-T33 PolarHBondContact O-N 3.35Å; W31-T33 VanDerWaalsContact C-N 3.3Å; W31-T33 PolarHBondContact O-N 2.96Å; T33-S36 PolarHBondContact O-N 2.95Å; T33-I37 HydrophobicContact CG2-CD1 3.87Å; T33-I37 HydrophobicContact CG2-CG1 4.46Å; T33-I37 WeakPolarHBondContact O-CB 3.47Å; T33-I37 VanDerWaalsContact O-CG1 3.25Å; T33-I37 WeakPolarHBondContact O-CG1 3.49Å; T33-I37 PolarHBondContact O-N 2.8Å; T33-L77 HydrophobicContact CG2-CD2 4.05Å
34Y98.6Very high97.4Very high102 Ų10258.8 Ų58.840%0.427%0.269SS..Hα-helixtrans-59.6-48.4175167.9-103.3000111.4I30 W31 S36 I37 R38 L449I30-Y34 WeakPolarHBondContact O-CB 3.35Å; I30-Y34 PolarHBondContact O-N 2.88Å; W31-Y34 HydrophobicContact CE3-CD1 4.15Å; W31-Y34 AromaticContact CZ3-CD1 4Å; W31-Y34 HydrophobicContact CZ3-CD1 4Å; W31-Y34 HydrophobicContact CZ3-CE1 4.17Å; W31-Y34 WeakPolarHBondContact O-CB 3.47Å; W31-Y34 PolarHBondContact O-N 3.22Å; W31-Y34 VanDerWaalsContact O-N 3.12Å; Y34-S36 VanDerWaalsContact C-N 3.34Å; Y34-S36 PolarHBondContact O-N 3.37Å; Y34-I37 PolarHBondContact O-N 3.23Å; Y34-R38 VanDerWaalsContact CE1-CD 3.48Å; Y34-R38 HydrophobicContact CE1-CG 4.22Å; Y34-R38 HydrophobicContact CE2-CG 4.2Å; Y34-R38 WeakPolarHBondContact O-CG 3.36Å; Y34-R38 PolarHBondContact O-N 3.2Å; Y34-R38 PolarHBondContact OH-NH1 3.46Å; Y34-L449 HydrophobicContact CE1-CD2 4.38Å
35L98.4Very high97.3Very high0 Ų062.1 Ų62.10%029%0.289CS..Hα-helixtrans-58.5-45.9175.9-65.1-174.3000111.4W31 E32 I37 R38 Q39 L449 Y450 F453W31-L35 HydrophobicContact CD2-CG 4.44Å; W31-L35 HydrophobicContact CH2-CD2 4.19Å; W31-L35 HydrophobicContact CZ2-CD1 4.15Å; W31-L35 HydrophobicContact CZ2-CD2 3.87Å; W31-L35 HydrophobicContact CZ2-CG 4.22Å; W31-L35 WeakPolarHBondContact O-CG 3.4Å; W31-L35 PolarHBondContact O-N 2.93Å; E32-L35 PolarHBondContact O-N 3.44Å; L35-I37 VanDerWaalsContact C-N 3.32Å; L35-I37 PolarHBondContact O-N 3.25Å; L35-R38 WeakPolarHBondContact O-CB 3.19Å; L35-R38 PolarHBondContact O-N 2.93Å; L35-R38 VanDerWaalsContact O-N 3.17Å; L35-Q39 PolarHBondContact O-N 3.3Å; L35-L449 HydrophobicContact CD2-CB 4.44Å; L35-L449 HydrophobicContact CD2-CD2 3.65Å; L35-L449 HydrophobicContact CD2-CG 3.62Å; L35-Y450 HydrophobicContact CB-CD2 3.93Å; L35-Y450 WeakPolarHBondContact O-CD2 3.45Å; L35-F453 HydrophobicContact CD1-CB 3.84Å; L35-F453 HydrophobicContact CD1-CD2 4.3Å; L35-F453 HydrophobicContact CD1-CG 3.98Å
36S98.1Very high97.1Very high33 Ų3362 Ų6223%0.23129%0.29CS..Hα-helixtrans-62-38.2178.2-640000112.5E32 T33 Y34 Q39 R40E32-S36 WeakPolarHBondContact O-CB 3.5Å; E32-S36 PolarHBondContact O-N 3.48Å; E32-S36 PolarHBondContact O-OG 3.24Å; T33-S36 PolarHBondContact O-N 2.95Å; Y34-S36 VanDerWaalsContact C-N 3.34Å; Y34-S36 PolarHBondContact O-N 3.37Å; S36-Q39 PolarHBondContact O-N 2.81Å; S36-R40 WeakPolarHBondContact O-CB 3.4Å; S36-R40 PolarHBondContact O-N 2.57Å
37I98.2Very high96.7Very high60 Ų6066.7 Ų66.731%0.30831%0.307SS..Hα-helixtrans-67.1-39.5174.8-70.7167.1000111.1T33 Y34 L35 R40 R41 L77T33-I37 HydrophobicContact CG2-CD1 3.87Å; T33-I37 HydrophobicContact CG2-CG1 4.46Å; T33-I37 WeakPolarHBondContact O-CB 3.47Å; T33-I37 VanDerWaalsContact O-CG1 3.25Å; T33-I37 WeakPolarHBondContact O-CG1 3.49Å; T33-I37 PolarHBondContact O-N 2.8Å; Y34-I37 PolarHBondContact O-N 3.23Å; L35-I37 VanDerWaalsContact C-N 3.32Å; L35-I37 PolarHBondContact O-N 3.25Å; I37-R40 PolarHBondContact O-N 3.06Å; I37-R41 HydrophobicContact CG2-CG 4.47Å; I37-R41 WeakPolarHBondContact O-CG 3.42Å; I37-R41 PolarHBondContact O-N 3.41Å; I37-L77 HydrophobicContact CG1-CD2 4.34Å
38R98.2Very high96.2Very high64 Ų6468.1 Ų68.124%0.24231%0.314CS..Hα-helixtrans-59.7-48.9174.3-68.1176.463.880.613.5111.2Y34 L35 R40 R41 K42 D447Y34-R38 VanDerWaalsContact CE1-CD 3.48Å; Y34-R38 HydrophobicContact CE1-CG 4.22Å; Y34-R38 HydrophobicContact CE2-CG 4.2Å; Y34-R38 WeakPolarHBondContact O-CG 3.36Å; Y34-R38 PolarHBondContact O-N 3.2Å; Y34-R38 PolarHBondContact OH-NH1 3.46Å; L35-R38 WeakPolarHBondContact O-CB 3.19Å; L35-R38 PolarHBondContact O-N 2.93Å; L35-R38 VanDerWaalsContact O-N 3.17Å; R38-R40 VanDerWaalsContact C-N 3.32Å; R38-R40 PolarHBondContact O-N 3.17Å; R38-R41 PolarHBondContact O-N 3.42Å; R38-K42 PolarHBondContact O-N 2.91Å; R38-D447 HydrophobicContact CB-CB 4.46Å; R38-D447 IonicContact CZ-OD1 2.85Å; R38-D447 IonicContact CZ-OD2 3.79Å; R38-D447 IonicContact NE-OD1 2.81Å; R38-D447 PolarHBondContact NE-OD1 3.44Å; R38-D447 IonicContact NE-OD2 3.76Å; R38-D447 PolarHBondContact NE-OD2 2.79Å; R38-D447 IonicContact NH2-OD1 3.92Å; R38-D447 IonicContact NH2-OD2 3.8Å; R38-D447 PolarHBondContact NH2-OD2 2.98Å
39Q97.8Very high95.7Very high17 Ų1767.5 Ų67.58%0.07931%0.313CS..Hα-helixtrans-59.4-45.3176.5178.257.121.400111L35 S36 R41 K42 I43 V445 Y450L35-Q39 PolarHBondContact O-N 3.3Å; S36-Q39 PolarHBondContact O-N 2.81Å; Q39-R41 PolarHBondContact O-N 3.32Å; Q39-K42 WeakPolarHBondContact O-CB 3.46Å; Q39-K42 PolarHBondContact O-N 3.31Å; Q39-I43 HydrophobicContact CG-CD1 3.87Å; Q39-I43 HydrophobicContact CG-CG1 4.47Å; Q39-I43 WeakPolarHBondContact O-CD1 3.45Å; Q39-I43 VanDerWaalsContact O-CG1 3.24Å; Q39-I43 WeakPolarHBondContact O-CG1 3.4Å; Q39-I43 PolarHBondContact O-N 3.32Å; Q39-V445 PolarHBondContact NE2-O 3.24Å; Q39-Y450 HydrophobicContact CB-CD1 3.8Å; Q39-Y450 HydrophobicContact CB-CD2 3.77Å; Q39-Y450 HydrophobicContact CB-CE1 4.2Å; Q39-Y450 HydrophobicContact CB-CE2 4.2Å; Q39-Y450 HydrophobicContact CB-CG 3.56Å; Q39-Y450 HydrophobicContact CG-CD1 3.71Å; Q39-Y450 HydrophobicContact CG-CD2 4.45Å; Q39-Y450 HydrophobicContact CG-CE1 3.82Å; Q39-Y450 HydrophobicContact CG-CG 4.04Å
40R97.2Very high95Very high70 Ų7066.3 Ų66.326%0.26431%0.31SS..Hα-helixtrans-57.4-47.3176.3-172.7-174-176.791.1-2.4112.4S36 I37 R38 K42 I43 V44 I70 S73 S74S36-R40 WeakPolarHBondContact O-CB 3.4Å; S36-R40 PolarHBondContact O-N 2.57Å; I37-R40 PolarHBondContact O-N 3.06Å; R38-R40 VanDerWaalsContact C-N 3.32Å; R38-R40 PolarHBondContact O-N 3.17Å; R40-K42 VanDerWaalsContact C-N 3.33Å; R40-K42 PolarHBondContact O-N 3.36Å; R40-I43 WeakPolarHBondContact O-CB 3.28Å; R40-I43 PolarHBondContact O-N 3.32Å; R40-V44 WeakPolarHBondContact O-CG2 3.33Å; R40-V44 PolarHBondContact O-N 3.45Å; R40-I70 PolarHBondContact NH1-O 3.21Å; R40-S73 PolarHBondContact NH1-OG 2.81Å; R40-S73 VanDerWaalsContact NH1-OG 3.12Å; R40-S74 VanDerWaalsContact CZ-OG 3.31Å; R40-S74 VanDerWaalsContact NH1-CA 3.32Å; R40-S74 VanDerWaalsContact NH1-N 3.12Å; R40-S74 PolarHBondContact NH1-OG 3.31Å; R40-S74 PolarHBondContact NH2-OG 3.25Å
41R97.2Very high94.2Very high166 Ų16668.7 Ų68.763%0.62632%0.323SS*.Hα-helixtrans-58.2-48.1176.6-73.6176.4-176.9178.91.5110.5I37 R38 Q39 I43 V44 D45I37-R41 HydrophobicContact CG2-CG 4.47Å; I37-R41 WeakPolarHBondContact O-CG 3.42Å; I37-R41 PolarHBondContact O-N 3.41Å; R38-R41 PolarHBondContact O-N 3.42Å; Q39-R41 PolarHBondContact O-N 3.32Å; R41-I43 VanDerWaalsContact C-N 3.3Å; R41-I43 PolarHBondContact O-N 3.29Å; R41-V44 PolarHBondContact O-N 2.92Å; R41-V44 VanDerWaalsContact O-N 3.12Å; R41-D45 WeakPolarHBondContact O-CB 3.39Å; R41-D45 PolarHBondContact O-N 2.86Å
42K95.6Very high93.2Very high89 Ų8970.9 Ų70.939%0.38734%0.337SS..Hα-helixtrans-57.9-42.1177.8-170.864.6176.1-179.90112.4R38 Q39 R40 T46 V445 D447R38-K42 PolarHBondContact O-N 2.91Å; Q39-K42 WeakPolarHBondContact O-CB 3.46Å; Q39-K42 PolarHBondContact O-N 3.31Å; R40-K42 VanDerWaalsContact C-N 3.33Å; R40-K42 PolarHBondContact O-N 3.36Å; K42-T46 WeakPolarHBondContact O-CB 3.12Å; K42-T46 PolarHBondContact O-N 3.34Å; K42-T46 VanDerWaalsContact O-N 3.15Å; K42-T46 PolarHBondContact O-OG1 2.86Å; K42-V445 HydrophobicContact CD-CG1 4.42Å; K42-V445 HydrophobicContact CG-CG1 4.1Å; K42-D447 HydrophobicContact CB-CB 4.39Å
43I95.7Very high92.3Very high6 Ų668.3 Ų68.33%0.03133%0.325CS..Hα-helixtrans-59.9-54174.3-65.8160.2000109.8Q39 R40 R41 D45 T46 R66 A69 I70 F443Q39-I43 HydrophobicContact CG-CD1 3.87Å; Q39-I43 HydrophobicContact CG-CG1 4.47Å; Q39-I43 WeakPolarHBondContact O-CD1 3.45Å; Q39-I43 VanDerWaalsContact O-CG1 3.24Å; Q39-I43 WeakPolarHBondContact O-CG1 3.4Å; Q39-I43 PolarHBondContact O-N 3.32Å; R40-I43 WeakPolarHBondContact O-CB 3.28Å; R40-I43 PolarHBondContact O-N 3.32Å; R41-I43 VanDerWaalsContact C-N 3.3Å; R41-I43 PolarHBondContact O-N 3.29Å; I43-D45 VanDerWaalsContact C-N 3.34Å; I43-D45 PolarHBondContact O-N 3.26Å; I43-T46 PolarHBondContact O-N 3.48Å; I43-R66 HydrophobicContact CG2-CG 3.48Å; I43-R66 VanDerWaalsContact CG2-CG 3.48Å; I43-R66 WeakPolarHBondContact O-CD 3.46Å; I43-A69 HydrophobicContact CD1-CB 3.89Å; I43-A69 HydrophobicContact CG1-CB 4.43Å; I43-A69 HydrophobicContact CG2-CB 4.15Å; I43-I70 HydrophobicContact CG2-CD1 4.3Å; I43-I70 HydrophobicContact CG2-CG1 3.7Å; I43-F443 HydrophobicContact CB-CD1 4.36Å; I43-F443 HydrophobicContact CB-CE1 4.06Å; I43-F443 HydrophobicContact CG1-CD1 3.58Å; I43-F443 HydrophobicContact CG1-CE1 3.68Å; I43-F443 HydrophobicContact CG1-CG 4.37Å; I43-F443 HydrophobicContact CG2-CD1 4.39Å; I43-F443 HydrophobicContact CG2-CE1 4.22Å; I43-F443 HydrophobicContact CG2-CZ 4.34Å
44V95.1Very high91.2Very high49 Ų4970 Ų7030%0.29734%0.342SS..Hα-helixtrans-61.6-39.1-175.7170.40000113R40 R41 I70R40-V44 WeakPolarHBondContact O-CG2 3.33Å; R40-V44 PolarHBondContact O-N 3.45Å; R41-V44 PolarHBondContact O-N 2.92Å; R41-V44 VanDerWaalsContact O-N 3.12Å; V44-I70 HydrophobicContact CG2-CD1 4.1Å; V44-I70 HydrophobicContact CG2-CG1 4.27Å
45D93.8Very high89.9Confident122 Ų12270.5 Ų70.565%0.65236%0.36SS*.Hα-helixtrans-74.1-32.2-178.4-64.6-20.6000111.9R41 I43 R47R41-D45 WeakPolarHBondContact O-CB 3.39Å; R41-D45 PolarHBondContact O-N 2.86Å; I43-D45 VanDerWaalsContact C-N 3.34Å; I43-D45 PolarHBondContact O-N 3.26Å; D45-R47 PolarHBondContact O-N 2.69Å; D45-R47 VanDerWaalsContact O-N 3.11Å
46T91.9Very high88.5Confident25 Ų2573.9 Ų73.915%0.15338%0.38CS..  trans-85.587.9-177-48.30000110.5K42 I43 F62 R66 F443 V445K42-T46 WeakPolarHBondContact O-CB 3.12Å; K42-T46 PolarHBondContact O-N 3.34Å; K42-T46 VanDerWaalsContact O-N 3.15Å; K42-T46 PolarHBondContact O-OG1 2.86Å; I43-T46 PolarHBondContact O-N 3.48Å; T46-F62 HydrophobicContact CG2-CZ 3.93Å; T46-F62 WeakPolarHBondContact O-CE1 3.24Å; T46-F62 WeakPolarHBondContact O-CZ 3.34Å; T46-R66 WeakPolarHBondContact O-CD 3.28Å; T46-F443 HydrophobicContact CG2-CZ 4.41Å; T46-V445 HydrophobicContact CG2-CB 4.33Å; T46-V445 HydrophobicContact CG2-CG1 4.35Å; T46-V445 HydrophobicContact CG2-CG2 4.05Å
47R88.6Confident87.5Confident162 Ų16272.8 Ų72.861%0.61137%0.372SS*.  trans-95.9-11.1-176.9-63.3-174.5-177.8178.90.7115.2D45 Q63D45-R47 PolarHBondContact O-N 2.69Å; D45-R47 VanDerWaalsContact O-N 3.11Å; R47-Q63 PolarHBondContact O-NE2 3.18Å
48T88.1Confident86.9Confident102 Ų10273.3 Ų73.363%0.62638%0.375SS*.SBendtrans-113.8150.7-178.651.20000110.9F62T48-F62 WeakPolarHBondContact O-CE1 3.41Å; T48-F62 VanDerWaalsContact O-CZ 3.25Å; T48-F62 WeakPolarHBondContact O-CZ 3.14Å
49V86.8Confident86.4Confident29 Ų2974 Ų7418%0.17638%0.384CS..  trans-64.2131.1176.4-1680000108.9L53 M57 F62V49-L53 HydrophobicContact CG1-CB 4.08Å; V49-M57 HydrophobicContact CG1-CB 4.31Å; V49-F62 HydrophobicContact CG2-CB 3.68Å; V49-F62 HydrophobicContact CG2-CD1 4.34Å; V49-F62 HydrophobicContact CG2-CD2 4.4Å; V49-F62 HydrophobicContact CG2-CG 3.89Å
50P83.7Confident85.9Confident21 Ų2178.9 Ų78.914%0.13641%0.411CS..  trans-56.2143.9169.6-24.534.5000111.2E52 L53 A54 V445P50-E52 WeakPolarHBondContact CB-OE2 3.24Å; P50-E52 PolarHBondContact O-N 3.46Å; P50-L53 HydrophobicContact CG-CD1 4.37Å; P50-L53 PolarHBondContact O-N 3.09Å; P50-A54 PolarHBondContact O-N 3.45Å; P50-A54 VanDerWaalsContact O-N 3.12Å; P50-V445 HydrophobicContact CG-CG2 3.48Å; P50-V445 VanDerWaalsContact CG-CG2 3.48Å
51I81.5Confident85.3Confident154 Ų15478.4 Ų78.479%0.7941%0.41SS*.G310 helixtrans-58.5-36.5-175.7-64167.6000110.5L53 A54I51-L53 PolarHBondContact O-N 2.68Å; I51-A54 WeakPolarHBondContact O-CB 3.24Å; I51-A54 PolarHBondContact O-N 2.91Å
52E76.9Confident85Confident132 Ų13270.5 Ų70.562%0.61738%0.381SS*.G310 helixtrans-64.9-23.2179.8-55.785.816900113.2P50 L461P50-E52 WeakPolarHBondContact CB-OE2 3.24Å; P50-E52 PolarHBondContact O-N 3.46Å; E52-L461 HydrophobicContact CB-CD2 3.89Å
53L78.2Confident84.9Confident2 Ų268.5 Ų68.51%0.0137%0.373CS..G310 helixtrans-108.8-2.2-179.7-65.1173.6000113.1V49 P50 I51 S55 V56 M57 P444 L460 L461 L464V49-L53 HydrophobicContact CG1-CB 4.08Å; P50-L53 HydrophobicContact CG-CD1 4.37Å; P50-L53 PolarHBondContact O-N 3.09Å; I51-L53 PolarHBondContact O-N 2.68Å; L53-S55 PolarHBondContact O-N 2.84Å; L53-S55 VanDerWaalsContact O-N 3.09Å; L53-V56 PolarHBondContact O-N 3.47Å; L53-M57 PolarHBondContact O-N 2.67Å; L53-P444 HydrophobicContact CD1-CB 3.31Å; L53-P444 HydrophobicContact CD1-CG 3.72Å; L53-L460 HydrophobicContact CD2-CD2 3.83Å; L53-L461 HydrophobicContact CD1-CD2 3.9Å; L53-L461 HydrophobicContact CD1-CG 4.43Å; L53-L461 HydrophobicContact CD2-CD2 4.1Å; L53-L461 HydrophobicContact CG-CD2 3.76Å; L53-L464 HydrophobicContact CD2-CD1 4.15Å
54A76.1Confident84.7Confident65 Ų6574.1 Ų74.154%0.53740%0.397SS..THydrogen-bonded Turntrans-58.7-26.4-176.500000112.9P50 I51P50-A54 PolarHBondContact O-N 3.45Å; P50-A54 VanDerWaalsContact O-N 3.12Å; I51-A54 WeakPolarHBondContact O-CB 3.24Å; I51-A54 PolarHBondContact O-N 2.91Å
55S71.2Confident84.6Confident112 Ų11271.8 Ų71.878%0.78338%0.383SS*.THydrogen-bonded Turntrans-77.3-18.6177.156.30000114.1L53L53-S55 PolarHBondContact O-N 2.84Å; L53-S55 VanDerWaalsContact O-N 3.09Å
56V68.2Low84.7Confident71 Ų7167.2 Ų67.243%0.4336%0.356SS..THydrogen-bonded Turntrans-123.3-24.1-169.4-152.40000113.4L53 V434L53-V56 PolarHBondContact O-N 3.47Å; V56-V434 HydrophobicContact CB-CB 4.38Å; V56-V434 HydrophobicContact CB-CG1 3.61Å; V56-V434 HydrophobicContact CB-CG2 4.4Å; V56-V434 HydrophobicContact CG1-CB 3.66Å; V56-V434 HydrophobicContact CG1-CG1 3.12Å; V56-V434 HydrophobicContact CG1-CG2 4.09Å; V56-V434 HydrophobicContact CG2-CG1 4.42Å; V56-V434 HydrophobicContact CG2-CG2 4.34Å
57M78.4Confident84.9Confident10 Ų1070.3 Ų70.35%0.04937%0.371CS..  trans-121.5115.9178.5-174.6172.8-73.700110.3V49 L53 K61 F62 L437 P444V49-M57 HydrophobicContact CG1-CB 4.31Å; L53-M57 PolarHBondContact O-N 2.67Å; M57-K61 HydrophobicContact CG-CB 4.17Å; M57-F62 HydrophobicContact CG-CB 3.92Å; M57-F62 VanDerWaalsContact SD-CA 3.55Å; M57-F62 HydrophobicContact SD-CB 3.64Å; M57-F62 HydrophobicContact SD-CD2 3.65Å; M57-F62 HydrophobicContact SD-CG 4.14Å; M57-L437 HydrophobicContact CE-CD2 3.22Å; M57-P444 HydrophobicContact SD-CG 4.36Å
58D85Confident85.2Confident71 Ų7163.7 Ų63.738%0.3835%0.347SS..  trans-71.7164.6170.358.445.9000111.5D60 K61 F62D58-D60 VanDerWaalsContact C-N 3.31Å; D58-D60 PolarHBondContact O-N 3.22Å; D58-D60 PolarHBondContact OD1-N 2.86Å; D58-K61 PolarHBondContact O-N 2.8Å; D58-K61 WeakPolarHBondContact OD1-CB 3.46Å; D58-K61 WeakPolarHBondContact OD1-CG 3.42Å; D58-K61 PolarHBondContact OD1-N 3.28Å; D58-K61 WeakPolarHBondContact OD2-CD 3.27Å; D58-K61 WeakPolarHBondContact OD2-CE 3.3Å; D58-K61 IonicContact OD2-NZ 2.68Å; D58-K61 PolarHBondContact OD2-NZ 3.15Å; D58-F62 WeakPolarHBondContact O-CB 3.33Å; D58-F62 PolarHBondContact O-N 3.15Å
59N87.2Confident85.7Confident80 Ų8059.6 Ų59.643%0.42832%0.323SS..Hα-helixtrans-60.1-42.9-177.6-163-69.9000111.3K61 F62 Q63N59-K61 PolarHBondContact O-N 3.43Å; N59-F62 CarbonylContact O-C 3.6Å; N59-F62 WeakPolarHBondContact O-CB 3.39Å; N59-F62 PolarHBondContact O-N 3.19Å; N59-Q63 VanDerWaalsContact O-CG 3.3Å; N59-Q63 WeakPolarHBondContact O-CG 3.41Å; N59-Q63 PolarHBondContact O-N 3.26Å; N59-Q63 WeakPolarHBondContact OD1-CG 3.36Å; N59-Q63 PolarHBondContact OD1-NE2 3.32Å; N59-Q63 VanDerWaalsContact OD1-NE2 3.13Å
60D88.3Confident86.2Confident119 Ų11959.9 Ų59.964%0.63632%0.323SS*.Hα-helixtrans-61.5-46.4-176.9-69.7-12.9000112.2D58 F62 Q63 K64D58-D60 VanDerWaalsContact C-N 3.31Å; D58-D60 PolarHBondContact O-N 3.22Å; D58-D60 PolarHBondContact OD1-N 2.86Å; D60-F62 VanDerWaalsContact C-N 3.35Å; D60-Q63 PolarHBondContact O-N 3.38Å; D60-K64 WeakPolarHBondContact O-CG 3.3Å; D60-K64 PolarHBondContact O-N 2.73Å
61K84.7Confident86.9Confident60 Ų6060.5 Ų60.526%0.26133%0.325SS..Hα-helixtrans-65.4-39.6175.2-72.4170.5-170.7136.10111.5M57 D58 N59 Q63 K64 S65 K438M57-K61 HydrophobicContact CG-CB 4.17Å; D58-K61 PolarHBondContact O-N 2.8Å; D58-K61 WeakPolarHBondContact OD1-CB 3.46Å; D58-K61 WeakPolarHBondContact OD1-CG 3.42Å; D58-K61 PolarHBondContact OD1-N 3.28Å; D58-K61 WeakPolarHBondContact OD2-CD 3.27Å; D58-K61 WeakPolarHBondContact OD2-CE 3.3Å; D58-K61 IonicContact OD2-NZ 2.68Å; D58-K61 PolarHBondContact OD2-NZ 3.15Å; N59-K61 PolarHBondContact O-N 3.43Å; K61-Q63 PolarHBondContact O-N 3.42Å; K61-K64 PolarHBondContact O-N 2.92Å; K61-S65 PolarHBondContact O-N 2.94Å; K61-K438 HydrophobicContact CD-CD 4.49Å; K61-K438 HydrophobicContact CD-CG 4.33Å
62F90.8Very high87.6Confident0 Ų057.8 Ų57.80%031%0.305CS..Hα-helixtrans-60.2-45.8174.1-178.3-95.5000111.3T46 T48 V49 M57 D58 N59 D60 K64 S65 R66 F443 P444T46-F62 HydrophobicContact CG2-CZ 3.93Å; T46-F62 WeakPolarHBondContact O-CE1 3.24Å; T46-F62 WeakPolarHBondContact O-CZ 3.34Å; T48-F62 WeakPolarHBondContact O-CE1 3.41Å; T48-F62 VanDerWaalsContact O-CZ 3.25Å; T48-F62 WeakPolarHBondContact O-CZ 3.14Å; V49-F62 HydrophobicContact CG2-CB 3.68Å; V49-F62 HydrophobicContact CG2-CD1 4.34Å; V49-F62 HydrophobicContact CG2-CD2 4.4Å; V49-F62 HydrophobicContact CG2-CG 3.89Å; M57-F62 HydrophobicContact CG-CB 3.92Å; M57-F62 VanDerWaalsContact SD-CA 3.55Å; M57-F62 HydrophobicContact SD-CB 3.64Å; M57-F62 HydrophobicContact SD-CD2 3.65Å; M57-F62 HydrophobicContact SD-CG 4.14Å; D58-F62 WeakPolarHBondContact O-CB 3.33Å; D58-F62 PolarHBondContact O-N 3.15Å; N59-F62 CarbonylContact O-C 3.6Å; N59-F62 WeakPolarHBondContact O-CB 3.39Å; N59-F62 PolarHBondContact O-N 3.19Å; D60-F62 VanDerWaalsContact C-N 3.35Å; F62-K64 VanDerWaalsContact C-N 3.34Å; F62-K64 PolarHBondContact O-N 2.59Å; F62-S65 PolarHBondContact O-N 3.31Å; F62-S65 PolarHBondContact O-OG 2.92Å; F62-R66 WeakPolarHBondContact O-CB 3.43Å; F62-R66 PolarHBondContact O-N 3.27Å; F62-F443 HydrophobicContact CE1-CE2 4.24Å; F62-F443 HydrophobicContact CE2-CD2 4.46Å; F62-F443 AromaticContact CE2-CE2 3.7Å; F62-F443 HydrophobicContact CE2-CE2 3.7Å; F62-F443 HydrophobicContact CE2-CZ 4.24Å; F62-F443 AromaticContact CZ-CE2 3.53Å; F62-F443 HydrophobicContact CZ-CE2 3.53Å; F62-F443 AromaticContact CZ-CZ 3.87Å; F62-F443 HydrophobicContact CZ-CZ 3.87Å; F62-P444 HydrophobicContact CD2-CG 4.08Å; F62-P444 HydrophobicContact CE2-CG 3.84Å
63Q92.9Very high88.6Confident47 Ų4752.6 Ų52.622%0.2228%0.283CS..Hα-helixtrans-59.1-44174.6-61.3-50.9-66.600111.3R47 N59 D60 K61 R66 L67R47-Q63 PolarHBondContact O-NE2 3.18Å; N59-Q63 VanDerWaalsContact O-CG 3.3Å; N59-Q63 WeakPolarHBondContact O-CG 3.41Å; N59-Q63 PolarHBondContact O-N 3.26Å; N59-Q63 WeakPolarHBondContact OD1-CG 3.36Å; N59-Q63 PolarHBondContact OD1-NE2 3.32Å; N59-Q63 VanDerWaalsContact OD1-NE2 3.13Å; D60-Q63 PolarHBondContact O-N 3.38Å; K61-Q63 PolarHBondContact O-N 3.42Å; Q63-R66 VanDerWaalsContact NE2-NH1 3.11Å; Q63-R66 PolarHBondContact O-N 2.92Å; Q63-L67 WeakPolarHBondContact O-CG 3.25Å; Q63-L67 PolarHBondContact O-N 3.2Å
64K92.2Very high89.5Confident123 Ų12354.2 Ų54.254%0.53530%0.295SS..Hα-helixtrans-59.2-49176.5-73.5-179.9-178.6-177.10111.9D60 K61 F62 R66 L67 Y68 L441D60-K64 WeakPolarHBondContact O-CG 3.3Å; D60-K64 PolarHBondContact O-N 2.73Å; K61-K64 PolarHBondContact O-N 2.92Å; F62-K64 VanDerWaalsContact C-N 3.34Å; F62-K64 PolarHBondContact O-N 2.59Å; K64-R66 VanDerWaalsContact C-N 3.28Å; K64-R66 PolarHBondContact O-N 2.92Å; K64-L67 PolarHBondContact O-N 3.5Å; K64-Y68 WeakPolarHBondContact O-CB 3.41Å; K64-Y68 PolarHBondContact O-N 2.96Å; K64-L441 HydrophobicContact CB-CD1 4.45Å; K64-L441 HydrophobicContact CB-CD2 4.14Å
65S92.4Very high90.6Very high1 Ų152.7 Ų52.71%0.00728%0.276CS..Hα-helixtrans-59.9-38.6176.573.50000112.3K61 F62 A69 L441K61-S65 PolarHBondContact O-N 2.94Å; F62-S65 PolarHBondContact O-N 3.31Å; F62-S65 PolarHBondContact O-OG 2.92Å; S65-A69 WeakPolarHBondContact O-CB 3.49Å; S65-A69 PolarHBondContact O-N 3.01Å; S65-L441 WeakPolarHBondContact CB-O 3.15Å
66R95.1Very high91.8Very high26 Ų2649.1 Ų49.110%0.09826%0.257CS..Hα-helixtrans-65.5-48177-164.6-175.569.1-110.24111.6I43 T46 F62 Q63 K64 Y68 A69 I70 F443I43-R66 HydrophobicContact CG2-CG 3.48Å; I43-R66 VanDerWaalsContact CG2-CG 3.48Å; I43-R66 WeakPolarHBondContact O-CD 3.46Å; T46-R66 WeakPolarHBondContact O-CD 3.28Å; F62-R66 WeakPolarHBondContact O-CB 3.43Å; F62-R66 PolarHBondContact O-N 3.27Å; Q63-R66 VanDerWaalsContact NE2-NH1 3.11Å; Q63-R66 PolarHBondContact O-N 2.92Å; K64-R66 VanDerWaalsContact C-N 3.28Å; K64-R66 PolarHBondContact O-N 2.92Å; R66-Y68 VanDerWaalsContact C-N 3.33Å; R66-A69 PolarHBondContact O-N 2.88Å; R66-I70 HydrophobicContact CG-CD1 4.25Å; R66-I70 WeakPolarHBondContact O-CG1 3.44Å; R66-I70 PolarHBondContact O-N 3.49Å; R66-F443 HydrophobicContact CB-CD2 3.99Å; R66-F443 HydrophobicContact CB-CE2 3.7Å; R66-F443 HydrophobicContact CG-CD2 4.27Å; R66-F443 HydrophobicContact CG-CE2 3.72Å; R66-F443 HydrophobicContact CG-CZ 4.2Å
67L95.7Very high93.3Very high89 Ų8947.6 Ų47.647%0.46625%0.246SC..Hα-helixtrans-63.5-41.4179.4-70.2174.6000111.3Q63 K64 A69 I70 D71Q63-L67 WeakPolarHBondContact O-CG 3.25Å; Q63-L67 PolarHBondContact O-N 3.2Å; K64-L67 PolarHBondContact O-N 3.5Å; L67-A69 PolarHBondContact O-N 3.37Å; L67-I70 PolarHBondContact O-N 3.34Å; L67-D71 PolarHBondContact O-N 3.21Å
68Y96.9Very high94.2Very high24 Ų2451.5 Ų51.59%0.09427%0.27CS..Hα-helixtrans-58.5-47.3173.4-179.2-125.9000111.5K64 R66 I70 D71 R72 I159 E160 H163 F165 L441K64-Y68 WeakPolarHBondContact O-CB 3.41Å; K64-Y68 PolarHBondContact O-N 2.96Å; R66-Y68 VanDerWaalsContact C-N 3.33Å; Y68-I70 VanDerWaalsContact C-N 3.33Å; Y68-I70 PolarHBondContact O-N 2.93Å; Y68-D71 PolarHBondContact O-N 3.14Å; Y68-R72 HydrophobicContact CD2-CG 4.01Å; Y68-R72 HydrophobicContact CE1-CG 4.22Å; Y68-R72 HydrophobicContact CE2-CG 3.7Å; Y68-R72 HydrophobicContact CG-CG 4.43Å; Y68-R72 WeakPolarHBondContact O-CB 3.32Å; Y68-R72 VanDerWaalsContact O-CG 3.3Å; Y68-R72 WeakPolarHBondContact O-CG 3.39Å; Y68-R72 PolarHBondContact O-N 2.9Å; Y68-I159 HydrophobicContact CD2-CG2 4.41Å; Y68-I159 HydrophobicContact CE2-CG2 4.13Å; Y68-E160 VanDerWaalsContact OH-CD 3.29Å; Y68-E160 PolarHBondContact OH-OE1 3.2Å; Y68-E160 PolarHBondContact OH-OE2 3.43Å; Y68-H163 WeakPolarHBondContact CA-CE1 3.18Å; Y68-H163 HydrophobicContact CD2-CB 3.83Å; Y68-H163 AromaticContact CD2-CD2 3.45Å; Y68-H163 VanDerWaalsContact CD2-CD2 3.45Å; Y68-H163 WeakPolarHBondContact CD2-CD2 3.42Å; Y68-H163 AromaticContact CD2-CG 3.52Å; Y68-H163 HydrophobicContact CE2-CB 4.37Å; Y68-H163 HydrophobicContact CG-CB 4.4Å; Y68-H163 PolarHBondContact N-CE1 3.14Å; Y68-H163 VanDerWaalsContact N-CE1 3.25Å; Y68-F165 HydrophobicContact CD1-CE2 4.07Å; Y68-F165 HydrophobicContact CD2-CE2 4.31Å; Y68-F165 HydrophobicContact CE1-CD2 4.44Å; Y68-F165 AromaticContact CE1-CE2 3.81Å; Y68-F165 HydrophobicContact CE1-CE2 3.81Å; Y68-F165 AromaticContact CE2-CD2 3.99Å; Y68-F165 HydrophobicContact CE2-CD2 3.99Å; Y68-F165 HydrophobicContact CE2-CE2 4.04Å; Y68-F165 HydrophobicContact CG-CE2 4.31Å; Y68-F165 AromaticContact CZ-CD2 3.95Å; Y68-F165 AromaticContact CZ-CE2 3.78Å; Y68-L441 HydrophobicContact CD1-CB 3.96Å; Y68-L441 HydrophobicContact CG-CB 4.5Å
69A96.9Very high94.8Very high16 Ų1648.9 Ų48.913%0.13226%0.257CS..Hα-helixtrans-63.4-35.2177.300000113.3I43 S65 R66 L67 S73 F443I43-A69 HydrophobicContact CD1-CB 3.89Å; I43-A69 HydrophobicContact CG1-CB 4.43Å; I43-A69 HydrophobicContact CG2-CB 4.15Å; S65-A69 WeakPolarHBondContact O-CB 3.49Å; S65-A69 PolarHBondContact O-N 3.01Å; R66-A69 PolarHBondContact O-N 2.88Å; L67-A69 PolarHBondContact O-N 3.37Å; A69-S73 WeakPolarHBondContact O-CB 3.23Å; A69-S73 PolarHBondContact O-N 3.23Å; A69-F443 HydrophobicContact CB-CB 3.73Å; A69-F443 HydrophobicContact CB-CG 4.26Å
70I97.5Very high95.4Very high34 Ų3446.1 Ų46.117%0.17425%0.248CC..Hα-helixtrans-66.2-44.1174.3-69.9167.6000110.9R40 I43 V44 R66 L67 Y68 S73 S74R40-I70 PolarHBondContact NH1-O 3.21Å; I43-I70 HydrophobicContact CG2-CD1 4.3Å; I43-I70 HydrophobicContact CG2-CG1 3.7Å; V44-I70 HydrophobicContact CG2-CD1 4.1Å; V44-I70 HydrophobicContact CG2-CG1 4.27Å; R66-I70 HydrophobicContact CG-CD1 4.25Å; R66-I70 WeakPolarHBondContact O-CG1 3.44Å; R66-I70 PolarHBondContact O-N 3.49Å; L67-I70 PolarHBondContact O-N 3.34Å; Y68-I70 VanDerWaalsContact C-N 3.33Å; Y68-I70 PolarHBondContact O-N 2.93Å; I70-S73 PolarHBondContact O-N 2.9Å; I70-S74 WeakPolarHBondContact O-CB 3.33Å; I70-S74 PolarHBondContact O-N 3.08Å; I70-S74 PolarHBondContact O-OG 3.45Å
71D98Very high95.8Very high35 Ų3545.6 Ų45.619%0.18724%0.24CC..Hα-helixtrans-63.7-48.1178.4-78.8-19.2000110.8L67 Y68 S73 S74 F75 I159 R162 H163L67-D71 PolarHBondContact O-N 3.21Å; Y68-D71 PolarHBondContact O-N 3.14Å; D71-S73 VanDerWaalsContact C-N 3.34Å; D71-S73 PolarHBondContact O-N 3.33Å; D71-S74 PolarHBondContact O-N 3.34Å; D71-F75 WeakPolarHBondContact O-CB 3.38Å; D71-F75 PolarHBondContact O-N 2.89Å; D71-I159 HydrophobicContact CB-CG2 4.12Å; D71-R162 IonicContact OD1-NH1 3.93Å; D71-R162 PolarHBondContact OD1-NH1 2.88Å; D71-R162 VanDerWaalsContact OD1-NH1 3.09Å; D71-R162 VanDerWaalsContact OD2-CD 3.27Å; D71-R162 WeakPolarHBondContact OD2-CD 3.07Å; D71-R162 IonicContact OD2-CZ 3.09Å; D71-R162 IonicContact OD2-NE 3.99Å; D71-R162 IonicContact OD2-NH1 3.94Å; D71-R162 PolarHBondContact OD2-NH1 3Å; D71-H163 IonicContact OD2-CD2 2.75Å; D71-H163 IonicContact OD2-CE1 3.92Å; D71-H163 IonicContact OD2-NE2 2.79Å; D71-H163 PolarHBondContact OD2-NE2 3.4Å
72R97.4Very high96.5Very high97 Ų9747.2 Ų47.237%0.36625%0.245SC..Hα-helixtrans-59.1-43.8175.3-67.7-67.7-62.8-175.79.8111.8Y68 F75 G76 S155 I159 E160Y68-R72 HydrophobicContact CD2-CG 4.01Å; Y68-R72 HydrophobicContact CE1-CG 4.22Å; Y68-R72 HydrophobicContact CE2-CG 3.7Å; Y68-R72 HydrophobicContact CG-CG 4.43Å; Y68-R72 WeakPolarHBondContact O-CB 3.32Å; Y68-R72 VanDerWaalsContact O-CG 3.3Å; Y68-R72 WeakPolarHBondContact O-CG 3.39Å; Y68-R72 PolarHBondContact O-N 2.9Å; R72-F75 PolarHBondContact O-N 2.94Å; R72-G76 PolarHBondContact O-N 3.43Å; R72-S155 PolarHBondContact NH1-OG 2.97Å; R72-S155 VanDerWaalsContact NH1-OG 3.09Å; R72-I159 HydrophobicContact CG-CG2 4.37Å; R72-E160 IonicContact CZ-OE1 2.7Å; R72-E160 IonicContact NH1-OE1 2.64Å; R72-E160 PolarHBondContact NH1-OE1 2.99Å
73S97.6Very high96.8Very high22 Ų2250.6 Ų50.615%0.15426%0.261CS..Hα-helixtrans-62.7-42.6175.5169.30000112.2R40 A69 I70 D71 G76 L77R40-S73 PolarHBondContact NH1-OG 2.81Å; R40-S73 VanDerWaalsContact NH1-OG 3.12Å; A69-S73 WeakPolarHBondContact O-CB 3.23Å; A69-S73 PolarHBondContact O-N 3.23Å; I70-S73 PolarHBondContact O-N 2.9Å; D71-S73 VanDerWaalsContact C-N 3.34Å; D71-S73 PolarHBondContact O-N 3.33Å; S73-G76 PolarHBondContact O-N 3.14Å; S73-L77 WeakPolarHBondContact O-CG 3.38Å; S73-L77 PolarHBondContact O-N 3.41Å
74S97.4Very high97.1Very high37 Ų3749 Ų4926%0.25925%0.254SS..Hα-helixtrans-64.8-45.7-179.8-53.20000110.7R40 I70 D71 L77 V78R40-S74 VanDerWaalsContact CZ-OG 3.31Å; R40-S74 VanDerWaalsContact NH1-CA 3.32Å; R40-S74 VanDerWaalsContact NH1-N 3.12Å; R40-S74 PolarHBondContact NH1-OG 3.31Å; R40-S74 PolarHBondContact NH2-OG 3.25Å; I70-S74 WeakPolarHBondContact O-CB 3.33Å; I70-S74 PolarHBondContact O-N 3.08Å; I70-S74 PolarHBondContact O-OG 3.45Å; D71-S74 PolarHBondContact O-N 3.34Å; S74-L77 PolarHBondContact O-N 2.84Å; S74-V78 WeakPolarHBondContact O-CG2 3.3Å; S74-V78 PolarHBondContact O-N 2.71Å; S74-V78 VanDerWaalsContact O-N 3.16Å
75F98.5Very high97.4Very high33 Ų3346.5 Ų46.515%0.14525%0.246CC..Hα-helixtrans-57.9-51.1174.9176.4-100.1000111.5D71 R72 L77 V78 S79 W151 Y154 I159D71-F75 WeakPolarHBondContact O-CB 3.38Å; D71-F75 PolarHBondContact O-N 2.89Å; R72-F75 PolarHBondContact O-N 2.94Å; F75-L77 VanDerWaalsContact C-N 3.32Å; F75-L77 PolarHBondContact O-N 3.2Å; F75-V78 PolarHBondContact O-N 2.93Å; F75-V78 VanDerWaalsContact O-N 3.16Å; F75-S79 WeakPolarHBondContact O-CB 3.36Å; F75-S79 PolarHBondContact O-N 3.27Å; F75-S79 PolarHBondContact O-OG 3.46Å; F75-S79 VanDerWaalsContact O-OG 3.06Å; F75-W151 AromaticContact CE2-CE3 3.87Å; F75-W151 HydrophobicContact CE2-CE3 3.87Å; F75-W151 HydrophobicContact CZ-CB 4.2Å; F75-W151 HydrophobicContact CZ-CE3 4.21Å; F75-W151 WeakPolarHBondContact CZ-O 3.47Å; F75-Y154 AromaticContact CD2-CD1 3.66Å; F75-Y154 HydrophobicContact CD2-CD1 3.66Å; F75-Y154 HydrophobicContact CD2-CE1 4.11Å; F75-Y154 AromaticContact CE2-CD1 3.84Å; F75-Y154 HydrophobicContact CE2-CD1 3.84Å; F75-I159 HydrophobicContact CB-CD1 3.41Å; F75-I159 VanDerWaalsContact CB-CD1 3.41Å; F75-I159 HydrophobicContact CD1-CD1 4.22Å; F75-I159 HydrophobicContact CD2-CD1 3.7Å; F75-I159 HydrophobicContact CG-CD1 3.5Å
76G97.8Very high97.6Very high36 Ų3648.6 Ų48.637%0.37126%0.255SS..Hα-helixtrans-59.6-37.6-179.500000113.9R72 S73 S79 G80R72-G76 PolarHBondContact O-N 3.43Å; S73-G76 PolarHBondContact O-N 3.14Å; G76-S79 PolarHBondContact O-OG 3.14Å; G76-G80 WeakPolarHBondContact O-CA 3.37Å; G76-G80 PolarHBondContact O-N 3.03Å
77L98.2Very high97.6Very high40 Ų4049.6 Ų49.621%0.20926%0.263CS..Hα-helixtrans-67.3-42.1175.7-71.4173000112.2T33 I37 S73 S74 F75 F81T33-L77 HydrophobicContact CG2-CD2 4.05Å; I37-L77 HydrophobicContact CG1-CD2 4.34Å; S73-L77 WeakPolarHBondContact O-CG 3.38Å; S73-L77 PolarHBondContact O-N 3.41Å; S74-L77 PolarHBondContact O-N 2.84Å; F75-L77 VanDerWaalsContact C-N 3.32Å; F75-L77 PolarHBondContact O-N 3.2Å; L77-F81 WeakPolarHBondContact O-CB 3.47Å; L77-F81 PolarHBondContact O-N 2.77Å; L77-F81 VanDerWaalsContact O-N 3.11Å
78V98.3Very high97.6Very high92 Ų9246 Ų4656%0.55825%0.245SC*.Hα-helixtrans-71.6-48.7-179.4174.10000111.2S74 F75 F81 Y82 W151S74-V78 WeakPolarHBondContact O-CG2 3.3Å; S74-V78 PolarHBondContact O-N 2.71Å; S74-V78 VanDerWaalsContact O-N 3.16Å; F75-V78 PolarHBondContact O-N 2.93Å; F75-V78 VanDerWaalsContact O-N 3.16Å; V78-F81 PolarHBondContact O-N 3.33Å; V78-Y82 PolarHBondContact O-N 3.12Å; V78-W151 HydrophobicContact CG1-CZ3 4.47Å
79S98.2Very high97.6Very high15 Ų1547.7 Ų47.711%0.10526%0.257CS..Hα-helixtrans-66.2-39.5178.865.60000111.2F75 G76 F81 Y82 H83F75-S79 WeakPolarHBondContact O-CB 3.36Å; F75-S79 PolarHBondContact O-N 3.27Å; F75-S79 PolarHBondContact O-OG 3.46Å; F75-S79 VanDerWaalsContact O-OG 3.06Å; G76-S79 PolarHBondContact O-OG 3.14Å; S79-F81 VanDerWaalsContact C-N 3.33Å; S79-F81 PolarHBondContact O-N 2.97Å; S79-Y82 WeakPolarHBondContact O-CB 3.32Å; S79-Y82 PolarHBondContact O-N 3.26Å; S79-H83 PolarHBondContact O-CD2 3.34Å; S79-H83 PolarHBondContact O-N 3.18Å
80G98Very high97.4Very high23 Ų2348 Ų4824%0.23726%0.258CS..Hα-helixtrans-59.4-43.317500000112.2Y29 G76 H83 M84Y29-G80 WeakPolarHBondContact CE2-O 3.22Å; G76-G80 WeakPolarHBondContact O-CA 3.37Å; G76-G80 PolarHBondContact O-N 3.03Å; G80-H83 PolarHBondContact O-N 3.13Å; G80-M84 PolarHBondContact O-N 2.94Å
81F98.5Very high97Very high107 Ų10747 Ų4747%0.46925%0.252SS..Hα-helixtrans-64-45175.3-176.1-115.9000112.2Y29 L77 V78 S79 H83 M84 I85Y29-F81 HydrophobicContact CE1-CD2 4.36Å; Y29-F81 WeakPolarHBondContact OH-CA 3.49Å; Y29-F81 VanDerWaalsContact OH-CB 3.31Å; Y29-F81 WeakPolarHBondContact OH-CB 3.3Å; Y29-F81 PolarHBondContact OH-N 3.29Å; L77-F81 WeakPolarHBondContact O-CB 3.47Å; L77-F81 PolarHBondContact O-N 2.77Å; L77-F81 VanDerWaalsContact O-N 3.11Å; V78-F81 PolarHBondContact O-N 3.33Å; S79-F81 VanDerWaalsContact C-N 3.33Å; S79-F81 PolarHBondContact O-N 2.97Å; F81-H83 PolarHBondContact O-N 2.88Å; F81-M84 PolarHBondContact O-N 3.25Å; F81-I85 HydrophobicContact CD1-CG1 4.47Å; F81-I85 HydrophobicContact CD2-CG1 4.42Å; F81-I85 HydrophobicContact CE1-CG1 4.1Å; F81-I85 HydrophobicContact CE2-CD1 4.05Å; F81-I85 HydrophobicContact CE2-CG1 4.05Å; F81-I85 HydrophobicContact CZ-CD1 3.93Å; F81-I85 HydrophobicContact CZ-CG1 3.87Å; F81-I85 WeakPolarHBondContact O-CG1 3.25Å; F81-I85 PolarHBondContact O-N 3.31Å
82Y98.4Very high96.6Very high94 Ų9452.9 Ų52.937%0.36927%0.273SS..Hα-helixtrans-54.6-52.7175.2172.6-94.2000111.7V78 S79 M84 I85 E86 D147 W151V78-Y82 PolarHBondContact O-N 3.12Å; S79-Y82 WeakPolarHBondContact O-CB 3.32Å; S79-Y82 PolarHBondContact O-N 3.26Å; Y82-M84 VanDerWaalsContact C-N 3.29Å; Y82-M84 PolarHBondContact O-N 3.36Å; Y82-I85 WeakPolarHBondContact O-CB 3.44Å; Y82-I85 PolarHBondContact O-N 2.8Å; Y82-I85 VanDerWaalsContact O-N 3.12Å; Y82-E86 WeakPolarHBondContact O-CB 3.3Å; Y82-E86 PolarHBondContact O-N 3.23Å; Y82-D147 PolarHBondContact OH-OD1 3.43Å; Y82-W151 AromaticContact CD1-CE2 3.7Å; Y82-W151 HydrophobicContact CD1-CH2 4.43Å; Y82-W151 AromaticContact CD1-CZ2 3.37Å; Y82-W151 HydrophobicContact CD1-CZ2 3.37Å; Y82-W151 AromaticContact CD1-NE1 3.61Å; Y82-W151 AromaticContact CD2-CZ2 3.8Å; Y82-W151 HydrophobicContact CD2-CZ2 3.8Å; Y82-W151 AromaticContact CE1-CZ2 3.91Å; Y82-W151 HydrophobicContact CE1-CZ2 3.91Å; Y82-W151 AromaticContact CE1-NE1 3.52Å; Y82-W151 HydrophobicContact CE2-CZ2 4.27Å; Y82-W151 HydrophobicContact CG-CH2 4.04Å; Y82-W151 AromaticContact CG-CZ2 3.31Å; Y82-W151 HydrophobicContact CG-CZ2 3.31Å
83H98Very high96.3Very high72 Ų7254.2 Ų54.233%0.33328%0.282SS..Hα-helixtrans-64.5-33.4-178.8-69.2-52.3000112.5S79 G80 F81 E86 L87 D147 W151S79-H83 PolarHBondContact O-CD2 3.34Å; S79-H83 PolarHBondContact O-N 3.18Å; G80-H83 PolarHBondContact O-N 3.13Å; F81-H83 PolarHBondContact O-N 2.88Å; H83-E86 IonicContact CE1-OE2 3.86Å; H83-E86 IonicContact ND1-OE2 2.83Å; H83-E86 PolarHBondContact ND1-OE2 3.32Å; H83-E86 VanDerWaalsContact ND1-OE2 3.07Å; H83-E86 PolarHBondContact O-N 3.47Å; H83-L87 VanDerWaalsContact O-CB 3.23Å; H83-L87 WeakPolarHBondContact O-CB 3.41Å; H83-L87 PolarHBondContact O-N 3.07Å; H83-D147 IonicContact CE1-OD2 2.71Å; H83-W151 AromaticContact CE1-CD1 3.97Å; H83-W151 AromaticContact CE1-NE1 3.87Å
84M97.9Very high95.8Very high14 Ų1454.7 Ų54.77%0.06929%0.285CS..Hα-helixtrans-67.4-38.2174.8-17060.1-157.600111.9L25 W26 Y29 G80 F81 Y82 L87 S88L25-M84 HydrophobicContact CB-CE 4.04Å; W26-M84 HydrophobicContact CB-CE 4.18Å; W26-M84 HydrophobicContact CD2-CE 3.47Å; W26-M84 VanDerWaalsContact CD2-CE 3.47Å; W26-M84 HydrophobicContact CD2-CG 4.2Å; W26-M84 VanDerWaalsContact CE2-CE 3.45Å; W26-M84 HydrophobicContact CE3-CE 4.18Å; W26-M84 HydrophobicContact CE3-CG 4.05Å; W26-M84 HydrophobicContact CG-CE 3.45Å; W26-M84 VanDerWaalsContact CG-CE 3.45Å; W26-M84 HydrophobicContact CH2-CG 3.79Å; W26-M84 HydrophobicContact CZ2-CE 4.15Å; W26-M84 HydrophobicContact CZ2-CG 3.93Å; W26-M84 HydrophobicContact CZ3-CG 3.84Å; Y29-M84 HydrophobicContact CD1-CB 4.23Å; Y29-M84 HydrophobicContact CD1-CG 3.8Å; Y29-M84 HydrophobicContact CD2-CB 3.89Å; Y29-M84 HydrophobicContact CD2-CG 4.09Å; Y29-M84 HydrophobicContact CE1-CB 4.36Å; Y29-M84 HydrophobicContact CE1-CG 4.33Å; Y29-M84 HydrophobicContact CE2-CB 4.03Å; Y29-M84 HydrophobicContact CG-CB 4Å; Y29-M84 HydrophobicContact CG-CG 3.68Å; Y29-M84 HydrophobicContact CG-SD 4.11Å; G80-M84 PolarHBondContact O-N 2.94Å; F81-M84 PolarHBondContact O-N 3.25Å; Y82-M84 VanDerWaalsContact C-N 3.29Å; Y82-M84 PolarHBondContact O-N 3.36Å; M84-L87 HydrophobicContact SD-CD2 4.4Å; M84-S88 VanDerWaalsContact O-CB 3.26Å; M84-S88 WeakPolarHBondContact O-CB 3.42Å; M84-S88 PolarHBondContact O-N 3.09Å; M84-S88 PolarHBondContact O-OG 2.87Å
85I98.3Very high95.6Very high70 Ų7056 Ų5636%0.35929%0.289SS..Hα-helixtrans-66.7-46.7173.5-65.7-62.7000110.6W26 F81 Y82 L87 S88 V89W26-I85 HydrophobicContact CH2-CD1 4.04Å; W26-I85 HydrophobicContact CZ2-CD1 4.36Å; F81-I85 HydrophobicContact CD1-CG1 4.47Å; F81-I85 HydrophobicContact CD2-CG1 4.42Å; F81-I85 HydrophobicContact CE1-CG1 4.1Å; F81-I85 HydrophobicContact CE2-CD1 4.05Å; F81-I85 HydrophobicContact CE2-CG1 4.05Å; F81-I85 HydrophobicContact CZ-CD1 3.93Å; F81-I85 HydrophobicContact CZ-CG1 3.87Å; F81-I85 WeakPolarHBondContact O-CG1 3.25Å; F81-I85 PolarHBondContact O-N 3.31Å; Y82-I85 WeakPolarHBondContact O-CB 3.44Å; Y82-I85 PolarHBondContact O-N 2.8Å; Y82-I85 VanDerWaalsContact O-N 3.12Å; I85-L87 PolarHBondContact O-N 2.85Å; I85-S88 WeakPolarHBondContact O-CB 3.06Å; I85-S88 PolarHBondContact O-N 3Å; I85-S88 VanDerWaalsContact O-N 3.15Å; I85-V89 HydrophobicContact CG2-CG2 4.26Å; I85-V89 WeakPolarHBondContact O-CB 3.15Å; I85-V89 VanDerWaalsContact O-CG2 3.28Å; I85-V89 WeakPolarHBondContact O-CG2 3.17Å; I85-V89 PolarHBondContact O-N 3.44Å
86E97.1Very high95.3Very high45 Ų4555.9 Ų55.921%0.2129%0.29CS..Hα-helixtrans-56.2-49.2176.9-174.1-158.5163.400111.5Y82 H83 S88 V89 T90Y82-E86 WeakPolarHBondContact O-CB 3.3Å; Y82-E86 PolarHBondContact O-N 3.23Å; H83-E86 IonicContact CE1-OE2 3.86Å; H83-E86 IonicContact ND1-OE2 2.83Å; H83-E86 PolarHBondContact ND1-OE2 3.32Å; H83-E86 VanDerWaalsContact ND1-OE2 3.07Å; H83-E86 PolarHBondContact O-N 3.47Å; E86-S88 VanDerWaalsContact C-N 3.33Å; E86-S88 PolarHBondContact O-N 2.75Å; E86-V89 PolarHBondContact O-N 3.08Å; E86-T90 VanDerWaalsContact O-CB 3.28Å; E86-T90 WeakPolarHBondContact O-CB 3.3Å; E86-T90 PolarHBondContact O-N 3.47Å; E86-T90 PolarHBondContact O-OG1 2.9Å
87L95.9Very high94.9Very high47 Ų4754.6 Ų54.625%0.24628%0.275CS..Hα-helixtrans-60.8-43.6175.7176.859.4000111.2L25 H83 M84 I85 T90 L91 Y392L25-L87 HydrophobicContact CD1-CD2 4.13Å; H83-L87 VanDerWaalsContact O-CB 3.23Å; H83-L87 WeakPolarHBondContact O-CB 3.41Å; H83-L87 PolarHBondContact O-N 3.07Å; M84-L87 HydrophobicContact SD-CD2 4.4Å; I85-L87 PolarHBondContact O-N 2.85Å; L87-T90 PolarHBondContact O-N 3.11Å; L87-L91 HydrophobicContact CD1-CD1 3.94Å; L87-L91 HydrophobicContact CD1-CG 4.07Å; L87-L91 HydrophobicContact CG-CD1 4.14Å; L87-L91 WeakPolarHBondContact O-CB 3.32Å; L87-L91 WeakPolarHBondContact O-CG 3.49Å; L87-L91 PolarHBondContact O-N 2.89Å; L87-Y392 HydrophobicContact CD1-CE1 3.79Å
88S96Very high94.6Very high13 Ų1360.1 Ų60.19%0.09129%0.293CS..Hα-helixtrans-63-44.2179.2-64.20000112W26 M84 I85 E86 Y92W26-S88 VanDerWaalsContact CZ2-OG 3.23Å; W26-S88 WeakPolarHBondContact CZ2-OG 3.41Å; W26-S88 PolarHBondContact NE1-OG 3.33Å; M84-S88 VanDerWaalsContact O-CB 3.26Å; M84-S88 WeakPolarHBondContact O-CB 3.42Å; M84-S88 PolarHBondContact O-N 3.09Å; M84-S88 PolarHBondContact O-OG 2.87Å; I85-S88 WeakPolarHBondContact O-CB 3.06Å; I85-S88 PolarHBondContact O-N 3Å; I85-S88 VanDerWaalsContact O-N 3.15Å; E86-S88 VanDerWaalsContact C-N 3.33Å; E86-S88 PolarHBondContact O-N 2.75Å; S88-Y92 WeakPolarHBondContact O-CB 3.41Å; S88-Y92 PolarHBondContact O-N 3.32Å
89V95.9Very high94.4Very high60 Ų6057.2 Ų57.236%0.36427%0.274SS..Hα-helixtrans-63.4-46.6175.6168.50000110I85 E86 L91 Y92 F93 L95I85-V89 HydrophobicContact CG2-CG2 4.26Å; I85-V89 WeakPolarHBondContact O-CB 3.15Å; I85-V89 VanDerWaalsContact O-CG2 3.28Å; I85-V89 WeakPolarHBondContact O-CG2 3.17Å; I85-V89 PolarHBondContact O-N 3.44Å; E86-V89 PolarHBondContact O-N 3.08Å; V89-L91 VanDerWaalsContact C-N 3.33Å; V89-L91 PolarHBondContact O-N 3.18Å; V89-Y92 PolarHBondContact O-N 3.32Å; V89-F93 HydrophobicContact CB-CD2 4.34Å; V89-F93 HydrophobicContact CG1-CD2 3.73Å; V89-F93 HydrophobicContact CG1-CE2 4.18Å; V89-F93 WeakPolarHBondContact O-CB 3.36Å; V89-F93 WeakPolarHBondContact O-CD2 3.47Å; V89-F93 PolarHBondContact O-N 2.98Å; V89-L95 HydrophobicContact CG1-CD1 4.18Å
90T92.2Very high94.1Very high23 Ų2357.2 Ų57.214%0.14127%0.272CS..Hα-helixtrans-57.6-45.4179.3-64.60000112.1E86 L87 S94 L95 I96E86-T90 VanDerWaalsContact O-CB 3.28Å; E86-T90 WeakPolarHBondContact O-CB 3.3Å; E86-T90 PolarHBondContact O-N 3.47Å; E86-T90 PolarHBondContact O-OG1 2.9Å; L87-T90 PolarHBondContact O-N 3.11Å; T90-S94 PolarHBondContact O-N 3.34Å; T90-L95 HydrophobicContact CG2-CB 4.25Å; T90-L95 PolarHBondContact O-N 3.38Å; T90-I96 HydrophobicContact CG2-CD1 3.97Å; T90-I96 HydrophobicContact CG2-CG1 3.76Å
91L90.4Very high93.8Very high11 Ų1159.6 Ų59.66%0.05827%0.274CS..Hα-helixtrans-71.2-51.6177.9-74178.3000112F18 F22 L25 L87 V89 F93 S94 F373 Y392F18-L91 HydrophobicContact CE2-CB 3.87Å; F18-L91 HydrophobicContact CZ-CB 4.16Å; F22-L91 HydrophobicContact CD2-CB 4.43Å; F22-L91 HydrophobicContact CD2-CD1 4.32Å; L25-L91 HydrophobicContact CD1-CD1 3.82Å; L87-L91 HydrophobicContact CD1-CD1 3.94Å; L87-L91 HydrophobicContact CD1-CG 4.07Å; L87-L91 HydrophobicContact CG-CD1 4.14Å; L87-L91 WeakPolarHBondContact O-CB 3.32Å; L87-L91 WeakPolarHBondContact O-CG 3.49Å; L87-L91 PolarHBondContact O-N 2.89Å; V89-L91 VanDerWaalsContact C-N 3.33Å; V89-L91 PolarHBondContact O-N 3.18Å; L91-F93 PolarHBondContact O-N 3.41Å; L91-S94 PolarHBondContact O-N 3.26Å; L91-S94 VanDerWaalsContact O-N 3.15Å; L91-F373 HydrophobicContact CD2-CD1 4.12Å; L91-F373 HydrophobicContact CD2-CE1 4.05Å; L91-Y392 HydrophobicContact CD1-CE1 4.48Å; L91-Y392 HydrophobicContact CD2-CD2 4.12Å; L91-Y392 HydrophobicContact CD2-CE1 4.1Å; L91-Y392 HydrophobicContact CD2-CE2 3.64Å
92Y89.4Confident93.6Very high159 Ų15955.9 Ų55.962%0.62426%0.26SS*.Hα-helixtrans-62.4-41.7-175.1-176.6-95.7000112.5S88 V89 S94S88-Y92 WeakPolarHBondContact O-CB 3.41Å; S88-Y92 PolarHBondContact O-N 3.32Å; V89-Y92 PolarHBondContact O-N 3.32Å; Y92-S94 VanDerWaalsContact C-N 3.32Å
93F90.1Very high93.4Very high125 Ų12551.4 Ų51.455%0.54824%0.243SC..THydrogen-bonded Turntrans-89.87.1178.7-66.1-73.6000113.8V89 L91 L95V89-F93 HydrophobicContact CB-CD2 4.34Å; V89-F93 HydrophobicContact CG1-CD2 3.73Å; V89-F93 HydrophobicContact CG1-CE2 4.18Å; V89-F93 WeakPolarHBondContact O-CB 3.36Å; V89-F93 WeakPolarHBondContact O-CD2 3.47Å; V89-F93 PolarHBondContact O-N 2.98Å; L91-F93 PolarHBondContact O-N 3.41Å; F93-L95 HydrophobicContact CB-CD2 3.79Å; F93-L95 HydrophobicContact CB-CG 4.05Å; F93-L95 PolarHBondContact O-N 3.01Å
94S88.4Confident93.1Very high33 Ų3348.7 Ų48.723%0.23123%0.231CC..THydrogen-bonded Turntrans54.241.2178.2-62.90000112.3T90 L91 Y92 I96 P97 W98T90-S94 PolarHBondContact O-N 3.34Å; L91-S94 PolarHBondContact O-N 3.26Å; L91-S94 VanDerWaalsContact O-N 3.15Å; Y92-S94 VanDerWaalsContact C-N 3.32Å; S94-I96 VanDerWaalsContact C-N 3.25Å; S94-I96 PolarHBondContact O-N 3.24Å; S94-P97 WeakPolarHBondContact O-CD 3.18Å; S94-W98 PolarHBondContact O-N 3.41Å
95L92.2Very high92.8Very high64 Ų6452.1 Ų52.134%0.33525%0.25SC..Hα-helixtrans-66.7-28.1-173.8-62.6-171.4000112.5V89 T90 F93 W98 L99V89-L95 HydrophobicContact CG1-CD1 4.18Å; T90-L95 HydrophobicContact CG2-CB 4.25Å; T90-L95 PolarHBondContact O-N 3.38Å; F93-L95 HydrophobicContact CB-CD2 3.79Å; F93-L95 HydrophobicContact CB-CG 4.05Å; F93-L95 PolarHBondContact O-N 3.01Å; L95-W98 PolarHBondContact O-N 2.91Å; L95-L99 VanDerWaalsContact O-CB 3.26Å; L95-L99 WeakPolarHBondContact O-CB 3.43Å; L95-L99 PolarHBondContact O-N 2.96Å
96I91.7Very high92.6Very high30 Ų3052.5 Ų52.515%0.15425%0.25CC..Hα-helixtrans-66.5-53.3175.3-60.2-59.6000111.6T90 S94 W98 L99 W100 F136 F375 L384 F387T90-I96 HydrophobicContact CG2-CD1 3.97Å; T90-I96 HydrophobicContact CG2-CG1 3.76Å; S94-I96 VanDerWaalsContact C-N 3.25Å; S94-I96 PolarHBondContact O-N 3.24Å; I96-W98 VanDerWaalsContact C-N 3.3Å; I96-W98 PolarHBondContact O-N 3.08Å; I96-L99 PolarHBondContact O-N 3.26Å; I96-W100 PolarHBondContact O-N 3.24Å; I96-F136 HydrophobicContact CG2-CZ 4.22Å; I96-F375 HydrophobicContact CG2-CZ 4.47Å; I96-L384 HydrophobicContact CG2-CD2 3.67Å; I96-F387 HydrophobicContact CD1-CE1 4.31Å; I96-F387 HydrophobicContact CG1-CE1 4.13Å; I96-F387 HydrophobicContact CG2-CD1 4.35Å; I96-F387 HydrophobicContact CG2-CE1 4.41Å
97P89.8Confident92.3Very high9 Ų950.4 Ų50.46%0.05824%0.24CC..Hα-helixtrans-52.6-45.6168.5-22.822.2000113.5S94 L99 W100 Y101 F375S94-P97 WeakPolarHBondContact O-CD 3.18Å; P97-L99 VanDerWaalsContact C-N 3.34Å; P97-L99 PolarHBondContact O-N 3.44Å; P97-W100 WeakPolarHBondContact O-CB 3.31Å; P97-W100 PolarHBondContact O-N 3.48Å; P97-Y101 HydrophobicContact CB-CE2 4.5Å; P97-Y101 WeakPolarHBondContact O-CD2 3.38Å; P97-Y101 PolarHBondContact O-N 2.79Å; P97-F375 HydrophobicContact CB-CD1 4.17Å; P97-F375 HydrophobicContact CB-CE1 3.75Å; P97-F375 HydrophobicContact CB-CE2 4.48Å; P97-F375 HydrophobicContact CB-CZ 3.97Å; P97-F375 HydrophobicContact CG-CD1 4.21Å; P97-F375 HydrophobicContact CG-CD2 4.08Å; P97-F375 HydrophobicContact CG-CE1 3.71Å; P97-F375 HydrophobicContact CG-CE2 3.57Å; P97-F375 HydrophobicContact CG-CG 4.38Å; P97-F375 HydrophobicContact CG-CZ 3.41Å; P97-F375 VanDerWaalsContact CG-CZ 3.41Å
98W92.2Very high92.1Very high156 Ų15650.6 Ų50.659%0.59124%0.243SC*.Hα-helixtrans-59.3-45.2178.7169.282.5000112S94 L95 I96 W100 Y101 T102S94-W98 PolarHBondContact O-N 3.41Å; L95-W98 PolarHBondContact O-N 2.91Å; I96-W98 VanDerWaalsContact C-N 3.3Å; I96-W98 PolarHBondContact O-N 3.08Å; W98-W100 VanDerWaalsContact C-N 3.33Å; W98-W100 PolarHBondContact O-N 3.41Å; W98-Y101 PolarHBondContact O-N 3.41Å; W98-T102 WeakPolarHBondContact O-CB 3.5Å; W98-T102 PolarHBondContact O-N 2.83Å; W98-T102 PolarHBondContact O-OG1 3.45Å
99L94Very high91.9Very high31 Ų3154.7 Ų54.716%0.16226%0.263CS..Hα-helixtrans-62.4-41.8177.7-178.662.6000111.1L95 I96 P97 T102 V103 F136 Y139 V140L95-L99 VanDerWaalsContact O-CB 3.26Å; L95-L99 WeakPolarHBondContact O-CB 3.43Å; L95-L99 PolarHBondContact O-N 2.96Å; I96-L99 PolarHBondContact O-N 3.26Å; P97-L99 VanDerWaalsContact C-N 3.34Å; P97-L99 PolarHBondContact O-N 3.44Å; L99-T102 WeakPolarHBondContact O-CB 3.46Å; L99-T102 PolarHBondContact O-N 2.77Å; L99-V103 HydrophobicContact CD1-CG2 4.43Å; L99-V103 WeakPolarHBondContact O-CB 3.3Å; L99-V103 VanDerWaalsContact O-CG2 3.29Å; L99-V103 WeakPolarHBondContact O-CG2 3.32Å; L99-V103 PolarHBondContact O-N 2.75Å; L99-F136 HydrophobicContact CB-CE2 4.13Å; L99-F136 HydrophobicContact CD2-CD2 4.33Å; L99-F136 HydrophobicContact CD2-CE2 3.77Å; L99-F136 HydrophobicContact CD2-CZ 4.37Å; L99-F136 HydrophobicContact CG-CD2 4.14Å; L99-F136 HydrophobicContact CG-CE2 3.82Å; L99-Y139 HydrophobicContact CD1-CD1 4.02Å; L99-V140 HydrophobicContact CD2-CG2 3.73Å
100W92.6Very high91.6Very high15 Ų1555.9 Ų55.96%0.05727%0.267CS..Hα-helixtrans-58.2-53175.1172.8-103.7000112.3I96 P97 W98 T102 V103 V104 E129 C132 F136 P381 I383 L384I96-W100 PolarHBondContact O-N 3.24Å; P97-W100 WeakPolarHBondContact O-CB 3.31Å; P97-W100 PolarHBondContact O-N 3.48Å; W98-W100 VanDerWaalsContact C-N 3.33Å; W98-W100 PolarHBondContact O-N 3.41Å; W100-T102 PolarHBondContact O-N 3.23Å; W100-V103 WeakPolarHBondContact O-CB 3.46Å; W100-V103 PolarHBondContact O-N 3.05Å; W100-V103 VanDerWaalsContact O-N 3.14Å; W100-V104 HydrophobicContact CD2-CG2 4.17Å; W100-V104 HydrophobicContact CZ2-CG2 3.89Å; W100-V104 WeakPolarHBondContact O-CG2 3.34Å; W100-V104 PolarHBondContact O-N 2.76Å; W100-E129 HydrophobicContact CH2-CG 4.08Å; W100-E129 HydrophobicContact CZ2-CG 4.36Å; W100-C132 HydrophobicContact CH2-CB 3.65Å; W100-C132 HydrophobicContact CZ2-CB 4.2Å; W100-C132 HydrophobicContact CZ3-CB 4.16Å; W100-F136 HydrophobicContact CB-CD2 4.34Å; W100-F136 HydrophobicContact CB-CE2 4.31Å; W100-F136 HydrophobicContact CE3-CB 4.03Å; W100-F136 AromaticContact CE3-CD2 4Å; W100-F136 HydrophobicContact CE3-CD2 4Å; W100-F136 HydrophobicContact CE3-CG 4.01Å; W100-F136 HydrophobicContact CZ3-CB 4.11Å; W100-F136 HydrophobicContact CZ3-CG 4.45Å; W100-P381 HydrophobicContact CD2-CG 3.73Å; W100-P381 VanDerWaalsContact CE2-CG 3.45Å; W100-P381 HydrophobicContact CE3-CG 4.06Å; W100-P381 HydrophobicContact CG-CG 4.31Å; W100-P381 HydrophobicContact CH2-CB 3.64Å; W100-P381 HydrophobicContact CH2-CG 3.88Å; W100-P381 HydrophobicContact CZ2-CB 3.44Å; W100-P381 VanDerWaalsContact CZ2-CB 3.44Å; W100-P381 HydrophobicContact CZ2-CG 3.55Å; W100-P381 HydrophobicContact CZ3-CB 4.27Å; W100-P381 HydrophobicContact CZ3-CG 4.12Å; W100-I383 HydrophobicContact CE3-CG2 4.31Å; W100-I383 HydrophobicContact CH2-CG2 4.41Å; W100-I383 HydrophobicContact CZ3-CG2 3.77Å; W100-L384 HydrophobicContact CB-CD1 3.56Å; W100-L384 HydrophobicContact CD2-CD1 3.91Å; W100-L384 HydrophobicContact CE3-CD1 4.21Å; W100-L384 HydrophobicContact CG-CD1 3.58Å
101Y91.1Very high91.5Very high74 Ų7455.6 Ų55.629%0.2927%0.265SS..Hα-helixtrans-64.2-32.3-179.8-69.6-58000112.3P97 W98 N105 D379P97-Y101 HydrophobicContact CB-CE2 4.5Å; P97-Y101 WeakPolarHBondContact O-CD2 3.38Å; P97-Y101 PolarHBondContact O-N 2.79Å; W98-Y101 PolarHBondContact O-N 3.41Å; Y101-N105 WeakPolarHBondContact O-CB 3.4Å; Y101-N105 PolarHBondContact O-N 3.4Å; Y101-D379 PolarHBondContact OH-OD2 2.97Å; Y101-D379 VanDerWaalsContact OH-OD2 3.04Å
102T93.6Very high91.5Very high28 Ų2858 Ų5817%0.17229%0.286CS..Hα-helixtrans-64.7-46.6173-600000111.1W98 L99 W100 V104 N105 H106W98-T102 WeakPolarHBondContact O-CB 3.5Å; W98-T102 PolarHBondContact O-N 2.83Å; W98-T102 PolarHBondContact O-OG1 3.45Å; L99-T102 WeakPolarHBondContact O-CB 3.46Å; L99-T102 PolarHBondContact O-N 2.77Å; W100-T102 PolarHBondContact O-N 3.23Å; T102-V104 PolarHBondContact O-N 2.95Å; T102-N105 PolarHBondContact O-N 3.14Å; T102-H106 WeakPolarHBondContact O-CB 3.48Å; T102-H106 PolarHBondContact O-CD2 2.96Å; T102-H106 VanDerWaalsContact O-CG 3.3Å; T102-H106 PolarHBondContact O-N 3.07Å
103V93.6Very high91.7Very high0 Ų056.1 Ų56.10%028%0.279CS..Hα-helixtrans-59.7-46175.9162.30000111.2L99 W100 N105 H106 S107 C132 I135 F136 Y139L99-V103 HydrophobicContact CD1-CG2 4.43Å; L99-V103 WeakPolarHBondContact O-CB 3.3Å; L99-V103 VanDerWaalsContact O-CG2 3.29Å; L99-V103 WeakPolarHBondContact O-CG2 3.32Å; L99-V103 PolarHBondContact O-N 2.75Å; W100-V103 WeakPolarHBondContact O-CB 3.46Å; W100-V103 PolarHBondContact O-N 3.05Å; W100-V103 VanDerWaalsContact O-N 3.14Å; V103-N105 VanDerWaalsContact C-N 3.33Å; V103-N105 PolarHBondContact O-N 3.19Å; V103-H106 PolarHBondContact O-N 3.42Å; V103-S107 VanDerWaalsContact O-CB 3.28Å; V103-S107 WeakPolarHBondContact O-CB 3.44Å; V103-S107 PolarHBondContact O-N 3.37Å; V103-S107 PolarHBondContact O-OG 2.79Å; V103-C132 WeakPolarHBondContact CG1-O 3.23Å; V103-I135 HydrophobicContact CG1-CB 3.86Å; V103-I135 HydrophobicContact CG1-CG2 3.7Å; V103-F136 HydrophobicContact CG1-CB 4.08Å; V103-F136 HydrophobicContact CG2-CB 4.38Å; V103-F136 HydrophobicContact CG2-CD2 4.31Å; V103-Y139 HydrophobicContact CG2-CD1 3.56Å; V103-Y139 HydrophobicContact CG2-CD2 4.39Å; V103-Y139 HydrophobicContact CG2-CE1 3.95Å; V103-Y139 HydrophobicContact CG2-CG 3.8Å
104V91.7Very high91.8Very high15 Ų1550.7 Ų50.79%0.09126%0.256CS..Hα-helixtrans-60.4-43.81781710000111W100 T102 S107 T108 K126 C132W100-V104 HydrophobicContact CD2-CG2 4.17Å; W100-V104 HydrophobicContact CZ2-CG2 3.89Å; W100-V104 WeakPolarHBondContact O-CG2 3.34Å; W100-V104 PolarHBondContact O-N 2.76Å; T102-V104 PolarHBondContact O-N 2.95Å; V104-S107 PolarHBondContact O-N 2.84Å; V104-T108 PolarHBondContact O-N 3.46Å; V104-T108 PolarHBondContact O-OG1 3.44Å; V104-K126 HydrophobicContact CG1-CB 4.32Å; V104-K126 HydrophobicContact CG1-CD 4.47Å; V104-K126 HydrophobicContact CG1-CG 3.62Å; V104-C132 HydrophobicContact CG2-CB 4.24Å
105N92.9Very high92Very high87 Ų8751.9 Ų51.947%0.46526%0.261SS..Hα-helixtrans-63.1-48.7176.2-175.954.9000111.9Y101 T102 V103 S107 T108 I109Y101-N105 WeakPolarHBondContact O-CB 3.4Å; Y101-N105 PolarHBondContact O-N 3.4Å; T102-N105 PolarHBondContact O-N 3.14Å; V103-N105 VanDerWaalsContact C-N 3.33Å; V103-N105 PolarHBondContact O-N 3.19Å; N105-S107 VanDerWaalsContact C-N 3.3Å; N105-S107 PolarHBondContact O-N 3.29Å; N105-T108 PolarHBondContact O-N 3.48Å; N105-I109 WeakPolarHBondContact O-CG1 3.25Å; N105-I109 PolarHBondContact O-N 3.03Å
106H93.6Very high92.1Very high78 Ų7855.6 Ų55.636%0.36128%0.282SS..Hα-helixtrans-61.6-38.6177.7-70.2-177.6000112.2T102 V103 I109 L110 Y139T102-H106 WeakPolarHBondContact O-CB 3.48Å; T102-H106 PolarHBondContact O-CD2 2.96Å; T102-H106 VanDerWaalsContact O-CG 3.3Å; T102-H106 PolarHBondContact O-N 3.07Å; V103-H106 PolarHBondContact O-N 3.42Å; H106-I109 PolarHBondContact O-N 2.98Å; H106-L110 WeakPolarHBondContact O-CB 3.36Å; H106-L110 PolarHBondContact O-N 3.41Å; H106-Y139 AromaticContact ND1-CE1 3.72Å; H106-Y139 AromaticContact ND1-CZ 3.83Å; H106-Y139 PolarHBondContact ND1-OH 3.32Å
107S91.5Very high92.2Very high1 Ų159.9 Ų59.91%0.00730%0.299CS..Hα-helixtrans-62-44.6176.3-56.80000110.8V103 V104 N105 L110 N111 F124 I135V103-S107 VanDerWaalsContact O-CB 3.28Å; V103-S107 WeakPolarHBondContact O-CB 3.44Å; V103-S107 PolarHBondContact O-N 3.37Å; V103-S107 PolarHBondContact O-OG 2.79Å; V104-S107 PolarHBondContact O-N 2.84Å; N105-S107 VanDerWaalsContact C-N 3.3Å; N105-S107 PolarHBondContact O-N 3.29Å; S107-L110 PolarHBondContact O-N 3.15Å; S107-N111 PolarHBondContact O-N 3.24Å; S107-F124 CarbonylContact C-O 3.58Å; S107-F124 WeakPolarHBondContact O-CB 3.46Å; S107-I135 WeakPolarHBondContact OG-CD1 3.16Å
108T90.8Very high92.5Very high50 Ų5065.9 Ų65.931%0.30732%0.324SS..Hα-helixtrans-63.1-44.2177.3-53.20000111.8V104 N105 N111 A112 F124V104-T108 PolarHBondContact O-N 3.46Å; V104-T108 PolarHBondContact O-OG1 3.44Å; N105-T108 PolarHBondContact O-N 3.48Å; T108-N111 WeakPolarHBondContact O-CB 3.45Å; T108-N111 PolarHBondContact O-N 3.22Å; T108-A112 PolarHBondContact O-N 3.17Å; T108-F124 WeakPolarHBondContact CA-O 3.3Å; T108-F124 PolarHBondContact N-O 3.3Å
109I91.7Very high92.5Very high99 Ų9961.6 Ų61.651%0.50833%0.329SS..Hα-helixtrans-63.8-44.3177.6-67.4165.4000110.7N105 H106 N111 A112 Y113N105-I109 WeakPolarHBondContact O-CG1 3.25Å; N105-I109 PolarHBondContact O-N 3.03Å; H106-I109 PolarHBondContact O-N 2.98Å; I109-N111 VanDerWaalsContact C-N 3.33Å; I109-N111 PolarHBondContact O-N 3.17Å; I109-A112 PolarHBondContact O-N 3.04Å; I109-Y113 PolarHBondContact O-N 2.81Å
110L89.9Confident92.3Very high85 Ų8564 Ų6445%0.44534%0.344SS..Hα-helixtrans-61.4-42.8177179.963.1000111.1H106 S107 Y113 V114H106-L110 WeakPolarHBondContact O-CB 3.36Å; H106-L110 PolarHBondContact O-N 3.41Å; S107-L110 PolarHBondContact O-N 3.15Å; L110-Y113 PolarHBondContact O-N 3.21Å; L110-V114 HydrophobicContact CD1-CG2 4.32Å; L110-V114 VanDerWaalsContact O-CG2 3.27Å; L110-V114 WeakPolarHBondContact O-CG2 3.48Å; L110-V114 PolarHBondContact O-N 3.39Å
111N90.2Very high92Very high18 Ų1868.3 Ų68.310%0.09637%0.368CS..Hα-helixtrans-59.1-50.4176.4-156.157.9000111.7S107 T108 I109 Y113 V114 V115 D121 M122 G123 F124S107-N111 PolarHBondContact O-N 3.24Å; T108-N111 WeakPolarHBondContact O-CB 3.45Å; T108-N111 PolarHBondContact O-N 3.22Å; I109-N111 VanDerWaalsContact C-N 3.33Å; I109-N111 PolarHBondContact O-N 3.17Å; N111-Y113 VanDerWaalsContact C-N 3.28Å; N111-Y113 PolarHBondContact O-N 3Å; N111-V114 PolarHBondContact O-N 3.13Å; N111-V114 VanDerWaalsContact O-N 3.12Å; N111-V115 VanDerWaalsContact O-CG2 3.31Å; N111-V115 WeakPolarHBondContact O-CG2 3.4Å; N111-V115 PolarHBondContact O-N 2.74Å; N111-D121 PolarHBondContact ND2-OD1 2.99Å; N111-D121 PolarHBondContact OD1-OD1 2.92Å; N111-M122 PolarHBondContact OD1-N 2.65Å; N111-G123 PolarHBondContact OD1-N 2.94Å; N111-G123 VanDerWaalsContact OD1-N 3.13Å; N111-F124 HydrophobicContact CB-CB 3.85Å; N111-F124 WeakPolarHBondContact CB-O 3.37Å; N111-F124 PolarHBondContact OD1-N 3Å
112A91.2Very high91.6Very high60 Ų6069.1 Ų69.150%0.49638%0.376SS..Hα-helixtrans-58.9-41.9-179.700000111.5T108 I109 V115 D116T108-A112 PolarHBondContact O-N 3.17Å; I109-A112 PolarHBondContact O-N 3.04Å; A112-V115 PolarHBondContact O-N 3.28Å; A112-D116 VanDerWaalsContact O-CB 3.3Å; A112-D116 WeakPolarHBondContact O-CB 3.39Å; A112-D116 PolarHBondContact O-N 2.76Å
113Y92.1Very high91.1Very high121 Ų12168.2 Ų68.248%0.47537%0.372SS..Hα-helixtrans-62.3-43175.3179.3-97.4000112.7I109 L110 N111 K117I109-Y113 PolarHBondContact O-N 2.81Å; L110-Y113 PolarHBondContact O-N 3.21Å; N111-Y113 VanDerWaalsContact C-N 3.28Å; N111-Y113 PolarHBondContact O-N 3Å; Y113-K117 HydrophobicContact CE1-CD 3.78Å; Y113-K117 HydrophobicContact CE2-CD 4.34Å; Y113-K117 VanDerWaalsContact O-CB 3.24Å; Y113-K117 WeakPolarHBondContact O-CB 3.32Å; Y113-K117 PolarHBondContact O-N 2.96Å; Y113-K117 VanDerWaalsContact OH-CD 3.27Å; Y113-K117 WeakPolarHBondContact OH-CD 3.43Å; Y113-K117 PolarHBondContact OH-NZ 3.42Å
114V91.9Very high90.5Very high11 Ų1170.3 Ų70.37%0.06738%0.381CS..Hα-helixtrans-69.2-40.6-179.8174.10000111L110 N111 K117 F118 G119 V120 M122L110-V114 HydrophobicContact CD1-CG2 4.32Å; L110-V114 VanDerWaalsContact O-CG2 3.27Å; L110-V114 WeakPolarHBondContact O-CG2 3.48Å; L110-V114 PolarHBondContact O-N 3.39Å; N111-V114 PolarHBondContact O-N 3.13Å; N111-V114 VanDerWaalsContact O-N 3.12Å; V114-K117 PolarHBondContact O-N 3.04Å; V114-F118 HydrophobicContact CB-CD2 4.5Å; V114-F118 HydrophobicContact CG1-CD2 4.06Å; V114-F118 WeakPolarHBondContact O-CA 3.18Å; V114-F118 WeakPolarHBondContact O-CB 3.19Å; V114-F118 PolarHBondContact O-N 3.13Å; V114-G119 PolarHBondContact O-N 3.47Å; V114-V120 WeakPolarHBondContact CG1-O 3.08Å; V114-M122 HydrophobicContact CB-CE 4.32Å; V114-M122 HydrophobicContact CG1-CE 3.53Å; V114-M122 HydrophobicContact CG1-CG 4.18Å; V114-M122 HydrophobicContact CG2-CE 3.97Å
115V93.2Very high89.6Confident58 Ų5871.9 Ų71.935%0.35239%0.389SS..Hα-helixtrans-61.6-47.6175171.70000110.5N111 A112 G119 V120 D121N111-V115 VanDerWaalsContact O-CG2 3.31Å; N111-V115 WeakPolarHBondContact O-CG2 3.4Å; N111-V115 PolarHBondContact O-N 2.74Å; A112-V115 PolarHBondContact O-N 3.28Å; V115-G119 WeakPolarHBondContact O-CA 3.36Å; V115-G119 PolarHBondContact O-N 2.88Å; V115-V120 WeakPolarHBondContact CG2-O 3.37Å; V115-D121 HydrophobicContact CG2-CB 3.85Å
116D94Very high88.6Confident142 Ų14275.2 Ų75.276%0.75940%0.4SS*.Hα-helixtrans-62.2-45.5178.9-17972.6000112.1A112A112-D116 VanDerWaalsContact O-CB 3.3Å; A112-D116 WeakPolarHBondContact O-CB 3.39Å; A112-D116 PolarHBondContact O-N 2.76Å
117K95Very high87.9Confident120 Ų12078.3 Ų78.352%0.52242%0.419SS..Hα-helixtrans-84.3-33.7-172.9-170.8169.8-175.1-176.40114.6Y113 V114Y113-K117 HydrophobicContact CE1-CD 3.78Å; Y113-K117 HydrophobicContact CE2-CD 4.34Å; Y113-K117 VanDerWaalsContact O-CB 3.24Å; Y113-K117 WeakPolarHBondContact O-CB 3.32Å; Y113-K117 PolarHBondContact O-N 2.96Å; Y113-K117 VanDerWaalsContact OH-CD 3.27Å; Y113-K117 WeakPolarHBondContact OH-CD 3.43Å; Y113-K117 PolarHBondContact OH-NZ 3.42Å; V114-K117 PolarHBondContact O-N 3.04Å
118F95.2Very high87.7Confident134 Ų13479.6 Ų79.659%0.58843%0.428SS*.Hα-helixtrans-121.3-7.4-172.4-56.8-75000113.3V114 V120V114-F118 HydrophobicContact CB-CD2 4.5Å; V114-F118 HydrophobicContact CG1-CD2 4.06Å; V114-F118 WeakPolarHBondContact O-CA 3.18Å; V114-F118 WeakPolarHBondContact O-CB 3.19Å; V114-F118 PolarHBondContact O-N 3.13Å; F118-V120 PolarHBondContact O-N 2.94Å
119G92.2Very high87.6Confident66 Ų6678.8 Ų78.868%0.6842%0.421SS*.SBendtrans69.212.6-177.700000114.2V114 V115V114-G119 PolarHBondContact O-N 3.47Å; V115-G119 WeakPolarHBondContact O-CA 3.36Å; V115-G119 PolarHBondContact O-N 2.88Å
120V89.8Confident87.6Confident82 Ų8276.6 Ų76.650%0.49741%0.41SS..  trans-109.7116.3-176.7179.50000109.7V114 V115 F118 M122V114-V120 WeakPolarHBondContact CG1-O 3.08Å; V115-V120 WeakPolarHBondContact CG2-O 3.37Å; F118-V120 PolarHBondContact O-N 2.94Å; V120-M122 HydrophobicContact CG1-CG 4.44Å; V120-M122 PolarHBondContact O-N 2.95Å
121D86.2Confident87.7Confident105 Ų10576.1 Ų76.156%0.56140%0.404SS*.  trans-81.9107.2169.6-171.24.7000109.9N111 V115 G123N111-D121 PolarHBondContact ND2-OD1 2.99Å; N111-D121 PolarHBondContact OD1-OD1 2.92Å; V115-D121 HydrophobicContact CG2-CB 3.85Å; D121-G123 PolarHBondContact O-N 2.92Å; D121-G123 VanDerWaalsContact OD1-CA 3.29Å; D121-G123 WeakPolarHBondContact OD1-CA 3.45Å; D121-G123 PolarHBondContact OD1-N 2.54Å
122M84.3Confident87.8Confident92 Ų9275.3 Ų75.345%0.45340%0.4SS..  trans-78.6-6173.7-62.5-152.1-143.900111.8N111 V114 V120 F124 K131N111-M122 PolarHBondContact OD1-N 2.65Å; V114-M122 HydrophobicContact CB-CE 4.32Å; V114-M122 HydrophobicContact CG1-CE 3.53Å; V114-M122 HydrophobicContact CG1-CG 4.18Å; V114-M122 HydrophobicContact CG2-CE 3.97Å; V120-M122 HydrophobicContact CG1-CG 4.44Å; V120-M122 PolarHBondContact O-N 2.95Å; M122-F124 VanDerWaalsContact C-N 3.31Å; M122-F124 HydrophobicContact CB-CD2 3.51Å; M122-F124 HydrophobicContact CB-CE2 3.57Å; M122-F124 HydrophobicContact CB-CG 4.47Å; M122-F124 HydrophobicContact CG-CD2 4.41Å; M122-F124 HydrophobicContact CG-CE2 4.18Å; M122-F124 PolarHBondContact O-N 2.83Å; M122-F124 HydrophobicContact SD-CD2 4.37Å; M122-F124 HydrophobicContact SD-CE2 3.62Å; M122-K131 PolarHBondContact O-NZ 2.95Å
123G81.7Confident87.8Confident9 Ų972.7 Ų72.79%0.09338%0.378CS..  trans60.936.9-17700000112.3N111 D121 D125 S128 K131N111-G123 PolarHBondContact OD1-N 2.94Å; N111-G123 VanDerWaalsContact OD1-N 3.13Å; D121-G123 PolarHBondContact O-N 2.92Å; D121-G123 VanDerWaalsContact OD1-CA 3.29Å; D121-G123 WeakPolarHBondContact OD1-CA 3.45Å; D121-G123 PolarHBondContact OD1-N 2.54Å; G123-D125 VanDerWaalsContact C-N 3.26Å; G123-D125 PolarHBondContact O-N 3.17Å; G123-D125 VanDerWaalsContact O-N 3.13Å; G123-S128 WeakPolarHBondContact O-CB 3.47Å; G123-S128 PolarHBondContact O-OG 3.44Å; G123-K131 VanDerWaalsContact C-NZ 3.33Å; G123-K131 WeakPolarHBondContact O-CD 3.41Å; G123-K131 PolarHBondContact O-NZ 3.06Å
124F80.8Confident87.9Confident43 Ų4368.5 Ų68.519%0.18937%0.365CS..  trans-80.279.3169.9-70.5-65.6000109.1S107 T108 N111 M122 K131 I135S107-F124 CarbonylContact C-O 3.58Å; S107-F124 WeakPolarHBondContact O-CB 3.46Å; T108-F124 WeakPolarHBondContact CA-O 3.3Å; T108-F124 PolarHBondContact N-O 3.3Å; N111-F124 HydrophobicContact CB-CB 3.85Å; N111-F124 WeakPolarHBondContact CB-O 3.37Å; N111-F124 PolarHBondContact OD1-N 3Å; M122-F124 VanDerWaalsContact C-N 3.31Å; M122-F124 HydrophobicContact CB-CD2 3.51Å; M122-F124 HydrophobicContact CB-CE2 3.57Å; M122-F124 HydrophobicContact CB-CG 4.47Å; M122-F124 HydrophobicContact CG-CD2 4.41Å; M122-F124 HydrophobicContact CG-CE2 4.18Å; M122-F124 PolarHBondContact O-N 2.83Å; M122-F124 HydrophobicContact SD-CD2 4.37Å; M122-F124 HydrophobicContact SD-CE2 3.62Å; F124-K131 HydrophobicContact CD1-CB 3.67Å; F124-K131 HydrophobicContact CD1-CD 3.93Å; F124-K131 HydrophobicContact CD1-CG 4.34Å; F124-K131 HydrophobicContact CE1-CB 3.78Å; F124-K131 HydrophobicContact CE1-CD 4.07Å; F124-K131 HydrophobicContact CE1-CG 4.26Å; F124-I135 HydrophobicContact CD1-CD1 3.71Å; F124-I135 HydrophobicContact CE1-CD1 3.78Å; F124-I135 HydrophobicContact CG-CD1 4.47Å
125D74.1Confident87.9Confident48 Ų4869.1 Ų69.126%0.25737%0.367SS..SBendtrans-125.5179.5-17957.629.4000111.8G123 D127 S128 C132G123-D125 VanDerWaalsContact C-N 3.26Å; G123-D125 PolarHBondContact O-N 3.17Å; G123-D125 VanDerWaalsContact O-N 3.13Å; D125-D127 PolarHBondContact O-N 2.94Å; D125-D127 PolarHBondContact OD1-N 2.93Å; D125-D127 VanDerWaalsContact OD1-N 3.09Å; D125-S128 PolarHBondContact O-N 3.02Å; D125-S128 WeakPolarHBondContact OD1-CB 3.25Å; D125-S128 PolarHBondContact OD1-N 2.85Å; D125-S128 PolarHBondContact OD1-OG 2.67Å; D125-C132 PolarHBondContact O-SG 2.93Å; D125-C132 VanDerWaalsContact O-SG 3.34Å
126K72Confident88Confident158 Ų15866.9 Ų66.969%0.68735%0.353SS*.SBendtrans-64.2-25.3178.1-60.9-176.7177.8172.60112.4V104V104-K126 HydrophobicContact CG1-CB 4.32Å; V104-K126 HydrophobicContact CG1-CD 4.47Å; V104-K126 HydrophobicContact CG1-CG 3.62Å
127D78.5Confident88Confident142 Ų14262.6 Ų62.676%0.75933%0.328SS*.SBendtrans-83.4-23.5-176.5-57.3-42.1000111.4D125 E129D125-D127 PolarHBondContact O-N 2.94Å; D125-D127 PolarHBondContact OD1-N 2.93Å; D125-D127 VanDerWaalsContact OD1-N 3.09Å; D127-E129 PolarHBondContact O-N 3.13Å; D127-E129 VanDerWaalsContact O-N 3.11Å
128S87.1Confident88Confident29 Ų2960 Ų6020%0.20332%0.319CS..  trans-88.463.5-178.8-64.80000113.3G123 D125 I130 K131 C132G123-S128 WeakPolarHBondContact O-CB 3.47Å; G123-S128 PolarHBondContact O-OG 3.44Å; D125-S128 PolarHBondContact O-N 3.02Å; D125-S128 WeakPolarHBondContact OD1-CB 3.25Å; D125-S128 PolarHBondContact OD1-N 2.85Å; D125-S128 PolarHBondContact OD1-OG 2.67Å; S128-I130 VanDerWaalsContact C-N 3.29Å; S128-I130 PolarHBondContact O-N 2.95Å; S128-I130 VanDerWaalsContact O-N 3.15Å; S128-K131 PolarHBondContact O-N 3.32Å; S128-C132 PolarHBondContact O-N 2.93Å; S128-C132 VanDerWaalsContact O-N 3.13Å
129E89.3Confident88Confident32 Ų3257.4 Ų57.415%0.1531%0.306CS..Hα-helixtrans-53.8-37.8-175.9-168-169.214700114.5W100 D127 K131 C132 S133 K200 P381 V382W100-E129 HydrophobicContact CH2-CG 4.08Å; W100-E129 HydrophobicContact CZ2-CG 4.36Å; D127-E129 PolarHBondContact O-N 3.13Å; D127-E129 VanDerWaalsContact O-N 3.11Å; E129-K131 VanDerWaalsContact C-N 3.33Å; E129-K131 PolarHBondContact O-N 3.35Å; E129-C132 PolarHBondContact O-N 3.28Å; E129-S133 VanDerWaalsContact O-CB 3.3Å; E129-S133 WeakPolarHBondContact O-CB 3.11Å; E129-S133 PolarHBondContact O-N 2.96Å; E129-S133 PolarHBondContact O-OG 3.29Å; E129-K200 WeakPolarHBondContact OE2-CE 3.42Å; E129-K200 IonicContact OE2-NZ 3.88Å; E129-K200 PolarHBondContact OE2-NZ 3.28Å; E129-P381 HydrophobicContact CG-CB 3.84Å; E129-P381 WeakPolarHBondContact OE1-CA 3.38Å; E129-P381 WeakPolarHBondContact OE1-CB 3.46Å; E129-V382 VanDerWaalsContact OE1-CB 3.27Å; E129-V382 WeakPolarHBondContact OE1-CB 3.33Å; E129-V382 WeakPolarHBondContact OE1-CG2 3.45Å; E129-V382 PolarHBondContact OE1-N 3.23Å
130I91.8Very high88.2Confident54 Ų5456.3 Ų56.328%0.27729%0.286SS..Hα-helixtrans-61.5-44.2179.2-65.4169000110.2S128 S133 V134 V196 W197S128-I130 VanDerWaalsContact C-N 3.29Å; S128-I130 PolarHBondContact O-N 2.95Å; S128-I130 VanDerWaalsContact O-N 3.15Å; I130-S133 WeakPolarHBondContact O-CB 3.35Å; I130-S133 PolarHBondContact O-N 3.29Å; I130-V134 WeakPolarHBondContact O-CG2 3.48Å; I130-V134 PolarHBondContact O-N 3.09Å; I130-V196 HydrophobicContact CG1-CG1 3.9Å; I130-W197 HydrophobicContact CD1-CB 3.93Å; I130-W197 HydrophobicContact CD1-CG 4.45Å
131K91Very high88.5Confident75 Ų7553.4 Ų53.433%0.32627%0.271SS..Hα-helixtrans-68.2-43.7-179.6-61179.5-163.6159.30111M122 G123 F124 S128 E129 S133 V134 I135M122-K131 PolarHBondContact O-NZ 2.95Å; G123-K131 VanDerWaalsContact C-NZ 3.33Å; G123-K131 WeakPolarHBondContact O-CD 3.41Å; G123-K131 PolarHBondContact O-NZ 3.06Å; F124-K131 HydrophobicContact CD1-CB 3.67Å; F124-K131 HydrophobicContact CD1-CD 3.93Å; F124-K131 HydrophobicContact CD1-CG 4.34Å; F124-K131 HydrophobicContact CE1-CB 3.78Å; F124-K131 HydrophobicContact CE1-CD 4.07Å; F124-K131 HydrophobicContact CE1-CG 4.26Å; S128-K131 PolarHBondContact O-N 3.32Å; E129-K131 VanDerWaalsContact C-N 3.33Å; E129-K131 PolarHBondContact O-N 3.35Å; K131-S133 VanDerWaalsContact C-N 3.26Å; K131-S133 PolarHBondContact O-N 3.48Å; K131-V134 WeakPolarHBondContact O-CB 3.38Å; K131-V134 PolarHBondContact O-N 3.15Å; K131-V134 VanDerWaalsContact O-N 3.16Å; K131-I135 PolarHBondContact O-N 3.41Å
132C91.8Very high89Confident1 Ų151.1 Ų51.11%0.00726%0.26CS..Hα-helixtrans-60.3-36.9172.8-72.60000111.8W100 V103 V104 D125 S128 E129 I135 F136W100-C132 HydrophobicContact CH2-CB 3.65Å; W100-C132 HydrophobicContact CZ2-CB 4.2Å; W100-C132 HydrophobicContact CZ3-CB 4.16Å; V103-C132 WeakPolarHBondContact CG1-O 3.23Å; V104-C132 HydrophobicContact CG2-CB 4.24Å; D125-C132 PolarHBondContact O-SG 2.93Å; D125-C132 VanDerWaalsContact O-SG 3.34Å; S128-C132 PolarHBondContact O-N 2.93Å; S128-C132 VanDerWaalsContact O-N 3.13Å; E129-C132 PolarHBondContact O-N 3.28Å; C132-I135 PolarHBondContact O-N 3.31Å; C132-F136 VanDerWaalsContact O-CB 3.23Å; C132-F136 WeakPolarHBondContact O-CB 3.42Å; C132-F136 PolarHBondContact O-N 2.94Å
133S92.9Very high89.5Confident4 Ų452.3 Ų52.33%0.02826%0.263CS..Hα-helixtrans-64.9-38175-60.40000112.5E129 I130 K131 F136 F137 I383E129-S133 VanDerWaalsContact O-CB 3.3Å; E129-S133 WeakPolarHBondContact O-CB 3.11Å; E129-S133 PolarHBondContact O-N 2.96Å; E129-S133 PolarHBondContact O-OG 3.29Å; I130-S133 WeakPolarHBondContact O-CB 3.35Å; I130-S133 PolarHBondContact O-N 3.29Å; K131-S133 VanDerWaalsContact C-N 3.26Å; K131-S133 PolarHBondContact O-N 3.48Å; S133-F136 PolarHBondContact O-N 3.5Å; S133-F137 VanDerWaalsContact O-CB 3.31Å; S133-F137 WeakPolarHBondContact O-CB 3.38Å; S133-F137 PolarHBondContact O-N 2.98Å; S133-I383 WeakPolarHBondContact OG-CG2 3Å
134V92.7Very high90.2Very high34 Ų3455.5 Ų55.521%0.20628%0.281CS..Hα-helixtrans-65.6-45.5174.51700000111.4I130 K131 F136 F137 L138 I189 S193I130-V134 WeakPolarHBondContact O-CG2 3.48Å; I130-V134 PolarHBondContact O-N 3.09Å; K131-V134 WeakPolarHBondContact O-CB 3.38Å; K131-V134 PolarHBondContact O-N 3.15Å; K131-V134 VanDerWaalsContact O-N 3.16Å; V134-F136 VanDerWaalsContact C-N 3.33Å; V134-F137 PolarHBondContact O-N 3.07Å; V134-L138 PolarHBondContact O-N 3.5Å; V134-I189 HydrophobicContact CG1-CD1 4.43Å; V134-I189 HydrophobicContact CG1-CG1 4.28Å; V134-I189 HydrophobicContact CG1-CG2 3.7Å; V134-I189 HydrophobicContact CG2-CG2 4.12Å; V134-S193 WeakPolarHBondContact CG2-OG 3.49Å
135I92.4Very high91Very high23 Ų2354.9 Ų54.912%0.11828%0.278CS..Hα-helixtrans-66.4-39.4177.7-62.5170.3000110.3V103 S107 F124 K131 C132 L138 Y139V103-I135 HydrophobicContact CG1-CB 3.86Å; V103-I135 HydrophobicContact CG1-CG2 3.7Å; S107-I135 WeakPolarHBondContact OG-CD1 3.16Å; F124-I135 HydrophobicContact CD1-CD1 3.71Å; F124-I135 HydrophobicContact CE1-CD1 3.78Å; F124-I135 HydrophobicContact CG-CD1 4.47Å; K131-I135 PolarHBondContact O-N 3.41Å; C132-I135 PolarHBondContact O-N 3.31Å; I135-L138 WeakPolarHBondContact O-CB 3.45Å; I135-L138 PolarHBondContact O-N 2.89Å; I135-Y139 HydrophobicContact CG2-CD2 3.88Å; I135-Y139 HydrophobicContact CG2-CE2 3.62Å; I135-Y139 WeakPolarHBondContact O-CD2 3.23Å; I135-Y139 PolarHBondContact O-N 3.32Å
136F94.4Very high92.2Very high11 Ų1158.8 Ų58.85%0.04829%0.293CS..Hα-helixtrans-60.4-48.2174.7176.8-94000111.2I96 L99 W100 V103 C132 S133 V134 L138 Y139 V140 I383 L384I96-F136 HydrophobicContact CG2-CZ 4.22Å; L99-F136 HydrophobicContact CB-CE2 4.13Å; L99-F136 HydrophobicContact CD2-CD2 4.33Å; L99-F136 HydrophobicContact CD2-CE2 3.77Å; L99-F136 HydrophobicContact CD2-CZ 4.37Å; L99-F136 HydrophobicContact CG-CD2 4.14Å; L99-F136 HydrophobicContact CG-CE2 3.82Å; W100-F136 HydrophobicContact CB-CD2 4.34Å; W100-F136 HydrophobicContact CB-CE2 4.31Å; W100-F136 HydrophobicContact CE3-CB 4.03Å; W100-F136 AromaticContact CE3-CD2 4Å; W100-F136 HydrophobicContact CE3-CD2 4Å; W100-F136 HydrophobicContact CE3-CG 4.01Å; W100-F136 HydrophobicContact CZ3-CB 4.11Å; W100-F136 HydrophobicContact CZ3-CG 4.45Å; V103-F136 HydrophobicContact CG1-CB 4.08Å; V103-F136 HydrophobicContact CG2-CB 4.38Å; V103-F136 HydrophobicContact CG2-CD2 4.31Å; C132-F136 VanDerWaalsContact O-CB 3.23Å; C132-F136 WeakPolarHBondContact O-CB 3.42Å; C132-F136 PolarHBondContact O-N 2.94Å; S133-F136 PolarHBondContact O-N 3.5Å; V134-F136 VanDerWaalsContact C-N 3.33Å; F136-L138 VanDerWaalsContact C-N 3.29Å; F136-L138 PolarHBondContact O-N 2.95Å; F136-Y139 PolarHBondContact O-N 2.82Å; F136-V140 HydrophobicContact CD1-CG2 4.15Å; F136-V140 HydrophobicContact CE1-CG2 3.69Å; F136-V140 HydrophobicContact CE2-CG2 4.15Å; F136-V140 HydrophobicContact CZ-CG2 3.68Å; F136-V140 WeakPolarHBondContact O-CG2 3.34Å; F136-V140 PolarHBondContact O-N 3.47Å; F136-I383 HydrophobicContact CD1-CD1 4Å; F136-L384 HydrophobicContact CE1-CD2 3.76Å; F136-L384 HydrophobicContact CE2-CD2 4.1Å; F136-L384 HydrophobicContact CZ-CD2 3.52Å
137F94.6Very high93.3Very high53 Ų5352.5 Ų52.523%0.23227%0.266CS..Hα-helixtrans-58.2-41.1175.3179.7-101.2000111.9S133 V134 V140 A141 I189 M192S133-F137 VanDerWaalsContact O-CB 3.31Å; S133-F137 WeakPolarHBondContact O-CB 3.38Å; S133-F137 PolarHBondContact O-N 2.98Å; V134-F137 PolarHBondContact O-N 3.07Å; F137-V140 PolarHBondContact O-N 3.23Å; F137-A141 VanDerWaalsContact O-CB 3.28Å; F137-A141 WeakPolarHBondContact O-CB 3.31Å; F137-A141 PolarHBondContact O-N 3.45Å; F137-I189 HydrophobicContact CD1-CG1 3.92Å; F137-I189 HydrophobicContact CE1-CG1 4.18Å; F137-M192 HydrophobicContact CD2-CG 4.07Å; F137-M192 HydrophobicContact CE2-CG 4.15Å; F137-M192 HydrophobicContact CG-CG 4.46Å
138L94.4Very high94.2Very high64 Ų6447.5 Ų47.534%0.33524%0.243SC..Hα-helixtrans-62.3-45.6175.4177.670.4000111.9V134 I135 F136 A141 V142 M185V134-L138 PolarHBondContact O-N 3.5Å; I135-L138 WeakPolarHBondContact O-CB 3.45Å; I135-L138 PolarHBondContact O-N 2.89Å; F136-L138 VanDerWaalsContact C-N 3.29Å; F136-L138 PolarHBondContact O-N 2.95Å; L138-A141 PolarHBondContact O-N 3.49Å; L138-V142 HydrophobicContact CD1-CG2 4.43Å; L138-V142 WeakPolarHBondContact O-CG2 3.18Å; L138-V142 PolarHBondContact O-N 3.32Å; L138-M185 HydrophobicContact CD1-CE 3.51Å; L138-M185 HydrophobicContact CD1-SD 3.55Å; L138-M185 VanDerWaalsContact CD1-SD 3.55Å
139Y95.6Very high94.7Very high81 Ų8147.5 Ų47.532%0.31824%0.24SC..Hα-helixtrans-62.6-45.7179.2-85.3-138.1000111.1L99 V103 H106 I135 F136 V142 F143L99-Y139 HydrophobicContact CD1-CD1 4.02Å; V103-Y139 HydrophobicContact CG2-CD1 3.56Å; V103-Y139 HydrophobicContact CG2-CD2 4.39Å; V103-Y139 HydrophobicContact CG2-CE1 3.95Å; V103-Y139 HydrophobicContact CG2-CG 3.8Å; H106-Y139 AromaticContact ND1-CE1 3.72Å; H106-Y139 AromaticContact ND1-CZ 3.83Å; H106-Y139 PolarHBondContact ND1-OH 3.32Å; I135-Y139 HydrophobicContact CG2-CD2 3.88Å; I135-Y139 HydrophobicContact CG2-CE2 3.62Å; I135-Y139 WeakPolarHBondContact O-CD2 3.23Å; I135-Y139 PolarHBondContact O-N 3.32Å; F136-Y139 PolarHBondContact O-N 2.82Å; Y139-V142 PolarHBondContact O-N 3.02Å; Y139-F143 WeakPolarHBondContact O-CB 3.31Å; Y139-F143 PolarHBondContact O-N 3.31Å
140V96.1Very high95.1Very high43 Ų4349.7 Ų49.726%0.26126%0.257SS..Hα-helixtrans-61.2-45.2175.5173.20000110.6L99 F136 F137 V142 F143 V144L99-V140 HydrophobicContact CD2-CG2 3.73Å; F136-V140 HydrophobicContact CD1-CG2 4.15Å; F136-V140 HydrophobicContact CE1-CG2 3.69Å; F136-V140 HydrophobicContact CE2-CG2 4.15Å; F136-V140 HydrophobicContact CZ-CG2 3.68Å; F136-V140 WeakPolarHBondContact O-CG2 3.34Å; F136-V140 PolarHBondContact O-N 3.47Å; F137-V140 PolarHBondContact O-N 3.23Å; V140-V142 VanDerWaalsContact C-N 3.34Å; V140-V142 PolarHBondContact O-N 3.46Å; V140-F143 PolarHBondContact O-N 3.33Å; V140-V144 HydrophobicContact CG1-CG2 4.19Å; V140-V144 WeakPolarHBondContact O-CB 3.5Å; V140-V144 VanDerWaalsContact O-CG2 3.3Å; V140-V144 WeakPolarHBondContact O-CG2 3.49Å; V140-V144 PolarHBondContact O-N 2.96Å
141A96.6Very high95.4Very high21 Ų2149.8 Ų49.817%0.17425%0.254CS..Hα-helixtrans-61.6-41.5179.100000112.3F137 L138 F145 M185F137-A141 VanDerWaalsContact O-CB 3.28Å; F137-A141 WeakPolarHBondContact O-CB 3.31Å; F137-A141 PolarHBondContact O-N 3.45Å; L138-A141 PolarHBondContact O-N 3.49Å; A141-F145 VanDerWaalsContact O-CB 3.27Å; A141-F145 WeakPolarHBondContact O-CB 3.46Å; A141-F145 PolarHBondContact O-N 3.36Å; A141-M185 HydrophobicContact CB-CE 3.92Å
142V96.3Very high95.7Very high56 Ų5648.3 Ų48.334%0.33925%0.252SS..Hα-helixtrans-66.8-43.9176171.90000111.1L138 Y139 V140 F145 F146 M185L138-V142 HydrophobicContact CD1-CG2 4.43Å; L138-V142 WeakPolarHBondContact O-CG2 3.18Å; L138-V142 PolarHBondContact O-N 3.32Å; Y139-V142 PolarHBondContact O-N 3.02Å; V140-V142 VanDerWaalsContact C-N 3.34Å; V140-V142 PolarHBondContact O-N 3.46Å; V142-F145 WeakPolarHBondContact O-CB 3.28Å; V142-F145 PolarHBondContact O-N 3.35Å; V142-F146 HydrophobicContact CG1-CD2 3.83Å; V142-F146 HydrophobicContact CG1-CE2 3.77Å; V142-F146 VanDerWaalsContact O-CD2 3.24Å; V142-F146 WeakPolarHBondContact O-CD2 3.4Å; V142-F146 PolarHBondContact O-N 2.77Å; V142-F146 VanDerWaalsContact O-N 3.13Å; V142-M185 HydrophobicContact CG2-CE 4.01Å
143F96.4Very high96.1Very high118 Ų11850.6 Ų50.652%0.51826%0.263SS..Hα-helixtrans-58.6-53.4176175.9-94.2000111.3Y139 V140 F145 F146 D147Y139-F143 WeakPolarHBondContact O-CB 3.31Å; Y139-F143 PolarHBondContact O-N 3.31Å; V140-F143 PolarHBondContact O-N 3.33Å; F143-F145 VanDerWaalsContact C-N 3.26Å; F143-F145 PolarHBondContact O-N 2.87Å; F143-F146 PolarHBondContact O-N 3.42Å; F143-F146 VanDerWaalsContact O-N 3.13Å; F143-D147 HydrophobicContact CE1-CB 4.25Å; F143-D147 HydrophobicContact CZ-CB 4.47Å; F143-D147 WeakPolarHBondContact O-CB 3.41Å; F143-D147 PolarHBondContact O-N 2.93Å
144V96.5Very high96.3Very high76 Ų7655.7 Ų55.746%0.46128%0.283SS..Hα-helixtrans-60.4-37.1179.6171.60000111.6V140 S148V140-V144 HydrophobicContact CG1-CG2 4.19Å; V140-V144 WeakPolarHBondContact O-CB 3.5Å; V140-V144 VanDerWaalsContact O-CG2 3.3Å; V140-V144 WeakPolarHBondContact O-CG2 3.49Å; V140-V144 PolarHBondContact O-N 2.96Å; V144-S148 VanDerWaalsContact O-CB 3.27Å; V144-S148 WeakPolarHBondContact O-CB 3.32Å; V144-S148 PolarHBondContact O-N 3.04Å; V144-S148 PolarHBondContact O-OG 3.35Å
145F97.4Very high96.6Very high30 Ų3055 Ų5513%0.13228%0.279CS..Hα-helixtrans-59.2-48.9175.2176.6-95.8000111.7A141 V142 F143 S148 L149 Q177 L181A141-F145 VanDerWaalsContact O-CB 3.27Å; A141-F145 WeakPolarHBondContact O-CB 3.46Å; A141-F145 PolarHBondContact O-N 3.36Å; V142-F145 WeakPolarHBondContact O-CB 3.28Å; V142-F145 PolarHBondContact O-N 3.35Å; F143-F145 VanDerWaalsContact C-N 3.26Å; F143-F145 PolarHBondContact O-N 2.87Å; F145-S148 PolarHBondContact O-OG 2.68Å; F145-L149 WeakPolarHBondContact O-CB 3.39Å; F145-L149 PolarHBondContact O-N 3.15Å; F145-Q177 HydrophobicContact CE2-CB 3.87Å; F145-Q177 HydrophobicContact CZ-CB 4.2Å; F145-L181 HydrophobicContact CB-CD1 4Å; F145-L181 HydrophobicContact CB-CD2 4.33Å; F145-L181 HydrophobicContact CD1-CD2 4.29Å; F145-L181 HydrophobicContact CD2-CB 4.06Å; F145-L181 HydrophobicContact CD2-CD1 4.05Å; F145-L181 HydrophobicContact CD2-CD2 3.87Å; F145-L181 HydrophobicContact CD2-CG 4.22Å; F145-L181 HydrophobicContact CE2-CB 4.22Å; F145-L181 HydrophobicContact CE2-CD2 4.21Å; F145-L181 HydrophobicContact CG-CD1 4.25Å; F145-L181 HydrophobicContact CG-CD2 3.9Å
146F97.7Very high96.9Very high129 Ų12954.7 Ų54.757%0.56628%0.279SS*.Hα-helixtrans-74.2-35.6-179.8-76.4-68.4000113.1V142 F143 L149 P150V142-F146 HydrophobicContact CG1-CD2 3.83Å; V142-F146 HydrophobicContact CG1-CE2 3.77Å; V142-F146 VanDerWaalsContact O-CD2 3.24Å; V142-F146 WeakPolarHBondContact O-CD2 3.4Å; V142-F146 PolarHBondContact O-N 2.77Å; V142-F146 VanDerWaalsContact O-N 3.13Å; F143-F146 PolarHBondContact O-N 3.42Å; F143-F146 VanDerWaalsContact O-N 3.13Å; F146-L149 PolarHBondContact O-N 3.11Å; F146-P150 WeakPolarHBondContact O-CD 3.26Å
147D96.8Very high97.1Very high26 Ų2656.8 Ų56.814%0.13929%0.288CS..Hα-helixtrans-64.1-43.9177.1-179.474.8000112.2Y82 H83 F143 L149 P150 W151Y82-D147 PolarHBondContact OH-OD1 3.43Å; H83-D147 IonicContact CE1-OD2 2.71Å; F143-D147 HydrophobicContact CE1-CB 4.25Å; F143-D147 HydrophobicContact CZ-CB 4.47Å; F143-D147 WeakPolarHBondContact O-CB 3.41Å; F143-D147 PolarHBondContact O-N 2.93Å; D147-L149 VanDerWaalsContact C-N 3.33Å; D147-L149 PolarHBondContact O-N 2.62Å; D147-P150 WeakPolarHBondContact O-CD 3.2Å; D147-W151 VanDerWaalsContact O-CD1 3.27Å
148S96.6Very high97.2Very high38 Ų3856.7 Ų56.727%0.26629%0.291SS..Hα-helixtrans-76.1-18.4-179.463.40000114.3V144 F145 W151 T152V144-S148 VanDerWaalsContact O-CB 3.27Å; V144-S148 WeakPolarHBondContact O-CB 3.32Å; V144-S148 PolarHBondContact O-N 3.04Å; V144-S148 PolarHBondContact O-OG 3.35Å; F145-S148 PolarHBondContact O-OG 2.68Å; S148-W151 PolarHBondContact O-N 3.35Å; S148-T152 PolarHBondContact O-N 3.35Å; S148-T152 PolarHBondContact O-OG1 3.29Å
149L97.4Very high97.4Very high29 Ų2953.8 Ų53.815%0.15228%0.276CS..Hα-helixtrans-64.1-48.2-171.7-174.566.8000113.1F145 F146 D147 W151 T152 I153 F173 I174 Q177F145-L149 WeakPolarHBondContact O-CB 3.39Å; F145-L149 PolarHBondContact O-N 3.15Å; F146-L149 PolarHBondContact O-N 3.11Å; D147-L149 VanDerWaalsContact C-N 3.33Å; D147-L149 PolarHBondContact O-N 2.62Å; L149-W151 VanDerWaalsContact C-N 3.33Å; L149-W151 PolarHBondContact O-N 2.74Å; L149-T152 PolarHBondContact O-N 3.34Å; L149-I153 HydrophobicContact CD1-CD1 3.94Å; L149-I153 HydrophobicContact CD1-CG1 4.16Å; L149-I153 HydrophobicContact CD2-CD1 4.38Å; L149-I153 HydrophobicContact CG-CD1 3.72Å; L149-I153 HydrophobicContact CG-CG1 4.33Å; L149-I153 WeakPolarHBondContact O-CB 3.41Å; L149-I153 VanDerWaalsContact O-CG1 3.26Å; L149-I153 WeakPolarHBondContact O-CG1 3.49Å; L149-I153 PolarHBondContact O-N 2.94Å; L149-F173 HydrophobicContact CD1-CE1 4.12Å; L149-I174 HydrophobicContact CD1-CD1 4.4Å; L149-Q177 HydrophobicContact CD1-CG 4.38Å
150P98Very high97.5Very high78 Ų7851 Ų5151%0.50627%0.266SS..Hα-helixtrans-57.3-43.4176.6-24.934.2000113.1F146 D147 I153 Y154F146-P150 WeakPolarHBondContact O-CD 3.26Å; D147-P150 WeakPolarHBondContact O-CD 3.2Å; P150-I153 PolarHBondContact O-N 2.68Å; P150-Y154 WeakPolarHBondContact O-CB 3.48Å; P150-Y154 PolarHBondContact O-N 3.27Å
151W98.1Very high97.5Very high55 Ų5551 Ų5121%0.20827%0.27CS..Hα-helixtrans-63.4-44.6179.5-59113000111.7F75 V78 Y82 H83 D147 S148 L149 Y154 S155F75-W151 AromaticContact CE2-CE3 3.87Å; F75-W151 HydrophobicContact CE2-CE3 3.87Å; F75-W151 HydrophobicContact CZ-CB 4.2Å; F75-W151 HydrophobicContact CZ-CE3 4.21Å; F75-W151 WeakPolarHBondContact CZ-O 3.47Å; V78-W151 HydrophobicContact CG1-CZ3 4.47Å; Y82-W151 AromaticContact CD1-CE2 3.7Å; Y82-W151 HydrophobicContact CD1-CH2 4.43Å; Y82-W151 AromaticContact CD1-CZ2 3.37Å; Y82-W151 HydrophobicContact CD1-CZ2 3.37Å; Y82-W151 AromaticContact CD1-NE1 3.61Å; Y82-W151 AromaticContact CD2-CZ2 3.8Å; Y82-W151 HydrophobicContact CD2-CZ2 3.8Å; Y82-W151 AromaticContact CE1-CZ2 3.91Å; Y82-W151 HydrophobicContact CE1-CZ2 3.91Å; Y82-W151 AromaticContact CE1-NE1 3.52Å; Y82-W151 HydrophobicContact CE2-CZ2 4.27Å; Y82-W151 HydrophobicContact CG-CH2 4.04Å; Y82-W151 AromaticContact CG-CZ2 3.31Å; Y82-W151 HydrophobicContact CG-CZ2 3.31Å; H83-W151 AromaticContact CE1-CD1 3.97Å; H83-W151 AromaticContact CE1-NE1 3.87Å; D147-W151 VanDerWaalsContact O-CD1 3.27Å; S148-W151 PolarHBondContact O-N 3.35Å; L149-W151 VanDerWaalsContact C-N 3.33Å; L149-W151 PolarHBondContact O-N 2.74Å; W151-Y154 PolarHBondContact O-N 3.27Å; W151-S155 WeakPolarHBondContact O-CB 3.27Å; W151-S155 PolarHBondContact O-N 2.98Å
152T98.1Very high97.4Very high45 Ų4556.7 Ų56.728%0.27629%0.287SS..Hα-helixtrans-69.4-39.9179.9-51.80000111.6S148 L149 T156 F173S148-T152 PolarHBondContact O-N 3.35Å; S148-T152 PolarHBondContact O-OG1 3.29Å; L149-T152 PolarHBondContact O-N 3.34Å; T152-T156 VanDerWaalsContact O-CB 3.28Å; T152-T156 WeakPolarHBondContact O-CB 3.41Å; T152-T156 PolarHBondContact O-N 2.68Å; T152-T156 PolarHBondContact O-OG1 3.4Å; T152-F173 HydrophobicContact CG2-CE2 3.7Å; T152-F173 HydrophobicContact CG2-CZ 3.59Å
153I98.6Very high97.3Very high48 Ų4855.6 Ų55.625%0.24628%0.279CS..Hα-helixtrans-61.8-47.5174.6-71.7171.5000110.1L149 P150 T156 F157 F170 F173L149-I153 HydrophobicContact CD1-CD1 3.94Å; L149-I153 HydrophobicContact CD1-CG1 4.16Å; L149-I153 HydrophobicContact CD2-CD1 4.38Å; L149-I153 HydrophobicContact CG-CD1 3.72Å; L149-I153 HydrophobicContact CG-CG1 4.33Å; L149-I153 WeakPolarHBondContact O-CB 3.41Å; L149-I153 VanDerWaalsContact O-CG1 3.26Å; L149-I153 WeakPolarHBondContact O-CG1 3.49Å; L149-I153 PolarHBondContact O-N 2.94Å; P150-I153 PolarHBondContact O-N 2.68Å; I153-T156 PolarHBondContact O-N 2.87Å; I153-F157 HydrophobicContact CG2-CD2 4.23Å; I153-F157 WeakPolarHBondContact O-CB 3.44Å; I153-F157 PolarHBondContact O-N 3.03Å; I153-F170 HydrophobicContact CD1-CE2 4.13Å; I153-F170 HydrophobicContact CD1-CZ 4.45Å; I153-F170 HydrophobicContact CG1-CE2 4.37Å; I153-F173 HydrophobicContact CG1-CE1 3.7Å; I153-F173 HydrophobicContact CG1-CZ 4.2Å
154Y98.6Very high97Very high112 Ų11251.7 Ų51.744%0.43927%0.272SS..Hα-helixtrans-63.7-47.8179.9-170.4-86.2000111.6F75 P150 W151 T156 V158 I159F75-Y154 AromaticContact CD2-CD1 3.66Å; F75-Y154 HydrophobicContact CD2-CD1 3.66Å; F75-Y154 HydrophobicContact CD2-CE1 4.11Å; F75-Y154 AromaticContact CE2-CD1 3.84Å; F75-Y154 HydrophobicContact CE2-CD1 3.84Å; P150-Y154 WeakPolarHBondContact O-CB 3.48Å; P150-Y154 PolarHBondContact O-N 3.27Å; W151-Y154 PolarHBondContact O-N 3.27Å; Y154-T156 VanDerWaalsContact C-N 3.28Å; Y154-T156 PolarHBondContact O-N 3.4Å; Y154-V158 HydrophobicContact CD1-CB 4.34Å; Y154-V158 HydrophobicContact CD2-CB 4.1Å; Y154-V158 HydrophobicContact CD2-CG1 4.46Å; Y154-V158 HydrophobicContact CD2-CG2 3.77Å; Y154-V158 HydrophobicContact CE1-CB 4.31Å; Y154-V158 HydrophobicContact CE1-CG1 4.27Å; Y154-V158 HydrophobicContact CE2-CB 4.08Å; Y154-V158 HydrophobicContact CE2-CG1 3.93Å; Y154-V158 HydrophobicContact CE2-CG2 3.98Å; Y154-V158 HydrophobicContact CG-CB 4.24Å; Y154-V158 HydrophobicContact CG-CG2 4.21Å; Y154-V158 WeakPolarHBondContact O-CA 3.49Å; Y154-V158 WeakPolarHBondContact O-CB 3.43Å; Y154-V158 PolarHBondContact O-N 2.93Å; Y154-I159 HydrophobicContact CD1-CD1 3.96Å; Y154-I159 HydrophobicContact CD1-CG1 4Å; Y154-I159 HydrophobicContact CE1-CD1 3.89Å; Y154-I159 HydrophobicContact CE1-CG1 3.79Å; Y154-I159 PolarHBondContact O-N 3.04Å; Y154-I159 VanDerWaalsContact O-N 3.13Å
155S98.2Very high96.9Very high19 Ų1948.5 Ų48.513%0.13325%0.252CS..Iπ-helixtrans-55.1-47.3176.1-177.50000110.8R72 W151 I159 E160R72-S155 PolarHBondContact NH1-OG 2.97Å; R72-S155 VanDerWaalsContact NH1-OG 3.09Å; W151-S155 WeakPolarHBondContact O-CB 3.27Å; W151-S155 PolarHBondContact O-N 2.98Å; S155-I159 WeakPolarHBondContact O-CB 3.34Å; S155-I159 PolarHBondContact O-N 3.18Å; S155-E160 WeakPolarHBondContact O-CG 3.32Å; S155-E160 PolarHBondContact O-N 3.44Å
156T98.1Very high96.8Very high17 Ų1748.4 Ų48.410%0.10425%0.252CS..Iπ-helixtrans-76.3-53.3-173.7-56.20000113T152 I153 Y154 E160 A161 N166 Q168 F173T152-T156 VanDerWaalsContact O-CB 3.28Å; T152-T156 WeakPolarHBondContact O-CB 3.41Å; T152-T156 PolarHBondContact O-N 2.68Å; T152-T156 PolarHBondContact O-OG1 3.4Å; I153-T156 PolarHBondContact O-N 2.87Å; Y154-T156 VanDerWaalsContact C-N 3.28Å; Y154-T156 PolarHBondContact O-N 3.4Å; T156-E160 WeakPolarHBondContact O-CB 3.44Å; T156-A161 PolarHBondContact O-N 3.38Å; T156-A161 VanDerWaalsContact O-N 3.17Å; T156-N166 VanDerWaalsContact CG2-OD1 3.3Å; T156-N166 WeakPolarHBondContact CG2-OD1 3.26Å; T156-N166 VanDerWaalsContact O-CB 3.29Å; T156-N166 WeakPolarHBondContact O-CB 3.34Å; T156-N166 PolarHBondContact O-ND2 2.9Å; T156-Q168 HydrophobicContact CG2-CG 4.41Å; T156-F173 HydrophobicContact CG2-CD2 4.42Å
157F98.4Very high96.5Very high54 Ų5445.5 Ų45.524%0.23724%0.24CC..Iπ-helixtrans-92.9-8.3-170-68-80.1000113.8I153 A161 N166 F170 F173I153-F157 HydrophobicContact CG2-CD2 4.23Å; I153-F157 WeakPolarHBondContact O-CB 3.44Å; I153-F157 PolarHBondContact O-N 3.03Å; F157-A161 VanDerWaalsContact O-CB 3.29Å; F157-A161 WeakPolarHBondContact O-CB 3.33Å; F157-N166 VanDerWaalsContact CD1-ND2 3.34Å; F157-N166 WeakPolarHBondContact CD1-ND2 3.37Å; F157-N166 WeakPolarHBondContact CE1-ND2 3.49Å; F157-F170 HydrophobicContact CD2-CD2 4.24Å; F157-F170 HydrophobicContact CE1-CB 4.29Å; F157-F170 AromaticContact CE2-CD2 3.86Å; F157-F170 HydrophobicContact CE2-CD2 3.86Å; F157-F170 HydrophobicContact CZ-CB 4.21Å; F157-F170 HydrophobicContact CZ-CD2 4.02Å; F157-F173 HydrophobicContact CE2-CB 3.87Å; F157-F173 AromaticContact CE2-CD1 3.78Å; F157-F173 HydrophobicContact CE2-CD1 3.78Å; F157-F173 HydrophobicContact CE2-CD2 4.08Å; F157-F173 HydrophobicContact CE2-CE1 4.35Å; F157-F173 AromaticContact CE2-CG 3.63Å; F157-F173 HydrophobicContact CE2-CG 3.63Å; F157-F173 HydrophobicContact CZ-CB 3.7Å; F157-F173 HydrophobicContact CZ-CD1 4.43Å; F157-F173 HydrophobicContact CZ-CG 4.01Å
158V97.9Very high96.3Very high51 Ų5145.8 Ų45.831%0.30924%0.24SC..Iπ-helixtrans-112.8-56.6173.9-172.90000110.8Y154 R162Y154-V158 HydrophobicContact CD1-CB 4.34Å; Y154-V158 HydrophobicContact CD2-CB 4.1Å; Y154-V158 HydrophobicContact CD2-CG1 4.46Å; Y154-V158 HydrophobicContact CD2-CG2 3.77Å; Y154-V158 HydrophobicContact CE1-CB 4.31Å; Y154-V158 HydrophobicContact CE1-CG1 4.27Å; Y154-V158 HydrophobicContact CE2-CB 4.08Å; Y154-V158 HydrophobicContact CE2-CG1 3.93Å; Y154-V158 HydrophobicContact CE2-CG2 3.98Å; Y154-V158 HydrophobicContact CG-CB 4.24Å; Y154-V158 HydrophobicContact CG-CG2 4.21Å; Y154-V158 WeakPolarHBondContact O-CA 3.49Å; Y154-V158 WeakPolarHBondContact O-CB 3.43Å; Y154-V158 PolarHBondContact O-N 2.93Å; V158-R162 WeakPolarHBondContact O-CB 3.5Å; V158-R162 PolarHBondContact O-N 3.4Å; V158-R162 VanDerWaalsContact O-N 3.08Å
159I98Very high96.2Very high4 Ų448 Ų482%0.02125%0.252CS..Iπ-helixtrans-76.5-60.6-174.3-54.7176.1000110.9Y68 D71 R72 F75 Y154 S155 A161 R162 H163Y68-I159 HydrophobicContact CD2-CG2 4.41Å; Y68-I159 HydrophobicContact CE2-CG2 4.13Å; D71-I159 HydrophobicContact CB-CG2 4.12Å; R72-I159 HydrophobicContact CG-CG2 4.37Å; F75-I159 HydrophobicContact CB-CD1 3.41Å; F75-I159 VanDerWaalsContact CB-CD1 3.41Å; F75-I159 HydrophobicContact CD1-CD1 4.22Å; F75-I159 HydrophobicContact CD2-CD1 3.7Å; F75-I159 HydrophobicContact CG-CD1 3.5Å; Y154-I159 HydrophobicContact CD1-CD1 3.96Å; Y154-I159 HydrophobicContact CD1-CG1 4Å; Y154-I159 HydrophobicContact CE1-CD1 3.89Å; Y154-I159 HydrophobicContact CE1-CG1 3.79Å; Y154-I159 PolarHBondContact O-N 3.04Å; Y154-I159 VanDerWaalsContact O-N 3.13Å; S155-I159 WeakPolarHBondContact O-CB 3.34Å; S155-I159 PolarHBondContact O-N 3.18Å; I159-A161 VanDerWaalsContact C-N 3.25Å; I159-A161 PolarHBondContact O-N 2.83Å; I159-R162 PolarHBondContact O-N 3.23Å; I159-R162 VanDerWaalsContact O-N 3.16Å; I159-H163 PolarHBondContact O-CD2 3.39Å; I159-H163 PolarHBondContact O-N 3.37Å
160E97.2Very high96.2Very high22 Ų2251.9 Ų51.910%0.10327%0.268CS..Iπ-helixtrans-61.1-37.3-179.3-61.9-49.1136.300111.1Y68 R72 S155 T156 H163 G164 F165 N166 H273Y68-E160 VanDerWaalsContact OH-CD 3.29Å; Y68-E160 PolarHBondContact OH-OE1 3.2Å; Y68-E160 PolarHBondContact OH-OE2 3.43Å; R72-E160 IonicContact CZ-OE1 2.7Å; R72-E160 IonicContact NH1-OE1 2.64Å; R72-E160 PolarHBondContact NH1-OE1 2.99Å; S155-E160 WeakPolarHBondContact O-CG 3.32Å; S155-E160 PolarHBondContact O-N 3.44Å; T156-E160 WeakPolarHBondContact O-CB 3.44Å; E160-H163 PolarHBondContact O-N 3.17Å; E160-G164 PolarHBondContact O-N 3.31Å; E160-F165 HydrophobicContact CB-CB 4.07Å; E160-F165 PolarHBondContact O-N 3.28Å; E160-F165 WeakPolarHBondContact OE2-CB 3.23Å; E160-F165 WeakPolarHBondContact OE2-CD2 3.49Å; E160-N166 HydrophobicContact CB-CB 3.95Å; E160-N166 PolarHBondContact O-N 3.35Å; E160-H273 IonicContact OE2-NE2 3.31Å
161A96.2Very high96.1Very high42 Ų4250.6 Ų50.635%0.34727%0.269SS..Hα-helixtrans-64.1-43175.400000113.1T156 F157 I159 H163 G164 N166T156-A161 PolarHBondContact O-N 3.38Å; T156-A161 VanDerWaalsContact O-N 3.17Å; F157-A161 VanDerWaalsContact O-CB 3.29Å; F157-A161 WeakPolarHBondContact O-CB 3.33Å; I159-A161 VanDerWaalsContact C-N 3.25Å; I159-A161 PolarHBondContact O-N 2.83Å; A161-H163 PolarHBondContact O-N 2.87Å; A161-G164 PolarHBondContact O-N 2.95Å; A161-G164 VanDerWaalsContact O-N 3.1Å; A161-N166 HydrophobicContact CB-CB 4.12Å
162R95.6Very high96Very high141 Ų14149.1 Ų49.153%0.53226%0.264SS..Hα-helixtrans-59.7-34178.3179.2-173.3-63.3172.6-0.5112.4D71 V158 I159D71-R162 IonicContact OD1-NH1 3.93Å; D71-R162 PolarHBondContact OD1-NH1 2.88Å; D71-R162 VanDerWaalsContact OD1-NH1 3.09Å; D71-R162 VanDerWaalsContact OD2-CD 3.27Å; D71-R162 WeakPolarHBondContact OD2-CD 3.07Å; D71-R162 IonicContact OD2-CZ 3.09Å; D71-R162 IonicContact OD2-NE 3.99Å; D71-R162 IonicContact OD2-NH1 3.94Å; D71-R162 PolarHBondContact OD2-NH1 3Å; V158-R162 WeakPolarHBondContact O-CB 3.5Å; V158-R162 PolarHBondContact O-N 3.4Å; V158-R162 VanDerWaalsContact O-N 3.08Å; I159-R162 PolarHBondContact O-N 3.23Å; I159-R162 VanDerWaalsContact O-N 3.16Å
163H93.9Very high95.9Very high34 Ų3447.2 Ų47.216%0.15725%0.252CS..THydrogen-bonded Turntrans-96.910.5-179.8-65.8-80.3000113.4Y68 D71 I159 E160 A161 F165 L441Y68-H163 WeakPolarHBondContact CA-CE1 3.18Å; Y68-H163 HydrophobicContact CD2-CB 3.83Å; Y68-H163 AromaticContact CD2-CD2 3.45Å; Y68-H163 VanDerWaalsContact CD2-CD2 3.45Å; Y68-H163 WeakPolarHBondContact CD2-CD2 3.42Å; Y68-H163 AromaticContact CD2-CG 3.52Å; Y68-H163 HydrophobicContact CE2-CB 4.37Å; Y68-H163 HydrophobicContact CG-CB 4.4Å; Y68-H163 PolarHBondContact N-CE1 3.14Å; Y68-H163 VanDerWaalsContact N-CE1 3.25Å; D71-H163 IonicContact OD2-CD2 2.75Å; D71-H163 IonicContact OD2-CE1 3.92Å; D71-H163 IonicContact OD2-NE2 2.79Å; D71-H163 PolarHBondContact OD2-NE2 3.4Å; I159-H163 PolarHBondContact O-CD2 3.39Å; I159-H163 PolarHBondContact O-N 3.37Å; E160-H163 PolarHBondContact O-N 3.17Å; A161-H163 PolarHBondContact O-N 2.87Å; H163-F165 VanDerWaalsContact C-N 3.29Å; H163-F165 HydrophobicContact CB-CD2 3.95Å; H163-F165 HydrophobicContact CB-CE2 4.14Å; H163-F165 PolarHBondContact O-N 2.92Å; H163-L441 HydrophobicContact CB-CD1 4.34Å
164G90.4Very high95.9Very high36 Ų3647.1 Ų47.137%0.37125%0.251SS..THydrogen-bonded Turntrans77.19.9173.100000115.1E160 A161 K167E160-G164 PolarHBondContact O-N 3.31Å; A161-G164 PolarHBondContact O-N 2.95Å; A161-G164 VanDerWaalsContact O-N 3.1Å; G164-K167 WeakPolarHBondContact O-CE 3.36Å; G164-K167 PolarHBondContact O-NZ 3.41Å
165F93.1Very high95.8Very high9 Ų948.3 Ų48.34%0.03926%0.259CS..  trans-82.5-38.8-178.1-71.8-54.2000113.9Y68 E160 H163 K167 S271 A272 H273 D439 L441Y68-F165 HydrophobicContact CD1-CE2 4.07Å; Y68-F165 HydrophobicContact CD2-CE2 4.31Å; Y68-F165 HydrophobicContact CE1-CD2 4.44Å; Y68-F165 AromaticContact CE1-CE2 3.81Å; Y68-F165 HydrophobicContact CE1-CE2 3.81Å; Y68-F165 AromaticContact CE2-CD2 3.99Å; Y68-F165 HydrophobicContact CE2-CD2 3.99Å; Y68-F165 HydrophobicContact CE2-CE2 4.04Å; Y68-F165 HydrophobicContact CG-CE2 4.31Å; Y68-F165 AromaticContact CZ-CD2 3.95Å; Y68-F165 AromaticContact CZ-CE2 3.78Å; E160-F165 HydrophobicContact CB-CB 4.07Å; E160-F165 PolarHBondContact O-N 3.28Å; E160-F165 WeakPolarHBondContact OE2-CB 3.23Å; E160-F165 WeakPolarHBondContact OE2-CD2 3.49Å; H163-F165 VanDerWaalsContact C-N 3.29Å; H163-F165 HydrophobicContact CB-CD2 3.95Å; H163-F165 HydrophobicContact CB-CE2 4.14Å; H163-F165 PolarHBondContact O-N 2.92Å; F165-K167 PolarHBondContact O-N 3.25Å; F165-S271 VanDerWaalsContact O-CA 3.27Å; F165-S271 WeakPolarHBondContact O-CA 3.43Å; F165-A272 HydrophobicContact CD1-CB 3.85Å; F165-A272 HydrophobicContact CE1-CB 4.49Å; F165-A272 PolarHBondContact O-N 3.37Å; F165-H273 AromaticContact CD1-CE1 3.58Å; F165-H273 AromaticContact CD1-ND1 3.97Å; F165-H273 AromaticContact CD1-NE2 3.9Å; F165-H273 AromaticContact CD2-CE1 3.93Å; F165-H273 AromaticContact CE1-CE1 3.56Å; F165-H273 AromaticContact CE1-ND1 3.83Å; F165-H273 AromaticContact CE2-CE1 3.84Å; F165-H273 AromaticContact CG-CE1 3.79Å; F165-H273 AromaticContact CG-NE2 3.8Å; F165-H273 AromaticContact CZ-CE1 3.65Å; F165-D439 WeakPolarHBondContact CE1-O 3.41Å; F165-L441 HydrophobicContact CE1-CG 4.42Å; F165-L441 HydrophobicContact CE2-CB 3.88Å; F165-L441 HydrophobicContact CE2-CD1 3.65Å; F165-L441 HydrophobicContact CE2-CG 3.99Å; F165-L441 HydrophobicContact CZ-CB 3.56Å; F165-L441 HydrophobicContact CZ-CD1 3.55Å; F165-L441 HydrophobicContact CZ-CG 3.45Å; F165-L441 VanDerWaalsContact CZ-CG 3.45Å
166N95.2Very high95.8Very high28 Ų2847.8 Ų47.815%0.1526%0.255CS..BIsolated β-bridgetrans-72.9117.7-177.5-174.938.8000111.4T156 F157 E160 A161 Q168T156-N166 VanDerWaalsContact CG2-OD1 3.3Å; T156-N166 WeakPolarHBondContact CG2-OD1 3.26Å; T156-N166 VanDerWaalsContact O-CB 3.29Å; T156-N166 WeakPolarHBondContact O-CB 3.34Å; T156-N166 PolarHBondContact O-ND2 2.9Å; F157-N166 VanDerWaalsContact CD1-ND2 3.34Å; F157-N166 WeakPolarHBondContact CD1-ND2 3.37Å; F157-N166 WeakPolarHBondContact CE1-ND2 3.49Å; E160-N166 HydrophobicContact CB-CB 3.95Å; E160-N166 PolarHBondContact O-N 3.35Å; A161-N166 HydrophobicContact CB-CB 4.12Å; N166-Q168 WeakPolarHBondContact OD1-CG 3.32Å
167K91.9Very high95.7Very high68 Ų6849.2 Ų49.230%0.29626%0.26SS..  trans-110.7-11.6177.6-57.7-55.5-174.1177.30113.7G164 F165 S268 R270 E310G164-K167 WeakPolarHBondContact O-CE 3.36Å; G164-K167 PolarHBondContact O-NZ 3.41Å; F165-K167 PolarHBondContact O-N 3.25Å; K167-S268 WeakPolarHBondContact CB-O 3.24Å; K167-R270 PolarHBondContact N-O 3.5Å; K167-E310 WeakPolarHBondContact CE-OE1 3.38Å; K167-E310 IonicContact NZ-OE1 2.84Å; K167-E310 PolarHBondContact NZ-OE1 3.09Å
168Q92.8Very high95.7Very high32 Ų3250.6 Ų50.615%0.1527%0.269CS..  trans-80.4151.1-178.848.1179.1-12.700113.1T156 N166 F172T156-Q168 HydrophobicContact CG2-CG 4.41Å; N166-Q168 WeakPolarHBondContact OD1-CG 3.32Å; Q168-F172 HydrophobicContact CB-CD1 3.57Å; Q168-F172 HydrophobicContact CB-CE1 4.08Å
169T95.5Very high95.7Very high84 Ų8450.5 Ų50.552%0.51527%0.265SS..  trans-82.7157.917066.70000111.1G171 F172 F173T169-G171 VanDerWaalsContact C-N 3.33Å; T169-G171 PolarHBondContact O-N 3.32Å; T169-F172 PolarHBondContact O-N 3.46Å; T169-F172 WeakPolarHBondContact OG1-CB 3.45Å; T169-F172 PolarHBondContact OG1-N 3.42Å; T169-F173 PolarHBondContact O-N 2.81Å
170F96.3Very high95.7Very high110 Ų11052.8 Ų52.848%0.48228%0.281SS..Hα-helixtrans-58.9-42176.8-171.5-102.7000112.8I153 F157 F172 F173 I174I153-F170 HydrophobicContact CD1-CE2 4.13Å; I153-F170 HydrophobicContact CD1-CZ 4.45Å; I153-F170 HydrophobicContact CG1-CE2 4.37Å; F157-F170 HydrophobicContact CD2-CD2 4.24Å; F157-F170 HydrophobicContact CE1-CB 4.29Å; F157-F170 AromaticContact CE2-CD2 3.86Å; F157-F170 HydrophobicContact CE2-CD2 3.86Å; F157-F170 HydrophobicContact CZ-CB 4.21Å; F157-F170 HydrophobicContact CZ-CD2 4.02Å; F170-F172 PolarHBondContact O-N 3.27Å; F170-F173 PolarHBondContact O-N 2.97Å; F170-I174 HydrophobicContact CD1-CG1 4.07Å; F170-I174 HydrophobicContact CE1-CD1 4.2Å; F170-I174 HydrophobicContact CE1-CG1 3.65Å; F170-I174 HydrophobicContact CE2-CD1 4.25Å; F170-I174 HydrophobicContact CE2-CG1 4.24Å; F170-I174 HydrophobicContact CZ-CD1 3.8Å; F170-I174 HydrophobicContact CZ-CG1 3.74Å; F170-I174 WeakPolarHBondContact O-CG1 3.09Å; F170-I174 PolarHBondContact O-N 3.48Å
171G96.5Very high95.7Very high51 Ų5153.6 Ų53.653%0.52629%0.285SS..Hα-helixtrans-64.4-38177.500000113.4T169 K175T169-G171 VanDerWaalsContact C-N 3.33Å; T169-G171 PolarHBondContact O-N 3.32Å; G171-K175 WeakPolarHBondContact O-CB 3.48Å; G171-K175 PolarHBondContact O-N 3.18Å; G171-K175 VanDerWaalsContact O-N 3.11Å
172F95Very high95.7Very high25 Ų2556.2 Ų56.211%0.1129%0.293CS..Hα-helixtrans-65.3-45.5173.8176.1-96.5000111.5Q168 T169 F170 K175 D176 R269 R270Q168-F172 HydrophobicContact CB-CD1 3.57Å; Q168-F172 HydrophobicContact CB-CE1 4.08Å; T169-F172 PolarHBondContact O-N 3.46Å; T169-F172 WeakPolarHBondContact OG1-CB 3.45Å; T169-F172 PolarHBondContact OG1-N 3.42Å; F170-F172 PolarHBondContact O-N 3.27Å; F172-K175 PolarHBondContact O-N 2.94Å; F172-D176 VanDerWaalsContact CE1-OD2 3.31Å; F172-D176 WeakPolarHBondContact CE1-OD2 3.38Å; F172-D176 VanDerWaalsContact CZ-OD2 3.26Å; F172-D176 WeakPolarHBondContact CZ-OD2 3.32Å; F172-D176 PolarHBondContact O-N 3.37Å; F172-D176 VanDerWaalsContact O-N 3.09Å; F172-R269 VanDerWaalsContact CD2-NH2 3.34Å; F172-R269 HydrophobicContact CZ-CG 4.25Å; F172-R270 HydrophobicContact CE1-CG 4.02Å; F172-R270 HydrophobicContact CZ-CG 4.46Å; F172-R270 VanDerWaalsContact CZ-NH2 3.3Å
173F97.6Very high95.8Very high4 Ų450.9 Ų50.92%0.01828%0.275CS..Hα-helixtrans-57.5-51.5176.5171.3-94.9000112.1L149 T152 I153 T156 F157 T169 F170 K175 D176 Q177L149-F173 HydrophobicContact CD1-CE1 4.12Å; T152-F173 HydrophobicContact CG2-CE2 3.7Å; T152-F173 HydrophobicContact CG2-CZ 3.59Å; I153-F173 HydrophobicContact CG1-CE1 3.7Å; I153-F173 HydrophobicContact CG1-CZ 4.2Å; T156-F173 HydrophobicContact CG2-CD2 4.42Å; F157-F173 HydrophobicContact CE2-CB 3.87Å; F157-F173 AromaticContact CE2-CD1 3.78Å; F157-F173 HydrophobicContact CE2-CD1 3.78Å; F157-F173 HydrophobicContact CE2-CD2 4.08Å; F157-F173 HydrophobicContact CE2-CE1 4.35Å; F157-F173 AromaticContact CE2-CG 3.63Å; F157-F173 HydrophobicContact CE2-CG 3.63Å; F157-F173 HydrophobicContact CZ-CB 3.7Å; F157-F173 HydrophobicContact CZ-CD1 4.43Å; F157-F173 HydrophobicContact CZ-CG 4.01Å; T169-F173 PolarHBondContact O-N 2.81Å; F170-F173 PolarHBondContact O-N 2.97Å; F173-K175 VanDerWaalsContact C-N 3.31Å; F173-K175 PolarHBondContact O-N 3.24Å; F173-D176 PolarHBondContact O-N 3.05Å; F173-D176 VanDerWaalsContact O-N 3.09Å; F173-Q177 HydrophobicContact CD1-CG 4.12Å; F173-Q177 HydrophobicContact CE1-CG 3.67Å; F173-Q177 HydrophobicContact CE2-CG 4.11Å; F173-Q177 VanDerWaalsContact CE2-NE2 3.29Å; F173-Q177 HydrophobicContact CZ-CG 3.66Å; F173-Q177 WeakPolarHBondContact O-CG 3.39Å; F173-Q177 PolarHBondContact O-N 2.96Å
174I97.4Very high95.9Very high47 Ų4752.4 Ų52.424%0.24129%0.29CS..Hα-helixtrans-61.5-40.2-180-67.3-61.5000111.5L149 F170 D176 Q177 I178L149-I174 HydrophobicContact CD1-CD1 4.4Å; F170-I174 HydrophobicContact CD1-CG1 4.07Å; F170-I174 HydrophobicContact CE1-CD1 4.2Å; F170-I174 HydrophobicContact CE1-CG1 3.65Å; F170-I174 HydrophobicContact CE2-CD1 4.25Å; F170-I174 HydrophobicContact CE2-CG1 4.24Å; F170-I174 HydrophobicContact CZ-CD1 3.8Å; F170-I174 HydrophobicContact CZ-CG1 3.74Å; F170-I174 WeakPolarHBondContact O-CG1 3.09Å; F170-I174 PolarHBondContact O-N 3.48Å; I174-D176 VanDerWaalsContact C-N 3.27Å; I174-D176 PolarHBondContact O-N 3.06Å; I174-Q177 PolarHBondContact O-N 3.24Å; I174-I178 HydrophobicContact CG2-CD1 3.89Å; I174-I178 HydrophobicContact CG2-CG1 4.48Å; I174-I178 WeakPolarHBondContact O-CG1 3.07Å; I174-I178 PolarHBondContact O-N 3.41Å
175K97.1Very high96.2Very high136 Ų13652 Ų5259%0.59128%0.278SS*.Hα-helixtrans-58.3-41.6175.2-178.8177.6179.4176.80111.5G171 F172 F173 K179G171-K175 WeakPolarHBondContact O-CB 3.48Å; G171-K175 PolarHBondContact O-N 3.18Å; G171-K175 VanDerWaalsContact O-N 3.11Å; F172-K175 PolarHBondContact O-N 2.94Å; F173-K175 VanDerWaalsContact C-N 3.31Å; F173-K175 PolarHBondContact O-N 3.24Å; K175-K179 VanDerWaalsContact O-CB 3.28Å; K175-K179 WeakPolarHBondContact O-CB 3.36Å; K175-K179 PolarHBondContact O-N 2.9Å
176D96.8Very high96.4Very high9 Ų957.4 Ų57.45%0.04831%0.306CS..Hα-helixtrans-73.3-35.2178.6-75-26.8000113.2F172 F173 I174 K179 S180 F233 R270F172-D176 VanDerWaalsContact CE1-OD2 3.31Å; F172-D176 WeakPolarHBondContact CE1-OD2 3.38Å; F172-D176 VanDerWaalsContact CZ-OD2 3.26Å; F172-D176 WeakPolarHBondContact CZ-OD2 3.32Å; F172-D176 PolarHBondContact O-N 3.37Å; F172-D176 VanDerWaalsContact O-N 3.09Å; F173-D176 PolarHBondContact O-N 3.05Å; F173-D176 VanDerWaalsContact O-N 3.09Å; I174-D176 VanDerWaalsContact C-N 3.27Å; I174-D176 PolarHBondContact O-N 3.06Å; D176-K179 PolarHBondContact O-N 3.25Å; D176-K179 IonicContact OD1-NZ 3.42Å; D176-K179 PolarHBondContact OD1-NZ 2.97Å; D176-S180 VanDerWaalsContact O-CB 3.28Å; D176-S180 WeakPolarHBondContact O-CB 3.29Å; D176-S180 PolarHBondContact O-N 3.46Å; D176-F233 HydrophobicContact CB-CD1 4.19Å; D176-F233 HydrophobicContact CB-CE1 4.29Å; D176-R270 IonicContact OD1-NH2 3.07Å; D176-R270 IonicContact OD2-CZ 3.37Å; D176-R270 IonicContact OD2-NH1 3.9Å; D176-R270 PolarHBondContact OD2-NH1 3.19Å; D176-R270 IonicContact OD2-NH2 2.76Å; D176-R270 PolarHBondContact OD2-NH2 2.87Å
177Q97.7Very high96.5Very high46 Ų4658.5 Ų58.522%0.21531%0.311CS..Hα-helixtrans-59.1-48.5172.2-67.1-56-36.900111.1F145 L149 F173 I174 S180 L181F145-Q177 HydrophobicContact CE2-CB 3.87Å; F145-Q177 HydrophobicContact CZ-CB 4.2Å; L149-Q177 HydrophobicContact CD1-CG 4.38Å; F173-Q177 HydrophobicContact CD1-CG 4.12Å; F173-Q177 HydrophobicContact CE1-CG 3.67Å; F173-Q177 HydrophobicContact CE2-CG 4.11Å; F173-Q177 VanDerWaalsContact CE2-NE2 3.29Å; F173-Q177 HydrophobicContact CZ-CG 3.66Å; F173-Q177 WeakPolarHBondContact O-CG 3.39Å; F173-Q177 PolarHBondContact O-N 2.96Å; I174-Q177 PolarHBondContact O-N 3.24Å; Q177-S180 PolarHBondContact O-N 2.88Å; Q177-L181 PolarHBondContact O-N 3.27Å
178I97.8Very high96.7Very high84 Ų8455.8 Ų55.843%0.43130%0.303SS..Hα-helixtrans-64.2-44.7177.9-65.6169000111I174 S180 L181 L182I174-I178 HydrophobicContact CG2-CD1 3.89Å; I174-I178 HydrophobicContact CG2-CG1 4.48Å; I174-I178 WeakPolarHBondContact O-CG1 3.07Å; I174-I178 PolarHBondContact O-N 3.41Å; I178-S180 VanDerWaalsContact C-N 3.31Å; I178-S180 PolarHBondContact O-N 3.38Å; I178-L181 WeakPolarHBondContact O-CB 3.27Å; I178-L181 PolarHBondContact O-N 2.78Å; I178-L182 HydrophobicContact CG2-CD1 4.13Å; I178-L182 HydrophobicContact CG2-CG 4.45Å; I178-L182 WeakPolarHBondContact O-CG 3.38Å; I178-L182 PolarHBondContact O-N 3.39Å
179K97.5Very high96.9Very high49 Ų4956.6 Ų56.621%0.21331%0.308CS..Hα-helixtrans-59.8-43177.7-171-166.3-59.9153.10111.5K175 D176 L182 I183 L232 F233K175-K179 VanDerWaalsContact O-CB 3.28Å; K175-K179 WeakPolarHBondContact O-CB 3.36Å; K175-K179 PolarHBondContact O-N 2.9Å; D176-K179 PolarHBondContact O-N 3.25Å; D176-K179 IonicContact OD1-NZ 3.42Å; D176-K179 PolarHBondContact OD1-NZ 2.97Å; K179-L182 PolarHBondContact O-N 3.21Å; K179-I183 HydrophobicContact CD-CD1 4.4Å; K179-I183 HydrophobicContact CG-CD1 3.93Å; K179-I183 WeakPolarHBondContact O-CG1 3.31Å; K179-I183 PolarHBondContact O-N 2.94Å; K179-L232 HydrophobicContact CD-CB 4.28Å; K179-L232 PolarHBondContact NZ-O 3.44Å; K179-F233 HydrophobicContact CB-CE1 4.21Å; K179-F233 HydrophobicContact CB-CZ 4.42Å; K179-F233 HydrophobicContact CD-CD1 4.13Å; K179-F233 HydrophobicContact CD-CE1 3.8Å; K179-F233 HydrophobicContact CD-CE2 4.31Å; K179-F233 HydrophobicContact CD-CZ 3.89Å; K179-F233 HydrophobicContact CG-CE1 4.22Å; K179-F233 HydrophobicContact CG-CZ 4.1Å
180S97.3Very high97Very high51 Ų5156.3 Ų56.336%0.35731%0.307SS..Hα-helixtrans-61.1-45.4176.4-172.50000111.9D176 Q177 I178 L182 I183 S184D176-S180 VanDerWaalsContact O-CB 3.28Å; D176-S180 WeakPolarHBondContact O-CB 3.29Å; D176-S180 PolarHBondContact O-N 3.46Å; Q177-S180 PolarHBondContact O-N 2.88Å; I178-S180 VanDerWaalsContact C-N 3.31Å; I178-S180 PolarHBondContact O-N 3.38Å; S180-L182 PolarHBondContact O-N 3.3Å; S180-I183 PolarHBondContact O-N 3.22Å; S180-S184 VanDerWaalsContact O-CB 3.3Å; S180-S184 WeakPolarHBondContact O-CB 3.24Å; S180-S184 PolarHBondContact O-N 2.91Å; S180-S184 PolarHBondContact O-OG 3.05Å
181L97.3Very high97Very high39 Ų3953 Ų5320%0.20430%0.295CS..Hα-helixtrans-58-49.5176.2-174.865.3000111.5F145 Q177 I178 S184 M185F145-L181 HydrophobicContact CB-CD1 4Å; F145-L181 HydrophobicContact CB-CD2 4.33Å; F145-L181 HydrophobicContact CD1-CD2 4.29Å; F145-L181 HydrophobicContact CD2-CB 4.06Å; F145-L181 HydrophobicContact CD2-CD1 4.05Å; F145-L181 HydrophobicContact CD2-CD2 3.87Å; F145-L181 HydrophobicContact CD2-CG 4.22Å; F145-L181 HydrophobicContact CE2-CB 4.22Å; F145-L181 HydrophobicContact CE2-CD2 4.21Å; F145-L181 HydrophobicContact CG-CD1 4.25Å; F145-L181 HydrophobicContact CG-CD2 3.9Å; Q177-L181 PolarHBondContact O-N 3.27Å; I178-L181 WeakPolarHBondContact O-CB 3.27Å; I178-L181 PolarHBondContact O-N 2.78Å; L181-S184 PolarHBondContact O-N 3.46Å; L181-M185 HydrophobicContact CD1-CE 3.57Å; L181-M185 HydrophobicContact CD2-CE 3.97Å; L181-M185 HydrophobicContact CG-CE 3.63Å; L181-M185 HydrophobicContact CG-SD 4.37Å; L181-M185 WeakPolarHBondContact O-CG 3.45Å; L181-M185 PolarHBondContact O-N 3.28Å
182L97.7Very high97Very high97 Ų9752.3 Ų52.351%0.50828%0.278SS..Hα-helixtrans-62.7-46.4-179.1-68.7175.6000112.3I178 K179 S180 S184 M185 I186I178-L182 HydrophobicContact CG2-CD1 4.13Å; I178-L182 HydrophobicContact CG2-CG 4.45Å; I178-L182 WeakPolarHBondContact O-CG 3.38Å; I178-L182 PolarHBondContact O-N 3.39Å; K179-L182 PolarHBondContact O-N 3.21Å; S180-L182 PolarHBondContact O-N 3.3Å; L182-S184 VanDerWaalsContact C-N 3.32Å; L182-S184 PolarHBondContact O-N 3.02Å; L182-M185 PolarHBondContact O-N 3.45Å; L182-I186 WeakPolarHBondContact O-CB 3.47Å; L182-I186 VanDerWaalsContact O-CG1 3.24Å; L182-I186 WeakPolarHBondContact O-CG1 3.32Å; L182-I186 PolarHBondContact O-N 2.91Å
183I97.8Very high97Very high30 Ų3052.6 Ų52.615%0.15428%0.283CS..Hα-helixtrans-62-43.2177.5-68.9169.7000110.4K179 S180 M185 I186 I187 I229 L232 F233K179-I183 HydrophobicContact CD-CD1 4.4Å; K179-I183 HydrophobicContact CG-CD1 3.93Å; K179-I183 WeakPolarHBondContact O-CG1 3.31Å; K179-I183 PolarHBondContact O-N 2.94Å; S180-I183 PolarHBondContact O-N 3.22Å; I183-M185 VanDerWaalsContact C-N 3.31Å; I183-M185 PolarHBondContact O-N 2.99Å; I183-I186 PolarHBondContact O-N 3.48Å; I183-I187 HydrophobicContact CG2-CD1 3.77Å; I183-I187 WeakPolarHBondContact O-CG1 3.42Å; I183-I187 PolarHBondContact O-N 3.44Å; I183-I229 HydrophobicContact CD1-CG2 4.37Å; I183-I229 HydrophobicContact CG2-CD1 4.33Å; I183-I229 HydrophobicContact CG2-CG2 4.17Å; I183-L232 HydrophobicContact CD1-CD1 3.84Å; I183-F233 HydrophobicContact CD1-CE2 3.74Å; I183-F233 HydrophobicContact CD1-CZ 3.89Å
184S96.4Very high97Very high66 Ų6654.3 Ų54.346%0.46230%0.295SS..Hα-helixtrans-62.9-38.3178.4-57.60000111.8S180 L181 L182 G188S180-S184 VanDerWaalsContact O-CB 3.3Å; S180-S184 WeakPolarHBondContact O-CB 3.24Å; S180-S184 PolarHBondContact O-N 2.91Å; S180-S184 PolarHBondContact O-OG 3.05Å; L181-S184 PolarHBondContact O-N 3.46Å; L182-S184 VanDerWaalsContact C-N 3.32Å; L182-S184 PolarHBondContact O-N 3.02Å; S184-G188 WeakPolarHBondContact O-CA 3.49Å; S184-G188 PolarHBondContact O-N 2.95Å
185M96.3Very high97Very high26 Ų2652.7 Ų52.713%0.12829%0.287CS..Hα-helixtrans-68.5-46.4174.5-71.5-179.5-177.600112.2L138 A141 V142 L181 L182 I183 I187 G188 I189L138-M185 HydrophobicContact CD1-CE 3.51Å; L138-M185 HydrophobicContact CD1-SD 3.55Å; L138-M185 VanDerWaalsContact CD1-SD 3.55Å; A141-M185 HydrophobicContact CB-CE 3.92Å; V142-M185 HydrophobicContact CG2-CE 4.01Å; L181-M185 HydrophobicContact CD1-CE 3.57Å; L181-M185 HydrophobicContact CD2-CE 3.97Å; L181-M185 HydrophobicContact CG-CE 3.63Å; L181-M185 HydrophobicContact CG-SD 4.37Å; L181-M185 WeakPolarHBondContact O-CG 3.45Å; L181-M185 PolarHBondContact O-N 3.28Å; L182-M185 PolarHBondContact O-N 3.45Å; I183-M185 VanDerWaalsContact C-N 3.31Å; I183-M185 PolarHBondContact O-N 2.99Å; M185-I187 PolarHBondContact O-N 3.12Å; M185-G188 PolarHBondContact O-N 3.31Å; M185-I189 HydrophobicContact CB-CD1 4.23Å; M185-I189 VanDerWaalsContact O-CB 3.32Å; M185-I189 WeakPolarHBondContact O-CB 3.32Å; M185-I189 VanDerWaalsContact O-CG1 3.31Å; M185-I189 WeakPolarHBondContact O-CG1 3.31Å; M185-I189 PolarHBondContact O-N 3.26Å
186I97Very high97Very high124 Ų12446.3 Ų46.364%0.63626%0.259SS*.Hα-helixtrans-58.7-37.9180-72165.6000111.3L182 I183 P190L182-I186 WeakPolarHBondContact O-CB 3.47Å; L182-I186 VanDerWaalsContact O-CG1 3.24Å; L182-I186 WeakPolarHBondContact O-CG1 3.32Å; L182-I186 PolarHBondContact O-N 2.91Å; I183-I186 PolarHBondContact O-N 3.48Å; I186-P190 WeakPolarHBondContact O-CD 3.45Å; I186-P190 VanDerWaalsContact O-CG 3.31Å; I186-P190 WeakPolarHBondContact O-CG 3.4Å
187I97.3Very high96.9Very high50 Ų5052.5 Ų52.526%0.25628%0.282SS..Hα-helixtrans-84.8-45.6179.5-66.1173.2000111I183 M185 P190 I191 L221 I229I183-I187 HydrophobicContact CG2-CD1 3.77Å; I183-I187 WeakPolarHBondContact O-CG1 3.42Å; I183-I187 PolarHBondContact O-N 3.44Å; M185-I187 PolarHBondContact O-N 3.12Å; I187-P190 WeakPolarHBondContact O-CD 3.5Å; I187-I191 HydrophobicContact CG2-CD1 3.49Å; I187-I191 VanDerWaalsContact CG2-CD1 3.49Å; I187-I191 VanDerWaalsContact O-CD1 3.28Å; I187-I191 WeakPolarHBondContact O-CD1 3.39Å; I187-I191 VanDerWaalsContact O-CG1 3.26Å; I187-I191 WeakPolarHBondContact O-CG1 3.49Å; I187-I191 PolarHBondContact O-N 3.42Å; I187-L221 HydrophobicContact CD1-CD2 4.38Å; I187-L221 HydrophobicContact CG2-CD1 4.27Å; I187-L221 HydrophobicContact CG2-CD2 4.09Å; I187-I229 HydrophobicContact CD1-CD1 3.55Å
188G96.5Very high96.9Very high12 Ų1251.2 Ų51.212%0.12428%0.276CS..Hα-helixtrans-67.3-41.7-17400000113.5S184 M185 I191 M192S184-G188 WeakPolarHBondContact O-CA 3.49Å; S184-G188 PolarHBondContact O-N 2.95Å; M185-G188 PolarHBondContact O-N 3.31Å; G188-I191 PolarHBondContact O-N 3.48Å; G188-M192 WeakPolarHBondContact O-CB 3.34Å; G188-M192 VanDerWaalsContact O-CG 3.29Å; G188-M192 WeakPolarHBondContact O-CG 3.32Å; G188-M192 PolarHBondContact O-N 2.95Å
189I96.3Very high96.8Very high49 Ų4947.7 Ų47.725%0.25126%0.258SS..Hα-helixtrans-60.5-51.7-177-71.3168.8000112V134 F137 M185 I191 S193V134-I189 HydrophobicContact CG1-CD1 4.43Å; V134-I189 HydrophobicContact CG1-CG1 4.28Å; V134-I189 HydrophobicContact CG1-CG2 3.7Å; V134-I189 HydrophobicContact CG2-CG2 4.12Å; F137-I189 HydrophobicContact CD1-CG1 3.92Å; F137-I189 HydrophobicContact CE1-CG1 4.18Å; M185-I189 HydrophobicContact CB-CD1 4.23Å; M185-I189 VanDerWaalsContact O-CB 3.32Å; M185-I189 WeakPolarHBondContact O-CB 3.32Å; M185-I189 VanDerWaalsContact O-CG1 3.31Å; M185-I189 WeakPolarHBondContact O-CG1 3.31Å; M185-I189 PolarHBondContact O-N 3.26Å; I189-I191 PolarHBondContact O-N 2.9Å; I189-S193 WeakPolarHBondContact O-CB 3.45Å; I189-S193 PolarHBondContact O-N 3.04Å; I189-S193 PolarHBondContact O-OG 2.85Å
190P96.8Very high96.6Very high77 Ų7750.1 Ų50.150%0.527%0.269SS..Hα-helixtrans-61.5-41.6176.4-25.134.5000113.2I186 I187 S193 C194I186-P190 WeakPolarHBondContact O-CD 3.45Å; I186-P190 VanDerWaalsContact O-CG 3.31Å; I186-P190 WeakPolarHBondContact O-CG 3.4Å; I187-P190 WeakPolarHBondContact O-CD 3.5Å; P190-S193 PolarHBondContact O-N 3.45Å; P190-C194 WeakPolarHBondContact O-CB 3.24Å; P190-C194 PolarHBondContact O-N 2.95Å
191I97.6Very high96.4Very high42 Ų4252.2 Ų52.222%0.21528%0.279CS..Hα-helixtrans-63.4-49-179.4-68.3166.8000110.4I187 G188 I189 S193 C194 L195 F213 V217 L221I187-I191 HydrophobicContact CG2-CD1 3.49Å; I187-I191 VanDerWaalsContact CG2-CD1 3.49Å; I187-I191 VanDerWaalsContact O-CD1 3.28Å; I187-I191 WeakPolarHBondContact O-CD1 3.39Å; I187-I191 VanDerWaalsContact O-CG1 3.26Å; I187-I191 WeakPolarHBondContact O-CG1 3.49Å; I187-I191 PolarHBondContact O-N 3.42Å; G188-I191 PolarHBondContact O-N 3.48Å; I189-I191 PolarHBondContact O-N 2.9Å; I191-S193 VanDerWaalsContact C-N 3.34Å; I191-S193 PolarHBondContact O-N 3.28Å; I191-C194 PolarHBondContact O-N 3.04Å; I191-L195 VanDerWaalsContact O-CB 3.3Å; I191-L195 WeakPolarHBondContact O-CB 3.47Å; I191-L195 PolarHBondContact O-N 2.84Å; I191-F213 HydrophobicContact CG2-CE1 3.99Å; I191-F213 HydrophobicContact CG2-CZ 4.2Å; I191-V217 HydrophobicContact CD1-CG1 3.45Å; I191-V217 VanDerWaalsContact CD1-CG1 3.45Å; I191-V217 HydrophobicContact CG1-CG1 3.87Å; I191-V217 HydrophobicContact CG1-CG2 4.49Å; I191-V217 HydrophobicContact CG2-CG1 4.32Å; I191-L221 HydrophobicContact CD1-CD1 4.28Å
192M95.7Very high96.2Very high36 Ų3651 Ų5118%0.17728%0.277CS..Hα-helixtrans-63.9-40.7178.7-71.7-53.9-58.600111.7F137 G188 C194 L195 V196 I383 L386F137-M192 HydrophobicContact CD2-CG 4.07Å; F137-M192 HydrophobicContact CE2-CG 4.15Å; F137-M192 HydrophobicContact CG-CG 4.46Å; G188-M192 WeakPolarHBondContact O-CB 3.34Å; G188-M192 VanDerWaalsContact O-CG 3.29Å; G188-M192 WeakPolarHBondContact O-CG 3.32Å; G188-M192 PolarHBondContact O-N 2.95Å; M192-C194 PolarHBondContact O-N 3.18Å; M192-L195 PolarHBondContact O-N 2.84Å; M192-L195 HydrophobicContact SD-CD2 4.47Å; M192-V196 WeakPolarHBondContact O-CG2 3.36Å; M192-V196 PolarHBondContact O-N 3.27Å; M192-I383 HydrophobicContact CE-CD1 3.86Å; M192-I383 HydrophobicContact CE-CG1 4.01Å; M192-L386 HydrophobicContact CE-CD2 4.41Å
193S95.9Very high96Very high30 Ų3048.8 Ų48.821%0.2128%0.277CS..Hα-helixtrans-61.8-46177.4-55.90000111.5V134 I189 P190 I191 W197V134-S193 WeakPolarHBondContact CG2-OG 3.49Å; I189-S193 WeakPolarHBondContact O-CB 3.45Å; I189-S193 PolarHBondContact O-N 3.04Å; I189-S193 PolarHBondContact O-OG 2.85Å; P190-S193 PolarHBondContact O-N 3.45Å; I191-S193 VanDerWaalsContact C-N 3.34Å; I191-S193 PolarHBondContact O-N 3.28Å; S193-W197 VanDerWaalsContact O-CB 3.28Å; S193-W197 WeakPolarHBondContact O-CB 3.48Å; S193-W197 PolarHBondContact O-N 3.04Å
194C97.7Very high95.8Very high41 Ų4154.4 Ų54.428%0.27730%0.302SS..Hα-helixtrans-66.9-40.7178.1-170.60000111.5P190 I191 M192 W197 I198 F213P190-C194 WeakPolarHBondContact O-CB 3.24Å; P190-C194 PolarHBondContact O-N 2.95Å; I191-C194 PolarHBondContact O-N 3.04Å; M192-C194 PolarHBondContact O-N 3.18Å; C194-W197 WeakPolarHBondContact O-CB 3.15Å; C194-W197 PolarHBondContact O-N 3.09Å; C194-I198 WeakPolarHBondContact O-CB 3.45Å; C194-I198 VanDerWaalsContact O-CG1 3.25Å; C194-I198 WeakPolarHBondContact O-CG1 3.35Å; C194-I198 PolarHBondContact O-N 3.45Å; C194-F213 HydrophobicContact CB-CE1 4.29Å; C194-F213 HydrophobicContact CB-CE2 3.91Å; C194-F213 HydrophobicContact CB-CZ 3.6Å; C194-F213 WeakPolarHBondContact SG-CE2 3.44Å
195L97.2Very high95.7Very high12 Ų1257.1 Ų57.16%0.06330%0.303CS..Hα-helixtrans-62.3-49178.3-176.462000111.8I191 M192 W197 I198 I199 A210 F213 L386I191-L195 VanDerWaalsContact O-CB 3.3Å; I191-L195 WeakPolarHBondContact O-CB 3.47Å; I191-L195 PolarHBondContact O-N 2.84Å; M192-L195 PolarHBondContact O-N 2.84Å; M192-L195 HydrophobicContact SD-CD2 4.47Å; L195-W197 VanDerWaalsContact C-N 3.3Å; L195-W197 PolarHBondContact O-N 3.01Å; L195-I198 PolarHBondContact O-N 2.86Å; L195-I199 HydrophobicContact CD1-CD1 4.17Å; L195-I199 HydrophobicContact CG-CD1 4.05Å; L195-I199 VanDerWaalsContact O-CG1 3.28Å; L195-I199 WeakPolarHBondContact O-CG1 3.48Å; L195-I199 PolarHBondContact O-N 3.47Å; L195-A210 HydrophobicContact CD1-CB 3.79Å; L195-F213 HydrophobicContact CB-CD1 4.46Å; L195-F213 HydrophobicContact CB-CE1 4.07Å; L195-F213 HydrophobicContact CD1-CD1 4.19Å; L195-L386 HydrophobicContact CD2-CD2 3.64Å
196V95.8Very high95.8Very high2 Ų256.8 Ų56.81%0.01230%0.301CS..Hα-helixtrans-60.9-42.8176173.10000110.3I130 M192 I199 K200 V382 I383I130-V196 HydrophobicContact CG1-CG1 3.9Å; M192-V196 WeakPolarHBondContact O-CG2 3.36Å; M192-V196 PolarHBondContact O-N 3.27Å; V196-I199 PolarHBondContact O-N 3.35Å; V196-K200 HydrophobicContact CG1-CD 4.17Å; V196-K200 HydrophobicContact CG1-CG 4.41Å; V196-K200 WeakPolarHBondContact O-CG 3.39Å; V196-K200 PolarHBondContact O-N 3.19Å; V196-V382 HydrophobicContact CG1-CB 4.19Å; V196-V382 HydrophobicContact CG1-CG1 4.3Å; V196-V382 HydrophobicContact CG2-CG1 4.42Å; V196-I383 HydrophobicContact CG2-CB 4.26Å
197W96.1Very high95.7Very high139 Ų13953 Ų5353%0.52728%0.279SS..Hα-helixtrans-60.3-46.8176.7175.176.2000112.8I130 S193 C194 L195 I199 K200 V201I130-W197 HydrophobicContact CD1-CB 3.93Å; I130-W197 HydrophobicContact CD1-CG 4.45Å; S193-W197 VanDerWaalsContact O-CB 3.28Å; S193-W197 WeakPolarHBondContact O-CB 3.48Å; S193-W197 PolarHBondContact O-N 3.04Å; C194-W197 WeakPolarHBondContact O-CB 3.15Å; C194-W197 PolarHBondContact O-N 3.09Å; L195-W197 VanDerWaalsContact C-N 3.3Å; L195-W197 PolarHBondContact O-N 3.01Å; W197-I199 VanDerWaalsContact C-N 3.3Å; W197-I199 PolarHBondContact O-N 3.33Å; W197-K200 PolarHBondContact O-N 2.86Å; W197-V201 WeakPolarHBondContact O-CB 3.47Å; W197-V201 PolarHBondContact O-N 2.94Å
198I97.7Very high95.8Very high19 Ų1953.8 Ų53.810%0.09728%0.284CS..Hα-helixtrans-58.7-44.1177-72.7166.3000110.6C194 L195 G202 A210 F213C194-I198 WeakPolarHBondContact O-CB 3.45Å; C194-I198 VanDerWaalsContact O-CG1 3.25Å; C194-I198 WeakPolarHBondContact O-CG1 3.35Å; C194-I198 PolarHBondContact O-N 3.45Å; L195-I198 PolarHBondContact O-N 2.86Å; I198-G202 WeakPolarHBondContact O-CA 3.4Å; I198-G202 PolarHBondContact O-N 2.69Å; I198-A210 HydrophobicContact CG2-CB 4.19Å; I198-F213 HydrophobicContact CD1-CB 3.51Å; I198-F213 HydrophobicContact CD1-CD1 3.93Å; I198-F213 HydrophobicContact CD1-CD2 3.85Å; I198-F213 HydrophobicContact CD1-CG 3.48Å; I198-F213 VanDerWaalsContact CD1-CG 3.48Å
199I95.7Very high95.9Very high10 Ų1058.9 Ų58.95%0.05130%0.3CS..Hα-helixtrans-66.3-42.1-179-66.4165.2000110.7L195 V196 W197 F206 A210 F360 M364 V382 L386L195-I199 HydrophobicContact CD1-CD1 4.17Å; L195-I199 HydrophobicContact CG-CD1 4.05Å; L195-I199 VanDerWaalsContact O-CG1 3.28Å; L195-I199 WeakPolarHBondContact O-CG1 3.48Å; L195-I199 PolarHBondContact O-N 3.47Å; V196-I199 PolarHBondContact O-N 3.35Å; W197-I199 VanDerWaalsContact C-N 3.3Å; W197-I199 PolarHBondContact O-N 3.33Å; I199-F206 HydrophobicContact CB-CD2 4.12Å; I199-F206 HydrophobicContact CG1-CD2 3.95Å; I199-F206 HydrophobicContact CG1-CE2 4.4Å; I199-F206 HydrophobicContact CG2-CD2 3.74Å; I199-F206 HydrophobicContact CG2-CE2 3.92Å; I199-F206 HydrophobicContact CG2-CG 4.35Å; I199-A210 HydrophobicContact CG1-CB 4.19Å; I199-F360 HydrophobicContact CD1-CE1 4.01Å; I199-F360 HydrophobicContact CD1-CZ 4.36Å; I199-F360 HydrophobicContact CG1-CE1 4.49Å; I199-M364 HydrophobicContact CG2-CE 3.32Å; I199-M364 HydrophobicContact CG2-SD 3.52Å; I199-M364 VanDerWaalsContact CG2-SD 3.52Å; I199-V382 HydrophobicContact CB-CG1 3.76Å; I199-V382 HydrophobicContact CD1-CG1 3.77Å; I199-V382 HydrophobicContact CG1-CG1 4.38Å; I199-V382 HydrophobicContact CG2-CG1 3.52Å; I199-V382 HydrophobicContact CG2-CG2 4.28Å; I199-L386 HydrophobicContact CD1-CD1 4.4Å
200K92.7Very high96Very high100 Ų10056.6 Ų56.644%0.43529%0.288SS..Hα-helixtrans-67.7-37.7179.2-71.4-170.169.1150.40113.6E129 V196 W197 V382E129-K200 WeakPolarHBondContact OE2-CE 3.42Å; E129-K200 IonicContact OE2-NZ 3.88Å; E129-K200 PolarHBondContact OE2-NZ 3.28Å; V196-K200 HydrophobicContact CG1-CD 4.17Å; V196-K200 HydrophobicContact CG1-CG 4.41Å; V196-K200 WeakPolarHBondContact O-CG 3.39Å; V196-K200 PolarHBondContact O-N 3.19Å; W197-K200 PolarHBondContact O-N 2.86Å; K200-V382 HydrophobicContact CD-CG2 4.35Å; K200-V382 HydrophobicContact CG-CG2 3.72Å
201V94.2Very high96Very high95 Ų9554.7 Ų54.758%0.57627%0.272SS*.Hα-helixtrans-98.5-19.7-172.9179.40000112.5W197 G203W197-V201 WeakPolarHBondContact O-CB 3.47Å; W197-V201 PolarHBondContact O-N 2.94Å; V201-G203 PolarHBondContact O-N 2.99Å
202G92.7Very high96.1Very high15 Ų1557.6 Ų57.616%0.15529%0.287CS..SBendtrans-69.9-2.2-168.900000116.3I198 F206 Y209I198-G202 WeakPolarHBondContact O-CA 3.4Å; I198-G202 PolarHBondContact O-N 2.69Å; G202-F206 PolarHBondContact O-N 3Å; G202-Y209 VanDerWaalsContact O-CE2 3.28Å; G202-Y209 WeakPolarHBondContact O-CE2 3.3Å
203G93.3Very high96.2Very high50 Ų5057.7 Ų57.752%0.51529%0.287SS..G310 helixtrans55.5-149.4178.300000112.6V201 Y205 F206V201-G203 PolarHBondContact O-N 2.99Å; G203-Y205 PolarHBondContact O-N 3.3Å; G203-Y205 VanDerWaalsContact O-N 3.1Å; G203-F206 WeakPolarHBondContact O-CB 3.41Å; G203-F206 VanDerWaalsContact O-CD1 3.25Å; G203-F206 WeakPolarHBondContact O-CD1 3.41Å; G203-F206 PolarHBondContact O-N 2.87Å; G203-F206 VanDerWaalsContact O-N 3.12Å
204H92.8Very high96.3Very high148 Ų14857.6 Ų57.669%0.68529%0.285SS*.G310 helixtrans-57.8-29.2-175.6-174.4-170.4000114.1Y207H204-Y207 VanDerWaalsContact O-CE1 3.28Å; H204-Y207 WeakPolarHBondContact O-CE1 3.4Å
205Y95.3Very high96.4Very high122 Ų12257 Ų5748%0.47828%0.28SS..G310 helixtrans-101.817.5-177.9-62.1-68.6000113.7G203 Y207 L208 Y209G203-Y205 PolarHBondContact O-N 3.3Å; G203-Y205 VanDerWaalsContact O-N 3.1Å; Y205-Y207 PolarHBondContact O-N 3.27Å; Y205-L208 HydrophobicContact CD1-CD1 3.99Å; Y205-L208 PolarHBondContact O-N 2.84Å; Y205-Y209 PolarHBondContact O-N 3.17Å
206F96.8Very high96.4Very high19 Ų1960.6 Ų60.68%0.08330%0.303CS..Hα-helixtrans-51.7-36.7-175.377.2-101000113I199 G202 G203 L208 Y209 A210 F360 M364I199-F206 HydrophobicContact CB-CD2 4.12Å; I199-F206 HydrophobicContact CG1-CD2 3.95Å; I199-F206 HydrophobicContact CG1-CE2 4.4Å; I199-F206 HydrophobicContact CG2-CD2 3.74Å; I199-F206 HydrophobicContact CG2-CE2 3.92Å; I199-F206 HydrophobicContact CG2-CG 4.35Å; G202-F206 PolarHBondContact O-N 3Å; G203-F206 WeakPolarHBondContact O-CB 3.41Å; G203-F206 VanDerWaalsContact O-CD1 3.25Å; G203-F206 WeakPolarHBondContact O-CD1 3.41Å; G203-F206 PolarHBondContact O-N 2.87Å; G203-F206 VanDerWaalsContact O-N 3.12Å; F206-L208 VanDerWaalsContact C-N 3.32Å; F206-L208 PolarHBondContact O-N 3.3Å; F206-Y209 PolarHBondContact O-N 3.2Å; F206-A210 WeakPolarHBondContact O-CB 3.2Å; F206-A210 PolarHBondContact O-N 2.84Å; F206-F360 AromaticContact CE2-CD1 3.89Å; F206-F360 HydrophobicContact CE2-CD1 3.89Å; F206-F360 AromaticContact CE2-CE1 3.59Å; F206-F360 HydrophobicContact CE2-CE1 3.59Å; F206-F360 HydrophobicContact CZ-CD1 4.45Å; F206-F360 HydrophobicContact CZ-CE1 4.25Å; F206-M364 HydrophobicContact CE1-SD 4.01Å; F206-M364 HydrophobicContact CE2-SD 3.65Å; F206-M364 HydrophobicContact CZ-CB 4.08Å; F206-M364 HydrophobicContact CZ-CG 4.31Å; F206-M364 HydrophobicContact CZ-SD 3.31Å; F206-M364 WeakPolarHBondContact CZ-SD 3.19Å
207Y96.5Very high96.6Very high44 Ų4461.6 Ų61.617%0.17331%0.309CS..Hα-helixtrans-67.5-31.4-177.159.4-92.2000112.5H204 Y205 F211 F357 V358H204-Y207 VanDerWaalsContact O-CE1 3.28Å; H204-Y207 WeakPolarHBondContact O-CE1 3.4Å; Y205-Y207 PolarHBondContact O-N 3.27Å; Y207-F211 VanDerWaalsContact O-CB 3.25Å; Y207-F211 WeakPolarHBondContact O-CB 3.31Å; Y207-F211 PolarHBondContact O-N 3.34Å; Y207-F357 VanDerWaalsContact CB-O 3.28Å; Y207-F357 WeakPolarHBondContact CB-O 3.4Å; Y207-V358 HydrophobicContact CD2-CG2 4.06Å; Y207-V358 HydrophobicContact CE2-CG2 3.97Å
208L98Very high96.6Very high67 Ų6757 Ų5735%0.35130%0.296SS..Hα-helixtrans-70.2-39.8173.7-64.7179.6000110.9Y205 F206 L212 L354Y205-L208 HydrophobicContact CD1-CD1 3.99Å; Y205-L208 PolarHBondContact O-N 2.84Å; F206-L208 VanDerWaalsContact C-N 3.32Å; F206-L208 PolarHBondContact O-N 3.3Å; L208-L212 WeakPolarHBondContact O-CB 3.29Å; L208-L212 PolarHBondContact O-N 3.29Å; L208-L354 HydrophobicContact CD2-CD1 4.05Å
209Y98.4Very high96.5Very high120 Ų12058.3 Ų58.347%0.47131%0.305SS..Hα-helixtrans-67.2-42.6175.8-53.1-39000111.3G202 Y205 F206 L212 F213G202-Y209 VanDerWaalsContact O-CE2 3.28Å; G202-Y209 WeakPolarHBondContact O-CE2 3.3Å; Y205-Y209 PolarHBondContact O-N 3.17Å; F206-Y209 PolarHBondContact O-N 3.2Å; Y209-L212 PolarHBondContact O-N 3.42Å; Y209-F213 VanDerWaalsContact O-CB 3.24Å; Y209-F213 WeakPolarHBondContact O-CB 3.34Å; Y209-F213 PolarHBondContact O-N 3.08Å
210A98.3Very high96.5Very high0 Ų063.9 Ų63.90%033%0.329CS..Hα-helixtrans-63.8-42176.400000111.7L195 I198 I199 F206 T214 F357L195-A210 HydrophobicContact CD1-CB 3.79Å; I198-A210 HydrophobicContact CG2-CB 4.19Å; I199-A210 HydrophobicContact CG1-CB 4.19Å; F206-A210 WeakPolarHBondContact O-CB 3.2Å; F206-A210 PolarHBondContact O-N 2.84Å; A210-T214 WeakPolarHBondContact O-CB 3.33Å; A210-T214 PolarHBondContact O-N 3.38Å; A210-T214 PolarHBondContact O-OG1 3.4Å; A210-F357 HydrophobicContact CB-CD1 3.98Å; A210-F357 HydrophobicContact CB-CE1 3.68Å; A210-F357 HydrophobicContact CB-CZ 4.27Å
211F98.5Very high96.6Very high37 Ų3761.4 Ų61.416%0.16232%0.32CS..Hα-helixtrans-58.3-54.9171.2161.4-105.9000111.4Y207 F213 T214 V215 K350 L353 L354 F357Y207-F211 VanDerWaalsContact O-CB 3.25Å; Y207-F211 WeakPolarHBondContact O-CB 3.31Å; Y207-F211 PolarHBondContact O-N 3.34Å; F211-F213 VanDerWaalsContact C-N 3.32Å; F211-F213 PolarHBondContact O-N 2.88Å; F211-T214 PolarHBondContact O-N 3.09Å; F211-T214 VanDerWaalsContact O-N 3.13Å; F211-V215 HydrophobicContact CD2-CG2 3.89Å; F211-V215 HydrophobicContact CE1-CG2 4.24Å; F211-V215 HydrophobicContact CE2-CG2 3.37Å; F211-V215 HydrophobicContact CZ-CG2 3.59Å; F211-V215 WeakPolarHBondContact O-CG2 3.42Å; F211-V215 PolarHBondContact O-N 3.38Å; F211-K350 WeakPolarHBondContact CE2-O 3.33Å; F211-L353 HydrophobicContact CD2-CB 4.44Å; F211-L353 HydrophobicContact CD2-CD2 4.21Å; F211-L353 HydrophobicContact CD2-CG 4.07Å; F211-L353 HydrophobicContact CE2-CB 4.38Å; F211-L353 HydrophobicContact CE2-CD2 4.37Å; F211-L353 HydrophobicContact CE2-CG 4.4Å; F211-L354 HydrophobicContact CB-CD1 4.47Å; F211-L354 HydrophobicContact CD1-CD1 3.72Å; F211-L354 HydrophobicContact CD2-CB 3.9Å; F211-L354 HydrophobicContact CD2-CD1 4.21Å; F211-L354 HydrophobicContact CE1-CB 4.4Å; F211-L354 HydrophobicContact CE1-CD1 3.94Å; F211-L354 HydrophobicContact CE2-CB 3.6Å; F211-L354 HydrophobicContact CE2-CD1 4.41Å; F211-L354 HydrophobicContact CG-CB 4.42Å; F211-L354 HydrophobicContact CG-CD1 3.86Å; F211-L354 HydrophobicContact CZ-CB 3.87Å; F211-L354 HydrophobicContact CZ-CD1 4.27Å; F211-L354 HydrophobicContact CZ-CG 4.48Å; F211-F357 HydrophobicContact CB-CB 4.05Å; F211-F357 HydrophobicContact CB-CD2 3.75Å; F211-F357 HydrophobicContact CB-CE2 4.45Å; F211-F357 HydrophobicContact CB-CG 4.02Å; F211-F357 HydrophobicContact CD2-CD2 4.32Å
212L98.5Very high96.6Very high103 Ų10361 Ų6154%0.53931%0.313SS..Hα-helixtrans-59.9-45-177.3-179.761.5000110.9L208 Y209 T214 V215 V216L208-L212 WeakPolarHBondContact O-CB 3.29Å; L208-L212 PolarHBondContact O-N 3.29Å; Y209-L212 PolarHBondContact O-N 3.42Å; L212-T214 PolarHBondContact O-N 3.16Å; L212-V215 WeakPolarHBondContact O-CB 3.35Å; L212-V215 PolarHBondContact O-N 3.1Å; L212-V216 HydrophobicContact CD1-CG2 4.49Å; L212-V216 WeakPolarHBondContact O-CG2 3.38Å; L212-V216 PolarHBondContact O-N 3.28Å
213F98.7Very high96.5Very high39 Ų3965.1 Ų65.117%0.17133%0.327CS..Hα-helixtrans-55.9-49.8174.2169.9-105.1000111.7I191 C194 L195 I198 Y209 F211 V215 V216 V217I191-F213 HydrophobicContact CG2-CE1 3.99Å; I191-F213 HydrophobicContact CG2-CZ 4.2Å; C194-F213 HydrophobicContact CB-CE1 4.29Å; C194-F213 HydrophobicContact CB-CE2 3.91Å; C194-F213 HydrophobicContact CB-CZ 3.6Å; C194-F213 WeakPolarHBondContact SG-CE2 3.44Å; L195-F213 HydrophobicContact CB-CD1 4.46Å; L195-F213 HydrophobicContact CB-CE1 4.07Å; L195-F213 HydrophobicContact CD1-CD1 4.19Å; I198-F213 HydrophobicContact CD1-CB 3.51Å; I198-F213 HydrophobicContact CD1-CD1 3.93Å; I198-F213 HydrophobicContact CD1-CD2 3.85Å; I198-F213 HydrophobicContact CD1-CG 3.48Å; I198-F213 VanDerWaalsContact CD1-CG 3.48Å; Y209-F213 VanDerWaalsContact O-CB 3.24Å; Y209-F213 WeakPolarHBondContact O-CB 3.34Å; Y209-F213 PolarHBondContact O-N 3.08Å; F211-F213 VanDerWaalsContact C-N 3.32Å; F211-F213 PolarHBondContact O-N 2.88Å; F213-V215 VanDerWaalsContact C-N 3.29Å; F213-V215 PolarHBondContact O-N 2.97Å; F213-V216 PolarHBondContact O-N 2.85Å; F213-V217 HydrophobicContact CD1-CG2 4.46Å; F213-V217 HydrophobicContact CD2-CG2 4.01Å; F213-V217 HydrophobicContact CE1-CG2 4.06Å; F213-V217 HydrophobicContact CE2-CG2 3.55Å; F213-V217 HydrophobicContact CG-CG2 4.44Å; F213-V217 HydrophobicContact CZ-CG2 3.58Å; F213-V217 WeakPolarHBondContact O-CB 3.27Å; F213-V217 WeakPolarHBondContact O-CG2 3.13Å; F213-V217 PolarHBondContact O-N 2.8Å
214T98.4Very high96.6Very high28 Ų2864 Ų6417%0.17231%0.31CS..Hα-helixtrans-63.2-36.3179-54.20000111.6A210 F211 L212 T218 L353 F357A210-T214 WeakPolarHBondContact O-CB 3.33Å; A210-T214 PolarHBondContact O-N 3.38Å; A210-T214 PolarHBondContact O-OG1 3.4Å; F211-T214 PolarHBondContact O-N 3.09Å; F211-T214 VanDerWaalsContact O-N 3.13Å; L212-T214 PolarHBondContact O-N 3.16Å; T214-T218 HydrophobicContact CG2-CG2 4.21Å; T214-T218 WeakPolarHBondContact O-CB 3.29Å; T214-T218 VanDerWaalsContact O-CG2 3.23Å; T214-T218 WeakPolarHBondContact O-CG2 3.3Å; T214-T218 PolarHBondContact O-N 3.33Å; T214-T218 PolarHBondContact O-OG1 2.98Å; T214-L353 HydrophobicContact CG2-CD1 4.46Å; T214-L353 HydrophobicContact CG2-CD2 3.83Å; T214-F357 HydrophobicContact CG2-CE2 4.38Å
215V98.5Very high96.8Very high27 Ų2763.6 Ų63.616%0.16430%0.303CS..Hα-helixtrans-62.7-49.9173.3171.10000111F211 L212 F213 V217 T218 V219 K350 L353F211-V215 HydrophobicContact CD2-CG2 3.89Å; F211-V215 HydrophobicContact CE1-CG2 4.24Å; F211-V215 HydrophobicContact CE2-CG2 3.37Å; F211-V215 HydrophobicContact CZ-CG2 3.59Å; F211-V215 WeakPolarHBondContact O-CG2 3.42Å; F211-V215 PolarHBondContact O-N 3.38Å; L212-V215 WeakPolarHBondContact O-CB 3.35Å; L212-V215 PolarHBondContact O-N 3.1Å; F213-V215 VanDerWaalsContact C-N 3.29Å; F213-V215 PolarHBondContact O-N 2.97Å; V215-V217 PolarHBondContact O-N 3.41Å; V215-T218 PolarHBondContact O-N 2.84Å; V215-T218 PolarHBondContact O-OG1 3.25Å; V215-T218 VanDerWaalsContact O-OG1 3.09Å; V215-V219 HydrophobicContact CG1-CG2 4.36Å; V215-V219 WeakPolarHBondContact O-CB 3.41Å; V215-V219 VanDerWaalsContact O-CG2 3.31Å; V215-V219 WeakPolarHBondContact O-CG2 3.38Å; V215-V219 PolarHBondContact O-N 3.43Å; V215-K350 HydrophobicContact CG2-CD 4.2Å; V215-L353 HydrophobicContact CG2-CD2 4.17Å
216V98.4Very high96.7Very high89 Ų8958.6 Ų58.654%0.53929%0.286SS..Hα-helixtrans-59.3-49.1179174.50000110.6L212 F213 T218 V219 F220L212-V216 HydrophobicContact CD1-CG2 4.49Å; L212-V216 WeakPolarHBondContact O-CG2 3.38Å; L212-V216 PolarHBondContact O-N 3.28Å; F213-V216 PolarHBondContact O-N 2.85Å; V216-T218 PolarHBondContact O-N 2.77Å; V216-V219 PolarHBondContact O-N 3.49Å; V216-F220 WeakPolarHBondContact O-CB 3.45Å; V216-F220 PolarHBondContact O-N 2.88Å
217V98.5Very high96.5Very high23 Ų2361 Ų6114%0.13930%0.297CS..Hα-helixtrans-60-48.2179.6168.30000111.3I191 F213 V215 F220 L221I191-V217 HydrophobicContact CD1-CG1 3.45Å; I191-V217 VanDerWaalsContact CD1-CG1 3.45Å; I191-V217 HydrophobicContact CG1-CG1 3.87Å; I191-V217 HydrophobicContact CG1-CG2 4.49Å; I191-V217 HydrophobicContact CG2-CG1 4.32Å; F213-V217 HydrophobicContact CD1-CG2 4.46Å; F213-V217 HydrophobicContact CD2-CG2 4.01Å; F213-V217 HydrophobicContact CE1-CG2 4.06Å; F213-V217 HydrophobicContact CE2-CG2 3.55Å; F213-V217 HydrophobicContact CG-CG2 4.44Å; F213-V217 HydrophobicContact CZ-CG2 3.58Å; F213-V217 WeakPolarHBondContact O-CB 3.27Å; F213-V217 WeakPolarHBondContact O-CG2 3.13Å; F213-V217 PolarHBondContact O-N 2.8Å; V215-V217 PolarHBondContact O-N 3.41Å; V217-F220 PolarHBondContact O-N 2.92Å; V217-L221 HydrophobicContact CG1-CD1 4Å; V217-L221 HydrophobicContact CG1-CG 4.43Å; V217-L221 WeakPolarHBondContact O-CB 3.41Å; V217-L221 WeakPolarHBondContact O-CG 3.49Å; V217-L221 PolarHBondContact O-N 3.23Å
218T96.7Very high96.4Very high43 Ų4365.3 Ų65.326%0.26432%0.317SS..Hα-helixtrans-68.3-39.5-177.852.30000112.4T214 V215 V216 L221 M222 K350T214-T218 HydrophobicContact CG2-CG2 4.21Å; T214-T218 WeakPolarHBondContact O-CB 3.29Å; T214-T218 VanDerWaalsContact O-CG2 3.23Å; T214-T218 WeakPolarHBondContact O-CG2 3.3Å; T214-T218 PolarHBondContact O-N 3.33Å; T214-T218 PolarHBondContact O-OG1 2.98Å; V215-T218 PolarHBondContact O-N 2.84Å; V215-T218 PolarHBondContact O-OG1 3.25Å; V215-T218 VanDerWaalsContact O-OG1 3.09Å; V216-T218 PolarHBondContact O-N 2.77Å; T218-L221 PolarHBondContact O-N 2.97Å; T218-M222 WeakPolarHBondContact O-CG 3.17Å; T218-M222 PolarHBondContact O-N 2.71Å; T218-K350 PolarHBondContact OG1-NZ 3.16Å
219V94.7Very high96.4Very high45 Ų4562.9 Ų62.927%0.27331%0.305SS..Hα-helixtrans-63.7-45173.6170.90000110.1V215 V216 L221 M222 F223V215-V219 HydrophobicContact CG1-CG2 4.36Å; V215-V219 WeakPolarHBondContact O-CB 3.41Å; V215-V219 VanDerWaalsContact O-CG2 3.31Å; V215-V219 WeakPolarHBondContact O-CG2 3.38Å; V215-V219 PolarHBondContact O-N 3.43Å; V216-V219 PolarHBondContact O-N 3.49Å; V219-L221 PolarHBondContact O-N 3.41Å; V219-M222 WeakPolarHBondContact O-CB 3.43Å; V219-M222 PolarHBondContact O-N 2.85Å; V219-F223 HydrophobicContact CG1-CD2 4.42Å; V219-F223 HydrophobicContact CG1-CE2 3.94Å; V219-F223 WeakPolarHBondContact O-CD2 3.4Å; V219-F223 PolarHBondContact O-N 3.38Å
220F95.7Very high96.3Very high128 Ų12857.5 Ų57.556%0.56129%0.285SS*.Hα-helixtrans-58.4-46.1175.9178.5-109.6000112V216 V217 M222 F223 V224V216-F220 WeakPolarHBondContact O-CB 3.45Å; V216-F220 PolarHBondContact O-N 2.88Å; V217-F220 PolarHBondContact O-N 2.92Å; F220-M222 VanDerWaalsContact C-N 3.3Å; F220-M222 PolarHBondContact O-N 3.47Å; F220-F223 WeakPolarHBondContact O-CB 3.5Å; F220-F223 PolarHBondContact O-N 3.24Å; F220-V224 HydrophobicContact CD1-CG2 3.93Å; F220-V224 HydrophobicContact CD2-CG2 4.14Å; F220-V224 HydrophobicContact CE1-CG2 3.53Å; F220-V224 HydrophobicContact CE2-CG2 3.73Å; F220-V224 HydrophobicContact CG-CG2 4.23Å; F220-V224 HydrophobicContact CZ-CG2 3.41Å; F220-V224 VanDerWaalsContact CZ-CG2 3.41Å; F220-V224 WeakPolarHBondContact O-CG2 3.33Å; F220-V224 PolarHBondContact O-N 3.12Å
221L96.5Very high96.2Very high47 Ų4760.3 Ų60.325%0.24630%0.303CS..Hα-helixtrans-63.9-31.4177.1-73.4176.8000113.1I187 I191 V217 T218 V219 F223 V224 Y225I187-L221 HydrophobicContact CD1-CD2 4.38Å; I187-L221 HydrophobicContact CG2-CD1 4.27Å; I187-L221 HydrophobicContact CG2-CD2 4.09Å; I191-L221 HydrophobicContact CD1-CD1 4.28Å; V217-L221 HydrophobicContact CG1-CD1 4Å; V217-L221 HydrophobicContact CG1-CG 4.43Å; V217-L221 WeakPolarHBondContact O-CB 3.41Å; V217-L221 WeakPolarHBondContact O-CG 3.49Å; V217-L221 PolarHBondContact O-N 3.23Å; T218-L221 PolarHBondContact O-N 2.97Å; V219-L221 PolarHBondContact O-N 3.41Å; L221-F223 PolarHBondContact O-N 3.05Å; L221-V224 PolarHBondContact O-N 3.42Å; L221-Y225 WeakPolarHBondContact O-CB 3.44Å; L221-Y225 PolarHBondContact O-N 3.13Å
222M93.2Very high96.1Very high88 Ų8863.1 Ų63.143%0.43332%0.319SS..Hα-helixtrans-62.1-26.1172.2-71.6174.6172.800112.9T218 V219 F220 P226 F281 L346T218-M222 WeakPolarHBondContact O-CG 3.17Å; T218-M222 PolarHBondContact O-N 2.71Å; V219-M222 WeakPolarHBondContact O-CB 3.43Å; V219-M222 PolarHBondContact O-N 2.85Å; F220-M222 VanDerWaalsContact C-N 3.3Å; F220-M222 PolarHBondContact O-N 3.47Å; M222-P226 VanDerWaalsContact O-CD 3.3Å; M222-P226 WeakPolarHBondContact O-CD 3.31Å; M222-P226 WeakPolarHBondContact O-CG 3.46Å; M222-F281 HydrophobicContact CB-CE2 3.77Å; M222-F281 HydrophobicContact CB-CZ 3.8Å; M222-F281 HydrophobicContact CG-CZ 4.5Å; M222-F281 HydrophobicContact SD-CZ 3.93Å; M222-L346 HydrophobicContact CE-CD1 3.96Å; M222-L346 HydrophobicContact SD-CD1 4.07Å
223F91.7Very high96Very high100 Ų10059.8 Ų59.844%0.43930%0.3SS..Hα-helixtrans-84.7-45.4170.9-70.9-88000112.1V219 F220 L221 F281V219-F223 HydrophobicContact CG1-CD2 4.42Å; V219-F223 HydrophobicContact CG1-CE2 3.94Å; V219-F223 WeakPolarHBondContact O-CD2 3.4Å; V219-F223 PolarHBondContact O-N 3.38Å; F220-F223 WeakPolarHBondContact O-CB 3.5Å; F220-F223 PolarHBondContact O-N 3.24Å; L221-F223 PolarHBondContact O-N 3.05Å; F223-F281 AromaticContact CD1-CD2 3.69Å; F223-F281 HydrophobicContact CD1-CD2 3.69Å; F223-F281 HydrophobicContact CD1-CE2 4.27Å; F223-F281 HydrophobicContact CD2-CD2 4.01Å; F223-F281 AromaticContact CD2-CE2 3.92Å; F223-F281 HydrophobicContact CD2-CE2 3.92Å; F223-F281 HydrophobicContact CE1-CB 3.52Å; F223-F281 AromaticContact CE1-CD2 3.21Å; F223-F281 HydrophobicContact CE1-CD2 3.21Å; F223-F281 HydrophobicContact CE1-CE2 4.09Å; F223-F281 AromaticContact CE1-CG 3.62Å; F223-F281 HydrophobicContact CE1-CG 3.62Å; F223-F281 HydrophobicContact CE2-CD1 4.39Å; F223-F281 AromaticContact CE2-CD2 3.52Å; F223-F281 HydrophobicContact CE2-CD2 3.52Å; F223-F281 AromaticContact CE2-CE2 3.67Å; F223-F281 HydrophobicContact CE2-CE2 3.67Å; F223-F281 AromaticContact CE2-CG 3.9Å; F223-F281 HydrophobicContact CE2-CG 3.9Å; F223-F281 HydrophobicContact CE2-CZ 4.18Å; F223-F281 HydrophobicContact CG-CD2 4.08Å; F223-F281 HydrophobicContact CG-CE2 4.2Å; F223-F281 HydrophobicContact CZ-CB 3.41Å; F223-F281 VanDerWaalsContact CZ-CB 3.41Å; F223-F281 HydrophobicContact CZ-CD1 4.02Å; F223-F281 AromaticContact CZ-CD2 3.1Å; F223-F281 HydrophobicContact CZ-CD2 3.1Å; F223-F281 AromaticContact CZ-CE2 3.78Å; F223-F281 HydrophobicContact CZ-CE2 3.78Å; F223-F281 AromaticContact CZ-CG 3.23Å; F223-F281 HydrophobicContact CZ-CG 3.23Å; F223-F281 HydrophobicContact CZ-CZ 4.46Å
224V95.1Very high95.8Very high28 Ų2859.6 Ų59.617%0.1730%0.301CS..Hα-helixtrans-68.8-41-172.8171.60000111.9F220 L221 E227 F228 I229F220-V224 HydrophobicContact CD1-CG2 3.93Å; F220-V224 HydrophobicContact CD2-CG2 4.14Å; F220-V224 HydrophobicContact CE1-CG2 3.53Å; F220-V224 HydrophobicContact CE2-CG2 3.73Å; F220-V224 HydrophobicContact CG-CG2 4.23Å; F220-V224 HydrophobicContact CZ-CG2 3.41Å; F220-V224 VanDerWaalsContact CZ-CG2 3.41Å; F220-V224 WeakPolarHBondContact O-CG2 3.33Å; F220-V224 PolarHBondContact O-N 3.12Å; L221-V224 PolarHBondContact O-N 3.42Å; V224-E227 PolarHBondContact O-N 3.42Å; V224-F228 HydrophobicContact CB-CD2 4.46Å; V224-F228 HydrophobicContact CG1-CB 4.36Å; V224-F228 HydrophobicContact CG1-CD2 4.17Å; V224-F228 WeakPolarHBondContact O-CB 3.36Å; V224-F228 PolarHBondContact O-N 3.2Å; V224-I229 HydrophobicContact CG1-CD1 4.2Å; V224-I229 HydrophobicContact CG1-CG1 4.29Å; V224-I229 PolarHBondContact O-N 3.25Å
225Y95.9Very high95.6Very high138 Ų13861.4 Ų61.454%0.54131%0.305SS..Iπ-helixtrans-57.7-58-173.9-178-87.3000113.1L221 E227 I229 A230L221-Y225 WeakPolarHBondContact O-CB 3.44Å; L221-Y225 PolarHBondContact O-N 3.13Å; Y225-E227 PolarHBondContact O-N 3.07Å; Y225-I229 HydrophobicContact CD2-CB 3.99Å; Y225-I229 HydrophobicContact CD2-CD1 4.11Å; Y225-I229 HydrophobicContact CD2-CG2 3.97Å; Y225-I229 HydrophobicContact CE2-CB 4.44Å; Y225-I229 HydrophobicContact CE2-CG2 3.99Å; Y225-I229 HydrophobicContact CG-CB 4.43Å; Y225-I229 CarbonylContact O-C 3.55Å; Y225-I229 WeakPolarHBondContact O-CA 3.42Å; Y225-I229 WeakPolarHBondContact O-CB 3.35Å; Y225-I229 PolarHBondContact O-N 3.49Å; Y225-A230 HydrophobicContact CE1-CB 4.24Å; Y225-A230 PolarHBondContact O-N 2.89Å
226P94.5Very high95.4Very high18 Ų1862.6 Ų62.612%0.11731%0.307CS..Iπ-helixtrans-71.3-27.4-176.629.2-36.9000113.8M222 P231 Y279M222-P226 VanDerWaalsContact O-CD 3.3Å; M222-P226 WeakPolarHBondContact O-CD 3.31Å; M222-P226 WeakPolarHBondContact O-CG 3.46Å; P226-P231 WeakPolarHBondContact O-CD 3.37Å; P226-Y279 HydrophobicContact CB-CD1 4.36Å; P226-Y279 HydrophobicContact CB-CD2 3.66Å; P226-Y279 HydrophobicContact CB-CE1 4.14Å; P226-Y279 HydrophobicContact CB-CE2 3.45Å; P226-Y279 VanDerWaalsContact CB-CE2 3.45Å; P226-Y279 HydrophobicContact CB-CG 4.12Å; P226-Y279 HydrophobicContact CG-CD2 3.56Å; P226-Y279 HydrophobicContact CG-CE2 3.62Å; P226-Y279 HydrophobicContact CG-CG 4.3Å
227E91.9Very high95.2Very high68 Ų6860.2 Ų60.232%0.31829%0.29SS..Iπ-helixtrans-85.4-33.6-177.1-16771.1-160.700112.8V224 Y225 R286V224-E227 PolarHBondContact O-N 3.42Å; Y225-E227 PolarHBondContact O-N 3.07Å; E227-R286 IonicContact OE1-NH2 2.71Å; E227-R286 IonicContact OE2-CZ 3.33Å; E227-R286 VanDerWaalsContact OE2-CZ 3.23Å; E227-R286 IonicContact OE2-NE 2.81Å; E227-R286 PolarHBondContact OE2-NE 3.12Å; E227-R286 IonicContact OE2-NH2 3.74Å; E227-R286 PolarHBondContact OE2-NH2 3.25Å
228F94.9Very high95.1Very high136 Ų13663.6 Ų63.660%0.59631%0.312SS*.Iπ-helixtrans-122.2-30.9-171.9-58.2-76.9000114.3V224 L232V224-F228 HydrophobicContact CB-CD2 4.46Å; V224-F228 HydrophobicContact CG1-CB 4.36Å; V224-F228 HydrophobicContact CG1-CD2 4.17Å; V224-F228 WeakPolarHBondContact O-CB 3.36Å; V224-F228 PolarHBondContact O-N 3.2Å; F228-L232 VanDerWaalsContact O-CG 3.31Å; F228-L232 WeakPolarHBondContact O-CG 3.29Å
229I97.2Very high95Very high16 Ų1661.9 Ų61.98%0.08230%0.301CS..Iπ-helixtrans-91.8-52.4-175.1-57.8177.9000110.8I183 I187 V224 Y225 P231 L232 F233I183-I229 HydrophobicContact CD1-CG2 4.37Å; I183-I229 HydrophobicContact CG2-CD1 4.33Å; I183-I229 HydrophobicContact CG2-CG2 4.17Å; I187-I229 HydrophobicContact CD1-CD1 3.55Å; V224-I229 HydrophobicContact CG1-CD1 4.2Å; V224-I229 HydrophobicContact CG1-CG1 4.29Å; V224-I229 PolarHBondContact O-N 3.25Å; Y225-I229 HydrophobicContact CD2-CB 3.99Å; Y225-I229 HydrophobicContact CD2-CD1 4.11Å; Y225-I229 HydrophobicContact CD2-CG2 3.97Å; Y225-I229 HydrophobicContact CE2-CB 4.44Å; Y225-I229 HydrophobicContact CE2-CG2 3.99Å; Y225-I229 HydrophobicContact CG-CB 4.43Å; Y225-I229 CarbonylContact O-C 3.55Å; Y225-I229 WeakPolarHBondContact O-CA 3.42Å; Y225-I229 WeakPolarHBondContact O-CB 3.35Å; Y225-I229 PolarHBondContact O-N 3.49Å; I229-P231 VanDerWaalsContact C-N 3.33Å; I229-L232 VanDerWaalsContact O-CB 3.29Å; I229-L232 WeakPolarHBondContact O-CB 3.26Å; I229-L232 PolarHBondContact O-N 2.88Å; I229-F233 HydrophobicContact CG2-CD2 4.49Å; I229-F233 HydrophobicContact CG2-CE2 3.99Å; I229-F233 WeakPolarHBondContact O-CD2 3.38Å
230A96.2Very high95Very high6 Ų662.6 Ų62.65%0.0531%0.307CS..G310 helixtrans-55.7-40.4-179.100000113Y225 L232 F233 D234 Y236Y225-A230 HydrophobicContact CE1-CB 4.24Å; Y225-A230 PolarHBondContact O-N 2.89Å; A230-L232 PolarHBondContact O-N 3.12Å; A230-F233 PolarHBondContact O-N 3.41Å; A230-D234 PolarHBondContact O-N 3.24Å; A230-D234 VanDerWaalsContact O-N 3.09Å; A230-Y236 HydrophobicContact CB-CE2 4.1Å
231P96.5Very high94.8Very high59 Ų5963.1 Ų63.138%0.38332%0.315SS..G310 helixtrans-66.1-13.8175.9-24.537.6000115.5P226 I229 F233 D234 Y236P226-P231 WeakPolarHBondContact O-CD 3.37Å; I229-P231 VanDerWaalsContact C-N 3.33Å; P231-F233 VanDerWaalsContact C-N 3.27Å; P231-D234 CarbonylContact C-O 3.59Å; P231-D234 WeakPolarHBondContact CA-O 3.36Å; P231-Y236 HydrophobicContact CB-CD2 4.34Å; P231-Y236 HydrophobicContact CG-CD2 4.2Å
232L96.5Very high94.7Very high96 Ų9662.2 Ų62.250%0.50332%0.318SS..G310 helixtrans-75.6-20.4172.6-59.4173000112.1K179 I183 F228 I229 A230K179-L232 HydrophobicContact CD-CB 4.28Å; K179-L232 PolarHBondContact NZ-O 3.44Å; I183-L232 HydrophobicContact CD1-CD1 3.84Å; F228-L232 VanDerWaalsContact O-CG 3.31Å; F228-L232 WeakPolarHBondContact O-CG 3.29Å; I229-L232 VanDerWaalsContact O-CB 3.29Å; I229-L232 WeakPolarHBondContact O-CB 3.26Å; I229-L232 PolarHBondContact O-N 2.88Å; A230-L232 PolarHBondContact O-N 3.12Å
233F96.6Very high94.7Very high34 Ų3462.5 Ų62.515%0.14933%0.326CS..THydrogen-bonded Turntrans-99.7-42.3-180-68-86.8000111.6D176 K179 I183 I229 A230 P231 R270D176-F233 HydrophobicContact CB-CD1 4.19Å; D176-F233 HydrophobicContact CB-CE1 4.29Å; K179-F233 HydrophobicContact CB-CE1 4.21Å; K179-F233 HydrophobicContact CB-CZ 4.42Å; K179-F233 HydrophobicContact CD-CD1 4.13Å; K179-F233 HydrophobicContact CD-CE1 3.8Å; K179-F233 HydrophobicContact CD-CE2 4.31Å; K179-F233 HydrophobicContact CD-CZ 3.89Å; K179-F233 HydrophobicContact CG-CE1 4.22Å; K179-F233 HydrophobicContact CG-CZ 4.1Å; I183-F233 HydrophobicContact CD1-CE2 3.74Å; I183-F233 HydrophobicContact CD1-CZ 3.89Å; I229-F233 HydrophobicContact CG2-CD2 4.49Å; I229-F233 HydrophobicContact CG2-CE2 3.99Å; I229-F233 WeakPolarHBondContact O-CD2 3.38Å; A230-F233 PolarHBondContact O-N 3.41Å; P231-F233 VanDerWaalsContact C-N 3.27Å; F233-R270 PolarHBondContact O-NH2 3.31Å
234D94.3Very high95Very high34 Ų3458.6 Ų58.618%0.18231%0.31CS..SBendtrans-130.5153.6-171.9-61.3-53.5000112.6A230 P231 Y236 V265 R270A230-D234 PolarHBondContact O-N 3.24Å; A230-D234 VanDerWaalsContact O-N 3.09Å; P231-D234 CarbonylContact C-O 3.59Å; P231-D234 WeakPolarHBondContact CA-O 3.36Å; D234-Y236 HydrophobicContact CB-CE2 3.91Å; D234-Y236 VanDerWaalsContact O-CD2 3.32Å; D234-Y236 WeakPolarHBondContact O-CD2 3.37Å; D234-V265 HydrophobicContact CB-CG2 3.78Å; D234-R270 IonicContact OD1-CZ 3.87Å; D234-R270 IonicContact OD1-NE 3.48Å; D234-R270 PolarHBondContact OD1-NE 2.93Å; D234-R270 IonicContact OD1-NH2 3.1Å; D234-R270 PolarHBondContact OD1-NH2 2.88Å; D234-R270 IonicContact OD2-NE 3.44Å
235R93.3Very high95Very high66 Ų6659.1 Ų59.125%0.24931%0.31CS..  trans-82.2123.3176.3-176.2-174.5-175.31692109.1E237 V265 E266 N301R235-E237 HydrophobicContact CG-CG 4.1Å; R235-E237 IonicContact CZ-OE1 3.28Å; R235-E237 VanDerWaalsContact NE-CD 3.31Å; R235-E237 IonicContact NE-OE1 3.4Å; R235-E237 PolarHBondContact NE-OE1 2.98Å; R235-E237 IonicContact NE-OE2 3.65Å; R235-E237 IonicContact NH2-OE1 2.69Å; R235-E237 PolarHBondContact NH2-OE1 2.89Å; R235-E237 IonicContact NH2-OE2 3.63Å; R235-V265 WeakPolarHBondContact O-CA 3.39Å; R235-E266 HydrophobicContact CB-CB 4.03Å; R235-E266 PolarHBondContact O-N 3.09Å; R235-N301 PolarHBondContact NH1-O 2.75Å; R235-N301 PolarHBondContact NH2-O 3.17Å
236Y94.9Very high95.1Very high52 Ų5256.3 Ų56.320%0.20431%0.307CS..EExtended strand (participates in β ladder)trans-113126.1172.1-68.8-100.9000109A230 P231 D234 L263 V264 V265 Y277 V288A230-Y236 HydrophobicContact CB-CE2 4.1Å; P231-Y236 HydrophobicContact CB-CD2 4.34Å; P231-Y236 HydrophobicContact CG-CD2 4.2Å; D234-Y236 HydrophobicContact CB-CE2 3.91Å; D234-Y236 VanDerWaalsContact O-CD2 3.32Å; D234-Y236 WeakPolarHBondContact O-CD2 3.37Å; Y236-L263 HydrophobicContact CD1-CD1 4.46Å; Y236-V264 WeakPolarHBondContact CA-O 3.36Å; Y236-V265 HydrophobicContact CD1-CB 3.89Å; Y236-V265 HydrophobicContact CD1-CG2 4.09Å; Y236-V265 HydrophobicContact CD2-CG2 4.27Å; Y236-V265 HydrophobicContact CE1-CB 3.68Å; Y236-V265 HydrophobicContact CE1-CG2 3.68Å; Y236-V265 HydrophobicContact CE2-CG2 3.85Å; Y236-V265 HydrophobicContact CG-CB 4.49Å; Y236-V265 HydrophobicContact CG-CG2 4.36Å; Y236-Y277 PolarHBondContact OH-OH 3.09Å; Y236-V288 HydrophobicContact CD1-CG1 4.27Å; Y236-V288 HydrophobicContact CE1-CG1 3.9Å; Y236-V288 HydrophobicContact CE1-CG2 4.37Å
237E94.9Very high95.3Very high39 Ų3958.7 Ų58.718%0.18232%0.316CS..EExtended strand (participates in β ladder)trans-126.5151.6173.8-58.6-156.115200110.9R235 L239 L263 V264 F299R235-E237 HydrophobicContact CG-CG 4.1Å; R235-E237 IonicContact CZ-OE1 3.28Å; R235-E237 VanDerWaalsContact NE-CD 3.31Å; R235-E237 IonicContact NE-OE1 3.4Å; R235-E237 PolarHBondContact NE-OE1 2.98Å; R235-E237 IonicContact NE-OE2 3.65Å; R235-E237 IonicContact NH2-OE1 2.69Å; R235-E237 PolarHBondContact NH2-OE1 2.89Å; R235-E237 IonicContact NH2-OE2 3.63Å; E237-L239 PolarHBondContact O-N 3.32Å; E237-L263 CarbonylContact O-C 3.47Å; E237-L263 VanDerWaalsContact O-CA 3.23Å; E237-L263 WeakPolarHBondContact O-CA 3.2Å; E237-V264 PolarHBondContact N-O 3.39Å; E237-V264 PolarHBondContact O-N 2.94Å; E237-F299 HydrophobicContact CB-CD1 4.26Å; E237-F299 HydrophobicContact CB-CE1 4.11Å; E237-F299 HydrophobicContact CG-CD1 3.99Å; E237-F299 HydrophobicContact CG-CE1 4.05Å; E237-F299 WeakPolarHBondContact OE2-CD1 3.45Å
238P95.9Very high95.6Very high95 Ų9555.5 Ų55.562%0.61730%0.301SS*.EExtended strand (participates in β ladder)trans-54.7138.1166.8-22.734.3000110.8P240 L262P238-P240 WeakPolarHBondContact O-CD 3.45Å; P238-L262 WeakPolarHBondContact CA-O 3.35Å
239L95.7Very high95.7Very high6 Ų653.1 Ų53.13%0.03129%0.291CS..PPolyproline II helixtrans-58.2127.8170.7-176.569.9000108.2E237 L244 K245 I248 L262 V264 I294 F297E237-L239 PolarHBondContact O-N 3.32Å; L239-L244 HydrophobicContact CD2-CD2 4.41Å; L239-L244 HydrophobicContact CD2-CG 4.29Å; L239-K245 HydrophobicContact CD2-CB 3.82Å; L239-K245 HydrophobicContact CD2-CG 4.43Å; L239-K245 HydrophobicContact CG-CB 4.33Å; L239-I248 HydrophobicContact CD2-CD1 4.18Å; L239-L262 HydrophobicContact CB-CD2 4.17Å; L239-L262 HydrophobicContact CB-CG 3.87Å; L239-L262 HydrophobicContact CD2-CD2 3.43Å; L239-L262 VanDerWaalsContact CD2-CD2 3.43Å; L239-L262 HydrophobicContact CD2-CG 3.91Å; L239-L262 HydrophobicContact CG-CD2 4.44Å; L239-L262 PolarHBondContact N-O 2.89Å; L239-V264 HydrophobicContact CB-CG2 4Å; L239-V264 HydrophobicContact CD1-CG2 3.26Å; L239-V264 HydrophobicContact CG-CG2 4.22Å; L239-I294 HydrophobicContact CD1-CD1 3.88Å; L239-F297 HydrophobicContact CD1-CE2 4.14Å
240P92.8Very high95.8Very high60 Ų6056.6 Ų56.639%0.3931%0.313SS..PPolyproline II helixtrans-56.5152.8178.2-26.135.4000112.1P238 G242 F297P238-P240 WeakPolarHBondContact O-CD 3.45Å; P240-G242 PolarHBondContact O-N 2.97Å; P240-F297 HydrophobicContact CG-CE2 4.12Å; P240-F297 HydrophobicContact CG-CZ 4.25Å
241D93Very high95.8Very high139 Ų13956.7 Ų56.774%0.74331%0.313SS*.SBendtrans-63.5134.6175.2-64.5-41.1000110.6K245D241-K245 WeakPolarHBondContact OD1-CD 3.31Å; D241-K245 WeakPolarHBondContact OD1-CE 2.93Å; D241-K245 IonicContact OD1-NZ 3.23Å; D241-K245 PolarHBondContact OD1-NZ 2.76Å
242G93Very high95.9Very high28 Ų2853.9 Ų53.929%0.28930%0.295SS..SBendtrans171-179.9-177.600000113.1P240 L244 K245 T246P240-G242 PolarHBondContact O-N 2.97Å; G242-L244 VanDerWaalsContact C-N 3.33Å; G242-L244 PolarHBondContact O-N 2.81Å; G242-K245 PolarHBondContact O-N 3.28Å; G242-T246 PolarHBondContact O-N 3.48Å; G242-T246 VanDerWaalsContact O-N 3.16Å; G242-T246 PolarHBondContact O-OG1 2.64Å
243P94.8Very high95.9Very high94 Ų9452.5 Ų52.561%0.6130%0.297SS*.Hα-helixtrans-56.7-45.1-179.6-25.434.8000112.6K245 T246 K247P243-K245 PolarHBondContact O-N 3.45Å; P243-T246 PolarHBondContact O-N 2.84Å; P243-K247 WeakPolarHBondContact O-CB 3.37Å; P243-K247 VanDerWaalsContact O-CG 3.26Å; P243-K247 WeakPolarHBondContact O-CG 3.47Å; P243-K247 PolarHBondContact O-N 3.39Å
244L96.1Very high95.9Very high18 Ų1854.7 Ų54.79%0.09432%0.317CS..Hα-helixtrans-58-49.6179.8179.659.7000112.5L239 G242 T246 K247 I248 I294 D323 I326 L327L239-L244 HydrophobicContact CD2-CD2 4.41Å; L239-L244 HydrophobicContact CD2-CG 4.29Å; G242-L244 VanDerWaalsContact C-N 3.33Å; G242-L244 PolarHBondContact O-N 2.81Å; L244-T246 PolarHBondContact O-N 3.42Å; L244-K247 PolarHBondContact O-N 2.98Å; L244-I248 HydrophobicContact CD1-CD1 3.79Å; L244-I248 HydrophobicContact CD1-CG1 4.25Å; L244-I248 HydrophobicContact CG-CD1 3.87Å; L244-I248 WeakPolarHBondContact O-CG1 3.48Å; L244-I248 PolarHBondContact O-N 2.92Å; L244-I294 HydrophobicContact CD2-CD1 4.29Å; L244-I294 HydrophobicContact CD2-CG1 4.38Å; L244-I294 HydrophobicContact CD2-CG2 4.26Å; L244-D323 HydrophobicContact CD1-CB 3.82Å; L244-I326 HydrophobicContact CD1-CB 4.07Å; L244-I326 HydrophobicContact CD1-CD1 4.01Å; L244-I326 HydrophobicContact CD1-CG2 4.14Å; L244-I326 HydrophobicContact CD2-CD1 3.75Å; L244-L327 HydrophobicContact CD1-CD1 4.03Å
245K96.9Very high96Very high39 Ų3953.7 Ų53.717%0.1731%0.312CS..Hα-helixtrans-57.6-49.1177.8179.7178.1-177.1179.50111.3L239 D241 G242 P243 K247 I248 E249 L262L239-K245 HydrophobicContact CD2-CB 3.82Å; L239-K245 HydrophobicContact CD2-CG 4.43Å; L239-K245 HydrophobicContact CG-CB 4.33Å; D241-K245 WeakPolarHBondContact OD1-CD 3.31Å; D241-K245 WeakPolarHBondContact OD1-CE 2.93Å; D241-K245 IonicContact OD1-NZ 3.23Å; D241-K245 PolarHBondContact OD1-NZ 2.76Å; G242-K245 PolarHBondContact O-N 3.28Å; P243-K245 PolarHBondContact O-N 3.45Å; K245-K247 VanDerWaalsContact C-N 3.33Å; K245-K247 PolarHBondContact O-N 3.46Å; K245-I248 PolarHBondContact O-N 3.2Å; K245-E249 WeakPolarHBondContact CE-OE1 3.33Å; K245-E249 HydrophobicContact CG-CG 4.48Å; K245-E249 WeakPolarHBondContact O-CG 3.23Å; K245-E249 PolarHBondContact O-N 3.48Å; K245-L262 HydrophobicContact CG-CD2 4.17Å
246T98Very high96Very high80 Ų8058.8 Ų58.849%0.49134%0.335SS..Hα-helixtrans-60.3-44.1-179.6-52.30000111.4G242 P243 L244 E249 T250G242-T246 PolarHBondContact O-N 3.48Å; G242-T246 VanDerWaalsContact O-N 3.16Å; G242-T246 PolarHBondContact O-OG1 2.64Å; P243-T246 PolarHBondContact O-N 2.84Å; L244-T246 PolarHBondContact O-N 3.42Å; T246-E249 PolarHBondContact O-N 2.7Å; T246-T250 WeakPolarHBondContact O-CB 3.3Å; T246-T250 PolarHBondContact O-N 3.09Å; T246-T250 PolarHBondContact O-OG1 2.85Å
247K97.9Very high96.1Very high68 Ų6856.7 Ų56.730%0.29633%0.327SS..Hα-helixtrans-62.9-44177.4-73.5175.9-178.7175.30111.5P243 L244 K245 T250 L251 D323 E324 L327P243-K247 WeakPolarHBondContact O-CB 3.37Å; P243-K247 VanDerWaalsContact O-CG 3.26Å; P243-K247 WeakPolarHBondContact O-CG 3.47Å; P243-K247 PolarHBondContact O-N 3.39Å; L244-K247 PolarHBondContact O-N 2.98Å; K245-K247 VanDerWaalsContact C-N 3.33Å; K245-K247 PolarHBondContact O-N 3.46Å; K247-T250 PolarHBondContact O-N 3.4Å; K247-L251 WeakPolarHBondContact O-CB 3.28Å; K247-L251 PolarHBondContact O-N 2.72Å; K247-D323 HydrophobicContact CD-CB 3.94Å; K247-D323 IonicContact NZ-OD2 3.93Å; K247-D323 PolarHBondContact NZ-OD2 2.89Å; K247-E324 IonicContact NZ-OE1 2.74Å; K247-E324 PolarHBondContact NZ-OE1 3.42Å; K247-L327 HydrophobicContact CB-CD1 3.69Å; K247-L327 HydrophobicContact CB-CD2 3.78Å; K247-L327 HydrophobicContact CB-CG 4.28Å; K247-L327 HydrophobicContact CD-CD1 4.05Å
248I98.1Very high96.1Very high0 Ų056.4 Ų56.40%033%0.329CS..Hα-helixtrans-64.5-44.7177.5-68.1164.3000111.3L239 L244 K245 T250 L251 A252 L262 I287 I289 L327 I330L239-I248 HydrophobicContact CD2-CD1 4.18Å; L244-I248 HydrophobicContact CD1-CD1 3.79Å; L244-I248 HydrophobicContact CD1-CG1 4.25Å; L244-I248 HydrophobicContact CG-CD1 3.87Å; L244-I248 WeakPolarHBondContact O-CG1 3.48Å; L244-I248 PolarHBondContact O-N 2.92Å; K245-I248 PolarHBondContact O-N 3.2Å; I248-T250 VanDerWaalsContact C-N 3.31Å; I248-T250 PolarHBondContact O-N 3.36Å; I248-L251 PolarHBondContact O-N 2.91Å; I248-A252 WeakPolarHBondContact O-CB 3.44Å; I248-A252 PolarHBondContact O-N 2.76Å; I248-L262 HydrophobicContact CB-CD2 3.87Å; I248-L262 HydrophobicContact CD1-CD1 4.48Å; I248-L262 HydrophobicContact CD1-CD2 3.9Å; I248-L262 HydrophobicContact CG2-CD1 4.06Å; I248-L262 HydrophobicContact CG2-CD2 3.65Å; I248-I287 HydrophobicContact CG2-CD1 4.12Å; I248-I289 HydrophobicContact CD1-CD1 3.67Å; I248-L327 HydrophobicContact CG1-CD1 4.39Å; I248-L327 HydrophobicContact CG1-CG 4.37Å; I248-I330 HydrophobicContact CG2-CG2 4.35Å
249E98.1Very high96.2Very high87 Ų8753.9 Ų53.941%0.40731%0.31SS..Hα-helixtrans-62.1-40.5177.2-73.4175.9169.100111.4K245 T246 A252 A253 L259K245-E249 WeakPolarHBondContact CE-OE1 3.33Å; K245-E249 HydrophobicContact CG-CG 4.48Å; K245-E249 WeakPolarHBondContact O-CG 3.23Å; K245-E249 PolarHBondContact O-N 3.48Å; T246-E249 PolarHBondContact O-N 2.7Å; E249-A252 PolarHBondContact O-N 2.89Å; E249-A253 VanDerWaalsContact O-CB 3.29Å; E249-A253 WeakPolarHBondContact O-CB 3.45Å; E249-A253 PolarHBondContact O-N 3.2Å; E249-L259 HydrophobicContact CG-CD2 4.02Å
250T98Very high96.1Very high88 Ų8860.1 Ų60.154%0.5434%0.337SS..Hα-helixtrans-63.1-44.8175.1-57.60000111.6T246 K247 I248 A253 S254T246-T250 WeakPolarHBondContact O-CB 3.3Å; T246-T250 PolarHBondContact O-N 3.09Å; T246-T250 PolarHBondContact O-OG1 2.85Å; K247-T250 PolarHBondContact O-N 3.4Å; I248-T250 VanDerWaalsContact C-N 3.31Å; I248-T250 PolarHBondContact O-N 3.36Å; T250-A253 PolarHBondContact O-N 3.41Å; T250-S254 WeakPolarHBondContact O-CB 3.39Å; T250-S254 PolarHBondContact O-N 2.81Å
251L97.7Very high96.3Very high8 Ų861.9 Ų61.94%0.04234%0.339CS..Hα-helixtrans-62.5-44.7176.217661.8000111.7K247 I248 A253 S254 L327 I330 A331 L334 L423 Y425K247-L251 WeakPolarHBondContact O-CB 3.28Å; K247-L251 PolarHBondContact O-N 2.72Å; I248-L251 PolarHBondContact O-N 2.91Å; L251-A253 VanDerWaalsContact C-N 3.34Å; L251-A253 PolarHBondContact O-N 2.91Å; L251-S254 PolarHBondContact O-N 2.98Å; L251-S254 PolarHBondContact O-OG 3.34Å; L251-L327 HydrophobicContact CB-CD2 4.22Å; L251-L327 HydrophobicContact CD2-CB 4.36Å; L251-L327 HydrophobicContact CD2-CD2 4.13Å; L251-L327 HydrophobicContact CD2-CG 4.37Å; L251-I330 HydrophobicContact CD2-CG2 4.24Å; L251-A331 HydrophobicContact CD2-CB 4.06Å; L251-L334 HydrophobicContact CD2-CD1 4.3Å; L251-L334 HydrophobicContact CG-CD1 4.09Å; L251-L423 HydrophobicContact CD1-CD1 4.11Å; L251-Y425 HydrophobicContact CD1-CE2 3.88Å; L251-Y425 HydrophobicContact CD2-CE2 4.39Å
252A97.7Very high96.5Very high1 Ų155.7 Ų55.71%0.00831%0.305CS..Hα-helixtrans-62.1-43.6176.600000111.3I248 E249 I255 K256 F257 L259I248-A252 WeakPolarHBondContact O-CB 3.44Å; I248-A252 PolarHBondContact O-N 2.76Å; E249-A252 PolarHBondContact O-N 2.89Å; A252-I255 WeakPolarHBondContact O-CG1 3.34Å; A252-I255 PolarHBondContact O-N 3.32Å; A252-K256 PolarHBondContact O-N 3.32Å; A252-F257 HydrophobicContact CB-CB 4.18Å; A252-F257 HydrophobicContact CB-CD1 4.19Å; A252-F257 WeakPolarHBondContact O-CB 3.38Å; A252-F257 PolarHBondContact O-N 2.97Å; A252-L259 HydrophobicContact CB-CB 4.03Å; A252-L259 HydrophobicContact CB-CD2 3.92Å
253A97.1Very high96.7Very high67 Ų6755.2 Ų55.255%0.55430%0.296SS*.Hα-helixtrans-63.6-41.3177.800000112.3E249 T250 L251 I255 K256E249-A253 VanDerWaalsContact O-CB 3.29Å; E249-A253 WeakPolarHBondContact O-CB 3.45Å; E249-A253 PolarHBondContact O-N 3.2Å; T250-A253 PolarHBondContact O-N 3.41Å; L251-A253 VanDerWaalsContact C-N 3.34Å; L251-A253 PolarHBondContact O-N 2.91Å; A253-I255 PolarHBondContact O-N 3.09Å; A253-K256 PolarHBondContact O-N 3.13Å
254S96.6Very high96.8Very high80 Ų8050.7 Ų50.756%0.55927%0.267SS*.Hα-helixtrans-60.4-32-177.476.80000112.8T250 L251T250-S254 WeakPolarHBondContact O-CB 3.39Å; T250-S254 PolarHBondContact O-N 2.81Å; L251-S254 PolarHBondContact O-N 2.98Å; L251-S254 PolarHBondContact O-OG 3.34Å
255I94.8Very high96.8Very high13 Ų1350 Ų507%0.06726%0.263CS..THydrogen-bonded Turntrans-98.13.4177.568167.1000113.8A252 A253 F257 L334 W337 K338 F419 L423A252-I255 WeakPolarHBondContact O-CG1 3.34Å; A252-I255 PolarHBondContact O-N 3.32Å; A253-I255 PolarHBondContact O-N 3.09Å; I255-F257 VanDerWaalsContact C-N 3.31Å; I255-F257 HydrophobicContact CD1-CB 4.1Å; I255-F257 HydrophobicContact CG1-CB 3.97Å; I255-L334 HydrophobicContact CD1-CB 3.54Å; I255-L334 HydrophobicContact CD1-CD1 3.72Å; I255-L334 HydrophobicContact CD1-CD2 4.28Å; I255-L334 HydrophobicContact CD1-CG 4.04Å; I255-W337 HydrophobicContact CD1-CE3 4.42Å; I255-W337 HydrophobicContact CD1-CZ3 4.42Å; I255-K338 PolarHBondContact O-NZ 3.37Å; I255-F419 HydrophobicContact CG2-CZ 4.08Å; I255-L423 HydrophobicContact CG2-CD1 4.2Å; I255-L423 HydrophobicContact CG2-CD2 4.36Å
256K94.8Very high96.7Very high173 Ų17348.8 Ų48.875%0.75226%0.258SS*.THydrogen-bonded Turntrans62.530.4-175.3-53.3179.3178.7-179.70114A252 A253 P258 W337A252-K256 PolarHBondContact O-N 3.32Å; A253-K256 PolarHBondContact O-N 3.13Å; K256-P258 WeakPolarHBondContact O-CD 3.25Å; K256-W337 VanDerWaalsContact O-CH2 3.28Å; K256-W337 WeakPolarHBondContact O-CH2 3.43Å
257F96.4Very high96.4Very high7 Ų745.2 Ų45.23%0.03124%0.238CC..  trans-68.3123.5171.4-177.8-93.7000109A252 I255 L259 F278 K285 I287 L334 W337A252-F257 HydrophobicContact CB-CB 4.18Å; A252-F257 HydrophobicContact CB-CD1 4.19Å; A252-F257 WeakPolarHBondContact O-CB 3.38Å; A252-F257 PolarHBondContact O-N 2.97Å; I255-F257 VanDerWaalsContact C-N 3.31Å; I255-F257 HydrophobicContact CD1-CB 4.1Å; I255-F257 HydrophobicContact CG1-CB 3.97Å; F257-L259 HydrophobicContact CD1-CB 3.87Å; F257-L259 HydrophobicContact CD1-CD1 4.49Å; F257-L259 HydrophobicContact CE1-CB 4.2Å; F257-L259 HydrophobicContact CE1-CD1 4.05Å; F257-L259 PolarHBondContact O-N 3.05Å; F257-F278 AromaticContact CE2-CD2 3.97Å; F257-F278 HydrophobicContact CE2-CD2 3.97Å; F257-F278 HydrophobicContact CE2-CE2 4.4Å; F257-F278 HydrophobicContact CE2-CG 4.36Å; F257-F278 HydrophobicContact CZ-CB 4.16Å; F257-F278 AromaticContact CZ-CD2 3.99Å; F257-F278 HydrophobicContact CZ-CD2 3.99Å; F257-F278 HydrophobicContact CZ-CG 4.23Å; F257-K285 HydrophobicContact CD1-CB 4.32Å; F257-K285 HydrophobicContact CE1-CB 3.47Å; F257-K285 VanDerWaalsContact CE1-CB 3.47Å; F257-K285 HydrophobicContact CE1-CG 4.31Å; F257-K285 HydrophobicContact CE2-CB 4.07Å; F257-K285 HydrophobicContact CE2-CG 4.1Å; F257-K285 HydrophobicContact CZ-CB 3.34Å; F257-K285 HydrophobicContact CZ-CG 3.88Å; F257-I287 HydrophobicContact CE1-CD1 4.17Å; F257-I287 HydrophobicContact CE1-CG1 4.04Å; F257-I287 HydrophobicContact CZ-CG1 4.38Å; F257-L334 HydrophobicContact CB-CD2 4.05Å; F257-L334 HydrophobicContact CD1-CD2 3.84Å; F257-L334 HydrophobicContact CD2-CD2 3.33Å; F257-L334 HydrophobicContact CE1-CD2 4.02Å; F257-L334 HydrophobicContact CE2-CD2 3.55Å; F257-L334 HydrophobicContact CG-CD2 3.48Å; F257-L334 VanDerWaalsContact CG-CD2 3.48Å; F257-L334 HydrophobicContact CZ-CD2 3.87Å; F257-W337 HydrophobicContact CB-CE3 4.17Å; F257-W337 HydrophobicContact CB-CH2 4.31Å; F257-W337 HydrophobicContact CB-CZ3 3.92Å; F257-W337 HydrophobicContact CD2-CB 4.13Å; F257-W337 AromaticContact CD2-CD2 3.38Å; F257-W337 HydrophobicContact CD2-CD2 3.38Å; F257-W337 AromaticContact CD2-CE2 3.84Å; F257-W337 AromaticContact CD2-CE3 3.52Å; F257-W337 HydrophobicContact CD2-CE3 3.52Å; F257-W337 AromaticContact CD2-CG 3.64Å; F257-W337 HydrophobicContact CD2-CG 3.64Å; F257-W337 HydrophobicContact CD2-CH2 4.47Å; F257-W337 HydrophobicContact CD2-CZ2 4.38Å; F257-W337 HydrophobicContact CD2-CZ3 4.06Å; F257-W337 HydrophobicContact CE2-CB 3.96Å; F257-W337 AromaticContact CE2-CD1 4Å; F257-W337 AromaticContact CE2-CD2 3.92Å; F257-W337 HydrophobicContact CE2-CD2 3.92Å; F257-W337 HydrophobicContact CE2-CE3 4.44Å; F257-W337 AromaticContact CE2-CG 3.65Å; F257-W337 HydrophobicContact CE2-CG 3.65Å; F257-W337 HydrophobicContact CG-CD2 4.46Å; F257-W337 HydrophobicContact CG-CE3 4.33Å; F257-W337 HydrophobicContact CG-CZ3 4.48Å
258P95.3Very high96.1Very high34 Ų3443.2 Ų43.222%0.22123%0.232CC..  trans-79.868.7-175.332.2-34.1000110.9K256 K260 G282 N283 K285 W337K256-P258 WeakPolarHBondContact O-CD 3.25Å; P258-K260 PolarHBondContact O-N 2.9Å; P258-G282 WeakPolarHBondContact CG-O 3.41Å; P258-N283 HydrophobicContact CB-CB 4.41Å; P258-K285 HydrophobicContact CG-CB 4.49Å; P258-K285 HydrophobicContact CG-CG 3.77Å; P258-K285 WeakPolarHBondContact O-CB 3.19Å; P258-K285 PolarHBondContact O-N 2.8Å; P258-W337 HydrophobicContact CG-CZ2 4.44Å
259L96.8Very high95.7Very high42 Ų4248.8 Ų48.822%0.2225%0.253CS..EExtended strand (participates in β ladder)trans-66.7119.7179-175.959.5000110.1E249 A252 F257 K261 I287E249-L259 HydrophobicContact CG-CD2 4.02Å; A252-L259 HydrophobicContact CB-CB 4.03Å; A252-L259 HydrophobicContact CB-CD2 3.92Å; F257-L259 HydrophobicContact CD1-CB 3.87Å; F257-L259 HydrophobicContact CD1-CD1 4.49Å; F257-L259 HydrophobicContact CE1-CB 4.2Å; F257-L259 HydrophobicContact CE1-CD1 4.05Å; F257-L259 PolarHBondContact O-N 3.05Å; L259-K261 VanDerWaalsContact CD1-O 3.32Å; L259-K261 WeakPolarHBondContact CD1-O 3.39Å; L259-I287 HydrophobicContact CD1-CB 4.18Å; L259-I287 HydrophobicContact CD1-CD1 3.78Å; L259-I287 HydrophobicContact CD1-CG1 3.8Å; L259-I287 HydrophobicContact CD2-CD1 4.32Å
260K95.5Very high95.4Very high136 Ų13647 Ų4759%0.59124%0.242SC*.EExtended strand (participates in β ladder)trans-103.5-39.6177.1-172.260.5175.1-1790113P258 K285P258-K260 PolarHBondContact O-N 2.9Å; K260-K285 WeakPolarHBondContact CB-O 3.25Å; K260-K285 PolarHBondContact N-O 2.81Å
261K95.5Very high95.2Very high98 Ų9844.1 Ų44.143%0.42623%0.226SC..EExtended strand (participates in β ladder)trans-142.4140.8175.9-57.3-176.4178.9177.90110.2L259 L263 R286 I287L259-K261 VanDerWaalsContact CD1-O 3.32Å; L259-K261 WeakPolarHBondContact CD1-O 3.39Å; K261-L263 HydrophobicContact CB-CD2 4.27Å; K261-L263 HydrophobicContact CB-CG 4.29Å; K261-R286 HydrophobicContact CB-CG 4.01Å; K261-R286 VanDerWaalsContact O-CA 3.22Å; K261-R286 WeakPolarHBondContact O-CA 3.29Å; K261-I287 PolarHBondContact O-N 3.23Å; K261-I287 VanDerWaalsContact O-N 3.13Å
262L97.4Very high94.8Very high9 Ų943.8 Ų43.85%0.04722%0.224CC..EExtended strand (participates in β ladder)trans-112.3118.8168.6178.858.5000107.9P238 L239 K245 I248 I287 I289P238-L262 WeakPolarHBondContact CA-O 3.35Å; L239-L262 HydrophobicContact CB-CD2 4.17Å; L239-L262 HydrophobicContact CB-CG 3.87Å; L239-L262 HydrophobicContact CD2-CD2 3.43Å; L239-L262 VanDerWaalsContact CD2-CD2 3.43Å; L239-L262 HydrophobicContact CD2-CG 3.91Å; L239-L262 HydrophobicContact CG-CD2 4.44Å; L239-L262 PolarHBondContact N-O 2.89Å; K245-L262 HydrophobicContact CG-CD2 4.17Å; I248-L262 HydrophobicContact CB-CD2 3.87Å; I248-L262 HydrophobicContact CD1-CD1 4.48Å; I248-L262 HydrophobicContact CD1-CD2 3.9Å; I248-L262 HydrophobicContact CG2-CD1 4.06Å; I248-L262 HydrophobicContact CG2-CD2 3.65Å; L262-I287 HydrophobicContact CD1-CB 3.61Å; L262-I287 HydrophobicContact CD1-CG2 3.52Å; L262-I289 HydrophobicContact CD1-CD1 4.14Å; L262-I289 HydrophobicContact CD1-CG1 4.47Å
263L97.3Very high94.6Very high17 Ų1746 Ų469%0.08923%0.234CC..EExtended strand (participates in β ladder)trans-120.8151.4-171-57.7174.3000110.8Y236 E237 K261 I287 V288 I289Y236-L263 HydrophobicContact CD1-CD1 4.46Å; E237-L263 CarbonylContact O-C 3.47Å; E237-L263 VanDerWaalsContact O-CA 3.23Å; E237-L263 WeakPolarHBondContact O-CA 3.2Å; K261-L263 HydrophobicContact CB-CD2 4.27Å; K261-L263 HydrophobicContact CB-CG 4.29Å; L263-I287 PolarHBondContact N-O 3.44Å; L263-V288 HydrophobicContact CB-CG2 4.38Å; L263-V288 WeakPolarHBondContact O-CA 3.11Å; L263-I289 PolarHBondContact O-N 3.3Å
264V97.3Very high94.4Very high0 Ų042.9 Ų42.90%021%0.209CC..EExtended strand (participates in β ladder)trans-112.3132.5165.4-173.60000108.9Y236 E237 L239 I289 D291 I294 F297 F299Y236-V264 WeakPolarHBondContact CA-O 3.36Å; E237-V264 PolarHBondContact N-O 3.39Å; E237-V264 PolarHBondContact O-N 2.94Å; L239-V264 HydrophobicContact CB-CG2 4Å; L239-V264 HydrophobicContact CD1-CG2 3.26Å; L239-V264 HydrophobicContact CG-CG2 4.22Å; V264-I289 CarbonylContact C-O 3.57Å; V264-I289 VanDerWaalsContact CA-O 3.23Å; V264-I289 WeakPolarHBondContact CA-O 3.33Å; V264-I289 WeakPolarHBondContact CG1-O 3.42Å; V264-D291 HydrophobicContact CG1-CB 3.9Å; V264-I294 HydrophobicContact CG1-CD1 4.39Å; V264-I294 HydrophobicContact CG2-CD1 3.97Å; V264-F297 HydrophobicContact CB-CE1 4.28Å; V264-F297 HydrophobicContact CB-CZ 4.09Å; V264-F297 HydrophobicContact CG1-CD1 4.17Å; V264-F297 HydrophobicContact CG1-CE1 3.71Å; V264-F297 HydrophobicContact CG1-CZ 3.96Å; V264-F297 HydrophobicContact CG2-CE2 4.23Å; V264-F297 HydrophobicContact CG2-CZ 3.97Å; V264-F299 HydrophobicContact CB-CE1 4.32Å; V264-F299 HydrophobicContact CB-CZ 4.34Å; V264-F299 HydrophobicContact CG1-CE1 4.25Å; V264-F299 HydrophobicContact CG1-CZ 3.81Å
265V96.2Very high94.3Very high2 Ų242.9 Ų42.91%0.01220%0.202CC..EExtended strand (participates in β ladder)trans-102.6137.7173.964.10000110.5D234 R235 Y236 G267 V288 I289 F290 D291D234-V265 HydrophobicContact CB-CG2 3.78Å; R235-V265 WeakPolarHBondContact O-CA 3.39Å; Y236-V265 HydrophobicContact CD1-CB 3.89Å; Y236-V265 HydrophobicContact CD1-CG2 4.09Å; Y236-V265 HydrophobicContact CD2-CG2 4.27Å; Y236-V265 HydrophobicContact CE1-CB 3.68Å; Y236-V265 HydrophobicContact CE1-CG2 3.68Å; Y236-V265 HydrophobicContact CE2-CG2 3.85Å; Y236-V265 HydrophobicContact CG-CB 4.49Å; Y236-V265 HydrophobicContact CG-CG2 4.36Å; V265-G267 PolarHBondContact O-N 3.4Å; V265-V288 HydrophobicContact CB-CG1 3.9Å; V265-V288 HydrophobicContact CG1-CG1 3.66Å; V265-I289 PolarHBondContact N-O 3.03Å; V265-F290 HydrophobicContact CG1-CB 4.35Å; V265-F290 HydrophobicContact CG1-CD1 4.35Å; V265-F290 HydrophobicContact CG1-CD2 3.49Å; V265-F290 VanDerWaalsContact CG1-CD2 3.49Å; V265-F290 HydrophobicContact CG1-CE2 3.78Å; V265-F290 HydrophobicContact CG1-CG 3.8Å; V265-F290 HydrophobicContact CG1-CZ 4.3Å; V265-D291 PolarHBondContact O-N 2.91Å
266E94.5Very high94.5Very high14 Ų1442.3 Ų42.37%0.06520%0.199CC..  trans-76.468.9176.3-168-176.8-159.100111.3R235 S268 R269 F299 K302R235-E266 HydrophobicContact CB-CB 4.03Å; R235-E266 PolarHBondContact O-N 3.09Å; E266-S268 VanDerWaalsContact C-N 3.3Å; E266-R269 HydrophobicContact CG-CB 4.13Å; E266-F299 HydrophobicContact CB-CD2 4.47Å; E266-F299 HydrophobicContact CB-CE2 3.65Å; E266-F299 HydrophobicContact CB-CZ 3.79Å; E266-F299 HydrophobicContact CG-CD2 4.27Å; E266-F299 HydrophobicContact CG-CE2 3.77Å; E266-F299 HydrophobicContact CG-CZ 4.42Å; E266-K302 WeakPolarHBondContact OE1-CE 3.4Å; E266-K302 IonicContact OE1-NZ 3.78Å; E266-K302 PolarHBondContact OE1-NZ 2.94Å
267G91.1Very high94.6Very high6 Ų637.1 Ų37.16%0.06218%0.176CC..G310 helixtrans-67-32.4176.300000112.6V265 R269 R270 S271 D291V265-G267 PolarHBondContact O-N 3.4Å; G267-R269 PolarHBondContact O-N 3.43Å; G267-R270 PolarHBondContact O-N 2.9Å; G267-S271 CarbonylContact C-O 3.56Å; G267-S271 PolarHBondContact O-N 3.46Å; G267-S271 VanDerWaalsContact O-O 3.12Å; G267-D291 PolarHBondContact N-OD1 2.88Å
268S91.5Very high94.6Very high25 Ų2538 Ų3818%0.17518%0.18CC..G310 helixtrans-55.8-24.7-178.964.60000114.6K167 E266 R270 S271 D291K167-S268 WeakPolarHBondContact CB-O 3.24Å; E266-S268 VanDerWaalsContact C-N 3.3Å; S268-R270 PolarHBondContact O-N 2.94Å; S268-S271 WeakPolarHBondContact CA-O 3.34Å; S268-D291 WeakPolarHBondContact CB-OD2 3.26Å; S268-D291 PolarHBondContact N-OD1 2.97Å; S268-D291 PolarHBondContact OG-OD2 3.46Å
269R90.3Very high94.6Very high118 Ų11838 Ų3845%0.44518%0.176SC..G310 helixtrans-65.2-28.9176.3-174.4176.2176.3177.63112.7F172 E266 G267F172-R269 VanDerWaalsContact CD2-NH2 3.34Å; F172-R269 HydrophobicContact CZ-CG 4.25Å; E266-R269 HydrophobicContact CG-CB 4.13Å; G267-R269 PolarHBondContact O-N 3.43Å
270R92.9Very high94.4Very high48 Ų4836.8 Ų36.818%0.18117%0.172CC..THydrogen-bonded Turntrans-103.7-54.3-177.6-64-175.6-177.5-72.3-12111.6K167 F172 D176 F233 D234 G267 S268K167-R270 PolarHBondContact N-O 3.5Å; F172-R270 HydrophobicContact CE1-CG 4.02Å; F172-R270 HydrophobicContact CZ-CG 4.46Å; F172-R270 VanDerWaalsContact CZ-NH2 3.3Å; D176-R270 IonicContact OD1-NH2 3.07Å; D176-R270 IonicContact OD2-CZ 3.37Å; D176-R270 IonicContact OD2-NH1 3.9Å; D176-R270 PolarHBondContact OD2-NH1 3.19Å; D176-R270 IonicContact OD2-NH2 2.76Å; D176-R270 PolarHBondContact OD2-NH2 2.87Å; F233-R270 PolarHBondContact O-NH2 3.31Å; D234-R270 IonicContact OD1-CZ 3.87Å; D234-R270 IonicContact OD1-NE 3.48Å; D234-R270 PolarHBondContact OD1-NE 2.93Å; D234-R270 IonicContact OD1-NH2 3.1Å; D234-R270 PolarHBondContact OD1-NH2 2.88Å; D234-R270 IonicContact OD2-NE 3.44Å; G267-R270 PolarHBondContact O-N 2.9Å; S268-R270 PolarHBondContact O-N 2.94Å
271S92.7Very high93.9Very high29 Ų2933.1 Ų33.120%0.20316%0.157CC..BIsolated β-bridgetrans-140.1157.7-169.876.30000111.8F165 G267 S268 H273F165-S271 VanDerWaalsContact O-CA 3.27Å; F165-S271 WeakPolarHBondContact O-CA 3.43Å; G267-S271 CarbonylContact C-O 3.56Å; G267-S271 PolarHBondContact O-N 3.46Å; G267-S271 VanDerWaalsContact O-O 3.12Å; S268-S271 WeakPolarHBondContact CA-O 3.34Å; S271-H273 VanDerWaalsContact C-N 3.26Å; S271-H273 PolarHBondContact OG-N 3.12Å
272A89.1Confident93.5Very high0 Ų031 Ų310%016%0.163CC..SBendtrans-86.46.7171.500000113.4F165 R318F165-A272 HydrophobicContact CD1-CB 3.85Å; F165-A272 HydrophobicContact CE1-CB 4.49Å; F165-A272 PolarHBondContact O-N 3.37Å; A272-R318 VanDerWaalsContact CB-NH1 3.26Å; A272-R318 VanDerWaalsContact CB-NH2 3.25Å; A272-R318 VanDerWaalsContact O-CD 3.28Å; A272-R318 WeakPolarHBondContact O-CD 3.45Å; A272-R318 PolarHBondContact O-NE 3.39Å
273H93Very high93Very high48 Ų4836.9 Ų36.922%0.22219%0.194CC..  trans-75.2143.2-179.5-69.4-56.6000111.8E160 F165 S271 T292 N440E160-H273 IonicContact OE2-NE2 3.31Å; F165-H273 AromaticContact CD1-CE1 3.58Å; F165-H273 AromaticContact CD1-ND1 3.97Å; F165-H273 AromaticContact CD1-NE2 3.9Å; F165-H273 AromaticContact CD2-CE1 3.93Å; F165-H273 AromaticContact CE1-CE1 3.56Å; F165-H273 AromaticContact CE1-ND1 3.83Å; F165-H273 AromaticContact CE2-CE1 3.84Å; F165-H273 AromaticContact CG-CE1 3.79Å; F165-H273 AromaticContact CG-NE2 3.8Å; F165-H273 AromaticContact CZ-CE1 3.65Å; S271-H273 VanDerWaalsContact C-N 3.26Å; S271-H273 PolarHBondContact OG-N 3.12Å; H273-T292 WeakPolarHBondContact O-CB 3.43Å; H273-T292 PolarHBondContact O-OG1 3.11Å; H273-N440 VanDerWaalsContact CA-OD1 3.24Å; H273-N440 WeakPolarHBondContact CA-OD1 3.45Å; H273-N440 VanDerWaalsContact CB-OD1 3.29Å; H273-N440 WeakPolarHBondContact CB-OD1 3.34Å; H273-N440 PolarHBondContact ND1-OD1 3.31Å
274S93.9Very high92.7Very high2 Ų240.3 Ų40.31%0.01421%0.213CC..  trans-105.8136.6-179.4-61.50000110.3T292 L436 D439 N440S274-T292 WeakPolarHBondContact CA-OG1 3.3Å; S274-T292 PolarHBondContact OG-O 3.24Å; S274-L436 WeakPolarHBondContact O-CD2 3.39Å; S274-D439 PolarHBondContact OG-OD2 3.03Å; S274-N440 PolarHBondContact N-OD1 3.45Å; S274-N440 VanDerWaalsContact N-OD1 3.13Å; S274-N440 PolarHBondContact O-ND2 3.13Å
275N94.9Very high92.5Very high79 Ų7941.4 Ų41.442%0.42222%0.218SC..  trans-158.9163.1179-16110.5000112.1F290N275-F290 HydrophobicContact CB-CD1 4.48Å; N275-F290 HydrophobicContact CB-CD2 3.86Å; N275-F290 HydrophobicContact CB-CE2 3.91Å; N275-F290 HydrophobicContact CB-CG 4.17Å; N275-F290 HydrophobicContact CB-CZ 4.29Å; N275-F290 VanDerWaalsContact O-CB 3.31Å; N275-F290 WeakPolarHBondContact O-CB 3.41Å; N275-F290 VanDerWaalsContact O-CD2 3.31Å; N275-F290 WeakPolarHBondContact O-CD2 3.28Å; N275-F290 PolarHBondContact O-N 2.85Å
276A97.4Very high92.6Very high1 Ų143 Ų431%0.00822%0.223CC..EExtended strand (participates in β ladder)trans-146.6151.4166.900000109.2V288 I289 L293 V329 I330A276-V288 WeakPolarHBondContact CA-O 3.28Å; A276-I289 HydrophobicContact CB-CG1 4.45Å; A276-L293 HydrophobicContact CB-CD2 3.83Å; A276-V329 HydrophobicContact CB-CG1 4.11Å; A276-I330 HydrophobicContact CB-CD1 3.98Å
277Y97Very high92.8Very high64 Ų6442.5 Ų42.525%0.25122%0.221SC..EExtended strand (participates in β ladder)trans-156.4169178.664.9-85.5000110.8Y236 Y279 V288 F290Y236-Y277 PolarHBondContact OH-OH 3.09Å; Y277-Y279 HydrophobicContact CD2-CD1 4.27Å; Y277-Y279 AromaticContact CE2-CD1 3.76Å; Y277-Y279 HydrophobicContact CE2-CD1 3.76Å; Y277-Y279 HydrophobicContact CE2-CE1 4.31Å; Y277-V288 HydrophobicContact CD1-CB 4.15Å; Y277-V288 HydrophobicContact CD1-CG1 4.45Å; Y277-V288 HydrophobicContact CD2-CB 4.41Å; Y277-V288 HydrophobicContact CE1-CB 3.7Å; Y277-V288 HydrophobicContact CE1-CG1 3.67Å; Y277-V288 HydrophobicContact CE1-CG2 4.39Å; Y277-V288 HydrophobicContact CE2-CB 4Å; Y277-V288 HydrophobicContact CE2-CG2 3.91Å; Y277-V288 HydrophobicContact CG-CB 4.48Å; Y277-V288 PolarHBondContact N-O 2.94Å; Y277-V288 PolarHBondContact O-N 3.49Å; Y277-F290 HydrophobicContact CD1-CE2 4.15Å; Y277-F290 AromaticContact CE1-CE2 3.82Å; Y277-F290 HydrophobicContact CE1-CE2 3.82Å
278F96.6Very high93.1Very high27 Ų2742.2 Ų42.212%0.11822%0.218CC..EExtended strand (participates in β ladder)trans-126.5156.617176.1-84.6000111.4F257 R286 I287 E333 H336 W337 T342F257-F278 AromaticContact CE2-CD2 3.97Å; F257-F278 HydrophobicContact CE2-CD2 3.97Å; F257-F278 HydrophobicContact CE2-CE2 4.4Å; F257-F278 HydrophobicContact CE2-CG 4.36Å; F257-F278 HydrophobicContact CZ-CB 4.16Å; F257-F278 AromaticContact CZ-CD2 3.99Å; F257-F278 HydrophobicContact CZ-CD2 3.99Å; F257-F278 HydrophobicContact CZ-CG 4.23Å; F278-R286 CarbonylContact C-O 3.58Å; F278-R286 WeakPolarHBondContact CA-O 3.24Å; F278-R286 VanDerWaalsContact CB-O 3.3Å; F278-R286 WeakPolarHBondContact CB-O 3.34Å; F278-I287 HydrophobicContact CB-CG1 4.22Å; F278-E333 HydrophobicContact CD1-CB 4.14Å; F278-E333 WeakPolarHBondContact CE1-O 3.47Å; F278-H336 HydrophobicContact CE1-CB 4.16Å; F278-H336 HydrophobicContact CZ-CB 4.48Å; F278-W337 HydrophobicContact CE1-CB 4.25Å; F278-W337 HydrophobicContact CE2-CB 3.84Å; F278-W337 HydrophobicContact CE2-CG 4.36Å; F278-W337 HydrophobicContact CZ-CB 3.6Å; F278-T342 HydrophobicContact CE2-CG2 4.33Å; F278-T342 HydrophobicContact CZ-CG2 3.75Å
279Y95Very high93.4Very high34 Ų3441 Ų4113%0.13321%0.21CC..EExtended strand (participates in β ladder)trans-150.1179174.970.6-90.4000112.2P226 Y277 K285 R286 V288P226-Y279 HydrophobicContact CB-CD1 4.36Å; P226-Y279 HydrophobicContact CB-CD2 3.66Å; P226-Y279 HydrophobicContact CB-CE1 4.14Å; P226-Y279 HydrophobicContact CB-CE2 3.45Å; P226-Y279 VanDerWaalsContact CB-CE2 3.45Å; P226-Y279 HydrophobicContact CB-CG 4.12Å; P226-Y279 HydrophobicContact CG-CD2 3.56Å; P226-Y279 HydrophobicContact CG-CE2 3.62Å; P226-Y279 HydrophobicContact CG-CG 4.3Å; Y277-Y279 HydrophobicContact CD2-CD1 4.27Å; Y277-Y279 AromaticContact CE2-CD1 3.76Å; Y277-Y279 HydrophobicContact CE2-CD1 3.76Å; Y277-Y279 HydrophobicContact CE2-CE1 4.31Å; Y279-K285 CarbonylContact O-C 3.6Å; Y279-K285 WeakPolarHBondContact O-CA 3.34Å; Y279-R286 HydrophobicContact CD1-CB 4.38Å; Y279-R286 HydrophobicContact CE1-CB 3.99Å; Y279-R286 HydrophobicContact CE2-CB 4.29Å; Y279-R286 HydrophobicContact CE2-CG 4.38Å; Y279-R286 PolarHBondContact N-O 3.43Å; Y279-R286 PolarHBondContact O-N 3.44Å; Y279-R286 WeakPolarHBondContact OH-CD 3.33Å; Y279-V288 HydrophobicContact CD1-CG2 4.03Å; Y279-V288 HydrophobicContact CE1-CG2 3.51Å
280G92.4Very high93.7Very high15 Ų1537.4 Ų37.416%0.15520%0.197CC..  trans108.4177.2175.600000112.8K285G280-K285 WeakPolarHBondContact O-CD 3.49Å; G280-K285 PolarHBondContact O-NZ 2.93Å
281F86.9Confident93.8Very high60 Ų6035.7 Ų35.726%0.26319%0.192SC..SBendtrans-132152.9-175.8-68.1-96.7000111.6M222 F223 N283 N284M222-F281 HydrophobicContact CB-CE2 3.77Å; M222-F281 HydrophobicContact CB-CZ 3.8Å; M222-F281 HydrophobicContact CG-CZ 4.5Å; M222-F281 HydrophobicContact SD-CZ 3.93Å; F223-F281 AromaticContact CD1-CD2 3.69Å; F223-F281 HydrophobicContact CD1-CD2 3.69Å; F223-F281 HydrophobicContact CD1-CE2 4.27Å; F223-F281 HydrophobicContact CD2-CD2 4.01Å; F223-F281 AromaticContact CD2-CE2 3.92Å; F223-F281 HydrophobicContact CD2-CE2 3.92Å; F223-F281 HydrophobicContact CE1-CB 3.52Å; F223-F281 AromaticContact CE1-CD2 3.21Å; F223-F281 HydrophobicContact CE1-CD2 3.21Å; F223-F281 HydrophobicContact CE1-CE2 4.09Å; F223-F281 AromaticContact CE1-CG 3.62Å; F223-F281 HydrophobicContact CE1-CG 3.62Å; F223-F281 HydrophobicContact CE2-CD1 4.39Å; F223-F281 AromaticContact CE2-CD2 3.52Å; F223-F281 HydrophobicContact CE2-CD2 3.52Å; F223-F281 AromaticContact CE2-CE2 3.67Å; F223-F281 HydrophobicContact CE2-CE2 3.67Å; F223-F281 AromaticContact CE2-CG 3.9Å; F223-F281 HydrophobicContact CE2-CG 3.9Å; F223-F281 HydrophobicContact CE2-CZ 4.18Å; F223-F281 HydrophobicContact CG-CD2 4.08Å; F223-F281 HydrophobicContact CG-CE2 4.2Å; F223-F281 HydrophobicContact CZ-CB 3.41Å; F223-F281 VanDerWaalsContact CZ-CB 3.41Å; F223-F281 HydrophobicContact CZ-CD1 4.02Å; F223-F281 AromaticContact CZ-CD2 3.1Å; F223-F281 HydrophobicContact CZ-CD2 3.1Å; F223-F281 AromaticContact CZ-CE2 3.78Å; F223-F281 HydrophobicContact CZ-CE2 3.78Å; F223-F281 AromaticContact CZ-CG 3.23Å; F223-F281 HydrophobicContact CZ-CG 3.23Å; F223-F281 HydrophobicContact CZ-CZ 4.46Å; F281-N283 PolarHBondContact O-N 3.06Å; F281-N284 PolarHBondContact O-N 3.16Å
282G86.8Confident93.9Very high54 Ų5434.8 Ų34.856%0.55719%0.185SC*.THydrogen-bonded Turntrans50.6-127.6-177.900000111.8P258 N284P258-G282 WeakPolarHBondContact CG-O 3.41Å; G282-N284 VanDerWaalsContact C-N 3.29Å; G282-N284 PolarHBondContact O-N 2.9Å
283N86.7Confident94.2Very high132 Ų13234.8 Ų34.871%0.70619%0.185SC*.THydrogen-bonded Turntrans-85.77.1-177.3-63-13.6000114.3P258 F281P258-N283 HydrophobicContact CB-CB 4.41Å; F281-N283 PolarHBondContact O-N 3.06Å
284N89.7Confident94.3Very high89 Ų8933.4 Ų33.448%0.47618%0.179SC..  trans-111.851.4-177.2-72.1-30.1000111.3F281 G282 R286F281-N284 PolarHBondContact O-N 3.16Å; G282-N284 VanDerWaalsContact C-N 3.29Å; G282-N284 PolarHBondContact O-N 2.9Å; N284-R286 PolarHBondContact O-NH1 3.39Å; N284-R286 VanDerWaalsContact O-NH1 3.13Å
285K95Very high94.1Very high23 Ų2338.6 Ų38.610%0.120%0.198CC..EExtended strand (participates in β ladder)trans-82.2149.2177.5-58.9-64.7-167-176.30111.5F257 P258 K260 Y279 G280F257-K285 HydrophobicContact CD1-CB 4.32Å; F257-K285 HydrophobicContact CE1-CB 3.47Å; F257-K285 VanDerWaalsContact CE1-CB 3.47Å; F257-K285 HydrophobicContact CE1-CG 4.31Å; F257-K285 HydrophobicContact CE2-CB 4.07Å; F257-K285 HydrophobicContact CE2-CG 4.1Å; F257-K285 HydrophobicContact CZ-CB 3.34Å; F257-K285 HydrophobicContact CZ-CG 3.88Å; P258-K285 HydrophobicContact CG-CB 4.49Å; P258-K285 HydrophobicContact CG-CG 3.77Å; P258-K285 WeakPolarHBondContact O-CB 3.19Å; P258-K285 PolarHBondContact O-N 2.8Å; K260-K285 WeakPolarHBondContact CB-O 3.25Å; K260-K285 PolarHBondContact N-O 2.81Å; Y279-K285 CarbonylContact O-C 3.6Å; Y279-K285 WeakPolarHBondContact O-CA 3.34Å; G280-K285 WeakPolarHBondContact O-CD 3.49Å; G280-K285 PolarHBondContact O-NZ 2.93Å
286R96.8Very high93.7Very high36 Ų3637.4 Ų37.414%0.13621%0.205CC..EExtended strand (participates in β ladder)trans-135.5144.5179-59.5172.7179.676.8-16.7109.5E227 K261 F278 Y279 N284E227-R286 IonicContact OE1-NH2 2.71Å; E227-R286 IonicContact OE2-CZ 3.33Å; E227-R286 VanDerWaalsContact OE2-CZ 3.23Å; E227-R286 IonicContact OE2-NE 2.81Å; E227-R286 PolarHBondContact OE2-NE 3.12Å; E227-R286 IonicContact OE2-NH2 3.74Å; E227-R286 PolarHBondContact OE2-NH2 3.25Å; K261-R286 HydrophobicContact CB-CG 4.01Å; K261-R286 VanDerWaalsContact O-CA 3.22Å; K261-R286 WeakPolarHBondContact O-CA 3.29Å; F278-R286 CarbonylContact C-O 3.58Å; F278-R286 WeakPolarHBondContact CA-O 3.24Å; F278-R286 VanDerWaalsContact CB-O 3.3Å; F278-R286 WeakPolarHBondContact CB-O 3.34Å; Y279-R286 HydrophobicContact CD1-CB 4.38Å; Y279-R286 HydrophobicContact CE1-CB 3.99Å; Y279-R286 HydrophobicContact CE2-CB 4.29Å; Y279-R286 HydrophobicContact CE2-CG 4.38Å; Y279-R286 PolarHBondContact N-O 3.43Å; Y279-R286 PolarHBondContact O-N 3.44Å; Y279-R286 WeakPolarHBondContact OH-CD 3.33Å; N284-R286 PolarHBondContact O-NH1 3.39Å; N284-R286 VanDerWaalsContact O-NH1 3.13Å
287I98.3Very high93.3Very high2 Ų239.5 Ų39.51%0.0121%0.214CC..EExtended strand (participates in β ladder)trans-108.7136172.1-65.6168.8000107.2I248 F257 L259 K261 L262 L263 F278 I289 I330 L334I248-I287 HydrophobicContact CG2-CD1 4.12Å; F257-I287 HydrophobicContact CE1-CD1 4.17Å; F257-I287 HydrophobicContact CE1-CG1 4.04Å; F257-I287 HydrophobicContact CZ-CG1 4.38Å; L259-I287 HydrophobicContact CD1-CB 4.18Å; L259-I287 HydrophobicContact CD1-CD1 3.78Å; L259-I287 HydrophobicContact CD1-CG1 3.8Å; L259-I287 HydrophobicContact CD2-CD1 4.32Å; K261-I287 PolarHBondContact O-N 3.23Å; K261-I287 VanDerWaalsContact O-N 3.13Å; L262-I287 HydrophobicContact CD1-CB 3.61Å; L262-I287 HydrophobicContact CD1-CG2 3.52Å; L263-I287 PolarHBondContact N-O 3.44Å; F278-I287 HydrophobicContact CB-CG1 4.22Å; I287-I289 HydrophobicContact CG2-CG1 4.21Å; I287-I330 HydrophobicContact CD1-CG2 4.06Å; I287-I330 HydrophobicContact CG2-CD1 3.63Å; I287-L334 HydrophobicContact CD1-CD2 4.25Å
288V98.3Very high92.7Very high0 Ų044.9 Ų44.90%024%0.238CC..EExtended strand (participates in β ladder)trans-121.6128.4175.8-177.50000108.9Y236 L263 V265 A276 Y277 Y279Y236-V288 HydrophobicContact CD1-CG1 4.27Å; Y236-V288 HydrophobicContact CE1-CG1 3.9Å; Y236-V288 HydrophobicContact CE1-CG2 4.37Å; L263-V288 HydrophobicContact CB-CG2 4.38Å; L263-V288 WeakPolarHBondContact O-CA 3.11Å; V265-V288 HydrophobicContact CB-CG1 3.9Å; V265-V288 HydrophobicContact CG1-CG1 3.66Å; A276-V288 WeakPolarHBondContact CA-O 3.28Å; Y277-V288 HydrophobicContact CD1-CB 4.15Å; Y277-V288 HydrophobicContact CD1-CG1 4.45Å; Y277-V288 HydrophobicContact CD2-CB 4.41Å; Y277-V288 HydrophobicContact CE1-CB 3.7Å; Y277-V288 HydrophobicContact CE1-CG1 3.67Å; Y277-V288 HydrophobicContact CE1-CG2 4.39Å; Y277-V288 HydrophobicContact CE2-CB 4Å; Y277-V288 HydrophobicContact CE2-CG2 3.91Å; Y277-V288 HydrophobicContact CG-CB 4.48Å; Y277-V288 PolarHBondContact N-O 2.94Å; Y277-V288 PolarHBondContact O-N 3.49Å; Y279-V288 HydrophobicContact CD1-CG2 4.03Å; Y279-V288 HydrophobicContact CE1-CG2 3.51Å
289I98.3Very high92.2Very high0 Ų044 Ų440%024%0.235CC..EExtended strand (participates in β ladder)trans-114.9134.3175.9-57178.2000107.9I248 L262 L263 V264 V265 A276 I287 L293 I294 I326 I330I248-I289 HydrophobicContact CD1-CD1 3.67Å; L262-I289 HydrophobicContact CD1-CD1 4.14Å; L262-I289 HydrophobicContact CD1-CG1 4.47Å; L263-I289 PolarHBondContact O-N 3.3Å; V264-I289 CarbonylContact C-O 3.57Å; V264-I289 VanDerWaalsContact CA-O 3.23Å; V264-I289 WeakPolarHBondContact CA-O 3.33Å; V264-I289 WeakPolarHBondContact CG1-O 3.42Å; V265-I289 PolarHBondContact N-O 3.03Å; A276-I289 HydrophobicContact CB-CG1 4.45Å; I287-I289 HydrophobicContact CG2-CG1 4.21Å; I289-L293 HydrophobicContact CG2-CB 4.14Å; I289-L293 HydrophobicContact CG2-CD2 4.17Å; I289-I294 HydrophobicContact CB-CD1 4.41Å; I289-I294 HydrophobicContact CG2-CD1 3.8Å; I289-I294 HydrophobicContact CG2-CG1 3.72Å; I289-I326 HydrophobicContact CD1-CG2 4.04Å; I289-I330 HydrophobicContact CD1-CD1 4.22Å; I289-I330 HydrophobicContact CD1-CG1 4.44Å; I289-I330 HydrophobicContact CG1-CD1 4.14Å
290F96.7Very high91.1Very high43 Ų4346.9 Ų46.919%0.18926%0.257CS..EExtended strand (participates in β ladder)trans-72.1137.8170.6-78.5-131.3000108.9V265 N275 Y277 T292 L293V265-F290 HydrophobicContact CG1-CB 4.35Å; V265-F290 HydrophobicContact CG1-CD1 4.35Å; V265-F290 HydrophobicContact CG1-CD2 3.49Å; V265-F290 VanDerWaalsContact CG1-CD2 3.49Å; V265-F290 HydrophobicContact CG1-CE2 3.78Å; V265-F290 HydrophobicContact CG1-CG 3.8Å; V265-F290 HydrophobicContact CG1-CZ 4.3Å; N275-F290 HydrophobicContact CB-CD1 4.48Å; N275-F290 HydrophobicContact CB-CD2 3.86Å; N275-F290 HydrophobicContact CB-CE2 3.91Å; N275-F290 HydrophobicContact CB-CG 4.17Å; N275-F290 HydrophobicContact CB-CZ 4.29Å; N275-F290 VanDerWaalsContact O-CB 3.31Å; N275-F290 WeakPolarHBondContact O-CB 3.41Å; N275-F290 VanDerWaalsContact O-CD2 3.31Å; N275-F290 WeakPolarHBondContact O-CD2 3.28Å; N275-F290 PolarHBondContact O-N 2.85Å; Y277-F290 HydrophobicContact CD1-CE2 4.15Å; Y277-F290 AromaticContact CE1-CE2 3.82Å; Y277-F290 HydrophobicContact CE1-CE2 3.82Å; F290-T292 WeakPolarHBondContact CB-OG1 3.33Å; F290-T292 PolarHBondContact O-N 3.46Å; F290-L293 WeakPolarHBondContact O-CB 3.46Å; F290-L293 PolarHBondContact O-N 3.45Å
291D94.9Very high89.8Confident11 Ų1152.1 Ų52.16%0.05928%0.282CS..G310 helixtrans-53.2-34.4173.462.5-19.7000112.9V264 V265 G267 S268 L293 I294 F297 F299V264-D291 HydrophobicContact CG1-CB 3.9Å; V265-D291 PolarHBondContact O-N 2.91Å; G267-D291 PolarHBondContact N-OD1 2.88Å; S268-D291 WeakPolarHBondContact CB-OD2 3.26Å; S268-D291 PolarHBondContact N-OD1 2.97Å; S268-D291 PolarHBondContact OG-OD2 3.46Å; D291-L293 PolarHBondContact O-N 3.46Å; D291-I294 PolarHBondContact O-N 2.92Å; D291-I294 VanDerWaalsContact O-N 3.09Å; D291-F297 HydrophobicContact CB-CD1 3.8Å; D291-F297 HydrophobicContact CB-CE1 4.41Å; D291-F299 HydrophobicContact CB-CE2 3.73Å; D291-F299 HydrophobicContact CB-CZ 4.14Å
292T93.8Very high88.4Confident11 Ų1153.4 Ų53.47%0.06729%0.287CS..G310 helixtrans-62.3-2517550.30000114.2H273 S274 F290 G319H273-T292 WeakPolarHBondContact O-CB 3.43Å; H273-T292 PolarHBondContact O-OG1 3.11Å; S274-T292 WeakPolarHBondContact CA-OG1 3.3Å; S274-T292 PolarHBondContact OG-O 3.24Å; F290-T292 WeakPolarHBondContact CB-OG1 3.33Å; F290-T292 PolarHBondContact O-N 3.46Å; T292-G319 VanDerWaalsContact O-CA 3.3Å; T292-G319 WeakPolarHBondContact O-CA 3.37Å
293L95.5Very high86.8Confident0 Ų057.4 Ų57.40%030%0.296CS..G310 helixtrans-78.2-23.4175.6-17260.6000112.1A276 I289 F290 D291 G319 C320 V329 L436A276-L293 HydrophobicContact CB-CD2 3.83Å; I289-L293 HydrophobicContact CG2-CB 4.14Å; I289-L293 HydrophobicContact CG2-CD2 4.17Å; F290-L293 WeakPolarHBondContact O-CB 3.46Å; F290-L293 PolarHBondContact O-N 3.45Å; D291-L293 PolarHBondContact O-N 3.46Å; L293-G319 WeakPolarHBondContact O-CA 3.28Å; L293-C320 PolarHBondContact O-N 3.31Å; L293-V329 HydrophobicContact CD2-CG1 4.39Å; L293-L436 HydrophobicContact CD1-CD2 3.76Å; L293-L436 HydrophobicContact CD1-CG 4.48Å
294I94.7Very high85.2Confident19 Ų1959.5 Ų59.510%0.09730%0.301CS..BIsolated β-bridgetrans-98.1104.2179.8-51.6168.2000108.5L239 L244 V264 I289 D291 G296 F297 I326L239-I294 HydrophobicContact CD1-CD1 3.88Å; L244-I294 HydrophobicContact CD2-CD1 4.29Å; L244-I294 HydrophobicContact CD2-CG1 4.38Å; L244-I294 HydrophobicContact CD2-CG2 4.26Å; V264-I294 HydrophobicContact CG1-CD1 4.39Å; V264-I294 HydrophobicContact CG2-CD1 3.97Å; I289-I294 HydrophobicContact CB-CD1 4.41Å; I289-I294 HydrophobicContact CG2-CD1 3.8Å; I289-I294 HydrophobicContact CG2-CG1 3.72Å; D291-I294 PolarHBondContact O-N 2.92Å; D291-I294 VanDerWaalsContact O-N 3.09Å; I294-G296 PolarHBondContact O-N 3.42Å; I294-F297 HydrophobicContact CB-CB 3.78Å; I294-F297 HydrophobicContact CB-CD2 4.33Å; I294-F297 HydrophobicContact CB-CG 4.3Å; I294-F297 HydrophobicContact CD1-CD2 4.01Å; I294-F297 HydrophobicContact CD1-CE2 4.4Å; I294-F297 HydrophobicContact CD1-CG 4.43Å; I294-F297 HydrophobicContact CG2-CB 3.85Å; I294-F297 HydrophobicContact CG2-CD2 4.03Å; I294-F297 HydrophobicContact CG2-CG 4.35Å; I294-F297 VanDerWaalsContact O-CB 3.25Å; I294-F297 WeakPolarHBondContact O-CB 3.26Å; I294-F297 PolarHBondContact O-N 3.32Å; I294-F297 VanDerWaalsContact O-N 3.07Å; I294-I326 HydrophobicContact CB-CD1 4.43Å; I294-I326 HydrophobicContact CG1-CD1 4.06Å; I294-I326 HydrophobicContact CG2-CD1 4.33Å
295R90.6Very high83.2Confident111 Ų11162.2 Ų62.242%0.41932%0.316SS..THydrogen-bonded Turntrans-58.9127-175.5-174.5167.2-172.2-175.9-1.4112F297 E316 R318 C320R295-F297 PolarHBondContact O-N 3.46Å; R295-E316 PolarHBondContact NE-O 3.03Å; R295-E316 PolarHBondContact NH2-O 3.41Å; R295-R318 WeakPolarHBondContact CA-O 3.41Å; R295-R318 VanDerWaalsContact CB-O 3.28Å; R295-R318 WeakPolarHBondContact CB-O 3.42Å; R295-R318 VanDerWaalsContact CG-O 3.24Å; R295-R318 WeakPolarHBondContact CG-O 3.24Å; R295-C320 WeakPolarHBondContact CB-O 3.47Å; R295-C320 PolarHBondContact N-O 2.91Å
296G86.1Confident80.9Confident54 Ų5468.3 Ų68.356%0.55735%0.349SS*.THydrogen-bonded Turntrans71.312179.300000114.9I294 K298I294-G296 PolarHBondContact O-N 3.42Å; G296-K298 PolarHBondContact O-N 3.01Å
297F89.1Confident78.5Confident45 Ų4572.2 Ų72.220%0.19738%0.377CS..  trans-61.8135.3178-173.5-93.3000111.9L239 P240 V264 D291 I294 R295 F299L239-F297 HydrophobicContact CD1-CE2 4.14Å; P240-F297 HydrophobicContact CG-CE2 4.12Å; P240-F297 HydrophobicContact CG-CZ 4.25Å; V264-F297 HydrophobicContact CB-CE1 4.28Å; V264-F297 HydrophobicContact CB-CZ 4.09Å; V264-F297 HydrophobicContact CG1-CD1 4.17Å; V264-F297 HydrophobicContact CG1-CE1 3.71Å; V264-F297 HydrophobicContact CG1-CZ 3.96Å; V264-F297 HydrophobicContact CG2-CE2 4.23Å; V264-F297 HydrophobicContact CG2-CZ 3.97Å; D291-F297 HydrophobicContact CB-CD1 3.8Å; D291-F297 HydrophobicContact CB-CE1 4.41Å; I294-F297 HydrophobicContact CB-CB 3.78Å; I294-F297 HydrophobicContact CB-CD2 4.33Å; I294-F297 HydrophobicContact CB-CG 4.3Å; I294-F297 HydrophobicContact CD1-CD2 4.01Å; I294-F297 HydrophobicContact CD1-CE2 4.4Å; I294-F297 HydrophobicContact CD1-CG 4.43Å; I294-F297 HydrophobicContact CG2-CB 3.85Å; I294-F297 HydrophobicContact CG2-CD2 4.03Å; I294-F297 HydrophobicContact CG2-CG 4.35Å; I294-F297 VanDerWaalsContact O-CB 3.25Å; I294-F297 WeakPolarHBondContact O-CB 3.26Å; I294-F297 PolarHBondContact O-N 3.32Å; I294-F297 VanDerWaalsContact O-N 3.07Å; R295-F297 PolarHBondContact O-N 3.46Å; F297-F299 HydrophobicContact CD1-CD2 4.25Å; F297-F299 HydrophobicContact CD1-CE2 4.14Å; F297-F299 HydrophobicContact CD1-CZ 4.48Å; F297-F299 AromaticContact CE1-CD1 3.88Å; F297-F299 HydrophobicContact CE1-CD1 3.88Å; F297-F299 AromaticContact CE1-CD2 3.85Å; F297-F299 HydrophobicContact CE1-CD2 3.85Å; F297-F299 AromaticContact CE1-CE1 3.83Å; F297-F299 HydrophobicContact CE1-CE1 3.83Å; F297-F299 AromaticContact CE1-CE2 3.77Å; F297-F299 HydrophobicContact CE1-CE2 3.77Å; F297-F299 AromaticContact CE1-CG 3.91Å; F297-F299 HydrophobicContact CE1-CG 3.91Å; F297-F299 AromaticContact CE1-CZ 3.77Å; F297-F299 HydrophobicContact CE1-CZ 3.77Å; F297-F299 HydrophobicContact CZ-CD1 4.46Å; F297-F299 HydrophobicContact CZ-CE1 4.44Å
298K85.2Confident76Confident176 Ų17680.6 Ų80.677%0.76541%0.413SS*.  trans-130.8130.2175-67.8-176.7179.8-177.40109.3G296G296-K298 PolarHBondContact O-N 3.01Å
299F85.1Confident73.5Confident10 Ų1089.5 Ų89.54%0.04446%0.455CS..  trans-68.5132.7173.1-73.8-86.7000110.1E237 V264 E266 D291 F297 N301 K302E237-F299 HydrophobicContact CB-CD1 4.26Å; E237-F299 HydrophobicContact CB-CE1 4.11Å; E237-F299 HydrophobicContact CG-CD1 3.99Å; E237-F299 HydrophobicContact CG-CE1 4.05Å; E237-F299 WeakPolarHBondContact OE2-CD1 3.45Å; V264-F299 HydrophobicContact CB-CE1 4.32Å; V264-F299 HydrophobicContact CB-CZ 4.34Å; V264-F299 HydrophobicContact CG1-CE1 4.25Å; V264-F299 HydrophobicContact CG1-CZ 3.81Å; E266-F299 HydrophobicContact CB-CD2 4.47Å; E266-F299 HydrophobicContact CB-CE2 3.65Å; E266-F299 HydrophobicContact CB-CZ 3.79Å; E266-F299 HydrophobicContact CG-CD2 4.27Å; E266-F299 HydrophobicContact CG-CE2 3.77Å; E266-F299 HydrophobicContact CG-CZ 4.42Å; D291-F299 HydrophobicContact CB-CE2 3.73Å; D291-F299 HydrophobicContact CB-CZ 4.14Å; F297-F299 HydrophobicContact CD1-CD2 4.25Å; F297-F299 HydrophobicContact CD1-CE2 4.14Å; F297-F299 HydrophobicContact CD1-CZ 4.48Å; F297-F299 AromaticContact CE1-CD1 3.88Å; F297-F299 HydrophobicContact CE1-CD1 3.88Å; F297-F299 AromaticContact CE1-CD2 3.85Å; F297-F299 HydrophobicContact CE1-CD2 3.85Å; F297-F299 AromaticContact CE1-CE1 3.83Å; F297-F299 HydrophobicContact CE1-CE1 3.83Å; F297-F299 AromaticContact CE1-CE2 3.77Å; F297-F299 HydrophobicContact CE1-CE2 3.77Å; F297-F299 AromaticContact CE1-CG 3.91Å; F297-F299 HydrophobicContact CE1-CG 3.91Å; F297-F299 AromaticContact CE1-CZ 3.77Å; F297-F299 HydrophobicContact CE1-CZ 3.77Å; F297-F299 HydrophobicContact CZ-CD1 4.46Å; F297-F299 HydrophobicContact CZ-CE1 4.44Å; F299-N301 VanDerWaalsContact C-N 3.29Å; F299-N301 PolarHBondContact O-N 3.48Å; F299-K302 HydrophobicContact CB-CB 4.38Å; F299-K302 PolarHBondContact O-N 3.42Å
300P71.4Confident71.2Confident94 Ų9492 Ų9261%0.6147%0.467SS*.THydrogen-bonded Turntrans-63.4-31.3-172.321.2-31.4000113.7
301N65.2Low68.9Low125 Ų12594.1 Ų94.167%0.66848%0.483SS*.THydrogen-bonded Turntrans-106.443.8-179.7-71.4-18.1000111.8R235 F299R235-N301 PolarHBondContact NH1-O 2.75Å; R235-N301 PolarHBondContact NH2-O 3.17Å; F299-N301 VanDerWaalsContact C-N 3.29Å; F299-N301 PolarHBondContact O-N 3.48Å
302K58.9Low66.6Low87 Ų87101.3 Ų101.338%0.37851%0.514SS..  trans-100.4108.6174.4-153.5173.3-171165.60108.2E266 F299 E304E266-K302 WeakPolarHBondContact OE1-CE 3.4Å; E266-K302 IonicContact OE1-NZ 3.78Å; E266-K302 PolarHBondContact OE1-NZ 2.94Å; F299-K302 HydrophobicContact CB-CB 4.38Å; F299-K302 PolarHBondContact O-N 3.42Å; K302-E304 PolarHBondContact O-N 2.85Å
303N52.9Low64.5Low137 Ų137105.9 Ų105.973%0.73354%0.538SS*.  trans-54.4129.5163.9-69.9-8.8000107.1D305N303-D305 PolarHBondContact O-N 3.36Å
304E52.9Low62.8Low176 Ų176110 Ų11082%0.82256%0.56SS**G310 helixtrans-61.2-8-176.2-67.6-173.2147.300113.6K302 L306 T307K302-E304 PolarHBondContact O-N 2.85Å; E304-L306 PolarHBondContact O-N 3.4Å; E304-T307 PolarHBondContact O-OG1 3.27Å
305D46.7Very low61Low147 Ų147111.1 Ų111.179%0.78657%0.57SS**G310 helixtrans-71.18.6-169.1-79-23.2000117.4N303N303-D305 PolarHBondContact O-N 3.36Å
306L47.6Very low59.5Low151 Ų151111 Ų11179%0.79157%0.574SS**G310 helixtrans-1286.8179.7-72.2172.8000116.3E304 K308E304-L306 PolarHBondContact O-N 3.4Å; L306-K308 PolarHBondContact O-N 2.94Å
307T45.8Very low58.9Low118 Ų118113.2 Ų113.272%0.72457%0.569SS**  trans-74.775.6168.420.10000111.3E304 Q309E304-T307 PolarHBondContact O-OG1 3.27Å; T307-Q309 PolarHBondContact O-N 3.39Å
308K47Very low58.7Low177 Ų177112.7 Ų112.777%0.7757%0.566SS**  trans-66.1120.1152.7-86.9-175.5175.1-178.20108.3L306 E310L306-K308 PolarHBondContact O-N 2.94Å; K308-E310 VanDerWaalsContact C-N 3.29Å; K308-E310 PolarHBondContact O-N 3.36Å
309Q45.6Very low58.9Low188 Ų188104.5 Ų104.588%0.87953%0.532SS*.  trans4139.3146.4-69.4-178.5-30.200117.9T307 T311T307-Q309 PolarHBondContact O-N 3.39Å; Q309-T311 PolarHBondContact O-N 3.37Å
310E48.7Very low59.3Low52 Ų52104.2 Ų104.224%0.24353%0.531CS..  trans-74.1114.9141.2-76.4-163.4135.900105.5K167 K308 K312 S315 R318K167-E310 WeakPolarHBondContact CE-OE1 3.38Å; K167-E310 IonicContact NZ-OE1 2.84Å; K167-E310 PolarHBondContact NZ-OE1 3.09Å; K308-E310 VanDerWaalsContact C-N 3.29Å; K308-E310 PolarHBondContact O-N 3.36Å; E310-K312 PolarHBondContact O-N 2.95Å; E310-S315 VanDerWaalsContact OE2-CB 3.32Å; E310-S315 WeakPolarHBondContact OE2-CB 3.46Å; E310-R318 IonicContact OE1-NH1 2.87Å; E310-R318 PolarHBondContact OE1-NH1 3.09Å
311T48.5Very low60.1Low88 Ų88102.6 Ų102.654%0.5453%0.526SS..  trans-48.8117.2160.725.20000105.8Q309 N313 D314Q309-T311 PolarHBondContact O-N 3.37Å; T311-N313 PolarHBondContact O-N 3.38Å; T311-D314 PolarHBondContact O-N 3.32Å; T311-D314 PolarHBondContact OG1-OD2 3.36Å
312K47.6Very low61.4Low161 Ų16199.6 Ų99.670%0.751%0.511SS*.Hα-helixtrans-40.6-37.1-179.3-83.2179.1168.6178.60111.9E310 D314 S315 E316E310-K312 PolarHBondContact O-N 2.95Å; K312-D314 PolarHBondContact O-N 3.29Å; K312-S315 PolarHBondContact O-OG 2.86Å; K312-E316 WeakPolarHBondContact O-CB 3.42Å; K312-E316 WeakPolarHBondContact O-CG 3.28Å; K312-E316 PolarHBondContact O-N 3.13Å; K312-E316 VanDerWaalsContact O-N 3.08Å
313N50.6Low63.2Low107 Ų10797.5 Ų97.557%0.57250%0.504SS*.Hα-helixtrans-56-37177.7-65.92.3000115.8T311 Q317T311-N313 PolarHBondContact O-N 3.38Å; N313-Q317 WeakPolarHBondContact O-CB 3.28Å; N313-Q317 VanDerWaalsContact O-CG 3.32Å; N313-Q317 WeakPolarHBondContact O-CG 3.48Å; N313-Q317 PolarHBondContact O-N 3.2Å
314D58.2Low65.3Low88 Ų8893.5 Ų93.547%0.47148%0.481SS..Hα-helixtrans-82-43-172.6-75.1-20.4000112.2T311 K312 E316 Q317 R318T311-D314 PolarHBondContact O-N 3.32Å; T311-D314 PolarHBondContact OG1-OD2 3.36Å; K312-D314 PolarHBondContact O-N 3.29Å; D314-E316 VanDerWaalsContact C-N 3.33Å; D314-Q317 PolarHBondContact O-N 2.99Å; D314-R318 PolarHBondContact O-N 3.04Å
315S57Low67.3Low42 Ų4286 Ų8629%0.29445%0.446SS..Hα-helixtrans-71.1-32.2175.955.60000111.8E310 K312 Q317E310-S315 VanDerWaalsContact OE2-CB 3.32Å; E310-S315 WeakPolarHBondContact OE2-CB 3.46Å; K312-S315 PolarHBondContact O-OG 2.86Å; S315-Q317 PolarHBondContact O-N 2.95Å
316E60.5Low69.8Low108 Ų10879.1 Ų79.151%0.50541%0.409SS..THydrogen-bonded Turntrans-71.3-10.4173.2-73.7175.8-170.500113.4R295 K312 D314R295-E316 PolarHBondContact NE-O 3.03Å; R295-E316 PolarHBondContact NH2-O 3.41Å; K312-E316 WeakPolarHBondContact O-CB 3.42Å; K312-E316 WeakPolarHBondContact O-CG 3.28Å; K312-E316 PolarHBondContact O-N 3.13Å; K312-E316 VanDerWaalsContact O-N 3.08Å; D314-E316 VanDerWaalsContact C-N 3.33Å
317Q72Confident72.2Confident100 Ų10072.2 Ų72.247%0.46737%0.373SS..THydrogen-bonded Turntrans-112.70.2177.6-70.9-169.216.200115.2N313 D314 S315 K438N313-Q317 WeakPolarHBondContact O-CB 3.28Å; N313-Q317 VanDerWaalsContact O-CG 3.32Å; N313-Q317 WeakPolarHBondContact O-CG 3.48Å; N313-Q317 PolarHBondContact O-N 3.2Å; D314-Q317 PolarHBondContact O-N 2.99Å; S315-Q317 PolarHBondContact O-N 2.95Å; Q317-K438 PolarHBondContact O-NZ 3.41Å
318R84.7Confident74.7Confident35 Ų3566.6 Ų66.613%0.13234%0.339CS..SBendtrans-93.8150.5179.9-172.2-179.8-66.4136.49.4111.4A272 R295 E310 D314 D439A272-R318 VanDerWaalsContact CB-NH1 3.26Å; A272-R318 VanDerWaalsContact CB-NH2 3.25Å; A272-R318 VanDerWaalsContact O-CD 3.28Å; A272-R318 WeakPolarHBondContact O-CD 3.45Å; A272-R318 PolarHBondContact O-NE 3.39Å; R295-R318 WeakPolarHBondContact CA-O 3.41Å; R295-R318 VanDerWaalsContact CB-O 3.28Å; R295-R318 WeakPolarHBondContact CB-O 3.42Å; R295-R318 VanDerWaalsContact CG-O 3.24Å; R295-R318 WeakPolarHBondContact CG-O 3.24Å; E310-R318 IonicContact OE1-NH1 2.87Å; E310-R318 PolarHBondContact OE1-NH1 3.09Å; D314-R318 PolarHBondContact O-N 3.04Å; R318-D439 HydrophobicContact CG-CB 4.39Å; R318-D439 WeakPolarHBondContact CG-OD2 3.14Å
319G90.6Very high77.1Confident4 Ų458.5 Ų58.54%0.04130%0.304CS..SBendtrans83.3172.2177.100000113.4T292 L293 A321 D439T292-G319 VanDerWaalsContact O-CA 3.3Å; T292-G319 WeakPolarHBondContact O-CA 3.37Å; L293-G319 WeakPolarHBondContact O-CA 3.28Å; G319-A321 PolarHBondContact O-N 2.85Å; G319-D439 WeakPolarHBondContact CA-OD2 3.35Å; G319-D439 PolarHBondContact N-OD2 2.92Å
320C93.2Very high79.6Confident4 Ų449.6 Ų49.63%0.02726%0.263CS..BIsolated β-bridgetrans-66.3130.5178.6-70.60000110.5L293 R295 E325 I326L293-C320 PolarHBondContact O-N 3.31Å; R295-C320 WeakPolarHBondContact CB-O 3.47Å; R295-C320 PolarHBondContact N-O 2.91Å; C320-E325 WeakPolarHBondContact CA-OE2 3.31Å; C320-E325 HydrophobicContact CB-CB 3.74Å; C320-I326 HydrophobicContact CB-CD1 4.11Å; C320-I326 HydrophobicContact CB-CG1 3.39Å
321A87.7Confident82Confident60 Ų6047.1 Ų47.150%0.49625%0.251SS..SBendtrans-84.1-25-175.900000112.3G319 E325G319-A321 PolarHBondContact O-N 2.85Å; A321-E325 PolarHBondContact N-OE2 2.85Å
322V92.9Very high84.3Confident61 Ų6143.4 Ų43.437%0.3723%0.228SC..SBendtrans-125.7148.3178.5-62.20000110.4E324 E325 Y428V322-E324 PolarHBondContact O-N 3.3Å; V322-E325 HydrophobicContact CG2-CB 4.26Å; V322-E325 HydrophobicContact CG2-CG 3.62Å; V322-E325 PolarHBondContact N-OE2 2.76Å; V322-E325 WeakPolarHBondContact O-CB 3.43Å; V322-E325 PolarHBondContact O-N 2.92Å; V322-Y428 HydrophobicContact CG2-CD1 4.32Å; V322-Y428 HydrophobicContact CG2-CE1 4.24Å
323D95.9Very high86.7Confident43 Ų4337.5 Ų37.523%0.2320%0.202CC..Hα-helixtrans-56.9-37.4-178.7-65.4-21000111.7L244 K247 E325 I326 L327L244-D323 HydrophobicContact CD1-CB 3.82Å; K247-D323 HydrophobicContact CD-CB 3.94Å; K247-D323 IonicContact NZ-OD2 3.93Å; K247-D323 PolarHBondContact NZ-OD2 2.89Å; D323-E325 PolarHBondContact O-N 2.89Å; D323-I326 CarbonylContact O-C 3.59Å; D323-I326 WeakPolarHBondContact O-CA 3.48Å; D323-I326 WeakPolarHBondContact O-CB 3.46Å; D323-I326 PolarHBondContact O-N 2.92Å; D323-L327 HydrophobicContact CB-CD1 4.04Å; D323-L327 WeakPolarHBondContact O-CD1 3.44Å; D323-L327 PolarHBondContact O-N 3.45Å
324E97.2Very high88.9Confident54 Ų5432.4 Ų32.425%0.25218%0.175SC..Hα-helixtrans-61.7-29.5-175.9-68.568.5-148.200112.7K247 V322 S328 Y428K247-E324 IonicContact NZ-OE1 2.74Å; K247-E324 PolarHBondContact NZ-OE1 3.42Å; V322-E324 PolarHBondContact O-N 3.3Å; E324-S328 WeakPolarHBondContact O-CB 3.49Å; E324-S328 PolarHBondContact O-N 3.04Å; E324-Y428 HydrophobicContact CB-CD1 3.49Å; E324-Y428 VanDerWaalsContact CB-CD1 3.49Å; E324-Y428 HydrophobicContact CB-CD2 3.76Å; E324-Y428 HydrophobicContact CB-CE1 3.52Å; E324-Y428 HydrophobicContact CB-CE2 3.79Å; E324-Y428 HydrophobicContact CB-CG 3.6Å; E324-Y428 HydrophobicContact CG-CD2 4.46Å; E324-Y428 HydrophobicContact CG-CE1 4.18Å; E324-Y428 HydrophobicContact CG-CE2 4.06Å; E324-Y428 WeakPolarHBondContact O-CB 3.28Å
325E96.5Very high90.8Very high17 Ų1728.2 Ų28.28%0.07915%0.153CC..Hα-helixtrans-67.6-43.6172-70.5172.6153.300110.6C320 A321 V322 D323 S328 V329 Y428 S431 A432 I435C320-E325 WeakPolarHBondContact CA-OE2 3.31Å; C320-E325 HydrophobicContact CB-CB 3.74Å; A321-E325 PolarHBondContact N-OE2 2.85Å; V322-E325 HydrophobicContact CG2-CB 4.26Å; V322-E325 HydrophobicContact CG2-CG 3.62Å; V322-E325 PolarHBondContact N-OE2 2.76Å; V322-E325 WeakPolarHBondContact O-CB 3.43Å; V322-E325 PolarHBondContact O-N 2.92Å; D323-E325 PolarHBondContact O-N 2.89Å; E325-S328 WeakPolarHBondContact O-CB 3.33Å; E325-S328 PolarHBondContact O-N 3.35Å; E325-S328 PolarHBondContact O-OG 3.28Å; E325-V329 PolarHBondContact O-N 3.49Å; E325-Y428 HydrophobicContact CG-CD1 4.21Å; E325-S431 VanDerWaalsContact OE1-CB 3.3Å; E325-S431 WeakPolarHBondContact OE1-CB 3.43Å; E325-S431 PolarHBondContact OE1-OG 3.43Å; E325-A432 HydrophobicContact CB-CB 4.06Å; E325-I435 VanDerWaalsContact CD-CD1 3.45Å; E325-I435 WeakPolarHBondContact OE1-CD1 3.45Å; E325-I435 VanDerWaalsContact OE2-CD1 3.27Å; E325-I435 WeakPolarHBondContact OE2-CD1 3.2Å
326I97.8Very high92.8Very high3 Ų327.2 Ų27.22%0.01514%0.144CC..Hα-helixtrans-63.8-45.5175.3-55.5174.3000109.8L244 I289 I294 C320 D323 S328 V329 I330L244-I326 HydrophobicContact CD1-CB 4.07Å; L244-I326 HydrophobicContact CD1-CD1 4.01Å; L244-I326 HydrophobicContact CD1-CG2 4.14Å; L244-I326 HydrophobicContact CD2-CD1 3.75Å; I289-I326 HydrophobicContact CD1-CG2 4.04Å; I294-I326 HydrophobicContact CB-CD1 4.43Å; I294-I326 HydrophobicContact CG1-CD1 4.06Å; I294-I326 HydrophobicContact CG2-CD1 4.33Å; C320-I326 HydrophobicContact CB-CD1 4.11Å; C320-I326 HydrophobicContact CB-CG1 3.39Å; D323-I326 CarbonylContact O-C 3.59Å; D323-I326 WeakPolarHBondContact O-CA 3.48Å; D323-I326 WeakPolarHBondContact O-CB 3.46Å; D323-I326 PolarHBondContact O-N 2.92Å; I326-S328 PolarHBondContact O-N 3.45Å; I326-V329 PolarHBondContact O-N 2.83Å; I326-V329 VanDerWaalsContact O-N 3.15Å; I326-I330 HydrophobicContact CG2-CG1 4.4Å; I326-I330 WeakPolarHBondContact O-CG1 3.42Å; I326-I330 PolarHBondContact O-N 3.17Å
327L98.2Very high94.5Very high6 Ų624.8 Ų24.83%0.03113%0.13CC..Hα-helixtrans-59-33.8175.7-88.893.3000112.2L244 K247 I248 L251 D323 I330 A331 Y425L244-L327 HydrophobicContact CD1-CD1 4.03Å; K247-L327 HydrophobicContact CB-CD1 3.69Å; K247-L327 HydrophobicContact CB-CD2 3.78Å; K247-L327 HydrophobicContact CB-CG 4.28Å; K247-L327 HydrophobicContact CD-CD1 4.05Å; I248-L327 HydrophobicContact CG1-CD1 4.39Å; I248-L327 HydrophobicContact CG1-CG 4.37Å; L251-L327 HydrophobicContact CB-CD2 4.22Å; L251-L327 HydrophobicContact CD2-CB 4.36Å; L251-L327 HydrophobicContact CD2-CD2 4.13Å; L251-L327 HydrophobicContact CD2-CG 4.37Å; D323-L327 HydrophobicContact CB-CD1 4.04Å; D323-L327 WeakPolarHBondContact O-CD1 3.44Å; D323-L327 PolarHBondContact O-N 3.45Å; L327-I330 PolarHBondContact O-N 3.43Å; L327-A331 VanDerWaalsContact O-CB 3.24Å; L327-A331 WeakPolarHBondContact O-CB 3.42Å; L327-A331 PolarHBondContact O-N 3.25Å; L327-Y425 HydrophobicContact CB-CD1 4.25Å; L327-Y425 HydrophobicContact CB-CE1 3.64Å; L327-Y425 HydrophobicContact CD2-CE1 4.14Å; L327-Y425 VanDerWaalsContact CD2-OH 3.28Å; L327-Y425 WeakPolarHBondContact CD2-OH 3.44Å
328S97.8Very high95.6Very high0 Ų024.8 Ų24.80%013%0.128CC..Hα-helixtrans-67.6-40.1176.878.90000112.7E324 E325 I326 A331 H332 Y428 L429 A432E324-S328 WeakPolarHBondContact O-CB 3.49Å; E324-S328 PolarHBondContact O-N 3.04Å; E325-S328 WeakPolarHBondContact O-CB 3.33Å; E325-S328 PolarHBondContact O-N 3.35Å; E325-S328 PolarHBondContact O-OG 3.28Å; I326-S328 PolarHBondContact O-N 3.45Å; S328-A331 PolarHBondContact O-N 3.43Å; S328-H332 PolarHBondContact O-N 3.02Å; S328-Y428 PolarHBondContact OG-O 2.96Å; S328-L429 VanDerWaalsContact OG-CA 3.25Å; S328-L429 WeakPolarHBondContact OG-CA 3.44Å; S328-L429 PolarHBondContact OG-N 3.35Å; S328-A432 WeakPolarHBondContact OG-CB 3.35Å
329V98Very high96.2Very high8 Ų826.4 Ų26.45%0.04814%0.139CC..Hα-helixtrans-64.2-46.8173.2179.70000109.4A276 L293 E325 I326 A331 H332 E333 A432 L436A276-V329 HydrophobicContact CB-CG1 4.11Å; L293-V329 HydrophobicContact CD2-CG1 4.39Å; E325-V329 PolarHBondContact O-N 3.49Å; I326-V329 PolarHBondContact O-N 2.83Å; I326-V329 VanDerWaalsContact O-N 3.15Å; V329-A331 VanDerWaalsContact C-N 3.31Å; V329-A331 PolarHBondContact O-N 2.86Å; V329-H332 WeakPolarHBondContact O-CB 3.48Å; V329-H332 PolarHBondContact O-N 3.49Å; V329-H332 VanDerWaalsContact O-N 3.15Å; V329-E333 WeakPolarHBondContact O-CG 3.29Å; V329-E333 PolarHBondContact O-N 3.16Å; V329-A432 HydrophobicContact CG2-CB 3.65Å; V329-L436 HydrophobicContact CG2-CD1 4.15Å
330I98.3Very high96.5Very high1 Ų127 Ų271%0.00515%0.145CC..Hα-helixtrans-62-38.6175.8-62.6-52.5000111.6I248 L251 A276 I287 I289 I326 L327 H332 E333 L334I248-I330 HydrophobicContact CG2-CG2 4.35Å; L251-I330 HydrophobicContact CD2-CG2 4.24Å; A276-I330 HydrophobicContact CB-CD1 3.98Å; I287-I330 HydrophobicContact CD1-CG2 4.06Å; I287-I330 HydrophobicContact CG2-CD1 3.63Å; I289-I330 HydrophobicContact CD1-CD1 4.22Å; I289-I330 HydrophobicContact CD1-CG1 4.44Å; I289-I330 HydrophobicContact CG1-CD1 4.14Å; I326-I330 HydrophobicContact CG2-CG1 4.4Å; I326-I330 WeakPolarHBondContact O-CG1 3.42Å; I326-I330 PolarHBondContact O-N 3.17Å; L327-I330 PolarHBondContact O-N 3.43Å; I330-H332 VanDerWaalsContact C-N 3.3Å; I330-H332 PolarHBondContact O-N 3.06Å; I330-E333 PolarHBondContact O-N 3.06Å; I330-L334 HydrophobicContact CG2-CD1 3.75Å; I330-L334 HydrophobicContact CG2-CG 3.97Å; I330-L334 VanDerWaalsContact O-CB 3.24Å; I330-L334 WeakPolarHBondContact O-CB 3.45Å; I330-L334 WeakPolarHBondContact O-CG 3.05Å; I330-L334 PolarHBondContact O-N 2.94Å
331A98.2Very high96.7Very high0 Ų026.9 Ų26.90%015%0.145CC..Hα-helixtrans-62.6-38.517600000111.7L251 L327 S328 V329 G335 A420 L423 Y425L251-A331 HydrophobicContact CD2-CB 4.06Å; L327-A331 VanDerWaalsContact O-CB 3.24Å; L327-A331 WeakPolarHBondContact O-CB 3.42Å; L327-A331 PolarHBondContact O-N 3.25Å; S328-A331 PolarHBondContact O-N 3.43Å; V329-A331 VanDerWaalsContact C-N 3.31Å; V329-A331 PolarHBondContact O-N 2.86Å; A331-G335 PolarHBondContact O-N 3.42Å; A331-A420 HydrophobicContact CB-CB 3.85Å; A331-L423 HydrophobicContact CB-CD1 4.3Å; A331-Y425 HydrophobicContact CB-CD2 3.87Å; A331-Y425 HydrophobicContact CB-CE2 4.34Å; A331-Y425 HydrophobicContact CB-CG 4.45Å
332H97.9Very high97Very high9 Ų926.8 Ų26.84%0.04214%0.138CC..Hα-helixtrans-62.7-51.5172.3168.795000110.8S328 V329 I330 L334 G335 H336 E413 D417 A420 L429 R463S328-H332 PolarHBondContact O-N 3.02Å; V329-H332 WeakPolarHBondContact O-CB 3.48Å; V329-H332 PolarHBondContact O-N 3.49Å; V329-H332 VanDerWaalsContact O-N 3.15Å; I330-H332 VanDerWaalsContact C-N 3.3Å; I330-H332 PolarHBondContact O-N 3.06Å; H332-L334 VanDerWaalsContact C-N 3.31Å; H332-L334 PolarHBondContact O-N 3.11Å; H332-G335 VanDerWaalsContact O-CA 3.3Å; H332-G335 WeakPolarHBondContact O-CA 3.31Å; H332-G335 PolarHBondContact O-N 2.89Å; H332-H336 AromaticContact CD2-NE2 3.93Å; H332-H336 AromaticContact CE1-NE2 3.55Å; H332-H336 AromaticContact NE2-CD2 3.83Å; H332-H336 AromaticContact NE2-NE2 3.24Å; H332-H336 PolarHBondContact NE2-NE2 3.4Å; H332-H336 PolarHBondContact O-CD2 3.21Å; H332-H336 PolarHBondContact O-N 3.41Å; H332-E413 IonicContact CE1-OE2 3.75Å; H332-E413 PolarHBondContact CE1-OE2 2.82Å; H332-E413 IonicContact NE2-OE2 2.97Å; H332-E413 PolarHBondContact NE2-OE2 3.36Å; H332-D417 IonicContact CE1-OD1 3.71Å; H332-D417 PolarHBondContact CE1-OD1 3.44Å; H332-D417 VanDerWaalsContact CE1-OD1 3.31Å; H332-D417 IonicContact CG-OD1 2.69Å; H332-D417 IonicContact ND1-OD1 2.86Å; H332-D417 PolarHBondContact ND1-OD1 3.34Å; H332-A420 HydrophobicContact CB-CB 4.29Å; H332-L429 HydrophobicContact CB-CD1 4.26Å; H332-R463 PolarHBondContact CE1-NH2 3.32Å; H332-R463 PolarHBondContact ND1-NH2 3.16Å
333E97.8Very high97Very high37 Ų3728.6 Ų28.617%0.17315%0.149CC..Hα-helixtrans-55.7-45.8176.5-68.9-51.2132.700112F278 V329 I330 G335 H336 W337F278-E333 HydrophobicContact CD1-CB 4.14Å; F278-E333 WeakPolarHBondContact CE1-O 3.47Å; V329-E333 WeakPolarHBondContact O-CG 3.29Å; V329-E333 PolarHBondContact O-N 3.16Å; I330-E333 PolarHBondContact O-N 3.06Å; E333-G335 PolarHBondContact O-N 3.23Å; E333-H336 WeakPolarHBondContact O-CB 3.24Å; E333-H336 PolarHBondContact O-N 2.7Å; E333-H336 VanDerWaalsContact O-N 3.11Å; E333-W337 PolarHBondContact O-N 3.4Å
334L97.6Very high97.1Very high1 Ų133.2 Ų33.21%0.00516%0.164CC..Hα-helixtrans-66.4-26.6176.4-71-178.8000112.8L251 I255 F257 I287 I330 H332 W337 K338L251-L334 HydrophobicContact CD2-CD1 4.3Å; L251-L334 HydrophobicContact CG-CD1 4.09Å; I255-L334 HydrophobicContact CD1-CB 3.54Å; I255-L334 HydrophobicContact CD1-CD1 3.72Å; I255-L334 HydrophobicContact CD1-CD2 4.28Å; I255-L334 HydrophobicContact CD1-CG 4.04Å; F257-L334 HydrophobicContact CB-CD2 4.05Å; F257-L334 HydrophobicContact CD1-CD2 3.84Å; F257-L334 HydrophobicContact CD2-CD2 3.33Å; F257-L334 HydrophobicContact CE1-CD2 4.02Å; F257-L334 HydrophobicContact CE2-CD2 3.55Å; F257-L334 HydrophobicContact CG-CD2 3.48Å; F257-L334 VanDerWaalsContact CG-CD2 3.48Å; F257-L334 HydrophobicContact CZ-CD2 3.87Å; I287-L334 HydrophobicContact CD1-CD2 4.25Å; I330-L334 HydrophobicContact CG2-CD1 3.75Å; I330-L334 HydrophobicContact CG2-CG 3.97Å; I330-L334 VanDerWaalsContact O-CB 3.24Å; I330-L334 WeakPolarHBondContact O-CB 3.45Å; I330-L334 WeakPolarHBondContact O-CG 3.05Å; I330-L334 PolarHBondContact O-N 2.94Å; H332-L334 VanDerWaalsContact C-N 3.31Å; H332-L334 PolarHBondContact O-N 3.11Å; L334-W337 PolarHBondContact O-N 3.01Å; L334-K338 WeakPolarHBondContact O-CB 3.48Å; L334-K338 PolarHBondContact O-N 3.32Å
335G97.6Very high97Very high0 Ų033.7 Ų33.70%017%0.168CC..Hα-helixtrans-59.2-44169.100000112A331 H332 E333 W337 K338 L339A331-G335 PolarHBondContact O-N 3.42Å; H332-G335 VanDerWaalsContact O-CA 3.3Å; H332-G335 WeakPolarHBondContact O-CA 3.31Å; H332-G335 PolarHBondContact O-N 2.89Å; E333-G335 PolarHBondContact O-N 3.23Å; G335-W337 VanDerWaalsContact C-N 3.25Å; G335-W337 PolarHBondContact O-N 3.44Å; G335-K338 PolarHBondContact O-N 3.5Å; G335-L339 WeakPolarHBondContact O-CB 3.24Å; G335-L339 WeakPolarHBondContact O-CG 3.36Å; G335-L339 PolarHBondContact O-N 2.94Å
336H97.4Very high97Very high21 Ų2135.6 Ų35.610%0.09718%0.179CC..Hα-helixtrans-60.3-35.5175.1-72.2-86.8000113F278 H332 E333 H341 E413 A416F278-H336 HydrophobicContact CE1-CB 4.16Å; F278-H336 HydrophobicContact CZ-CB 4.48Å; H332-H336 AromaticContact CD2-NE2 3.93Å; H332-H336 AromaticContact CE1-NE2 3.55Å; H332-H336 AromaticContact NE2-CD2 3.83Å; H332-H336 AromaticContact NE2-NE2 3.24Å; H332-H336 PolarHBondContact NE2-NE2 3.4Å; H332-H336 PolarHBondContact O-CD2 3.21Å; H332-H336 PolarHBondContact O-N 3.41Å; E333-H336 WeakPolarHBondContact O-CB 3.24Å; E333-H336 PolarHBondContact O-N 2.7Å; E333-H336 VanDerWaalsContact O-N 3.11Å; H336-H341 HydrophobicContact CB-CB 4.31Å; H336-H341 AromaticContact CE1-ND1 3.84Å; H336-H341 AromaticContact CG-ND1 3.68Å; H336-H341 AromaticContact ND1-CG 3.9Å; H336-H341 AromaticContact ND1-ND1 3.08Å; H336-H341 PolarHBondContact ND1-ND1 2.87Å; H336-H341 WeakPolarHBondContact O-CB 3.32Å; H336-H341 PolarHBondContact O-N 3.4Å; H336-E413 IonicContact CE1-OE1 3.48Å; H336-E413 PolarHBondContact CE1-OE1 2.9Å; H336-E413 IonicContact NE2-OE1 2.71Å; H336-E413 PolarHBondContact NE2-OE1 2.89Å; H336-A416 VanDerWaalsContact NE2-CB 3.31Å; H336-A416 WeakPolarHBondContact NE2-CB 3.48Å
337W96.5Very high97Very high56 Ų5642.6 Ų42.621%0.21221%0.209CC..Hα-helixtrans-70.3-51.1173174.876.7000111.9I255 K256 F257 P258 F278 E333 L334 G335 L339 G340I255-W337 HydrophobicContact CD1-CE3 4.42Å; I255-W337 HydrophobicContact CD1-CZ3 4.42Å; K256-W337 VanDerWaalsContact O-CH2 3.28Å; K256-W337 WeakPolarHBondContact O-CH2 3.43Å; F257-W337 HydrophobicContact CB-CE3 4.17Å; F257-W337 HydrophobicContact CB-CH2 4.31Å; F257-W337 HydrophobicContact CB-CZ3 3.92Å; F257-W337 HydrophobicContact CD2-CB 4.13Å; F257-W337 AromaticContact CD2-CD2 3.38Å; F257-W337 HydrophobicContact CD2-CD2 3.38Å; F257-W337 AromaticContact CD2-CE2 3.84Å; F257-W337 AromaticContact CD2-CE3 3.52Å; F257-W337 HydrophobicContact CD2-CE3 3.52Å; F257-W337 AromaticContact CD2-CG 3.64Å; F257-W337 HydrophobicContact CD2-CG 3.64Å; F257-W337 HydrophobicContact CD2-CH2 4.47Å; F257-W337 HydrophobicContact CD2-CZ2 4.38Å; F257-W337 HydrophobicContact CD2-CZ3 4.06Å; F257-W337 HydrophobicContact CE2-CB 3.96Å; F257-W337 AromaticContact CE2-CD1 4Å; F257-W337 AromaticContact CE2-CD2 3.92Å; F257-W337 HydrophobicContact CE2-CD2 3.92Å; F257-W337 HydrophobicContact CE2-CE3 4.44Å; F257-W337 AromaticContact CE2-CG 3.65Å; F257-W337 HydrophobicContact CE2-CG 3.65Å; F257-W337 HydrophobicContact CG-CD2 4.46Å; F257-W337 HydrophobicContact CG-CE3 4.33Å; F257-W337 HydrophobicContact CG-CZ3 4.48Å; P258-W337 HydrophobicContact CG-CZ2 4.44Å; F278-W337 HydrophobicContact CE1-CB 4.25Å; F278-W337 HydrophobicContact CE2-CB 3.84Å; F278-W337 HydrophobicContact CE2-CG 4.36Å; F278-W337 HydrophobicContact CZ-CB 3.6Å; E333-W337 PolarHBondContact O-N 3.4Å; L334-W337 PolarHBondContact O-N 3.01Å; G335-W337 VanDerWaalsContact C-N 3.25Å; G335-W337 PolarHBondContact O-N 3.44Å; W337-L339 VanDerWaalsContact C-N 3.28Å; W337-L339 PolarHBondContact O-N 2.76Å; W337-G340 PolarHBondContact O-N 3.32Å
338K96.1Very high97Very high101 Ų10145.1 Ų45.144%0.43922%0.222SC..Hα-helixtrans-63.7-35.7-172.2-172.762.6171-167.90112.5I255 L334 G335 G340 F419I255-K338 PolarHBondContact O-NZ 3.37Å; L334-K338 WeakPolarHBondContact O-CB 3.48Å; L334-K338 PolarHBondContact O-N 3.32Å; G335-K338 PolarHBondContact O-N 3.5Å; K338-G340 VanDerWaalsContact C-N 3.28Å; K338-F419 HydrophobicContact CB-CE1 4.46Å; K338-F419 HydrophobicContact CB-CE2 4.11Å; K338-F419 HydrophobicContact CB-CZ 3.93Å; K338-F419 HydrophobicContact CG-CE2 3.72Å; K338-F419 HydrophobicContact CG-CZ 3.81Å
339L97.1Very high97Very high68 Ų6846.9 Ų46.936%0.35624%0.24SC..THydrogen-bonded Turntrans-85.3-0.2178-62.4170.4000113.1G335 W337 H341 Q415 F419G335-L339 WeakPolarHBondContact O-CB 3.24Å; G335-L339 WeakPolarHBondContact O-CG 3.36Å; G335-L339 PolarHBondContact O-N 2.94Å; W337-L339 VanDerWaalsContact C-N 3.28Å; W337-L339 PolarHBondContact O-N 2.76Å; L339-H341 VanDerWaalsContact C-N 3.31Å; L339-H341 VanDerWaalsContact CB-NE2 3.3Å; L339-H341 WeakPolarHBondContact CB-NE2 3.38Å; L339-H341 PolarHBondContact O-N 2.96Å; L339-Q415 HydrophobicContact CD1-CB 3.7Å; L339-F419 HydrophobicContact CD1-CB 4.4Å
340G96Very high97Very high17 Ų1748.4 Ų48.418%0.17525%0.246CC..THydrogen-bonded Turntrans73.815.117500000114.8W337 K338 T342 V343 Y344W337-G340 PolarHBondContact O-N 3.32Å; K338-G340 VanDerWaalsContact C-N 3.28Å; G340-T342 VanDerWaalsContact C-N 3.27Å; G340-T342 PolarHBondContact O-N 3.46Å; G340-V343 WeakPolarHBondContact O-CA 3.45Å; G340-V343 WeakPolarHBondContact O-CB 3.33Å; G340-V343 PolarHBondContact O-N 3.32Å; G340-Y344 WeakPolarHBondContact O-CD2 3.31Å; G340-Y344 PolarHBondContact O-N 3.43Å
341H97.7Very high97Very high2 Ų250.6 Ų50.61%0.00927%0.265CS..Hα-helixtrans-55.1-42.6-176.8-60.5164000112.2H336 L339 V343 Y344 N345 F412 Q415H336-H341 HydrophobicContact CB-CB 4.31Å; H336-H341 AromaticContact CE1-ND1 3.84Å; H336-H341 AromaticContact CG-ND1 3.68Å; H336-H341 AromaticContact ND1-CG 3.9Å; H336-H341 AromaticContact ND1-ND1 3.08Å; H336-H341 PolarHBondContact ND1-ND1 2.87Å; H336-H341 WeakPolarHBondContact O-CB 3.32Å; H336-H341 PolarHBondContact O-N 3.4Å; L339-H341 VanDerWaalsContact C-N 3.31Å; L339-H341 VanDerWaalsContact CB-NE2 3.3Å; L339-H341 WeakPolarHBondContact CB-NE2 3.38Å; L339-H341 PolarHBondContact O-N 2.96Å; H341-V343 VanDerWaalsContact C-N 3.31Å; H341-V343 PolarHBondContact O-N 3.29Å; H341-Y344 PolarHBondContact O-N 2.93Å; H341-N345 WeakPolarHBondContact O-CB 3.35Å; H341-N345 PolarHBondContact O-N 3.41Å; H341-F412 HydrophobicContact CB-CB 4.38Å; H341-F412 HydrophobicContact CB-CD2 3.71Å; H341-F412 HydrophobicContact CB-CE2 4.02Å; H341-F412 HydrophobicContact CB-CG 3.98Å; H341-F412 AromaticContact CD2-CD1 3.25Å; H341-F412 WeakPolarHBondContact CD2-CD1 3.11Å; H341-F412 AromaticContact CD2-CE1 3.56Å; H341-F412 AromaticContact CD2-CG 3.52Å; H341-F412 AromaticContact CE1-CD1 3.94Å; H341-F412 AromaticContact CE1-CG 3.93Å; H341-F412 PolarHBondContact CE1-O 3.4Å; H341-F412 AromaticContact CG-CD1 3.77Å; H341-F412 AromaticContact CG-CD2 3.79Å; H341-F412 AromaticContact CG-CG 3.5Å; H341-F412 VanDerWaalsContact CG-CG 3.5Å; H341-F412 WeakPolarHBondContact ND1-CB 3.38Å; H341-F412 AromaticContact ND1-CG 3.76Å; H341-F412 AromaticContact NE2-CD1 3.4Å; H341-F412 WeakPolarHBondContact NE2-CD1 3.46Å; H341-F412 AromaticContact NE2-CG 3.81Å; H341-Q415 PolarHBondContact NE2-OE1 3.38Å
342T93.4Very high97Very high58 Ų5852.3 Ų52.336%0.35627%0.274SS..Hα-helixtrans-64.7-34.5177.352.90000112.7F278 G340 L346F278-T342 HydrophobicContact CE2-CG2 4.33Å; F278-T342 HydrophobicContact CZ-CG2 3.75Å; G340-T342 VanDerWaalsContact C-N 3.27Å; G340-T342 PolarHBondContact O-N 3.46Å; T342-L346 WeakPolarHBondContact O-CB 3.48Å; T342-L346 PolarHBondContact O-N 2.78Å
343V94.8Very high97Very high98 Ų9853.4 Ų53.459%0.59428%0.28SS*.Hα-helixtrans-72.7-42.5176.7179.90000110.7G340 H341 L346 F347G340-V343 WeakPolarHBondContact O-CA 3.45Å; G340-V343 WeakPolarHBondContact O-CB 3.33Å; G340-V343 PolarHBondContact O-N 3.32Å; H341-V343 VanDerWaalsContact C-N 3.31Å; H341-V343 PolarHBondContact O-N 3.29Å; V343-L346 PolarHBondContact O-N 2.91Å; V343-F347 PolarHBondContact O-N 3.28Å
344Y97.1Very high97Very high140 Ų14054.7 Ų54.755%0.54929%0.287SS..Hα-helixtrans-59.1-49.3173.8-76.3-64.5000111.6G340 H341 L346 F347 I348 F412G340-Y344 WeakPolarHBondContact O-CD2 3.31Å; G340-Y344 PolarHBondContact O-N 3.43Å; H341-Y344 PolarHBondContact O-N 2.93Å; Y344-L346 VanDerWaalsContact C-N 3.3Å; Y344-L346 PolarHBondContact O-N 3.01Å; Y344-F347 PolarHBondContact O-N 3.01Å; Y344-I348 WeakPolarHBondContact O-CB 3.48Å; Y344-I348 VanDerWaalsContact O-CG1 3.31Å; Y344-I348 WeakPolarHBondContact O-CG1 3.28Å; Y344-I348 PolarHBondContact O-N 3.03Å; Y344-F412 HydrophobicContact CD2-CZ 4.31Å; Y344-F412 HydrophobicContact CG-CZ 4.39Å
345N96.1Very high97Very high64 Ų6457.9 Ų57.934%0.34230%0.303SS..Hα-helixtrans-60.6-40.2178.1-75.3-13.9000111.8H341 G349H341-N345 WeakPolarHBondContact O-CB 3.35Å; H341-N345 PolarHBondContact O-N 3.41Å; N345-G349 PolarHBondContact O-N 3.36Å
346L95.5Very high97.1Very high58 Ų5858.5 Ų58.530%0.30431%0.306SS..Hα-helixtrans-61.7-48.2175.3-176.966.2000111.3M222 T342 V343 Y344 G349 K350M222-L346 HydrophobicContact CE-CD1 3.96Å; M222-L346 HydrophobicContact SD-CD1 4.07Å; T342-L346 WeakPolarHBondContact O-CB 3.48Å; T342-L346 PolarHBondContact O-N 2.78Å; V343-L346 PolarHBondContact O-N 2.91Å; Y344-L346 VanDerWaalsContact C-N 3.3Å; Y344-L346 PolarHBondContact O-N 3.01Å; L346-G349 PolarHBondContact O-N 3.26Å; L346-K350 VanDerWaalsContact O-CG 3.31Å; L346-K350 WeakPolarHBondContact O-CG 3.42Å; L346-K350 PolarHBondContact O-N 3.01Å
347F97.6Very high97.1Very high150 Ų15057.8 Ų57.866%0.65830%0.303SS*.Hα-helixtrans-65-48.1-178.8-178-97.5000112.3V343 Y344 G349 K350 A351V343-F347 PolarHBondContact O-N 3.28Å; Y344-F347 PolarHBondContact O-N 3.01Å; F347-G349 VanDerWaalsContact C-N 3.3Å; F347-G349 PolarHBondContact O-N 3.33Å; F347-K350 PolarHBondContact O-N 2.83Å; F347-K350 VanDerWaalsContact O-N 3.14Å; F347-A351 WeakPolarHBondContact O-CB 3.25Å; F347-A351 PolarHBondContact O-N 3.44Å
348I98.3Very high97.2Very high59 Ų5957.6 Ų57.630%0.30331%0.308SS..Hα-helixtrans-57.9-46176.5-68.1166.8000110Y344 K350 A351 N352 M405 L408Y344-I348 WeakPolarHBondContact O-CB 3.48Å; Y344-I348 VanDerWaalsContact O-CG1 3.31Å; Y344-I348 WeakPolarHBondContact O-CG1 3.28Å; Y344-I348 PolarHBondContact O-N 3.03Å; I348-K350 VanDerWaalsContact C-N 3.32Å; I348-K350 PolarHBondContact O-N 3.29Å; I348-A351 PolarHBondContact O-N 3.12Å; I348-N352 WeakPolarHBondContact O-CB 3.5Å; I348-N352 PolarHBondContact O-N 2.77Å; I348-M405 HydrophobicContact CG2-SD 3.82Å; I348-L408 HydrophobicContact CD1-CD2 3.61Å
349G97.8Very high97.2Very high37 Ų3755.5 Ų55.538%0.38130%0.301SS..Hα-helixtrans-59.8-4017700000112.9N345 L346 F347 L353N345-G349 PolarHBondContact O-N 3.36Å; L346-G349 PolarHBondContact O-N 3.26Å; F347-G349 VanDerWaalsContact C-N 3.3Å; F347-G349 PolarHBondContact O-N 3.33Å; G349-L353 VanDerWaalsContact O-CB 3.29Å; G349-L353 WeakPolarHBondContact O-CB 3.3Å; G349-L353 PolarHBondContact O-N 2.86Å
350K97.9Very high97.2Very high40 Ų4052.3 Ų52.317%0.17428%0.284CS..Hα-helixtrans-73.9-38178.1-63.2-28.4-175.4-176.10112.8F211 V215 T218 L346 F347 I348 L353 L354F211-K350 WeakPolarHBondContact CE2-O 3.33Å; V215-K350 HydrophobicContact CG2-CD 4.2Å; T218-K350 PolarHBondContact OG1-NZ 3.16Å; L346-K350 VanDerWaalsContact O-CG 3.31Å; L346-K350 WeakPolarHBondContact O-CG 3.42Å; L346-K350 PolarHBondContact O-N 3.01Å; F347-K350 PolarHBondContact O-N 2.83Å; F347-K350 VanDerWaalsContact O-N 3.14Å; I348-K350 VanDerWaalsContact C-N 3.32Å; I348-K350 PolarHBondContact O-N 3.29Å; K350-L353 PolarHBondContact O-N 2.84Å; K350-L354 PolarHBondContact O-N 3.48Å
351A98.3Very high97.2Very high47 Ų4752.1 Ų52.139%0.38828%0.282SS..Hα-helixtrans-63.9-44.6174.800000111.3F347 I348 L354 M355F347-A351 WeakPolarHBondContact O-CB 3.25Å; F347-A351 PolarHBondContact O-N 3.44Å; I348-A351 PolarHBondContact O-N 3.12Å; A351-L354 PolarHBondContact O-N 3.22Å; A351-M355 PolarHBondContact O-N 3.1Å; A351-M355 VanDerWaalsContact O-N 3.09Å
352N98.2Very high97Very high35 Ų3558.1 Ų58.119%0.18731%0.314CS..Hα-helixtrans-59.2-49.5173.3-18034.7000111.2I348 L354 M355 L356 Y397I348-N352 WeakPolarHBondContact O-CB 3.5Å; I348-N352 PolarHBondContact O-N 2.77Å; N352-L354 VanDerWaalsContact C-N 3.3Å; N352-L354 PolarHBondContact O-N 3.32Å; N352-M355 WeakPolarHBondContact O-CB 3.29Å; N352-M355 PolarHBondContact O-N 3.41Å; N352-L356 WeakPolarHBondContact O-CG 3.33Å; N352-L356 PolarHBondContact O-N 3.3Å; N352-Y397 VanDerWaalsContact OD1-CE1 3.24Å; N352-Y397 WeakPolarHBondContact OD1-CE1 3.47Å; N352-Y397 PolarHBondContact OD1-OH 2.96Å
353L98.1Very high97Very high32 Ų3257.5 Ų57.517%0.16831%0.308CS..Hα-helixtrans-57.4-42179.2-174.965.9000112.5F211 T214 V215 G349 K350 L356 F357F211-L353 HydrophobicContact CD2-CB 4.44Å; F211-L353 HydrophobicContact CD2-CD2 4.21Å; F211-L353 HydrophobicContact CD2-CG 4.07Å; F211-L353 HydrophobicContact CE2-CB 4.38Å; F211-L353 HydrophobicContact CE2-CD2 4.37Å; F211-L353 HydrophobicContact CE2-CG 4.4Å; T214-L353 HydrophobicContact CG2-CD1 4.46Å; T214-L353 HydrophobicContact CG2-CD2 3.83Å; V215-L353 HydrophobicContact CG2-CD2 4.17Å; G349-L353 VanDerWaalsContact O-CB 3.29Å; G349-L353 WeakPolarHBondContact O-CB 3.3Å; G349-L353 PolarHBondContact O-N 2.86Å; K350-L353 PolarHBondContact O-N 2.84Å; L353-L356 PolarHBondContact O-N 2.74Å; L353-F357 HydrophobicContact CD1-CD2 3.96Å; L353-F357 HydrophobicContact CD1-CE2 3.67Å; L353-F357 HydrophobicContact CG-CD2 3.97Å; L353-F357 HydrophobicContact CG-CE2 3.97Å; L353-F357 WeakPolarHBondContact O-CD2 3.27Å; L353-F357 PolarHBondContact O-N 2.97Å
354L98.5Very high96.8Very high64 Ų6453.4 Ų53.434%0.33528%0.283SS..Hα-helixtrans-59.6-47.9174.7176.360.3000110.9L208 F211 K350 A351 N352 L356 F357 V358L208-L354 HydrophobicContact CD2-CD1 4.05Å; F211-L354 HydrophobicContact CB-CD1 4.47Å; F211-L354 HydrophobicContact CD1-CD1 3.72Å; F211-L354 HydrophobicContact CD2-CB 3.9Å; F211-L354 HydrophobicContact CD2-CD1 4.21Å; F211-L354 HydrophobicContact CE1-CB 4.4Å; F211-L354 HydrophobicContact CE1-CD1 3.94Å; F211-L354 HydrophobicContact CE2-CB 3.6Å; F211-L354 HydrophobicContact CE2-CD1 4.41Å; F211-L354 HydrophobicContact CG-CB 4.42Å; F211-L354 HydrophobicContact CG-CD1 3.86Å; F211-L354 HydrophobicContact CZ-CB 3.87Å; F211-L354 HydrophobicContact CZ-CD1 4.27Å; F211-L354 HydrophobicContact CZ-CG 4.48Å; K350-L354 PolarHBondContact O-N 3.48Å; A351-L354 PolarHBondContact O-N 3.22Å; N352-L354 VanDerWaalsContact C-N 3.3Å; N352-L354 PolarHBondContact O-N 3.32Å; L354-L356 VanDerWaalsContact C-N 3.34Å; L354-L356 PolarHBondContact O-N 3.48Å; L354-F357 PolarHBondContact O-N 3.44Å; L354-V358 HydrophobicContact CD1-CG2 4.15Å; L354-V358 HydrophobicContact CG-CG2 4.44Å; L354-V358 WeakPolarHBondContact O-CG2 3.19Å; L354-V358 PolarHBondContact O-N 3.26Å
355M97.7Very high96.3Very high69 Ų6952.8 Ų52.834%0.3429%0.289SS..Hα-helixtrans-59.8-44.6179.3-165.5-164.575.500111.6A351 N352 F357 V358 I359 Y397A351-M355 PolarHBondContact O-N 3.1Å; A351-M355 VanDerWaalsContact O-N 3.09Å; N352-M355 WeakPolarHBondContact O-CB 3.29Å; N352-M355 PolarHBondContact O-N 3.41Å; M355-F357 VanDerWaalsContact C-N 3.35Å; M355-F357 PolarHBondContact O-N 3.32Å; M355-V358 PolarHBondContact O-N 2.94Å; M355-I359 HydrophobicContact CE-CD1 3.93Å; M355-I359 HydrophobicContact CG-CD1 4.09Å; M355-I359 WeakPolarHBondContact O-CG1 3.28Å; M355-I359 PolarHBondContact O-N 3.38Å; M355-I359 HydrophobicContact SD-CD1 4.48Å; M355-Y397 HydrophobicContact CE-CD1 4.46Å; M355-Y397 HydrophobicContact CE-CD2 4.17Å; M355-Y397 HydrophobicContact CE-CE1 3.74Å; M355-Y397 HydrophobicContact CE-CE2 3.4Å; M355-Y397 WeakPolarHBondContact CE-OH 3.24Å
356L98.2Very high96Very high13 Ų1352.7 Ų52.77%0.06829%0.29CS..Hα-helixtrans-60.7-42176.7-65.8-174.5000112N352 L353 L354 I359 F360 F390 F394 Y397N352-L356 WeakPolarHBondContact O-CG 3.33Å; N352-L356 PolarHBondContact O-N 3.3Å; L353-L356 PolarHBondContact O-N 2.74Å; L354-L356 VanDerWaalsContact C-N 3.34Å; L354-L356 PolarHBondContact O-N 3.48Å; L356-I359 PolarHBondContact O-N 3Å; L356-F360 VanDerWaalsContact O-CB 3.27Å; L356-F360 WeakPolarHBondContact O-CB 3.27Å; L356-F360 PolarHBondContact O-N 3.28Å; L356-F390 HydrophobicContact CB-CE1 3.85Å; L356-F390 HydrophobicContact CB-CZ 4.27Å; L356-F390 HydrophobicContact CD1-CD1 4.49Å; L356-F390 HydrophobicContact CD1-CE1 4.24Å; L356-F394 HydrophobicContact CB-CD2 4.34Å; L356-F394 HydrophobicContact CB-CE2 3.85Å; L356-F394 HydrophobicContact CD1-CD2 4.46Å; L356-F394 HydrophobicContact CD2-CD2 3.61Å; L356-F394 HydrophobicContact CD2-CE2 3.75Å; L356-F394 HydrophobicContact CD2-CG 4.04Å; L356-F394 HydrophobicContact CD2-CZ 4.27Å; L356-F394 HydrophobicContact CG-CD2 4.35Å; L356-F394 HydrophobicContact CG-CE2 4.3Å; L356-F394 WeakPolarHBondContact O-CZ 3.37Å; L356-Y397 HydrophobicContact CD2-CD1 3.74Å; L356-Y397 HydrophobicContact CD2-CE1 3.6Å; L356-Y397 HydrophobicContact CG-CE1 4.44Å
357F98.3Very high95.4Very high6 Ų651.8 Ų51.83%0.02629%0.286CS..Hα-helixtrans-68.6-38.1176-87.8-67.3000113Y207 A210 F211 T214 L353 L354 M355 F360 G361 F390Y207-F357 VanDerWaalsContact CB-O 3.28Å; Y207-F357 WeakPolarHBondContact CB-O 3.4Å; A210-F357 HydrophobicContact CB-CD1 3.98Å; A210-F357 HydrophobicContact CB-CE1 3.68Å; A210-F357 HydrophobicContact CB-CZ 4.27Å; F211-F357 HydrophobicContact CB-CB 4.05Å; F211-F357 HydrophobicContact CB-CD2 3.75Å; F211-F357 HydrophobicContact CB-CE2 4.45Å; F211-F357 HydrophobicContact CB-CG 4.02Å; F211-F357 HydrophobicContact CD2-CD2 4.32Å; T214-F357 HydrophobicContact CG2-CE2 4.38Å; L353-F357 HydrophobicContact CD1-CD2 3.96Å; L353-F357 HydrophobicContact CD1-CE2 3.67Å; L353-F357 HydrophobicContact CG-CD2 3.97Å; L353-F357 HydrophobicContact CG-CE2 3.97Å; L353-F357 WeakPolarHBondContact O-CD2 3.27Å; L353-F357 PolarHBondContact O-N 2.97Å; L354-F357 PolarHBondContact O-N 3.44Å; M355-F357 VanDerWaalsContact C-N 3.35Å; M355-F357 PolarHBondContact O-N 3.32Å; F357-F360 HydrophobicContact CD1-CD1 4.22Å; F357-F360 WeakPolarHBondContact O-CB 3.25Å; F357-F360 PolarHBondContact O-N 2.98Å; F357-G361 PolarHBondContact O-N 3.49Å; F357-F390 HydrophobicContact CD1-CZ 4.08Å; F357-F390 HydrophobicContact CE1-CE2 4.5Å; F357-F390 HydrophobicContact CE1-CZ 4.03Å; F357-F390 HydrophobicContact CG-CZ 4.35Å; F357-F390 HydrophobicContact CZ-CZ 4.29Å
358V98Very high94.8Very high52 Ų5248.9 Ų48.932%0.31528%0.277SS..Hα-helixtrans-60.8-48.1174.3169.80000110.3Y207 L354 M355 F360 G361 L362Y207-V358 HydrophobicContact CD2-CG2 4.06Å; Y207-V358 HydrophobicContact CE2-CG2 3.97Å; L354-V358 HydrophobicContact CD1-CG2 4.15Å; L354-V358 HydrophobicContact CG-CG2 4.44Å; L354-V358 WeakPolarHBondContact O-CG2 3.19Å; L354-V358 PolarHBondContact O-N 3.26Å; M355-V358 PolarHBondContact O-N 2.94Å; V358-F360 VanDerWaalsContact C-N 3.34Å; V358-F360 PolarHBondContact O-N 3.08Å; V358-G361 PolarHBondContact O-N 3.47Å; V358-L362 WeakPolarHBondContact O-CG 3.19Å; V358-L362 PolarHBondContact O-N 3.09Å; V358-L362 VanDerWaalsContact O-N 3.16Å
359I97Very high94.2Very high57 Ų5746.7 Ų46.729%0.29227%0.266SS..Hα-helixtrans-66.7-38.5178.3-61.1168.8000110.7M355 L356 G361 L362 L363 F394M355-I359 HydrophobicContact CE-CD1 3.93Å; M355-I359 HydrophobicContact CG-CD1 4.09Å; M355-I359 WeakPolarHBondContact O-CG1 3.28Å; M355-I359 PolarHBondContact O-N 3.38Å; M355-I359 HydrophobicContact SD-CD1 4.48Å; L356-I359 PolarHBondContact O-N 3Å; I359-G361 VanDerWaalsContact C-N 3.29Å; I359-G361 PolarHBondContact O-N 2.85Å; I359-L362 WeakPolarHBondContact O-CB 3.37Å; I359-L362 PolarHBondContact O-N 2.85Å; I359-L362 VanDerWaalsContact O-N 3.08Å; I359-L363 HydrophobicContact CG2-CD1 3.78Å; I359-L363 HydrophobicContact CG2-CG 4.14Å; I359-L363 WeakPolarHBondContact O-CG 3.3Å; I359-L363 PolarHBondContact O-N 2.94Å; I359-F394 HydrophobicContact CB-CE1 4.06Å; I359-F394 HydrophobicContact CB-CZ 3.88Å; I359-F394 HydrophobicContact CG2-CE1 3.54Å; I359-F394 HydrophobicContact CG2-CZ 3.82Å
360F96.7Very high93.7Very high0 Ų045 Ų450%025%0.248CC..Hα-helixtrans-56.8-44.9171.8171.2-111.4000111.3I199 F206 L356 F357 V358 L362 L363 M364 L386 I389 F390I199-F360 HydrophobicContact CD1-CE1 4.01Å; I199-F360 HydrophobicContact CD1-CZ 4.36Å; I199-F360 HydrophobicContact CG1-CE1 4.49Å; F206-F360 AromaticContact CE2-CD1 3.89Å; F206-F360 HydrophobicContact CE2-CD1 3.89Å; F206-F360 AromaticContact CE2-CE1 3.59Å; F206-F360 HydrophobicContact CE2-CE1 3.59Å; F206-F360 HydrophobicContact CZ-CD1 4.45Å; F206-F360 HydrophobicContact CZ-CE1 4.25Å; L356-F360 VanDerWaalsContact O-CB 3.27Å; L356-F360 WeakPolarHBondContact O-CB 3.27Å; L356-F360 PolarHBondContact O-N 3.28Å; F357-F360 HydrophobicContact CD1-CD1 4.22Å; F357-F360 WeakPolarHBondContact O-CB 3.25Å; F357-F360 PolarHBondContact O-N 2.98Å; V358-F360 VanDerWaalsContact C-N 3.34Å; V358-F360 PolarHBondContact O-N 3.08Å; F360-L362 PolarHBondContact O-N 3.25Å; F360-L363 PolarHBondContact O-N 3.46Å; F360-L363 VanDerWaalsContact O-N 3.09Å; F360-M364 HydrophobicContact CE1-SD 3.83Å; F360-M364 HydrophobicContact CE2-CB 4.38Å; F360-M364 HydrophobicContact CE2-CG 4.31Å; F360-M364 HydrophobicContact CE2-SD 4.39Å; F360-M364 HydrophobicContact CZ-CB 4.41Å; F360-M364 HydrophobicContact CZ-CE 3.97Å; F360-M364 HydrophobicContact CZ-CG 4.06Å; F360-M364 HydrophobicContact CZ-SD 3.58Å; F360-M364 VanDerWaalsContact CZ-SD 3.58Å; F360-M364 WeakPolarHBondContact O-CB 3.44Å; F360-M364 PolarHBondContact O-N 3.41Å; F360-L386 HydrophobicContact CD1-CD1 4.45Å; F360-L386 HydrophobicContact CD2-CD1 4.48Å; F360-L386 HydrophobicContact CE1-CD1 4.02Å; F360-L386 HydrophobicContact CE2-CB 4.39Å; F360-L386 HydrophobicContact CE2-CD1 4.11Å; F360-L386 HydrophobicContact CZ-CB 4.35Å; F360-L386 HydrophobicContact CZ-CD1 3.86Å; F360-I389 HydrophobicContact CB-CG2 4.45Å; F360-I389 HydrophobicContact CD2-CB 4.03Å; F360-I389 HydrophobicContact CD2-CD1 3.53Å; F360-I389 HydrophobicContact CD2-CG1 4.36Å; F360-I389 HydrophobicContact CD2-CG2 3.98Å; F360-I389 HydrophobicContact CE2-CD1 3.78Å; F360-F390 HydrophobicContact CB-CE2 3.78Å; F360-F390 HydrophobicContact CB-CZ 4.26Å; F360-F390 HydrophobicContact CD1-CE2 4.31Å; F360-F390 HydrophobicContact CD2-CD2 4.33Å; F360-F390 AromaticContact CD2-CE2 3.91Å; F360-F390 HydrophobicContact CD2-CE2 3.91Å; F360-F390 AromaticContact CG-CE2 3.75Å; F360-F390 HydrophobicContact CG-CE2 3.75Å
361G95.8Very high93Very high13 Ų1344.4 Ų44.413%0.13425%0.246CC..Hα-helixtrans-55.2-37.6174.100000113.4F357 V358 I359F357-G361 PolarHBondContact O-N 3.49Å; V358-G361 PolarHBondContact O-N 3.47Å; I359-G361 VanDerWaalsContact C-N 3.29Å; I359-G361 PolarHBondContact O-N 2.85Å
362L93.8Very high92.3Very high129 Ų12942.9 Ų42.968%0.67523%0.233SC*.Hα-helixtrans-75.9-28.1177.5-62.1174.7000113.6V358 I359 F360V358-L362 WeakPolarHBondContact O-CG 3.19Å; V358-L362 PolarHBondContact O-N 3.09Å; V358-L362 VanDerWaalsContact O-N 3.16Å; I359-L362 WeakPolarHBondContact O-CB 3.37Å; I359-L362 PolarHBondContact O-N 2.85Å; I359-L362 VanDerWaalsContact O-N 3.08Å; F360-L362 PolarHBondContact O-N 3.25Å
363L93.1Very high91.6Very high44 Ų4441.7 Ų41.723%0.2323%0.226CC..Hα-helixtrans-96.9-17-175.7-65.5-179.8000113.5I359 F360 D365 V366 I389 I393 F394I359-L363 HydrophobicContact CG2-CD1 3.78Å; I359-L363 HydrophobicContact CG2-CG 4.14Å; I359-L363 WeakPolarHBondContact O-CG 3.3Å; I359-L363 PolarHBondContact O-N 2.94Å; F360-L363 PolarHBondContact O-N 3.46Å; F360-L363 VanDerWaalsContact O-N 3.09Å; L363-D365 VanDerWaalsContact C-N 3.26Å; L363-D365 PolarHBondContact O-N 2.96Å; L363-V366 WeakPolarHBondContact O-CB 3.4Å; L363-V366 PolarHBondContact O-N 3.11Å; L363-V366 VanDerWaalsContact O-N 3.11Å; L363-I389 HydrophobicContact CB-CD1 3.75Å; L363-I389 HydrophobicContact CB-CG1 4.46Å; L363-I389 HydrophobicContact CD1-CG2 4.36Å; L363-I393 HydrophobicContact CD1-CG2 4.09Å; L363-F394 HydrophobicContact CD1-CE1 4.23Å
364M90.3Very high90.8Very high13 Ų1341.8 Ų41.86%0.06424%0.235CC..THydrogen-bonded Turntrans-61-34.5-170.4-172.5169.9-167.600113.2I199 F206 F360 F370 V382 R385I199-M364 HydrophobicContact CG2-CE 3.32Å; I199-M364 HydrophobicContact CG2-SD 3.52Å; I199-M364 VanDerWaalsContact CG2-SD 3.52Å; F206-M364 HydrophobicContact CE1-SD 4.01Å; F206-M364 HydrophobicContact CE2-SD 3.65Å; F206-M364 HydrophobicContact CZ-CB 4.08Å; F206-M364 HydrophobicContact CZ-CG 4.31Å; F206-M364 HydrophobicContact CZ-SD 3.31Å; F206-M364 WeakPolarHBondContact CZ-SD 3.19Å; F360-M364 HydrophobicContact CE1-SD 3.83Å; F360-M364 HydrophobicContact CE2-CB 4.38Å; F360-M364 HydrophobicContact CE2-CG 4.31Å; F360-M364 HydrophobicContact CE2-SD 4.39Å; F360-M364 HydrophobicContact CZ-CB 4.41Å; F360-M364 HydrophobicContact CZ-CE 3.97Å; F360-M364 HydrophobicContact CZ-CG 4.06Å; F360-M364 HydrophobicContact CZ-SD 3.58Å; F360-M364 VanDerWaalsContact CZ-SD 3.58Å; F360-M364 WeakPolarHBondContact O-CB 3.44Å; F360-M364 PolarHBondContact O-N 3.41Å; M364-F370 WeakPolarHBondContact O-CE2 3.4Å; M364-V382 HydrophobicContact CE-CB 4.09Å; M364-V382 HydrophobicContact CE-CG1 3.82Å; M364-V382 HydrophobicContact CE-CG2 3.73Å; M364-R385 HydrophobicContact CE-CB 4.4Å; M364-R385 PolarHBondContact O-NH1 3.08Å
365D87.7Confident90Very high127 Ų12739.1 Ų39.168%0.67922%0.22SC*.THydrogen-bonded Turntrans-92.63.7-178.1-61.2-36.1000113.2L363 D367L363-D365 VanDerWaalsContact C-N 3.26Å; L363-D365 PolarHBondContact O-N 2.96Å; D365-D367 PolarHBondContact O-N 3.07Å; D365-D367 VanDerWaalsContact O-N 3.09Å
366V88.6Confident89Confident62 Ų6242.4 Ų42.438%0.37623%0.233SC..  trans-84.482.4178-173.80000109.2L363 D368 L369 F370L363-V366 WeakPolarHBondContact O-CB 3.4Å; L363-V366 PolarHBondContact O-N 3.11Å; L363-V366 VanDerWaalsContact O-N 3.11Å; V366-D368 HydrophobicContact CG1-CB 4.34Å; V366-D368 PolarHBondContact O-N 2.86Å; V366-L369 HydrophobicContact CB-CB 4.38Å; V366-L369 HydrophobicContact CG1-CB 4.27Å; V366-L369 WeakPolarHBondContact O-CB 3.27Å; V366-L369 PolarHBondContact O-N 3.45Å; V366-F370 WeakPolarHBondContact O-CD2 3.37Å
367D84.6Confident87.7Confident39 Ų3945.5 Ų45.521%0.20926%0.255CS..Hα-helixtrans-58.9-33.6-174.8-72.4-49.7000114.2D365 L369 F370 I371 N378 R385D365-D367 PolarHBondContact O-N 3.07Å; D365-D367 VanDerWaalsContact O-N 3.09Å; D367-L369 PolarHBondContact O-N 3.12Å; D367-L369 VanDerWaalsContact O-N 3.17Å; D367-F370 PolarHBondContact O-N 2.94Å; D367-I371 HydrophobicContact CB-CD1 4.49Å; D367-I371 WeakPolarHBondContact O-CG1 3.31Å; D367-I371 PolarHBondContact O-N 3.27Å; D367-N378 PolarHBondContact OD2-OD1 3.47Å; D367-R385 IonicContact OD1-CZ 3.28Å; D367-R385 VanDerWaalsContact OD1-CZ 3.28Å; D367-R385 IonicContact OD1-NH1 3.14Å; D367-R385 PolarHBondContact OD1-NH1 2.96Å; D367-R385 IonicContact OD1-NH2 2.76Å; D367-R385 PolarHBondContact OD1-NH2 3.47Å
368D83.4Confident86.4Confident89 Ų8951 Ų5148%0.47629%0.285SS..Hα-helixtrans-51.9-33.8172.9-89.2-6.3000113.4V5 V366 S372V5-D368 HydrophobicContact CG2-CB 3.36Å; V366-D368 HydrophobicContact CG1-CB 4.34Å; V366-D368 PolarHBondContact O-N 2.86Å; D368-S372 PolarHBondContact O-N 2.84Å
369L86.2Confident85.4Confident13 Ų1352.3 Ų52.37%0.06829%0.29CS..Hα-helixtrans-58.6-50.6174.2-168.396000110L17 V366 D367 S372 F373 I389 I393L17-L369 HydrophobicContact CD2-CB 4.27Å; L17-L369 HydrophobicContact CD2-CD1 3.28Å; L17-L369 HydrophobicContact CD2-CG 3.73Å; V366-L369 HydrophobicContact CB-CB 4.38Å; V366-L369 HydrophobicContact CG1-CB 4.27Å; V366-L369 WeakPolarHBondContact O-CB 3.27Å; V366-L369 PolarHBondContact O-N 3.45Å; D367-L369 PolarHBondContact O-N 3.12Å; D367-L369 VanDerWaalsContact O-N 3.17Å; L369-S372 PolarHBondContact O-N 3.34Å; L369-S372 PolarHBondContact O-OG 2.7Å; L369-F373 VanDerWaalsContact O-CD2 3.32Å; L369-F373 WeakPolarHBondContact O-CD2 3.33Å; L369-I389 HydrophobicContact CD2-CD1 4.01Å; L369-I389 HydrophobicContact CD2-CG1 3.61Å; L369-I393 HydrophobicContact CD1-CD1 3.89Å; L369-I393 HydrophobicContact CD1-CG1 4.06Å; L369-I393 HydrophobicContact CD2-CG1 4.07Å; L369-I393 HydrophobicContact CG-CD1 4.26Å; L369-I393 HydrophobicContact CG-CG1 4.32Å
370F87.2Confident84.8Confident0 Ų050.1 Ų50.10%028%0.279CS..Hα-helixtrans-79.6-33.9-173.5-51-70.6000112.5M364 V366 D367 S372 F373 F375 T380 R385 I388 I389M364-F370 WeakPolarHBondContact O-CE2 3.4Å; V366-F370 WeakPolarHBondContact O-CD2 3.37Å; D367-F370 PolarHBondContact O-N 2.94Å; F370-S372 PolarHBondContact O-N 3.02Å; F370-F373 WeakPolarHBondContact O-CA 3.47Å; F370-F373 PolarHBondContact O-N 3.24Å; F370-F375 HydrophobicContact CB-CB 4.19Å; F370-F375 HydrophobicContact CB-CD2 4.27Å; F370-F375 HydrophobicContact CB-CG 4.46Å; F370-F375 WeakPolarHBondContact O-CD2 3.36Å; F370-F375 PolarHBondContact O-N 3.42Å; F370-T380 HydrophobicContact CB-CG2 4.08Å; F370-T380 WeakPolarHBondContact CB-OG1 3.42Å; F370-T380 HydrophobicContact CD1-CG2 4.12Å; F370-T380 HydrophobicContact CG-CG2 4.04Å; F370-R385 HydrophobicContact CD1-CG 4.15Å; F370-R385 HydrophobicContact CD2-CG 4.3Å; F370-R385 VanDerWaalsContact CD2-NH1 3.28Å; F370-R385 VanDerWaalsContact CE1-CA 3.42Å; F370-R385 HydrophobicContact CE1-CB 3.7Å; F370-R385 HydrophobicContact CE1-CG 3.7Å; F370-R385 HydrophobicContact CE2-CB 4.45Å; F370-R385 HydrophobicContact CE2-CG 3.89Å; F370-R385 HydrophobicContact CG-CG 4.42Å; F370-R385 HydrophobicContact CZ-CB 3.64Å; F370-R385 HydrophobicContact CZ-CG 3.54Å; F370-I388 HydrophobicContact CD1-CB 4.34Å; F370-I388 HydrophobicContact CD1-CD1 3.78Å; F370-I388 HydrophobicContact CD1-CG2 4.28Å; F370-I388 HydrophobicContact CE1-CB 4.31Å; F370-I388 HydrophobicContact CE1-CD1 4.44Å; F370-I388 HydrophobicContact CE1-CG2 4.39Å; F370-I389 HydrophobicContact CE1-CD1 4.18Å; F370-I389 HydrophobicContact CE1-CG1 4.21Å; F370-I389 HydrophobicContact CZ-CD1 3.75Å; F370-I389 HydrophobicContact CZ-CG1 4.25Å
371I84Confident84.6Confident28 Ų2850.5 Ų50.514%0.14428%0.282CS..Hα-helixtrans-56.9-36.6173.6-67166.7000110.4D367 F373 G374D367-I371 HydrophobicContact CB-CD1 4.49Å; D367-I371 WeakPolarHBondContact O-CG1 3.31Å; D367-I371 PolarHBondContact O-N 3.27Å; I371-F373 PolarHBondContact O-N 2.92Å; I371-G374 PolarHBondContact O-N 2.84Å; I371-G374 VanDerWaalsContact O-N 3.07Å
372S83Confident84.4Confident15 Ų1550.4 Ų50.411%0.10528%0.279CS..THydrogen-bonded Turntrans-63.7-22.7176.781.50000114F18 D368 L369 F370F18-S372 WeakPolarHBondContact CB-O 3.45Å; D368-S372 PolarHBondContact O-N 2.84Å; L369-S372 PolarHBondContact O-N 3.34Å; L369-S372 PolarHBondContact O-OG 2.7Å; F370-S372 PolarHBondContact O-N 3.02Å
373F84.4Confident84.4Confident11 Ų1144.8 Ų44.85%0.04825%0.249CC..THydrogen-bonded Turntrans-95.514.2175.7-72.7-95.5000113.4L17 F18 V21 L91 L369 F370 I371 F375 I388 Y392 I393L17-F373 HydrophobicContact CD2-CE2 4.37Å; F18-F373 HydrophobicContact CD2-CD1 4.07Å; F18-F373 HydrophobicContact CD2-CE1 4.23Å; V21-F373 HydrophobicContact CB-CZ 4.42Å; V21-F373 HydrophobicContact CG1-CZ 4.29Å; V21-F373 HydrophobicContact CG2-CZ 4.28Å; L91-F373 HydrophobicContact CD2-CD1 4.12Å; L91-F373 HydrophobicContact CD2-CE1 4.05Å; L369-F373 VanDerWaalsContact O-CD2 3.32Å; L369-F373 WeakPolarHBondContact O-CD2 3.33Å; F370-F373 WeakPolarHBondContact O-CA 3.47Å; F370-F373 PolarHBondContact O-N 3.24Å; I371-F373 PolarHBondContact O-N 2.92Å; F373-F375 HydrophobicContact CB-CD2 4.07Å; F373-F375 HydrophobicContact CB-CE2 4.14Å; F373-I388 HydrophobicContact CB-CD1 4.48Å; F373-I388 HydrophobicContact CD1-CG2 4.46Å; F373-I388 HydrophobicContact CD2-CG2 3.82Å; F373-I388 HydrophobicContact CE1-CG2 4.44Å; F373-I388 HydrophobicContact CE2-CG2 3.81Å; F373-I388 HydrophobicContact CG-CG2 4.17Å; F373-I388 HydrophobicContact CZ-CG2 4.13Å; F373-Y392 HydrophobicContact CD1-CD2 4.33Å; F373-Y392 AromaticContact CE1-CD2 3.81Å; F373-Y392 HydrophobicContact CE1-CD2 3.81Å; F373-Y392 HydrophobicContact CE1-CG 4.23Å; F373-Y392 HydrophobicContact CZ-CD2 4.47Å; F373-I393 HydrophobicContact CE2-CD1 3.98Å; F373-I393 HydrophobicContact CZ-CD1 4.15Å
374G80.2Confident84.3Confident33 Ų3342.7 Ų42.734%0.3424%0.238SC..THydrogen-bonded Turntrans90.56174.700000115I371I371-G374 PolarHBondContact O-N 2.84Å; I371-G374 VanDerWaalsContact O-N 3.07Å
375F81.2Confident84.5Confident9 Ų943.1 Ų43.14%0.03924%0.239CC..PPolyproline II helixtrans-77.1153.3174.8-67.3-83000112.5I96 P97 F370 F373 T380 L384 I388I96-F375 HydrophobicContact CG2-CZ 4.47Å; P97-F375 HydrophobicContact CB-CD1 4.17Å; P97-F375 HydrophobicContact CB-CE1 3.75Å; P97-F375 HydrophobicContact CB-CE2 4.48Å; P97-F375 HydrophobicContact CB-CZ 3.97Å; P97-F375 HydrophobicContact CG-CD1 4.21Å; P97-F375 HydrophobicContact CG-CD2 4.08Å; P97-F375 HydrophobicContact CG-CE1 3.71Å; P97-F375 HydrophobicContact CG-CE2 3.57Å; P97-F375 HydrophobicContact CG-CG 4.38Å; P97-F375 HydrophobicContact CG-CZ 3.41Å; P97-F375 VanDerWaalsContact CG-CZ 3.41Å; F370-F375 HydrophobicContact CB-CB 4.19Å; F370-F375 HydrophobicContact CB-CD2 4.27Å; F370-F375 HydrophobicContact CB-CG 4.46Å; F370-F375 WeakPolarHBondContact O-CD2 3.36Å; F370-F375 PolarHBondContact O-N 3.42Å; F373-F375 HydrophobicContact CB-CD2 4.07Å; F373-F375 HydrophobicContact CB-CE2 4.14Å; F375-T380 HydrophobicContact CB-CG2 4.43Å; F375-T380 WeakPolarHBondContact CB-OG1 3.45Å; F375-T380 HydrophobicContact CD1-CG2 3.89Å; F375-T380 HydrophobicContact CD2-CG2 4.36Å; F375-T380 HydrophobicContact CE1-CG2 4.26Å; F375-T380 HydrophobicContact CG-CG2 3.93Å; F375-L384 HydrophobicContact CD1-CD1 4.36Å; F375-L384 HydrophobicContact CE1-CB 4.2Å; F375-L384 HydrophobicContact CE1-CD1 3.27Å; F375-L384 HydrophobicContact CE1-CG 4.31Å; F375-L384 HydrophobicContact CZ-CB 4.02Å; F375-L384 HydrophobicContact CZ-CD1 3.65Å; F375-L384 HydrophobicContact CZ-CG 4.32Å; F375-I388 HydrophobicContact CD2-CD1 3.82Å; F375-I388 HydrophobicContact CE2-CD1 3.18Å; F375-I388 HydrophobicContact CE2-CG1 4.35Å; F375-I388 HydrophobicContact CZ-CD1 3.85Å
376K77Confident84.8Confident138 Ų13838.1 Ų38.160%0.621%0.213SC*.PPolyproline II helixtrans-77.5148.2170.3-66.6178.4-176.4173.60109.9N378 D379K376-N378 PolarHBondContact O-N 2.93Å; K376-D379 HydrophobicContact CB-CB 4.13Å; K376-D379 PolarHBondContact O-N 3.47Å
377S71.8Confident85Confident77 Ų7738.5 Ų38.554%0.53821%0.209SC..THydrogen-bonded Turntrans-56.8136.5177.3-173.10000110.9D379S377-D379 PolarHBondContact O-N 3.36Å
378N70.3Confident85.4Confident122 Ų12236.7 Ų36.765%0.65220%0.2SC*.THydrogen-bonded Turntrans56.37.6179.6-60.912.7000116.9D367 K376D367-N378 PolarHBondContact OD2-OD1 3.47Å; K376-N378 PolarHBondContact O-N 2.93Å
379D76.8Confident85.9Confident80 Ų8032.5 Ų32.543%0.42818%0.177SC..  trans-113.411.4-175.6-169.839.6000112.3Y101 K376 S377 P381Y101-D379 PolarHBondContact OH-OD2 2.97Å; Y101-D379 VanDerWaalsContact OH-OD2 3.04Å; K376-D379 HydrophobicContact CB-CB 4.13Å; K376-D379 PolarHBondContact O-N 3.47Å; S377-D379 PolarHBondContact O-N 3.36Å; D379-P381 WeakPolarHBondContact O-CD 3.48Å
380T85.9Confident86.4Confident10 Ų1034.1 Ų34.16%0.06118%0.184CC..  trans-81.5116.5179.2-50.30000109.6F370 F375 L384 R385F370-T380 HydrophobicContact CB-CG2 4.08Å; F370-T380 WeakPolarHBondContact CB-OG1 3.42Å; F370-T380 HydrophobicContact CD1-CG2 4.12Å; F370-T380 HydrophobicContact CG-CG2 4.04Å; F375-T380 HydrophobicContact CB-CG2 4.43Å; F375-T380 WeakPolarHBondContact CB-OG1 3.45Å; F375-T380 HydrophobicContact CD1-CG2 3.89Å; F375-T380 HydrophobicContact CD2-CG2 4.36Å; F375-T380 HydrophobicContact CE1-CG2 4.26Å; F375-T380 HydrophobicContact CG-CG2 3.93Å; T380-L384 HydrophobicContact CG2-CB 4.08Å; T380-R385 HydrophobicContact CG2-CG 3.68Å; T380-R385 PolarHBondContact O-NE 3.02Å; T380-R385 PolarHBondContact O-NH2 3.12Å
381P90.9Very high86.6Confident8 Ų839.3 Ų39.35%0.05221%0.208CC..  trans-67.3153178.133.8-42.2000111.3W100 E129 D379 I383 L384 R385W100-P381 HydrophobicContact CD2-CG 3.73Å; W100-P381 VanDerWaalsContact CE2-CG 3.45Å; W100-P381 HydrophobicContact CE3-CG 4.06Å; W100-P381 HydrophobicContact CG-CG 4.31Å; W100-P381 HydrophobicContact CH2-CB 3.64Å; W100-P381 HydrophobicContact CH2-CG 3.88Å; W100-P381 HydrophobicContact CZ2-CB 3.44Å; W100-P381 VanDerWaalsContact CZ2-CB 3.44Å; W100-P381 HydrophobicContact CZ2-CG 3.55Å; W100-P381 HydrophobicContact CZ3-CB 4.27Å; W100-P381 HydrophobicContact CZ3-CG 4.12Å; E129-P381 HydrophobicContact CG-CB 3.84Å; E129-P381 WeakPolarHBondContact OE1-CA 3.38Å; E129-P381 WeakPolarHBondContact OE1-CB 3.46Å; D379-P381 WeakPolarHBondContact O-CD 3.48Å; P381-I383 VanDerWaalsContact C-N 3.28Å; P381-I383 HydrophobicContact CB-CG2 4.37Å; P381-I383 HydrophobicContact CG-CG2 4.33Å; P381-I383 PolarHBondContact O-N 3.45Å; P381-L384 HydrophobicContact CG-CB 3.89Å; P381-L384 HydrophobicContact CG-CD1 3.39Å; P381-L384 HydrophobicContact CG-CG 3.55Å; P381-L384 PolarHBondContact O-N 2.87Å; P381-R385 PolarHBondContact O-N 2.94Å
382V92.4Very high87Confident12 Ų1238.6 Ų38.67%0.07320%0.204CC..Hα-helixtrans-51.5-44.2-179.9172.90000112.3E129 V196 I199 K200 M364 L384 R385 L386E129-V382 VanDerWaalsContact OE1-CB 3.27Å; E129-V382 WeakPolarHBondContact OE1-CB 3.33Å; E129-V382 WeakPolarHBondContact OE1-CG2 3.45Å; E129-V382 PolarHBondContact OE1-N 3.23Å; V196-V382 HydrophobicContact CG1-CB 4.19Å; V196-V382 HydrophobicContact CG1-CG1 4.3Å; V196-V382 HydrophobicContact CG2-CG1 4.42Å; I199-V382 HydrophobicContact CB-CG1 3.76Å; I199-V382 HydrophobicContact CD1-CG1 3.77Å; I199-V382 HydrophobicContact CG1-CG1 4.38Å; I199-V382 HydrophobicContact CG2-CG1 3.52Å; I199-V382 HydrophobicContact CG2-CG2 4.28Å; K200-V382 HydrophobicContact CD-CG2 4.35Å; K200-V382 HydrophobicContact CG-CG2 3.72Å; M364-V382 HydrophobicContact CE-CB 4.09Å; M364-V382 HydrophobicContact CE-CG1 3.82Å; M364-V382 HydrophobicContact CE-CG2 3.73Å; V382-L384 VanDerWaalsContact C-N 3.27Å; V382-L384 PolarHBondContact O-N 3.28Å; V382-R385 PolarHBondContact O-N 3.38Å; V382-L386 WeakPolarHBondContact O-CB 3.45Å; V382-L386 PolarHBondContact O-N 3.26Å
383I92.7Very high87.5Confident10 Ų1039.4 Ų39.45%0.05121%0.206CC..Hα-helixtrans-60.8-37.2-179.4-171.6164.8000112.2W100 S133 F136 M192 V196 P381 F387W100-I383 HydrophobicContact CE3-CG2 4.31Å; W100-I383 HydrophobicContact CH2-CG2 4.41Å; W100-I383 HydrophobicContact CZ3-CG2 3.77Å; S133-I383 WeakPolarHBondContact OG-CG2 3Å; F136-I383 HydrophobicContact CD1-CD1 4Å; M192-I383 HydrophobicContact CE-CD1 3.86Å; M192-I383 HydrophobicContact CE-CG1 4.01Å; V196-I383 HydrophobicContact CG2-CB 4.26Å; P381-I383 VanDerWaalsContact C-N 3.28Å; P381-I383 HydrophobicContact CB-CG2 4.37Å; P381-I383 HydrophobicContact CG-CG2 4.33Å; P381-I383 PolarHBondContact O-N 3.45Å; I383-F387 WeakPolarHBondContact O-CB 3.27Å; I383-F387 PolarHBondContact O-N 2.96Å
384L92.5Very high88Confident0 Ų039.4 Ų39.40%021%0.206CC..Hα-helixtrans-79-34.1178.6-60.4179.1000111.4I96 W100 F136 F375 T380 P381 V382 L386 F387 I388I96-L384 HydrophobicContact CG2-CD2 3.67Å; W100-L384 HydrophobicContact CB-CD1 3.56Å; W100-L384 HydrophobicContact CD2-CD1 3.91Å; W100-L384 HydrophobicContact CE3-CD1 4.21Å; W100-L384 HydrophobicContact CG-CD1 3.58Å; F136-L384 HydrophobicContact CE1-CD2 3.76Å; F136-L384 HydrophobicContact CE2-CD2 4.1Å; F136-L384 HydrophobicContact CZ-CD2 3.52Å; F375-L384 HydrophobicContact CD1-CD1 4.36Å; F375-L384 HydrophobicContact CE1-CB 4.2Å; F375-L384 HydrophobicContact CE1-CD1 3.27Å; F375-L384 HydrophobicContact CE1-CG 4.31Å; F375-L384 HydrophobicContact CZ-CB 4.02Å; F375-L384 HydrophobicContact CZ-CD1 3.65Å; F375-L384 HydrophobicContact CZ-CG 4.32Å; T380-L384 HydrophobicContact CG2-CB 4.08Å; P381-L384 HydrophobicContact CG-CB 3.89Å; P381-L384 HydrophobicContact CG-CD1 3.39Å; P381-L384 HydrophobicContact CG-CG 3.55Å; P381-L384 PolarHBondContact O-N 2.87Å; V382-L384 VanDerWaalsContact C-N 3.27Å; V382-L384 PolarHBondContact O-N 3.28Å; L384-L386 VanDerWaalsContact C-N 3.33Å; L384-L386 PolarHBondContact O-N 3.4Å; L384-F387 PolarHBondContact O-N 3.23Å; L384-I388 WeakPolarHBondContact O-CB 3.48Å; L384-I388 VanDerWaalsContact O-CD1 3.28Å; L384-I388 WeakPolarHBondContact O-CD1 3.49Å; L384-I388 VanDerWaalsContact O-CG1 3.27Å; L384-I388 WeakPolarHBondContact O-CG1 3.23Å; L384-I388 PolarHBondContact O-N 2.7Å
385R93.8Very high88.7Confident22 Ų2238.4 Ų38.48%0.08319%0.194CC..Hα-helixtrans-59.1-46.8171.1-64.1-174.3-174.2-103.6-4.7111.2M364 D367 F370 T380 P381 V382 I389M364-R385 HydrophobicContact CE-CB 4.4Å; M364-R385 PolarHBondContact O-NH1 3.08Å; D367-R385 IonicContact OD1-CZ 3.28Å; D367-R385 VanDerWaalsContact OD1-CZ 3.28Å; D367-R385 IonicContact OD1-NH1 3.14Å; D367-R385 PolarHBondContact OD1-NH1 2.96Å; D367-R385 IonicContact OD1-NH2 2.76Å; D367-R385 PolarHBondContact OD1-NH2 3.47Å; F370-R385 HydrophobicContact CD1-CG 4.15Å; F370-R385 HydrophobicContact CD2-CG 4.3Å; F370-R385 VanDerWaalsContact CD2-NH1 3.28Å; F370-R385 VanDerWaalsContact CE1-CA 3.42Å; F370-R385 HydrophobicContact CE1-CB 3.7Å; F370-R385 HydrophobicContact CE1-CG 3.7Å; F370-R385 HydrophobicContact CE2-CB 4.45Å; F370-R385 HydrophobicContact CE2-CG 3.89Å; F370-R385 HydrophobicContact CG-CG 4.42Å; F370-R385 HydrophobicContact CZ-CB 3.64Å; F370-R385 HydrophobicContact CZ-CG 3.54Å; T380-R385 HydrophobicContact CG2-CG 3.68Å; T380-R385 PolarHBondContact O-NE 3.02Å; T380-R385 PolarHBondContact O-NH2 3.12Å; P381-R385 PolarHBondContact O-N 2.94Å; V382-R385 PolarHBondContact O-N 3.38Å; R385-I389 WeakPolarHBondContact O-CB 3.12Å; R385-I389 WeakPolarHBondContact O-CG1 3.45Å; R385-I389 PolarHBondContact O-N 2.87Å; R385-I389 VanDerWaalsContact O-N 3.11Å
386L94.1Very high89.4Confident23 Ų2340.6 Ų40.612%0.1221%0.209CC..Hα-helixtrans-59.1-51174.8-170.578.9000110.8M192 L195 I199 F360 V382 L384 I388 I389 F390M192-L386 HydrophobicContact CE-CD2 4.41Å; L195-L386 HydrophobicContact CD2-CD2 3.64Å; I199-L386 HydrophobicContact CD1-CD1 4.4Å; F360-L386 HydrophobicContact CD1-CD1 4.45Å; F360-L386 HydrophobicContact CD2-CD1 4.48Å; F360-L386 HydrophobicContact CE1-CD1 4.02Å; F360-L386 HydrophobicContact CE2-CB 4.39Å; F360-L386 HydrophobicContact CE2-CD1 4.11Å; F360-L386 HydrophobicContact CZ-CB 4.35Å; F360-L386 HydrophobicContact CZ-CD1 3.86Å; V382-L386 WeakPolarHBondContact O-CB 3.45Å; V382-L386 PolarHBondContact O-N 3.26Å; L384-L386 VanDerWaalsContact C-N 3.33Å; L384-L386 PolarHBondContact O-N 3.4Å; L386-I388 PolarHBondContact O-N 2.97Å; L386-I389 PolarHBondContact O-N 3.31Å; L386-F390 HydrophobicContact CD1-CD2 3.59Å; L386-F390 HydrophobicContact CD1-CE2 3.4Å; L386-F390 VanDerWaalsContact CD1-CE2 3.4Å; L386-F390 HydrophobicContact CD1-CZ 4.3Å; L386-F390 HydrophobicContact CG-CD2 4.02Å; L386-F390 HydrophobicContact CG-CE2 4.32Å; L386-F390 WeakPolarHBondContact O-CB 3.47Å; L386-F390 WeakPolarHBondContact O-CD2 3.28Å; L386-F390 PolarHBondContact O-N 3Å
387F92.7Very high90.3Very high69 Ų6937.4 Ų37.430%0.30319%0.194SC..Hα-helixtrans-58.3-50.8-179-178.6-102.9000112.2I96 I383 L384 I389 Q391 Y392I96-F387 HydrophobicContact CD1-CE1 4.31Å; I96-F387 HydrophobicContact CG1-CE1 4.13Å; I96-F387 HydrophobicContact CG2-CD1 4.35Å; I96-F387 HydrophobicContact CG2-CE1 4.41Å; I383-F387 WeakPolarHBondContact O-CB 3.27Å; I383-F387 PolarHBondContact O-N 2.96Å; L384-F387 PolarHBondContact O-N 3.23Å; F387-I389 PolarHBondContact O-N 3.36Å; F387-Q391 HydrophobicContact CD2-CB 4.44Å; F387-Q391 HydrophobicContact CE2-CB 4.3Å; F387-Q391 HydrophobicContact CE2-CG 4.28Å; F387-Q391 HydrophobicContact CZ-CB 4.44Å; F387-Q391 HydrophobicContact CZ-CG 4.19Å; F387-Q391 WeakPolarHBondContact O-CA 3.26Å; F387-Q391 WeakPolarHBondContact O-CB 3.37Å; F387-Q391 PolarHBondContact O-N 2.87Å; F387-Y392 HydrophobicContact CD1-CE2 4.16Å; F387-Y392 AromaticContact CE1-CE2 3.64Å; F387-Y392 HydrophobicContact CE1-CE2 3.64Å; F387-Y392 AromaticContact CE1-CZ 3.73Å; F387-Y392 WeakPolarHBondContact CE1-OH 3.42Å; F387-Y392 HydrophobicContact CZ-CE2 4.47Å
388I92.1Very high91.5Very high2 Ų235.8 Ų35.81%0.0118%0.18CC..Hα-helixtrans-64.1-44.4-177.1-68.1155.8000111.2F370 F373 F375 L384 L386 Y392 I393F370-I388 HydrophobicContact CD1-CB 4.34Å; F370-I388 HydrophobicContact CD1-CD1 3.78Å; F370-I388 HydrophobicContact CD1-CG2 4.28Å; F370-I388 HydrophobicContact CE1-CB 4.31Å; F370-I388 HydrophobicContact CE1-CD1 4.44Å; F370-I388 HydrophobicContact CE1-CG2 4.39Å; F373-I388 HydrophobicContact CB-CD1 4.48Å; F373-I388 HydrophobicContact CD1-CG2 4.46Å; F373-I388 HydrophobicContact CD2-CG2 3.82Å; F373-I388 HydrophobicContact CE1-CG2 4.44Å; F373-I388 HydrophobicContact CE2-CG2 3.81Å; F373-I388 HydrophobicContact CG-CG2 4.17Å; F373-I388 HydrophobicContact CZ-CG2 4.13Å; F375-I388 HydrophobicContact CD2-CD1 3.82Å; F375-I388 HydrophobicContact CE2-CD1 3.18Å; F375-I388 HydrophobicContact CE2-CG1 4.35Å; F375-I388 HydrophobicContact CZ-CD1 3.85Å; L384-I388 WeakPolarHBondContact O-CB 3.48Å; L384-I388 VanDerWaalsContact O-CD1 3.28Å; L384-I388 WeakPolarHBondContact O-CD1 3.49Å; L384-I388 VanDerWaalsContact O-CG1 3.27Å; L384-I388 WeakPolarHBondContact O-CG1 3.23Å; L384-I388 PolarHBondContact O-N 2.7Å; L386-I388 PolarHBondContact O-N 2.97Å; I388-Y392 HydrophobicContact CB-CD2 4.44Å; I388-Y392 HydrophobicContact CG1-CD2 4.37Å; I388-Y392 HydrophobicContact CG2-CD2 4.41Å; I388-Y392 WeakPolarHBondContact O-CA 3.21Å; I388-Y392 WeakPolarHBondContact O-CB 3.33Å; I388-Y392 PolarHBondContact O-N 2.95Å; I388-I393 HydrophobicContact CG2-CG1 4.33Å; I388-I393 PolarHBondContact O-N 3.36Å; I388-I393 VanDerWaalsContact O-N 3.08Å
389I95.1Very high92.7Very high0 Ų032.2 Ų32.20%016%0.162CC..Iπ-helixtrans-66.2-53.5-179.3-70.5168.9000110.5F360 L363 L369 F370 R385 L386 F387 I393 F394F360-I389 HydrophobicContact CB-CG2 4.45Å; F360-I389 HydrophobicContact CD2-CB 4.03Å; F360-I389 HydrophobicContact CD2-CD1 3.53Å; F360-I389 HydrophobicContact CD2-CG1 4.36Å; F360-I389 HydrophobicContact CD2-CG2 3.98Å; F360-I389 HydrophobicContact CE2-CD1 3.78Å; L363-I389 HydrophobicContact CB-CD1 3.75Å; L363-I389 HydrophobicContact CB-CG1 4.46Å; L363-I389 HydrophobicContact CD1-CG2 4.36Å; L369-I389 HydrophobicContact CD2-CD1 4.01Å; L369-I389 HydrophobicContact CD2-CG1 3.61Å; F370-I389 HydrophobicContact CE1-CD1 4.18Å; F370-I389 HydrophobicContact CE1-CG1 4.21Å; F370-I389 HydrophobicContact CZ-CD1 3.75Å; F370-I389 HydrophobicContact CZ-CG1 4.25Å; R385-I389 WeakPolarHBondContact O-CB 3.12Å; R385-I389 WeakPolarHBondContact O-CG1 3.45Å; R385-I389 PolarHBondContact O-N 2.87Å; R385-I389 VanDerWaalsContact O-N 3.11Å; L386-I389 PolarHBondContact O-N 3.31Å; F387-I389 PolarHBondContact O-N 3.36Å; I389-I393 HydrophobicContact CG1-CG1 4.42Å; I389-I393 WeakPolarHBondContact O-CB 3.35Å; I389-I393 PolarHBondContact O-N 3.48Å; I389-F394 HydrophobicContact CG2-CD1 4.32Å; I389-F394 HydrophobicContact CG2-CD2 4.15Å; I389-F394 HydrophobicContact CG2-CE1 3.85Å; I389-F394 HydrophobicContact CG2-CE2 3.67Å; I389-F394 HydrophobicContact CG2-CG 4.47Å; I389-F394 HydrophobicContact CG2-CZ 3.51Å; I389-F394 WeakPolarHBondContact O-CG 3.38Å; I389-F394 PolarHBondContact O-N 3.3Å
390F95.5Very high93.6Very high48 Ų4832.5 Ų32.521%0.21117%0.166CC..Iπ-helixtrans-70.5-36.8-174.9-81.9-99.8000113.1L356 F357 F360 L386 F394L356-F390 HydrophobicContact CB-CE1 3.85Å; L356-F390 HydrophobicContact CB-CZ 4.27Å; L356-F390 HydrophobicContact CD1-CD1 4.49Å; L356-F390 HydrophobicContact CD1-CE1 4.24Å; F357-F390 HydrophobicContact CD1-CZ 4.08Å; F357-F390 HydrophobicContact CE1-CE2 4.5Å; F357-F390 HydrophobicContact CE1-CZ 4.03Å; F357-F390 HydrophobicContact CG-CZ 4.35Å; F357-F390 HydrophobicContact CZ-CZ 4.29Å; F360-F390 HydrophobicContact CB-CE2 3.78Å; F360-F390 HydrophobicContact CB-CZ 4.26Å; F360-F390 HydrophobicContact CD1-CE2 4.31Å; F360-F390 HydrophobicContact CD2-CD2 4.33Å; F360-F390 AromaticContact CD2-CE2 3.91Å; F360-F390 HydrophobicContact CD2-CE2 3.91Å; F360-F390 AromaticContact CG-CE2 3.75Å; F360-F390 HydrophobicContact CG-CE2 3.75Å; L386-F390 HydrophobicContact CD1-CD2 3.59Å; L386-F390 HydrophobicContact CD1-CE2 3.4Å; L386-F390 VanDerWaalsContact CD1-CE2 3.4Å; L386-F390 HydrophobicContact CD1-CZ 4.3Å; L386-F390 HydrophobicContact CG-CD2 4.02Å; L386-F390 HydrophobicContact CG-CE2 4.32Å; L386-F390 WeakPolarHBondContact O-CB 3.47Å; L386-F390 WeakPolarHBondContact O-CD2 3.28Å; L386-F390 PolarHBondContact O-N 3Å; F390-F394 HydrophobicContact CD1-CD2 4.13Å; F390-F394 HydrophobicContact CD1-CE2 4.25Å; F390-F394 HydrophobicContact CD2-CE2 4.33Å; F390-F394 HydrophobicContact CE1-CE2 4.24Å; F390-F394 HydrophobicContact CE2-CE2 4.32Å; F390-F394 HydrophobicContact CG-CD2 4.21Å; F390-F394 HydrophobicContact CG-CE2 4.31Å; F390-F394 HydrophobicContact CZ-CE2 4.28Å
391Q92.2Very high94.2Very high109 Ų10933.8 Ų33.851%0.50917%0.172SC..Iπ-helixtrans-83.4-43.7-177.4-172.163.631.100112.5F387F387-Q391 HydrophobicContact CD2-CB 4.44Å; F387-Q391 HydrophobicContact CE2-CB 4.3Å; F387-Q391 HydrophobicContact CE2-CG 4.28Å; F387-Q391 HydrophobicContact CZ-CB 4.44Å; F387-Q391 HydrophobicContact CZ-CG 4.19Å; F387-Q391 WeakPolarHBondContact O-CA 3.26Å; F387-Q391 WeakPolarHBondContact O-CB 3.37Å; F387-Q391 PolarHBondContact O-N 2.87Å
392Y92.6Very high94.4Very high13 Ų1338.2 Ų38.25%0.05120%0.196CC..Iπ-helixtrans-108.1-49.5-168.4-56.2-45.3000112.9L87 L91 F373 F387 I388 S395L87-Y392 HydrophobicContact CD1-CE1 3.79Å; L91-Y392 HydrophobicContact CD1-CE1 4.48Å; L91-Y392 HydrophobicContact CD2-CD2 4.12Å; L91-Y392 HydrophobicContact CD2-CE1 4.1Å; L91-Y392 HydrophobicContact CD2-CE2 3.64Å; F373-Y392 HydrophobicContact CD1-CD2 4.33Å; F373-Y392 AromaticContact CE1-CD2 3.81Å; F373-Y392 HydrophobicContact CE1-CD2 3.81Å; F373-Y392 HydrophobicContact CE1-CG 4.23Å; F373-Y392 HydrophobicContact CZ-CD2 4.47Å; F387-Y392 HydrophobicContact CD1-CE2 4.16Å; F387-Y392 AromaticContact CE1-CE2 3.64Å; F387-Y392 HydrophobicContact CE1-CE2 3.64Å; F387-Y392 AromaticContact CE1-CZ 3.73Å; F387-Y392 WeakPolarHBondContact CE1-OH 3.42Å; F387-Y392 HydrophobicContact CZ-CE2 4.47Å; I388-Y392 HydrophobicContact CB-CD2 4.44Å; I388-Y392 HydrophobicContact CG1-CD2 4.37Å; I388-Y392 HydrophobicContact CG2-CD2 4.41Å; I388-Y392 WeakPolarHBondContact O-CA 3.21Å; I388-Y392 WeakPolarHBondContact O-CB 3.33Å; I388-Y392 PolarHBondContact O-N 2.95Å; Y392-S395 WeakPolarHBondContact O-CB 3.31Å; Y392-S395 PolarHBondContact O-N 2.94Å; Y392-S395 PolarHBondContact O-OG 3.36Å
393I92.4Very high94.6Very high32 Ų3240.2 Ų40.216%0.16420%0.204CC..Iπ-helixtrans-69.2-39.9-176.3-55.7-54.3000111.6L17 V21 L363 L369 F373 I388 I389 S395 P396L17-I393 HydrophobicContact CD1-CD1 4.2Å; L17-I393 HydrophobicContact CD2-CD1 4.02Å; L17-I393 HydrophobicContact CG-CD1 4.3Å; V21-I393 HydrophobicContact CG2-CD1 4.11Å; L363-I393 HydrophobicContact CD1-CG2 4.09Å; L369-I393 HydrophobicContact CD1-CD1 3.89Å; L369-I393 HydrophobicContact CD1-CG1 4.06Å; L369-I393 HydrophobicContact CD2-CG1 4.07Å; L369-I393 HydrophobicContact CG-CD1 4.26Å; L369-I393 HydrophobicContact CG-CG1 4.32Å; F373-I393 HydrophobicContact CE2-CD1 3.98Å; F373-I393 HydrophobicContact CZ-CD1 4.15Å; I388-I393 HydrophobicContact CG2-CG1 4.33Å; I388-I393 PolarHBondContact O-N 3.36Å; I388-I393 VanDerWaalsContact O-N 3.08Å; I389-I393 HydrophobicContact CG1-CG1 4.42Å; I389-I393 WeakPolarHBondContact O-CB 3.35Å; I389-I393 PolarHBondContact O-N 3.48Å; I393-S395 PolarHBondContact O-N 3.49Å; I393-P396 VanDerWaalsContact O-CD 3.28Å; I393-P396 WeakPolarHBondContact O-CD 3.28Å
394F95.9Very high94.9Very high10 Ų1044.2 Ų44.24%0.04423%0.225CC..THydrogen-bonded Turntrans-78.2-2176.3-66.6-19.8000114.2L356 I359 L363 I389 F390 Y397 N398L356-F394 HydrophobicContact CB-CD2 4.34Å; L356-F394 HydrophobicContact CB-CE2 3.85Å; L356-F394 HydrophobicContact CD1-CD2 4.46Å; L356-F394 HydrophobicContact CD2-CD2 3.61Å; L356-F394 HydrophobicContact CD2-CE2 3.75Å; L356-F394 HydrophobicContact CD2-CG 4.04Å; L356-F394 HydrophobicContact CD2-CZ 4.27Å; L356-F394 HydrophobicContact CG-CD2 4.35Å; L356-F394 HydrophobicContact CG-CE2 4.3Å; L356-F394 WeakPolarHBondContact O-CZ 3.37Å; I359-F394 HydrophobicContact CB-CE1 4.06Å; I359-F394 HydrophobicContact CB-CZ 3.88Å; I359-F394 HydrophobicContact CG2-CE1 3.54Å; I359-F394 HydrophobicContact CG2-CZ 3.82Å; L363-F394 HydrophobicContact CD1-CE1 4.23Å; I389-F394 HydrophobicContact CG2-CD1 4.32Å; I389-F394 HydrophobicContact CG2-CD2 4.15Å; I389-F394 HydrophobicContact CG2-CE1 3.85Å; I389-F394 HydrophobicContact CG2-CE2 3.67Å; I389-F394 HydrophobicContact CG2-CG 4.47Å; I389-F394 HydrophobicContact CG2-CZ 3.51Å; I389-F394 WeakPolarHBondContact O-CG 3.38Å; I389-F394 PolarHBondContact O-N 3.3Å; F390-F394 HydrophobicContact CD1-CD2 4.13Å; F390-F394 HydrophobicContact CD1-CE2 4.25Å; F390-F394 HydrophobicContact CD2-CE2 4.33Å; F390-F394 HydrophobicContact CE1-CE2 4.24Å; F390-F394 HydrophobicContact CE2-CE2 4.32Å; F390-F394 HydrophobicContact CG-CD2 4.21Å; F390-F394 HydrophobicContact CG-CE2 4.31Å; F390-F394 HydrophobicContact CZ-CE2 4.28Å; F394-Y397 WeakPolarHBondContact O-CB 3.34Å; F394-Y397 PolarHBondContact O-N 3.13Å; F394-Y397 VanDerWaalsContact O-N 3.12Å; F394-N398 VanDerWaalsContact O-CG 3.27Å; F394-N398 PolarHBondContact O-N 3.24Å; F394-N398 PolarHBondContact O-ND2 3.27Å
395S95.2Very high95.1Very high12 Ų1247 Ų478%0.08424%0.238CC..Hα-helixtrans-55.4-41.9-177.664.50000114.3Y392 I393 Y397 N398 T399Y392-S395 WeakPolarHBondContact O-CB 3.31Å; Y392-S395 PolarHBondContact O-N 2.94Å; Y392-S395 PolarHBondContact O-OG 3.36Å; I393-S395 PolarHBondContact O-N 3.49Å; S395-Y397 PolarHBondContact O-N 3.37Å; S395-N398 PolarHBondContact O-N 2.87Å; S395-T399 PolarHBondContact O-N 2.93Å; S395-T399 VanDerWaalsContact O-N 3.09Å; S395-T399 PolarHBondContact O-OG1 2.85Å; S395-T399 VanDerWaalsContact O-OG1 3.13Å
396P95.3Very high95.3Very high56 Ų5647 Ų4736%0.36424%0.241SC..Hα-helixtrans-67.8-36.7178.1-17.733.3000113.2F24 I393 V400F24-P396 HydrophobicContact CD1-CG 3.89Å; F24-P396 HydrophobicContact CD2-CB 4.35Å; F24-P396 HydrophobicContact CD2-CG 4.24Å; F24-P396 HydrophobicContact CE1-CB 4.08Å; F24-P396 HydrophobicContact CE1-CG 3.83Å; F24-P396 HydrophobicContact CE2-CB 3.88Å; F24-P396 HydrophobicContact CE2-CG 4.18Å; F24-P396 HydrophobicContact CG-CG 4.11Å; F24-P396 HydrophobicContact CZ-CB 3.75Å; F24-P396 HydrophobicContact CZ-CG 4.01Å; I393-P396 VanDerWaalsContact O-CD 3.28Å; I393-P396 WeakPolarHBondContact O-CD 3.28Å; P396-V400 PolarHBondContact O-N 3.13Å
397Y96.4Very high95.4Very high70 Ų7049 Ų4928%0.27525%0.254SS..Hα-helixtrans-64.9-48.3175.3171-98.7000111N352 M355 L356 F394 S395 T399 V400 I401N352-Y397 VanDerWaalsContact OD1-CE1 3.24Å; N352-Y397 WeakPolarHBondContact OD1-CE1 3.47Å; N352-Y397 PolarHBondContact OD1-OH 2.96Å; M355-Y397 HydrophobicContact CE-CD1 4.46Å; M355-Y397 HydrophobicContact CE-CD2 4.17Å; M355-Y397 HydrophobicContact CE-CE1 3.74Å; M355-Y397 HydrophobicContact CE-CE2 3.4Å; M355-Y397 WeakPolarHBondContact CE-OH 3.24Å; L356-Y397 HydrophobicContact CD2-CD1 3.74Å; L356-Y397 HydrophobicContact CD2-CE1 3.6Å; L356-Y397 HydrophobicContact CG-CE1 4.44Å; F394-Y397 WeakPolarHBondContact O-CB 3.34Å; F394-Y397 PolarHBondContact O-N 3.13Å; F394-Y397 VanDerWaalsContact O-N 3.12Å; S395-Y397 PolarHBondContact O-N 3.37Å; Y397-T399 VanDerWaalsContact C-N 3.34Å; Y397-T399 PolarHBondContact O-N 3.42Å; Y397-V400 PolarHBondContact O-N 2.9Å; Y397-V400 VanDerWaalsContact O-N 3.13Å; Y397-I401 HydrophobicContact CD1-CG1 4.15Å; Y397-I401 HydrophobicContact CD2-CG1 4.21Å; Y397-I401 HydrophobicContact CE1-CD1 4.43Å; Y397-I401 HydrophobicContact CE1-CG1 3.53Å; Y397-I401 HydrophobicContact CE2-CD1 3.77Å; Y397-I401 HydrophobicContact CE2-CG1 3.6Å; Y397-I401 HydrophobicContact CG-CG1 4.45Å; Y397-I401 WeakPolarHBondContact O-CG1 3.37Å; Y397-I401 PolarHBondContact O-N 3.5Å; Y397-I401 WeakPolarHBondContact OH-CD1 3.27Å; Y397-I401 WeakPolarHBondContact OH-CG1 3.36Å
398N96.3Very high95.6Very high44 Ų4447.8 Ų47.824%0.23525%0.251CS..Hα-helixtrans-59.2-44.4-178.8-68.8-19.8000111.3F394 S395 V400 I401 D402F394-N398 VanDerWaalsContact O-CG 3.27Å; F394-N398 PolarHBondContact O-N 3.24Å; F394-N398 PolarHBondContact O-ND2 3.27Å; S395-N398 PolarHBondContact O-N 2.87Å; N398-V400 VanDerWaalsContact C-N 3.28Å; N398-V400 PolarHBondContact O-N 2.88Å; N398-I401 PolarHBondContact O-N 3.21Å; N398-I401 VanDerWaalsContact O-N 3.12Å; N398-D402 WeakPolarHBondContact O-CB 3.38Å; N398-D402 PolarHBondContact O-N 2.88Å
399T95.9Very high95.9Very high47 Ų4749.1 Ų49.129%0.28826%0.26SS..Hα-helixtrans-53.7-43.6175.7-62.50000112.7M28 S395 Y397 F403M28-T399 HydrophobicContact CE-CG2 3.32Å; M28-T399 HydrophobicContact SD-CG2 3.83Å; S395-T399 PolarHBondContact O-N 2.93Å; S395-T399 VanDerWaalsContact O-N 3.09Å; S395-T399 PolarHBondContact O-OG1 2.85Å; S395-T399 VanDerWaalsContact O-OG1 3.13Å; Y397-T399 VanDerWaalsContact C-N 3.34Å; Y397-T399 PolarHBondContact O-N 3.42Å; T399-F403 PolarHBondContact O-N 3.03Å
400V96.7Very high96Very high85 Ų8551 Ų5152%0.51527%0.267SS..Hα-helixtrans-68.2-44.7179.4175.10000110.6P396 Y397 N398 F403 L404P396-V400 PolarHBondContact O-N 3.13Å; Y397-V400 PolarHBondContact O-N 2.9Å; Y397-V400 VanDerWaalsContact O-N 3.13Å; N398-V400 VanDerWaalsContact C-N 3.28Å; N398-V400 PolarHBondContact O-N 2.88Å; V400-F403 PolarHBondContact O-N 3.24Å; V400-L404 HydrophobicContact CG1-CD1 4.13Å; V400-L404 VanDerWaalsContact O-CG 3.32Å; V400-L404 WeakPolarHBondContact O-CG 3.42Å; V400-L404 PolarHBondContact O-N 2.79Å
401I97.3Very high96.1Very high37 Ų3754.6 Ų54.619%0.1928%0.282CS..Hα-helixtrans-63.6-43.1178.7-65.4-54000111.6Y397 N398 F403 L404 M405Y397-I401 HydrophobicContact CD1-CG1 4.15Å; Y397-I401 HydrophobicContact CD2-CG1 4.21Å; Y397-I401 HydrophobicContact CE1-CD1 4.43Å; Y397-I401 HydrophobicContact CE1-CG1 3.53Å; Y397-I401 HydrophobicContact CE2-CD1 3.77Å; Y397-I401 HydrophobicContact CE2-CG1 3.6Å; Y397-I401 HydrophobicContact CG-CG1 4.45Å; Y397-I401 WeakPolarHBondContact O-CG1 3.37Å; Y397-I401 PolarHBondContact O-N 3.5Å; Y397-I401 WeakPolarHBondContact OH-CD1 3.27Å; Y397-I401 WeakPolarHBondContact OH-CG1 3.36Å; N398-I401 PolarHBondContact O-N 3.21Å; N398-I401 VanDerWaalsContact O-N 3.12Å; I401-F403 VanDerWaalsContact C-N 3.32Å; I401-F403 PolarHBondContact O-N 3.32Å; I401-L404 HydrophobicContact CD1-CD1 4.43Å; I401-L404 PolarHBondContact O-N 2.99Å; I401-L404 VanDerWaalsContact O-N 3.16Å; I401-M405 HydrophobicContact CG2-CG 4.07Å; I401-M405 WeakPolarHBondContact O-CB 3.38Å; I401-M405 VanDerWaalsContact O-CG 3.32Å; I401-M405 WeakPolarHBondContact O-CG 3.28Å; I401-M405 PolarHBondContact O-N 3.11Å
402D96.1Very high96.4Very high102 Ų10250.1 Ų50.155%0.54526%0.261SS..Hα-helixtrans-59.5-44.8179.1-70.8-21.3000110.8N398 L404 M405 T406N398-D402 WeakPolarHBondContact O-CB 3.38Å; N398-D402 PolarHBondContact O-N 2.88Å; D402-L404 PolarHBondContact O-N 3.03Å; D402-M405 PolarHBondContact O-N 2.81Å; D402-T406 PolarHBondContact O-N 2.85Å; D402-T406 PolarHBondContact O-OG1 3.46Å
403F96.9Very high96.7Very high54 Ų5449.9 Ų49.924%0.23726%0.261CS..Hα-helixtrans-59.7-47.6173.8173.4-107.3000112.4T399 V400 I401 M405 T406 V407 M452 F453T399-F403 PolarHBondContact O-N 3.03Å; V400-F403 PolarHBondContact O-N 3.24Å; I401-F403 VanDerWaalsContact C-N 3.32Å; I401-F403 PolarHBondContact O-N 3.32Å; F403-M405 VanDerWaalsContact C-N 3.31Å; F403-M405 PolarHBondContact O-N 3.45Å; F403-T406 WeakPolarHBondContact O-CB 3.27Å; F403-T406 PolarHBondContact O-N 3.37Å; F403-V407 HydrophobicContact CE1-CG2 4.21Å; F403-V407 HydrophobicContact CE2-CG2 4.02Å; F403-V407 HydrophobicContact CZ-CG2 3.83Å; F403-V407 WeakPolarHBondContact O-CG2 3.45Å; F403-V407 PolarHBondContact O-N 2.98Å; F403-M452 HydrophobicContact CE2-CE 4.22Å; F403-M452 HydrophobicContact CE2-CG 4.1Å; F403-M452 HydrophobicContact CZ-CE 3.74Å; F403-F453 AromaticContact CD2-CD1 3.57Å; F403-F453 HydrophobicContact CD2-CD1 3.57Å; F403-F453 HydrophobicContact CD2-CD2 4.47Å; F403-F453 AromaticContact CD2-CE1 3.65Å; F403-F453 HydrophobicContact CD2-CE1 3.65Å; F403-F453 HydrophobicContact CD2-CG 4.01Å; F403-F453 HydrophobicContact CD2-CZ 4.15Å; F403-F453 HydrophobicContact CE2-CD1 4.06Å; F403-F453 HydrophobicContact CE2-CD2 4.18Å; F403-F453 AromaticContact CE2-CE1 3.95Å; F403-F453 HydrophobicContact CE2-CE1 3.95Å; F403-F453 HydrophobicContact CE2-CE2 4.07Å; F403-F453 HydrophobicContact CE2-CG 4.18Å; F403-F453 AromaticContact CE2-CZ 3.95Å; F403-F453 HydrophobicContact CE2-CZ 3.95Å; F403-F453 HydrophobicContact CG-CD1 4.37Å; F403-F453 HydrophobicContact CG-CE1 4.21Å
404L97.7Very high96.9Very high94 Ų9451.3 Ų51.349%0.49227%0.266SS..Hα-helixtrans-62.8-38.8178.7-68.3175.4000112.1V400 I401 D402 V407 L408V400-L404 HydrophobicContact CG1-CD1 4.13Å; V400-L404 VanDerWaalsContact O-CG 3.32Å; V400-L404 WeakPolarHBondContact O-CG 3.42Å; V400-L404 PolarHBondContact O-N 2.79Å; I401-L404 HydrophobicContact CD1-CD1 4.43Å; I401-L404 PolarHBondContact O-N 2.99Å; I401-L404 VanDerWaalsContact O-N 3.16Å; D402-L404 PolarHBondContact O-N 3.03Å; L404-V407 PolarHBondContact O-N 3.2Å; L404-L408 WeakPolarHBondContact O-CB 3.4Å; L404-L408 PolarHBondContact O-N 2.66Å
405M97.5Very high97Very high57 Ų5754.3 Ų54.328%0.28128%0.28SS..Hα-helixtrans-67.5-38.1176.3-73.2-56.7-59.800111.9I348 I401 D402 F403 L408 S409I348-M405 HydrophobicContact CG2-SD 3.82Å; I401-M405 HydrophobicContact CG2-CG 4.07Å; I401-M405 WeakPolarHBondContact O-CB 3.38Å; I401-M405 VanDerWaalsContact O-CG 3.32Å; I401-M405 WeakPolarHBondContact O-CG 3.28Å; I401-M405 PolarHBondContact O-N 3.11Å; D402-M405 PolarHBondContact O-N 2.81Å; F403-M405 VanDerWaalsContact C-N 3.31Å; F403-M405 PolarHBondContact O-N 3.45Å; M405-L408 HydrophobicContact CE-CD2 4.48Å; M405-L408 PolarHBondContact O-N 2.93Å; M405-L408 HydrophobicContact SD-CD2 4.34Å; M405-S409 WeakPolarHBondContact O-CB 3.41Å; M405-S409 PolarHBondContact O-N 3.05Å
406T97.2Very high97.2Very high23 Ų2353.7 Ų53.714%0.14128%0.276CS..Hα-helixtrans-59.8-46.5171.9-68.40000111.3D402 F403 L408 S409 R410D402-T406 PolarHBondContact O-N 2.85Å; D402-T406 PolarHBondContact O-OG1 3.46Å; F403-T406 WeakPolarHBondContact O-CB 3.27Å; F403-T406 PolarHBondContact O-N 3.37Å; T406-L408 VanDerWaalsContact C-N 3.35Å; T406-L408 PolarHBondContact O-N 3.38Å; T406-S409 PolarHBondContact O-N 2.85Å; T406-R410 WeakPolarHBondContact O-CG 3.48Å; T406-R410 PolarHBondContact O-N 3.42Å
407V96.7Very high97.3Very high66 Ų6651.1 Ų51.140%0.426%0.259SS..Hα-helixtrans-61.3-43.9177.1173.80000111.3F403 L404 R410 K411F403-V407 HydrophobicContact CE1-CG2 4.21Å; F403-V407 HydrophobicContact CE2-CG2 4.02Å; F403-V407 HydrophobicContact CZ-CG2 3.83Å; F403-V407 WeakPolarHBondContact O-CG2 3.45Å; F403-V407 PolarHBondContact O-N 2.98Å; L404-V407 PolarHBondContact O-N 3.2Å; V407-R410 PolarHBondContact O-N 3.49Å; V407-K411 PolarHBondContact O-N 3.23Å
408L97.5Very high97.3Very high43 Ų4349 Ų4923%0.22526%0.256CS..Hα-helixtrans-64.5-43.3177.3-177.561.5000111.9I348 L404 M405 T406 R410 K411 F412I348-L408 HydrophobicContact CD1-CD2 3.61Å; L404-L408 WeakPolarHBondContact O-CB 3.4Å; L404-L408 PolarHBondContact O-N 2.66Å; M405-L408 HydrophobicContact CE-CD2 4.48Å; M405-L408 PolarHBondContact O-N 2.93Å; M405-L408 HydrophobicContact SD-CD2 4.34Å; T406-L408 VanDerWaalsContact C-N 3.35Å; T406-L408 PolarHBondContact O-N 3.38Å; L408-R410 PolarHBondContact O-N 2.83Å; L408-K411 WeakPolarHBondContact O-CB 3.06Å; L408-K411 PolarHBondContact O-N 3.38Å; L408-K411 VanDerWaalsContact O-N 3.15Å; L408-F412 HydrophobicContact CD1-CD1 4.39Å; L408-F412 HydrophobicContact CD1-CE1 3.78Å; L408-F412 HydrophobicContact CD1-CE2 4.23Å; L408-F412 HydrophobicContact CD1-CZ 3.69Å; L408-F412 HydrophobicContact CD2-CE2 4.08Å; L408-F412 HydrophobicContact CD2-CZ 4.04Å; L408-F412 HydrophobicContact CG-CD2 4.35Å; L408-F412 HydrophobicContact CG-CE1 4.28Å; L408-F412 HydrophobicContact CG-CE2 3.83Å; L408-F412 HydrophobicContact CG-CZ 3.79Å; L408-F412 PolarHBondContact O-N 3.12Å
409S98Very high97.4Very high29 Ų2948.6 Ų48.620%0.20325%0.252CS..Hα-helixtrans-58.5-48.1177.6-167.70000110.8M405 T406 K411 F412 E413 S456M405-S409 WeakPolarHBondContact O-CB 3.41Å; M405-S409 PolarHBondContact O-N 3.05Å; T406-S409 PolarHBondContact O-N 2.85Å; S409-K411 VanDerWaalsContact C-N 3.25Å; S409-K411 PolarHBondContact O-N 3.36Å; S409-F412 WeakPolarHBondContact O-CA 3.32Å; S409-F412 WeakPolarHBondContact O-CB 3.41Å; S409-F412 PolarHBondContact O-N 3.45Å; S409-E413 WeakPolarHBondContact O-CG 3.45Å; S409-E413 PolarHBondContact O-N 2.78Å; S409-S456 CarbonylContact C-O 3.56Å; S409-S456 PolarHBondContact OG-O 3.15Å
410R97.6Very high97.4Very high41 Ų4146.4 Ų46.416%0.15524%0.239CC..Hα-helixtrans-57.3-38.9176.6-72.2179.870.1-177.23.8112.6T406 V407 L408 E413 F414 H455 S456 P458 E462T406-R410 WeakPolarHBondContact O-CG 3.48Å; T406-R410 PolarHBondContact O-N 3.42Å; V407-R410 PolarHBondContact O-N 3.49Å; L408-R410 PolarHBondContact O-N 2.83Å; R410-E413 WeakPolarHBondContact O-CB 3.28Å; R410-E413 PolarHBondContact O-N 2.88Å; R410-F414 WeakPolarHBondContact O-CD2 3.24Å; R410-F414 PolarHBondContact O-N 3.49Å; R410-H455 VanDerWaalsContact CD-O 3.26Å; R410-H455 WeakPolarHBondContact CD-O 3.46Å; R410-H455 VanDerWaalsContact CG-O 3.27Å; R410-H455 WeakPolarHBondContact CG-O 3.28Å; R410-S456 WeakPolarHBondContact CG-O 3.27Å; R410-S456 PolarHBondContact N-O 3.34Å; R410-P458 HydrophobicContact CB-CG 3.96Å; R410-P458 HydrophobicContact CG-CG 4Å; R410-E462 IonicContact CZ-OE2 3.39Å; R410-E462 IonicContact NH2-OE1 3.75Å; R410-E462 IonicContact NH2-OE2 2.78Å; R410-E462 PolarHBondContact NH2-OE2 2.85Å
411K97.4Very high97.4Very high122 Ų12242.6 Ų42.653%0.5322%0.216SC..Hα-helixtrans-63-43.3174.9-177.3-178178.2-1780111.4V407 L408 S409 E413 F414 Q415V407-K411 PolarHBondContact O-N 3.23Å; L408-K411 WeakPolarHBondContact O-CB 3.06Å; L408-K411 PolarHBondContact O-N 3.38Å; L408-K411 VanDerWaalsContact O-N 3.15Å; S409-K411 VanDerWaalsContact C-N 3.25Å; S409-K411 PolarHBondContact O-N 3.36Å; K411-E413 VanDerWaalsContact C-N 3.34Å; K411-F414 PolarHBondContact O-N 3.08Å; K411-Q415 WeakPolarHBondContact O-CG 3.23Å; K411-Q415 PolarHBondContact O-N 2.9Å; K411-Q415 VanDerWaalsContact O-N 3.14Å
412F98.5Very high97.3Very high15 Ų1547.6 Ų47.67%0.06624%0.236CC..Hα-helixtrans-62.4-39.4176.5-71.4-15.3000112.5H341 Y344 L408 S409 Q415 A416H341-F412 HydrophobicContact CB-CB 4.38Å; H341-F412 HydrophobicContact CB-CD2 3.71Å; H341-F412 HydrophobicContact CB-CE2 4.02Å; H341-F412 HydrophobicContact CB-CG 3.98Å; H341-F412 AromaticContact CD2-CD1 3.25Å; H341-F412 WeakPolarHBondContact CD2-CD1 3.11Å; H341-F412 AromaticContact CD2-CE1 3.56Å; H341-F412 AromaticContact CD2-CG 3.52Å; H341-F412 AromaticContact CE1-CD1 3.94Å; H341-F412 AromaticContact CE1-CG 3.93Å; H341-F412 PolarHBondContact CE1-O 3.4Å; H341-F412 AromaticContact CG-CD1 3.77Å; H341-F412 AromaticContact CG-CD2 3.79Å; H341-F412 AromaticContact CG-CG 3.5Å; H341-F412 VanDerWaalsContact CG-CG 3.5Å; H341-F412 WeakPolarHBondContact ND1-CB 3.38Å; H341-F412 AromaticContact ND1-CG 3.76Å; H341-F412 AromaticContact NE2-CD1 3.4Å; H341-F412 WeakPolarHBondContact NE2-CD1 3.46Å; H341-F412 AromaticContact NE2-CG 3.81Å; Y344-F412 HydrophobicContact CD2-CZ 4.31Å; Y344-F412 HydrophobicContact CG-CZ 4.39Å; L408-F412 HydrophobicContact CD1-CD1 4.39Å; L408-F412 HydrophobicContact CD1-CE1 3.78Å; L408-F412 HydrophobicContact CD1-CE2 4.23Å; L408-F412 HydrophobicContact CD1-CZ 3.69Å; L408-F412 HydrophobicContact CD2-CE2 4.08Å; L408-F412 HydrophobicContact CD2-CZ 4.04Å; L408-F412 HydrophobicContact CG-CD2 4.35Å; L408-F412 HydrophobicContact CG-CE1 4.28Å; L408-F412 HydrophobicContact CG-CE2 3.83Å; L408-F412 HydrophobicContact CG-CZ 3.79Å; L408-F412 PolarHBondContact O-N 3.12Å; S409-F412 WeakPolarHBondContact O-CA 3.32Å; S409-F412 WeakPolarHBondContact O-CB 3.41Å; S409-F412 PolarHBondContact O-N 3.45Å; F412-Q415 PolarHBondContact O-N 3.15Å; F412-A416 WeakPolarHBondContact O-CB 3.23Å; F412-A416 PolarHBondContact O-N 3.24Å
413E98Very high97.2Very high9 Ų945.7 Ų45.74%0.04223%0.226CC..Hα-helixtrans-58.8-48.7175.1-66.1-64.1132.400112.2H332 H336 S409 R410 K411 Q415 A416 D417 H457 P458 R463H332-E413 IonicContact CE1-OE2 3.75Å; H332-E413 PolarHBondContact CE1-OE2 2.82Å; H332-E413 IonicContact NE2-OE2 2.97Å; H332-E413 PolarHBondContact NE2-OE2 3.36Å; H336-E413 IonicContact CE1-OE1 3.48Å; H336-E413 PolarHBondContact CE1-OE1 2.9Å; H336-E413 IonicContact NE2-OE1 2.71Å; H336-E413 PolarHBondContact NE2-OE1 2.89Å; S409-E413 WeakPolarHBondContact O-CG 3.45Å; S409-E413 PolarHBondContact O-N 2.78Å; R410-E413 WeakPolarHBondContact O-CB 3.28Å; R410-E413 PolarHBondContact O-N 2.88Å; K411-E413 VanDerWaalsContact C-N 3.34Å; E413-Q415 VanDerWaalsContact C-N 3.27Å; E413-Q415 PolarHBondContact O-N 3.16Å; E413-A416 PolarHBondContact O-N 2.78Å; E413-D417 PolarHBondContact O-N 3.05Å; E413-H457 IonicContact OE1-CE1 2.94Å; E413-H457 PolarHBondContact OE1-CE1 3.15Å; E413-H457 IonicContact OE1-ND1 3.51Å; E413-H457 PolarHBondContact OE1-ND1 3.29Å; E413-H457 IonicContact OE2-CE1 2.68Å; E413-H457 PolarHBondContact OE2-CE1 3.1Å; E413-H457 IonicContact OE2-CG 3.18Å; E413-H457 IonicContact OE2-ND1 2.68Å; E413-H457 PolarHBondContact OE2-ND1 2.91Å; E413-P458 HydrophobicContact CB-CG 4.22Å; E413-R463 IonicContact OE2-CZ 3.23Å; E413-R463 IonicContact OE2-NH1 3.5Å; E413-R463 IonicContact OE2-NH2 3.75Å
414F97.7Very high97.1Very high61 Ų6146 Ų4627%0.26825%0.245SC..Hα-helixtrans-63.3-34.2177.3-69.5-58000112.6R410 K411 A418 P458 E462 R463 A466R410-F414 WeakPolarHBondContact O-CD2 3.24Å; R410-F414 PolarHBondContact O-N 3.49Å; K411-F414 PolarHBondContact O-N 3.08Å; F414-A418 WeakPolarHBondContact O-CB 3.37Å; F414-A418 PolarHBondContact O-N 2.92Å; F414-P458 HydrophobicContact CD1-CG 4.49Å; F414-P458 HydrophobicContact CD2-CG 4.13Å; F414-P458 HydrophobicContact CE1-CB 4.02Å; F414-P458 HydrophobicContact CE1-CG 3.96Å; F414-P458 HydrophobicContact CE2-CB 4.06Å; F414-P458 HydrophobicContact CE2-CG 3.54Å; F414-P458 HydrophobicContact CZ-CB 3.49Å; F414-P458 VanDerWaalsContact CZ-CB 3.49Å; F414-P458 HydrophobicContact CZ-CG 3.44Å; F414-P458 VanDerWaalsContact CZ-CG 3.44Å; F414-E462 HydrophobicContact CE1-CB 4.44Å; F414-E462 HydrophobicContact CZ-CB 4.25Å; F414-R463 HydrophobicContact CE1-CG 4.35Å; F414-A466 HydrophobicContact CD1-CB 3.67Å; F414-A466 HydrophobicContact CE1-CB 3.83Å
415Q97.8Very high97Very high73 Ų7343.7 Ų43.734%0.34123%0.23SC..Hα-helixtrans-70.7-38.6176.7-68.9176.2-10.300112L339 H341 K411 F412 E413 A418 F419L339-Q415 HydrophobicContact CD1-CB 3.7Å; H341-Q415 PolarHBondContact NE2-OE1 3.38Å; K411-Q415 WeakPolarHBondContact O-CG 3.23Å; K411-Q415 PolarHBondContact O-N 2.9Å; K411-Q415 VanDerWaalsContact O-N 3.14Å; F412-Q415 PolarHBondContact O-N 3.15Å; E413-Q415 VanDerWaalsContact C-N 3.27Å; E413-Q415 PolarHBondContact O-N 3.16Å; Q415-A418 PolarHBondContact O-N 3.01Å; Q415-F419 WeakPolarHBondContact O-CB 3.36Å; Q415-F419 PolarHBondContact O-N 3.38Å
416A98.1Very high96.8Very high0 Ų043.1 Ų43.10%023%0.226CC..Hα-helixtrans-66.9-41.9174.800000111.9H336 F412 E413 A418 F419 A420H336-A416 VanDerWaalsContact NE2-CB 3.31Å; H336-A416 WeakPolarHBondContact NE2-CB 3.48Å; F412-A416 WeakPolarHBondContact O-CB 3.23Å; F412-A416 PolarHBondContact O-N 3.24Å; E413-A416 PolarHBondContact O-N 2.78Å; A416-A418 PolarHBondContact O-N 3.39Å; A416-F419 WeakPolarHBondContact O-CB 3.3Å; A416-F419 PolarHBondContact O-N 3.13Å; A416-A420 PolarHBondContact O-N 2.68Å
417D98.1Very high96.6Very high2 Ų248.8 Ų48.81%0.01125%0.25CS..Hα-helixtrans-58.8-46.8172.2-75.4-14.2000111.8H332 E413 F419 A420 A421 L429 R463 I467H332-D417 IonicContact CE1-OD1 3.71Å; H332-D417 PolarHBondContact CE1-OD1 3.44Å; H332-D417 VanDerWaalsContact CE1-OD1 3.31Å; H332-D417 IonicContact CG-OD1 2.69Å; H332-D417 IonicContact ND1-OD1 2.86Å; H332-D417 PolarHBondContact ND1-OD1 3.34Å; E413-D417 PolarHBondContact O-N 3.05Å; D417-F419 VanDerWaalsContact C-N 3.29Å; D417-F419 PolarHBondContact O-N 3.18Å; D417-A420 PolarHBondContact O-N 2.87Å; D417-A421 WeakPolarHBondContact O-CB 3.37Å; D417-A421 PolarHBondContact O-N 3.01Å; D417-L429 HydrophobicContact CB-CD2 4.27Å; D417-R463 IonicContact OD1-CZ 2.62Å; D417-R463 IonicContact OD1-NE 3.05Å; D417-R463 IonicContact OD1-NH2 2.74Å; D417-R463 PolarHBondContact OD1-NH2 3.03Å; D417-R463 IonicContact OD2-CZ 3.47Å; D417-R463 IonicContact OD2-NE 3.31Å; D417-R463 PolarHBondContact OD2-NE 2.72Å; D417-R463 IonicContact OD2-NH2 3.15Å; D417-R463 PolarHBondContact OD2-NH2 2.81Å; D417-I467 HydrophobicContact CB-CD1 4.25Å; D417-I467 HydrophobicContact CB-CG1 3.92Å
418A97.2Very high96.5Very high26 Ų2650 Ų5022%0.21525%0.248CC..Hα-helixtrans-64-35.2176.800000112.3F414 Q415 A416 K422F414-A418 WeakPolarHBondContact O-CB 3.37Å; F414-A418 PolarHBondContact O-N 2.92Å; Q415-A418 PolarHBondContact O-N 3.01Å; A416-A418 PolarHBondContact O-N 3.39Å; A418-K422 VanDerWaalsContact O-CG 3.28Å; A418-K422 WeakPolarHBondContact O-CG 3.49Å; A418-K422 PolarHBondContact O-N 3.26Å
419F96.8Very high96.5Very high35 Ų3548 Ų4815%0.15424%0.238CC..Hα-helixtrans-65.1-48.5175.6179.9-94.7000111.6I255 K338 L339 Q415 A416 D417 A421 K422 L423I255-F419 HydrophobicContact CG2-CZ 4.08Å; K338-F419 HydrophobicContact CB-CE1 4.46Å; K338-F419 HydrophobicContact CB-CE2 4.11Å; K338-F419 HydrophobicContact CB-CZ 3.93Å; K338-F419 HydrophobicContact CG-CE2 3.72Å; K338-F419 HydrophobicContact CG-CZ 3.81Å; L339-F419 HydrophobicContact CD1-CB 4.4Å; Q415-F419 WeakPolarHBondContact O-CB 3.36Å; Q415-F419 PolarHBondContact O-N 3.38Å; A416-F419 WeakPolarHBondContact O-CB 3.3Å; A416-F419 PolarHBondContact O-N 3.13Å; D417-F419 VanDerWaalsContact C-N 3.29Å; D417-F419 PolarHBondContact O-N 3.18Å; F419-A421 VanDerWaalsContact C-N 3.32Å; F419-A421 PolarHBondContact O-N 3.39Å; F419-K422 PolarHBondContact O-N 2.71Å; F419-L423 HydrophobicContact CD1-CD1 4.03Å; F419-L423 HydrophobicContact CE1-CD1 3.46Å; F419-L423 VanDerWaalsContact CE1-CD1 3.46Å; F419-L423 HydrophobicContact CE1-CG 4.28Å; F419-L423 HydrophobicContact CZ-CD1 3.93Å; F419-L423 HydrophobicContact CZ-CG 4.47Å; F419-L423 PolarHBondContact O-N 2.83Å
420A97Very high96.2Very high0 Ų049.4 Ų49.40%024%0.24CC..Hα-helixtrans-62-39.6176.200000112.2A331 H332 A416 D417 K422 L423 Y425 L429A331-A420 HydrophobicContact CB-CB 3.85Å; H332-A420 HydrophobicContact CB-CB 4.29Å; A416-A420 PolarHBondContact O-N 2.68Å; D417-A420 PolarHBondContact O-N 2.87Å; A420-K422 PolarHBondContact O-N 3.47Å; A420-L423 PolarHBondContact O-N 3.45Å; A420-Y425 PolarHBondContact O-N 3.31Å; A420-L429 HydrophobicContact CB-CD2 3.92Å
421A96Very high96Very high5 Ų549.2 Ų49.24%0.04125%0.245CC..Iπ-helixtrans-61.2-42.2175.300000112.4D417 F419 L423 G424 K426 C470D417-A421 WeakPolarHBondContact O-CB 3.37Å; D417-A421 PolarHBondContact O-N 3.01Å; F419-A421 VanDerWaalsContact C-N 3.32Å; F419-A421 PolarHBondContact O-N 3.39Å; A421-L423 VanDerWaalsContact C-N 3.27Å; A421-L423 PolarHBondContact O-N 2.83Å; A421-G424 PolarHBondContact O-N 2.84Å; A421-K426 HydrophobicContact CB-CB 4.1Å; A421-K426 HydrophobicContact CB-CG 4.4Å; A421-C470 HydrophobicContact CB-CB 4.03Å
422K94.8Very high95.9Very high142 Ų14243.4 Ų43.462%0.61722%0.22SC*.Iπ-helixtrans-65.5-26.3176.3-75.1174.9-178.5-175.50113.7A418 F419 A420 G424A418-K422 VanDerWaalsContact O-CG 3.28Å; A418-K422 WeakPolarHBondContact O-CG 3.49Å; A418-K422 PolarHBondContact O-N 3.26Å; F419-K422 PolarHBondContact O-N 2.71Å; A420-K422 PolarHBondContact O-N 3.47Å; K422-G424 PolarHBondContact O-N 2.76Å
423L94.6Very high95.7Very high63 Ų6343.4 Ų43.433%0.3322%0.22SC..Iπ-helixtrans-77.64.6173.2-69178.6000113.3L251 I255 A331 F419 A420 A421 Y425L251-L423 HydrophobicContact CD1-CD1 4.11Å; I255-L423 HydrophobicContact CG2-CD1 4.2Å; I255-L423 HydrophobicContact CG2-CD2 4.36Å; A331-L423 HydrophobicContact CB-CD1 4.3Å; F419-L423 HydrophobicContact CD1-CD1 4.03Å; F419-L423 HydrophobicContact CE1-CD1 3.46Å; F419-L423 VanDerWaalsContact CE1-CD1 3.46Å; F419-L423 HydrophobicContact CE1-CG 4.28Å; F419-L423 HydrophobicContact CZ-CD1 3.93Å; F419-L423 HydrophobicContact CZ-CG 4.47Å; F419-L423 PolarHBondContact O-N 2.83Å; A420-L423 PolarHBondContact O-N 3.45Å; A421-L423 VanDerWaalsContact C-N 3.27Å; A421-L423 PolarHBondContact O-N 2.83Å; L423-Y425 HydrophobicContact CB-CD2 3.79Å; L423-Y425 HydrophobicContact CB-CE2 4.05Å
424G94.3Very high95.4Very high61 Ų6143.3 Ų43.363%0.62922%0.221SC*.Iπ-helixtrans90.12.7179.800000114.4A421 K422 K426A421-G424 PolarHBondContact O-N 2.84Å; K422-G424 PolarHBondContact O-N 2.76Å; G424-K426 VanDerWaalsContact C-N 3.32Å; G424-K426 PolarHBondContact O-N 3.09Å
425Y95.5Very high95Very high45 Ų4541.7 Ų41.718%0.17621%0.214CC..Iπ-helixtrans-89.913.3-178-64.2-78000114.1L251 L327 A331 A420 L423 H427 Y428 L429L251-Y425 HydrophobicContact CD1-CE2 3.88Å; L251-Y425 HydrophobicContact CD2-CE2 4.39Å; L327-Y425 HydrophobicContact CB-CD1 4.25Å; L327-Y425 HydrophobicContact CB-CE1 3.64Å; L327-Y425 HydrophobicContact CD2-CE1 4.14Å; L327-Y425 VanDerWaalsContact CD2-OH 3.28Å; L327-Y425 WeakPolarHBondContact CD2-OH 3.44Å; A331-Y425 HydrophobicContact CB-CD2 3.87Å; A331-Y425 HydrophobicContact CB-CE2 4.34Å; A331-Y425 HydrophobicContact CB-CG 4.45Å; A420-Y425 PolarHBondContact O-N 3.31Å; L423-Y425 HydrophobicContact CB-CD2 3.79Å; L423-Y425 HydrophobicContact CB-CE2 4.05Å; Y425-H427 PolarHBondContact O-N 3.33Å; Y425-Y428 PolarHBondContact O-N 2.93Å; Y425-L429 VanDerWaalsContact O-CB 3.31Å; Y425-L429 WeakPolarHBondContact O-CB 3.48Å; Y425-L429 PolarHBondContact O-N 3.24Å
426K94Very high94.8Very high45 Ų4539.5 Ų39.520%0.19621%0.205CC..Hα-helixtrans-49.2-52.8-175-179176.8176168.80113.2A421 G424 K430 I467 D468 C470A421-K426 HydrophobicContact CB-CB 4.1Å; A421-K426 HydrophobicContact CB-CG 4.4Å; G424-K426 VanDerWaalsContact C-N 3.32Å; G424-K426 PolarHBondContact O-N 3.09Å; K426-K430 WeakPolarHBondContact O-CG 3.41Å; K426-K430 PolarHBondContact O-N 3.23Å; K426-I467 WeakPolarHBondContact CE-O 3.37Å; K426-I467 HydrophobicContact CG-CG2 3.65Å; K426-I467 PolarHBondContact NZ-O 3.3Å; K426-D468 PolarHBondContact NZ-O 2.82Å; K426-C470 PolarHBondContact NZ-O 3.35Å
427H93.1Very high94.5Very high142 Ų14240.3 Ų40.366%0.65721%0.209SC*.Hα-helixtrans-67.3-46-177.8-178.6-89.2000111.9Y425 L429 K430 S431Y425-H427 PolarHBondContact O-N 3.33Å; H427-L429 VanDerWaalsContact C-N 3.35Å; H427-L429 PolarHBondContact O-N 3.07Å; H427-K430 PolarHBondContact O-N 2.94Å; H427-S431 PolarHBondContact O-N 3.23Å; H427-S431 VanDerWaalsContact O-N 3.17Å
428Y95.3Very high94Very high90 Ų9043 Ų4335%0.35322%0.221SC..Hα-helixtrans-66.4-35.3-179.6-64.4-70.9000112.7V322 E324 E325 S328 Y425 S431 A432V322-Y428 HydrophobicContact CG2-CD1 4.32Å; V322-Y428 HydrophobicContact CG2-CE1 4.24Å; E324-Y428 HydrophobicContact CB-CD1 3.49Å; E324-Y428 VanDerWaalsContact CB-CD1 3.49Å; E324-Y428 HydrophobicContact CB-CD2 3.76Å; E324-Y428 HydrophobicContact CB-CE1 3.52Å; E324-Y428 HydrophobicContact CB-CE2 3.79Å; E324-Y428 HydrophobicContact CB-CG 3.6Å; E324-Y428 HydrophobicContact CG-CD2 4.46Å; E324-Y428 HydrophobicContact CG-CE1 4.18Å; E324-Y428 HydrophobicContact CG-CE2 4.06Å; E324-Y428 WeakPolarHBondContact O-CB 3.28Å; E325-Y428 HydrophobicContact CG-CD1 4.21Å; S328-Y428 PolarHBondContact OG-O 2.96Å; Y425-Y428 PolarHBondContact O-N 2.93Å; Y428-S431 WeakPolarHBondContact O-CB 3.3Å; Y428-S431 PolarHBondContact O-N 3.15Å; Y428-A432 WeakPolarHBondContact O-CB 3.22Å; Y428-A432 PolarHBondContact O-N 3.17Å
429L96Very high93.6Very high1 Ų142.2 Ų42.21%0.00521%0.213CC..Hα-helixtrans-63.4-44.1175.3-177.162.4000111.4S328 H332 D417 A420 Y425 H427 S431 A432 L433 I467S328-L429 VanDerWaalsContact OG-CA 3.25Å; S328-L429 WeakPolarHBondContact OG-CA 3.44Å; S328-L429 PolarHBondContact OG-N 3.35Å; H332-L429 HydrophobicContact CB-CD1 4.26Å; D417-L429 HydrophobicContact CB-CD2 4.27Å; A420-L429 HydrophobicContact CB-CD2 3.92Å; Y425-L429 VanDerWaalsContact O-CB 3.31Å; Y425-L429 WeakPolarHBondContact O-CB 3.48Å; Y425-L429 PolarHBondContact O-N 3.24Å; H427-L429 VanDerWaalsContact C-N 3.35Å; H427-L429 PolarHBondContact O-N 3.07Å; L429-S431 VanDerWaalsContact C-N 3.3Å; L429-S431 PolarHBondContact O-N 3.41Å; L429-A432 PolarHBondContact O-N 3.35Å; L429-L433 HydrophobicContact CD1-CD1 4.38Å; L429-L433 HydrophobicContact CD1-CG 4.14Å; L429-L433 HydrophobicContact CG-CD1 4.14Å; L429-L433 HydrophobicContact CG-CG 4.32Å; L429-L433 WeakPolarHBondContact O-CB 3.23Å; L429-L433 VanDerWaalsContact O-CG 3.25Å; L429-L433 WeakPolarHBondContact O-CG 3.47Å; L429-L433 PolarHBondContact O-N 2.72Å; L429-I467 HydrophobicContact CD2-CD1 3.72Å; L429-I467 HydrophobicContact CD2-CG1 4.28Å; L429-I467 HydrophobicContact CG-CD1 4.04Å
430K93.5Very high93.4Very high59 Ų5942.2 Ų42.226%0.25722%0.215SC..Hα-helixtrans-58.2-46.1174.8-68.1-177.668.8176.10110.8K426 H427 V434 L464 I467 D468K426-K430 WeakPolarHBondContact O-CG 3.41Å; K426-K430 PolarHBondContact O-N 3.23Å; H427-K430 PolarHBondContact O-N 2.94Å; K430-V434 WeakPolarHBondContact O-CG2 3.39Å; K430-V434 PolarHBondContact O-N 2.92Å; K430-L464 HydrophobicContact CB-CD2 3.77Å; K430-L464 HydrophobicContact CD-CD2 4.41Å; K430-L464 HydrophobicContact CG-CD2 3.71Å; K430-I467 HydrophobicContact CD-CG2 4.15Å; K430-I467 HydrophobicContact CG-CB 4.47Å; K430-I467 HydrophobicContact CG-CD1 4.49Å; K430-I467 HydrophobicContact CG-CG2 3.84Å; K430-D468 WeakPolarHBondContact CE-OD1 3.27Å; K430-D468 IonicContact NZ-OD1 4Å; K430-D468 PolarHBondContact NZ-OD1 3.5Å; K430-D468 IonicContact NZ-OD2 3.61Å; K430-D468 PolarHBondContact NZ-OD2 2.95Å
431S92.5Very high93.2Very high38 Ų3843.3 Ų43.327%0.26622%0.22SC..Hα-helixtrans-61.2-50.6177.8-1660000111.3E325 H427 Y428 L429 L433 V434 I435E325-S431 VanDerWaalsContact OE1-CB 3.3Å; E325-S431 WeakPolarHBondContact OE1-CB 3.43Å; E325-S431 PolarHBondContact OE1-OG 3.43Å; H427-S431 PolarHBondContact O-N 3.23Å; H427-S431 VanDerWaalsContact O-N 3.17Å; Y428-S431 WeakPolarHBondContact O-CB 3.3Å; Y428-S431 PolarHBondContact O-N 3.15Å; L429-S431 VanDerWaalsContact C-N 3.3Å; L429-S431 PolarHBondContact O-N 3.41Å; S431-L433 PolarHBondContact O-N 2.85Å; S431-V434 PolarHBondContact O-N 2.93Å; S431-V434 VanDerWaalsContact O-N 3.08Å; S431-I435 WeakPolarHBondContact O-CG1 3.48Å; S431-I435 PolarHBondContact O-N 2.84Å
432A94.7Very high92.9Very high0 Ų045.6 Ų45.60%024%0.236CC..Hα-helixtrans-61.1-40.3-178.800000112.9E325 S328 V329 Y428 L429 V434 I435 L436E325-A432 HydrophobicContact CB-CB 4.06Å; S328-A432 WeakPolarHBondContact OG-CB 3.35Å; V329-A432 HydrophobicContact CG2-CB 3.65Å; Y428-A432 WeakPolarHBondContact O-CB 3.22Å; Y428-A432 PolarHBondContact O-N 3.17Å; L429-A432 PolarHBondContact O-N 3.35Å; A432-V434 VanDerWaalsContact C-N 3.29Å; A432-V434 PolarHBondContact O-N 3.03Å; A432-I435 PolarHBondContact O-N 3.13Å; A432-L436 WeakPolarHBondContact O-CB 3.39Å; A432-L436 WeakPolarHBondContact O-CG 3.21Å; A432-L436 PolarHBondContact O-N 3.47Å
433L94.5Very high92.8Very high14 Ų1439.9 Ų39.97%0.07321%0.211CC..Hα-helixtrans-63.2-36.5175.8-72.9177.3000112.2L429 S431 L437 L460 R463 I467L429-L433 HydrophobicContact CD1-CD1 4.38Å; L429-L433 HydrophobicContact CD1-CG 4.14Å; L429-L433 HydrophobicContact CG-CD1 4.14Å; L429-L433 HydrophobicContact CG-CG 4.32Å; L429-L433 WeakPolarHBondContact O-CB 3.23Å; L429-L433 VanDerWaalsContact O-CG 3.25Å; L429-L433 WeakPolarHBondContact O-CG 3.47Å; L429-L433 PolarHBondContact O-N 2.72Å; S431-L433 PolarHBondContact O-N 2.85Å; L433-L437 WeakPolarHBondContact O-CB 3.26Å; L433-L437 PolarHBondContact O-N 2.86Å; L433-L460 HydrophobicContact CB-CD1 3.64Å; L433-R463 HydrophobicContact CD1-CB 4.36Å; L433-I467 HydrophobicContact CD1-CD1 3.71Å
434V91.4Very high92.5Very high8 Ų837 Ų375%0.04820%0.197CC..Hα-helixtrans-73.1-37.1175.3-172.30000111.4V56 K430 S431 A432 L436 L437 K438 L460 L464V56-V434 HydrophobicContact CB-CB 4.38Å; V56-V434 HydrophobicContact CB-CG1 3.61Å; V56-V434 HydrophobicContact CB-CG2 4.4Å; V56-V434 HydrophobicContact CG1-CB 3.66Å; V56-V434 HydrophobicContact CG1-CG1 3.12Å; V56-V434 HydrophobicContact CG1-CG2 4.09Å; V56-V434 HydrophobicContact CG2-CG1 4.42Å; V56-V434 HydrophobicContact CG2-CG2 4.34Å; K430-V434 WeakPolarHBondContact O-CG2 3.39Å; K430-V434 PolarHBondContact O-N 2.92Å; S431-V434 PolarHBondContact O-N 2.93Å; S431-V434 VanDerWaalsContact O-N 3.08Å; A432-V434 VanDerWaalsContact C-N 3.29Å; A432-V434 PolarHBondContact O-N 3.03Å; V434-L436 VanDerWaalsContact C-N 3.34Å; V434-L437 PolarHBondContact O-N 3.33Å; V434-K438 WeakPolarHBondContact O-CB 3.33Å; V434-K438 PolarHBondContact O-N 2.81Å; V434-L460 HydrophobicContact CG2-CD2 4.11Å; V434-L464 HydrophobicContact CG2-CD1 4.48Å
435I90.9Very high92.3Very high26 Ų2635 Ų3513%0.13317%0.172CC..Hα-helixtrans-59.6-46.4172.6-68169.8000110.1E325 S431 A432 L437 K438 D439E325-I435 VanDerWaalsContact CD-CD1 3.45Å; E325-I435 WeakPolarHBondContact OE1-CD1 3.45Å; E325-I435 VanDerWaalsContact OE2-CD1 3.27Å; E325-I435 WeakPolarHBondContact OE2-CD1 3.2Å; S431-I435 WeakPolarHBondContact O-CG1 3.48Å; S431-I435 PolarHBondContact O-N 2.84Å; A432-I435 PolarHBondContact O-N 3.13Å; I435-L437 PolarHBondContact O-N 3.11Å; I435-K438 WeakPolarHBondContact O-CB 3.48Å; I435-K438 PolarHBondContact O-N 2.77Å; I435-D439 VanDerWaalsContact O-CB 3.3Å; I435-D439 WeakPolarHBondContact O-CB 3.22Å; I435-D439 VanDerWaalsContact O-CG 3.29Å; I435-D439 PolarHBondContact O-N 3.35Å
436L92.6Very high92.2Very high28 Ų2834.2 Ų34.215%0.14717%0.173CC..Hα-helixtrans-61.2-42.7175.9-74.2171.8000112.1S274 L293 V329 A432 V434 K438 D439 N440S274-L436 WeakPolarHBondContact O-CD2 3.39Å; L293-L436 HydrophobicContact CD1-CD2 3.76Å; L293-L436 HydrophobicContact CD1-CG 4.48Å; V329-L436 HydrophobicContact CG2-CD1 4.15Å; A432-L436 WeakPolarHBondContact O-CB 3.39Å; A432-L436 WeakPolarHBondContact O-CG 3.21Å; A432-L436 PolarHBondContact O-N 3.47Å; V434-L436 VanDerWaalsContact C-N 3.34Å; L436-K438 VanDerWaalsContact C-N 3.35Å; L436-K438 PolarHBondContact O-N 3.34Å; L436-D439 PolarHBondContact O-N 3.43Å; L436-N440 VanDerWaalsContact O-CB 3.26Å; L436-N440 WeakPolarHBondContact O-CB 3.42Å; L436-N440 VanDerWaalsContact O-CG 3.3Å; L436-N440 PolarHBondContact O-N 3.48Å; L436-N440 PolarHBondContact O-ND2 2.86Å
437L91.5Very high92.3Very high16 Ų1632.8 Ų32.88%0.08417%0.167CC..Hα-helixtrans-62.6-42.6175.9-179.1124.7000111.5M57 L433 V434 I435 L441 S442 P444 L460M57-L437 HydrophobicContact CE-CD2 3.22Å; L433-L437 WeakPolarHBondContact O-CB 3.26Å; L433-L437 PolarHBondContact O-N 2.86Å; V434-L437 PolarHBondContact O-N 3.33Å; I435-L437 PolarHBondContact O-N 3.11Å; L437-L441 WeakPolarHBondContact O-CA 3.37Å; L437-L441 PolarHBondContact O-N 2.65Å; L437-S442 WeakPolarHBondContact CD1-O 3.34Å; L437-S442 VanDerWaalsContact CG-O 3.32Å; L437-S442 WeakPolarHBondContact CG-O 3.48Å; L437-S442 PolarHBondContact O-N 2.94Å; L437-P444 HydrophobicContact CD1-CB 4.12Å; L437-P444 HydrophobicContact CD2-CB 4.28Å; L437-L460 HydrophobicContact CB-CD2 4.07Å; L437-L460 HydrophobicContact CD1-CB 3.79Å; L437-L460 HydrophobicContact CD1-CD2 3.69Å; L437-L460 HydrophobicContact CD1-CG 4.33Å; L437-L460 HydrophobicContact CD2-CD2 3.97Å; L437-L460 HydrophobicContact CG-CD2 4.1Å
438K88.4Confident92.4Very high59 Ų5933.8 Ų33.826%0.25717%0.165SC..Hα-helixtrans-63.5-51.5175.9174.5-163.7165.9-154.70111.1K61 Q317 V434 I435 L436 N440 L441K61-K438 HydrophobicContact CD-CD 4.49Å; K61-K438 HydrophobicContact CD-CG 4.33Å; Q317-K438 PolarHBondContact O-NZ 3.41Å; V434-K438 WeakPolarHBondContact O-CB 3.33Å; V434-K438 PolarHBondContact O-N 2.81Å; I435-K438 WeakPolarHBondContact O-CB 3.48Å; I435-K438 PolarHBondContact O-N 2.77Å; L436-K438 VanDerWaalsContact C-N 3.35Å; L436-K438 PolarHBondContact O-N 3.34Å; K438-N440 PolarHBondContact O-N 3.14Å; K438-L441 PolarHBondContact O-N 3.33Å; K438-L441 VanDerWaalsContact O-N 3.09Å
439D89.6Confident92.5Very high10 Ų1030.6 Ų30.65%0.05315%0.154CC..Hα-helixtrans-64-28.3-177.4-76-0.6000111.6F165 S274 R318 G319 I435 L436F165-D439 WeakPolarHBondContact CE1-O 3.41Å; S274-D439 PolarHBondContact OG-OD2 3.03Å; R318-D439 HydrophobicContact CG-CB 4.39Å; R318-D439 WeakPolarHBondContact CG-OD2 3.14Å; G319-D439 WeakPolarHBondContact CA-OD2 3.35Å; G319-D439 PolarHBondContact N-OD2 2.92Å; I435-D439 VanDerWaalsContact O-CB 3.3Å; I435-D439 WeakPolarHBondContact O-CB 3.22Å; I435-D439 VanDerWaalsContact O-CG 3.29Å; I435-D439 PolarHBondContact O-N 3.35Å; L436-D439 PolarHBondContact O-N 3.43Å
440N92.5Very high92.5Very high34 Ų3433 Ų3318%0.18216%0.163CC..THydrogen-bonded Turntrans-98.25.2177.2-62.5-26.7000113.7H273 S274 L436 K438 S442H273-N440 VanDerWaalsContact CA-OD1 3.24Å; H273-N440 WeakPolarHBondContact CA-OD1 3.45Å; H273-N440 VanDerWaalsContact CB-OD1 3.29Å; H273-N440 WeakPolarHBondContact CB-OD1 3.34Å; H273-N440 PolarHBondContact ND1-OD1 3.31Å; S274-N440 PolarHBondContact N-OD1 3.45Å; S274-N440 VanDerWaalsContact N-OD1 3.13Å; S274-N440 PolarHBondContact O-ND2 3.13Å; L436-N440 VanDerWaalsContact O-CB 3.26Å; L436-N440 WeakPolarHBondContact O-CB 3.42Å; L436-N440 VanDerWaalsContact O-CG 3.3Å; L436-N440 PolarHBondContact O-N 3.48Å; L436-N440 PolarHBondContact O-ND2 2.86Å; K438-N440 PolarHBondContact O-N 3.14Å; N440-S442 PolarHBondContact O-N 3.04Å
441L90.9Very high92.6Very high24 Ų2430.2 Ų30.213%0.12615%0.152CC..THydrogen-bonded Turntrans41.636.7-171.5-67.4177.9000113K64 S65 Y68 H163 F165 L437 K438 F443K64-L441 HydrophobicContact CB-CD1 4.45Å; K64-L441 HydrophobicContact CB-CD2 4.14Å; S65-L441 WeakPolarHBondContact CB-O 3.15Å; Y68-L441 HydrophobicContact CD1-CB 3.96Å; Y68-L441 HydrophobicContact CG-CB 4.5Å; H163-L441 HydrophobicContact CB-CD1 4.34Å; F165-L441 HydrophobicContact CE1-CG 4.42Å; F165-L441 HydrophobicContact CE2-CB 3.88Å; F165-L441 HydrophobicContact CE2-CD1 3.65Å; F165-L441 HydrophobicContact CE2-CG 3.99Å; F165-L441 HydrophobicContact CZ-CB 3.56Å; F165-L441 HydrophobicContact CZ-CD1 3.55Å; F165-L441 HydrophobicContact CZ-CG 3.45Å; F165-L441 VanDerWaalsContact CZ-CG 3.45Å; L437-L441 WeakPolarHBondContact O-CA 3.37Å; L437-L441 PolarHBondContact O-N 2.65Å; K438-L441 PolarHBondContact O-N 3.33Å; K438-L441 VanDerWaalsContact O-N 3.09Å; L441-F443 PolarHBondContact O-N 3.33Å
442S90.5Very high92.7Very high53 Ų5331.8 Ų31.837%0.37116%0.156SC..  trans-71.1128.9-178.1-65.40000109.2L437 N440 P444L437-S442 WeakPolarHBondContact CD1-O 3.34Å; L437-S442 VanDerWaalsContact CG-O 3.32Å; L437-S442 WeakPolarHBondContact CG-O 3.48Å; L437-S442 PolarHBondContact O-N 2.94Å; N440-S442 PolarHBondContact O-N 3.04Å; S442-P444 WeakPolarHBondContact O-CD 3.19Å
443F92.9Very high92.8Very high22 Ų2234.3 Ų34.310%0.09617%0.167CC..  trans-73.4122.8-177.6-173-110.1000110.2I43 T46 F62 R66 A69 L441 V445I43-F443 HydrophobicContact CB-CD1 4.36Å; I43-F443 HydrophobicContact CB-CE1 4.06Å; I43-F443 HydrophobicContact CG1-CD1 3.58Å; I43-F443 HydrophobicContact CG1-CE1 3.68Å; I43-F443 HydrophobicContact CG1-CG 4.37Å; I43-F443 HydrophobicContact CG2-CD1 4.39Å; I43-F443 HydrophobicContact CG2-CE1 4.22Å; I43-F443 HydrophobicContact CG2-CZ 4.34Å; T46-F443 HydrophobicContact CG2-CZ 4.41Å; F62-F443 HydrophobicContact CE1-CE2 4.24Å; F62-F443 HydrophobicContact CE2-CD2 4.46Å; F62-F443 AromaticContact CE2-CE2 3.7Å; F62-F443 HydrophobicContact CE2-CE2 3.7Å; F62-F443 HydrophobicContact CE2-CZ 4.24Å; F62-F443 AromaticContact CZ-CE2 3.53Å; F62-F443 HydrophobicContact CZ-CE2 3.53Å; F62-F443 AromaticContact CZ-CZ 3.87Å; F62-F443 HydrophobicContact CZ-CZ 3.87Å; R66-F443 HydrophobicContact CB-CD2 3.99Å; R66-F443 HydrophobicContact CB-CE2 3.7Å; R66-F443 HydrophobicContact CG-CD2 4.27Å; R66-F443 HydrophobicContact CG-CE2 3.72Å; R66-F443 HydrophobicContact CG-CZ 4.2Å; A69-F443 HydrophobicContact CB-CB 3.73Å; A69-F443 HydrophobicContact CB-CG 4.26Å; L441-F443 PolarHBondContact O-N 3.33Å; F443-V445 VanDerWaalsContact C-N 3.33Å; F443-V445 HydrophobicContact CD1-CB 4.37Å; F443-V445 WeakPolarHBondContact CD1-O 3.28Å; F443-V445 HydrophobicContact CE1-CB 3.71Å; F443-V445 WeakPolarHBondContact CE1-O 3.38Å; F443-V445 HydrophobicContact CZ-CB 4.17Å; F443-V445 PolarHBondContact O-N 3.38Å
444P88.3Confident92.8Very high3 Ų336.6 Ų36.62%0.01918%0.179CC..SBendtrans-78.1-14.3-166.427.9-35000114.9L53 M57 F62 L437 S442L53-P444 HydrophobicContact CD1-CB 3.31Å; L53-P444 HydrophobicContact CD1-CG 3.72Å; M57-P444 HydrophobicContact SD-CG 4.36Å; F62-P444 HydrophobicContact CD2-CG 4.08Å; F62-P444 HydrophobicContact CE2-CG 3.84Å; L437-P444 HydrophobicContact CD1-CB 4.12Å; L437-P444 HydrophobicContact CD2-CB 4.28Å; S442-P444 WeakPolarHBondContact O-CD 3.19Å
445V90.3Very high93Very high18 Ų1838.5 Ų38.511%0.10919%0.187CC..  trans-106.9124.8-176-178.80000110.3Q39 K42 T46 P50 F443Q39-V445 PolarHBondContact NE2-O 3.24Å; K42-V445 HydrophobicContact CD-CG1 4.42Å; K42-V445 HydrophobicContact CG-CG1 4.1Å; T46-V445 HydrophobicContact CG2-CB 4.33Å; T46-V445 HydrophobicContact CG2-CG1 4.35Å; T46-V445 HydrophobicContact CG2-CG2 4.05Å; P50-V445 HydrophobicContact CG-CG2 3.48Å; P50-V445 VanDerWaalsContact CG-CG2 3.48Å; F443-V445 VanDerWaalsContact C-N 3.33Å; F443-V445 HydrophobicContact CD1-CB 4.37Å; F443-V445 WeakPolarHBondContact CD1-O 3.28Å; F443-V445 HydrophobicContact CE1-CB 3.71Å; F443-V445 WeakPolarHBondContact CE1-O 3.38Å; F443-V445 HydrophobicContact CZ-CB 4.17Å; F443-V445 PolarHBondContact O-N 3.38Å
446C92.7Very high93.1Very high29 Ų2939.7 Ų39.720%0.19620%0.198CC..  trans-120.9146.8-177.1-51.80000111.2H455 P459C446-H455 VanDerWaalsContact SG-CE1 3.59Å; C446-P459 HydrophobicContact CB-CB 4.49Å; C446-P459 HydrophobicContact CB-CG 3.96Å
447D96.1Very high93.1Very high15 Ų1543 Ų438%0.0821%0.212CC..  trans-68.5131.6160.8177.2-106.9000108.5R38 K42 L449 Y450 S451R38-D447 HydrophobicContact CB-CB 4.46Å; R38-D447 IonicContact CZ-OD1 2.85Å; R38-D447 IonicContact CZ-OD2 3.79Å; R38-D447 IonicContact NE-OD1 2.81Å; R38-D447 PolarHBondContact NE-OD1 3.44Å; R38-D447 IonicContact NE-OD2 3.76Å; R38-D447 PolarHBondContact NE-OD2 2.79Å; R38-D447 IonicContact NH2-OD1 3.92Å; R38-D447 IonicContact NH2-OD2 3.8Å; R38-D447 PolarHBondContact NH2-OD2 2.98Å; K42-D447 HydrophobicContact CB-CB 4.39Å; D447-L449 VanDerWaalsContact C-N 3.3Å; D447-L449 PolarHBondContact O-N 3.47Å; D447-L449 PolarHBondContact OD1-N 3.36Å; D447-Y450 PolarHBondContact O-N 3.05Å; D447-Y450 PolarHBondContact OD1-N 3.48Å; D447-S451 WeakPolarHBondContact O-CB 3.45Å; D447-S451 PolarHBondContact O-N 3.31Å
448W94.9Very high93.3Very high162 Ų16242.4 Ų42.461%0.61421%0.21SC*.Hα-helixtrans-62.3-38.4-173.369.4-89.8000112.1M452W448-M452 HydrophobicContact CZ3-SD 4.41Å; W448-M452 WeakPolarHBondContact O-CB 3.36Å; W448-M452 PolarHBondContact O-N 2.78Å
449L96.8Very high93.4Very high23 Ų2340.4 Ų40.412%0.1220%0.202CC..Hα-helixtrans-74.9-44-177.1-175.664.6000110.2W31 Y34 L35 D447 S451 M452 F453W31-L449 HydrophobicContact CH2-CD2 4.08Å; Y34-L449 HydrophobicContact CE1-CD2 4.38Å; L35-L449 HydrophobicContact CD2-CB 4.44Å; L35-L449 HydrophobicContact CD2-CD2 3.65Å; L35-L449 HydrophobicContact CD2-CG 3.62Å; D447-L449 VanDerWaalsContact C-N 3.3Å; D447-L449 PolarHBondContact O-N 3.47Å; D447-L449 PolarHBondContact OD1-N 3.36Å; L449-S451 VanDerWaalsContact C-N 3.33Å; L449-S451 PolarHBondContact O-N 3.27Å; L449-M452 WeakPolarHBondContact O-CB 3.11Å; L449-M452 PolarHBondContact O-N 3.45Å; L449-F453 HydrophobicContact CD1-CD2 4.19Å; L449-F453 HydrophobicContact CD1-CE2 3.85Å; L449-F453 WeakPolarHBondContact O-CD2 3.45Å; L449-F453 PolarHBondContact O-N 3.38Å
450Y96.9Very high93.5Very high51 Ų5140.6 Ų40.620%0.220%0.203CC..Hα-helixtrans-55.9-49.4170.7179.8-95.2000111.5L35 Q39 D447 M452 F453 N454 H455L35-Y450 HydrophobicContact CB-CD2 3.93Å; L35-Y450 WeakPolarHBondContact O-CD2 3.45Å; Q39-Y450 HydrophobicContact CB-CD1 3.8Å; Q39-Y450 HydrophobicContact CB-CD2 3.77Å; Q39-Y450 HydrophobicContact CB-CE1 4.2Å; Q39-Y450 HydrophobicContact CB-CE2 4.2Å; Q39-Y450 HydrophobicContact CB-CG 3.56Å; Q39-Y450 HydrophobicContact CG-CD1 3.71Å; Q39-Y450 HydrophobicContact CG-CD2 4.45Å; Q39-Y450 HydrophobicContact CG-CE1 3.82Å; Q39-Y450 HydrophobicContact CG-CG 4.04Å; D447-Y450 PolarHBondContact O-N 3.05Å; D447-Y450 PolarHBondContact OD1-N 3.48Å; Y450-M452 PolarHBondContact O-N 3.13Å; Y450-F453 PolarHBondContact O-N 3.3Å; Y450-N454 HydrophobicContact CD2-CB 4.5Å; Y450-N454 HydrophobicContact CE1-CB 4.14Å; Y450-N454 HydrophobicContact CE2-CB 4.12Å; Y450-N454 WeakPolarHBondContact CE2-ND2 3.37Å; Y450-N454 WeakPolarHBondContact O-CB 3.29Å; Y450-N454 PolarHBondContact O-N 3.49Å; Y450-H455 AromaticContact CE1-CE1 3.92Å; Y450-H455 AromaticContact CE1-NE2 3.49Å; Y450-H455 WeakPolarHBondContact CE1-NE2 3.39Å
451S95.7Very high93.4Very high1 Ų141.3 Ų41.31%0.00721%0.207CC..Hα-helixtrans-64-27.3-179.7-170.60000113.2D447 L449 H455 P459D447-S451 WeakPolarHBondContact O-CB 3.45Å; D447-S451 PolarHBondContact O-N 3.31Å; L449-S451 VanDerWaalsContact C-N 3.33Å; L449-S451 PolarHBondContact O-N 3.27Å; S451-H455 WeakPolarHBondContact O-CB 3.29Å; S451-H455 PolarHBondContact O-N 3.48Å; S451-H455 PolarHBondContact OG-ND1 2.74Å; S451-P459 VanDerWaalsContact OG-CD 3.32Å; S451-P459 WeakPolarHBondContact OG-CD 3.49Å; S451-P459 VanDerWaalsContact OG-CG 3.23Å; S451-P459 WeakPolarHBondContact OG-CG 3.48Å
452M94.6Very high93.4Very high71 Ų7143.6 Ų43.635%0.3522%0.217SC..Hα-helixtrans-68.5-36.7178.4-177.8167.9173.600112.6F403 W448 L449 Y450F403-M452 HydrophobicContact CE2-CE 4.22Å; F403-M452 HydrophobicContact CE2-CG 4.1Å; F403-M452 HydrophobicContact CZ-CE 3.74Å; W448-M452 HydrophobicContact CZ3-SD 4.41Å; W448-M452 WeakPolarHBondContact O-CB 3.36Å; W448-M452 PolarHBondContact O-N 2.78Å; L449-M452 WeakPolarHBondContact O-CB 3.11Å; L449-M452 PolarHBondContact O-N 3.45Å; Y450-M452 PolarHBondContact O-N 3.13Å
453F96Very high93.6Very high54 Ų5442.2 Ų42.224%0.23720%0.204CC..Hα-helixtrans-92.7-36.9-177.5-79.4-101000113.2W31 L35 F403 L449 Y450W31-F453 HydrophobicContact CZ2-CE1 4.49Å; W31-F453 HydrophobicContact CZ2-CE2 4.15Å; W31-F453 HydrophobicContact CZ2-CZ 4.08Å; W31-F453 AromaticContact NE1-CE1 4Å; L35-F453 HydrophobicContact CD1-CB 3.84Å; L35-F453 HydrophobicContact CD1-CD2 4.3Å; L35-F453 HydrophobicContact CD1-CG 3.98Å; F403-F453 AromaticContact CD2-CD1 3.57Å; F403-F453 HydrophobicContact CD2-CD1 3.57Å; F403-F453 HydrophobicContact CD2-CD2 4.47Å; F403-F453 AromaticContact CD2-CE1 3.65Å; F403-F453 HydrophobicContact CD2-CE1 3.65Å; F403-F453 HydrophobicContact CD2-CG 4.01Å; F403-F453 HydrophobicContact CD2-CZ 4.15Å; F403-F453 HydrophobicContact CE2-CD1 4.06Å; F403-F453 HydrophobicContact CE2-CD2 4.18Å; F403-F453 AromaticContact CE2-CE1 3.95Å; F403-F453 HydrophobicContact CE2-CE1 3.95Å; F403-F453 HydrophobicContact CE2-CE2 4.07Å; F403-F453 HydrophobicContact CE2-CG 4.18Å; F403-F453 AromaticContact CE2-CZ 3.95Å; F403-F453 HydrophobicContact CE2-CZ 3.95Å; F403-F453 HydrophobicContact CG-CD1 4.37Å; F403-F453 HydrophobicContact CG-CE1 4.21Å; L449-F453 HydrophobicContact CD1-CD2 4.19Å; L449-F453 HydrophobicContact CD1-CE2 3.85Å; L449-F453 WeakPolarHBondContact O-CD2 3.45Å; L449-F453 PolarHBondContact O-N 3.38Å; Y450-F453 PolarHBondContact O-N 3.3Å
454N95.3Very high93.6Very high61 Ų6142 Ų4233%0.32620%0.204SC..Hα-helixtrans-109.8-12.5-163.8-73.4-47.8000115.5E32 Y450E32-N454 PolarHBondContact OE2-ND2 3Å; E32-N454 PolarHBondContact OE2-OD1 2.91Å; Y450-N454 HydrophobicContact CD2-CB 4.5Å; Y450-N454 HydrophobicContact CE1-CB 4.14Å; Y450-N454 HydrophobicContact CE2-CB 4.12Å; Y450-N454 WeakPolarHBondContact CE2-ND2 3.37Å; Y450-N454 WeakPolarHBondContact O-CB 3.29Å; Y450-N454 PolarHBondContact O-N 3.49Å
455H94.7Very high93.7Very high49 Ų4944.5 Ų44.523%0.22722%0.221CC..  trans-105.6104.2-177.9-68.8163.2000112R410 C446 Y450 S451 H457R410-H455 VanDerWaalsContact CD-O 3.26Å; R410-H455 WeakPolarHBondContact CD-O 3.46Å; R410-H455 VanDerWaalsContact CG-O 3.27Å; R410-H455 WeakPolarHBondContact CG-O 3.28Å; C446-H455 VanDerWaalsContact SG-CE1 3.59Å; Y450-H455 AromaticContact CE1-CE1 3.92Å; Y450-H455 AromaticContact CE1-NE2 3.49Å; Y450-H455 WeakPolarHBondContact CE1-NE2 3.39Å; S451-H455 WeakPolarHBondContact O-CB 3.29Å; S451-H455 PolarHBondContact O-N 3.48Å; S451-H455 PolarHBondContact OG-ND1 2.74Å; H455-H457 VanDerWaalsContact C-N 3.25Å; H455-H457 WeakPolarHBondContact CB-O 3.34Å; H455-H457 PolarHBondContact O-N 3.36Å
456S93.9Very high93.9Very high50 Ų5045 Ų4535%0.3523%0.227SC..SBendtrans-66-28.8171.157.10000112.8S409 R410S409-S456 CarbonylContact C-O 3.56Å; S409-S456 PolarHBondContact OG-O 3.15Å; R410-S456 WeakPolarHBondContact CG-O 3.27Å; R410-S456 PolarHBondContact N-O 3.34Å
457H93.3Very high93.9Very high97 Ų9743.7 Ų43.745%0.44922%0.218SC..SBendtrans-101.8125.4168.9-64-94.1000110.2E413 H455E413-H457 IonicContact OE1-CE1 2.94Å; E413-H457 PolarHBondContact OE1-CE1 3.15Å; E413-H457 IonicContact OE1-ND1 3.51Å; E413-H457 PolarHBondContact OE1-ND1 3.29Å; E413-H457 IonicContact OE2-CE1 2.68Å; E413-H457 PolarHBondContact OE2-CE1 3.1Å; E413-H457 IonicContact OE2-CG 3.18Å; E413-H457 IonicContact OE2-ND1 2.68Å; E413-H457 PolarHBondContact OE2-ND1 2.91Å; H455-H457 VanDerWaalsContact C-N 3.25Å; H455-H457 WeakPolarHBondContact CB-O 3.34Å; H455-H457 PolarHBondContact O-N 3.36Å
458P94.1Very high93.6Very high5 Ų546.7 Ų46.73%0.03223%0.234CC..PPolyproline II helixtrans-58.6150177-1929.1000112.1R410 E413 F414 E462 R463R410-P458 HydrophobicContact CB-CG 3.96Å; R410-P458 HydrophobicContact CG-CG 4Å; E413-P458 HydrophobicContact CB-CG 4.22Å; F414-P458 HydrophobicContact CD1-CG 4.49Å; F414-P458 HydrophobicContact CD2-CG 4.13Å; F414-P458 HydrophobicContact CE1-CB 4.02Å; F414-P458 HydrophobicContact CE1-CG 3.96Å; F414-P458 HydrophobicContact CE2-CB 4.06Å; F414-P458 HydrophobicContact CE2-CG 3.54Å; F414-P458 HydrophobicContact CZ-CB 3.49Å; F414-P458 VanDerWaalsContact CZ-CB 3.49Å; F414-P458 HydrophobicContact CZ-CG 3.44Å; F414-P458 VanDerWaalsContact CZ-CG 3.44Å; P458-E462 HydrophobicContact CB-CB 4.38Å; P458-R463 HydrophobicContact CB-CG 3.97Å; P458-R463 HydrophobicContact CG-CG 4.41Å; P458-R463 WeakPolarHBondContact O-CD 3.32Å
459P92.2Very high93.3Very high16 Ų1646.9 Ų46.910%0.10424%0.239CC..PPolyproline II helixtrans-53.4148174.4-26.134.3000112.4C446 S451 L461 E462 R463C446-P459 HydrophobicContact CB-CB 4.49Å; C446-P459 HydrophobicContact CB-CG 3.96Å; S451-P459 VanDerWaalsContact OG-CD 3.32Å; S451-P459 WeakPolarHBondContact OG-CD 3.49Å; S451-P459 VanDerWaalsContact OG-CG 3.23Å; S451-P459 WeakPolarHBondContact OG-CG 3.48Å; P459-L461 VanDerWaalsContact C-N 3.27Å; P459-L461 PolarHBondContact O-N 3.09Å; P459-L461 VanDerWaalsContact O-N 3.17Å; P459-E462 HydrophobicContact CB-CG 4.48Å; P459-E462 WeakPolarHBondContact O-CB 3.37Å; P459-E462 PolarHBondContact O-N 3.36Å; P459-R463 PolarHBondContact O-N 3.39Å; P459-R463 VanDerWaalsContact O-N 3.14Å
460L91.6Very high92.8Very high14 Ų1447.1 Ų47.17%0.07324%0.243CC..Hα-helixtrans-50.4-46.5-177176.466.8000112.3L53 L433 V434 L437 E462 R463 L464L53-L460 HydrophobicContact CD2-CD2 3.83Å; L433-L460 HydrophobicContact CB-CD1 3.64Å; V434-L460 HydrophobicContact CG2-CD2 4.11Å; L437-L460 HydrophobicContact CB-CD2 4.07Å; L437-L460 HydrophobicContact CD1-CB 3.79Å; L437-L460 HydrophobicContact CD1-CD2 3.69Å; L437-L460 HydrophobicContact CD1-CG 4.33Å; L437-L460 HydrophobicContact CD2-CD2 3.97Å; L437-L460 HydrophobicContact CG-CD2 4.1Å; L460-E462 VanDerWaalsContact C-N 3.29Å; L460-E462 PolarHBondContact O-N 2.9Å; L460-R463 PolarHBondContact O-N 2.99Å; L460-R463 VanDerWaalsContact O-N 3.14Å; L460-L464 HydrophobicContact CD1-CD1 4.07Å; L460-L464 HydrophobicContact CD1-CD2 4.15Å; L460-L464 HydrophobicContact CD1-CG 3.88Å; L460-L464 HydrophobicContact CD2-CD1 4.28Å; L460-L464 HydrophobicContact CG-CD1 3.83Å; L460-L464 HydrophobicContact CG-CG 4.05Å; L460-L464 VanDerWaalsContact O-CG 3.3Å; L460-L464 WeakPolarHBondContact O-CG 3.35Å; L460-L464 PolarHBondContact O-N 3.03Å
461L89Confident91.6Very high49 Ų4953.6 Ų53.626%0.25727%0.272SS..Hα-helixtrans-59.7-38.5-178.7-66.3177.8000112.8E52 L53 P459 S465E52-L461 HydrophobicContact CB-CD2 3.89Å; L53-L461 HydrophobicContact CD1-CD2 3.9Å; L53-L461 HydrophobicContact CD1-CG 4.43Å; L53-L461 HydrophobicContact CD2-CD2 4.1Å; L53-L461 HydrophobicContact CG-CD2 3.76Å; P459-L461 VanDerWaalsContact C-N 3.27Å; P459-L461 PolarHBondContact O-N 3.09Å; P459-L461 VanDerWaalsContact O-N 3.17Å; L461-S465 WeakPolarHBondContact O-CB 3.47Å; L461-S465 PolarHBondContact O-N 3.43Å
462E92.4Very high89.9Confident72 Ų7257.7 Ų57.734%0.33630%0.3SS..Hα-helixtrans-67.1-43.5176.1-65.1-177-164.900111R410 F414 P458 P459 L460 S465 A466R410-E462 IonicContact CZ-OE2 3.39Å; R410-E462 IonicContact NH2-OE1 3.75Å; R410-E462 IonicContact NH2-OE2 2.78Å; R410-E462 PolarHBondContact NH2-OE2 2.85Å; F414-E462 HydrophobicContact CE1-CB 4.44Å; F414-E462 HydrophobicContact CZ-CB 4.25Å; P458-E462 HydrophobicContact CB-CB 4.38Å; P459-E462 HydrophobicContact CB-CG 4.48Å; P459-E462 WeakPolarHBondContact O-CB 3.37Å; P459-E462 PolarHBondContact O-N 3.36Å; L460-E462 VanDerWaalsContact C-N 3.29Å; L460-E462 PolarHBondContact O-N 2.9Å; E462-S465 PolarHBondContact O-N 2.87Å; E462-A466 WeakPolarHBondContact O-CB 3.44Å; E462-A466 PolarHBondContact O-N 3.47Å
463R94.4Very high87.9Confident24 Ų2464.1 Ų64.19%0.09134%0.336CS..Hα-helixtrans-62.7-47.4177.3-64.2-176.967.11763.4111.5H332 E413 F414 D417 L433 P458 P459 L460 S465 A466 I467H332-R463 PolarHBondContact CE1-NH2 3.32Å; H332-R463 PolarHBondContact ND1-NH2 3.16Å; E413-R463 IonicContact OE2-CZ 3.23Å; E413-R463 IonicContact OE2-NH1 3.5Å; E413-R463 IonicContact OE2-NH2 3.75Å; F414-R463 HydrophobicContact CE1-CG 4.35Å; D417-R463 IonicContact OD1-CZ 2.62Å; D417-R463 IonicContact OD1-NE 3.05Å; D417-R463 IonicContact OD1-NH2 2.74Å; D417-R463 PolarHBondContact OD1-NH2 3.03Å; D417-R463 IonicContact OD2-CZ 3.47Å; D417-R463 IonicContact OD2-NE 3.31Å; D417-R463 PolarHBondContact OD2-NE 2.72Å; D417-R463 IonicContact OD2-NH2 3.15Å; D417-R463 PolarHBondContact OD2-NH2 2.81Å; L433-R463 HydrophobicContact CD1-CB 4.36Å; P458-R463 HydrophobicContact CB-CG 3.97Å; P458-R463 HydrophobicContact CG-CG 4.41Å; P458-R463 WeakPolarHBondContact O-CD 3.32Å; P459-R463 PolarHBondContact O-N 3.39Å; P459-R463 VanDerWaalsContact O-N 3.14Å; L460-R463 PolarHBondContact O-N 2.99Å; L460-R463 VanDerWaalsContact O-N 3.14Å; R463-S465 VanDerWaalsContact C-N 3.35Å; R463-S465 PolarHBondContact O-N 3.22Å; R463-A466 PolarHBondContact O-N 3.28Å; R463-I467 WeakPolarHBondContact O-CB 3.12Å; R463-I467 WeakPolarHBondContact O-CD1 3.24Å; R463-I467 VanDerWaalsContact O-CG1 3.23Å; R463-I467 WeakPolarHBondContact O-CG1 3.42Å; R463-I467 PolarHBondContact O-N 3.03Å
464L91.9Very high87.4Confident19 Ų1964.7 Ų64.710%0.09934%0.341CS..Hα-helixtrans-59.3-45.4177.2-66.4179.3000111.4L53 K430 V434 L460 A466 I467 D468L53-L464 HydrophobicContact CD2-CD1 4.15Å; K430-L464 HydrophobicContact CB-CD2 3.77Å; K430-L464 HydrophobicContact CD-CD2 4.41Å; K430-L464 HydrophobicContact CG-CD2 3.71Å; V434-L464 HydrophobicContact CG2-CD1 4.48Å; L460-L464 HydrophobicContact CD1-CD1 4.07Å; L460-L464 HydrophobicContact CD1-CD2 4.15Å; L460-L464 HydrophobicContact CD1-CG 3.88Å; L460-L464 HydrophobicContact CD2-CD1 4.28Å; L460-L464 HydrophobicContact CG-CD1 3.83Å; L460-L464 HydrophobicContact CG-CG 4.05Å; L460-L464 VanDerWaalsContact O-CG 3.3Å; L460-L464 WeakPolarHBondContact O-CG 3.35Å; L460-L464 PolarHBondContact O-N 3.03Å; L464-A466 PolarHBondContact O-N 3.39Å; L464-I467 PolarHBondContact O-N 3.04Å; L464-D468 PolarHBondContact O-N 3.28Å
465S91.1Very high87Confident55 Ų5564.8 Ų64.839%0.38534%0.342SS..Hα-helixtrans-62.2-40.5176.5-173.60000112.5L461 E462 R463 D468 K469L461-S465 WeakPolarHBondContact O-CB 3.47Å; L461-S465 PolarHBondContact O-N 3.43Å; E462-S465 PolarHBondContact O-N 2.87Å; R463-S465 VanDerWaalsContact C-N 3.35Å; R463-S465 PolarHBondContact O-N 3.22Å; S465-D468 PolarHBondContact O-N 2.86Å; S465-K469 WeakPolarHBondContact O-CG 3.31Å; S465-K469 PolarHBondContact O-N 2.94Å
466A93.3Very high86.6Confident29 Ų2965.7 Ų65.724%0.2435%0.349CS..Hα-helixtrans-67-42176.600000112.3F414 E462 R463 L464 D468 K469 C470F414-A466 HydrophobicContact CD1-CB 3.67Å; F414-A466 HydrophobicContact CE1-CB 3.83Å; E462-A466 WeakPolarHBondContact O-CB 3.44Å; E462-A466 PolarHBondContact O-N 3.47Å; R463-A466 PolarHBondContact O-N 3.28Å; L464-A466 PolarHBondContact O-N 3.39Å; A466-D468 VanDerWaalsContact C-N 3.32Å; A466-D468 PolarHBondContact O-N 3.47Å; A466-K469 PolarHBondContact O-N 2.93Å; A466-C470 PolarHBondContact O-N 2.87Å; A466-C470 PolarHBondContact O-SG 3.01Å; A466-C470 VanDerWaalsContact O-SG 3.36Å
467I93Very high86.2Confident0 Ų066.6 Ų66.60%035%0.349CS..Hα-helixtrans-62.1-41.7175.2-68.6163.3000110.2D417 K426 L429 K430 L433 R463 L464 K469 C470D417-I467 HydrophobicContact CB-CD1 4.25Å; D417-I467 HydrophobicContact CB-CG1 3.92Å; K426-I467 WeakPolarHBondContact CE-O 3.37Å; K426-I467 HydrophobicContact CG-CG2 3.65Å; K426-I467 PolarHBondContact NZ-O 3.3Å; L429-I467 HydrophobicContact CD2-CD1 3.72Å; L429-I467 HydrophobicContact CD2-CG1 4.28Å; L429-I467 HydrophobicContact CG-CD1 4.04Å; K430-I467 HydrophobicContact CD-CG2 4.15Å; K430-I467 HydrophobicContact CG-CB 4.47Å; K430-I467 HydrophobicContact CG-CD1 4.49Å; K430-I467 HydrophobicContact CG-CG2 3.84Å; L433-I467 HydrophobicContact CD1-CD1 3.71Å; R463-I467 WeakPolarHBondContact O-CB 3.12Å; R463-I467 WeakPolarHBondContact O-CD1 3.24Å; R463-I467 VanDerWaalsContact O-CG1 3.23Å; R463-I467 WeakPolarHBondContact O-CG1 3.42Å; R463-I467 PolarHBondContact O-N 3.03Å; L464-I467 PolarHBondContact O-N 3.04Å; I467-K469 VanDerWaalsContact C-N 3.26Å; I467-K469 PolarHBondContact O-N 3.47Å; I467-C470 VanDerWaalsContact O-CB 3.27Å; I467-C470 WeakPolarHBondContact O-CB 3.3Å; I467-C470 PolarHBondContact O-N 3.12Å
468D89.8Confident85.7Confident79 Ų7964.8 Ų64.842%0.42234%0.342SS..Hα-helixtrans-61.4-35.6178.8-78.4-26.7000112.9K426 K430 L464 S465 A466 C470K426-D468 PolarHBondContact NZ-O 2.82Å; K430-D468 WeakPolarHBondContact CE-OD1 3.27Å; K430-D468 IonicContact NZ-OD1 4Å; K430-D468 PolarHBondContact NZ-OD1 3.5Å; K430-D468 IonicContact NZ-OD2 3.61Å; K430-D468 PolarHBondContact NZ-OD2 2.95Å; L464-D468 PolarHBondContact O-N 3.28Å; S465-D468 PolarHBondContact O-N 2.86Å; A466-D468 VanDerWaalsContact C-N 3.32Å; A466-D468 PolarHBondContact O-N 3.47Å; D468-C470 VanDerWaalsContact C-N 3.28Å; D468-C470 PolarHBondContact O-N 3Å
469K90.2Very high85.2Confident165 Ų16568.7 Ų68.772%0.71736%0.363SS*.Hα-helixtrans-73.2-16175.3-67.4170.3-172.61750113.8S465 A466 I467 K471S465-K469 WeakPolarHBondContact O-CG 3.31Å; S465-K469 PolarHBondContact O-N 2.94Å; A466-K469 PolarHBondContact O-N 2.93Å; I467-K469 VanDerWaalsContact C-N 3.26Å; I467-K469 PolarHBondContact O-N 3.47Å; K469-K471 PolarHBondContact O-N 3.36Å
470C86.2Confident84.7Confident29 Ų2972.5 Ų72.520%0.19638%0.381CS..SBendtrans-67.7122.3173.4-64.90000108.9A421 K426 A466 I467 D468 S472A421-C470 HydrophobicContact CB-CB 4.03Å; K426-C470 PolarHBondContact NZ-O 3.35Å; A466-C470 PolarHBondContact O-N 2.87Å; A466-C470 PolarHBondContact O-SG 3.01Å; A466-C470 VanDerWaalsContact O-SG 3.36Å; I467-C470 VanDerWaalsContact O-CB 3.27Å; I467-C470 WeakPolarHBondContact O-CB 3.3Å; I467-C470 PolarHBondContact O-N 3.12Å; D468-C470 VanDerWaalsContact C-N 3.28Å; D468-C470 PolarHBondContact O-N 3Å; C470-S472 PolarHBondContact O-N 3.03Å
471K70.1Confident84.1Confident186 Ų18677 Ų7781%0.80941%0.405SS*.PPolyproline II helixtrans-59.9122.8170.3-67-175.7177.2-175.90107.7K469K469-K471 PolarHBondContact O-N 3.36Å
472S60.2Low83.7Confident87 Ų8779.3 Ų79.361%0.60842%0.418SS*.PPolyproline II helixtrans-68.8129.715842.40000106.3C470C470-S472 PolarHBondContact O-N 3.03Å
473D52.3Low83Confident207 Ų20780 Ų80100%1.10743%0.425SS*.  trans-57.30167.2-75.6-23.1000111

Retrieved 473 of 473 residues in 116.7 ms (Link to these results)

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