A0A087YH69_POEFO Loading...

Conserved oligomeric Golgi complex subunit 7

AlphaFold DB , UniProt , Accession A0A087YH69, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 769 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
1M54.5Low64.8Low116 Ų116109.2 Ų109.257%0.57156%0.561SS**  0126.80-90.5-165.5179.700105.9F3 W16 A20 L39M1-F3 HydrophobicContact CB-CD1 3.83Å; M1-F3 HydrophobicContact CB-CD2 4.12Å; M1-F3 HydrophobicContact CB-CE1 3.33Å; M1-F3 HydrophobicContact CB-CE2 3.6Å; M1-F3 HydrophobicContact CB-CG 4.26Å; M1-F3 HydrophobicContact CB-CZ 3.21Å; M1-F3 HydrophobicContact CG-CE1 4.01Å; M1-F3 HydrophobicContact CG-CZ 4.05Å; M1-F3 WeakPolarHBondContact O-CD2 3.5Å; M1-F3 WeakPolarHBondContact O-CE2 3.29Å; M1-F3 PolarHBondContact O-N 3.42Å; M1-F3 HydrophobicContact SD-CD1 4.35Å; M1-F3 HydrophobicContact SD-CE1 3.4Å; M1-F3 WeakPolarHBondContact SD-CE1 3.36Å; M1-F3 HydrophobicContact SD-CZ 3.78Å; M1-W16 HydrophobicContact CE-CH2 4.49Å; M1-W16 HydrophobicContact CE-CZ2 4.04Å; M1-W16 HydrophobicContact SD-CH2 4.18Å; M1-W16 HydrophobicContact SD-CZ2 3.47Å; M1-W16 WeakPolarHBondContact SD-CZ2 3.46Å; M1-A20 HydrophobicContact CE-CB 3.68Å; M1-L39 HydrophobicContact CE-CD1 3.26Å; M1-L39 HydrophobicContact CE-CD2 4.15Å; M1-L39 HydrophobicContact CE-CG 4.29Å; M1-L39 HydrophobicContact SD-CD1 3.67Å
2D54Low65.5Low125 Ų125106.4 Ų106.467%0.66855%0.548SS*.  trans-84.5106.5176-164-16.5000107S4D2-S4 PolarHBondContact OD1-OG 3.33Å
3F60.4Low66.2Low57 Ų57104.9 Ų104.925%0.2555%0.546CS..G310 helixtrans-98.64.7-167.3-65-62.7000113M1 K5 F6 W16M1-F3 HydrophobicContact CB-CD1 3.83Å; M1-F3 HydrophobicContact CB-CD2 4.12Å; M1-F3 HydrophobicContact CB-CE1 3.33Å; M1-F3 HydrophobicContact CB-CE2 3.6Å; M1-F3 HydrophobicContact CB-CG 4.26Å; M1-F3 HydrophobicContact CB-CZ 3.21Å; M1-F3 HydrophobicContact CG-CE1 4.01Å; M1-F3 HydrophobicContact CG-CZ 4.05Å; M1-F3 WeakPolarHBondContact O-CD2 3.5Å; M1-F3 WeakPolarHBondContact O-CE2 3.29Å; M1-F3 PolarHBondContact O-N 3.42Å; M1-F3 HydrophobicContact SD-CD1 4.35Å; M1-F3 HydrophobicContact SD-CE1 3.4Å; M1-F3 WeakPolarHBondContact SD-CE1 3.36Å; M1-F3 HydrophobicContact SD-CZ 3.78Å; F3-K5 PolarHBondContact O-N 3.02Å; F3-K5 VanDerWaalsContact O-N 3.12Å; F3-F6 HydrophobicContact CB-CD2 3.85Å; F3-F6 HydrophobicContact CB-CE2 4.1Å; F3-F6 AromaticContact CD1-CD2 3.92Å; F3-F6 HydrophobicContact CD1-CD2 3.92Å; F3-F6 AromaticContact CD1-CE2 3.27Å; F3-F6 HydrophobicContact CD1-CE2 3.27Å; F3-F6 HydrophobicContact CD1-CZ 4.19Å; F3-F6 AromaticContact CE1-CE2 3.89Å; F3-F6 HydrophobicContact CE1-CE2 3.89Å; F3-F6 HydrophobicContact CG-CD2 4.3Å; F3-F6 HydrophobicContact CG-CE2 4.03Å; F3-F6 WeakPolarHBondContact O-CD2 3.23Å; F3-F6 PolarHBondContact O-N 3.39Å; F3-W16 HydrophobicContact CD1-CZ2 4.41Å; F3-W16 HydrophobicContact CE1-CZ2 4.01Å
4S62.1Low66.7Low66 Ų66108.6 Ų108.646%0.46256%0.556SS.*G310 helixtrans-50.6-27.6165.450.10000112.6D2 F6 L7D2-S4 PolarHBondContact OD1-OG 3.33Å; S4-F6 VanDerWaalsContact C-N 3.26Å; S4-F6 PolarHBondContact O-N 2.79Å; S4-L7 WeakPolarHBondContact O-CB 3.34Å; S4-L7 PolarHBondContact O-N 2.97Å; S4-L7 VanDerWaalsContact O-N 3.13Å
5K61.7Low67Low123 Ų123108.6 Ų108.654%0.53556%0.557SS.*G310 helixtrans-62.2-23174.5-63.4-166175.2-166.20115F3 L7 D8 F11F3-K5 PolarHBondContact O-N 3.02Å; F3-K5 VanDerWaalsContact O-N 3.12Å; K5-L7 PolarHBondContact O-N 3.03Å; K5-D8 WeakPolarHBondContact O-CB 3.41Å; K5-D8 PolarHBondContact O-N 3.28Å; K5-F11 HydrophobicContact CB-CD2 4.11Å; K5-F11 HydrophobicContact CB-CE2 4.08Å; K5-F11 WeakPolarHBondContact O-CD2 3.49Å; K5-F11 WeakPolarHBondContact O-CG 3.41Å
6F66.5Low67.6Low72 Ų72104.5 Ų104.532%0.31653%0.533SS..G310 helixtrans-74.9-15.8175.6-68.9-61.9000113.4F3 S4 D8 F11 W16 L43F3-F6 HydrophobicContact CB-CD2 3.85Å; F3-F6 HydrophobicContact CB-CE2 4.1Å; F3-F6 AromaticContact CD1-CD2 3.92Å; F3-F6 HydrophobicContact CD1-CD2 3.92Å; F3-F6 AromaticContact CD1-CE2 3.27Å; F3-F6 HydrophobicContact CD1-CE2 3.27Å; F3-F6 HydrophobicContact CD1-CZ 4.19Å; F3-F6 AromaticContact CE1-CE2 3.89Å; F3-F6 HydrophobicContact CE1-CE2 3.89Å; F3-F6 HydrophobicContact CG-CD2 4.3Å; F3-F6 HydrophobicContact CG-CE2 4.03Å; F3-F6 WeakPolarHBondContact O-CD2 3.23Å; F3-F6 PolarHBondContact O-N 3.39Å; S4-F6 VanDerWaalsContact C-N 3.26Å; S4-F6 PolarHBondContact O-N 2.79Å; F6-D8 VanDerWaalsContact C-N 3.31Å; F6-F11 HydrophobicContact CD1-CD1 4Å; F6-F11 AromaticContact CD1-CE1 3.38Å; F6-F11 HydrophobicContact CD1-CE1 3.38Å; F6-F11 HydrophobicContact CD1-CE2 4.03Å; F6-F11 AromaticContact CD1-CZ 3.39Å; F6-F11 HydrophobicContact CD1-CZ 3.39Å; F6-F11 HydrophobicContact CE1-CD1 4.48Å; F6-F11 AromaticContact CE1-CE1 3.45Å; F6-F11 HydrophobicContact CE1-CE1 3.45Å; F6-F11 VanDerWaalsContact CE1-CE1 3.45Å; F6-F11 HydrophobicContact CE1-CE2 4.19Å; F6-F11 AromaticContact CE1-CZ 3.26Å; F6-F11 HydrophobicContact CE1-CZ 3.26Å; F6-F11 HydrophobicContact CG-CZ 4.46Å; F6-F11 HydrophobicContact CZ-CZ 4.27Å; F6-W16 HydrophobicContact CE1-CZ2 4.43Å; F6-W16 HydrophobicContact CE2-CZ2 4.29Å; F6-W16 HydrophobicContact CZ-CD2 4.48Å; F6-W16 AromaticContact CZ-CE2 3.99Å; F6-W16 AromaticContact CZ-CH2 3.75Å; F6-W16 HydrophobicContact CZ-CH2 3.75Å; F6-W16 AromaticContact CZ-CZ2 3.61Å; F6-W16 HydrophobicContact CZ-CZ2 3.61Å; F6-W16 HydrophobicContact CZ-CZ3 4.26Å; F6-L43 HydrophobicContact CE2-CD2 3.68Å; F6-L43 HydrophobicContact CZ-CD2 3.7Å
7L66.2Low67.9Low153 Ų153101.5 Ų101.580%0.80152%0.52SS*.G310 helixtrans-90.5-0.4176.6-65162.3000111.8S4 K5S4-L7 WeakPolarHBondContact O-CB 3.34Å; S4-L7 PolarHBondContact O-N 2.97Å; S4-L7 VanDerWaalsContact O-N 3.13Å; K5-L7 PolarHBondContact O-N 3.03Å
8D71.2Confident68.3Low110 Ų110100.8 Ų100.859%0.58852%0.518SS*.SBendtrans-87.3128.8-179.7-129.6-16.3000109.6K5 F6 D10 F11K5-D8 WeakPolarHBondContact O-CB 3.41Å; K5-D8 PolarHBondContact O-N 3.28Å; F6-D8 VanDerWaalsContact C-N 3.31Å; D8-D10 PolarHBondContact O-N 3.39Å; D8-F11 VanDerWaalsContact O-CB 3.29Å; D8-F11 WeakPolarHBondContact O-CB 3.49Å; D8-F11 PolarHBondContact O-N 3.4Å
9D69.4Low68.5Low165 Ų16597.4 Ų97.488%0.88251%0.51SS*.THydrogen-bonded Turntrans-65.4-23.3-171.9-74.6-31.9000113.3
10D69Low68.6Low161 Ų16193.5 Ų93.586%0.86149%0.493SS*.THydrogen-bonded Turntrans-98.522.9178.9-72.5-39.9000113.6D8 D12D8-D10 PolarHBondContact O-N 3.39Å; D10-D12 PolarHBondContact O-N 3.09Å; D10-D12 VanDerWaalsContact O-N 3.09Å
11F77.4Confident68.6Low53 Ų5391.1 Ų91.123%0.23248%0.478CS..  trans-66.8107.9-175.1-179.5-103.1000113.6K5 F6 D8 V13 W16K5-F11 HydrophobicContact CB-CD2 4.11Å; K5-F11 HydrophobicContact CB-CE2 4.08Å; K5-F11 WeakPolarHBondContact O-CD2 3.49Å; K5-F11 WeakPolarHBondContact O-CG 3.41Å; F6-F11 HydrophobicContact CD1-CD1 4Å; F6-F11 AromaticContact CD1-CE1 3.38Å; F6-F11 HydrophobicContact CD1-CE1 3.38Å; F6-F11 HydrophobicContact CD1-CE2 4.03Å; F6-F11 AromaticContact CD1-CZ 3.39Å; F6-F11 HydrophobicContact CD1-CZ 3.39Å; F6-F11 HydrophobicContact CE1-CD1 4.48Å; F6-F11 AromaticContact CE1-CE1 3.45Å; F6-F11 HydrophobicContact CE1-CE1 3.45Å; F6-F11 VanDerWaalsContact CE1-CE1 3.45Å; F6-F11 HydrophobicContact CE1-CE2 4.19Å; F6-F11 AromaticContact CE1-CZ 3.26Å; F6-F11 HydrophobicContact CE1-CZ 3.26Å; F6-F11 HydrophobicContact CG-CZ 4.46Å; F6-F11 HydrophobicContact CZ-CZ 4.27Å; D8-F11 VanDerWaalsContact O-CB 3.29Å; D8-F11 WeakPolarHBondContact O-CB 3.49Å; D8-F11 PolarHBondContact O-N 3.4Å; F11-V13 HydrophobicContact CD1-CG2 4.08Å; F11-V13 HydrophobicContact CE1-CB 4.44Å; F11-V13 HydrophobicContact CE1-CG2 3.9Å; F11-V13 PolarHBondContact O-N 3.23Å; F11-W16 HydrophobicContact CE2-CB 3.74Å; F11-W16 AromaticContact CE2-CD1 3.66Å; F11-W16 HydrophobicContact CE2-CD2 4.45Å; F11-W16 AromaticContact CE2-CG 3.69Å; F11-W16 HydrophobicContact CE2-CG 3.69Å; F11-W16 HydrophobicContact CZ-CB 3.55Å; F11-W16 AromaticContact CZ-CD1 3.84Å; F11-W16 AromaticContact CZ-CD2 3.86Å; F11-W16 HydrophobicContact CZ-CD2 3.86Å; F11-W16 HydrophobicContact CZ-CE3 4.38Å; F11-W16 AromaticContact CZ-CG 3.46Å; F11-W16 HydrophobicContact CZ-CG 3.46Å; F11-W16 VanDerWaalsContact CZ-CG 3.46Å
12D73.8Confident69.1Low76 Ų7692.8 Ų92.841%0.40648%0.482SS..  trans-86106.4172.2-172.5-3.3000112.1D10 K14 D15 W16D10-D12 PolarHBondContact O-N 3.09Å; D10-D12 VanDerWaalsContact O-N 3.09Å; D12-K14 PolarHBondContact O-N 2.69Å; D12-K14 WeakPolarHBondContact OD1-CB 3.47Å; D12-K14 PolarHBondContact OD1-N 2.93Å; D12-D15 HydrophobicContact CB-CB 4.15Å; D12-D15 PolarHBondContact O-N 3.08Å; D12-W16 WeakPolarHBondContact O-CB 3.39Å; D12-W16 PolarHBondContact O-N 3.2Å
13V74.7Confident69.4Low87 Ų8793.5 Ų93.553%0.52748%0.484SS..Hα-helixtrans-55.3-38.6175.8-174.90000111.6F11 V17F11-V13 HydrophobicContact CD1-CG2 4.08Å; F11-V13 HydrophobicContact CE1-CB 4.44Å; F11-V13 HydrophobicContact CE1-CG2 3.9Å; F11-V13 PolarHBondContact O-N 3.23Å; V13-V17 HydrophobicContact CG1-CG2 4.26Å; V13-V17 WeakPolarHBondContact O-CB 3.48Å; V13-V17 VanDerWaalsContact O-CG2 3.22Å; V13-V17 WeakPolarHBondContact O-CG2 3.44Å; V13-V17 PolarHBondContact O-N 2.81Å
14K72.8Confident69.4Low156 Ų15692 Ų9268%0.67848%0.479SS*.Hα-helixtrans-69.2-47.2-177.6-70.3-178.9-177.8173.40111D12 W16 V17 N18D12-K14 PolarHBondContact O-N 2.69Å; D12-K14 WeakPolarHBondContact OD1-CB 3.47Å; D12-K14 PolarHBondContact OD1-N 2.93Å; K14-W16 VanDerWaalsContact C-N 3.3Å; K14-W16 PolarHBondContact O-N 3.07Å; K14-V17 PolarHBondContact O-N 3.14Å; K14-N18 WeakPolarHBondContact O-CB 3.46Å; K14-N18 PolarHBondContact O-N 3.14Å; K14-N18 PolarHBondContact O-ND2 3.11Å; K14-N18 VanDerWaalsContact O-ND2 3.1Å
15D72.1Confident69.3Low109 Ų10995.5 Ų95.558%0.58349%0.488SS*.Hα-helixtrans-64.9-37.1177.9-85.9-9.7000112D12 G19D12-D15 HydrophobicContact CB-CB 4.15Å; D12-D15 PolarHBondContact O-N 3.08Å; D15-G19 PolarHBondContact O-N 2.78Å
16W75.9Confident69.1Low43 Ų4398.8 Ų98.816%0.16350%0.502CS..Hα-helixtrans-66.6-47.6174.8-178.587.7000112.6M1 F3 F6 F11 D12 K14 G19 A20 L39 L43M1-W16 HydrophobicContact CE-CH2 4.49Å; M1-W16 HydrophobicContact CE-CZ2 4.04Å; M1-W16 HydrophobicContact SD-CH2 4.18Å; M1-W16 HydrophobicContact SD-CZ2 3.47Å; M1-W16 WeakPolarHBondContact SD-CZ2 3.46Å; F3-W16 HydrophobicContact CD1-CZ2 4.41Å; F3-W16 HydrophobicContact CE1-CZ2 4.01Å; F6-W16 HydrophobicContact CE1-CZ2 4.43Å; F6-W16 HydrophobicContact CE2-CZ2 4.29Å; F6-W16 HydrophobicContact CZ-CD2 4.48Å; F6-W16 AromaticContact CZ-CE2 3.99Å; F6-W16 AromaticContact CZ-CH2 3.75Å; F6-W16 HydrophobicContact CZ-CH2 3.75Å; F6-W16 AromaticContact CZ-CZ2 3.61Å; F6-W16 HydrophobicContact CZ-CZ2 3.61Å; F6-W16 HydrophobicContact CZ-CZ3 4.26Å; F11-W16 HydrophobicContact CE2-CB 3.74Å; F11-W16 AromaticContact CE2-CD1 3.66Å; F11-W16 HydrophobicContact CE2-CD2 4.45Å; F11-W16 AromaticContact CE2-CG 3.69Å; F11-W16 HydrophobicContact CE2-CG 3.69Å; F11-W16 HydrophobicContact CZ-CB 3.55Å; F11-W16 AromaticContact CZ-CD1 3.84Å; F11-W16 AromaticContact CZ-CD2 3.86Å; F11-W16 HydrophobicContact CZ-CD2 3.86Å; F11-W16 HydrophobicContact CZ-CE3 4.38Å; F11-W16 AromaticContact CZ-CG 3.46Å; F11-W16 HydrophobicContact CZ-CG 3.46Å; F11-W16 VanDerWaalsContact CZ-CG 3.46Å; D12-W16 WeakPolarHBondContact O-CB 3.39Å; D12-W16 PolarHBondContact O-N 3.2Å; K14-W16 VanDerWaalsContact C-N 3.3Å; K14-W16 PolarHBondContact O-N 3.07Å; W16-G19 PolarHBondContact O-N 3.37Å; W16-A20 WeakPolarHBondContact O-CB 3.5Å; W16-A20 PolarHBondContact O-N 3.5Å; W16-L39 HydrophobicContact CH2-CD2 3.48Å; W16-L39 VanDerWaalsContact CH2-CD2 3.48Å; W16-L39 HydrophobicContact CH2-CG 4.25Å; W16-L39 HydrophobicContact CZ2-CD2 4.42Å; W16-L39 HydrophobicContact CZ3-CD2 3.82Å; W16-L43 HydrophobicContact CH2-CD1 4.33Å
17V73.3Confident68.8Low53 Ų53103.5 Ų103.532%0.32153%0.525SS..Hα-helixtrans-60.8-48.8175.2170.80000109.7V13 K14 G19 A20 F21V13-V17 HydrophobicContact CG1-CG2 4.26Å; V13-V17 WeakPolarHBondContact O-CB 3.48Å; V13-V17 VanDerWaalsContact O-CG2 3.22Å; V13-V17 WeakPolarHBondContact O-CG2 3.44Å; V13-V17 PolarHBondContact O-N 2.81Å; K14-V17 PolarHBondContact O-N 3.14Å; V17-G19 VanDerWaalsContact C-N 3.28Å; V17-G19 PolarHBondContact O-N 3.28Å; V17-A20 PolarHBondContact O-N 3.42Å; V17-A20 VanDerWaalsContact O-N 3.13Å; V17-F21 HydrophobicContact CG1-CD2 3.77Å; V17-F21 HydrophobicContact CG1-CE2 3.96Å; V17-F21 VanDerWaalsContact O-CD2 3.31Å; V17-F21 WeakPolarHBondContact O-CD2 3.39Å; V17-F21 PolarHBondContact O-N 3.17Å
18N74.1Confident68.4Low89 Ų8998 Ų9848%0.47650%0.502SS..Hα-helixtrans-60-38.8178.2-72.2-28.5000111.9K14 K22K14-N18 WeakPolarHBondContact O-CB 3.46Å; K14-N18 PolarHBondContact O-N 3.14Å; K14-N18 PolarHBondContact O-ND2 3.11Å; K14-N18 VanDerWaalsContact O-ND2 3.1Å; N18-K22 WeakPolarHBondContact O-CB 3.15Å; N18-K22 VanDerWaalsContact O-CG 3.29Å; N18-K22 WeakPolarHBondContact O-CG 3.39Å; N18-K22 PolarHBondContact O-N 3.38Å
19G72.6Confident67.7Low36 Ų3698.5 Ų98.537%0.37151%0.511SS..Hα-helixtrans-64.6-43.517400000112.9D15 W16 V17 F21 K22D15-G19 PolarHBondContact O-N 2.78Å; W16-G19 PolarHBondContact O-N 3.37Å; V17-G19 VanDerWaalsContact C-N 3.28Å; V17-G19 PolarHBondContact O-N 3.28Å; G19-F21 VanDerWaalsContact C-N 3.34Å; G19-F21 PolarHBondContact O-N 3.11Å; G19-K22 PolarHBondContact O-N 2.91Å
20A70.4Confident67.3Low19 Ų1994.4 Ų94.416%0.15751%0.508CS..Hα-helixtrans-65-35.5177.200000112.5M1 W16 V17M1-A20 HydrophobicContact CE-CB 3.68Å; W16-A20 WeakPolarHBondContact O-CB 3.5Å; W16-A20 PolarHBondContact O-N 3.5Å; V17-A20 PolarHBondContact O-N 3.42Å; V17-A20 VanDerWaalsContact O-N 3.13Å
21F68.5Low67Low45 Ų4593.6 Ų93.620%0.19750%0.497CS..Hα-helixtrans-87.6-22.5177.1-79-90000114.3V17 G19 M23 V24 Q25 A32 A36V17-F21 HydrophobicContact CG1-CD2 3.77Å; V17-F21 HydrophobicContact CG1-CE2 3.96Å; V17-F21 VanDerWaalsContact O-CD2 3.31Å; V17-F21 WeakPolarHBondContact O-CD2 3.39Å; V17-F21 PolarHBondContact O-N 3.17Å; G19-F21 VanDerWaalsContact C-N 3.34Å; G19-F21 PolarHBondContact O-N 3.11Å; F21-M23 VanDerWaalsContact C-N 3.29Å; F21-M23 PolarHBondContact O-N 3.34Å; F21-V24 PolarHBondContact O-N 2.95Å; F21-V24 VanDerWaalsContact O-N 3.16Å; F21-Q25 PolarHBondContact O-N 3.27Å; F21-A32 HydrophobicContact CD1-CB 4.26Å; F21-A32 HydrophobicContact CE1-CB 4.16Å; F21-A32 WeakPolarHBondContact CE1-O 3.42Å; F21-A36 HydrophobicContact CE1-CB 4.14Å; F21-A36 HydrophobicContact CZ-CB 3.6Å
22K65.3Low66.5Low150 Ų15093 Ų9365%0.65250%0.502SS*.Hα-helixtrans-58.4-38.8175.1-99.9176.7177.81730112.5N18 G19 V24 K26N18-K22 WeakPolarHBondContact O-CB 3.15Å; N18-K22 VanDerWaalsContact O-CG 3.29Å; N18-K22 WeakPolarHBondContact O-CG 3.39Å; N18-K22 PolarHBondContact O-N 3.38Å; G19-K22 PolarHBondContact O-N 2.91Å; K22-V24 VanDerWaalsContact C-N 3.33Å; K22-K26 PolarHBondContact O-N 3.27Å
23M61.1Low66.5Low141 Ų14196.2 Ų96.270%0.69552%0.519SS*.Hα-helixtrans-63.9-38.4177.2-76.6-77.817600111.6F21F21-M23 VanDerWaalsContact C-N 3.29Å; F21-M23 PolarHBondContact O-N 3.34Å
24V60Low66.5Low24 Ų2496.7 Ų96.715%0.14552%0.522CS..Hα-helixtrans-81.5-34.7-176.2-176.40000112.4F21 K22 K26 E27 A28 H35F21-V24 PolarHBondContact O-N 2.95Å; F21-V24 VanDerWaalsContact O-N 3.16Å; K22-V24 VanDerWaalsContact C-N 3.33Å; V24-K26 PolarHBondContact O-N 3.43Å; V24-E27 PolarHBondContact O-N 3.38Å; V24-A28 PolarHBondContact O-N 3.35Å; V24-A28 VanDerWaalsContact O-N 3.07Å; V24-H35 HydrophobicContact CG2-CB 4.4Å; V24-H35 WeakPolarHBondContact CG2-CD2 3.4Å
25Q59.2Low66.6Low140 Ų14093 Ų9365%0.65451%0.507SS*.Hα-helixtrans-65.1-27.2175-80.1-175.7-4.400113.1F21F21-Q25 PolarHBondContact O-N 3.27Å
26K58.7Low66.7Low192 Ų19289.2 Ų89.284%0.83549%0.491SS*.Hα-helixtrans-77.9-32.2177.4-116.4-178.6178.3-177.60113.5K22 V24K22-K26 PolarHBondContact O-N 3.27Å; V24-K26 PolarHBondContact O-N 3.43Å
27E58.6Low66.9Low171 Ų17190.2 Ų90.280%0.79951%0.508SS*.Hα-helixtrans-99.2-25.2-172.9-69.9-174159.800114.1V24V24-E27 PolarHBondContact O-N 3.38Å
28A58.8Low67.2Low38 Ų3891 Ų9131%0.31451%0.513SS..  trans-159.990.7174.400000112.3V24 G30V24-A28 PolarHBondContact O-N 3.35Å; V24-A28 VanDerWaalsContact O-N 3.07Å; A28-G30 PolarHBondContact O-N 2.95Å; A28-G30 VanDerWaalsContact O-N 3.1Å
29P56.5Low67.4Low120 Ų12087.6 Ų87.678%0.77950%0.495SS*.THydrogen-bonded Turntrans-63.4115176.324.5-30.6000110.2
30G61.7Low67.8Low80 Ų8089.8 Ų89.883%0.82550%0.501SS*.THydrogen-bonded Turntrans125.2-5178.100000117.1A28A28-G30 PolarHBondContact O-N 2.95Å; A28-G30 VanDerWaalsContact O-N 3.1Å
31K62.6Low68.4Low144 Ų14494.7 Ų94.763%0.62652%0.522SS*.  trans-11132.8179.5-68.6-173.2177.8178.40114.9T34K31-T34 PolarHBondContact O-OG1 3.01Å
32A66.6Low68.8Low40 Ų4098.5 Ų98.533%0.33154%0.539SS..Hα-helixtrans-68.6-42.4-174.800000113.7F21 T34 H35 A36F21-A32 HydrophobicContact CD1-CB 4.26Å; F21-A32 HydrophobicContact CE1-CB 4.16Å; F21-A32 WeakPolarHBondContact CE1-O 3.42Å; A32-T34 PolarHBondContact O-N 3.4Å; A32-H35 PolarHBondContact O-N 3.29Å; A32-A36 PolarHBondContact O-N 3.48Å
33D74.3Confident69.5Low143 Ų14393.7 Ų93.777%0.76552%0.52SS*.Hα-helixtrans-64.7-38.1-173.3-80.4-12.1000113.9H35 A36 A37D33-H35 VanDerWaalsContact C-N 3.3Å; D33-H35 PolarHBondContact O-N 2.97Å; D33-A36 WeakPolarHBondContact O-CB 3.36Å; D33-A36 PolarHBondContact O-N 3.14Å; D33-A37 PolarHBondContact O-N 2.97Å
34T74.4Confident70.5Confident98 Ų9893 Ų9360%0.60152%0.515SS*.Hα-helixtrans-66.2-35.3178.614.70000111.9K31 A32 T38K31-T34 PolarHBondContact O-OG1 3.01Å; A32-T34 PolarHBondContact O-N 3.4Å; T34-T38 PolarHBondContact O-N 3.38Å; T34-T38 PolarHBondContact O-OG1 3.38Å
35H74.8Confident71.5Confident78 Ų7896.9 Ų96.936%0.36153%0.534SS..Hα-helixtrans-73.1-35.7175.4-156.9-48.8000111.6V24 A32 D33 T38 L39V24-H35 HydrophobicContact CG2-CB 4.4Å; V24-H35 WeakPolarHBondContact CG2-CD2 3.4Å; A32-H35 PolarHBondContact O-N 3.29Å; D33-H35 VanDerWaalsContact C-N 3.3Å; D33-H35 PolarHBondContact O-N 2.97Å; H35-T38 PolarHBondContact O-N 3.03Å; H35-L39 PolarHBondContact O-N 3.27Å; H35-L39 VanDerWaalsContact O-N 3.08Å
36A74.1Confident72.5Confident29 Ų2994.6 Ų94.624%0.2452%0.522CS..Hα-helixtrans-58.7-51174.300000111.6F21 A32 D33 T38 L39 V40F21-A36 HydrophobicContact CE1-CB 4.14Å; F21-A36 HydrophobicContact CZ-CB 3.6Å; A32-A36 PolarHBondContact O-N 3.48Å; D33-A36 WeakPolarHBondContact O-CB 3.36Å; D33-A36 PolarHBondContact O-N 3.14Å; A36-T38 VanDerWaalsContact C-N 3.33Å; A36-T38 PolarHBondContact O-N 3.19Å; A36-L39 WeakPolarHBondContact O-CB 3.48Å; A36-L39 PolarHBondContact O-N 3.45Å; A36-L39 VanDerWaalsContact O-N 3.1Å; A36-V40 WeakPolarHBondContact O-CG2 3.46Å; A36-V40 PolarHBondContact O-N 3.43Å
37A79.9Confident73.5Confident64 Ų6490.2 Ų90.253%0.52951%0.507SS..Hα-helixtrans-61.5-40.5-179.200000112.4D33 L39 V40 M41D33-A37 PolarHBondContact O-N 2.97Å; A37-L39 VanDerWaalsContact C-N 3.28Å; A37-L39 PolarHBondContact O-N 3.42Å; A37-V40 PolarHBondContact O-N 3.32Å; A37-M41 PolarHBondContact O-N 3.46Å
38T79.9Confident74.7Confident70 Ų7088.1 Ų88.143%0.42950%0.497SS..Hα-helixtrans-64.1-36.1176.7-52.40000111.5T34 H35 A36 K42T34-T38 PolarHBondContact O-N 3.38Å; T34-T38 PolarHBondContact O-OG1 3.38Å; H35-T38 PolarHBondContact O-N 3.03Å; A36-T38 VanDerWaalsContact C-N 3.33Å; A36-T38 PolarHBondContact O-N 3.19Å; T38-K42 WeakPolarHBondContact O-CG 3.45Å; T38-K42 PolarHBondContact O-N 2.83Å
39L76.9Confident75.8Confident18 Ų1892.6 Ų92.69%0.09451%0.512CS..Hα-helixtrans-69.6-44.3178.4-151.178.2000112.1M1 W16 H35 A36 A37 M41 K42 L43M1-L39 HydrophobicContact CE-CD1 3.26Å; M1-L39 HydrophobicContact CE-CD2 4.15Å; M1-L39 HydrophobicContact CE-CG 4.29Å; M1-L39 HydrophobicContact SD-CD1 3.67Å; W16-L39 HydrophobicContact CH2-CD2 3.48Å; W16-L39 VanDerWaalsContact CH2-CD2 3.48Å; W16-L39 HydrophobicContact CH2-CG 4.25Å; W16-L39 HydrophobicContact CZ2-CD2 4.42Å; W16-L39 HydrophobicContact CZ3-CD2 3.82Å; H35-L39 PolarHBondContact O-N 3.27Å; H35-L39 VanDerWaalsContact O-N 3.08Å; A36-L39 WeakPolarHBondContact O-CB 3.48Å; A36-L39 PolarHBondContact O-N 3.45Å; A36-L39 VanDerWaalsContact O-N 3.1Å; A37-L39 VanDerWaalsContact C-N 3.28Å; A37-L39 PolarHBondContact O-N 3.42Å; L39-M41 VanDerWaalsContact C-N 3.34Å; L39-M41 PolarHBondContact O-N 2.83Å; L39-K42 PolarHBondContact O-N 2.99Å; L39-L43 PolarHBondContact O-N 3.26Å
40V82.1Confident77Confident82 Ų8289.5 Ų89.550%0.49749%0.49SS..Hα-helixtrans-59.6-46.1176.2172.60000110.5A36 A37 K42 L43 Q44A36-V40 WeakPolarHBondContact O-CG2 3.46Å; A36-V40 PolarHBondContact O-N 3.43Å; A37-V40 PolarHBondContact O-N 3.32Å; V40-K42 VanDerWaalsContact C-N 3.31Å; V40-K42 PolarHBondContact O-N 2.98Å; V40-L43 PolarHBondContact O-N 2.99Å; V40-L43 VanDerWaalsContact O-N 3.15Å; V40-Q44 PolarHBondContact O-N 3.27Å
41M82.5Confident78.1Confident122 Ų12290 Ų9060%0.60148%0.475SS*.Hα-helixtrans-61.3-39.3179.1-165.5173.188.300112.3A37 L39 Q44 L45A37-M41 PolarHBondContact O-N 3.46Å; L39-M41 VanDerWaalsContact C-N 3.34Å; L39-M41 PolarHBondContact O-N 2.83Å; M41-Q44 PolarHBondContact O-N 3Å; M41-L45 PolarHBondContact O-N 3.4Å; M41-L45 VanDerWaalsContact O-N 3.12Å
42K77.6Confident79.2Confident124 Ų12487.6 Ų87.654%0.53947%0.468SS..Hα-helixtrans-64.7-41.4174.9-76.7-177.8177.9-178.70112.4T38 L39 V40 Q44 F46T38-K42 WeakPolarHBondContact O-CG 3.45Å; T38-K42 PolarHBondContact O-N 2.83Å; L39-K42 PolarHBondContact O-N 2.99Å; V40-K42 VanDerWaalsContact C-N 3.31Å; V40-K42 PolarHBondContact O-N 2.98Å; K42-Q44 VanDerWaalsContact C-N 3.33Å; K42-F46 PolarHBondContact O-N 3.4Å
43L79.6Confident80.1Confident49 Ų4988.4 Ų88.426%0.25748%0.475SS..Hα-helixtrans-65-37.7175.8-75.7165.4000112F6 W16 L39 V40 F46 I47F6-L43 HydrophobicContact CE2-CD2 3.68Å; F6-L43 HydrophobicContact CZ-CD2 3.7Å; W16-L43 HydrophobicContact CH2-CD1 4.33Å; L39-L43 PolarHBondContact O-N 3.26Å; V40-L43 PolarHBondContact O-N 2.99Å; V40-L43 VanDerWaalsContact O-N 3.15Å; L43-F46 PolarHBondContact O-N 3.48Å; L43-I47 WeakPolarHBondContact O-CG1 3.35Å; L43-I47 PolarHBondContact O-N 2.72Å
44Q81.3Confident80.6Confident127 Ų12786.6 Ų86.659%0.59346%0.464SS*.Hα-helixtrans-66-41.7178.1-117.4158.6-1500112.8V40 M41 K42 F46 I47 Q48V40-Q44 PolarHBondContact O-N 3.27Å; M41-Q44 PolarHBondContact O-N 3Å; K42-Q44 VanDerWaalsContact C-N 3.33Å; Q44-F46 VanDerWaalsContact C-N 3.3Å; Q44-F46 PolarHBondContact O-N 3.03Å; Q44-I47 PolarHBondContact O-N 3.1Å; Q44-Q48 PolarHBondContact O-N 2.9Å
45L81.9Confident81.2Confident105 Ų10587.9 Ų87.955%0.5546%0.463SS..Hα-helixtrans-62-39.7173.8-73.7171.2000111.7M41 Q48 E49M41-L45 PolarHBondContact O-N 3.4Å; M41-L45 VanDerWaalsContact O-N 3.12Å; L45-Q48 PolarHBondContact O-N 3.22Å; L45-E49 PolarHBondContact O-N 3.42Å
46F79.4Confident81.9Confident92 Ų9290.7 Ų90.740%0.40448%0.477SS..Hα-helixtrans-65.3-43.3178.1-177.9-103.3000112.8K42 L43 Q44 Q48 E49 V50K42-F46 PolarHBondContact O-N 3.4Å; L43-F46 PolarHBondContact O-N 3.48Å; Q44-F46 VanDerWaalsContact C-N 3.3Å; Q44-F46 PolarHBondContact O-N 3.03Å; F46-Q48 PolarHBondContact O-N 3.23Å; F46-E49 PolarHBondContact O-N 2.93Å; F46-V50 HydrophobicContact CD1-CG2 4.05Å; F46-V50 HydrophobicContact CD2-CG2 4.4Å; F46-V50 HydrophobicContact CE1-CG2 3.59Å; F46-V50 HydrophobicContact CE2-CG2 3.98Å; F46-V50 HydrophobicContact CG-CG2 4.45Å; F46-V50 HydrophobicContact CZ-CG2 3.55Å; F46-V50 WeakPolarHBondContact O-CG2 3.19Å; F46-V50 PolarHBondContact O-N 3.41Å
47I80.8Confident82.4Confident100 Ų10092.9 Ų92.951%0.51349%0.49SS..Hα-helixtrans-56.3-39.1174.7-70.7166.1000110.5L43 Q44 N51L43-I47 WeakPolarHBondContact O-CG1 3.35Å; L43-I47 PolarHBondContact O-N 2.72Å; Q44-I47 PolarHBondContact O-N 3.1Å; I47-N51 WeakPolarHBondContact O-CB 3.3Å; I47-N51 PolarHBondContact O-N 3.27Å; I47-N51 PolarHBondContact O-ND2 3.05Å
48Q83.1Confident82.6Confident127 Ų12792.9 Ų92.959%0.59349%0.486SS*.Hα-helixtrans-72.3-39.1179.1-166.6140.86.700112.9Q44 L45 F46 N51 N52Q44-Q48 PolarHBondContact O-N 2.9Å; L45-Q48 PolarHBondContact O-N 3.22Å; F46-Q48 PolarHBondContact O-N 3.23Å; Q48-N51 PolarHBondContact O-N 3.47Å; Q48-N52 PolarHBondContact O-N 3.33Å
49E81.4Confident83Confident132 Ų13293.5 Ų93.562%0.61749%0.487SS*.Hα-helixtrans-61.5-43.6172.8-76.1178.2173.400112L45 F46 N52 A53L45-E49 PolarHBondContact O-N 3.42Å; F46-E49 PolarHBondContact O-N 2.93Å; E49-N52 PolarHBondContact O-N 3.49Å; E49-A53 WeakPolarHBondContact O-CB 3.45Å; E49-A53 PolarHBondContact O-N 2.75Å
50V81.6Confident83.4Confident55 Ų5598.1 Ų98.133%0.33351%0.508SS..Hα-helixtrans-64.1-44.8177.9172.30000111.3F46 N52 A53 I54F46-V50 HydrophobicContact CD1-CG2 4.05Å; F46-V50 HydrophobicContact CD2-CG2 4.4Å; F46-V50 HydrophobicContact CE1-CG2 3.59Å; F46-V50 HydrophobicContact CE2-CG2 3.98Å; F46-V50 HydrophobicContact CG-CG2 4.45Å; F46-V50 HydrophobicContact CZ-CG2 3.55Å; F46-V50 WeakPolarHBondContact O-CG2 3.19Å; F46-V50 PolarHBondContact O-N 3.41Å; V50-N52 VanDerWaalsContact C-N 3.35Å; V50-N52 PolarHBondContact O-N 3.18Å; V50-A53 PolarHBondContact O-N 2.96Å; V50-I54 HydrophobicContact CG1-CD1 3.82Å; V50-I54 HydrophobicContact CG1-CG1 4.47Å; V50-I54 WeakPolarHBondContact O-CG1 3.16Å; V50-I54 PolarHBondContact O-N 3.43Å
51N85.4Confident83.6Confident92 Ų9297.1 Ų97.149%0.49251%0.508SS..Hα-helixtrans-61.9-42.9178.1-76.3-22.2000111.9I47 Q48 I54 E55I47-N51 WeakPolarHBondContact O-CB 3.3Å; I47-N51 PolarHBondContact O-N 3.27Å; I47-N51 PolarHBondContact O-ND2 3.05Å; Q48-N51 PolarHBondContact O-N 3.47Å; N51-I54 PolarHBondContact O-N 2.88Å; N51-E55 WeakPolarHBondContact O-CB 3.46Å; N51-E55 PolarHBondContact O-N 3.39Å
52N86.3Confident83.7Confident92 Ų9296.4 Ų96.449%0.49251%0.506SS..Hα-helixtrans-63.7-42.1176.6-77.5-5.7000112Q48 E49 V50 I54 E55 E56Q48-N52 PolarHBondContact O-N 3.33Å; E49-N52 PolarHBondContact O-N 3.49Å; V50-N52 VanDerWaalsContact C-N 3.35Å; V50-N52 PolarHBondContact O-N 3.18Å; N52-I54 VanDerWaalsContact C-N 3.34Å; N52-I54 PolarHBondContact O-N 3.47Å; N52-E55 PolarHBondContact O-N 3.39Å; N52-E56 WeakPolarHBondContact O-CB 3.32Å; N52-E56 PolarHBondContact O-N 3.2Å
53A85.4Confident84.1Confident57 Ų5797.7 Ų97.747%0.47151%0.514SS..Hα-helixtrans-63.7-39.3178.100000112.2E49 V50 S57E49-A53 WeakPolarHBondContact O-CB 3.45Å; E49-A53 PolarHBondContact O-N 2.75Å; V50-A53 PolarHBondContact O-N 2.96Å; A53-S57 WeakPolarHBondContact O-CB 3.35Å; A53-S57 PolarHBondContact O-N 3.02Å
54I84.1Confident84.5Confident106 Ų10699.4 Ų99.454%0.54452%0.523SS..Hα-helixtrans-65-43.5175.4-70.4170.1000110.7V50 N51 N52 S57 S58V50-I54 HydrophobicContact CG1-CD1 3.82Å; V50-I54 HydrophobicContact CG1-CG1 4.47Å; V50-I54 WeakPolarHBondContact O-CG1 3.16Å; V50-I54 PolarHBondContact O-N 3.43Å; N51-I54 PolarHBondContact O-N 2.88Å; N52-I54 VanDerWaalsContact C-N 3.34Å; N52-I54 PolarHBondContact O-N 3.47Å; I54-S57 PolarHBondContact O-N 3.14Å; I54-S58 VanDerWaalsContact O-CB 3.29Å; I54-S58 WeakPolarHBondContact O-CB 3.24Å; I54-S58 PolarHBondContact O-N 3.07Å
55E87.7Confident84.7Confident124 Ų12498.9 Ų98.958%0.57952%0.522SS*.Hα-helixtrans-67.5-39.1-179.1-162.8168.2-159.200112.1N51 N52 N59N51-E55 WeakPolarHBondContact O-CB 3.46Å; N51-E55 PolarHBondContact O-N 3.39Å; N52-E55 PolarHBondContact O-N 3.39Å; E55-N59 WeakPolarHBondContact O-CB 3.5Å; E55-N59 PolarHBondContact O-N 3.12Å; E55-N59 PolarHBondContact O-ND2 3.04Å
56E88.2Confident84.9Confident138 Ų13897.1 Ų97.165%0.64552%0.518SS*.Hα-helixtrans-63.6-47.7173.6-171.4171.2-167.500111.2N52 S58 N59 Q60N52-E56 WeakPolarHBondContact O-CB 3.32Å; N52-E56 PolarHBondContact O-N 3.2Å; E56-S58 PolarHBondContact O-N 3.29Å; E56-N59 PolarHBondContact O-N 3.42Å; E56-Q60 WeakPolarHBondContact O-CB 3.36Å; E56-Q60 PolarHBondContact O-N 3.28Å
57S85.2Confident85.3Confident75 Ų75100.6 Ų100.652%0.52453%0.528SS..Hα-helixtrans-62.2-41.6178.2-170.70000112.3A53 I54 Q60 A61A53-S57 WeakPolarHBondContact O-CB 3.35Å; A53-S57 PolarHBondContact O-N 3.02Å; I54-S57 PolarHBondContact O-N 3.14Å; S57-Q60 PolarHBondContact O-N 3.43Å; S57-A61 WeakPolarHBondContact O-CB 3.44Å; S57-A61 PolarHBondContact O-N 2.74Å
58S84.3Confident85.6Confident63 Ų6399.9 Ų99.944%0.44153%0.528SS..Hα-helixtrans-62.1-46.7177.1-176.90000112.1I54 E56 Q60 A61 L62I54-S58 VanDerWaalsContact O-CB 3.29Å; I54-S58 WeakPolarHBondContact O-CB 3.24Å; I54-S58 PolarHBondContact O-N 3.07Å; E56-S58 PolarHBondContact O-N 3.29Å; S58-Q60 VanDerWaalsContact C-N 3.32Å; S58-Q60 PolarHBondContact O-N 3.1Å; S58-A61 PolarHBondContact O-N 2.88Å; S58-L62 WeakPolarHBondContact O-CG 3.46Å; S58-L62 PolarHBondContact O-N 3.43Å
59N87.8Confident85.8Confident83 Ų8399.2 Ų99.244%0.44453%0.528SS..Hα-helixtrans-64.7-37.8177.3-79.2-39000112.1E55 E56 L62 Q63E55-N59 WeakPolarHBondContact O-CB 3.5Å; E55-N59 PolarHBondContact O-N 3.12Å; E55-N59 PolarHBondContact O-ND2 3.04Å; E56-N59 PolarHBondContact O-N 3.42Å; N59-L62 PolarHBondContact O-N 3.43Å; N59-Q63 WeakPolarHBondContact O-CG 3.33Å; N59-Q63 PolarHBondContact O-N 3.49Å
60Q86.3Confident86.2Confident116 Ų116101.5 Ų101.554%0.54253%0.531SS..Hα-helixtrans-65.7-39.7175.8-141.6174.926.400111.6E56 S57 S58 Q63 N64E56-Q60 WeakPolarHBondContact O-CB 3.36Å; E56-Q60 PolarHBondContact O-N 3.28Å; S57-Q60 PolarHBondContact O-N 3.43Å; S58-Q60 VanDerWaalsContact C-N 3.32Å; S58-Q60 PolarHBondContact O-N 3.1Å; Q60-Q63 PolarHBondContact O-N 2.94Å; Q60-N64 WeakPolarHBondContact O-CB 3.32Å; Q60-N64 PolarHBondContact O-N 2.97Å; Q60-N64 VanDerWaalsContact O-N 3.14Å; Q60-N64 PolarHBondContact O-ND2 3.49Å
61A85.1Confident86.5Confident60 Ų60103.1 Ų103.150%0.49654%0.538SS..Hα-helixtrans-63.3-45.2174.200000111.7S57 S58 Q63 N64 M65S57-A61 WeakPolarHBondContact O-CB 3.44Å; S57-A61 PolarHBondContact O-N 2.74Å; S58-A61 PolarHBondContact O-N 2.88Å; A61-Q63 VanDerWaalsContact C-N 3.35Å; A61-Q63 PolarHBondContact O-N 3.42Å; A61-N64 PolarHBondContact O-N 2.91Å; A61-M65 PolarHBondContact O-N 3.29Å; A61-M65 VanDerWaalsContact O-N 3.1Å
62L85.6Confident86.6Confident108 Ų108102.7 Ų102.757%0.56554%0.538SS*.Hα-helixtrans-62.5-38.8177.6-75.3170.1000112.6S58 N59S58-L62 WeakPolarHBondContact O-CG 3.46Å; S58-L62 PolarHBondContact O-N 3.43Å; N59-L62 PolarHBondContact O-N 3.43Å
63Q85.4Confident86.8Confident151 Ų151102.6 Ų102.671%0.70654%0.535SS*.Hα-helixtrans-69.4-33.9177.3-74.5-179.71100113N59 Q60 A61 P66N59-Q63 WeakPolarHBondContact O-CG 3.33Å; N59-Q63 PolarHBondContact O-N 3.49Å; Q60-Q63 PolarHBondContact O-N 2.94Å; A61-Q63 VanDerWaalsContact C-N 3.35Å; A61-Q63 PolarHBondContact O-N 3.42Å; Q63-P66 WeakPolarHBondContact O-CD 3.44Å
64N87.5Confident87Confident84 Ų84102 Ų10245%0.44953%0.53SS..Hα-helixtrans-83.3-22-177.2-72.1-35.9000113.6Q60 A61 R67 V68Q60-N64 WeakPolarHBondContact O-CB 3.32Å; Q60-N64 PolarHBondContact O-N 2.97Å; Q60-N64 VanDerWaalsContact O-N 3.14Å; Q60-N64 PolarHBondContact O-ND2 3.49Å; A61-N64 PolarHBondContact O-N 2.91Å; N64-R67 WeakPolarHBondContact O-CB 3.28Å; N64-R67 PolarHBondContact O-N 2.89Å; N64-R67 VanDerWaalsContact O-N 3.12Å; N64-V68 PolarHBondContact O-N 2.86Å; N64-V68 VanDerWaalsContact O-N 3.17Å
65M86.4Confident87.3Confident116 Ų116102.5 Ų102.557%0.57153%0.533SS*.Hα-helixtrans-57.6-40.8-174.7-159.3164.9-175.900115.2A61 R67 V68 L69A61-M65 PolarHBondContact O-N 3.29Å; A61-M65 VanDerWaalsContact O-N 3.1Å; M65-R67 VanDerWaalsContact C-N 3.28Å; M65-R67 PolarHBondContact O-N 3.3Å; M65-V68 PolarHBondContact O-N 2.9Å; M65-L69 PolarHBondContact O-N 2.93Å
66P86.6Confident87.4Confident69 Ų69102.4 Ų102.445%0.44853%0.531SS..Hα-helixtrans-67.6-26177.6-20.533.3000114Q63 R70Q63-P66 WeakPolarHBondContact O-CD 3.44Å; P66-R70 PolarHBondContact O-N 2.7Å
67R86.7Confident87.5Confident165 Ų165101.8 Ų101.862%0.62353%0.528SS*.Hα-helixtrans-73.2-47.3173.9-177.9-179.4172.6-179.8-0.2109.8N64 M65 L69 R70 D71N64-R67 WeakPolarHBondContact O-CB 3.28Å; N64-R67 PolarHBondContact O-N 2.89Å; N64-R67 VanDerWaalsContact O-N 3.12Å; M65-R67 VanDerWaalsContact C-N 3.28Å; M65-R67 PolarHBondContact O-N 3.3Å; R67-L69 VanDerWaalsContact C-N 3.29Å; R67-L69 PolarHBondContact O-N 3.21Å; R67-R70 WeakPolarHBondContact O-CB 3.26Å; R67-R70 PolarHBondContact O-N 3.46Å; R67-R70 VanDerWaalsContact O-N 3.08Å; R67-D71 IonicContact NE-OD2 3.81Å; R67-D71 VanDerWaalsContact O-CG 3.3Å; R67-D71 PolarHBondContact O-N 3.42Å
68V87.1Confident87.8Confident84 Ų84104.6 Ų104.651%0.50953%0.533SS..Hα-helixtrans-57.3-42.7175.91780000111.3N64 M65 R70 D71 V72N64-V68 PolarHBondContact O-N 2.86Å; N64-V68 VanDerWaalsContact O-N 3.17Å; M65-V68 PolarHBondContact O-N 2.9Å; V68-R70 VanDerWaalsContact C-N 3.34Å; V68-R70 PolarHBondContact O-N 2.71Å; V68-D71 PolarHBondContact O-N 2.97Å; V68-V72 HydrophobicContact CG1-CG2 4.33Å; V68-V72 WeakPolarHBondContact O-CB 3.46Å; V68-V72 VanDerWaalsContact O-CG2 3.24Å; V68-V72 WeakPolarHBondContact O-CG2 3.37Å; V68-V72 PolarHBondContact O-N 2.93Å
69L88.4Confident87.9Confident114 Ų114104.3 Ų104.360%0.59754%0.535SS*.Hα-helixtrans-62.1-38.8176.4-77.4170.6000113.1M65 R67 V72 E73M65-L69 PolarHBondContact O-N 2.93Å; R67-L69 VanDerWaalsContact C-N 3.29Å; R67-L69 PolarHBondContact O-N 3.21Å; L69-V72 PolarHBondContact O-N 2.79Å; L69-E73 PolarHBondContact O-N 3.24Å; L69-E73 VanDerWaalsContact O-N 3.1Å
70R88.6Confident88Confident179 Ų179103.2 Ų103.268%0.67553%0.533SS*.Hα-helixtrans-67.2-43.4174.8-90.1-175.8-79.3165.8-8.3111.8P66 R67 V68 V72 E73 A74P66-R70 PolarHBondContact O-N 2.7Å; R67-R70 WeakPolarHBondContact O-CB 3.26Å; R67-R70 PolarHBondContact O-N 3.46Å; R67-R70 VanDerWaalsContact O-N 3.08Å; V68-R70 VanDerWaalsContact C-N 3.34Å; V68-R70 PolarHBondContact O-N 2.71Å; R70-V72 VanDerWaalsContact C-N 3.28Å; R70-V72 PolarHBondContact O-N 2.91Å; R70-E73 PolarHBondContact O-N 2.8Å; R70-A74 PolarHBondContact O-N 3.41Å
71D89.5Confident88.3Confident90 Ų90103.5 Ų103.548%0.48153%0.533SS..Hα-helixtrans-63.7-36.6178.2-64.4-14.3000110.6R67 V68 A74 L75R67-D71 IonicContact NE-OD2 3.81Å; R67-D71 VanDerWaalsContact O-CG 3.3Å; R67-D71 PolarHBondContact O-N 3.42Å; V68-D71 PolarHBondContact O-N 2.97Å; D71-A74 PolarHBondContact O-N 3.35Å; D71-L75 WeakPolarHBondContact O-CB 3.27Å; D71-L75 PolarHBondContact O-N 3.49Å
72V87.7Confident88.5Confident83 Ų83105.6 Ų105.650%0.50354%0.535SS..Hα-helixtrans-66.5-41.8174.6169.60000112.2V68 L69 R70 L75 K76V68-V72 HydrophobicContact CG1-CG2 4.33Å; V68-V72 WeakPolarHBondContact O-CB 3.46Å; V68-V72 VanDerWaalsContact O-CG2 3.24Å; V68-V72 WeakPolarHBondContact O-CG2 3.37Å; V68-V72 PolarHBondContact O-N 2.93Å; L69-V72 PolarHBondContact O-N 2.79Å; R70-V72 VanDerWaalsContact C-N 3.28Å; R70-V72 PolarHBondContact O-N 2.91Å; V72-L75 PolarHBondContact O-N 2.83Å; V72-K76 WeakPolarHBondContact O-CB 3.44Å; V72-K76 PolarHBondContact O-N 3.47Å
73E88.8Confident88.7Confident89 Ų89107.7 Ų107.742%0.41654%0.54SS..Hα-helixtrans-68.9-36.8177-169.163.2-149.500111.5L69 R70 K76 Q77L69-E73 PolarHBondContact O-N 3.24Å; L69-E73 VanDerWaalsContact O-N 3.1Å; R70-E73 PolarHBondContact O-N 2.8Å; E73-K76 WeakPolarHBondContact O-CB 3.41Å; E73-K76 PolarHBondContact O-N 2.99Å; E73-K76 IonicContact OE1-NZ 3.58Å; E73-K76 PolarHBondContact OE1-NZ 3.39Å; E73-K76 IonicContact OE2-NZ 2.78Å; E73-K76 PolarHBondContact OE2-NZ 2.72Å; E73-Q77 WeakPolarHBondContact O-CG 3.33Å; E73-Q77 PolarHBondContact O-N 3.22Å
74A90.6Very high88.9Confident45 Ų45106.4 Ų106.437%0.37253%0.534SS..Hα-helixtrans-61.7-46.6172.200000111.3R70 D71 K76 Q77 E78R70-A74 PolarHBondContact O-N 3.41Å; D71-A74 PolarHBondContact O-N 3.35Å; A74-K76 VanDerWaalsContact C-N 3.27Å; A74-K76 PolarHBondContact O-N 3.21Å; A74-Q77 WeakPolarHBondContact O-CB 3.48Å; A74-Q77 PolarHBondContact O-N 2.95Å; A74-Q77 VanDerWaalsContact O-N 3.1Å; A74-E78 PolarHBondContact O-N 2.88Å
75L90Very high89Confident116 Ų116106.2 Ų106.261%0.60753%0.53SS*.Hα-helixtrans-59.3-39.1176.3-161.597.4000111.8D71 V72 E78 A79D71-L75 WeakPolarHBondContact O-CB 3.27Å; D71-L75 PolarHBondContact O-N 3.49Å; V72-L75 PolarHBondContact O-N 2.83Å; L75-E78 PolarHBondContact O-N 3.5Å; L75-A79 VanDerWaalsContact O-CB 3.25Å; L75-A79 WeakPolarHBondContact O-CB 3.37Å; L75-A79 PolarHBondContact O-N 3.45Å
76K90.1Very high88.9Confident122 Ų122107 Ų10753%0.5353%0.534SS..Hα-helixtrans-64.5-40.6176177-177.8156.8-142.50111.9V72 E73 A74 A79 S80V72-K76 WeakPolarHBondContact O-CB 3.44Å; V72-K76 PolarHBondContact O-N 3.47Å; E73-K76 WeakPolarHBondContact O-CB 3.41Å; E73-K76 PolarHBondContact O-N 2.99Å; E73-K76 IonicContact OE1-NZ 3.58Å; E73-K76 PolarHBondContact OE1-NZ 3.39Å; E73-K76 IonicContact OE2-NZ 2.78Å; E73-K76 PolarHBondContact OE2-NZ 2.72Å; A74-K76 VanDerWaalsContact C-N 3.27Å; A74-K76 PolarHBondContact O-N 3.21Å; K76-A79 PolarHBondContact O-N 2.97Å; K76-S80 PolarHBondContact O-N 3.28Å; K76-S80 PolarHBondContact O-OG 3.03Å
77Q91Very high89Confident125 Ų125107.1 Ų107.158%0.58453%0.533SS*.Hα-helixtrans-65.4-45.8175.1-72.2-175.90.400111.6E73 A74 A79 S80 F81E73-Q77 WeakPolarHBondContact O-CG 3.33Å; E73-Q77 PolarHBondContact O-N 3.22Å; A74-Q77 WeakPolarHBondContact O-CB 3.48Å; A74-Q77 PolarHBondContact O-N 2.95Å; A74-Q77 VanDerWaalsContact O-N 3.1Å; Q77-A79 VanDerWaalsContact C-N 3.32Å; Q77-A79 PolarHBondContact O-N 3.5Å; Q77-S80 WeakPolarHBondContact CA-OG 3.44Å; Q77-S80 PolarHBondContact O-N 2.96Å; Q77-S80 PolarHBondContact O-OG 3.42Å; Q77-F81 PolarHBondContact O-N 3.02Å
78E90Very high89.2Confident134 Ų134103.3 Ų103.363%0.62653%0.525SS*.Hα-helixtrans-60.1-42.2174.9-71.4-178.9178.800111.8A74 L75 S80 F81 L82A74-E78 PolarHBondContact O-N 2.88Å; L75-E78 PolarHBondContact O-N 3.5Å; E78-S80 PolarHBondContact O-N 3.29Å; E78-F81 PolarHBondContact O-N 2.61Å; E78-L82 WeakPolarHBondContact O-CB 3.42Å; E78-L82 PolarHBondContact O-N 3.39Å
79A87.8Confident89.2Confident58 Ų58102.9 Ų102.948%0.47952%0.522SS..Hα-helixtrans-64.8-38.6176.300000112.3L75 K76 Q77 K83L75-A79 VanDerWaalsContact O-CB 3.25Å; L75-A79 WeakPolarHBondContact O-CB 3.37Å; L75-A79 PolarHBondContact O-N 3.45Å; K76-A79 PolarHBondContact O-N 2.97Å; Q77-A79 VanDerWaalsContact C-N 3.32Å; Q77-A79 PolarHBondContact O-N 3.5Å; A79-K83 WeakPolarHBondContact O-CB 3.42Å; A79-K83 PolarHBondContact O-N 3.43Å
80S89.8Confident89.1Confident59 Ų59104.9 Ų104.941%0.41353%0.526SS..Hα-helixtrans-66.3-40.8173.454.90000112.5K76 Q77 E78 K83 E84K76-S80 PolarHBondContact O-N 3.28Å; K76-S80 PolarHBondContact O-OG 3.03Å; Q77-S80 WeakPolarHBondContact CA-OG 3.44Å; Q77-S80 PolarHBondContact O-N 2.96Å; Q77-S80 PolarHBondContact O-OG 3.42Å; E78-S80 PolarHBondContact O-N 3.29Å; S80-K83 WeakPolarHBondContact O-CB 3.16Å; S80-K83 PolarHBondContact O-N 2.92Å; S80-E84 PolarHBondContact O-N 3.39Å
81F91.4Very high89Confident122 Ų122102 Ų10254%0.53552%0.52SS..Hα-helixtrans-64.4-43.3176.2-179.6-99.9000111.2Q77 E78 K83 E84 Q85Q77-F81 PolarHBondContact O-N 3.02Å; E78-F81 PolarHBondContact O-N 2.61Å; F81-K83 VanDerWaalsContact C-N 3.29Å; F81-K83 PolarHBondContact O-N 3.25Å; F81-E84 PolarHBondContact O-N 3.38Å; F81-Q85 HydrophobicContact CD1-CG 4.1Å; F81-Q85 HydrophobicContact CE1-CG 3.69Å; F81-Q85 HydrophobicContact CZ-CG 3.92Å; F81-Q85 WeakPolarHBondContact O-CG 3.13Å; F81-Q85 PolarHBondContact O-N 3.03Å
82L89.6Confident88.8Confident104 Ų104102.6 Ų102.655%0.54552%0.524SS..Hα-helixtrans-61.3-39.5174.8-176.765.7000111.5E78 E84 Q85 M86E78-L82 WeakPolarHBondContact O-CB 3.42Å; E78-L82 PolarHBondContact O-N 3.39Å; L82-E84 VanDerWaalsContact C-N 3.35Å; L82-Q85 PolarHBondContact O-N 3.43Å; L82-M86 WeakPolarHBondContact O-CB 3.46Å; L82-M86 PolarHBondContact O-N 2.71Å
83K89.1Confident88.5Confident152 Ų152103.6 Ų103.666%0.66153%0.525SS*.Hα-helixtrans-61.1-44.1175.2-179.4-178.2175.5-175.50111.3A79 S80 F81 M86 V87A79-K83 WeakPolarHBondContact O-CB 3.42Å; A79-K83 PolarHBondContact O-N 3.43Å; S80-K83 WeakPolarHBondContact O-CB 3.16Å; S80-K83 PolarHBondContact O-N 2.92Å; F81-K83 VanDerWaalsContact C-N 3.29Å; F81-K83 PolarHBondContact O-N 3.25Å; K83-M86 PolarHBondContact O-N 3.04Å; K83-V87 WeakPolarHBondContact O-CG2 3.41Å; K83-V87 PolarHBondContact O-N 3.16Å
84E91Very high88Confident124 Ų124105.4 Ų105.458%0.57953%0.532SS*.Hα-helixtrans-63.9-43.3175.8-72.1175.8-176.800111.7S80 F81 L82 M86 V87 L88S80-E84 PolarHBondContact O-N 3.39Å; F81-E84 PolarHBondContact O-N 3.38Å; L82-E84 VanDerWaalsContact C-N 3.35Å; E84-M86 PolarHBondContact O-N 3.12Å; E84-V87 PolarHBondContact O-N 2.89Å; E84-V87 VanDerWaalsContact O-N 3.17Å; E84-L88 PolarHBondContact O-N 3.03Å
85Q88.8Confident87.7Confident80 Ų80109.1 Ų109.137%0.37454%0.539SS..Hα-helixtrans-60.6-42174.1-71.8-66.6-35.200112.2F81 L82 V87 L88 V89F81-Q85 HydrophobicContact CD1-CG 4.1Å; F81-Q85 HydrophobicContact CE1-CG 3.69Å; F81-Q85 HydrophobicContact CZ-CG 3.92Å; F81-Q85 WeakPolarHBondContact O-CG 3.13Å; F81-Q85 PolarHBondContact O-N 3.03Å; L82-Q85 PolarHBondContact O-N 3.43Å; Q85-V87 VanDerWaalsContact C-N 3.31Å; Q85-V87 PolarHBondContact O-N 2.72Å; Q85-L88 PolarHBondContact O-N 3.45Å; Q85-V89 WeakPolarHBondContact O-CG2 3.36Å; Q85-V89 PolarHBondContact O-N 3.45Å
86M85.3Confident87.2Confident132 Ų132110.1 Ų110.165%0.6554%0.539SS*.Hα-helixtrans-64.4-35.2175.3-84.3-171.2147.200112.7L82 K83 E84 K90L82-M86 WeakPolarHBondContact O-CB 3.46Å; L82-M86 PolarHBondContact O-N 2.71Å; K83-M86 PolarHBondContact O-N 3.04Å; E84-M86 PolarHBondContact O-N 3.12Å; M86-K90 VanDerWaalsContact O-CB 3.27Å; M86-K90 WeakPolarHBondContact O-CB 3.45Å; M86-K90 PolarHBondContact O-N 2.95Å
87V88.5Confident86.5Confident72 Ų72109.8 Ų109.844%0.43654%0.539SS..Hα-helixtrans-65.9-44.6174.21710000110.4K83 E84 Q85 K90 E91K83-V87 WeakPolarHBondContact O-CG2 3.41Å; K83-V87 PolarHBondContact O-N 3.16Å; E84-V87 PolarHBondContact O-N 2.89Å; E84-V87 VanDerWaalsContact O-N 3.17Å; Q85-V87 VanDerWaalsContact C-N 3.31Å; Q85-V87 PolarHBondContact O-N 2.72Å; V87-K90 WeakPolarHBondContact O-CB 3.5Å; V87-K90 PolarHBondContact O-N 3.22Å; V87-E91 PolarHBondContact O-N 3.01Å
88L89.6Confident85.9Confident85 Ų85110.1 Ų110.145%0.44554%0.541SS..Hα-helixtrans-61.1-47.8175.3-75.1166.6000112E84 Q85 K90 E91 D92E84-L88 PolarHBondContact O-N 3.03Å; Q85-L88 PolarHBondContact O-N 3.45Å; L88-K90 VanDerWaalsContact C-N 3.27Å; L88-K90 PolarHBondContact O-N 2.92Å; L88-E91 CarbonylContact O-C 3.55Å; L88-E91 PolarHBondContact O-N 2.92Å; L88-E91 VanDerWaalsContact O-N 3.08Å; L88-D92 PolarHBondContact O-N 2.87Å
89V87.8Confident85.4Confident75 Ų75108.9 Ų108.946%0.45554%0.538SS..Hα-helixtrans-60.3-38.7176.1170.80000111.2Q85 E91 D92 I93Q85-V89 WeakPolarHBondContact O-CG2 3.36Å; Q85-V89 PolarHBondContact O-N 3.45Å; V89-E91 VanDerWaalsContact C-N 3.34Å; V89-D92 PolarHBondContact O-N 3.18Å; V89-I93 HydrophobicContact CG1-CD1 3.82Å; V89-I93 HydrophobicContact CG1-CG1 4.31Å; V89-I93 WeakPolarHBondContact O-CB 3.24Å; V89-I93 VanDerWaalsContact O-CG1 3.24Å; V89-I93 WeakPolarHBondContact O-CG1 3.35Å; V89-I93 PolarHBondContact O-N 2.89Å
90K86.7Confident84.8Confident156 Ų156108.1 Ų108.168%0.67853%0.528SS*.Hα-helixtrans-63.9-40.5175.3-178.6-176.8178-178.20111.7M86 V87 L88 K94M86-K90 VanDerWaalsContact O-CB 3.27Å; M86-K90 WeakPolarHBondContact O-CB 3.45Å; M86-K90 PolarHBondContact O-N 2.95Å; V87-K90 WeakPolarHBondContact O-CB 3.5Å; V87-K90 PolarHBondContact O-N 3.22Å; L88-K90 VanDerWaalsContact C-N 3.27Å; L88-K90 PolarHBondContact O-N 2.92Å; K90-K94 WeakPolarHBondContact O-CB 3.35Å; K90-K94 PolarHBondContact O-N 3.38Å
91E86.3Confident84.2Confident119 Ų119108.9 Ų108.956%0.55653%0.53SS*.Hα-helixtrans-66.9-41.4174.9-73.9-176.916800111.7V87 L88 V89 K94 K95V87-E91 PolarHBondContact O-N 3.01Å; L88-E91 CarbonylContact O-C 3.55Å; L88-E91 PolarHBondContact O-N 2.92Å; L88-E91 VanDerWaalsContact O-N 3.08Å; V89-E91 VanDerWaalsContact C-N 3.34Å; E91-K94 PolarHBondContact O-N 3.21Å; E91-K95 WeakPolarHBondContact O-CB 3.1Å; E91-K95 PolarHBondContact O-N 3.48Å
92D85.3Confident83.6Confident103 Ų103110.2 Ų110.255%0.55154%0.538SS*.Hα-helixtrans-64.1-40.6174.7-80.8-17000112L88 V89 K95 F96L88-D92 PolarHBondContact O-N 2.87Å; V89-D92 PolarHBondContact O-N 3.18Å; D92-K95 PolarHBondContact O-N 3.37Å; D92-F96 WeakPolarHBondContact O-CB 3.29Å; D92-F96 PolarHBondContact O-N 2.86Å
93I80.6Confident83.2Confident103 Ų103108.8 Ų108.853%0.52854%0.536SS..Hα-helixtrans-63.1-44.5173.1-71.4167.2000110.1V89 K95 F96 E97V89-I93 HydrophobicContact CG1-CD1 3.82Å; V89-I93 HydrophobicContact CG1-CG1 4.31Å; V89-I93 WeakPolarHBondContact O-CB 3.24Å; V89-I93 VanDerWaalsContact O-CG1 3.24Å; V89-I93 WeakPolarHBondContact O-CG1 3.35Å; V89-I93 PolarHBondContact O-N 2.89Å; I93-K95 VanDerWaalsContact C-N 3.3Å; I93-K95 PolarHBondContact O-N 3.01Å; I93-F96 PolarHBondContact O-N 2.98Å; I93-E97 VanDerWaalsContact O-CB 3.26Å; I93-E97 WeakPolarHBondContact O-CB 3.46Å; I93-E97 PolarHBondContact O-N 3.31Å
94K79.9Confident82.7Confident128 Ų128107.4 Ų107.456%0.55753%0.534SS*.Hα-helixtrans-64.3-38.2179-166.3-179.1-176.4-174.30111.5K90 E91 Q98K90-K94 WeakPolarHBondContact O-CB 3.35Å; K90-K94 PolarHBondContact O-N 3.38Å; E91-K94 PolarHBondContact O-N 3.21Å; K94-Q98 WeakPolarHBondContact O-CB 3.37Å; K94-Q98 WeakPolarHBondContact O-CG 3.39Å; K94-Q98 PolarHBondContact O-N 3.33Å
95K83.4Confident82.3Confident123 Ų123106.9 Ų106.954%0.53553%0.531SS..Hα-helixtrans-69.8-44.1175.4-171-178.4177.5-173.80111.3E91 D92 I93 E97 Q98 D99E91-K95 WeakPolarHBondContact O-CB 3.1Å; E91-K95 PolarHBondContact O-N 3.48Å; D92-K95 PolarHBondContact O-N 3.37Å; I93-K95 VanDerWaalsContact C-N 3.3Å; I93-K95 PolarHBondContact O-N 3.01Å; K95-E97 VanDerWaalsContact C-N 3.34Å; K95-E97 PolarHBondContact O-N 3.21Å; K95-Q98 PolarHBondContact O-N 2.86Å; K95-D99 WeakPolarHBondContact O-CB 3.28Å; K95-D99 VanDerWaalsContact O-CG 3.24Å; K95-D99 PolarHBondContact O-N 3.28Å
96F79.9Confident82.1Confident137 Ų137106.5 Ų106.560%0.60153%0.534SS*.Hα-helixtrans-60-44.3174.1-179.6-95.6000111D92 I93 D99 T100D92-F96 WeakPolarHBondContact O-CB 3.29Å; D92-F96 PolarHBondContact O-N 2.86Å; I93-F96 PolarHBondContact O-N 2.98Å; F96-D99 PolarHBondContact O-N 3.34Å; F96-T100 HydrophobicContact CD1-CG2 4.27Å; F96-T100 HydrophobicContact CD2-CG2 4.04Å; F96-T100 HydrophobicContact CE1-CG2 3.88Å; F96-T100 HydrophobicContact CE2-CG2 3.64Å; F96-T100 HydrophobicContact CG-CG2 4.35Å; F96-T100 HydrophobicContact CZ-CG2 3.56Å; F96-T100 VanDerWaalsContact O-CB 3.3Å; F96-T100 WeakPolarHBondContact O-CB 3.34Å; F96-T100 PolarHBondContact O-N 3.08Å; F96-T100 PolarHBondContact O-OG1 2.64Å
97E75.3Confident82.1Confident114 Ų114105.3 Ų105.353%0.53353%0.53SS..Hα-helixtrans-60.6-46.9174.5-171.2177.7-170.200110.3I93 K95 D99 T100 V101I93-E97 VanDerWaalsContact O-CB 3.26Å; I93-E97 WeakPolarHBondContact O-CB 3.46Å; I93-E97 PolarHBondContact O-N 3.31Å; K95-E97 VanDerWaalsContact C-N 3.34Å; K95-E97 PolarHBondContact O-N 3.21Å; E97-D99 VanDerWaalsContact C-N 3.35Å; E97-D99 PolarHBondContact O-N 2.98Å; E97-T100 PolarHBondContact O-N 3.35Å; E97-V101 HydrophobicContact CG-CG2 3.95Å; E97-V101 VanDerWaalsContact O-CB 3.25Å; E97-V101 WeakPolarHBondContact O-CB 3.44Å; E97-V101 WeakPolarHBondContact O-CG2 3.28Å; E97-V101 PolarHBondContact O-N 3.44Å
98Q77.9Confident82Confident132 Ų132106.1 Ų106.162%0.61754%0.535SS*.Hα-helixtrans-60-41.4175-74.5172.7-6.400113.2K94 K95K94-Q98 WeakPolarHBondContact O-CB 3.37Å; K94-Q98 WeakPolarHBondContact O-CG 3.39Å; K94-Q98 PolarHBondContact O-N 3.33Å; K95-Q98 PolarHBondContact O-N 2.86Å
99D78.7Confident81.9Confident108 Ų108107 Ų10758%0.57854%0.537SS*.Hα-helixtrans-75.4-31.9-179.3-69.1-16.7000112.1K95 F96 E97K95-D99 WeakPolarHBondContact O-CB 3.28Å; K95-D99 VanDerWaalsContact O-CG 3.24Å; K95-D99 PolarHBondContact O-N 3.28Å; F96-D99 PolarHBondContact O-N 3.34Å; E97-D99 VanDerWaalsContact C-N 3.35Å; E97-D99 PolarHBondContact O-N 2.98Å
100T76.4Confident82Confident43 Ų43108.1 Ų108.126%0.26454%0.539SS..Hα-helixtrans-97.5-18.8-176.554.20000114.8F96 E97 Q102 S103 M104F96-T100 HydrophobicContact CD1-CG2 4.27Å; F96-T100 HydrophobicContact CD2-CG2 4.04Å; F96-T100 HydrophobicContact CE1-CG2 3.88Å; F96-T100 HydrophobicContact CE2-CG2 3.64Å; F96-T100 HydrophobicContact CG-CG2 4.35Å; F96-T100 HydrophobicContact CZ-CG2 3.56Å; F96-T100 VanDerWaalsContact O-CB 3.3Å; F96-T100 WeakPolarHBondContact O-CB 3.34Å; F96-T100 PolarHBondContact O-N 3.08Å; F96-T100 PolarHBondContact O-OG1 2.64Å; E97-T100 PolarHBondContact O-N 3.35Å; T100-Q102 PolarHBondContact O-N 3.2Å; T100-S103 CarbonylContact O-C 3.6Å; T100-S103 PolarHBondContact O-N 3.14Å; T100-M104 WeakPolarHBondContact O-CB 3.34Å; T100-M104 PolarHBondContact O-N 2.78Å
101V77.1Confident82.2Confident74 Ų74105.6 Ų105.645%0.44853%0.533SS..Hα-helixtrans-52.8-43178.5156.90000111.3E97 M104 Q105E97-V101 HydrophobicContact CG-CG2 3.95Å; E97-V101 VanDerWaalsContact O-CB 3.25Å; E97-V101 WeakPolarHBondContact O-CB 3.44Å; E97-V101 WeakPolarHBondContact O-CG2 3.28Å; E97-V101 PolarHBondContact O-N 3.44Å; V101-M104 PolarHBondContact O-N 3.4Å; V101-Q105 VanDerWaalsContact O-CB 3.22Å; V101-Q105 WeakPolarHBondContact O-CB 3.43Å; V101-Q105 PolarHBondContact O-N 2.95Å
102Q77.7Confident82.3Confident151 Ų151104.8 Ų104.871%0.70653%0.529SS*.Hα-helixtrans-68.4-38.2179.3-160.3170.216.200112.2T100 V106T100-Q102 PolarHBondContact O-N 3.2Å; Q102-V106 VanDerWaalsContact O-CG2 3.31Å; Q102-V106 WeakPolarHBondContact O-CG2 3.39Å; Q102-V106 PolarHBondContact O-N 3.26Å; Q102-V106 VanDerWaalsContact O-N 3.12Å
103S81.4Confident82.6Confident73 Ų73104 Ų10451%0.5153%0.528SS..Hα-helixtrans-71.7-38.3176.6-62.20000112.3T100 V106 L107T100-S103 CarbonylContact O-C 3.6Å; T100-S103 PolarHBondContact O-N 3.14Å; S103-V106 PolarHBondContact O-N 3.43Å; S103-L107 WeakPolarHBondContact O-CG 3.42Å; S103-L107 PolarHBondContact O-N 3.27Å
104M78.9Confident83.2Confident124 Ų124104.8 Ų104.861%0.61153%0.528SS*.Hα-helixtrans-66.8-40.5176.2-163.377.9168.900110.8T100 V101 L107 V108T100-M104 WeakPolarHBondContact O-CB 3.34Å; T100-M104 PolarHBondContact O-N 2.78Å; V101-M104 PolarHBondContact O-N 3.4Å; M104-L107 PolarHBondContact O-N 2.97Å; M104-V108 WeakPolarHBondContact O-CG2 3.48Å; M104-V108 PolarHBondContact O-N 3.22Å
105Q82.2Confident83.6Confident112 Ų112101.3 Ų101.352%0.52352%0.52SS..Hα-helixtrans-62-44.4174.2-173.5169.31.600111.3V101 L107 V108 E109V101-Q105 VanDerWaalsContact O-CB 3.22Å; V101-Q105 WeakPolarHBondContact O-CB 3.43Å; V101-Q105 PolarHBondContact O-N 2.95Å; Q105-L107 VanDerWaalsContact C-N 3.35Å; Q105-L107 PolarHBondContact O-N 3.43Å; Q105-V108 PolarHBondContact O-N 3.1Å; Q105-E109 WeakPolarHBondContact O-CG 3.28Å; Q105-E109 PolarHBondContact O-N 3.04Å
106V86Confident83.8Confident72 Ų72103 Ų10344%0.43652%0.523SS..Hα-helixtrans-62.1-40.2173.4171.40000111.7Q102 S103 E109 I110Q102-V106 VanDerWaalsContact O-CG2 3.31Å; Q102-V106 WeakPolarHBondContact O-CG2 3.39Å; Q102-V106 PolarHBondContact O-N 3.26Å; Q102-V106 VanDerWaalsContact O-N 3.12Å; S103-V106 PolarHBondContact O-N 3.43Å; V106-E109 PolarHBondContact O-N 2.85Å; V106-I110 HydrophobicContact CG1-CD1 3.72Å; V106-I110 HydrophobicContact CG1-CG1 4.33Å; V106-I110 WeakPolarHBondContact O-CB 3.35Å; V106-I110 VanDerWaalsContact O-CG1 3.23Å; V106-I110 WeakPolarHBondContact O-CG1 3.29Å; V106-I110 PolarHBondContact O-N 3.4Å
107L84.8Confident84.2Confident107 Ų107103 Ų10356%0.5653%0.526SS*.Hα-helixtrans-64-39.8175.8-77.5168.4000112.6S103 M104 Q105 I110 D111S103-L107 WeakPolarHBondContact O-CG 3.42Å; S103-L107 PolarHBondContact O-N 3.27Å; M104-L107 PolarHBondContact O-N 2.97Å; Q105-L107 VanDerWaalsContact C-N 3.35Å; Q105-L107 PolarHBondContact O-N 3.43Å; L107-I110 PolarHBondContact O-N 3.3Å; L107-D111 WeakPolarHBondContact O-CB 3.45Å; L107-D111 PolarHBondContact O-N 3.43Å
108V87.1Confident84.8Confident89 Ų89102.2 Ų102.254%0.53952%0.522SS..Hα-helixtrans-65.2-41.6174.7171.10000110.8M104 Q105 D111 Q112M104-V108 WeakPolarHBondContact O-CG2 3.48Å; M104-V108 PolarHBondContact O-N 3.22Å; Q105-V108 PolarHBondContact O-N 3.1Å; V108-D111 PolarHBondContact O-N 2.92Å; V108-Q112 VanDerWaalsContact O-CB 3.3Å; V108-Q112 WeakPolarHBondContact O-CB 3.34Å; V108-Q112 PolarHBondContact O-N 3.44Å
109E87.6Confident85Confident103 Ų103100.8 Ų100.848%0.48152%0.519SS..Hα-helixtrans-62.3-43.5174.3-73.3177.2-169.600111.4Q105 V106 Q112 V113Q105-E109 WeakPolarHBondContact O-CG 3.28Å; Q105-E109 PolarHBondContact O-N 3.04Å; V106-E109 PolarHBondContact O-N 2.85Å; E109-Q112 PolarHBondContact O-N 3.2Å; E109-V113 VanDerWaalsContact O-CG2 3.28Å; E109-V113 WeakPolarHBondContact O-CG2 3.38Å; E109-V113 PolarHBondContact O-N 3.17Å
110I89.8Confident85.3Confident100 Ų10098 Ų9851%0.51351%0.51SS..Hα-helixtrans-64.7-42.7176.8-68.9167000111.3V106 L107 Q112 V113 K114V106-I110 HydrophobicContact CG1-CD1 3.72Å; V106-I110 HydrophobicContact CG1-CG1 4.33Å; V106-I110 WeakPolarHBondContact O-CB 3.35Å; V106-I110 VanDerWaalsContact O-CG1 3.23Å; V106-I110 WeakPolarHBondContact O-CG1 3.29Å; V106-I110 PolarHBondContact O-N 3.4Å; L107-I110 PolarHBondContact O-N 3.3Å; I110-Q112 VanDerWaalsContact C-N 3.34Å; I110-V113 PolarHBondContact O-N 3.33Å; I110-K114 VanDerWaalsContact O-CB 3.3Å; I110-K114 WeakPolarHBondContact O-CB 3.12Å; I110-K114 PolarHBondContact O-N 3.07Å
111D89.7Confident85.7Confident103 Ų10398.6 Ų98.655%0.55152%0.52SS*.Hα-helixtrans-65-40.5177.2-171.961.9000111.3L107 V108 V113 K114 S115L107-D111 WeakPolarHBondContact O-CB 3.45Å; L107-D111 PolarHBondContact O-N 3.43Å; V108-D111 PolarHBondContact O-N 2.92Å; D111-V113 PolarHBondContact O-N 3.32Å; D111-K114 PolarHBondContact O-N 3.18Å; D111-S115 WeakPolarHBondContact O-CB 3.44Å; D111-S115 PolarHBondContact O-N 3.42Å
112Q89.1Confident86.1Confident101 Ų10199 Ų9947%0.47252%0.517SS..Hα-helixtrans-64.1-41.7175.2-167.9171.932.400111.7V108 E109 I110 R116V108-Q112 VanDerWaalsContact O-CB 3.3Å; V108-Q112 WeakPolarHBondContact O-CB 3.34Å; V108-Q112 PolarHBondContact O-N 3.44Å; E109-Q112 PolarHBondContact O-N 3.2Å; I110-Q112 VanDerWaalsContact C-N 3.34Å; Q112-R116 VanDerWaalsContact NE2-NH2 3.16Å; Q112-R116 WeakPolarHBondContact O-CB 3.34Å; Q112-R116 VanDerWaalsContact O-CG 3.28Å; Q112-R116 WeakPolarHBondContact O-CG 3.43Å; Q112-R116 PolarHBondContact O-N 3.25Å
113V90.8Very high86.4Confident88 Ų8893.5 Ų93.553%0.53350%0.497SS..Hα-helixtrans-63.3-47173.3170.80000110.3E109 I110 D111 S115 R116 M117E109-V113 VanDerWaalsContact O-CG2 3.28Å; E109-V113 WeakPolarHBondContact O-CG2 3.38Å; E109-V113 PolarHBondContact O-N 3.17Å; I110-V113 PolarHBondContact O-N 3.33Å; D111-V113 PolarHBondContact O-N 3.32Å; V113-S115 PolarHBondContact O-N 3.28Å; V113-R116 PolarHBondContact O-N 3.49Å; V113-M117 WeakPolarHBondContact O-CB 3.45Å; V113-M117 PolarHBondContact O-N 3.46Å
114K92.8Very high86.5Confident118 Ų11896 Ų9651%0.51350%0.504SS..Hα-helixtrans-59.7-46.2178.8179.9-172.9171.1-168.10111.9I110 D111 M117 Q118I110-K114 VanDerWaalsContact O-CB 3.3Å; I110-K114 WeakPolarHBondContact O-CB 3.12Å; I110-K114 PolarHBondContact O-N 3.07Å; D111-K114 PolarHBondContact O-N 3.18Å; K114-M117 CarbonylContact O-C 3.57Å; K114-M117 PolarHBondContact O-N 3.44Å; K114-M117 VanDerWaalsContact O-N 3.16Å; K114-Q118 PolarHBondContact O-N 3.46Å
115S89.9Confident86.9Confident56 Ų5695.5 Ų95.539%0.39250%0.5SS..Hα-helixtrans-59.8-48.1177.2175.70000111D111 V113 M117 Q118 L119D111-S115 WeakPolarHBondContact O-CB 3.44Å; D111-S115 PolarHBondContact O-N 3.42Å; V113-S115 PolarHBondContact O-N 3.28Å; S115-M117 VanDerWaalsContact C-N 3.29Å; S115-M117 PolarHBondContact O-N 3.42Å; S115-Q118 PolarHBondContact O-N 2.95Å; S115-L119 WeakPolarHBondContact O-CG 3.39Å; S115-L119 PolarHBondContact O-N 3.24Å
116R86.7Confident87Confident158 Ų15891.8 Ų91.860%0.59648%0.483SS*.Hα-helixtrans-60.3-39.2174-71177-171179.27.3112.1Q112 V113 A120Q112-R116 VanDerWaalsContact NE2-NH2 3.16Å; Q112-R116 WeakPolarHBondContact O-CB 3.34Å; Q112-R116 VanDerWaalsContact O-CG 3.28Å; Q112-R116 WeakPolarHBondContact O-CG 3.43Å; Q112-R116 PolarHBondContact O-N 3.25Å; V113-R116 PolarHBondContact O-N 3.49Å; R116-A120 VanDerWaalsContact O-CB 3.29Å; R116-A120 WeakPolarHBondContact O-CB 3.5Å; R116-A120 PolarHBondContact O-N 2.89Å
117M88Confident87Confident136 Ų13689.9 Ų89.967%0.6748%0.475SS*.Hα-helixtrans-69.4-37.8179.7-139.3176.979.500112.1V113 K114 S115 A121V113-M117 WeakPolarHBondContact O-CB 3.45Å; V113-M117 PolarHBondContact O-N 3.46Å; K114-M117 CarbonylContact O-C 3.57Å; K114-M117 PolarHBondContact O-N 3.44Å; K114-M117 VanDerWaalsContact O-N 3.16Å; S115-M117 VanDerWaalsContact C-N 3.29Å; S115-M117 PolarHBondContact O-N 3.42Å; M117-A121 VanDerWaalsContact O-CB 3.28Å; M117-A121 WeakPolarHBondContact O-CB 3.43Å; M117-A121 PolarHBondContact O-N 3Å
118Q88.5Confident87Confident98 Ų9890 Ų9046%0.45848%0.476SS..Hα-helixtrans-66.1-47.3173.6-80.3179.3-75.300111.3K114 S115 A120 A121 E122K114-Q118 PolarHBondContact O-N 3.46Å; S115-Q118 PolarHBondContact O-N 2.95Å; Q118-A120 VanDerWaalsContact C-N 3.31Å; Q118-A120 PolarHBondContact O-N 2.99Å; Q118-A121 PolarHBondContact O-N 3.45Å; Q118-E122 WeakPolarHBondContact O-CB 3.39Å; Q118-E122 WeakPolarHBondContact O-CG 3.46Å; Q118-E122 PolarHBondContact O-N 3.39Å
119L82.6Confident87.1Confident102 Ų10289.7 Ų89.753%0.53447%0.468SS..Hα-helixtrans-59.2-42.3175.7-69.9171.2000111.8S115 A123S115-L119 WeakPolarHBondContact O-CG 3.39Å; S115-L119 PolarHBondContact O-N 3.24Å; L119-A123 VanDerWaalsContact O-CB 3.28Å; L119-A123 WeakPolarHBondContact O-CB 3.28Å; L119-A123 PolarHBondContact O-N 2.97Å
120A83.5Confident87.2Confident49 Ų4985.6 Ų85.641%0.40545%0.447SS..Hα-helixtrans-66.6-40.7176.200000112.4R116 Q118 A123 L124R116-A120 VanDerWaalsContact O-CB 3.29Å; R116-A120 WeakPolarHBondContact O-CB 3.5Å; R116-A120 PolarHBondContact O-N 2.89Å; Q118-A120 VanDerWaalsContact C-N 3.31Å; Q118-A120 PolarHBondContact O-N 2.99Å; A120-A123 PolarHBondContact O-N 3.33Å; A120-L124 WeakPolarHBondContact O-CB 3.46Å; A120-L124 VanDerWaalsContact O-CG 3.24Å; A120-L124 WeakPolarHBondContact O-CG 3.28Å; A120-L124 PolarHBondContact O-N 3.29Å
121A86.4Confident87Confident56 Ų5684.4 Ų84.446%0.46345%0.448SS..Hα-helixtrans-65.1-43.6177.200000111.8M117 Q118 L124 Q125M117-A121 VanDerWaalsContact O-CB 3.28Å; M117-A121 WeakPolarHBondContact O-CB 3.43Å; M117-A121 PolarHBondContact O-N 3Å; Q118-A121 PolarHBondContact O-N 3.45Å; A121-L124 PolarHBondContact O-N 3.28Å; A121-Q125 WeakPolarHBondContact O-CB 3.28Å; A121-Q125 PolarHBondContact O-N 3.11Å
122E85.3Confident87Confident84 Ų8482.7 Ų82.739%0.39344%0.441SS..Hα-helixtrans-62.9-46.8175.1-72.3170.5-168.400111Q118 L124 Q125 E126Q118-E122 WeakPolarHBondContact O-CB 3.39Å; Q118-E122 WeakPolarHBondContact O-CG 3.46Å; Q118-E122 PolarHBondContact O-N 3.39Å; E122-L124 PolarHBondContact O-N 3.1Å; E122-Q125 PolarHBondContact O-N 3.37Å; E122-E126 WeakPolarHBondContact O-CG 3.34Å; E122-E126 PolarHBondContact O-N 3.24Å
123A82.5Confident87Confident35 Ų3578.7 Ų78.729%0.28942%0.423SS..Hα-helixtrans-61.6-41176.400000112.6L119 A120 E126 A127 L163L119-A123 VanDerWaalsContact O-CB 3.28Å; L119-A123 WeakPolarHBondContact O-CB 3.28Å; L119-A123 PolarHBondContact O-N 2.97Å; A120-A123 PolarHBondContact O-N 3.33Å; A123-E126 PolarHBondContact O-N 2.74Å; A123-A127 WeakPolarHBondContact O-CB 3.33Å; A123-A127 PolarHBondContact O-N 3.37Å; A123-L163 WeakPolarHBondContact O-CD2 3.31Å
124L83.9Confident86.8Confident125 Ų12576.2 Ų76.265%0.65441%0.41SS*.Hα-helixtrans-65-40.5175.1-75.9170.2000111.8A120 A121 E122 A127 D128A120-L124 WeakPolarHBondContact O-CB 3.46Å; A120-L124 VanDerWaalsContact O-CG 3.24Å; A120-L124 WeakPolarHBondContact O-CG 3.28Å; A120-L124 PolarHBondContact O-N 3.29Å; A121-L124 PolarHBondContact O-N 3.28Å; E122-L124 PolarHBondContact O-N 3.1Å; L124-A127 PolarHBondContact O-N 3.34Å; L124-D128 PolarHBondContact O-N 3.27Å
125Q87.1Confident86.6Confident114 Ų11474.2 Ų74.253%0.53342%0.416SS..Hα-helixtrans-64.5-41.5176.9-168.8-179.32.300111.5A121 E122 D128 K129A121-Q125 WeakPolarHBondContact O-CB 3.28Å; A121-Q125 PolarHBondContact O-N 3.11Å; E122-Q125 PolarHBondContact O-N 3.37Å; Q125-D128 PolarHBondContact O-N 3.42Å; Q125-K129 WeakPolarHBondContact O-CB 3.48Å; Q125-K129 VanDerWaalsContact O-CG 3.26Å; Q125-K129 WeakPolarHBondContact O-CG 3.3Å; Q125-K129 PolarHBondContact O-N 3.47Å
126E85.9Confident86.5Confident34 Ų3474.4 Ų74.416%0.15941%0.412CS..Hα-helixtrans-70-31.4174.9-65.3-52.914100112.7E122 A123 K129 W130 S159 M162 L163E122-E126 WeakPolarHBondContact O-CG 3.34Å; E122-E126 PolarHBondContact O-N 3.24Å; A123-E126 PolarHBondContact O-N 2.74Å; E126-K129 IonicContact OE1-NZ 2.78Å; E126-K129 PolarHBondContact OE1-NZ 2.95Å; E126-K129 WeakPolarHBondContact OE2-CD 3.36Å; E126-K129 IonicContact OE2-NZ 2.95Å; E126-W130 WeakPolarHBondContact O-CB 3.49Å; E126-W130 PolarHBondContact O-N 3.09Å; E126-S159 PolarHBondContact OE2-OG 3.48Å; E126-M162 HydrophobicContact CB-CB 4.2Å; E126-M162 HydrophobicContact CG-CB 3.9Å; E126-M162 HydrophobicContact CG-CG 4.16Å; E126-L163 HydrophobicContact CB-CD2 4.39Å; E126-L163 HydrophobicContact CB-CG 4.39Å
127A85.1Confident86.6Confident32 Ų3267 Ų6726%0.26438%0.384SS..Hα-helixtrans-66.8-42173.300000112.1A123 L124 W130 S131 L163A123-A127 WeakPolarHBondContact O-CB 3.33Å; A123-A127 PolarHBondContact O-N 3.37Å; L124-A127 PolarHBondContact O-N 3.34Å; A127-W130 PolarHBondContact O-N 3.25Å; A127-S131 PolarHBondContact O-N 2.99Å; A127-L163 HydrophobicContact CB-CD1 4.49Å; A127-L163 HydrophobicContact CB-CD2 3.87Å
128D85.1Confident86.6Confident110 Ų11064.3 Ų64.359%0.58837%0.37SS*.Hα-helixtrans-67.3-42.2175.9-17147.6000111.6L124 Q125 W130 S131 T132L124-D128 PolarHBondContact O-N 3.27Å; Q125-D128 PolarHBondContact O-N 3.42Å; D128-W130 PolarHBondContact O-N 3.45Å; D128-S131 PolarHBondContact O-N 3.19Å; D128-T132 PolarHBondContact O-N 3.17Å; D128-T132 PolarHBondContact O-OG1 3.14Å
129K87.9Confident86.6Confident82 Ų8266.3 Ų66.336%0.35738%0.379SS..Hα-helixtrans-56.7-49.2170.4-75.8170.6-177.2174.30111.2Q125 E126 S131 T132 L133Q125-K129 WeakPolarHBondContact O-CB 3.48Å; Q125-K129 VanDerWaalsContact O-CG 3.26Å; Q125-K129 WeakPolarHBondContact O-CG 3.3Å; Q125-K129 PolarHBondContact O-N 3.47Å; E126-K129 IonicContact OE1-NZ 2.78Å; E126-K129 PolarHBondContact OE1-NZ 2.95Å; E126-K129 WeakPolarHBondContact OE2-CD 3.36Å; E126-K129 IonicContact OE2-NZ 2.95Å; K129-S131 VanDerWaalsContact C-N 3.34Å; K129-S131 PolarHBondContact O-N 3.4Å; K129-T132 PolarHBondContact O-N 3.39Å; K129-L133 WeakPolarHBondContact O-CB 3.34Å; K129-L133 WeakPolarHBondContact O-CG 3.46Å; K129-L133 PolarHBondContact O-N 3.35Å
130W89.7Confident86.9Confident16 Ų1662.6 Ų62.66%0.06136%0.361CS..Hα-helixtrans-56.7-46.4177.3173.8-85.7000112.2E126 A127 D128 T132 L133 S134 M156 L160 L163 K172 L176E126-W130 WeakPolarHBondContact O-CB 3.49Å; E126-W130 PolarHBondContact O-N 3.09Å; A127-W130 PolarHBondContact O-N 3.25Å; D128-W130 PolarHBondContact O-N 3.45Å; W130-T132 VanDerWaalsContact C-N 3.35Å; W130-T132 PolarHBondContact O-N 3.33Å; W130-L133 PolarHBondContact O-N 3.16Å; W130-S134 VanDerWaalsContact O-CB 3.23Å; W130-S134 WeakPolarHBondContact O-CB 3.43Å; W130-S134 PolarHBondContact O-N 3.18Å; W130-M156 HydrophobicContact CD2-CE 4.38Å; W130-M156 HydrophobicContact CE3-CB 4.1Å; W130-M156 HydrophobicContact CE3-CE 4.18Å; W130-M156 HydrophobicContact CE3-CG 4.48Å; W130-M156 HydrophobicContact CH2-CE 3.68Å; W130-M156 HydrophobicContact CZ2-CE 3.87Å; W130-M156 HydrophobicContact CZ3-CB 3.74Å; W130-M156 HydrophobicContact CZ3-CE 3.84Å; W130-M156 HydrophobicContact CZ3-CG 4.41Å; W130-M156 WeakPolarHBondContact CZ3-O 3.29Å; W130-L160 HydrophobicContact CE3-CB 4.17Å; W130-L160 HydrophobicContact CH2-CD1 4.35Å; W130-L160 HydrophobicContact CH2-CD2 4.34Å; W130-L160 HydrophobicContact CZ3-CB 3.81Å; W130-L160 HydrophobicContact CZ3-CD1 4.2Å; W130-L160 HydrophobicContact CZ3-CD2 4.25Å; W130-L160 HydrophobicContact CZ3-CG 4.32Å; W130-L163 HydrophobicContact CB-CD1 4.09Å; W130-K172 HydrophobicContact CH2-CB 4.2Å; W130-K172 HydrophobicContact CZ2-CB 3.7Å; W130-K172 HydrophobicContact CZ2-CG 3.99Å; W130-L176 HydrophobicContact CH2-CB 4.09Å; W130-L176 HydrophobicContact CH2-CD1 4.47Å
131S87Confident87.2Confident75 Ų7560.5 Ų60.552%0.52434%0.343SS..Hα-helixtrans-58.5-47178.4-173.30000111.6A127 D128 K129 S134 A135A127-S131 PolarHBondContact O-N 2.99Å; D128-S131 PolarHBondContact O-N 3.19Å; K129-S131 VanDerWaalsContact C-N 3.34Å; K129-S131 PolarHBondContact O-N 3.4Å; S131-S134 PolarHBondContact O-N 3.35Å; S131-A135 PolarHBondContact O-N 3.13Å
132T89.1Confident87.3Confident67 Ų6765.5 Ų65.541%0.41135%0.354SS..Hα-helixtrans-62.9-47.8177-53.80000111.3D128 K129 W130 S134 A135 D136D128-T132 PolarHBondContact O-N 3.17Å; D128-T132 PolarHBondContact O-OG1 3.14Å; K129-T132 PolarHBondContact O-N 3.39Å; W130-T132 VanDerWaalsContact C-N 3.35Å; W130-T132 PolarHBondContact O-N 3.33Å; T132-S134 VanDerWaalsContact C-N 3.32Å; T132-S134 PolarHBondContact O-N 3.48Å; T132-A135 PolarHBondContact O-N 3.48Å; T132-D136 VanDerWaalsContact O-CG 3.22Å; T132-D136 PolarHBondContact O-N 3.06Å; T132-D136 VanDerWaalsContact O-N 3.09Å
133L89.4Confident87.3Confident17 Ų1765.6 Ų65.69%0.08936%0.361CS..Hα-helixtrans-61.9-39.9179.3-66.6170.3000111.8K129 W130 D136 I137 K152 S155 M156K129-L133 WeakPolarHBondContact O-CB 3.34Å; K129-L133 WeakPolarHBondContact O-CG 3.46Å; K129-L133 PolarHBondContact O-N 3.35Å; W130-L133 PolarHBondContact O-N 3.16Å; L133-D136 PolarHBondContact O-N 3.43Å; L133-I137 WeakPolarHBondContact O-CB 3.32Å; L133-I137 PolarHBondContact O-N 3.17Å; L133-K152 HydrophobicContact CD2-CD 3.54Å; L133-K152 HydrophobicContact CD2-CG 4.27Å; L133-S155 WeakPolarHBondContact CD1-OG 2.98Å; L133-M156 HydrophobicContact CB-CG 3.52Å; L133-M156 HydrophobicContact CB-SD 4.16Å; L133-M156 HydrophobicContact CD1-CB 4.48Å; L133-M156 HydrophobicContact CD1-CG 3.77Å; L133-M156 HydrophobicContact CG-CG 4.22Å
134S87.3Confident87.4Confident36 Ų3670.7 Ų70.725%0.25238%0.378SS..Hα-helixtrans-69.4-32.7178.6-179.30000112.8W130 S131 T132 I137W130-S134 VanDerWaalsContact O-CB 3.23Å; W130-S134 WeakPolarHBondContact O-CB 3.43Å; W130-S134 PolarHBondContact O-N 3.18Å; S131-S134 PolarHBondContact O-N 3.35Å; T132-S134 VanDerWaalsContact C-N 3.32Å; T132-S134 PolarHBondContact O-N 3.48Å; S134-I137 VanDerWaalsContact O-CG2 3.29Å; S134-I137 WeakPolarHBondContact O-CG2 3.37Å
135A87.4Confident87.7Confident77 Ų7768.3 Ų68.364%0.63637%0.366SS*.Hα-helixtrans-69.8-41.817300000111.8S131 T132S131-A135 PolarHBondContact O-N 3.13Å; T132-A135 PolarHBondContact O-N 3.48Å
136D88.7Confident87.7Confident60 Ų6063.7 Ų63.732%0.32135%0.345SS..Hα-helixtrans-76.4-24.4-176.9-63.9-15.7000113.4T132 L133 E138 E139 T140 K152T132-D136 VanDerWaalsContact O-CG 3.22Å; T132-D136 PolarHBondContact O-N 3.06Å; T132-D136 VanDerWaalsContact O-N 3.09Å; L133-D136 PolarHBondContact O-N 3.43Å; D136-E138 VanDerWaalsContact C-N 3.28Å; D136-E138 PolarHBondContact O-N 3.31Å; D136-E139 WeakPolarHBondContact O-CB 3.47Å; D136-E139 PolarHBondContact O-N 2.79Å; D136-T140 PolarHBondContact O-N 2.9Å; D136-T140 VanDerWaalsContact O-N 3.08Å; D136-K152 IonicContact OD2-NZ 3.14Å; D136-K152 PolarHBondContact OD2-NZ 3.34Å
137I88.9Confident87.8Confident1 Ų165.7 Ų65.71%0.00536%0.355CS..Hα-helixtrans-59-39.7-168.7-162.668.4000111.7L133 S134 E139 T140 F141 K152 L153 M156 L179L133-I137 WeakPolarHBondContact O-CB 3.32Å; L133-I137 PolarHBondContact O-N 3.17Å; S134-I137 VanDerWaalsContact O-CG2 3.29Å; S134-I137 WeakPolarHBondContact O-CG2 3.37Å; I137-E139 VanDerWaalsContact C-N 3.28Å; I137-E139 PolarHBondContact O-N 2.8Å; I137-T140 WeakPolarHBondContact CA-OG1 3.26Å; I137-T140 PolarHBondContact O-N 2.82Å; I137-T140 VanDerWaalsContact O-N 3.14Å; I137-T140 PolarHBondContact O-OG1 3.37Å; I137-F141 HydrophobicContact CD1-CD2 4.42Å; I137-F141 HydrophobicContact CD1-CE2 4.11Å; I137-F141 HydrophobicContact CG1-CD2 3.85Å; I137-F141 HydrophobicContact CG1-CE2 3.68Å; I137-F141 WeakPolarHBondContact O-CD2 3.41Å; I137-F141 PolarHBondContact O-N 3.16Å; I137-K152 HydrophobicContact CD1-CB 3.95Å; I137-K152 HydrophobicContact CD1-CG 3.64Å; I137-L153 HydrophobicContact CD1-CD2 3.9Å; I137-L153 HydrophobicContact CD1-CG 4.3Å; I137-L153 HydrophobicContact CG1-CD2 4.36Å; I137-M156 HydrophobicContact CB-SD 4.32Å; I137-M156 HydrophobicContact CD1-SD 4.05Å; I137-M156 HydrophobicContact CG1-SD 4.19Å; I137-L179 HydrophobicContact CG1-CD1 4.09Å; I137-L179 HydrophobicContact CG1-CD2 4.25Å; I137-L179 HydrophobicContact CG2-CD1 4.12Å; I137-L179 HydrophobicContact CG2-CD2 4.13Å
138E87.7Confident88Confident81 Ų8167.3 Ų67.338%0.37936%0.361SS..Hα-helixtrans-65.4-30.1179-73.9-64.2160.700112.9D136 K142 R182D136-E138 VanDerWaalsContact C-N 3.28Å; D136-E138 PolarHBondContact O-N 3.31Å; E138-K142 WeakPolarHBondContact O-CG 3.28Å; E138-R182 VanDerWaalsContact CD-NH1 3.28Å; E138-R182 IonicContact OE1-NH1 3.35Å; E138-R182 PolarHBondContact OE1-NH1 3.05Å; E138-R182 IonicContact OE2-CZ 2.67Å; E138-R182 IonicContact OE2-NH1 2.71Å; E138-R182 PolarHBondContact OE2-NH1 3.47Å; E138-R182 IonicContact OE2-NH2 3.42Å; E138-R182 PolarHBondContact OE2-NH2 3.48Å
139E88Confident88.3Confident139 Ų13962 Ų6265%0.6533%0.333SS*.Hα-helixtrans-73.2-42.1172.8-168.4173.8-177.400110.7D136 I137 F141 K142D136-E139 WeakPolarHBondContact O-CB 3.47Å; D136-E139 PolarHBondContact O-N 2.79Å; I137-E139 VanDerWaalsContact C-N 3.28Å; I137-E139 PolarHBondContact O-N 2.8Å; E139-F141 VanDerWaalsContact C-N 3.31Å; E139-F141 PolarHBondContact O-N 3.29Å; E139-K142 WeakPolarHBondContact O-CB 2.89Å; E139-K142 PolarHBondContact O-N 2.82Å
140T88.7Confident88.5Confident24 Ų2458.1 Ų58.115%0.14732%0.316CS..Hα-helixtrans-62.8-35.3176.263.20000112.7D136 I137 K142 T143D136-T140 PolarHBondContact O-N 2.9Å; D136-T140 VanDerWaalsContact O-N 3.08Å; I137-T140 WeakPolarHBondContact CA-OG1 3.26Å; I137-T140 PolarHBondContact O-N 2.82Å; I137-T140 VanDerWaalsContact O-N 3.14Å; I137-T140 PolarHBondContact O-OG1 3.37Å; T140-K142 PolarHBondContact O-N 3.49Å; T140-T143 PolarHBondContact O-N 3.26Å; T140-T143 VanDerWaalsContact O-N 3.14Å; T140-T143 PolarHBondContact O-OG1 2.96Å
141F89.5Confident88.5Confident5 Ų560.6 Ų60.62%0.02234%0.335CS..Hα-helixtrans-64.1-22.4175.2-92.3-82.1000113.6I137 E139 T143 I149 L179 R182 L183 M186I137-F141 HydrophobicContact CD1-CD2 4.42Å; I137-F141 HydrophobicContact CD1-CE2 4.11Å; I137-F141 HydrophobicContact CG1-CD2 3.85Å; I137-F141 HydrophobicContact CG1-CE2 3.68Å; I137-F141 WeakPolarHBondContact O-CD2 3.41Å; I137-F141 PolarHBondContact O-N 3.16Å; E139-F141 VanDerWaalsContact C-N 3.31Å; E139-F141 PolarHBondContact O-N 3.29Å; F141-T143 VanDerWaalsContact C-N 3.33Å; F141-I149 HydrophobicContact CD1-CD1 4.09Å; F141-I149 HydrophobicContact CD1-CG2 4.28Å; F141-I149 HydrophobicContact CD2-CG2 4.24Å; F141-I149 HydrophobicContact CE1-CD1 4.49Å; F141-I149 HydrophobicContact CE1-CG2 3.84Å; F141-I149 HydrophobicContact CE2-CG2 3.77Å; F141-I149 HydrophobicContact CG-CD1 4.45Å; F141-I149 HydrophobicContact CG-CG2 4.47Å; F141-I149 HydrophobicContact CZ-CG2 3.56Å; F141-L179 HydrophobicContact CD2-CD2 4.46Å; F141-L179 HydrophobicContact CE2-CB 4.39Å; F141-L179 HydrophobicContact CE2-CD2 3.87Å; F141-L179 HydrophobicContact CZ-CB 4.5Å; F141-L179 WeakPolarHBondContact CZ-O 3.23Å; F141-R182 HydrophobicContact CD1-CG 4.33Å; F141-R182 HydrophobicContact CE1-CB 4.25Å; F141-R182 HydrophobicContact CE1-CG 4Å; F141-R182 HydrophobicContact CZ-CB 4.49Å; F141-L183 HydrophobicContact CE1-CB 4.11Å; F141-L183 HydrophobicContact CZ-CB 4.2Å; F141-M186 HydrophobicContact CD1-SD 3.69Å; F141-M186 HydrophobicContact CE1-SD 4.12Å
142K88.4Confident88.6Confident162 Ų16259 Ų5970%0.70432%0.319SS*.Hα-helixtrans-74.3-22.4176.6-65.3170.8-172.9169.80112.9E138 E139 T140 Q144E138-K142 WeakPolarHBondContact O-CG 3.28Å; E139-K142 WeakPolarHBondContact O-CB 2.89Å; E139-K142 PolarHBondContact O-N 2.82Å; T140-K142 PolarHBondContact O-N 3.49Å; K142-Q144 PolarHBondContact O-N 2.98Å
143T87.1Confident88.7Confident86 Ų8655.9 Ų55.953%0.52830%0.3SS..THydrogen-bonded Turntrans-71.7-19.5179.170.10000112.4T140 F141 D145T140-T143 PolarHBondContact O-N 3.26Å; T140-T143 VanDerWaalsContact O-N 3.14Å; T140-T143 PolarHBondContact O-OG1 2.96Å; F141-T143 VanDerWaalsContact C-N 3.33Å; T143-D145 PolarHBondContact O-N 3.33Å; T143-D145 VanDerWaalsContact O-N 3.11Å; T143-D145 PolarHBondContact OG1-N 3.3Å
144Q84.5Confident88.7Confident142 Ų14256.5 Ų56.566%0.66430%0.304SS*.  trans57.713.8-174.9-56.3-175.1-500114.5K142 L146 M186K142-Q144 PolarHBondContact O-N 2.98Å; Q144-L146 PolarHBondContact O-N 3.29Å; Q144-M186 HydrophobicContact CB-CE 4.4Å; Q144-M186 HydrophobicContact CG-CE 4.09Å
145D88.5Confident88.8Confident75 Ų7557.1 Ų57.140%0.40131%0.309SS..  trans-87.4108.5176.6-171.1-20.9000110.3T143 E147 V148 I149T143-D145 PolarHBondContact O-N 3.33Å; T143-D145 VanDerWaalsContact O-N 3.11Å; T143-D145 PolarHBondContact OG1-N 3.3Å; D145-E147 VanDerWaalsContact C-N 3.33Å; D145-E147 PolarHBondContact O-N 3.12Å; D145-E147 PolarHBondContact OD1-N 2.73Å; D145-E147 VanDerWaalsContact OD1-N 3.14Å; D145-V148 HydrophobicContact CB-CB 4.2Å; D145-V148 HydrophobicContact CB-CG2 4.12Å; D145-V148 PolarHBondContact O-N 3.44Å; D145-V148 WeakPolarHBondContact OD2-CG2 3.47Å; D145-I149 WeakPolarHBondContact O-CD1 3.38Å; D145-I149 WeakPolarHBondContact O-CG1 3.37Å; D145-I149 PolarHBondContact O-N 3.21Å
146L88.3Confident88.9Confident16 Ų1653.5 Ų53.58%0.08428%0.278CS..Hα-helixtrans-65.5-32.8-173.8-59.9176.4000113Q144 S150 L183 A187 F206Q144-L146 PolarHBondContact O-N 3.29Å; L146-S150 WeakPolarHBondContact O-CB 3.3Å; L146-S150 PolarHBondContact O-N 3.28Å; L146-L183 HydrophobicContact CD2-CD1 3.46Å; L146-L183 VanDerWaalsContact CD2-CD1 3.46Å; L146-A187 HydrophobicContact CD1-CB 4.04Å; L146-A187 HydrophobicContact CD2-CB 4.22Å; L146-F206 HydrophobicContact CD1-CD1 4.25Å; L146-F206 HydrophobicContact CD1-CE1 3.42Å; L146-F206 VanDerWaalsContact CD1-CE1 3.42Å; L146-F206 HydrophobicContact CD1-CZ 4.17Å
147E88.4Confident88.9Confident77 Ų7752.2 Ų52.236%0.3627%0.27SS..Hα-helixtrans-71.7-41.5179.9-65.5-163.7151.800111D145 S150 S151 V205 V209D145-E147 VanDerWaalsContact C-N 3.33Å; D145-E147 PolarHBondContact O-N 3.12Å; D145-E147 PolarHBondContact OD1-N 2.73Å; D145-E147 VanDerWaalsContact OD1-N 3.14Å; E147-S150 WeakPolarHBondContact O-CB 3.29Å; E147-S150 PolarHBondContact O-N 2.66Å; E147-S151 PolarHBondContact O-N 2.88Å; E147-V205 HydrophobicContact CG-CG1 3.93Å; E147-V209 HydrophobicContact CG-CG2 4.24Å
148V89.1Confident88.8Confident65 Ų6557.2 Ų57.239%0.39430%0.297SS..Hα-helixtrans-65.7-45.8177.6178.30000110.2D145 S150 S151 K152D145-V148 HydrophobicContact CB-CB 4.2Å; D145-V148 HydrophobicContact CB-CG2 4.12Å; D145-V148 PolarHBondContact O-N 3.44Å; D145-V148 WeakPolarHBondContact OD2-CG2 3.47Å; V148-S150 PolarHBondContact O-N 3.09Å; V148-S151 PolarHBondContact O-N 3.01Å; V148-S151 PolarHBondContact O-OG 3.38Å; V148-K152 PolarHBondContact O-N 2.86Å
149I90.4Very high88.8Confident0 Ų053.5 Ų53.50%028%0.28CS..Hα-helixtrans-62.7-44.1177.8-61.1161.3000110.6F141 D145 S151 K152 L153 L183F141-I149 HydrophobicContact CD1-CD1 4.09Å; F141-I149 HydrophobicContact CD1-CG2 4.28Å; F141-I149 HydrophobicContact CD2-CG2 4.24Å; F141-I149 HydrophobicContact CE1-CD1 4.49Å; F141-I149 HydrophobicContact CE1-CG2 3.84Å; F141-I149 HydrophobicContact CE2-CG2 3.77Å; F141-I149 HydrophobicContact CG-CD1 4.45Å; F141-I149 HydrophobicContact CG-CG2 4.47Å; F141-I149 HydrophobicContact CZ-CG2 3.56Å; D145-I149 WeakPolarHBondContact O-CD1 3.38Å; D145-I149 WeakPolarHBondContact O-CG1 3.37Å; D145-I149 PolarHBondContact O-N 3.21Å; I149-S151 PolarHBondContact O-N 3.49Å; I149-K152 PolarHBondContact O-N 3.01Å; I149-L153 HydrophobicContact CG2-CD1 4.07Å; I149-L153 HydrophobicContact CG2-CG 4.31Å; I149-L153 WeakPolarHBondContact O-CG 3.48Å; I149-L153 PolarHBondContact O-N 3.3Å; I149-L183 HydrophobicContact CB-CD1 4.03Å; I149-L183 HydrophobicContact CD1-CD1 4.3Å; I149-L183 HydrophobicContact CG2-CD1 3.75Å; I149-L183 HydrophobicContact CG2-CD2 4.4Å
150S91.5Very high88.7Confident0 Ų047.3 Ų47.30%025%0.251CS..Hα-helixtrans-52.9-49.7174.4-178.20000112.7L146 E147 V148 K152 L153 T154 E212L146-S150 WeakPolarHBondContact O-CB 3.3Å; L146-S150 PolarHBondContact O-N 3.28Å; E147-S150 WeakPolarHBondContact O-CB 3.29Å; E147-S150 PolarHBondContact O-N 2.66Å; V148-S150 PolarHBondContact O-N 3.09Å; S150-K152 VanDerWaalsContact C-N 3.32Å; S150-K152 PolarHBondContact O-N 2.81Å; S150-L153 PolarHBondContact O-N 3.41Å; S150-T154 WeakPolarHBondContact O-CB 3.49Å; S150-T154 PolarHBondContact O-N 3.23Å; S150-T154 PolarHBondContact O-OG1 3.11Å; S150-E212 WeakPolarHBondContact OG-CB 3.34Å; S150-E212 PolarHBondContact OG-OE2 2.72Å
151S90.2Very high88.5Confident67 Ų6749.3 Ų49.347%0.46927%0.271SS..Hα-helixtrans-63.1-38.8-178.473.30000112.3E147 V148 I149 T154 S155E147-S151 PolarHBondContact O-N 2.88Å; V148-S151 PolarHBondContact O-N 3.01Å; V148-S151 PolarHBondContact O-OG 3.38Å; I149-S151 PolarHBondContact O-N 3.49Å; S151-T154 PolarHBondContact O-N 3.32Å; S151-S155 PolarHBondContact O-N 3.27Å
152K89.6Confident88.1Confident43 Ų4354 Ų5419%0.18729%0.294CS..Hα-helixtrans-69-42.5177.6-163.981171.5-174.70110.9L133 D136 I137 V148 I149 S150 T154 S155 M156L133-K152 HydrophobicContact CD2-CD 3.54Å; L133-K152 HydrophobicContact CD2-CG 4.27Å; D136-K152 IonicContact OD2-NZ 3.14Å; D136-K152 PolarHBondContact OD2-NZ 3.34Å; I137-K152 HydrophobicContact CD1-CB 3.95Å; I137-K152 HydrophobicContact CD1-CG 3.64Å; V148-K152 PolarHBondContact O-N 2.86Å; I149-K152 PolarHBondContact O-N 3.01Å; S150-K152 VanDerWaalsContact C-N 3.32Å; S150-K152 PolarHBondContact O-N 2.81Å; K152-T154 VanDerWaalsContact C-N 3.35Å; K152-T154 PolarHBondContact O-N 3.23Å; K152-S155 WeakPolarHBondContact O-CB 3.5Å; K152-S155 PolarHBondContact O-N 3.27Å; K152-M156 WeakPolarHBondContact O-CG 3.15Å; K152-M156 PolarHBondContact O-N 3.44Å
153L90.7Very high87.8Confident0 Ų046.4 Ų46.40%026%0.261CS..Hα-helixtrans-63.6-38.6174.7-69.6177000112.5I137 I149 S150 S155 M156 Q157 L176 L179 K180 L183 I213I137-L153 HydrophobicContact CD1-CD2 3.9Å; I137-L153 HydrophobicContact CD1-CG 4.3Å; I137-L153 HydrophobicContact CG1-CD2 4.36Å; I149-L153 HydrophobicContact CG2-CD1 4.07Å; I149-L153 HydrophobicContact CG2-CG 4.31Å; I149-L153 WeakPolarHBondContact O-CG 3.48Å; I149-L153 PolarHBondContact O-N 3.3Å; S150-L153 PolarHBondContact O-N 3.41Å; L153-S155 VanDerWaalsContact C-N 3.35Å; L153-M156 CarbonylContact O-C 3.57Å; L153-M156 WeakPolarHBondContact O-CB 3.3Å; L153-M156 PolarHBondContact O-N 2.61Å; L153-Q157 PolarHBondContact O-N 2.96Å; L153-Q157 PolarHBondContact O-OE1 2.86Å; L153-L176 HydrophobicContact CD2-CD1 4.34Å; L153-L179 HydrophobicContact CD2-CB 3.7Å; L153-L179 HydrophobicContact CD2-CD1 4.21Å; L153-K180 HydrophobicContact CD1-CG 4.48Å; L153-L183 HydrophobicContact CD1-CB 4.23Å; L153-L183 HydrophobicContact CD1-CD2 3.73Å; L153-I213 HydrophobicContact CB-CG2 4.36Å; L153-I213 HydrophobicContact CD1-CG2 4.27Å
154T90.2Very high87.4Confident31 Ų3146 Ų4619%0.1926%0.258CS..Hα-helixtrans-65.2-40.4176-52.10000111.1S150 S151 K152 M156 Q157 N158S150-T154 WeakPolarHBondContact O-CB 3.49Å; S150-T154 PolarHBondContact O-N 3.23Å; S150-T154 PolarHBondContact O-OG1 3.11Å; S151-T154 PolarHBondContact O-N 3.32Å; K152-T154 VanDerWaalsContact C-N 3.35Å; K152-T154 PolarHBondContact O-N 3.23Å; T154-M156 VanDerWaalsContact C-N 3.32Å; T154-M156 PolarHBondContact O-N 3.1Å; T154-Q157 WeakPolarHBondContact O-CB 3.4Å; T154-Q157 PolarHBondContact O-N 3.08Å; T154-N158 VanDerWaalsContact O-CG 3.3Å; T154-N158 PolarHBondContact O-N 2.71Å; T154-N158 PolarHBondContact O-ND2 3.3Å
155S88.6Confident87Confident49 Ų4947.1 Ų47.134%0.34327%0.269SS..Hα-helixtrans-61.6-41.1172.7-168.80000111.9L133 S151 K152 L153 N158 S159L133-S155 WeakPolarHBondContact CD1-OG 2.98Å; S151-S155 PolarHBondContact O-N 3.27Å; K152-S155 WeakPolarHBondContact O-CB 3.5Å; K152-S155 PolarHBondContact O-N 3.27Å; L153-S155 VanDerWaalsContact C-N 3.35Å; S155-N158 PolarHBondContact O-N 3.38Å; S155-S159 PolarHBondContact O-N 2.82Å; S155-S159 PolarHBondContact O-OG 3.27Å
156M89.3Confident86.5Confident0 Ų045.5 Ų45.50%026%0.261CS..Hα-helixtrans-63.4-41.9173.5-71-178.774.700111.9W130 L133 I137 K152 L153 T154 N158 S159 L160 L176 L179W130-M156 HydrophobicContact CD2-CE 4.38Å; W130-M156 HydrophobicContact CE3-CB 4.1Å; W130-M156 HydrophobicContact CE3-CE 4.18Å; W130-M156 HydrophobicContact CE3-CG 4.48Å; W130-M156 HydrophobicContact CH2-CE 3.68Å; W130-M156 HydrophobicContact CZ2-CE 3.87Å; W130-M156 HydrophobicContact CZ3-CB 3.74Å; W130-M156 HydrophobicContact CZ3-CE 3.84Å; W130-M156 HydrophobicContact CZ3-CG 4.41Å; W130-M156 WeakPolarHBondContact CZ3-O 3.29Å; L133-M156 HydrophobicContact CB-CG 3.52Å; L133-M156 HydrophobicContact CB-SD 4.16Å; L133-M156 HydrophobicContact CD1-CB 4.48Å; L133-M156 HydrophobicContact CD1-CG 3.77Å; L133-M156 HydrophobicContact CG-CG 4.22Å; I137-M156 HydrophobicContact CB-SD 4.32Å; I137-M156 HydrophobicContact CD1-SD 4.05Å; I137-M156 HydrophobicContact CG1-SD 4.19Å; K152-M156 WeakPolarHBondContact O-CG 3.15Å; K152-M156 PolarHBondContact O-N 3.44Å; L153-M156 CarbonylContact O-C 3.57Å; L153-M156 WeakPolarHBondContact O-CB 3.3Å; L153-M156 PolarHBondContact O-N 2.61Å; T154-M156 VanDerWaalsContact C-N 3.32Å; T154-M156 PolarHBondContact O-N 3.1Å; M156-N158 PolarHBondContact O-N 3.34Å; M156-S159 PolarHBondContact O-N 3.08Å; M156-L160 WeakPolarHBondContact O-CB 3.49Å; M156-L160 PolarHBondContact O-N 3.37Å; M156-L176 HydrophobicContact CB-CD1 3.91Å; M156-L179 HydrophobicContact CE-CD1 4Å; M156-L179 HydrophobicContact SD-CD1 4.3Å
157Q89.4Confident85.8Confident33 Ų3350.3 Ų50.315%0.15429%0.294CS..Hα-helixtrans-57.5-47.6174-81.3168.9-90.800112.2L153 T154 L160 A161 L176L153-Q157 PolarHBondContact O-N 2.96Å; L153-Q157 PolarHBondContact O-OE1 2.86Å; T154-Q157 WeakPolarHBondContact O-CB 3.4Å; T154-Q157 PolarHBondContact O-N 3.08Å; Q157-L160 PolarHBondContact O-N 2.87Å; Q157-A161 PolarHBondContact O-N 3.32Å; Q157-L176 HydrophobicContact CB-CD2 4.47Å; Q157-L176 HydrophobicContact CG-CD1 4.33Å; Q157-L176 HydrophobicContact CG-CD2 3.61Å; Q157-L176 HydrophobicContact CG-CG 4.38Å
158N87.7Confident85.6Confident107 Ų10750.8 Ų50.857%0.57230%0.299SS*.Hα-helixtrans-65.3-40.9179.6-66.6-19.6000111.7T154 S155 M156 L160 A161T154-N158 VanDerWaalsContact O-CG 3.3Å; T154-N158 PolarHBondContact O-N 2.71Å; T154-N158 PolarHBondContact O-ND2 3.3Å; S155-N158 PolarHBondContact O-N 3.38Å; M156-N158 PolarHBondContact O-N 3.34Å; N158-L160 VanDerWaalsContact C-N 3.33Å; N158-L160 PolarHBondContact O-N 3.38Å; N158-A161 PolarHBondContact O-N 3.41Å
159S87.6Confident85.3Confident2 Ų251.3 Ų51.31%0.01429%0.294CS..Hα-helixtrans-62.9-41.9175.7-51.40000110.7E126 S155 M156 A161 M162 L163E126-S159 PolarHBondContact OE2-OG 3.48Å; S155-S159 PolarHBondContact O-N 2.82Å; S155-S159 PolarHBondContact O-OG 3.27Å; M156-S159 PolarHBondContact O-N 3.08Å; S159-A161 PolarHBondContact O-N 2.89Å; S159-M162 PolarHBondContact O-N 2.85Å; S159-L163 WeakPolarHBondContact O-CD1 3.41Å; S159-L163 VanDerWaalsContact O-CG 3.28Å; S159-L163 WeakPolarHBondContact O-CG 3.31Å
160L85.4Confident85.1Confident9 Ų955 Ų555%0.04732%0.321CS..Hα-helixtrans-66.4-35.4179.2-17163.9000112.6W130 M156 Q157 N158 M162 L163 Y169 K172 L176W130-L160 HydrophobicContact CE3-CB 4.17Å; W130-L160 HydrophobicContact CH2-CD1 4.35Å; W130-L160 HydrophobicContact CH2-CD2 4.34Å; W130-L160 HydrophobicContact CZ3-CB 3.81Å; W130-L160 HydrophobicContact CZ3-CD1 4.2Å; W130-L160 HydrophobicContact CZ3-CD2 4.25Å; W130-L160 HydrophobicContact CZ3-CG 4.32Å; M156-L160 WeakPolarHBondContact O-CB 3.49Å; M156-L160 PolarHBondContact O-N 3.37Å; Q157-L160 PolarHBondContact O-N 2.87Å; N158-L160 VanDerWaalsContact C-N 3.33Å; N158-L160 PolarHBondContact O-N 3.38Å; L160-M162 PolarHBondContact O-N 2.94Å; L160-L163 PolarHBondContact O-N 3.23Å; L160-Y169 HydrophobicContact CD1-CD2 3.83Å; L160-Y169 HydrophobicContact CD1-CE2 3.83Å; L160-Y169 HydrophobicContact CG-CD2 4.36Å; L160-Y169 HydrophobicContact CG-CE2 3.83Å; L160-Y169 WeakPolarHBondContact O-CE2 3.48Å; L160-K172 HydrophobicContact CD1-CB 3.55Å; L160-K172 HydrophobicContact CD1-CD 4.18Å; L160-L176 HydrophobicContact CD2-CB 4.4Å; L160-L176 HydrophobicContact CD2-CD2 3.56Å
161A83.8Confident84.9Confident67 Ų6761.6 Ų61.655%0.55435%0.351SS*.Hα-helixtrans-61.2-25.417800000113.4Q157 N158 S159 V164Q157-A161 PolarHBondContact O-N 3.32Å; N158-A161 PolarHBondContact O-N 3.41Å; S159-A161 PolarHBondContact O-N 2.89Å; A161-V164 WeakPolarHBondContact O-CG2 3.3Å
162M80.8Confident84.7Confident102 Ų10260.2 Ų60.250%0.50234%0.337SS..THydrogen-bonded Turntrans-89.6-7176.1-66-67.1-71.500113.4E126 S159 L160E126-M162 HydrophobicContact CB-CB 4.2Å; E126-M162 HydrophobicContact CG-CB 3.9Å; E126-M162 HydrophobicContact CG-CG 4.16Å; S159-M162 PolarHBondContact O-N 2.85Å; L160-M162 PolarHBondContact O-N 2.94Å
163L82.3Confident84.6Confident4 Ų460 Ų602%0.02134%0.34CS..  trans-108.520.6-172.6-65.7172.3000113.7A123 E126 A127 W130 S159 L160 D165 T166 Y169A123-L163 WeakPolarHBondContact O-CD2 3.31Å; E126-L163 HydrophobicContact CB-CD2 4.39Å; E126-L163 HydrophobicContact CB-CG 4.39Å; A127-L163 HydrophobicContact CB-CD1 4.49Å; A127-L163 HydrophobicContact CB-CD2 3.87Å; W130-L163 HydrophobicContact CB-CD1 4.09Å; S159-L163 WeakPolarHBondContact O-CD1 3.41Å; S159-L163 VanDerWaalsContact O-CG 3.28Å; S159-L163 WeakPolarHBondContact O-CG 3.31Å; L160-L163 PolarHBondContact O-N 3.23Å; L163-D165 PolarHBondContact O-N 2.77Å; L163-T166 HydrophobicContact CB-CG2 4.33Å; L163-T166 HydrophobicContact CD2-CG2 4.17Å; L163-T166 PolarHBondContact O-N 3.42Å; L163-T166 VanDerWaalsContact O-N 3.1Å; L163-T166 PolarHBondContact O-OG1 3.17Å; L163-Y169 WeakPolarHBondContact O-CD2 3.23Å
164V78.5Confident84.6Confident78 Ų7864.9 Ų64.947%0.47337%0.37SS..THydrogen-bonded Turntrans-57.2-35.5-174.9-177.80000112.6A161 T166 Y169A161-V164 WeakPolarHBondContact O-CG2 3.3Å; V164-T166 PolarHBondContact O-N 3.45Å; V164-Y169 HydrophobicContact CB-CE2 4.35Å; V164-Y169 HydrophobicContact CG2-CE2 4Å
165D76.4Confident84.6Confident165 Ų16566.9 Ų66.988%0.88238%0.377SS*.THydrogen-bonded Turntrans-82.66.6-177.1-62.3-38000113.9L163L163-D165 PolarHBondContact O-N 2.77Å
166T77.8Confident84.6Confident40 Ų4065 Ų6525%0.24536%0.363CS..SBendtrans-83.5139.9177.259.60000111.9L163 V164 D168 Y169L163-T166 HydrophobicContact CB-CG2 4.33Å; L163-T166 HydrophobicContact CD2-CG2 4.17Å; L163-T166 PolarHBondContact O-N 3.42Å; L163-T166 VanDerWaalsContact O-N 3.1Å; L163-T166 PolarHBondContact O-OG1 3.17Å; V164-T166 PolarHBondContact O-N 3.45Å; T166-D168 PolarHBondContact O-N 2.9Å; T166-Y169 WeakPolarHBondContact O-CB 3.4Å; T166-Y169 PolarHBondContact O-N 3.01Å; T166-Y169 VanDerWaalsContact O-N 3.07Å
167P74.8Confident84.7Confident118 Ų11868.8 Ų68.877%0.76638%0.38SS*.THydrogen-bonded Turntrans-60.1-32.3-177.923.4-33.4000112.8Y169P167-Y169 VanDerWaalsContact C-N 3.29Å; P167-Y169 PolarHBondContact O-N 3.31Å
168D82.8Confident84.8Confident87 Ų8769.7 Ų69.747%0.46539%0.394SS..THydrogen-bonded Turntrans-90.311.1-177.9-48.5-18000112.6T166 S170 E171 K172T166-D168 PolarHBondContact O-N 2.9Å; D168-S170 VanDerWaalsContact C-N 3.26Å; D168-S170 PolarHBondContact O-N 2.96Å; D168-E171 PolarHBondContact O-N 2.96Å; D168-K172 WeakPolarHBondContact O-CG 3.49Å; D168-K172 PolarHBondContact O-N 3.29Å; D168-K172 VanDerWaalsContact O-N 3.11Å
169Y84.3Confident85Confident75 Ų7564.9 Ų64.929%0.29437%0.368SS..Hα-helixtrans-55-42.2-177.5177.3-104.9000112.2L160 L163 V164 T166 P167 E171 K172 C173L160-Y169 HydrophobicContact CD1-CD2 3.83Å; L160-Y169 HydrophobicContact CD1-CE2 3.83Å; L160-Y169 HydrophobicContact CG-CD2 4.36Å; L160-Y169 HydrophobicContact CG-CE2 3.83Å; L160-Y169 WeakPolarHBondContact O-CE2 3.48Å; L163-Y169 WeakPolarHBondContact O-CD2 3.23Å; V164-Y169 HydrophobicContact CB-CE2 4.35Å; V164-Y169 HydrophobicContact CG2-CE2 4Å; T166-Y169 WeakPolarHBondContact O-CB 3.4Å; T166-Y169 PolarHBondContact O-N 3.01Å; T166-Y169 VanDerWaalsContact O-N 3.07Å; P167-Y169 VanDerWaalsContact C-N 3.29Å; P167-Y169 PolarHBondContact O-N 3.31Å; Y169-E171 PolarHBondContact O-N 3.31Å; Y169-K172 PolarHBondContact O-N 3.44Å; Y169-C173 VanDerWaalsContact CE1-SG 3.54Å; Y169-C173 VanDerWaalsContact CZ-SG 3.51Å; Y169-C173 PolarHBondContact O-N 2.82Å; Y169-C173 PolarHBondContact O-SG 2.93Å
170S85Confident85.2Confident79 Ų7965.3 Ų65.355%0.55237%0.37SS*.Hα-helixtrans-60.9-41.9179.265.40000112.9D168 C173 V174D168-S170 VanDerWaalsContact C-N 3.26Å; D168-S170 PolarHBondContact O-N 2.96Å; S170-C173 WeakPolarHBondContact O-CB 3.32Å; S170-C173 PolarHBondContact O-N 2.89Å; S170-V174 WeakPolarHBondContact O-CG2 3.49Å; S170-V174 PolarHBondContact O-N 3.18Å; S170-V174 VanDerWaalsContact O-N 3.12Å
171E87.1Confident85.6Confident137 Ų13768.9 Ų68.964%0.6439%0.389SS*.Hα-helixtrans-67.8-40.3177.9-61.5-173.5174.900111.4D168 Y169 C173 V174 H175D168-E171 PolarHBondContact O-N 2.96Å; Y169-E171 PolarHBondContact O-N 3.31Å; E171-C173 PolarHBondContact O-N 2.99Å; E171-V174 PolarHBondContact O-N 2.98Å; E171-H175 WeakPolarHBondContact O-CB 3.39Å; E171-H175 PolarHBondContact O-N 2.93Å
172K86.4Confident86Confident38 Ų3870.5 Ų70.517%0.16538%0.38CS..Hα-helixtrans-63.7-39.6175.7-67.4176.2-175.5170.10112.3W130 L160 D168 Y169 H175 L176W130-K172 HydrophobicContact CH2-CB 4.2Å; W130-K172 HydrophobicContact CZ2-CB 3.7Å; W130-K172 HydrophobicContact CZ2-CG 3.99Å; L160-K172 HydrophobicContact CD1-CB 3.55Å; L160-K172 HydrophobicContact CD1-CD 4.18Å; D168-K172 WeakPolarHBondContact O-CG 3.49Å; D168-K172 PolarHBondContact O-N 3.29Å; D168-K172 VanDerWaalsContact O-N 3.11Å; Y169-K172 PolarHBondContact O-N 3.44Å; K172-H175 PolarHBondContact O-N 3.41Å; K172-L176 WeakPolarHBondContact O-CB 3.31Å; K172-L176 PolarHBondContact O-N 3.42Å
173C88Confident86.5Confident38 Ų3865.7 Ų65.726%0.25736%0.357SS..Hα-helixtrans-60-48.1172.6-70.90000111.6Y169 S170 E171 H175 L176 E177Y169-C173 VanDerWaalsContact CE1-SG 3.54Å; Y169-C173 VanDerWaalsContact CZ-SG 3.51Å; Y169-C173 PolarHBondContact O-N 2.82Å; Y169-C173 PolarHBondContact O-SG 2.93Å; S170-C173 WeakPolarHBondContact O-CB 3.32Å; S170-C173 PolarHBondContact O-N 2.89Å; E171-C173 PolarHBondContact O-N 2.99Å; C173-H175 VanDerWaalsContact C-N 3.32Å; C173-H175 PolarHBondContact O-N 3.43Å; C173-L176 PolarHBondContact O-N 3.34Å; C173-E177 WeakPolarHBondContact O-CB 3.32Å; C173-E177 PolarHBondContact O-N 3.18Å
174V90.8Very high87Confident104 Ų10466.8 Ų66.863%0.6336%0.362SS*.Hα-helixtrans-61.4-42.3177.9172.80000111.1S170 E171 E177 A178S170-V174 WeakPolarHBondContact O-CG2 3.49Å; S170-V174 PolarHBondContact O-N 3.18Å; S170-V174 VanDerWaalsContact O-N 3.12Å; E171-V174 PolarHBondContact O-N 2.98Å; V174-E177 PolarHBondContact O-N 2.96Å; V174-A178 WeakPolarHBondContact O-CB 3.36Å; V174-A178 PolarHBondContact O-N 3.47Å
175H89.3Confident87.6Confident73 Ų7366.2 Ų66.234%0.33837%0.365SS..Hα-helixtrans-62.5-46.5177.7-17463.3000112.1E171 K172 C173 E177 A178 L179E171-H175 WeakPolarHBondContact O-CB 3.39Å; E171-H175 PolarHBondContact O-N 2.93Å; K172-H175 PolarHBondContact O-N 3.41Å; C173-H175 VanDerWaalsContact C-N 3.32Å; C173-H175 PolarHBondContact O-N 3.43Å; H175-E177 VanDerWaalsContact C-N 3.31Å; H175-E177 PolarHBondContact O-N 3.01Å; H175-A178 WeakPolarHBondContact O-CB 3.47Å; H175-A178 PolarHBondContact O-N 2.9Å; H175-L179 WeakPolarHBondContact O-CG 3.31Å; H175-L179 PolarHBondContact O-N 3.45Å
176L89.6Confident88.2Confident8 Ų861.4 Ų61.44%0.04234%0.338CS..Hα-helixtrans-58.4-44.7175.5-17462.2000111.8W130 L153 M156 Q157 L160 K172 C173 A178 L179 K180W130-L176 HydrophobicContact CH2-CB 4.09Å; W130-L176 HydrophobicContact CH2-CD1 4.47Å; L153-L176 HydrophobicContact CD2-CD1 4.34Å; M156-L176 HydrophobicContact CB-CD1 3.91Å; Q157-L176 HydrophobicContact CB-CD2 4.47Å; Q157-L176 HydrophobicContact CG-CD1 4.33Å; Q157-L176 HydrophobicContact CG-CD2 3.61Å; Q157-L176 HydrophobicContact CG-CG 4.38Å; L160-L176 HydrophobicContact CD2-CB 4.4Å; L160-L176 HydrophobicContact CD2-CD2 3.56Å; K172-L176 WeakPolarHBondContact O-CB 3.31Å; K172-L176 PolarHBondContact O-N 3.42Å; C173-L176 PolarHBondContact O-N 3.34Å; L176-A178 VanDerWaalsContact C-N 3.31Å; L176-A178 PolarHBondContact O-N 3.02Å; L176-L179 PolarHBondContact O-N 3.02Å; L176-K180 WeakPolarHBondContact O-CG 3.31Å; L176-K180 PolarHBondContact O-N 3.4Å
177E90.8Very high88.9Confident80 Ų8059.5 Ų59.537%0.37433%0.327SS..Hα-helixtrans-66.6-35.7-178.7-151.359.3-150.100111.5C173 V174 H175 K180 N181 R215C173-E177 WeakPolarHBondContact O-CB 3.32Å; C173-E177 PolarHBondContact O-N 3.18Å; V174-E177 PolarHBondContact O-N 2.96Å; H175-E177 VanDerWaalsContact C-N 3.31Å; H175-E177 PolarHBondContact O-N 3.01Å; E177-K180 PolarHBondContact O-N 3Å; E177-N181 WeakPolarHBondContact O-CB 3.39Å; E177-N181 VanDerWaalsContact O-CG 3.24Å; E177-N181 PolarHBondContact O-N 2.92Å; E177-N181 PolarHBondContact O-ND2 3.13Å; E177-N181 VanDerWaalsContact O-ND2 3.14Å; E177-R215 PolarHBondContact O-NH2 2.97Å; E177-R215 IonicContact OE1-CZ 3.56Å; E177-R215 IonicContact OE1-NE 3.19Å; E177-R215 IonicContact OE1-NH2 2.97Å; E177-R215 PolarHBondContact OE1-NH2 3.49Å
178A92.4Very high89.8Confident52 Ų5254.9 Ų54.943%0.4330%0.297SS..Hα-helixtrans-63.9-41.2172.200000112.2V174 H175 L176 N181 R182V174-A178 WeakPolarHBondContact O-CB 3.36Å; V174-A178 PolarHBondContact O-N 3.47Å; H175-A178 WeakPolarHBondContact O-CB 3.47Å; H175-A178 PolarHBondContact O-N 2.9Å; L176-A178 VanDerWaalsContact C-N 3.31Å; L176-A178 PolarHBondContact O-N 3.02Å; A178-N181 WeakPolarHBondContact O-CB 3.38Å; A178-N181 PolarHBondContact O-N 3.19Å; A178-R182 PolarHBondContact O-N 3.04Å
179L91.8Very high90.2Very high6 Ų655.1 Ų55.13%0.03130%0.303CS..Hα-helixtrans-65.8-41.7175.6-66.7167.8000111.7I137 F141 L153 M156 H175 L176 R182 L183I137-L179 HydrophobicContact CG1-CD1 4.09Å; I137-L179 HydrophobicContact CG1-CD2 4.25Å; I137-L179 HydrophobicContact CG2-CD1 4.12Å; I137-L179 HydrophobicContact CG2-CD2 4.13Å; F141-L179 HydrophobicContact CD2-CD2 4.46Å; F141-L179 HydrophobicContact CE2-CB 4.39Å; F141-L179 HydrophobicContact CE2-CD2 3.87Å; F141-L179 HydrophobicContact CZ-CB 4.5Å; F141-L179 WeakPolarHBondContact CZ-O 3.23Å; L153-L179 HydrophobicContact CD2-CB 3.7Å; L153-L179 HydrophobicContact CD2-CD1 4.21Å; M156-L179 HydrophobicContact CE-CD1 4Å; M156-L179 HydrophobicContact SD-CD1 4.3Å; H175-L179 WeakPolarHBondContact O-CG 3.31Å; H175-L179 PolarHBondContact O-N 3.45Å; L176-L179 PolarHBondContact O-N 3.02Å; L179-R182 WeakPolarHBondContact O-CB 3.37Å; L179-R182 PolarHBondContact O-N 2.83Å; L179-L183 PolarHBondContact O-N 3.49Å
180K91.9Very high90.6Very high12 Ų1256.2 Ų56.25%0.05231%0.311CS..Hα-helixtrans-60.9-44.2172.8-69.3-178.7179.5-170.50112.2L153 L176 E177 R182 L183 E184 I213L153-K180 HydrophobicContact CD1-CG 4.48Å; L176-K180 WeakPolarHBondContact O-CG 3.31Å; L176-K180 PolarHBondContact O-N 3.4Å; E177-K180 PolarHBondContact O-N 3Å; K180-R182 VanDerWaalsContact C-N 3.29Å; K180-R182 PolarHBondContact O-N 3.23Å; K180-L183 PolarHBondContact O-N 2.83Å; K180-E184 PolarHBondContact O-N 2.77Å; K180-I213 VanDerWaalsContact CE-O 3.27Å; K180-I213 WeakPolarHBondContact CE-O 3.48Å; K180-I213 PolarHBondContact NZ-O 3.38Å
181N93.2Very high90.9Very high83 Ų8352.4 Ų52.444%0.44429%0.285SS..Hα-helixtrans-58.7-40.4174.3-75.4-33.7000112E177 A178 E184 A185 R215E177-N181 WeakPolarHBondContact O-CB 3.39Å; E177-N181 VanDerWaalsContact O-CG 3.24Å; E177-N181 PolarHBondContact O-N 2.92Å; E177-N181 PolarHBondContact O-ND2 3.13Å; E177-N181 VanDerWaalsContact O-ND2 3.14Å; A178-N181 WeakPolarHBondContact O-CB 3.38Å; A178-N181 PolarHBondContact O-N 3.19Å; N181-E184 PolarHBondContact O-N 3.38Å; N181-A185 WeakPolarHBondContact O-CB 3.39Å; N181-A185 PolarHBondContact O-N 2.94Å; N181-R215 PolarHBondContact OD1-NH1 3.18Å; N181-R215 PolarHBondContact OD1-NH2 2.65Å
182R92.2Very high91.2Very high102 Ų10248.5 Ų48.539%0.38527%0.27SS..Hα-helixtrans-65.6-42.6177.5-174176.5175.4-173.3-6.3111.8E138 F141 A178 L179 K180 A185 M186E138-R182 VanDerWaalsContact CD-NH1 3.28Å; E138-R182 IonicContact OE1-NH1 3.35Å; E138-R182 PolarHBondContact OE1-NH1 3.05Å; E138-R182 IonicContact OE2-CZ 2.67Å; E138-R182 IonicContact OE2-NH1 2.71Å; E138-R182 PolarHBondContact OE2-NH1 3.47Å; E138-R182 IonicContact OE2-NH2 3.42Å; E138-R182 PolarHBondContact OE2-NH2 3.48Å; F141-R182 HydrophobicContact CD1-CG 4.33Å; F141-R182 HydrophobicContact CE1-CB 4.25Å; F141-R182 HydrophobicContact CE1-CG 4Å; F141-R182 HydrophobicContact CZ-CB 4.49Å; A178-R182 PolarHBondContact O-N 3.04Å; L179-R182 WeakPolarHBondContact O-CB 3.37Å; L179-R182 PolarHBondContact O-N 2.83Å; K180-R182 VanDerWaalsContact C-N 3.29Å; K180-R182 PolarHBondContact O-N 3.23Å; R182-A185 PolarHBondContact O-N 2.82Å; R182-M186 WeakPolarHBondContact O-CG 3.38Å; R182-M186 PolarHBondContact O-N 3.19Å
183L91.4Very high91.5Very high0 Ų049.4 Ų49.40%028%0.284CS..Hα-helixtrans-60.8-46.2173.9-179.367.6000111.3F141 L146 I149 L153 L179 K180 A185 M186 A187 V209 I213F141-L183 HydrophobicContact CE1-CB 4.11Å; F141-L183 HydrophobicContact CZ-CB 4.2Å; L146-L183 HydrophobicContact CD2-CD1 3.46Å; L146-L183 VanDerWaalsContact CD2-CD1 3.46Å; I149-L183 HydrophobicContact CB-CD1 4.03Å; I149-L183 HydrophobicContact CD1-CD1 4.3Å; I149-L183 HydrophobicContact CG2-CD1 3.75Å; I149-L183 HydrophobicContact CG2-CD2 4.4Å; L153-L183 HydrophobicContact CD1-CB 4.23Å; L153-L183 HydrophobicContact CD1-CD2 3.73Å; L179-L183 PolarHBondContact O-N 3.49Å; K180-L183 PolarHBondContact O-N 2.83Å; L183-A185 PolarHBondContact O-N 2.96Å; L183-M186 PolarHBondContact O-N 2.64Å; L183-A187 WeakPolarHBondContact O-CB 3.34Å; L183-A187 PolarHBondContact O-N 3.18Å; L183-V209 HydrophobicContact CD2-CG1 4.15Å; L183-I213 HydrophobicContact CD2-CD1 3.98Å; L183-I213 HydrophobicContact CD2-CG2 4.07Å
184E92.7Very high91.7Very high28 Ų2848.2 Ų48.213%0.13128%0.276CS..Hα-helixtrans-59.4-45.7177-178-178.2155.300111.9K180 N181 M186 A187 S188 F210 R215 Y222K180-E184 PolarHBondContact O-N 2.77Å; N181-E184 PolarHBondContact O-N 3.38Å; E184-M186 VanDerWaalsContact C-N 3.32Å; E184-M186 PolarHBondContact O-N 3.39Å; E184-A187 PolarHBondContact O-N 2.87Å; E184-S188 PolarHBondContact O-N 3.49Å; E184-S188 PolarHBondContact O-OG 3.1Å; E184-F210 HydrophobicContact CB-CE1 4.41Å; E184-F210 HydrophobicContact CB-CZ 4.39Å; E184-F210 HydrophobicContact CG-CE1 4.06Å; E184-F210 HydrophobicContact CG-CZ 4.2Å; E184-R215 IonicContact OE2-CZ 2.79Å; E184-R215 IonicContact OE2-NH1 3.35Å; E184-R215 PolarHBondContact OE2-NH1 3.35Å; E184-Y222 HydrophobicContact CG-CE2 4.25Å; E184-Y222 PolarHBondContact OE1-OH 3.49Å
185A91.5Very high91.8Very high66 Ų6643.2 Ų43.255%0.54525%0.246SC..Hα-helixtrans-62.2-38.9178.200000112.2N181 R182 L183N181-A185 WeakPolarHBondContact O-CB 3.39Å; N181-A185 PolarHBondContact O-N 2.94Å; R182-A185 PolarHBondContact O-N 2.82Å; L183-A185 PolarHBondContact O-N 2.96Å
186M89.6Confident91.9Very high63 Ų6343.4 Ų43.431%0.3125%0.249SC..Hα-helixtrans-67-38.8174.9-73.9178.559.600112.5F141 Q144 R182 L183 E184F141-M186 HydrophobicContact CD1-SD 3.69Å; F141-M186 HydrophobicContact CE1-SD 4.12Å; Q144-M186 HydrophobicContact CB-CE 4.4Å; Q144-M186 HydrophobicContact CG-CE 4.09Å; R182-M186 WeakPolarHBondContact O-CG 3.38Å; R182-M186 PolarHBondContact O-N 3.19Å; L183-M186 PolarHBondContact O-N 2.64Å; E184-M186 VanDerWaalsContact C-N 3.32Å; E184-M186 PolarHBondContact O-N 3.39Å
187A91.8Very high91.9Very high1 Ų146.9 Ų46.91%0.00827%0.274CS..Hα-helixtrans-77.5-25.2-179.500000113.3L146 L183 E184 Q190 I191 F206 F210L146-A187 HydrophobicContact CD1-CB 4.04Å; L146-A187 HydrophobicContact CD2-CB 4.22Å; L183-A187 WeakPolarHBondContact O-CB 3.34Å; L183-A187 PolarHBondContact O-N 3.18Å; E184-A187 PolarHBondContact O-N 2.87Å; A187-Q190 PolarHBondContact O-N 3.12Å; A187-I191 HydrophobicContact CB-CD1 3.67Å; A187-I191 HydrophobicContact CB-CG1 4.17Å; A187-I191 VanDerWaalsContact O-CG1 3.3Å; A187-I191 WeakPolarHBondContact O-CG1 3.31Å; A187-I191 PolarHBondContact O-N 2.76Å; A187-F206 HydrophobicContact CB-CE1 4.07Å; A187-F210 HydrophobicContact CB-CE2 4.23Å; A187-F210 HydrophobicContact CB-CZ 4.34Å
188S92.6Very high91.9Very high20 Ų2045.9 Ų45.914%0.1427%0.27CS..Hα-helixtrans-50-48.5-171.1-67.60000115.2E184 Q190 I191 V192 Y222E184-S188 PolarHBondContact O-N 3.49Å; E184-S188 PolarHBondContact O-OG 3.1Å; S188-Q190 VanDerWaalsContact C-N 3.34Å; S188-Q190 PolarHBondContact O-N 3.24Å; S188-I191 PolarHBondContact O-N 3.02Å; S188-V192 WeakPolarHBondContact O-CG2 3.45Å; S188-V192 PolarHBondContact O-N 2.92Å; S188-Y222 PolarHBondContact OG-OH 3.43Å; S188-Y222 VanDerWaalsContact OG-OH 3.1Å
189P92.4Very high91.9Very high92 Ų9245.6 Ų45.660%0.59727%0.265SS*.Hα-helixtrans-64.6-37.7178.9-20.133.4000112.8A193P189-A193 WeakPolarHBondContact O-CB 3.2Å; P189-A193 PolarHBondContact O-N 2.99Å
190Q91.3Very high91.8Very high98 Ų9847.8 Ų47.846%0.45828%0.276SS..Hα-helixtrans-72.1-37.2179.1-59-174.414.100111.6A187 S188 A193 T194 F206A187-Q190 PolarHBondContact O-N 3.12Å; S188-Q190 VanDerWaalsContact C-N 3.34Å; S188-Q190 PolarHBondContact O-N 3.24Å; Q190-A193 PolarHBondContact O-N 2.8Å; Q190-T194 VanDerWaalsContact O-CB 3.24Å; Q190-T194 WeakPolarHBondContact O-CB 3.24Å; Q190-T194 PolarHBondContact O-N 2.7Å; Q190-T194 PolarHBondContact O-OG1 3.46Å; Q190-F206 HydrophobicContact CB-CE1 4.49Å; Q190-F206 HydrophobicContact CB-CE2 4.5Å; Q190-F206 HydrophobicContact CB-CZ 3.7Å
191I93Very high91.7Very high0 Ų049.5 Ų49.50%030%0.298CS..Hα-helixtrans-61.1-49.7173.7-68.4167.4000110.2A187 S188 A193 T194 F195 F206 F210 L219 Y222A187-I191 HydrophobicContact CB-CD1 3.67Å; A187-I191 HydrophobicContact CB-CG1 4.17Å; A187-I191 VanDerWaalsContact O-CG1 3.3Å; A187-I191 WeakPolarHBondContact O-CG1 3.31Å; A187-I191 PolarHBondContact O-N 2.76Å; S188-I191 PolarHBondContact O-N 3.02Å; I191-A193 PolarHBondContact O-N 3.03Å; I191-T194 WeakPolarHBondContact O-CB 3.13Å; I191-T194 PolarHBondContact O-N 2.94Å; I191-T194 VanDerWaalsContact O-N 3.16Å; I191-F195 HydrophobicContact CG2-CD2 3.59Å; I191-F195 HydrophobicContact CG2-CE2 3.33Å; I191-F195 HydrophobicContact CG2-CZ 4.29Å; I191-F195 PolarHBondContact O-N 2.94Å; I191-F206 HydrophobicContact CD1-CD1 4.18Å; I191-F206 HydrophobicContact CD1-CE1 4.43Å; I191-F206 HydrophobicContact CG1-CD1 3.58Å; I191-F206 HydrophobicContact CG1-CD2 4.2Å; I191-F206 HydrophobicContact CG1-CE1 3.66Å; I191-F206 HydrophobicContact CG1-CE2 4.3Å; I191-F206 HydrophobicContact CG1-CG 3.88Å; I191-F206 HydrophobicContact CG1-CZ 4.05Å; I191-F210 HydrophobicContact CD1-CE1 4.45Å; I191-F210 HydrophobicContact CD1-CE2 3.62Å; I191-F210 HydrophobicContact CD1-CZ 3.5Å; I191-F210 VanDerWaalsContact CD1-CZ 3.5Å; I191-L219 HydrophobicContact CD1-CD1 4.04Å; I191-L219 HydrophobicContact CG1-CD1 4.27Å; I191-L219 HydrophobicContact CG2-CD1 3.84Å; I191-Y222 HydrophobicContact CG2-CD2 4.42Å; I191-Y222 HydrophobicContact CG2-CG 4.07Å
192V93.4Very high91.6Very high54 Ų5450 Ų5033%0.32730%0.298SS..Hα-helixtrans-61.1-44.3178.9171.90000111.1S188 T194 N196 Y222S188-V192 WeakPolarHBondContact O-CG2 3.45Å; S188-V192 PolarHBondContact O-N 2.92Å; V192-T194 VanDerWaalsContact C-N 3.3Å; V192-T194 PolarHBondContact O-N 3.2Å; V192-N196 WeakPolarHBondContact CG1-ND2 3.36Å; V192-N196 WeakPolarHBondContact O-CB 3.11Å; V192-N196 VanDerWaalsContact O-CG 3.31Å; V192-N196 PolarHBondContact O-N 3.38Å; V192-N196 PolarHBondContact O-ND2 3.28Å; V192-N196 VanDerWaalsContact O-ND2 3.12Å; V192-Y222 HydrophobicContact CG2-CD1 4.18Å
193A91.9Very high91.6Very high57 Ų5745.2 Ų45.247%0.47128%0.279SS..Hα-helixtrans-62.5-38.6175.900000112.3P189 Q190 I191 S197P189-A193 WeakPolarHBondContact O-CB 3.2Å; P189-A193 PolarHBondContact O-N 2.99Å; Q190-A193 PolarHBondContact O-N 2.8Å; I191-A193 PolarHBondContact O-N 3.03Å; A193-S197 WeakPolarHBondContact O-CB 3.23Å; A193-S197 PolarHBondContact O-N 2.94Å; A193-S197 PolarHBondContact O-OG 2.88Å
194T92.6Very high91.7Very high13 Ų1350.3 Ų50.38%0.0830%0.302CS..Hα-helixtrans-67.9-46-179.2-64.10000112Q190 I191 V192 S197 M198 S199 Q202 A203 F206Q190-T194 VanDerWaalsContact O-CB 3.24Å; Q190-T194 WeakPolarHBondContact O-CB 3.24Å; Q190-T194 PolarHBondContact O-N 2.7Å; Q190-T194 PolarHBondContact O-OG1 3.46Å; I191-T194 WeakPolarHBondContact O-CB 3.13Å; I191-T194 PolarHBondContact O-N 2.94Å; I191-T194 VanDerWaalsContact O-N 3.16Å; V192-T194 VanDerWaalsContact C-N 3.3Å; V192-T194 PolarHBondContact O-N 3.2Å; T194-S197 PolarHBondContact O-N 3.47Å; T194-S197 PolarHBondContact O-OG 3.37Å; T194-M198 PolarHBondContact O-N 3.03Å; T194-S199 PolarHBondContact O-N 3.5Å; T194-S199 VanDerWaalsContact O-N 3.16Å; T194-Q202 HydrophobicContact CG2-CB 3.61Å; T194-A203 HydrophobicContact CG2-CB 4.08Å; T194-F206 HydrophobicContact CG2-CD2 4.23Å; T194-F206 HydrophobicContact CG2-CE2 4.28Å; T194-F206 WeakPolarHBondContact OG1-CE2 3.43Å
195F92.6Very high91.7Very high0 Ų050.9 Ų50.90%031%0.307CS..Hα-helixtrans-71.2-35.1178-66.7-42.1000112.5I191 S197 M198 A203 L219 Y223 C226 H227 W266I191-F195 HydrophobicContact CG2-CD2 3.59Å; I191-F195 HydrophobicContact CG2-CE2 3.33Å; I191-F195 HydrophobicContact CG2-CZ 4.29Å; I191-F195 PolarHBondContact O-N 2.94Å; F195-S197 VanDerWaalsContact C-N 3.33Å; F195-S197 PolarHBondContact O-N 2.98Å; F195-M198 PolarHBondContact O-N 2.84Å; F195-A203 HydrophobicContact CE1-CB 4.29Å; F195-L219 HydrophobicContact CE2-CD1 3.83Å; F195-L219 HydrophobicContact CE2-CG 4.34Å; F195-L219 HydrophobicContact CZ-CD1 3.77Å; F195-L219 HydrophobicContact CZ-CG 4.03Å; F195-Y223 HydrophobicContact CD1-CD2 4.04Å; F195-Y223 HydrophobicContact CE1-CD2 4.2Å; F195-Y223 HydrophobicContact CG-CD2 4.36Å; F195-C226 HydrophobicContact CB-CB 4.25Å; F195-H227 PolarHBondContact O-CE1 3.17Å; F195-W266 AromaticContact CD1-CH2 3.94Å; F195-W266 HydrophobicContact CD1-CH2 3.94Å; F195-W266 AromaticContact CE1-CH2 3.94Å; F195-W266 HydrophobicContact CE1-CH2 3.94Å
196N90.9Very high91.7Very high77 Ų7747.8 Ų47.841%0.41228%0.281SS..Hα-helixtrans-66.1-33.3173.1-75.9-33.4000113.2V192 Q230V192-N196 WeakPolarHBondContact CG1-ND2 3.36Å; V192-N196 WeakPolarHBondContact O-CB 3.11Å; V192-N196 VanDerWaalsContact O-CG 3.31Å; V192-N196 PolarHBondContact O-N 3.38Å; V192-N196 PolarHBondContact O-ND2 3.28Å; V192-N196 VanDerWaalsContact O-ND2 3.12Å; N196-Q230 PolarHBondContact OD1-NE2 2.94Å
197S90.9Very high91.9Very high80 Ų8045.7 Ų45.756%0.55927%0.272SS*.THydrogen-bonded Turntrans-90.4-2.1177.559.20000114.1A193 T194 F195 S199A193-S197 WeakPolarHBondContact O-CB 3.23Å; A193-S197 PolarHBondContact O-N 2.94Å; A193-S197 PolarHBondContact O-OG 2.88Å; T194-S197 PolarHBondContact O-N 3.47Å; T194-S197 PolarHBondContact O-OG 3.37Å; F195-S197 VanDerWaalsContact C-N 3.33Å; F195-S197 PolarHBondContact O-N 2.98Å; S197-S199 PolarHBondContact O-N 3.39Å; S197-S199 VanDerWaalsContact O-N 3.17Å
198M89.3Confident91.9Very high60 Ų6050.5 Ų50.530%0.29629%0.293SS..THydrogen-bonded Turntrans5429.5-176.7-67-69.9-78.800114.1T194 F195 L200 H227 W266T194-M198 PolarHBondContact O-N 3.03Å; F195-M198 PolarHBondContact O-N 2.84Å; M198-L200 PolarHBondContact O-N 3.46Å; M198-L200 VanDerWaalsContact O-N 3.13Å; M198-H227 PolarHBondContact SD-CE1 3.4Å; M198-W266 HydrophobicContact CE-CB 3.85Å; M198-W266 VanDerWaalsContact CE-CD1 3.44Å; M198-W266 HydrophobicContact CE-CD2 3.65Å; M198-W266 HydrophobicContact CE-CE3 4.37Å; M198-W266 HydrophobicContact CE-CG 3.37Å; M198-W266 PolarHBondContact O-NE1 3.12Å; M198-W266 HydrophobicContact SD-CD2 4.34Å
199S92.4Very high91.9Very high45 Ų4549.6 Ų49.632%0.31529%0.286SS..  trans-71107.9-177177.70000112.1T194 S197 A203T194-S199 PolarHBondContact O-N 3.5Å; T194-S199 VanDerWaalsContact O-N 3.16Å; S197-S199 PolarHBondContact O-N 3.39Å; S197-S199 VanDerWaalsContact O-N 3.17Å; S199-A203 VanDerWaalsContact O-CB 3.28Å; S199-A203 WeakPolarHBondContact O-CB 3.44Å; S199-A203 PolarHBondContact O-N 3Å
200L90.8Very high91.9Very high52 Ų5245.2 Ų45.227%0.27226%0.258SS..Hα-helixtrans-65.4-40.1-174.3-119.1155.5000113.7M198 K204 Q269 V270M198-L200 PolarHBondContact O-N 3.46Å; M198-L200 VanDerWaalsContact O-N 3.13Å; L200-K204 HydrophobicContact CD2-CD 4.44Å; L200-K204 WeakPolarHBondContact O-CG 2.93Å; L200-K204 PolarHBondContact O-N 3.46Å; L200-Q269 VanDerWaalsContact CD1-OE1 3.23Å; L200-Q269 HydrophobicContact CD2-CB 3.73Å; L200-V270 HydrophobicContact CD2-CG2 3.71Å; L200-V270 HydrophobicContact CG-CG2 4.43Å
201G89.8Confident92Very high49 Ų4943.4 Ų43.451%0.50525%0.253SS..Hα-helixtrans-65-50.3-178.100000111.9K204 V205G201-K204 PolarHBondContact O-N 2.91Å; G201-V205 PolarHBondContact O-N 2.78Å
202Q90.2Very high91.8Very high94 Ų9446.5 Ų46.544%0.43927%0.268SS..Hα-helixtrans-68.1-38.3179.2-71.1-65.4-19.700111.8T194 K204 V205 F206T194-Q202 HydrophobicContact CG2-CB 3.61Å; Q202-K204 VanDerWaalsContact C-N 3.31Å; Q202-K204 PolarHBondContact O-N 2.74Å; Q202-V205 WeakPolarHBondContact O-CB 3.49Å; Q202-V205 PolarHBondContact O-N 2.87Å; Q202-V205 VanDerWaalsContact O-N 3.14Å; Q202-F206 HydrophobicContact CB-CE2 4.27Å; Q202-F206 WeakPolarHBondContact O-CD2 3.46Å; Q202-F206 PolarHBondContact O-N 2.84Å
203A92.6Very high91.7Very high0 Ų044 Ų440%025%0.252CS..Hα-helixtrans-59.4-40.3176.200000112.4T194 F195 S199 V205 F206 V207 W266 V270T194-A203 HydrophobicContact CG2-CB 4.08Å; F195-A203 HydrophobicContact CE1-CB 4.29Å; S199-A203 VanDerWaalsContact O-CB 3.28Å; S199-A203 WeakPolarHBondContact O-CB 3.44Å; S199-A203 PolarHBondContact O-N 3Å; A203-V205 VanDerWaalsContact C-N 3.35Å; A203-V205 PolarHBondContact O-N 3.19Å; A203-F206 PolarHBondContact O-N 3.41Å; A203-V207 WeakPolarHBondContact O-CG2 3.41Å; A203-V207 PolarHBondContact O-N 2.88Å; A203-W266 HydrophobicContact CB-CH2 3.83Å; A203-W266 HydrophobicContact CB-CZ2 3.74Å; A203-V270 HydrophobicContact CB-CG1 4.07Å; A203-V270 HydrophobicContact CB-CG2 4.31Å
204K93Very high91.6Very high107 Ų10747.2 Ų47.247%0.46526%0.262SS..Hα-helixtrans-63.1-38.9175.4-75.8175.5174.7178.70112.7L200 G201 Q202 V207 K208 Q269L200-K204 HydrophobicContact CD2-CD 4.44Å; L200-K204 WeakPolarHBondContact O-CG 2.93Å; L200-K204 PolarHBondContact O-N 3.46Å; G201-K204 PolarHBondContact O-N 2.91Å; Q202-K204 VanDerWaalsContact C-N 3.31Å; Q202-K204 PolarHBondContact O-N 2.74Å; K204-V207 PolarHBondContact O-N 3.13Å; K204-K208 WeakPolarHBondContact O-CB 3.48Å; K204-K208 PolarHBondContact O-N 3.17Å; K204-Q269 WeakPolarHBondContact CE-O 3.33Å
205V92.5Very high91.5Very high40 Ų4047 Ų4724%0.24226%0.26CS..Hα-helixtrans-62.8-48.7175.1174.70000110.1E147 G201 Q202 A203 V207 K208 V209E147-V205 HydrophobicContact CG-CG1 3.93Å; G201-V205 PolarHBondContact O-N 2.78Å; Q202-V205 WeakPolarHBondContact O-CB 3.49Å; Q202-V205 PolarHBondContact O-N 2.87Å; Q202-V205 VanDerWaalsContact O-N 3.14Å; A203-V205 VanDerWaalsContact C-N 3.35Å; A203-V205 PolarHBondContact O-N 3.19Å; V205-V207 PolarHBondContact O-N 3.38Å; V205-K208 PolarHBondContact O-N 3.29Å; V205-V209 HydrophobicContact CG1-CG2 4.46Å; V205-V209 WeakPolarHBondContact O-CG2 3.47Å; V205-V209 PolarHBondContact O-N 3.18Å
206F92.9Very high91.5Very high2 Ų249.1 Ų49.11%0.00927%0.27CS..Hα-helixtrans-62.7-40.7177-69.4-62.2000112.8L146 A187 Q190 I191 T194 Q202 A203 K208 V209 F210 L219L146-F206 HydrophobicContact CD1-CD1 4.25Å; L146-F206 HydrophobicContact CD1-CE1 3.42Å; L146-F206 VanDerWaalsContact CD1-CE1 3.42Å; L146-F206 HydrophobicContact CD1-CZ 4.17Å; A187-F206 HydrophobicContact CB-CE1 4.07Å; Q190-F206 HydrophobicContact CB-CE1 4.49Å; Q190-F206 HydrophobicContact CB-CE2 4.5Å; Q190-F206 HydrophobicContact CB-CZ 3.7Å; I191-F206 HydrophobicContact CD1-CD1 4.18Å; I191-F206 HydrophobicContact CD1-CE1 4.43Å; I191-F206 HydrophobicContact CG1-CD1 3.58Å; I191-F206 HydrophobicContact CG1-CD2 4.2Å; I191-F206 HydrophobicContact CG1-CE1 3.66Å; I191-F206 HydrophobicContact CG1-CE2 4.3Å; I191-F206 HydrophobicContact CG1-CG 3.88Å; I191-F206 HydrophobicContact CG1-CZ 4.05Å; T194-F206 HydrophobicContact CG2-CD2 4.23Å; T194-F206 HydrophobicContact CG2-CE2 4.28Å; T194-F206 WeakPolarHBondContact OG1-CE2 3.43Å; Q202-F206 HydrophobicContact CB-CE2 4.27Å; Q202-F206 WeakPolarHBondContact O-CD2 3.46Å; Q202-F206 PolarHBondContact O-N 2.84Å; A203-F206 PolarHBondContact O-N 3.41Å; F206-K208 VanDerWaalsContact C-N 3.34Å; F206-K208 PolarHBondContact O-N 3.49Å; F206-V209 PolarHBondContact O-N 2.88Å; F206-F210 HydrophobicContact CD1-CE2 4.37Å; F206-F210 WeakPolarHBondContact O-CB 3.22Å; F206-F210 VanDerWaalsContact O-CD2 3.29Å; F206-F210 WeakPolarHBondContact O-CD2 3.34Å; F206-F210 PolarHBondContact O-N 2.97Å; F206-L219 HydrophobicContact CB-CD1 4.1Å; F206-L219 HydrophobicContact CB-CD2 4.39Å
207V93.1Very high91.6Very high18 Ų1849.8 Ų49.811%0.10928%0.279CS..Hα-helixtrans-61.5-43.3175.4169.80000111.3A203 K204 V205 T211 M216 L219 V270 F271A203-V207 WeakPolarHBondContact O-CG2 3.41Å; A203-V207 PolarHBondContact O-N 2.88Å; K204-V207 PolarHBondContact O-N 3.13Å; V205-V207 PolarHBondContact O-N 3.38Å; V207-T211 VanDerWaalsContact O-CB 3.26Å; V207-T211 WeakPolarHBondContact O-CB 3.43Å; V207-T211 PolarHBondContact O-N 3.45Å; V207-T211 PolarHBondContact O-OG1 3.26Å; V207-M216 HydrophobicContact CG1-CE 4.07Å; V207-M216 HydrophobicContact CG1-SD 4.28Å; V207-L219 HydrophobicContact CB-CD2 4.37Å; V207-L219 HydrophobicContact CG2-CD2 3.74Å; V207-V270 HydrophobicContact CG2-CG1 3.55Å; V207-F271 HydrophobicContact CG2-CD1 3.91Å; V207-F271 HydrophobicContact CG2-CE1 3.63Å; V207-F271 HydrophobicContact CG2-CZ 4.47Å
208K91.5Very high91.7Very high103 Ų10349.1 Ų49.145%0.44827%0.267SS..Hα-helixtrans-60.1-53.6176.7-178.4-174.4169.6-162.90110.8K204 V205 F206 F210 T211 E212K204-K208 WeakPolarHBondContact O-CB 3.48Å; K204-K208 PolarHBondContact O-N 3.17Å; V205-K208 PolarHBondContact O-N 3.29Å; F206-K208 VanDerWaalsContact C-N 3.34Å; F206-K208 PolarHBondContact O-N 3.49Å; K208-F210 PolarHBondContact O-N 3.17Å; K208-T211 PolarHBondContact O-N 3.18Å; K208-E212 WeakPolarHBondContact CE-OE1 3.26Å; K208-E212 WeakPolarHBondContact CG-OE1 3.33Å; K208-E212 WeakPolarHBondContact O-CG 3.39Å; K208-E212 PolarHBondContact O-N 3.45Å
209V92.5Very high91.9Very high1 Ų146.3 Ų46.31%0.00625%0.253CS..Hα-helixtrans-58.8-47180167.20000111.9E147 L183 V205 F206 T211 E212 I213E147-V209 HydrophobicContact CG-CG2 4.24Å; L183-V209 HydrophobicContact CD2-CG1 4.15Å; V205-V209 HydrophobicContact CG1-CG2 4.46Å; V205-V209 WeakPolarHBondContact O-CG2 3.47Å; V205-V209 PolarHBondContact O-N 3.18Å; F206-V209 PolarHBondContact O-N 2.88Å; V209-T211 VanDerWaalsContact C-N 3.31Å; V209-T211 PolarHBondContact O-N 2.98Å; V209-E212 PolarHBondContact O-N 2.96Å; V209-I213 WeakPolarHBondContact O-CG1 3.33Å; V209-I213 PolarHBondContact O-N 3.46Å; V209-I213 VanDerWaalsContact O-N 3.08Å
210F93.8Very high92Very high0 Ų045.9 Ų45.90%025%0.247CC..Hα-helixtrans-74.4-20.9-178.8-81.6-106.7000113.5E184 A187 I191 F206 K208 I213 R215 M216 L219E184-F210 HydrophobicContact CB-CE1 4.41Å; E184-F210 HydrophobicContact CB-CZ 4.39Å; E184-F210 HydrophobicContact CG-CE1 4.06Å; E184-F210 HydrophobicContact CG-CZ 4.2Å; A187-F210 HydrophobicContact CB-CE2 4.23Å; A187-F210 HydrophobicContact CB-CZ 4.34Å; I191-F210 HydrophobicContact CD1-CE1 4.45Å; I191-F210 HydrophobicContact CD1-CE2 3.62Å; I191-F210 HydrophobicContact CD1-CZ 3.5Å; I191-F210 VanDerWaalsContact CD1-CZ 3.5Å; F206-F210 HydrophobicContact CD1-CE2 4.37Å; F206-F210 WeakPolarHBondContact O-CB 3.22Å; F206-F210 VanDerWaalsContact O-CD2 3.29Å; F206-F210 WeakPolarHBondContact O-CD2 3.34Å; F206-F210 PolarHBondContact O-N 2.97Å; K208-F210 PolarHBondContact O-N 3.17Å; F210-I213 HydrophobicContact CD1-CD1 4.15Å; F210-I213 HydrophobicContact CE1-CD1 4.4Å; F210-I213 HydrophobicContact CG-CD1 4.24Å; F210-R215 HydrophobicContact CD1-CB 3.91Å; F210-R215 WeakPolarHBondContact CD1-O 3.43Å; F210-R215 HydrophobicContact CE1-CB 4.49Å; F210-R215 CarbonylContact O-C 3.45Å; F210-R215 PolarHBondContact O-N 3.46Å; F210-M216 HydrophobicContact CB-SD 4.07Å; F210-M216 PolarHBondContact O-N 2.89Å; F210-L219 HydrophobicContact CB-CB 4.04Å; F210-L219 HydrophobicContact CB-CD2 4Å; F210-L219 HydrophobicContact CD1-CB 3.87Å; F210-L219 HydrophobicContact CD2-CD1 4.32Å; F210-L219 HydrophobicContact CG-CB 3.96Å; F210-L219 HydrophobicContact CG-CD1 4.37Å; F210-L219 HydrophobicContact CG-CD2 4.34Å; F210-L219 HydrophobicContact CG-CG 4.45Å
211T92.6Very high92.2Very high59 Ų5946 Ų4636%0.36226%0.255SS..Hα-helixtrans-73.5-43.1168.5-57.70000110.8V207 K208 V209 D214 M216V207-T211 VanDerWaalsContact O-CB 3.26Å; V207-T211 WeakPolarHBondContact O-CB 3.43Å; V207-T211 PolarHBondContact O-N 3.45Å; V207-T211 PolarHBondContact O-OG1 3.26Å; K208-T211 PolarHBondContact O-N 3.18Å; V209-T211 VanDerWaalsContact C-N 3.31Å; V209-T211 PolarHBondContact O-N 2.98Å; T211-D214 PolarHBondContact O-N 3.35Å; T211-M216 PolarHBondContact OG1-SD 3.28Å
212E89.3Confident92.4Very high66 Ų6646.2 Ų46.231%0.30824%0.241SC..Hα-helixtrans-62.3-44179.4-76.1172.7-173.200112.1S150 K208 V209 D214S150-E212 WeakPolarHBondContact OG-CB 3.34Å; S150-E212 PolarHBondContact OG-OE2 2.72Å; K208-E212 WeakPolarHBondContact CE-OE1 3.26Å; K208-E212 WeakPolarHBondContact CG-OE1 3.33Å; K208-E212 WeakPolarHBondContact O-CG 3.39Å; K208-E212 PolarHBondContact O-N 3.45Å; V209-E212 PolarHBondContact O-N 2.96Å; E212-D214 VanDerWaalsContact C-N 3.26Å; E212-D214 PolarHBondContact O-N 3.33Å
213I90.5Very high92.6Very high0 Ų041.7 Ų41.70%022%0.22CC..THydrogen-bonded Turntrans-82.13179.171-174.6000114.5L153 K180 L183 V209 F210 R215L153-I213 HydrophobicContact CB-CG2 4.36Å; L153-I213 HydrophobicContact CD1-CG2 4.27Å; K180-I213 VanDerWaalsContact CE-O 3.27Å; K180-I213 WeakPolarHBondContact CE-O 3.48Å; K180-I213 PolarHBondContact NZ-O 3.38Å; L183-I213 HydrophobicContact CD2-CD1 3.98Å; L183-I213 HydrophobicContact CD2-CG2 4.07Å; V209-I213 WeakPolarHBondContact O-CG1 3.33Å; V209-I213 PolarHBondContact O-N 3.46Å; V209-I213 VanDerWaalsContact O-N 3.08Å; F210-I213 HydrophobicContact CD1-CD1 4.15Å; F210-I213 HydrophobicContact CE1-CD1 4.4Å; F210-I213 HydrophobicContact CG-CD1 4.24Å; I213-R215 HydrophobicContact CD1-CB 4.16Å; I213-R215 HydrophobicContact CD1-CG 4.41Å; I213-R215 HydrophobicContact CG1-CB 3.94Å; I213-R215 HydrophobicContact CG1-CG 4.14Å
214D89.1Confident92.7Very high126 Ų12642.7 Ų42.767%0.67422%0.224SC*.THydrogen-bonded Turntrans5848.5-177.5-163.930.6000114.1T211 E212T211-D214 PolarHBondContact O-N 3.35Å; E212-D214 VanDerWaalsContact C-N 3.26Å; E212-D214 PolarHBondContact O-N 3.33Å
215R91.4Very high92.8Very high8 Ų844.8 Ų44.83%0.0323%0.233CC..  trans-131.531.3179.7-69.7-166166.9-156.33114.4E177 N181 E184 F210 I213 P217 Q218 L219E177-R215 PolarHBondContact O-NH2 2.97Å; E177-R215 IonicContact OE1-CZ 3.56Å; E177-R215 IonicContact OE1-NE 3.19Å; E177-R215 IonicContact OE1-NH2 2.97Å; E177-R215 PolarHBondContact OE1-NH2 3.49Å; N181-R215 PolarHBondContact OD1-NH1 3.18Å; N181-R215 PolarHBondContact OD1-NH2 2.65Å; E184-R215 IonicContact OE2-CZ 2.79Å; E184-R215 IonicContact OE2-NH1 3.35Å; E184-R215 PolarHBondContact OE2-NH1 3.35Å; F210-R215 HydrophobicContact CD1-CB 3.91Å; F210-R215 WeakPolarHBondContact CD1-O 3.43Å; F210-R215 HydrophobicContact CE1-CB 4.49Å; F210-R215 CarbonylContact O-C 3.45Å; F210-R215 PolarHBondContact O-N 3.46Å; I213-R215 HydrophobicContact CD1-CB 4.16Å; I213-R215 HydrophobicContact CD1-CG 4.41Å; I213-R215 HydrophobicContact CG1-CB 3.94Å; I213-R215 HydrophobicContact CG1-CG 4.14Å; R215-P217 VanDerWaalsContact C-N 3.34Å; R215-Q218 PolarHBondContact O-N 3.48Å; R215-Q218 PolarHBondContact O-OE1 3.41Å; R215-L219 PolarHBondContact O-N 3.25Å
216M92.9Very high92.8Very high44 Ų4443.5 Ų43.522%0.21723%0.226CC..Hα-helixtrans-55.5-38.4176.6-77.5-59.5-64.100114.8V207 F210 T211 Q218 L219 L220 F271V207-M216 HydrophobicContact CG1-CE 4.07Å; V207-M216 HydrophobicContact CG1-SD 4.28Å; F210-M216 HydrophobicContact CB-SD 4.07Å; F210-M216 PolarHBondContact O-N 2.89Å; T211-M216 PolarHBondContact OG1-SD 3.28Å; M216-Q218 VanDerWaalsContact C-N 3.28Å; M216-Q218 PolarHBondContact O-N 3.4Å; M216-L219 HydrophobicContact CE-CD2 4.42Å; M216-L219 PolarHBondContact O-N 2.82Å; M216-L219 HydrophobicContact SD-CD2 4.21Å; M216-L220 WeakPolarHBondContact O-CG 3.3Å; M216-L220 PolarHBondContact O-N 3.37Å; M216-F271 HydrophobicContact CE-CD1 4.02Å; M216-F271 HydrophobicContact CE-CE1 4.15Å
217P92.6Very high92.9Very high92 Ų9243.6 Ų43.660%0.59723%0.226SC*.Hα-helixtrans-58.6-36.9177.2-26.235.9000113.8R215 L220 A221R215-P217 VanDerWaalsContact C-N 3.34Å; P217-L220 PolarHBondContact O-N 3.18Å; P217-A221 PolarHBondContact O-N 3.49Å
218Q93.3Very high92.9Very high66 Ų6645.6 Ų45.631%0.30823%0.233SC..Hα-helixtrans-69-44.1178.5-66.278.8-3.500110.8R215 M216 L220 A221 Y222R215-Q218 PolarHBondContact O-N 3.48Å; R215-Q218 PolarHBondContact O-OE1 3.41Å; M216-Q218 VanDerWaalsContact C-N 3.28Å; M216-Q218 PolarHBondContact O-N 3.4Å; Q218-L220 VanDerWaalsContact C-N 3.32Å; Q218-L220 PolarHBondContact O-N 3.12Å; Q218-A221 WeakPolarHBondContact O-CB 3.39Å; Q218-A221 PolarHBondContact O-N 3.46Å; Q218-A221 VanDerWaalsContact O-N 3.1Å; Q218-Y222 WeakPolarHBondContact O-CD2 3.49Å; Q218-Y222 PolarHBondContact O-N 3.44Å; Q218-Y222 VanDerWaalsContact O-N 3.14Å
219L94.1Very high93Very high0 Ų042.6 Ų42.60%023%0.232CC..Hα-helixtrans-59.9-44175.3-175.567.7000111.5I191 F195 F206 V207 F210 R215 M216 A221 Y222 Y223I191-L219 HydrophobicContact CD1-CD1 4.04Å; I191-L219 HydrophobicContact CG1-CD1 4.27Å; I191-L219 HydrophobicContact CG2-CD1 3.84Å; F195-L219 HydrophobicContact CE2-CD1 3.83Å; F195-L219 HydrophobicContact CE2-CG 4.34Å; F195-L219 HydrophobicContact CZ-CD1 3.77Å; F195-L219 HydrophobicContact CZ-CG 4.03Å; F206-L219 HydrophobicContact CB-CD1 4.1Å; F206-L219 HydrophobicContact CB-CD2 4.39Å; V207-L219 HydrophobicContact CB-CD2 4.37Å; V207-L219 HydrophobicContact CG2-CD2 3.74Å; F210-L219 HydrophobicContact CB-CB 4.04Å; F210-L219 HydrophobicContact CB-CD2 4Å; F210-L219 HydrophobicContact CD1-CB 3.87Å; F210-L219 HydrophobicContact CD2-CD1 4.32Å; F210-L219 HydrophobicContact CG-CB 3.96Å; F210-L219 HydrophobicContact CG-CD1 4.37Å; F210-L219 HydrophobicContact CG-CD2 4.34Å; F210-L219 HydrophobicContact CG-CG 4.45Å; R215-L219 PolarHBondContact O-N 3.25Å; M216-L219 HydrophobicContact CE-CD2 4.42Å; M216-L219 PolarHBondContact O-N 2.82Å; M216-L219 HydrophobicContact SD-CD2 4.21Å; L219-A221 VanDerWaalsContact C-N 3.29Å; L219-A221 PolarHBondContact O-N 3.4Å; L219-Y222 PolarHBondContact O-N 3.42Å; L219-Y223 PolarHBondContact O-N 3.24Å
220L94Very high93Very high36 Ų3646.8 Ų46.819%0.18825%0.252CS..Hα-helixtrans-60.9-38.3174.6-72.3175.9000111.7M216 P217 Q218 Y222 Y223 Y224 F271 V277M216-L220 WeakPolarHBondContact O-CG 3.3Å; M216-L220 PolarHBondContact O-N 3.37Å; P217-L220 PolarHBondContact O-N 3.18Å; Q218-L220 VanDerWaalsContact C-N 3.32Å; Q218-L220 PolarHBondContact O-N 3.12Å; L220-Y222 VanDerWaalsContact C-N 3.33Å; L220-Y222 PolarHBondContact O-N 3.3Å; L220-Y223 WeakPolarHBondContact O-CB 3.36Å; L220-Y223 PolarHBondContact O-N 2.87Å; L220-Y224 HydrophobicContact CB-CD2 4.37Å; L220-Y224 HydrophobicContact CB-CE2 3.81Å; L220-Y224 WeakPolarHBondContact O-CD2 3.07Å; L220-Y224 VanDerWaalsContact O-CG 3.28Å; L220-Y224 PolarHBondContact O-N 3.43Å; L220-F271 HydrophobicContact CD2-CD1 4.05Å; L220-F271 HydrophobicContact CD2-CE1 3.67Å; L220-F271 HydrophobicContact CD2-CE2 4.29Å; L220-F271 HydrophobicContact CD2-CZ 3.81Å; L220-V277 HydrophobicContact CD2-CG1 4.14Å; L220-V277 HydrophobicContact CD2-CG2 3.83Å
221A94.6Very high93.1Very high55 Ų5547.1 Ų47.146%0.45525%0.253SS..Hα-helixtrans-60.8-38.8175.100000112.8P217 Q218 L219 K225P217-A221 PolarHBondContact O-N 3.49Å; Q218-A221 WeakPolarHBondContact O-CB 3.39Å; Q218-A221 PolarHBondContact O-N 3.46Å; Q218-A221 VanDerWaalsContact O-N 3.1Å; L219-A221 VanDerWaalsContact C-N 3.29Å; L219-A221 PolarHBondContact O-N 3.4Å; A221-K225 VanDerWaalsContact O-CB 3.28Å; A221-K225 WeakPolarHBondContact O-CB 3.38Å; A221-K225 PolarHBondContact O-N 3.36Å
222Y93.7Very high93.2Very high53 Ų5345.1 Ų45.121%0.20824%0.241CC..Hα-helixtrans-66.1-44.6172.7-71.5-74.9000112.1E184 S188 I191 V192 Q218 L219 L220 Y224 K225 C226E184-Y222 HydrophobicContact CG-CE2 4.25Å; E184-Y222 PolarHBondContact OE1-OH 3.49Å; S188-Y222 PolarHBondContact OG-OH 3.43Å; S188-Y222 VanDerWaalsContact OG-OH 3.1Å; I191-Y222 HydrophobicContact CG2-CD2 4.42Å; I191-Y222 HydrophobicContact CG2-CG 4.07Å; V192-Y222 HydrophobicContact CG2-CD1 4.18Å; Q218-Y222 WeakPolarHBondContact O-CD2 3.49Å; Q218-Y222 PolarHBondContact O-N 3.44Å; Q218-Y222 VanDerWaalsContact O-N 3.14Å; L219-Y222 PolarHBondContact O-N 3.42Å; L220-Y222 VanDerWaalsContact C-N 3.33Å; L220-Y222 PolarHBondContact O-N 3.3Å; Y222-Y224 PolarHBondContact O-N 3.38Å; Y222-K225 PolarHBondContact O-N 2.94Å; Y222-C226 PolarHBondContact O-N 3.1Å; Y222-C226 VanDerWaalsContact O-N 3.07Å; Y222-C226 PolarHBondContact O-SG 2.76Å
223Y94.7Very high93.5Very high0 Ų044.6 Ų44.60%024%0.244CC..Hα-helixtrans-55.1-52.2175.1170-95.5000110.8F195 L219 L220 K225 C226 H227 Q263 W266 F271 V277 L281F195-Y223 HydrophobicContact CD1-CD2 4.04Å; F195-Y223 HydrophobicContact CE1-CD2 4.2Å; F195-Y223 HydrophobicContact CG-CD2 4.36Å; L219-Y223 PolarHBondContact O-N 3.24Å; L220-Y223 WeakPolarHBondContact O-CB 3.36Å; L220-Y223 PolarHBondContact O-N 2.87Å; Y223-K225 PolarHBondContact O-N 3.22Å; Y223-C226 PolarHBondContact O-N 3.14Å; Y223-H227 AromaticContact CD2-CD2 3.37Å; Y223-H227 WeakPolarHBondContact CD2-CD2 3.25Å; Y223-H227 AromaticContact CD2-NE2 3.56Å; Y223-H227 AromaticContact CE2-CD2 3.15Å; Y223-H227 WeakPolarHBondContact CE2-CD2 3.46Å; Y223-H227 AromaticContact CE2-NE2 3.3Å; Y223-H227 VanDerWaalsContact CE2-NE2 3.3Å; Y223-H227 WeakPolarHBondContact CE2-NE2 3.25Å; Y223-H227 AromaticContact CG-CD2 3.99Å; Y223-H227 AromaticContact CZ-CD2 3.61Å; Y223-H227 PolarHBondContact O-CD2 2.9Å; Y223-H227 VanDerWaalsContact O-CD2 3.25Å; Y223-H227 PolarHBondContact O-N 3.36Å; Y223-H227 VanDerWaalsContact O-N 3.17Å; Y223-Q263 PolarHBondContact OH-OE1 3.37Å; Y223-W266 HydrophobicContact CD2-CZ3 4.18Å; Y223-W266 HydrophobicContact CE2-CE3 4.24Å; Y223-W266 AromaticContact CE2-CZ3 3.74Å; Y223-W266 HydrophobicContact CE2-CZ3 3.74Å; Y223-F271 HydrophobicContact CD2-CE2 4.12Å; Y223-F271 HydrophobicContact CD2-CZ 4.37Å; Y223-F271 HydrophobicContact CE2-CE2 4.28Å; Y223-F271 HydrophobicContact CG-CE2 4.29Å; Y223-F271 HydrophobicContact CG-CZ 4.34Å; Y223-V277 HydrophobicContact CD1-CG1 3.95Å; Y223-V277 HydrophobicContact CE1-CG1 3.52Å; Y223-L281 HydrophobicContact CE1-CD2 4.36Å
224Y95.4Very high93.7Very high21 Ų2147.7 Ų47.78%0.08226%0.26CS..Hα-helixtrans-60.6-44.9177.9-62.4-45.9000112L220 Y222 C226 K228 V277 V280 L281L220-Y224 HydrophobicContact CB-CD2 4.37Å; L220-Y224 HydrophobicContact CB-CE2 3.81Å; L220-Y224 WeakPolarHBondContact O-CD2 3.07Å; L220-Y224 VanDerWaalsContact O-CG 3.28Å; L220-Y224 PolarHBondContact O-N 3.43Å; Y222-Y224 PolarHBondContact O-N 3.38Å; Y224-C226 VanDerWaalsContact C-N 3.3Å; Y224-C226 PolarHBondContact O-N 2.82Å; Y224-K228 WeakPolarHBondContact O-CA 3.41Å; Y224-K228 WeakPolarHBondContact O-CB 3.49Å; Y224-K228 PolarHBondContact O-N 2.77Å; Y224-V277 HydrophobicContact CE1-CG1 4.03Å; Y224-V277 VanDerWaalsContact CE1-O 3.23Å; Y224-V277 WeakPolarHBondContact CE1-O 3.27Å; Y224-V277 WeakPolarHBondContact OH-CA 2.89Å; Y224-V277 PolarHBondContact OH-O 2.92Å; Y224-V280 HydrophobicContact CD2-CG1 4.41Å; Y224-V280 HydrophobicContact CE1-CB 4.16Å; Y224-V280 HydrophobicContact CE1-CG1 4Å; Y224-V280 HydrophobicContact CE2-CG1 3.77Å; Y224-L281 HydrophobicContact CD1-CB 3.93Å; Y224-L281 HydrophobicContact CD1-CD1 4.16Å; Y224-L281 HydrophobicContact CE1-CB 4.04Å
225K94.3Very high94.1Very high151 Ų15141.7 Ų41.766%0.65723%0.228SC*.Hα-helixtrans-58.7-41-179.4-173.6176.6179.5179.50112.5A221 Y222 Y223 G229A221-K225 VanDerWaalsContact O-CB 3.28Å; A221-K225 WeakPolarHBondContact O-CB 3.38Å; A221-K225 PolarHBondContact O-N 3.36Å; Y222-K225 PolarHBondContact O-N 2.94Å; Y223-K225 PolarHBondContact O-N 3.22Å; K225-G229 PolarHBondContact O-N 2.81Å
226C93.4Very high94.2Very high13 Ų1345 Ų459%0.08824%0.244CC..Hα-helixtrans-69.5-55.4-179.5-60.50000111.5F195 Y222 Y223 Y224 G229 Q230F195-C226 HydrophobicContact CB-CB 4.25Å; Y222-C226 PolarHBondContact O-N 3.1Å; Y222-C226 VanDerWaalsContact O-N 3.07Å; Y222-C226 PolarHBondContact O-SG 2.76Å; Y223-C226 PolarHBondContact O-N 3.14Å; Y224-C226 VanDerWaalsContact C-N 3.3Å; Y224-C226 PolarHBondContact O-N 2.82Å; C226-G229 PolarHBondContact O-N 3.05Å; C226-Q230 PolarHBondContact O-N 3.08Å
227H93.6Very high94.3Very high4 Ų447.6 Ų47.62%0.01926%0.259CS..Hα-helixtrans-70.1-40.1-175.8-68.2-61.4000113F195 M198 Y223 G229 Q230 L231 L281F195-H227 PolarHBondContact O-CE1 3.17Å; M198-H227 PolarHBondContact SD-CE1 3.4Å; Y223-H227 AromaticContact CD2-CD2 3.37Å; Y223-H227 WeakPolarHBondContact CD2-CD2 3.25Å; Y223-H227 AromaticContact CD2-NE2 3.56Å; Y223-H227 AromaticContact CE2-CD2 3.15Å; Y223-H227 WeakPolarHBondContact CE2-CD2 3.46Å; Y223-H227 AromaticContact CE2-NE2 3.3Å; Y223-H227 VanDerWaalsContact CE2-NE2 3.3Å; Y223-H227 WeakPolarHBondContact CE2-NE2 3.25Å; Y223-H227 AromaticContact CG-CD2 3.99Å; Y223-H227 AromaticContact CZ-CD2 3.61Å; Y223-H227 PolarHBondContact O-CD2 2.9Å; Y223-H227 VanDerWaalsContact O-CD2 3.25Å; Y223-H227 PolarHBondContact O-N 3.36Å; Y223-H227 VanDerWaalsContact O-N 3.17Å; H227-G229 VanDerWaalsContact C-N 3.29Å; H227-G229 PolarHBondContact O-N 3.44Å; H227-Q230 PolarHBondContact O-N 3.14Å; H227-L231 WeakPolarHBondContact O-CG 3.2Å; H227-L231 PolarHBondContact O-N 3.49Å; H227-L231 VanDerWaalsContact O-N 3.08Å; H227-L281 HydrophobicContact CB-CD1 3.75Å; H227-L281 HydrophobicContact CB-CD2 3.95Å
228K94.3Very high94.4Very high59 Ų5944.3 Ų44.326%0.25724%0.236SC..Hα-helixtrans-59.3-41.8173.6-173.5-176.778.6177.20111.3Y224 Q230 L231 V232 L281 Q284 S288Y224-K228 WeakPolarHBondContact O-CA 3.41Å; Y224-K228 WeakPolarHBondContact O-CB 3.49Å; Y224-K228 PolarHBondContact O-N 2.77Å; K228-Q230 VanDerWaalsContact C-N 3.31Å; K228-Q230 PolarHBondContact O-N 3.3Å; K228-L231 PolarHBondContact O-N 2.82Å; K228-V232 HydrophobicContact CG-CG2 4.16Å; K228-V232 WeakPolarHBondContact O-CB 3.5Å; K228-V232 VanDerWaalsContact O-CG2 3.28Å; K228-V232 WeakPolarHBondContact O-CG2 3.45Å; K228-V232 PolarHBondContact O-N 3.26Å; K228-L281 HydrophobicContact CB-CD1 4.25Å; K228-Q284 HydrophobicContact CD-CB 3.88Å; K228-S288 VanDerWaalsContact CD-OG 3.29Å; K228-S288 WeakPolarHBondContact CD-OG 3.42Å; K228-S288 WeakPolarHBondContact CG-OG 3.29Å
229G93.3Very high94.3Very high40 Ų4042.8 Ų42.841%0.41223%0.232SC..Hα-helixtrans-59.1-41.517800000112.6K225 C226 H227 S233K225-G229 PolarHBondContact O-N 2.81Å; C226-G229 PolarHBondContact O-N 3.05Å; H227-G229 VanDerWaalsContact C-N 3.29Å; H227-G229 PolarHBondContact O-N 3.44Å; G229-S233 WeakPolarHBondContact O-CB 3.44Å; G229-S233 PolarHBondContact O-N 3.02Å; G229-S233 VanDerWaalsContact O-N 3.09Å
230Q93.4Very high94.2Very high90 Ų9050.1 Ų50.142%0.42127%0.267SS..Hα-helixtrans-64.4-48.8175.6-65.7172.5-4.500111.6N196 C226 H227 K228 V232 S233 I234N196-Q230 PolarHBondContact OD1-NE2 2.94Å; C226-Q230 PolarHBondContact O-N 3.08Å; H227-Q230 PolarHBondContact O-N 3.14Å; K228-Q230 VanDerWaalsContact C-N 3.31Å; K228-Q230 PolarHBondContact O-N 3.3Å; Q230-V232 PolarHBondContact O-N 3.06Å; Q230-S233 WeakPolarHBondContact O-CB 3.37Å; Q230-S233 PolarHBondContact O-N 3.11Å; Q230-I234 WeakPolarHBondContact O-CG1 3.26Å; Q230-I234 PolarHBondContact O-N 3.16Å; Q230-I234 VanDerWaalsContact O-N 3.1Å
231L95.3Very high94.1Very high7 Ų750.3 Ų50.34%0.03727%0.271CS..Hα-helixtrans-64.7-40.9-179.3-67.3173.4000112.8H227 K228 S233 I234 W235 F252 T255 L256 T259 T285H227-L231 WeakPolarHBondContact O-CG 3.2Å; H227-L231 PolarHBondContact O-N 3.49Å; H227-L231 VanDerWaalsContact O-N 3.08Å; K228-L231 PolarHBondContact O-N 2.82Å; L231-S233 VanDerWaalsContact C-N 3.31Å; L231-S233 PolarHBondContact O-N 3.08Å; L231-I234 HydrophobicContact CD2-CD1 4.47Å; L231-I234 PolarHBondContact O-N 3.29Å; L231-W235 PolarHBondContact O-N 3.27Å; L231-W235 VanDerWaalsContact O-N 3.08Å; L231-F252 WeakPolarHBondContact O-CE2 3.27Å; L231-T255 HydrophobicContact CD2-CG2 4.46Å; L231-L256 HydrophobicContact CD1-CD2 4Å; L231-L256 HydrophobicContact CD2-CD2 4.22Å; L231-T259 HydrophobicContact CD1-CG2 4.24Å; L231-T259 HydrophobicContact CD2-CG2 4.18Å; L231-T285 HydrophobicContact CB-CG2 3.55Å; L231-T285 HydrophobicContact CD1-CG2 3.94Å; L231-T285 HydrophobicContact CG-CG2 4.4Å
232V95.4Very high93.9Very high17 Ų1757.6 Ų57.610%0.10330%0.296CS..Hα-helixtrans-65.8-35.3176.3172.30000111.2K228 Q230 W235 Q236 T285K228-V232 HydrophobicContact CG-CG2 4.16Å; K228-V232 WeakPolarHBondContact O-CB 3.5Å; K228-V232 VanDerWaalsContact O-CG2 3.28Å; K228-V232 WeakPolarHBondContact O-CG2 3.45Å; K228-V232 PolarHBondContact O-N 3.26Å; Q230-V232 PolarHBondContact O-N 3.06Å; V232-W235 PolarHBondContact O-N 3.14Å; V232-Q236 WeakPolarHBondContact O-CG 3.37Å; V232-Q236 PolarHBondContact O-N 3.15Å; V232-T285 HydrophobicContact CG2-CG2 4.4Å
233S94.6Very high93.8Very high54 Ų5458.1 Ų58.138%0.37830%0.302SS..Hα-helixtrans-62.1-44.9173.2-169.30000111.6G229 Q230 L231 W235 Q236 D237G229-S233 WeakPolarHBondContact O-CB 3.44Å; G229-S233 PolarHBondContact O-N 3.02Å; G229-S233 VanDerWaalsContact O-N 3.09Å; Q230-S233 WeakPolarHBondContact O-CB 3.37Å; Q230-S233 PolarHBondContact O-N 3.11Å; L231-S233 VanDerWaalsContact C-N 3.31Å; L231-S233 PolarHBondContact O-N 3.08Å; S233-W235 VanDerWaalsContact C-N 3.28Å; S233-W235 PolarHBondContact O-N 3.24Å; S233-Q236 WeakPolarHBondContact O-CB 3.35Å; S233-Q236 PolarHBondContact O-N 2.89Å; S233-Q236 VanDerWaalsContact O-N 3.11Å; S233-D237 PolarHBondContact O-N 3.47Å
234I95.4Very high93.6Very high65 Ų6561 Ų6133%0.33332%0.322SS..Hα-helixtrans-58.9-43.4177.1-64.9166.5000110.4Q230 L231 D237 L238 T255Q230-I234 WeakPolarHBondContact O-CG1 3.26Å; Q230-I234 PolarHBondContact O-N 3.16Å; Q230-I234 VanDerWaalsContact O-N 3.1Å; L231-I234 HydrophobicContact CD2-CD1 4.47Å; L231-I234 PolarHBondContact O-N 3.29Å; I234-D237 PolarHBondContact O-N 2.95Å; I234-L238 HydrophobicContact CG2-CD1 4.02Å; I234-L238 HydrophobicContact CG2-CG 4.44Å; I234-L238 WeakPolarHBondContact O-CB 3.26Å; I234-L238 WeakPolarHBondContact O-CG 3.41Å; I234-L238 PolarHBondContact O-N 2.96Å; I234-T255 HydrophobicContact CD1-CG2 4.09Å; I234-T255 HydrophobicContact CG2-CG2 4.42Å
235W96Very high93.5Very high0 Ų061 Ų610%032%0.323CS..Hα-helixtrans-62.4-42.3175.1175-113.9000112.9L231 V232 S233 D237 L238 S239 L245 Q248 L249 F252 M289 P291L231-W235 PolarHBondContact O-N 3.27Å; L231-W235 VanDerWaalsContact O-N 3.08Å; V232-W235 PolarHBondContact O-N 3.14Å; S233-W235 VanDerWaalsContact C-N 3.28Å; S233-W235 PolarHBondContact O-N 3.24Å; W235-D237 VanDerWaalsContact C-N 3.32Å; W235-D237 PolarHBondContact O-N 3.06Å; W235-L238 PolarHBondContact O-N 3.34Å; W235-S239 VanDerWaalsContact O-CB 3.3Å; W235-S239 WeakPolarHBondContact O-CB 3.33Å; W235-S239 PolarHBondContact O-N 3.39Å; W235-S239 PolarHBondContact O-OG 3.42Å; W235-L245 HydrophobicContact CH2-CD1 4.41Å; W235-Q248 HydrophobicContact CZ3-CB 4.35Å; W235-L249 HydrophobicContact CH2-CD2 3.62Å; W235-L249 HydrophobicContact CH2-CG 4.31Å; W235-L249 HydrophobicContact CZ3-CD2 3.91Å; W235-F252 HydrophobicContact CB-CD2 3.99Å; W235-F252 HydrophobicContact CB-CE2 3.69Å; W235-F252 HydrophobicContact CB-CZ 4.07Å; W235-F252 HydrophobicContact CE3-CB 3.85Å; W235-F252 AromaticContact CE3-CD1 3.99Å; W235-F252 HydrophobicContact CE3-CD1 3.99Å; W235-F252 HydrophobicContact CE3-CD2 4.09Å; W235-F252 AromaticContact CE3-CG 3.69Å; W235-F252 HydrophobicContact CE3-CG 3.69Å; W235-F252 HydrophobicContact CZ3-CB 4.08Å; W235-F252 HydrophobicContact CZ3-CD1 4.48Å; W235-F252 HydrophobicContact CZ3-CG 4.31Å; W235-M289 HydrophobicContact CB-CE 4.3Å; W235-M289 HydrophobicContact CD2-CE 3.17Å; W235-M289 HydrophobicContact CE3-CE 3.6Å; W235-M289 HydrophobicContact CG-CE 3.48Å; W235-M289 VanDerWaalsContact CG-CE 3.48Å; W235-M289 HydrophobicContact CG-CG 4.46Å; W235-M289 HydrophobicContact CH2-CE 4.14Å; W235-M289 HydrophobicContact CZ2-CE 3.76Å; W235-M289 HydrophobicContact CZ3-CE 4.07Å; W235-P291 PolarHBondContact NE1-O 3.43Å
236Q94.9Very high93.4Very high77 Ų7755.5 Ų55.536%0.3630%0.301SS..Hα-helixtrans-60.4-43.8177.8-75.5173.2-3.800111.3V232 S233 S239 Q240 V290V232-Q236 WeakPolarHBondContact O-CG 3.37Å; V232-Q236 PolarHBondContact O-N 3.15Å; S233-Q236 WeakPolarHBondContact O-CB 3.35Å; S233-Q236 PolarHBondContact O-N 2.89Å; S233-Q236 VanDerWaalsContact O-N 3.11Å; Q236-S239 PolarHBondContact O-N 2.94Å; Q236-S239 PolarHBondContact O-OG 3.21Å; Q236-Q240 WeakPolarHBondContact O-CG 3.39Å; Q236-Q240 PolarHBondContact O-N 3.12Å; Q236-V290 WeakPolarHBondContact CG-O 3.45Å
237D94.9Very high93.5Very high99 Ų9959.6 Ų59.653%0.52932%0.319SS..Hα-helixtrans-64.8-45.1177.3-63.2-27.2000111.3S233 I234 W235 S239 Q240 S241S233-D237 PolarHBondContact O-N 3.47Å; I234-D237 PolarHBondContact O-N 2.95Å; W235-D237 VanDerWaalsContact C-N 3.32Å; W235-D237 PolarHBondContact O-N 3.06Å; D237-S239 VanDerWaalsContact C-N 3.34Å; D237-S239 PolarHBondContact O-N 2.98Å; D237-Q240 PolarHBondContact O-N 3.06Å; D237-S241 PolarHBondContact O-N 2.89Å
238L94.2Very high93.5Very high24 Ų2460.3 Ų60.313%0.12632%0.322CS..Hα-helixtrans-62-40.2175.6-73.3174.1000112.1I234 W235 Q240 S241 Q248 E251 F252I234-L238 HydrophobicContact CG2-CD1 4.02Å; I234-L238 HydrophobicContact CG2-CG 4.44Å; I234-L238 WeakPolarHBondContact O-CB 3.26Å; I234-L238 WeakPolarHBondContact O-CG 3.41Å; I234-L238 PolarHBondContact O-N 2.96Å; W235-L238 PolarHBondContact O-N 3.34Å; L238-Q240 PolarHBondContact O-N 3.07Å; L238-S241 VanDerWaalsContact O-CB 3.29Å; L238-S241 WeakPolarHBondContact O-CB 2.97Å; L238-S241 PolarHBondContact O-N 3.36Å; L238-S241 VanDerWaalsContact O-N 3.1Å; L238-S241 PolarHBondContact O-OG 3.05Å; L238-Q248 PolarHBondContact O-NE2 3.43Å; L238-Q248 VanDerWaalsContact O-NE2 3.11Å; L238-E251 HydrophobicContact CD1-CB 4.34Å; L238-E251 HydrophobicContact CD2-CB 4.41Å; L238-E251 VanDerWaalsContact CD2-OE2 3.31Å; L238-E251 WeakPolarHBondContact CD2-OE2 3.25Å; L238-F252 HydrophobicContact CD1-CB 3.86Å; L238-F252 HydrophobicContact CD1-CD2 4.31Å
239S91.3Very high93.6Very high33 Ų3357.5 Ų57.523%0.23131%0.31CS..Hα-helixtrans-66.7-22.6-179.574.40000113.6W235 Q236 D237W235-S239 VanDerWaalsContact O-CB 3.3Å; W235-S239 WeakPolarHBondContact O-CB 3.33Å; W235-S239 PolarHBondContact O-N 3.39Å; W235-S239 PolarHBondContact O-OG 3.42Å; Q236-S239 PolarHBondContact O-N 2.94Å; Q236-S239 PolarHBondContact O-OG 3.21Å; D237-S239 VanDerWaalsContact C-N 3.34Å; D237-S239 PolarHBondContact O-N 2.98Å
240Q91.4Very high93.7Very high154 Ų15457.7 Ų57.772%0.7231%0.305SS*.THydrogen-bonded Turntrans-89.3-8176.3-68174.926.200113Q236 D237 L238Q236-Q240 WeakPolarHBondContact O-CG 3.39Å; Q236-Q240 PolarHBondContact O-N 3.12Å; D237-Q240 PolarHBondContact O-N 3.06Å; L238-Q240 PolarHBondContact O-N 3.07Å
241S92.6Very high93.8Very high41 Ų4157.6 Ų57.629%0.28731%0.305SS..SBendtrans-70.8160.2178.173.50000112.5D237 L238 L243 Q248D237-S241 PolarHBondContact O-N 2.89Å; L238-S241 VanDerWaalsContact O-CB 3.29Å; L238-S241 WeakPolarHBondContact O-CB 2.97Å; L238-S241 PolarHBondContact O-N 3.36Å; L238-S241 VanDerWaalsContact O-N 3.1Å; L238-S241 PolarHBondContact O-OG 3.05Å; S241-L243 PolarHBondContact O-N 3.08Å; S241-L243 WeakPolarHBondContact OG-CB 3.39Å; S241-L243 PolarHBondContact OG-N 3Å; S241-Q248 PolarHBondContact O-NE2 3.07Å; S241-Q248 PolarHBondContact OG-NE2 2.78Å
242E90.1Very high93.9Very high207 Ų20757.2 Ų57.297%0.96730%0.303SS*.SBendtrans-76.52.2174.6-62-170.6168.200113.6
243L91.1Very high93.9Very high65 Ų6556.6 Ų56.634%0.3430%0.299SS..SBendtrans-67.3155.3-178.6-61.4176000111.7S241 Q247 Q248S241-L243 PolarHBondContact O-N 3.08Å; S241-L243 WeakPolarHBondContact OG-CB 3.39Å; S241-L243 PolarHBondContact OG-N 3Å; L243-Q247 HydrophobicContact CB-CB 4.25Å; L243-Q248 HydrophobicContact CB-CG 3.86Å; L243-Q248 PolarHBondContact O-NE2 3.09Å
244S91.6Very high94Very high59 Ų5958.7 Ų58.741%0.41331%0.306SS..  trans-64.1149.7170.566.90000110.7N246 Q247 Q248S244-N246 PolarHBondContact O-N 3.5Å; S244-N246 VanDerWaalsContact O-N 3.12Å; S244-Q247 PolarHBondContact O-N 3.22Å; S244-Q247 WeakPolarHBondContact OG-CG 3.46Å; S244-Q247 PolarHBondContact OG-N 3.02Å; S244-Q247 PolarHBondContact OG-OE1 3.43Å; S244-Q248 WeakPolarHBondContact O-CG 3.45Å; S244-Q248 PolarHBondContact O-N 3.34Å
245L92.6Very high94.1Very high21 Ų2157.5 Ų57.511%0.1130%0.302CS..Hα-helixtrans-55.5-35.1178.9178.263.5000112.1W235 Q248 L249 C296 A300 L316W235-L245 HydrophobicContact CH2-CD1 4.41Å; L245-Q248 PolarHBondContact O-N 2.89Å; L245-L249 HydrophobicContact CD1-CD1 4.36Å; L245-L249 HydrophobicContact CD1-CG 4.19Å; L245-L249 HydrophobicContact CG-CD1 4.2Å; L245-L249 HydrophobicContact CG-CG 4.44Å; L245-L249 WeakPolarHBondContact O-CB 3.2Å; L245-L249 WeakPolarHBondContact O-CG 3.39Å; L245-L249 PolarHBondContact O-N 2.93Å; L245-C296 HydrophobicContact CD1-CB 3.79Å; L245-C296 HydrophobicContact CD2-CB 4Å; L245-C296 WeakPolarHBondContact CD2-O 3.48Å; L245-A300 HydrophobicContact CD2-CB 3.64Å; L245-L316 HydrophobicContact CB-CD2 4.27Å; L245-L316 HydrophobicContact CD2-CD1 4.08Å; L245-L316 HydrophobicContact CD2-CD2 3.94Å; L245-L316 HydrophobicContact CG-CD2 3.84Å
246N93.3Very high94.1Very high37 Ų3757.5 Ų57.520%0.19830%0.302CS..Hα-helixtrans-62.3-46.9177.4-170.2-6.1000111.6S244 L249 S250 L316 T319S244-N246 PolarHBondContact O-N 3.5Å; S244-N246 VanDerWaalsContact O-N 3.12Å; N246-L249 PolarHBondContact O-N 3.49Å; N246-S250 WeakPolarHBondContact O-CB 3.49Å; N246-S250 PolarHBondContact O-N 3.38Å; N246-L316 HydrophobicContact CB-CD2 4.03Å; N246-T319 WeakPolarHBondContact OD1-CB 3.14Å; N246-T319 PolarHBondContact OD1-OG1 2.98Å
247Q94Very high94.1Very high99 Ų9955.3 Ų55.346%0.46329%0.292SS..Hα-helixtrans-64.9-42.7175.4-72.9166.9-20.200112L243 S244 L249 S250 E251L243-Q247 HydrophobicContact CB-CB 4.25Å; S244-Q247 PolarHBondContact O-N 3.22Å; S244-Q247 WeakPolarHBondContact OG-CG 3.46Å; S244-Q247 PolarHBondContact OG-N 3.02Å; S244-Q247 PolarHBondContact OG-OE1 3.43Å; Q247-L249 VanDerWaalsContact C-N 3.31Å; Q247-L249 PolarHBondContact O-N 3.09Å; Q247-S250 PolarHBondContact O-N 3.27Å; Q247-E251 PolarHBondContact O-N 3.42Å
248Q95.1Very high94.2Very high18 Ų1853.8 Ų53.88%0.08429%0.289CS..Hα-helixtrans-57-44.8176-67.1174.6-16.700111.6W235 L238 S241 L243 S244 L245 F252W235-Q248 HydrophobicContact CZ3-CB 4.35Å; L238-Q248 PolarHBondContact O-NE2 3.43Å; L238-Q248 VanDerWaalsContact O-NE2 3.11Å; S241-Q248 PolarHBondContact O-NE2 3.07Å; S241-Q248 PolarHBondContact OG-NE2 2.78Å; L243-Q248 HydrophobicContact CB-CG 3.86Å; L243-Q248 PolarHBondContact O-NE2 3.09Å; S244-Q248 WeakPolarHBondContact O-CG 3.45Å; S244-Q248 PolarHBondContact O-N 3.34Å; L245-Q248 PolarHBondContact O-N 2.89Å; Q248-F252 VanDerWaalsContact O-CB 3.31Å; Q248-F252 WeakPolarHBondContact O-CB 3.45Å; Q248-F252 PolarHBondContact O-N 2.92Å; Q248-F252 VanDerWaalsContact O-N 3.13Å
249L94.7Very high94.2Very high1 Ų154 Ų541%0.00529%0.292CS..Hα-helixtrans-68.2-41.8176.2-73.1175.6000112W235 L245 N246 Q247 F252 Y253 L316W235-L249 HydrophobicContact CH2-CD2 3.62Å; W235-L249 HydrophobicContact CH2-CG 4.31Å; W235-L249 HydrophobicContact CZ3-CD2 3.91Å; L245-L249 HydrophobicContact CD1-CD1 4.36Å; L245-L249 HydrophobicContact CD1-CG 4.19Å; L245-L249 HydrophobicContact CG-CD1 4.2Å; L245-L249 HydrophobicContact CG-CG 4.44Å; L245-L249 WeakPolarHBondContact O-CB 3.2Å; L245-L249 WeakPolarHBondContact O-CG 3.39Å; L245-L249 PolarHBondContact O-N 2.93Å; N246-L249 PolarHBondContact O-N 3.49Å; Q247-L249 VanDerWaalsContact C-N 3.31Å; Q247-L249 PolarHBondContact O-N 3.09Å; L249-F252 PolarHBondContact O-N 3.44Å; L249-Y253 HydrophobicContact CB-CD2 4.35Å; L249-Y253 HydrophobicContact CB-CE2 3.99Å; L249-Y253 HydrophobicContact CD2-CE2 4.48Å; L249-Y253 VanDerWaalsContact O-CB 3.27Å; L249-Y253 WeakPolarHBondContact O-CB 3.38Å; L249-Y253 VanDerWaalsContact O-CD2 3.26Å; L249-Y253 WeakPolarHBondContact O-CD2 3.32Å; L249-Y253 PolarHBondContact O-N 3.04Å; L249-L316 HydrophobicContact CD1-CD2 3.88Å
250S96.1Very high94.4Very high44 Ų4452.7 Ų52.731%0.30828%0.282SS..Hα-helixtrans-58.7-52177.6-1690000111.6N246 Q247 F252 Y253 D254N246-S250 WeakPolarHBondContact O-CB 3.49Å; N246-S250 PolarHBondContact O-N 3.38Å; Q247-S250 PolarHBondContact O-N 3.27Å; S250-F252 VanDerWaalsContact C-N 3.3Å; S250-F252 PolarHBondContact O-N 3.27Å; S250-Y253 PolarHBondContact O-N 2.61Å; S250-D254 PolarHBondContact O-N 3.42Å
251E96.2Very high94.6Very high87 Ų8749.9 Ų49.941%0.40727%0.268SS..Hα-helixtrans-62.6-38.6179.7-70.9-177.5-166.300112L238 Q247 T255L238-E251 HydrophobicContact CD1-CB 4.34Å; L238-E251 HydrophobicContact CD2-CB 4.41Å; L238-E251 VanDerWaalsContact CD2-OE2 3.31Å; L238-E251 WeakPolarHBondContact CD2-OE2 3.25Å; Q247-E251 PolarHBondContact O-N 3.42Å; E251-T255 WeakPolarHBondContact O-CB 3.42Å; E251-T255 PolarHBondContact O-N 2.88Å; E251-T255 PolarHBondContact O-OG1 3.24Å
252F96.5Very high94.7Very high0 Ų050.4 Ų50.40%028%0.275CS..Hα-helixtrans-67.5-42.9176.2-175.3-112.6000112.2L231 W235 L238 Q248 L249 S250 T255 L256 T285 M289L231-F252 WeakPolarHBondContact O-CE2 3.27Å; W235-F252 HydrophobicContact CB-CD2 3.99Å; W235-F252 HydrophobicContact CB-CE2 3.69Å; W235-F252 HydrophobicContact CB-CZ 4.07Å; W235-F252 HydrophobicContact CE3-CB 3.85Å; W235-F252 AromaticContact CE3-CD1 3.99Å; W235-F252 HydrophobicContact CE3-CD1 3.99Å; W235-F252 HydrophobicContact CE3-CD2 4.09Å; W235-F252 AromaticContact CE3-CG 3.69Å; W235-F252 HydrophobicContact CE3-CG 3.69Å; W235-F252 HydrophobicContact CZ3-CB 4.08Å; W235-F252 HydrophobicContact CZ3-CD1 4.48Å; W235-F252 HydrophobicContact CZ3-CG 4.31Å; L238-F252 HydrophobicContact CD1-CB 3.86Å; L238-F252 HydrophobicContact CD1-CD2 4.31Å; Q248-F252 VanDerWaalsContact O-CB 3.31Å; Q248-F252 WeakPolarHBondContact O-CB 3.45Å; Q248-F252 PolarHBondContact O-N 2.92Å; Q248-F252 VanDerWaalsContact O-N 3.13Å; L249-F252 PolarHBondContact O-N 3.44Å; S250-F252 VanDerWaalsContact C-N 3.3Å; S250-F252 PolarHBondContact O-N 3.27Å; F252-T255 CarbonylContact O-C 3.59Å; F252-T255 WeakPolarHBondContact O-CB 3.32Å; F252-T255 PolarHBondContact O-N 3.27Å; F252-L256 HydrophobicContact CD1-CD1 4.01Å; F252-L256 HydrophobicContact CD1-CG 4.22Å; F252-L256 HydrophobicContact CE1-CD1 3.49Å; F252-L256 VanDerWaalsContact CE1-CD1 3.49Å; F252-L256 HydrophobicContact CE1-CD2 4.19Å; F252-L256 HydrophobicContact CE1-CG 3.82Å; F252-L256 HydrophobicContact CE2-CD2 4.29Å; F252-L256 HydrophobicContact CE2-CG 4.38Å; F252-L256 HydrophobicContact CZ-CD1 4Å; F252-L256 HydrophobicContact CZ-CD2 3.81Å; F252-L256 HydrophobicContact CZ-CG 3.92Å; F252-L256 WeakPolarHBondContact O-CG 3.37Å; F252-L256 PolarHBondContact O-N 3.17Å; F252-T285 HydrophobicContact CZ-CG2 4.2Å; F252-M289 HydrophobicContact CD1-CE 3.64Å; F252-M289 HydrophobicContact CD1-SD 4.36Å; F252-M289 HydrophobicContact CE1-CE 3.3Å; F252-M289 HydrophobicContact CE1-CG 4.42Å; F252-M289 HydrophobicContact CE1-SD 3.54Å; F252-M289 VanDerWaalsContact CE1-SD 3.54Å; F252-M289 HydrophobicContact CZ-CE 3.98Å; F252-M289 HydrophobicContact CZ-CG 4.48Å; F252-M289 HydrophobicContact CZ-SD 4.16Å
253Y96.6Very high94.9Very high3 Ų341.3 Ų41.31%0.01223%0.232CC..Hα-helixtrans-65.1-38.5177-70.7-22.4000112.6L249 S250 T255 L256 L257 T319 T320 F323L249-Y253 HydrophobicContact CB-CD2 4.35Å; L249-Y253 HydrophobicContact CB-CE2 3.99Å; L249-Y253 HydrophobicContact CD2-CE2 4.48Å; L249-Y253 VanDerWaalsContact O-CB 3.27Å; L249-Y253 WeakPolarHBondContact O-CB 3.38Å; L249-Y253 VanDerWaalsContact O-CD2 3.26Å; L249-Y253 WeakPolarHBondContact O-CD2 3.32Å; L249-Y253 PolarHBondContact O-N 3.04Å; S250-Y253 PolarHBondContact O-N 2.61Å; Y253-T255 VanDerWaalsContact C-N 3.3Å; Y253-T255 PolarHBondContact O-N 3.4Å; Y253-L256 HydrophobicContact CD1-CD1 4.28Å; Y253-L256 PolarHBondContact O-N 2.92Å; Y253-L257 WeakPolarHBondContact O-CB 3.46Å; Y253-L257 PolarHBondContact O-N 3.21Å; Y253-T319 HydrophobicContact CD2-CG2 4.14Å; Y253-T319 HydrophobicContact CE2-CG2 4.45Å; Y253-T320 HydrophobicContact CE2-CG2 4.31Å; Y253-T320 PolarHBondContact OH-OG1 3.27Å; Y253-F323 AromaticContact CD1-CD1 3.69Å; Y253-F323 HydrophobicContact CD1-CD1 3.69Å; Y253-F323 AromaticContact CD1-CE1 3.83Å; Y253-F323 HydrophobicContact CD1-CE1 3.83Å; Y253-F323 HydrophobicContact CD1-CG 4.08Å; Y253-F323 HydrophobicContact CD1-CZ 4.33Å; Y253-F323 HydrophobicContact CD2-CB 3.81Å; Y253-F323 HydrophobicContact CD2-CD1 4.22Å; Y253-F323 HydrophobicContact CD2-CG 4.1Å; Y253-F323 HydrophobicContact CE1-CD1 4.13Å; Y253-F323 HydrophobicContact CE1-CE1 4.29Å; Y253-F323 HydrophobicContact CG-CB 3.87Å; Y253-F323 AromaticContact CG-CD1 3.75Å; Y253-F323 HydrophobicContact CG-CD1 3.75Å; Y253-F323 HydrophobicContact CG-CD2 4.18Å; Y253-F323 HydrophobicContact CG-CE1 4.28Å; Y253-F323 AromaticContact CG-CG 3.67Å; Y253-F323 HydrophobicContact CG-CG 3.67Å; Y253-F323 WeakPolarHBondContact O-CD2 3.38Å; Y253-F323 WeakPolarHBondContact O-CE2 3.49Å
254D96.6Very high95Very high99 Ų9939 Ų3953%0.52922%0.221SC..Hα-helixtrans-62.6-39.7171.4-70.9-27.9000111.5S250 L257 S258S250-D254 PolarHBondContact O-N 3.42Å; D254-L257 PolarHBondContact O-N 3.21Å; D254-S258 WeakPolarHBondContact O-CB 3.42Å; D254-S258 PolarHBondContact O-N 2.87Å; D254-S258 PolarHBondContact O-OG 2.88Å
255T96.4Very high95.1Very high40 Ų4042.5 Ų42.525%0.24523%0.231CC..Hα-helixtrans-64.7-41174.2-56.50000111.6L231 I234 E251 F252 Y253 S258 T259L231-T255 HydrophobicContact CD2-CG2 4.46Å; I234-T255 HydrophobicContact CD1-CG2 4.09Å; I234-T255 HydrophobicContact CG2-CG2 4.42Å; E251-T255 WeakPolarHBondContact O-CB 3.42Å; E251-T255 PolarHBondContact O-N 2.88Å; E251-T255 PolarHBondContact O-OG1 3.24Å; F252-T255 CarbonylContact O-C 3.59Å; F252-T255 WeakPolarHBondContact O-CB 3.32Å; F252-T255 PolarHBondContact O-N 3.27Å; Y253-T255 VanDerWaalsContact C-N 3.3Å; Y253-T255 PolarHBondContact O-N 3.4Å; T255-S258 WeakPolarHBondContact CA-OG 3.31Å; T255-S258 PolarHBondContact O-OG 3.04Å; T255-T259 VanDerWaalsContact O-CB 3.24Å; T255-T259 WeakPolarHBondContact O-CB 3.35Å; T255-T259 PolarHBondContact O-N 3.19Å; T255-T259 PolarHBondContact O-OG1 3.19Å
256L96Very high95.1Very high0 Ų042.4 Ų42.40%023%0.229CC..Hα-helixtrans-66.3-42.2175.8-72.3-174.5000112L231 F252 Y253 T259 W260 L282 T285 L286 F323L231-L256 HydrophobicContact CD1-CD2 4Å; L231-L256 HydrophobicContact CD2-CD2 4.22Å; F252-L256 HydrophobicContact CD1-CD1 4.01Å; F252-L256 HydrophobicContact CD1-CG 4.22Å; F252-L256 HydrophobicContact CE1-CD1 3.49Å; F252-L256 VanDerWaalsContact CE1-CD1 3.49Å; F252-L256 HydrophobicContact CE1-CD2 4.19Å; F252-L256 HydrophobicContact CE1-CG 3.82Å; F252-L256 HydrophobicContact CE2-CD2 4.29Å; F252-L256 HydrophobicContact CE2-CG 4.38Å; F252-L256 HydrophobicContact CZ-CD1 4Å; F252-L256 HydrophobicContact CZ-CD2 3.81Å; F252-L256 HydrophobicContact CZ-CG 3.92Å; F252-L256 WeakPolarHBondContact O-CG 3.37Å; F252-L256 PolarHBondContact O-N 3.17Å; Y253-L256 HydrophobicContact CD1-CD1 4.28Å; Y253-L256 PolarHBondContact O-N 2.92Å; L256-T259 PolarHBondContact O-N 3.32Å; L256-W260 WeakPolarHBondContact O-CB 3.5Å; L256-W260 PolarHBondContact O-N 2.96Å; L256-L282 HydrophobicContact CB-CD2 4.28Å; L256-L282 HydrophobicContact CD2-CD2 4Å; L256-T285 HydrophobicContact CD2-CG2 4.13Å; L256-L286 HydrophobicContact CD1-CD2 3.87Å; L256-L286 HydrophobicContact CD1-CG 4.46Å; L256-F323 HydrophobicContact CB-CE2 4.03Å; L256-F323 HydrophobicContact CB-CZ 3.77Å; L256-F323 HydrophobicContact CD1-CE1 4.39Å; L256-F323 HydrophobicContact CD1-CZ 4.03Å
257L96.2Very high95.1Very high30 Ų3040.7 Ų40.716%0.15722%0.22CC..Hα-helixtrans-65.4-46.6179.3-173.963.8000111.3Y253 D254 T259 W260 H261 F323 L327Y253-L257 WeakPolarHBondContact O-CB 3.46Å; Y253-L257 PolarHBondContact O-N 3.21Å; D254-L257 PolarHBondContact O-N 3.21Å; L257-T259 VanDerWaalsContact C-N 3.33Å; L257-T259 PolarHBondContact O-N 3.3Å; L257-W260 WeakPolarHBondContact O-CB 3.45Å; L257-W260 PolarHBondContact O-N 3.21Å; L257-H261 PolarHBondContact O-CD2 2.74Å; L257-H261 VanDerWaalsContact O-CD2 3.22Å; L257-H261 PolarHBondContact O-N 3.47Å; L257-H261 VanDerWaalsContact O-N 3.1Å; L257-F323 HydrophobicContact CB-CD2 4.37Å; L257-F323 HydrophobicContact CB-CE2 3.97Å; L257-L327 HydrophobicContact CD1-CD2 3.77Å; L257-L327 HydrophobicContact CD1-CG 4.23Å
258S96.2Very high95.1Very high68 Ų6839.1 Ų39.148%0.47622%0.22SC..Hα-helixtrans-62.6-40.7175.757.10000111.8D254 T255 W260 H261 A262D254-S258 WeakPolarHBondContact O-CB 3.42Å; D254-S258 PolarHBondContact O-N 2.87Å; D254-S258 PolarHBondContact O-OG 2.88Å; T255-S258 WeakPolarHBondContact CA-OG 3.31Å; T255-S258 PolarHBondContact O-OG 3.04Å; S258-W260 VanDerWaalsContact C-N 3.34Å; S258-W260 PolarHBondContact O-N 3.47Å; S258-H261 PolarHBondContact O-N 3.24Å; S258-A262 WeakPolarHBondContact O-CB 3.43Å; S258-A262 PolarHBondContact O-N 3.49Å
259T94.8Very high94.9Very high28 Ų2842.5 Ų42.517%0.17224%0.235CC..Hα-helixtrans-63-40.2173.7-58.90000111.4L231 T255 L256 L257 H261 A262 Q263L231-T259 HydrophobicContact CD1-CG2 4.24Å; L231-T259 HydrophobicContact CD2-CG2 4.18Å; T255-T259 VanDerWaalsContact O-CB 3.24Å; T255-T259 WeakPolarHBondContact O-CB 3.35Å; T255-T259 PolarHBondContact O-N 3.19Å; T255-T259 PolarHBondContact O-OG1 3.19Å; L256-T259 PolarHBondContact O-N 3.32Å; L257-T259 VanDerWaalsContact C-N 3.33Å; L257-T259 PolarHBondContact O-N 3.3Å; T259-H261 PolarHBondContact O-N 3.17Å; T259-A262 PolarHBondContact O-N 3.14Å; T259-Q263 HydrophobicContact CG2-CG 3.74Å; T259-Q263 VanDerWaalsContact O-CB 3.23Å; T259-Q263 WeakPolarHBondContact O-CB 3.31Å; T259-Q263 WeakPolarHBondContact O-CG 3.46Å; T259-Q263 PolarHBondContact O-N 3.32Å
260W94.8Very high94.8Very high6 Ų643.1 Ų43.12%0.02324%0.239CC..Hα-helixtrans-57.2-51.4175.7-179.292.3000111L256 L257 S258 A262 Q263 V264 Y275 V278 L282 L327 A330 M331L256-W260 WeakPolarHBondContact O-CB 3.5Å; L256-W260 PolarHBondContact O-N 2.96Å; L257-W260 WeakPolarHBondContact O-CB 3.45Å; L257-W260 PolarHBondContact O-N 3.21Å; S258-W260 VanDerWaalsContact C-N 3.34Å; S258-W260 PolarHBondContact O-N 3.47Å; W260-A262 PolarHBondContact O-N 2.77Å; W260-Q263 PolarHBondContact O-N 2.58Å; W260-V264 HydrophobicContact CD2-CG2 3.98Å; W260-V264 HydrophobicContact CE3-CG2 4.38Å; W260-V264 HydrophobicContact CG-CG2 4.45Å; W260-V264 HydrophobicContact CH2-CG2 4.25Å; W260-V264 HydrophobicContact CZ2-CG2 3.87Å; W260-V264 HydrophobicContact CZ3-CG2 4.48Å; W260-V264 WeakPolarHBondContact O-CB 3.36Å; W260-V264 VanDerWaalsContact O-CG2 3.26Å; W260-V264 WeakPolarHBondContact O-CG2 3.22Å; W260-V264 PolarHBondContact O-N 3.28Å; W260-Y275 HydrophobicContact CZ2-CD1 4.18Å; W260-V278 HydrophobicContact CB-CG1 4.34Å; W260-V278 VanDerWaalsContact CD1-CG1 3.43Å; W260-V278 HydrophobicContact CG-CG1 4.02Å; W260-L282 HydrophobicContact CB-CD1 4.32Å; W260-L282 HydrophobicContact CG-CD1 4.29Å; W260-L327 HydrophobicContact CB-CD2 4.47Å; W260-L327 HydrophobicContact CG-CD2 4.22Å; W260-A330 HydrophobicContact CE3-CB 4.08Å; W260-A330 HydrophobicContact CH2-CB 3.73Å; W260-A330 WeakPolarHBondContact CH2-O 3.4Å; W260-A330 HydrophobicContact CZ2-CB 4.47Å; W260-A330 HydrophobicContact CZ3-CB 3.51Å; W260-M331 HydrophobicContact CZ2-CG 3.75Å
261H94.9Very high94.7Very high95 Ų9541.6 Ų41.644%0.4423%0.227SC..Hα-helixtrans-59.5-47.7178.6-75.5-68.7000112.2L257 S258 T259 Q263 V264 Q265L257-H261 PolarHBondContact O-CD2 2.74Å; L257-H261 VanDerWaalsContact O-CD2 3.22Å; L257-H261 PolarHBondContact O-N 3.47Å; L257-H261 VanDerWaalsContact O-N 3.1Å; S258-H261 PolarHBondContact O-N 3.24Å; T259-H261 PolarHBondContact O-N 3.17Å; H261-Q263 PolarHBondContact O-N 3.16Å; H261-V264 PolarHBondContact O-N 3.21Å; H261-Q265 PolarHBondContact O-N 3.33Å; H261-Q265 VanDerWaalsContact O-N 3.14Å
262A94.5Very high94.2Very high52 Ų5246.3 Ų46.343%0.4325%0.246SC..Hα-helixtrans-63.2-43.5-179.800000112.1S258 T259 W260 Q265 W266S258-A262 WeakPolarHBondContact O-CB 3.43Å; S258-A262 PolarHBondContact O-N 3.49Å; T259-A262 PolarHBondContact O-N 3.14Å; W260-A262 PolarHBondContact O-N 2.77Å; A262-Q265 PolarHBondContact O-N 2.79Å; A262-W266 WeakPolarHBondContact O-CB 3.42Å; A262-W266 PolarHBondContact O-N 2.94Å
263Q94.1Very high93.8Very high15 Ų1550.7 Ų50.77%0.0727%0.27CS..Hα-helixtrans-74.7-32-178.4-67.9-61.8-32.500112.3Y223 T259 W260 H261 W266 S267 V278 L281Y223-Q263 PolarHBondContact OH-OE1 3.37Å; T259-Q263 HydrophobicContact CG2-CG 3.74Å; T259-Q263 VanDerWaalsContact O-CB 3.23Å; T259-Q263 WeakPolarHBondContact O-CB 3.31Å; T259-Q263 WeakPolarHBondContact O-CG 3.46Å; T259-Q263 PolarHBondContact O-N 3.32Å; W260-Q263 PolarHBondContact O-N 2.58Å; H261-Q263 PolarHBondContact O-N 3.16Å; Q263-W266 PolarHBondContact O-N 3.43Å; Q263-S267 WeakPolarHBondContact O-CA 3.33Å; Q263-S267 WeakPolarHBondContact O-CB 3.26Å; Q263-S267 PolarHBondContact O-N 3Å; Q263-S267 PolarHBondContact O-OG 3.14Å; Q263-V278 HydrophobicContact CB-CG1 4.11Å; Q263-V278 HydrophobicContact CB-CG2 3.76Å; Q263-L281 HydrophobicContact CG-CD2 4.36Å
264V93.5Very high93.5Very high16 Ų1651.3 Ų51.310%0.09727%0.274CS..Hα-helixtrans-63.4-46.3171.9167.10000109.9W260 H261 W266 S267 S268 Y275 V278W260-V264 HydrophobicContact CD2-CG2 3.98Å; W260-V264 HydrophobicContact CE3-CG2 4.38Å; W260-V264 HydrophobicContact CG-CG2 4.45Å; W260-V264 HydrophobicContact CH2-CG2 4.25Å; W260-V264 HydrophobicContact CZ2-CG2 3.87Å; W260-V264 HydrophobicContact CZ3-CG2 4.48Å; W260-V264 WeakPolarHBondContact O-CB 3.36Å; W260-V264 VanDerWaalsContact O-CG2 3.26Å; W260-V264 WeakPolarHBondContact O-CG2 3.22Å; W260-V264 PolarHBondContact O-N 3.28Å; H261-V264 PolarHBondContact O-N 3.21Å; V264-W266 VanDerWaalsContact C-N 3.34Å; V264-W266 PolarHBondContact O-N 3.18Å; V264-S267 WeakPolarHBondContact CA-OG 3.3Å; V264-S267 PolarHBondContact O-N 2.98Å; V264-S267 PolarHBondContact O-OG 3.26Å; V264-S268 WeakPolarHBondContact O-CB 3.4Å; V264-S268 PolarHBondContact O-N 2.98Å; V264-S268 PolarHBondContact O-OG 2.97Å; V264-Y275 HydrophobicContact CG1-CD1 3.88Å; V264-Y275 HydrophobicContact CG1-CE1 3.45Å; V264-Y275 VanDerWaalsContact CG1-CE1 3.45Å; V264-Y275 HydrophobicContact CG2-CD1 4.1Å; V264-Y275 HydrophobicContact CG2-CE1 4.43Å; V264-V278 HydrophobicContact CG2-CB 4Å; V264-V278 HydrophobicContact CG2-CG1 4.13Å; V264-V278 HydrophobicContact CG2-CG2 3.86Å
265Q93.2Very high93.2Very high134 Ų13448 Ų4863%0.62625%0.254SS*.Hα-helixtrans-62.2-40.3177.1-172.3-177.21.500112.4H261 A262 S268 Q269H261-Q265 PolarHBondContact O-N 3.33Å; H261-Q265 VanDerWaalsContact O-N 3.14Å; A262-Q265 PolarHBondContact O-N 2.79Å; Q265-S268 PolarHBondContact O-OG 3.5Å; Q265-Q269 PolarHBondContact O-NE2 3.46Å
266W94.6Very high93Very high19 Ų1948.7 Ų48.77%0.07226%0.255CS..Hα-helixtrans-72.7-47.5177.7-174.493.4000112.2F195 M198 A203 Y223 A262 Q263 V264 S268 Q269 V270 F271F195-W266 AromaticContact CD1-CH2 3.94Å; F195-W266 HydrophobicContact CD1-CH2 3.94Å; F195-W266 AromaticContact CE1-CH2 3.94Å; F195-W266 HydrophobicContact CE1-CH2 3.94Å; M198-W266 HydrophobicContact CE-CB 3.85Å; M198-W266 VanDerWaalsContact CE-CD1 3.44Å; M198-W266 HydrophobicContact CE-CD2 3.65Å; M198-W266 HydrophobicContact CE-CE3 4.37Å; M198-W266 HydrophobicContact CE-CG 3.37Å; M198-W266 PolarHBondContact O-NE1 3.12Å; M198-W266 HydrophobicContact SD-CD2 4.34Å; A203-W266 HydrophobicContact CB-CH2 3.83Å; A203-W266 HydrophobicContact CB-CZ2 3.74Å; Y223-W266 HydrophobicContact CD2-CZ3 4.18Å; Y223-W266 HydrophobicContact CE2-CE3 4.24Å; Y223-W266 AromaticContact CE2-CZ3 3.74Å; Y223-W266 HydrophobicContact CE2-CZ3 3.74Å; A262-W266 WeakPolarHBondContact O-CB 3.42Å; A262-W266 PolarHBondContact O-N 2.94Å; Q263-W266 PolarHBondContact O-N 3.43Å; V264-W266 VanDerWaalsContact C-N 3.34Å; V264-W266 PolarHBondContact O-N 3.18Å; W266-S268 VanDerWaalsContact C-N 3.31Å; W266-S268 PolarHBondContact O-N 2.9Å; W266-Q269 WeakPolarHBondContact O-CB 3.44Å; W266-Q269 PolarHBondContact O-N 3.3Å; W266-Q269 VanDerWaalsContact O-N 3.1Å; W266-V270 HydrophobicContact CD2-CG2 4.28Å; W266-V270 HydrophobicContact CE3-CG2 4.25Å; W266-V270 HydrophobicContact CH2-CB 4.26Å; W266-V270 HydrophobicContact CH2-CG1 4.02Å; W266-V270 HydrophobicContact CH2-CG2 3.9Å; W266-V270 HydrophobicContact CZ2-CG2 3.94Å; W266-V270 HydrophobicContact CZ3-CB 4.12Å; W266-V270 HydrophobicContact CZ3-CG1 4.15Å; W266-V270 HydrophobicContact CZ3-CG2 4.05Å; W266-F271 AromaticContact CZ3-CE2 3.92Å; W266-F271 HydrophobicContact CZ3-CE2 3.92Å
267S92.9Very high92.8Very high0 Ų049.1 Ų49.10%026%0.257CS..Hα-helixtrans-64.8-32-178.459.70000112.5Q263 V264 Q269 V270 F271 P274Q263-S267 WeakPolarHBondContact O-CA 3.33Å; Q263-S267 WeakPolarHBondContact O-CB 3.26Å; Q263-S267 PolarHBondContact O-N 3Å; Q263-S267 PolarHBondContact O-OG 3.14Å; V264-S267 WeakPolarHBondContact CA-OG 3.3Å; V264-S267 PolarHBondContact O-N 2.98Å; V264-S267 PolarHBondContact O-OG 3.26Å; S267-Q269 PolarHBondContact O-N 3.33Å; S267-Q269 VanDerWaalsContact O-N 3.12Å; S267-V270 PolarHBondContact O-N 3.36Å; S267-F271 PolarHBondContact O-N 3.39Å; S267-P274 WeakPolarHBondContact OG-CA 3.34Å; S267-P274 WeakPolarHBondContact OG-CB 3.18Å
268S92.3Very high92.7Very high66 Ų6647.7 Ų47.746%0.46225%0.25SS..THydrogen-bonded Turntrans-60.6-22175.265.20000113.6V264 Q265 W266V264-S268 WeakPolarHBondContact O-CB 3.4Å; V264-S268 PolarHBondContact O-N 2.98Å; V264-S268 PolarHBondContact O-OG 2.97Å; Q265-S268 PolarHBondContact O-OG 3.5Å; W266-S268 VanDerWaalsContact C-N 3.31Å; W266-S268 PolarHBondContact O-N 2.9Å
269Q92.7Very high92.6Very high89 Ų8944.5 Ų44.542%0.41623%0.228SC..THydrogen-bonded Turntrans-90.7-12.3177.8-61.1175.952.200112.9L200 K204 Q265 W266 S267L200-Q269 VanDerWaalsContact CD1-OE1 3.23Å; L200-Q269 HydrophobicContact CD2-CB 3.73Å; K204-Q269 WeakPolarHBondContact CE-O 3.33Å; Q265-Q269 PolarHBondContact O-NE2 3.46Å; W266-Q269 WeakPolarHBondContact O-CB 3.44Å; W266-Q269 PolarHBondContact O-N 3.3Å; W266-Q269 VanDerWaalsContact O-N 3.1Å; S267-Q269 PolarHBondContact O-N 3.33Å; S267-Q269 VanDerWaalsContact O-N 3.12Å
270V92.7Very high92.6Very high14 Ų1444.1 Ų44.19%0.08523%0.225CC..THydrogen-bonded Turntrans-121.1-45.2-168.4176.60000111.8L200 A203 V207 W266 S267L200-V270 HydrophobicContact CD2-CG2 3.71Å; L200-V270 HydrophobicContact CG-CG2 4.43Å; A203-V270 HydrophobicContact CB-CG1 4.07Å; A203-V270 HydrophobicContact CB-CG2 4.31Å; V207-V270 HydrophobicContact CG2-CG1 3.55Å; W266-V270 HydrophobicContact CD2-CG2 4.28Å; W266-V270 HydrophobicContact CE3-CG2 4.25Å; W266-V270 HydrophobicContact CH2-CB 4.26Å; W266-V270 HydrophobicContact CH2-CG1 4.02Å; W266-V270 HydrophobicContact CH2-CG2 3.9Å; W266-V270 HydrophobicContact CZ2-CG2 3.94Å; W266-V270 HydrophobicContact CZ3-CB 4.12Å; W266-V270 HydrophobicContact CZ3-CG1 4.15Å; W266-V270 HydrophobicContact CZ3-CG2 4.05Å; S267-V270 PolarHBondContact O-N 3.36Å
271F92.2Very high92.6Very high13 Ų1343.9 Ų43.96%0.05723%0.225CC..  trans-110155.6-176-60.3-63.2000112.1V207 M216 L220 Y223 W266 S267 V277V207-F271 HydrophobicContact CG2-CD1 3.91Å; V207-F271 HydrophobicContact CG2-CE1 3.63Å; V207-F271 HydrophobicContact CG2-CZ 4.47Å; M216-F271 HydrophobicContact CE-CD1 4.02Å; M216-F271 HydrophobicContact CE-CE1 4.15Å; L220-F271 HydrophobicContact CD2-CD1 4.05Å; L220-F271 HydrophobicContact CD2-CE1 3.67Å; L220-F271 HydrophobicContact CD2-CE2 4.29Å; L220-F271 HydrophobicContact CD2-CZ 3.81Å; Y223-F271 HydrophobicContact CD2-CE2 4.12Å; Y223-F271 HydrophobicContact CD2-CZ 4.37Å; Y223-F271 HydrophobicContact CE2-CE2 4.28Å; Y223-F271 HydrophobicContact CG-CE2 4.29Å; Y223-F271 HydrophobicContact CG-CZ 4.34Å; W266-F271 AromaticContact CZ3-CE2 3.92Å; W266-F271 HydrophobicContact CZ3-CE2 3.92Å; S267-F271 PolarHBondContact O-N 3.39Å; F271-V277 HydrophobicContact CB-CG2 4.35Å; F271-V277 HydrophobicContact CD2-CG1 4.08Å; F271-V277 HydrophobicContact CD2-CG2 4.34Å; F271-V277 HydrophobicContact CE2-CG1 4.18Å; F271-V277 HydrophobicContact CG-CG2 4.34Å
272K86.5Confident92.6Very high186 Ų18639.5 Ų39.581%0.80920%0.204SC*.SBendtrans-72.2-37.5178.5-66.1-178.7179.5175.80113.3P274K272-P274 VanDerWaalsContact C-CD 3.5Å; K272-P274 VanDerWaalsContact O-CD 3.25Å; K272-P274 WeakPolarHBondContact O-CD 3.21Å
273N88.6Confident92.7Very high91 Ų9138.4 Ų38.449%0.48719%0.191SC..  trans-116.574.1-178.3-66.4-3.3000110.7Y275 E276 V277N273-Y275 PolarHBondContact O-N 3.35Å; N273-E276 HydrophobicContact CB-CB 4.17Å; N273-E276 PolarHBondContact ND2-OE2 3.49Å; N273-E276 PolarHBondContact O-N 3.08Å; N273-V277 WeakPolarHBondContact O-CG2 3.27Å; N273-V277 PolarHBondContact O-N 2.86Å
274P90.5Very high92.7Very high16 Ų1641 Ų4110%0.10420%0.203CC..Hα-helixtrans-60.4-44.1-172.723.2-34000113.4S267 K272 E276 V277 V278S267-P274 WeakPolarHBondContact OG-CA 3.34Å; S267-P274 WeakPolarHBondContact OG-CB 3.18Å; K272-P274 VanDerWaalsContact C-CD 3.5Å; K272-P274 VanDerWaalsContact O-CD 3.25Å; K272-P274 WeakPolarHBondContact O-CD 3.21Å; P274-E276 PolarHBondContact O-N 2.97Å; P274-V277 PolarHBondContact O-N 3.44Å; P274-V278 WeakPolarHBondContact O-CG2 3.42Å; P274-V278 PolarHBondContact O-N 3.1Å
275Y90.3Very high92.8Very high30 Ų3040.2 Ų40.212%0.11820%0.198CC..Hα-helixtrans-67.4-39.8-176.3-56-79.7000113W260 V264 N273 V277 V278 T279 H334 E337 N338W260-Y275 HydrophobicContact CZ2-CD1 4.18Å; V264-Y275 HydrophobicContact CG1-CD1 3.88Å; V264-Y275 HydrophobicContact CG1-CE1 3.45Å; V264-Y275 VanDerWaalsContact CG1-CE1 3.45Å; V264-Y275 HydrophobicContact CG2-CD1 4.1Å; V264-Y275 HydrophobicContact CG2-CE1 4.43Å; N273-Y275 PolarHBondContact O-N 3.35Å; Y275-V277 VanDerWaalsContact C-N 3.35Å; Y275-V278 PolarHBondContact O-N 3.18Å; Y275-T279 VanDerWaalsContact O-CB 3.27Å; Y275-T279 WeakPolarHBondContact O-CB 3.35Å; Y275-T279 PolarHBondContact O-N 3.49Å; Y275-T279 PolarHBondContact O-OG1 3.38Å; Y275-H334 HydrophobicContact CD1-CB 4.28Å; Y275-H334 HydrophobicContact CD2-CB 4.3Å; Y275-H334 HydrophobicContact CE1-CB 3.88Å; Y275-H334 AromaticContact CE1-CD2 3.68Å; Y275-H334 AromaticContact CE1-CG 3.71Å; Y275-H334 HydrophobicContact CE2-CB 3.91Å; Y275-H334 AromaticContact CE2-CG 3.93Å; Y275-H334 HydrophobicContact CG-CB 4.49Å; Y275-H334 AromaticContact CZ-CD2 3.64Å; Y275-H334 AromaticContact CZ-CG 3.35Å; Y275-H334 AromaticContact CZ-ND1 3.65Å; Y275-H334 PolarHBondContact OH-CD2 3.29Å; Y275-H334 PolarHBondContact OH-CE1 3.27Å; Y275-H334 VanDerWaalsContact OH-CG 3.24Å; Y275-H334 PolarHBondContact OH-ND1 2.94Å; Y275-H334 VanDerWaalsContact OH-ND1 3.14Å; Y275-H334 PolarHBondContact OH-NE2 3.38Å; Y275-E337 HydrophobicContact CD2-CB 4.48Å; Y275-E337 VanDerWaalsContact CE2-OE2 3.31Å; Y275-E337 WeakPolarHBondContact CE2-OE2 3.41Å; Y275-N338 WeakPolarHBondContact CB-OD1 3.44Å
276E91.3Very high92.8Very high54 Ų5434.4 Ų34.425%0.25217%0.171SC..Hα-helixtrans-63.1-43.5174.6-177.3173.4-157.800110.8N273 P274 V278 T279 V280 N339 K342N273-E276 HydrophobicContact CB-CB 4.17Å; N273-E276 PolarHBondContact ND2-OE2 3.49Å; N273-E276 PolarHBondContact O-N 3.08Å; P274-E276 PolarHBondContact O-N 2.97Å; E276-V278 PolarHBondContact O-N 3.37Å; E276-T279 PolarHBondContact O-N 3.41Å; E276-V280 VanDerWaalsContact O-CG2 3.32Å; E276-V280 WeakPolarHBondContact O-CG2 3.26Å; E276-V280 PolarHBondContact O-N 2.93Å; E276-N339 HydrophobicContact CG-CB 4.14Å; E276-N339 PolarHBondContact OE1-ND2 3.25Å; E276-K342 HydrophobicContact CG-CG 4.43Å
277V92.9Very high92.8Very high9 Ų936.9 Ų36.96%0.05520%0.203CC..Hα-helixtrans-58.4-50.6177.9171.60000110.6L220 Y223 Y224 F271 N273 P274 Y275 V280 L281L220-V277 HydrophobicContact CD2-CG1 4.14Å; L220-V277 HydrophobicContact CD2-CG2 3.83Å; Y223-V277 HydrophobicContact CD1-CG1 3.95Å; Y223-V277 HydrophobicContact CE1-CG1 3.52Å; Y224-V277 HydrophobicContact CE1-CG1 4.03Å; Y224-V277 VanDerWaalsContact CE1-O 3.23Å; Y224-V277 WeakPolarHBondContact CE1-O 3.27Å; Y224-V277 WeakPolarHBondContact OH-CA 2.89Å; Y224-V277 PolarHBondContact OH-O 2.92Å; F271-V277 HydrophobicContact CB-CG2 4.35Å; F271-V277 HydrophobicContact CD2-CG1 4.08Å; F271-V277 HydrophobicContact CD2-CG2 4.34Å; F271-V277 HydrophobicContact CE2-CG1 4.18Å; F271-V277 HydrophobicContact CG-CG2 4.34Å; N273-V277 WeakPolarHBondContact O-CG2 3.27Å; N273-V277 PolarHBondContact O-N 2.86Å; P274-V277 PolarHBondContact O-N 3.44Å; Y275-V277 VanDerWaalsContact C-N 3.35Å; V277-V280 PolarHBondContact O-N 3.2Å; V277-L281 PolarHBondContact O-N 3.45Å
278V94.2Very high92.8Very high1 Ų138.6 Ų38.61%0.00622%0.215CC..Hα-helixtrans-69.3-35.4-178.7-176.30000112W260 Q263 V264 P274 Y275 E276 V280 L281 L282W260-V278 HydrophobicContact CB-CG1 4.34Å; W260-V278 VanDerWaalsContact CD1-CG1 3.43Å; W260-V278 HydrophobicContact CG-CG1 4.02Å; Q263-V278 HydrophobicContact CB-CG1 4.11Å; Q263-V278 HydrophobicContact CB-CG2 3.76Å; V264-V278 HydrophobicContact CG2-CB 4Å; V264-V278 HydrophobicContact CG2-CG1 4.13Å; V264-V278 HydrophobicContact CG2-CG2 3.86Å; P274-V278 WeakPolarHBondContact O-CG2 3.42Å; P274-V278 PolarHBondContact O-N 3.1Å; Y275-V278 PolarHBondContact O-N 3.18Å; E276-V278 PolarHBondContact O-N 3.37Å; V278-V280 VanDerWaalsContact C-N 3.34Å; V278-V280 PolarHBondContact O-N 3.2Å; V278-L281 WeakPolarHBondContact O-CB 3.26Å; V278-L281 PolarHBondContact O-N 2.79Å; V278-L282 PolarHBondContact O-N 3.01Å
279T93.2Very high92.7Very high0 Ų035.7 Ų35.70%019%0.194CC..Hα-helixtrans-59.8-46174.4-58.30000110.9Y275 E276 L281 L282 I283 M331 K342 L346Y275-T279 VanDerWaalsContact O-CB 3.27Å; Y275-T279 WeakPolarHBondContact O-CB 3.35Å; Y275-T279 PolarHBondContact O-N 3.49Å; Y275-T279 PolarHBondContact O-OG1 3.38Å; E276-T279 PolarHBondContact O-N 3.41Å; T279-L281 VanDerWaalsContact C-N 3.32Å; T279-L281 PolarHBondContact O-N 3.47Å; T279-L282 PolarHBondContact O-N 3.49Å; T279-I283 HydrophobicContact CG2-CD1 4.01Å; T279-I283 VanDerWaalsContact O-CG1 3.3Å; T279-I283 WeakPolarHBondContact O-CG1 3.49Å; T279-I283 PolarHBondContact O-N 3.12Å; T279-M331 HydrophobicContact CG2-CE 4.2Å; T279-M331 WeakPolarHBondContact OG1-CE 3.35Å; T279-K342 HydrophobicContact CG2-CB 4.02Å; T279-L346 HydrophobicContact CG2-CB 4.17Å; T279-L346 HydrophobicContact CG2-CD2 4.12Å
280V94.4Very high92.7Very high21 Ų2135.8 Ų35.813%0.12720%0.201CC..Hα-helixtrans-64.2-36.9176.3173.10000111.7Y224 E276 V277 V278 I283 Q284 K342Y224-V280 HydrophobicContact CD2-CG1 4.41Å; Y224-V280 HydrophobicContact CE1-CB 4.16Å; Y224-V280 HydrophobicContact CE1-CG1 4Å; Y224-V280 HydrophobicContact CE2-CG1 3.77Å; E276-V280 VanDerWaalsContact O-CG2 3.32Å; E276-V280 WeakPolarHBondContact O-CG2 3.26Å; E276-V280 PolarHBondContact O-N 2.93Å; V277-V280 PolarHBondContact O-N 3.2Å; V278-V280 VanDerWaalsContact C-N 3.34Å; V278-V280 PolarHBondContact O-N 3.2Å; V280-I283 PolarHBondContact O-N 3.02Å; V280-Q284 HydrophobicContact CG1-CG 4.31Å; V280-Q284 WeakPolarHBondContact O-CB 3.33Å; V280-Q284 WeakPolarHBondContact O-CG 3.43Å; V280-Q284 PolarHBondContact O-N 3.22Å; V280-K342 HydrophobicContact CG2-CD 4.21Å; V280-K342 HydrophobicContact CG2-CG 4.19Å
281L95.4Very high92.6Very high1 Ų137.2 Ų37.21%0.00521%0.21CC..Hα-helixtrans-59.7-46.2173.8174.964.8000111.5Y223 Y224 H227 K228 Q263 V277 V278 T279 Q284 T285Y223-L281 HydrophobicContact CE1-CD2 4.36Å; Y224-L281 HydrophobicContact CD1-CB 3.93Å; Y224-L281 HydrophobicContact CD1-CD1 4.16Å; Y224-L281 HydrophobicContact CE1-CB 4.04Å; H227-L281 HydrophobicContact CB-CD1 3.75Å; H227-L281 HydrophobicContact CB-CD2 3.95Å; K228-L281 HydrophobicContact CB-CD1 4.25Å; Q263-L281 HydrophobicContact CG-CD2 4.36Å; V277-L281 PolarHBondContact O-N 3.45Å; V278-L281 WeakPolarHBondContact O-CB 3.26Å; V278-L281 PolarHBondContact O-N 2.79Å; T279-L281 VanDerWaalsContact C-N 3.32Å; T279-L281 PolarHBondContact O-N 3.47Å; L281-Q284 PolarHBondContact O-N 3.35Å; L281-T285 WeakPolarHBondContact O-CB 3.42Å; L281-T285 PolarHBondContact O-N 2.87Å; L281-T285 PolarHBondContact O-OG1 3.07Å
282L95.4Very high92.7Very high3 Ų338.7 Ų38.72%0.01622%0.222CC..Hα-helixtrans-63.7-46.1177.7-67.9-174.2000111.8L256 W260 V278 T279 Q284 T285 L286 L327 L346L256-L282 HydrophobicContact CB-CD2 4.28Å; L256-L282 HydrophobicContact CD2-CD2 4Å; W260-L282 HydrophobicContact CB-CD1 4.32Å; W260-L282 HydrophobicContact CG-CD1 4.29Å; V278-L282 PolarHBondContact O-N 3.01Å; T279-L282 PolarHBondContact O-N 3.49Å; L282-Q284 VanDerWaalsContact C-N 3.34Å; L282-Q284 PolarHBondContact O-N 2.93Å; L282-T285 PolarHBondContact O-N 2.84Å; L282-L286 WeakPolarHBondContact O-CG 3.44Å; L282-L286 PolarHBondContact O-N 2.97Å; L282-L327 HydrophobicContact CD1-CD1 4.44Å; L282-L327 HydrophobicContact CD1-CD2 4.12Å; L282-L346 HydrophobicContact CB-CD1 3.83Å; L282-L346 HydrophobicContact CD1-CD2 4.23Å
283I95.4Very high93Very high29 Ų2930.1 Ų30.115%0.14919%0.185CC..Hα-helixtrans-56.1-49.8177-66.7161.9000110.6T279 V280 T285 G287 K342 E345 L346T279-I283 HydrophobicContact CG2-CD1 4.01Å; T279-I283 VanDerWaalsContact O-CG1 3.3Å; T279-I283 WeakPolarHBondContact O-CG1 3.49Å; T279-I283 PolarHBondContact O-N 3.12Å; V280-I283 PolarHBondContact O-N 3.02Å; I283-T285 VanDerWaalsContact C-N 3.31Å; I283-T285 PolarHBondContact O-N 3.26Å; I283-G287 PolarHBondContact O-N 3.43Å; I283-K342 HydrophobicContact CD1-CB 4.45Å; I283-K342 WeakPolarHBondContact CD1-O 3.25Å; I283-E345 HydrophobicContact CD1-CB 3.77Å; I283-E345 HydrophobicContact CG1-CB 4.47Å; I283-L346 HydrophobicContact CD1-CB 4.18Å; I283-L346 HydrophobicContact CG1-CB 3.78Å; I283-L346 HydrophobicContact CG1-CD1 4.07Å
284Q94.9Very high93.3Very high68 Ų6828.8 Ų28.832%0.31818%0.182SC..Hα-helixtrans-66.5-34.8-179.6-70.4-174.92300112.3K228 V280 L281 L282 S288K228-Q284 HydrophobicContact CD-CB 3.88Å; V280-Q284 HydrophobicContact CG1-CG 4.31Å; V280-Q284 WeakPolarHBondContact O-CB 3.33Å; V280-Q284 WeakPolarHBondContact O-CG 3.43Å; V280-Q284 PolarHBondContact O-N 3.22Å; L281-Q284 PolarHBondContact O-N 3.35Å; L282-Q284 VanDerWaalsContact C-N 3.34Å; L282-Q284 PolarHBondContact O-N 2.93Å; Q284-S288 WeakPolarHBondContact O-CB 3.31Å; Q284-S288 PolarHBondContact O-N 2.89Å; Q284-S288 VanDerWaalsContact O-N 3.09Å; Q284-S288 PolarHBondContact O-OG 2.81Å
285T95.4Very high93.4Very high0 Ų031.4 Ų31.40%020%0.197CC..Hα-helixtrans-64.3-55.6176.3-57.80000110.1L231 V232 F252 L256 L281 L282 I283 G287 S288 M289L231-T285 HydrophobicContact CB-CG2 3.55Å; L231-T285 HydrophobicContact CD1-CG2 3.94Å; L231-T285 HydrophobicContact CG-CG2 4.4Å; V232-T285 HydrophobicContact CG2-CG2 4.4Å; F252-T285 HydrophobicContact CZ-CG2 4.2Å; L256-T285 HydrophobicContact CD2-CG2 4.13Å; L281-T285 WeakPolarHBondContact O-CB 3.42Å; L281-T285 PolarHBondContact O-N 2.87Å; L281-T285 PolarHBondContact O-OG1 3.07Å; L282-T285 PolarHBondContact O-N 2.84Å; I283-T285 VanDerWaalsContact C-N 3.31Å; I283-T285 PolarHBondContact O-N 3.26Å; T285-G287 VanDerWaalsContact C-N 3.28Å; T285-G287 PolarHBondContact O-N 2.84Å; T285-S288 CarbonylContact O-C 3.25Å; T285-S288 PolarHBondContact O-N 3.44Å; T285-S288 PolarHBondContact O-OG 3.16Å; T285-M289 WeakPolarHBondContact O-CG 3.23Å; T285-M289 PolarHBondContact O-N 3.18Å; T285-M289 VanDerWaalsContact O-N 3.12Å
286L93.9Very high93.5Very high12 Ų1230.6 Ų30.66%0.06320%0.196CC..Hα-helixtrans-56.4-41.6177.6-67.5168.2000112L256 L282 S288 M289 I293 L346 A349 L350L256-L286 HydrophobicContact CD1-CD2 3.87Å; L256-L286 HydrophobicContact CD1-CG 4.46Å; L282-L286 WeakPolarHBondContact O-CG 3.44Å; L282-L286 PolarHBondContact O-N 2.97Å; L286-S288 VanDerWaalsContact C-N 3.29Å; L286-S288 PolarHBondContact O-N 2.83Å; L286-M289 HydrophobicContact CD2-SD 3.86Å; L286-I293 HydrophobicContact CD2-CD1 4.13Å; L286-L346 HydrophobicContact CD1-CD1 3.77Å; L286-A349 HydrophobicContact CB-CB 4.34Å; L286-A349 HydrophobicContact CD1-CB 4.12Å; L286-L350 HydrophobicContact CD1-CD2 3.56Å; L286-L350 HydrophobicContact CD1-CG 4.08Å; L286-L350 HydrophobicContact CD2-CD2 4.16Å
287G93.3Very high93.6Very high72 Ų7228 Ų2874%0.74218%0.184SC*.Hα-helixtrans-71.5-16.1177.900000115.3I283 T285I283-G287 PolarHBondContact O-N 3.43Å; T285-G287 VanDerWaalsContact C-N 3.28Å; T285-G287 PolarHBondContact O-N 2.84Å
288S93.6Very high93.6Very high35 Ų3529.3 Ų29.325%0.24519%0.193CC..Hα-helixtrans-112.98.7179.563.30000114.1K228 Q284 T285 L286 V290K228-S288 VanDerWaalsContact CD-OG 3.29Å; K228-S288 WeakPolarHBondContact CD-OG 3.42Å; K228-S288 WeakPolarHBondContact CG-OG 3.29Å; Q284-S288 WeakPolarHBondContact O-CB 3.31Å; Q284-S288 PolarHBondContact O-N 2.89Å; Q284-S288 VanDerWaalsContact O-N 3.09Å; Q284-S288 PolarHBondContact O-OG 2.81Å; T285-S288 CarbonylContact O-C 3.25Å; T285-S288 PolarHBondContact O-N 3.44Å; T285-S288 PolarHBondContact O-OG 3.16Å; L286-S288 VanDerWaalsContact C-N 3.29Å; L286-S288 PolarHBondContact O-N 2.83Å; S288-V290 PolarHBondContact O-N 3.31Å
289M91.2Very high93.5Very high5 Ų531.5 Ų31.53%0.02521%0.209CC..  trans-60132.3173.2-70.3176.575.400110.8W235 F252 T285 L286 P291 S292 I293W235-M289 HydrophobicContact CB-CE 4.3Å; W235-M289 HydrophobicContact CD2-CE 3.17Å; W235-M289 HydrophobicContact CE3-CE 3.6Å; W235-M289 HydrophobicContact CG-CE 3.48Å; W235-M289 VanDerWaalsContact CG-CE 3.48Å; W235-M289 HydrophobicContact CG-CG 4.46Å; W235-M289 HydrophobicContact CH2-CE 4.14Å; W235-M289 HydrophobicContact CZ2-CE 3.76Å; W235-M289 HydrophobicContact CZ3-CE 4.07Å; F252-M289 HydrophobicContact CD1-CE 3.64Å; F252-M289 HydrophobicContact CD1-SD 4.36Å; F252-M289 HydrophobicContact CE1-CE 3.3Å; F252-M289 HydrophobicContact CE1-CG 4.42Å; F252-M289 HydrophobicContact CE1-SD 3.54Å; F252-M289 VanDerWaalsContact CE1-SD 3.54Å; F252-M289 HydrophobicContact CZ-CE 3.98Å; F252-M289 HydrophobicContact CZ-CG 4.48Å; F252-M289 HydrophobicContact CZ-SD 4.16Å; T285-M289 WeakPolarHBondContact O-CG 3.23Å; T285-M289 PolarHBondContact O-N 3.18Å; T285-M289 VanDerWaalsContact O-N 3.12Å; L286-M289 HydrophobicContact CD2-SD 3.86Å; M289-P291 CarbonylContact C-O 3.6Å; M289-P291 CarbonylContact O-C 3.42Å; M289-S292 WeakPolarHBondContact O-CA 3.37Å; M289-S292 PolarHBondContact O-N 3.38Å; M289-I293 HydrophobicContact CE-CG1 4.35Å; M289-I293 HydrophobicContact SD-CD1 4.2Å; M289-I293 HydrophobicContact SD-CG1 4.1Å
290V90.8Very high93.4Very high91 Ų9131.9 Ų31.955%0.55221%0.212SC*.SBendtrans-131.1116.7173.7-178.50000107.7Q236 S288Q236-V290 WeakPolarHBondContact CG-O 3.45Å; S288-V290 PolarHBondContact O-N 3.31Å
291P92.1Very high93.3Very high44 Ų4431.4 Ų31.429%0.28621%0.208SC..SBendcis-63.3150.8-5.828.2-35000112.3W235 M289 V295 C296W235-P291 PolarHBondContact NE1-O 3.43Å; M289-P291 CarbonylContact C-O 3.6Å; M289-P291 CarbonylContact O-C 3.42Å; P291-V295 HydrophobicContact CB-CG1 4.25Å; P291-C296 VanDerWaalsContact CG-SG 3.52Å
292S94Very high93Very high45 Ų4538.8 Ų38.832%0.31524%0.243SC..  trans-77.2156.2178.466.60000111.3M289 P294 V295 C296M289-S292 WeakPolarHBondContact O-CA 3.37Å; M289-S292 PolarHBondContact O-N 3.38Å; S292-P294 VanDerWaalsContact C-N 3.35Å; S292-V295 WeakPolarHBondContact O-CB 3.29Å; S292-V295 PolarHBondContact O-N 3.24Å; S292-V295 WeakPolarHBondContact OG-CG2 3.4Å; S292-C296 PolarHBondContact O-N 2.81Å
293I92.8Very high92.8Very high5 Ų547.7 Ų47.73%0.02628%0.276CS..Hα-helixtrans-51.9-46.9179.1-60.2172.3000111.8L286 M289 V295 C296 L297 P353L286-I293 HydrophobicContact CD2-CD1 4.13Å; M289-I293 HydrophobicContact CE-CG1 4.35Å; M289-I293 HydrophobicContact SD-CD1 4.2Å; M289-I293 HydrophobicContact SD-CG1 4.1Å; I293-V295 VanDerWaalsContact C-N 3.31Å; I293-V295 PolarHBondContact O-N 2.98Å; I293-C296 PolarHBondContact O-N 2.82Å; I293-L297 HydrophobicContact CG2-CD1 3.95Å; I293-L297 HydrophobicContact CG2-CG 4.13Å; I293-L297 VanDerWaalsContact O-CG 3.31Å; I293-L297 WeakPolarHBondContact O-CG 3.44Å; I293-L297 PolarHBondContact O-N 3.36Å; I293-P353 HydrophobicContact CB-CB 4.34Å; I293-P353 HydrophobicContact CB-CG 4.27Å; I293-P353 HydrophobicContact CG2-CB 3.76Å; I293-P353 HydrophobicContact CG2-CG 4.07Å
294P93.7Very high92.5Very high64 Ų6447.1 Ų47.142%0.41628%0.275SS..Hα-helixtrans-59.3-36.4176.5-24.634.5000114.4S292 S298 P353S292-P294 VanDerWaalsContact C-N 3.35Å; P294-S298 WeakPolarHBondContact O-CB 3.37Å; P294-S298 PolarHBondContact O-N 2.82Å; P294-S298 PolarHBondContact O-OG 3.29Å; P294-P353 HydrophobicContact CG-CB 4.04Å; P294-P353 HydrophobicContact CG-CG 4.25Å
295V93.6Very high92.2Very high71 Ų7146.4 Ų46.443%0.4328%0.281SS..Hα-helixtrans-69.9-40.6177.2173.30000110.6P291 S292 I293 S298 S299P291-V295 HydrophobicContact CB-CG1 4.25Å; S292-V295 WeakPolarHBondContact O-CB 3.29Å; S292-V295 PolarHBondContact O-N 3.24Å; S292-V295 WeakPolarHBondContact OG-CG2 3.4Å; I293-V295 VanDerWaalsContact C-N 3.31Å; I293-V295 PolarHBondContact O-N 2.98Å; V295-S298 WeakPolarHBondContact CA-OG 3.47Å; V295-S298 PolarHBondContact O-OG 2.67Å; V295-S299 VanDerWaalsContact O-CB 3.31Å; V295-S299 WeakPolarHBondContact O-CB 3.33Å; V295-S299 PolarHBondContact O-N 3.14Å; V295-S299 PolarHBondContact O-OG 3.27Å
296C92.8Very high91.7Very high13 Ų1350.5 Ų50.59%0.08830%0.3CS..Hα-helixtrans-63.5-44.7174.5-66.80000112.1L245 P291 S292 I293 S299 A300L245-C296 HydrophobicContact CD1-CB 3.79Å; L245-C296 HydrophobicContact CD2-CB 4Å; L245-C296 WeakPolarHBondContact CD2-O 3.48Å; P291-C296 VanDerWaalsContact CG-SG 3.52Å; S292-C296 PolarHBondContact O-N 2.81Å; I293-C296 PolarHBondContact O-N 2.82Å; C296-S299 PolarHBondContact O-N 2.92Å; C296-A300 WeakPolarHBondContact O-CB 3.22Å; C296-A300 PolarHBondContact O-N 3.07Å
297L93Very high91.4Very high0 Ų055.1 Ų55.10%032%0.321CS..Hα-helixtrans-61.4-51177.9-69.5177.7000111.3I293 S299 A300 M301 L316 P353 Y354 Y357I293-L297 HydrophobicContact CG2-CD1 3.95Å; I293-L297 HydrophobicContact CG2-CG 4.13Å; I293-L297 VanDerWaalsContact O-CG 3.31Å; I293-L297 WeakPolarHBondContact O-CG 3.44Å; I293-L297 PolarHBondContact O-N 3.36Å; L297-S299 PolarHBondContact O-N 3.12Å; L297-A300 PolarHBondContact O-N 3.01Å; L297-A300 VanDerWaalsContact O-N 3.13Å; L297-M301 VanDerWaalsContact O-CG 3.26Å; L297-M301 WeakPolarHBondContact O-CG 3.29Å; L297-M301 PolarHBondContact O-N 3.45Å; L297-L316 HydrophobicContact CD2-CB 4.23Å; L297-L316 HydrophobicContact CD2-CD1 3.83Å; L297-P353 HydrophobicContact CD1-CB 3.89Å; L297-Y354 HydrophobicContact CD1-CD1 4.05Å; L297-Y354 HydrophobicContact CD1-CD2 4.4Å; L297-Y354 HydrophobicContact CD1-CE1 3.84Å; L297-Y354 HydrophobicContact CD1-CE2 4.2Å; L297-Y354 HydrophobicContact CD1-CG 4.32Å; L297-Y354 HydrophobicContact CD2-CE1 3.71Å; L297-Y354 HydrophobicContact CG-CE1 4.44Å; L297-Y357 HydrophobicContact CB-CE2 4.02Å; L297-Y357 HydrophobicContact CD1-CE2 4.34Å
298S93.1Very high91.1Very high35 Ų3557.5 Ų57.525%0.24531%0.313CS..Hα-helixtrans-58.1-46.5177.346.10000112.1P294 V295 A300 M301 E302 Y357P294-S298 WeakPolarHBondContact O-CB 3.37Å; P294-S298 PolarHBondContact O-N 2.82Å; P294-S298 PolarHBondContact O-OG 3.29Å; V295-S298 WeakPolarHBondContact CA-OG 3.47Å; V295-S298 PolarHBondContact O-OG 2.67Å; S298-A300 VanDerWaalsContact C-N 3.28Å; S298-A300 PolarHBondContact O-N 3.31Å; S298-M301 PolarHBondContact O-N 3.36Å; S298-M301 VanDerWaalsContact O-N 3.17Å; S298-E302 WeakPolarHBondContact O-CG 2.97Å; S298-E302 PolarHBondContact O-N 3.35Å; S298-Y357 WeakPolarHBondContact CA-OH 3.4Å; S298-Y357 PolarHBondContact N-OH 3.06Å
299S91.8Very high91Very high48 Ų4858.8 Ų58.834%0.33631%0.313SS..Hα-helixtrans-63.1-31.3176.9-56.10000113.3V295 C296 L297 R303V295-S299 VanDerWaalsContact O-CB 3.31Å; V295-S299 WeakPolarHBondContact O-CB 3.33Å; V295-S299 PolarHBondContact O-N 3.14Å; V295-S299 PolarHBondContact O-OG 3.27Å; C296-S299 PolarHBondContact O-N 2.92Å; L297-S299 PolarHBondContact O-N 3.12Å; S299-R303 VanDerWaalsContact O-CG 3.31Å; S299-R303 WeakPolarHBondContact O-CG 2.98Å; S299-R303 PolarHBondContact O-N 2.67Å; S299-R303 PolarHBondContact O-NE 2.86Å
300A91.1Very high91.1Very high8 Ų858.7 Ų58.77%0.06631%0.312CS..Hα-helixtrans-73.8-42.5173.700000111.6L245 C296 L297 S298 E302 R303 A304 L316L245-A300 HydrophobicContact CD2-CB 3.64Å; C296-A300 WeakPolarHBondContact O-CB 3.22Å; C296-A300 PolarHBondContact O-N 3.07Å; L297-A300 PolarHBondContact O-N 3.01Å; L297-A300 VanDerWaalsContact O-N 3.13Å; S298-A300 VanDerWaalsContact C-N 3.28Å; S298-A300 PolarHBondContact O-N 3.31Å; A300-E302 PolarHBondContact O-N 2.98Å; A300-R303 PolarHBondContact O-N 3.03Å; A300-A304 WeakPolarHBondContact O-CB 3.41Å; A300-A304 PolarHBondContact O-N 3.26Å; A300-L316 HydrophobicContact CB-CD1 4.32Å
301M91.6Very high91.1Very high10 Ų1057 Ų575%0.04930%0.301CS..Hα-helixtrans-66.6-35.5179-66.1-57.796.700112.7L297 S298 R309 C312 L313 L316 Y357L297-M301 VanDerWaalsContact O-CG 3.26Å; L297-M301 WeakPolarHBondContact O-CG 3.29Å; L297-M301 PolarHBondContact O-N 3.45Å; S298-M301 PolarHBondContact O-N 3.36Å; S298-M301 VanDerWaalsContact O-N 3.17Å; M301-R309 HydrophobicContact CB-CG 4.35Å; M301-R309 HydrophobicContact CG-CG 4.49Å; M301-R309 PolarHBondContact O-NE 3.15Å; M301-R309 HydrophobicContact SD-CG 3.49Å; M301-R309 WeakPolarHBondContact SD-CG 3.36Å; M301-C312 HydrophobicContact CE-CB 3.93Å; M301-C312 VanDerWaalsContact CE-SG 3.56Å; M301-L313 HydrophobicContact CE-CB 4.29Å; M301-L313 HydrophobicContact SD-CB 4.04Å; M301-L313 HydrophobicContact SD-CD1 4.44Å; M301-L316 HydrophobicContact CE-CD1 4.16Å; M301-Y357 HydrophobicContact CB-CE1 4.46Å; M301-Y357 HydrophobicContact CG-CD1 4.46Å; M301-Y357 HydrophobicContact CG-CE1 3.79Å
302E90.6Very high91.2Very high157 Ų15756.6 Ų56.673%0.73430%0.298SS*.Hα-helixtrans-69-37.1175.1-74.7176.9-174.800112.6S298 A300S298-E302 WeakPolarHBondContact O-CG 2.97Å; S298-E302 PolarHBondContact O-N 3.35Å; A300-E302 PolarHBondContact O-N 2.98Å
303R89.6Confident91.2Very high190 Ų19054.5 Ų54.572%0.71728%0.283SS*.Hα-helixtrans-76.4-30.1177.4-74.5-176.4-67.8157.7-3.8113.2S299 A300S299-R303 VanDerWaalsContact O-CG 3.31Å; S299-R303 WeakPolarHBondContact O-CG 2.98Å; S299-R303 PolarHBondContact O-N 2.67Å; S299-R303 PolarHBondContact O-NE 2.86Å; A300-R303 PolarHBondContact O-N 3.03Å
304A90.3Very high91.2Very high16 Ų1654.3 Ų54.313%0.13228%0.283CS..SBendtrans-68.8135.5-179.300000111.4A300 R309A300-A304 WeakPolarHBondContact O-CB 3.41Å; A300-A304 PolarHBondContact O-N 3.26Å; A304-R309 HydrophobicContact CB-CB 4.33Å; A304-R309 PolarHBondContact O-NH2 3.23Å
305A88.8Confident91.2Very high53 Ų5356.4 Ų56.444%0.43829%0.287SS..  trans-59149.6168.700000110.2E307 Q308 R309A305-E307 PolarHBondContact O-N 3.49Å; A305-E307 VanDerWaalsContact O-N 3.08Å; A305-Q308 PolarHBondContact O-N 3.21Å; A305-R309 PolarHBondContact O-N 2.83Å
306Q85.2Confident91.3Very high87 Ų8753.2 Ų53.241%0.40727%0.267SS..THydrogen-bonded Turntrans-52.8-36.6-177.1-172.3692200112.6Q308 I371Q306-Q308 VanDerWaalsContact C-N 3.34Å; Q306-Q308 PolarHBondContact O-N 2.89Å; Q306-I371 HydrophobicContact CB-CD1 4.22Å; Q306-I371 HydrophobicContact CG-CD1 3.66Å
307E86.2Confident91.3Very high108 Ų10853.2 Ų53.251%0.50527%0.266SS..THydrogen-bonded Turntrans-72.8-25.2-177.3-31-172.9168.600113.1A305 F368 I371A305-E307 PolarHBondContact O-N 3.49Å; A305-E307 VanDerWaalsContact O-N 3.08Å; E307-F368 VanDerWaalsContact O-CD2 3.26Å; E307-F368 WeakPolarHBondContact O-CD2 3.45Å; E307-F368 VanDerWaalsContact O-CE2 3.26Å; E307-F368 WeakPolarHBondContact O-CE2 3.34Å; E307-I371 HydrophobicContact CB-CG2 4.31Å; E307-I371 HydrophobicContact CG-CD1 4.3Å; E307-I371 HydrophobicContact CG-CG2 3.92Å
308Q88.1Confident91.4Very high123 Ų12357 Ų5758%0.57528%0.283SS*.THydrogen-bonded Turntrans-108.1-8.1-175.2-65.8177.9-13.900112.6A305 Q306 L310 D311 C312A305-Q308 PolarHBondContact O-N 3.21Å; Q306-Q308 VanDerWaalsContact C-N 3.34Å; Q306-Q308 PolarHBondContact O-N 2.89Å; Q308-L310 VanDerWaalsContact C-N 3.3Å; Q308-L310 PolarHBondContact O-N 3.42Å; Q308-D311 PolarHBondContact O-N 3.36Å; Q308-C312 WeakPolarHBondContact O-CB 3.2Å; Q308-C312 PolarHBondContact O-N 2.87Å
309R91.2Very high91.5Very high62 Ų6256.2 Ų56.223%0.23428%0.277CS..Hα-helixtrans-58.8-42.9-175.4-171.6176.6-67.6140.111.5112M301 A304 A305 L313M301-R309 HydrophobicContact CB-CG 4.35Å; M301-R309 HydrophobicContact CG-CG 4.49Å; M301-R309 PolarHBondContact O-NE 3.15Å; M301-R309 HydrophobicContact SD-CG 3.49Å; M301-R309 WeakPolarHBondContact SD-CG 3.36Å; A304-R309 HydrophobicContact CB-CB 4.33Å; A304-R309 PolarHBondContact O-NH2 3.23Å; A305-R309 PolarHBondContact O-N 2.83Å; R309-L313 WeakPolarHBondContact O-CB 3.26Å; R309-L313 PolarHBondContact O-N 2.9Å
310L92.2Very high91.6Very high2 Ų254 Ų541%0.0126%0.261CS..Hα-helixtrans-66.8-43.8178179.771.5000111.7Q308 L313 L314 Y361 L364 E365 F368Q308-L310 VanDerWaalsContact C-N 3.3Å; Q308-L310 PolarHBondContact O-N 3.42Å; L310-L313 PolarHBondContact O-N 2.91Å; L310-L314 HydrophobicContact CD1-CD1 4.34Å; L310-L314 HydrophobicContact CD2-CD1 4.41Å; L310-L314 HydrophobicContact CG-CD1 3.9Å; L310-L314 WeakPolarHBondContact O-CD1 3.15Å; L310-L314 VanDerWaalsContact O-CG 3.25Å; L310-L314 WeakPolarHBondContact O-CG 3.32Å; L310-L314 PolarHBondContact O-N 2.94Å; L310-Y361 HydrophobicContact CD1-CD2 4.1Å; L310-Y361 HydrophobicContact CD1-CE2 3.93Å; L310-L364 HydrophobicContact CD1-CB 4.27Å; L310-E365 WeakPolarHBondContact CD2-OE2 3.35Å; L310-F368 HydrophobicContact CB-CB 4.49Å; L310-F368 HydrophobicContact CB-CD2 4.37Å; L310-F368 HydrophobicContact CD2-CB 3.96Å; L310-F368 HydrophobicContact CD2-CD1 4.09Å; L310-F368 HydrophobicContact CD2-CD2 4.33Å; L310-F368 HydrophobicContact CD2-CG 3.87Å
311D91.9Very high91.7Very high57 Ų5754.5 Ų54.531%0.30527%0.265SS..Hα-helixtrans-63.5-43.6178.1-69.2-39.5000111.5Q308 L313 L314 E315Q308-D311 PolarHBondContact O-N 3.36Å; D311-L313 VanDerWaalsContact C-N 3.34Å; D311-L313 PolarHBondContact O-N 3.07Å; D311-L314 PolarHBondContact O-N 3.47Å; D311-E315 WeakPolarHBondContact O-CG 3.34Å; D311-E315 PolarHBondContact O-N 2.92Å
312C93.1Very high91.9Very high35 Ų3557.2 Ų57.224%0.23628%0.282CS..Hα-helixtrans-58.7-44.2174.1-177.10000111.8M301 Q308 E315 L316M301-C312 HydrophobicContact CE-CB 3.93Å; M301-C312 VanDerWaalsContact CE-SG 3.56Å; Q308-C312 WeakPolarHBondContact O-CB 3.2Å; Q308-C312 PolarHBondContact O-N 2.87Å; C312-E315 PolarHBondContact O-N 2.67Å; C312-L316 WeakPolarHBondContact O-CD1 3.1Å; C312-L316 VanDerWaalsContact O-CG 3.25Å; C312-L316 WeakPolarHBondContact O-CG 3.49Å; C312-L316 PolarHBondContact O-N 3.06Å; C312-L316 VanDerWaalsContact O-N 3.07Å
313L94.1Very high92.1Very high1 Ų150.1 Ų50.11%0.00525%0.249CC..Hα-helixtrans-62.3-43.2176.118068.1000111.8M301 R309 L310 D311 L316 H317 Y354 Y357 L364 L411M301-L313 HydrophobicContact CE-CB 4.29Å; M301-L313 HydrophobicContact SD-CB 4.04Å; M301-L313 HydrophobicContact SD-CD1 4.44Å; R309-L313 WeakPolarHBondContact O-CB 3.26Å; R309-L313 PolarHBondContact O-N 2.9Å; L310-L313 PolarHBondContact O-N 2.91Å; D311-L313 VanDerWaalsContact C-N 3.34Å; D311-L313 PolarHBondContact O-N 3.07Å; L313-L316 PolarHBondContact O-N 3.18Å; L313-H317 VanDerWaalsContact O-CB 3.32Å; L313-H317 WeakPolarHBondContact O-CB 3.34Å; L313-H317 PolarHBondContact O-N 2.94Å; L313-Y354 HydrophobicContact CD1-CD1 3.97Å; L313-Y354 HydrophobicContact CD1-CE1 4.29Å; L313-Y357 HydrophobicContact CD1-CD2 4.16Å; L313-Y357 HydrophobicContact CD1-CG 4.02Å; L313-Y357 HydrophobicContact CD2-CG 4.43Å; L313-L364 HydrophobicContact CD2-CD1 4.1Å; L313-L411 HydrophobicContact CD2-CD1 4.4Å; L313-L411 HydrophobicContact CD2-CD2 3.88Å; L313-L411 HydrophobicContact CG-CD1 4.24Å
314L93.6Very high92.3Very high1 Ų141.1 Ų41.11%0.00522%0.215CC..Hα-helixtrans-64.1-41.3179.5-72.9162.8000111.8L310 D311 Q318 R407 R410 L411L310-L314 HydrophobicContact CD1-CD1 4.34Å; L310-L314 HydrophobicContact CD2-CD1 4.41Å; L310-L314 HydrophobicContact CG-CD1 3.9Å; L310-L314 WeakPolarHBondContact O-CD1 3.15Å; L310-L314 VanDerWaalsContact O-CG 3.25Å; L310-L314 WeakPolarHBondContact O-CG 3.32Å; L310-L314 PolarHBondContact O-N 2.94Å; D311-L314 PolarHBondContact O-N 3.47Å; L314-Q318 VanDerWaalsContact O-CB 3.23Å; L314-Q318 WeakPolarHBondContact O-CB 3.41Å; L314-Q318 PolarHBondContact O-N 3.44Å; L314-R407 HydrophobicContact CD1-CB 4.03Å; L314-R407 HydrophobicContact CD1-CG 3.67Å; L314-R410 HydrophobicContact CD2-CB 4.44Å; L314-L411 HydrophobicContact CD2-CB 3.63Å; L314-L411 HydrophobicContact CD2-CD1 4.19Å; L314-L411 HydrophobicContact CD2-CD2 4.44Å; L314-L411 HydrophobicContact CD2-CG 4.28Å
315E94.1Very high92.4Very high108 Ų10845.4 Ų45.451%0.50523%0.232SC..Hα-helixtrans-62.5-48.3175.4-78.4-175-170.700112.2D311 C312 H317 Q318 T319D311-E315 WeakPolarHBondContact O-CG 3.34Å; D311-E315 PolarHBondContact O-N 2.92Å; C312-E315 PolarHBondContact O-N 2.67Å; E315-H317 PolarHBondContact O-N 3.42Å; E315-Q318 WeakPolarHBondContact O-CB 3.44Å; E315-Q318 PolarHBondContact O-N 3.2Å; E315-T319 PolarHBondContact O-N 3.31Å; E315-T319 PolarHBondContact O-OG1 3.34Å
316L94.3Very high92.7Very high3 Ų345.4 Ų45.42%0.01623%0.229CC..Hα-helixtrans-63.7-42.5179.2-67.1166.7000111.8L245 N246 L249 L297 A300 M301 C312 L313 T319 T320 Y354L245-L316 HydrophobicContact CB-CD2 4.27Å; L245-L316 HydrophobicContact CD2-CD1 4.08Å; L245-L316 HydrophobicContact CD2-CD2 3.94Å; L245-L316 HydrophobicContact CG-CD2 3.84Å; N246-L316 HydrophobicContact CB-CD2 4.03Å; L249-L316 HydrophobicContact CD1-CD2 3.88Å; L297-L316 HydrophobicContact CD2-CB 4.23Å; L297-L316 HydrophobicContact CD2-CD1 3.83Å; A300-L316 HydrophobicContact CB-CD1 4.32Å; M301-L316 HydrophobicContact CE-CD1 4.16Å; C312-L316 WeakPolarHBondContact O-CD1 3.1Å; C312-L316 VanDerWaalsContact O-CG 3.25Å; C312-L316 WeakPolarHBondContact O-CG 3.49Å; C312-L316 PolarHBondContact O-N 3.06Å; C312-L316 VanDerWaalsContact O-N 3.07Å; L313-L316 PolarHBondContact O-N 3.18Å; L316-T319 PolarHBondContact O-N 2.77Å; L316-T320 PolarHBondContact O-N 3.25Å; L316-T320 VanDerWaalsContact O-N 3.09Å; L316-T320 PolarHBondContact O-OG1 3.37Å; L316-Y354 HydrophobicContact CB-CE1 4.19Å; L316-Y354 PolarHBondContact O-OH 3.17Å; L316-Y354 VanDerWaalsContact O-OH 3.09Å
317H94.4Very high93.1Very high14 Ų1441.2 Ų41.27%0.06521%0.209CC..Hα-helixtrans-64.6-41.4175.4-17469.7000111.8L313 E315 T319 T320 S321 Y354 L411L313-H317 VanDerWaalsContact O-CB 3.32Å; L313-H317 WeakPolarHBondContact O-CB 3.34Å; L313-H317 PolarHBondContact O-N 2.94Å; E315-H317 PolarHBondContact O-N 3.42Å; H317-T319 PolarHBondContact O-N 2.91Å; H317-T320 PolarHBondContact O-N 3.38Å; H317-S321 WeakPolarHBondContact O-CB 3.35Å; H317-S321 PolarHBondContact O-N 3.02Å; H317-Y354 HydrophobicContact CB-CD1 4.04Å; H317-Y354 HydrophobicContact CB-CE1 3.96Å; H317-Y354 AromaticContact ND1-CD1 3.87Å; H317-Y354 AromaticContact ND1-CG 3.71Å; H317-L411 HydrophobicContact CB-CD1 3.63Å; H317-L411 PolarHBondContact NE2-O 2.82Å
318Q94.4Very high93.3Very high79 Ų7937.2 Ų37.237%0.36919%0.191SC..Hα-helixtrans-58.7-46.6176.6-175.864.148.700111.1L314 E315 T320 S321 T322L314-Q318 VanDerWaalsContact O-CB 3.23Å; L314-Q318 WeakPolarHBondContact O-CB 3.41Å; L314-Q318 PolarHBondContact O-N 3.44Å; E315-Q318 WeakPolarHBondContact O-CB 3.44Å; E315-Q318 PolarHBondContact O-N 3.2Å; Q318-T320 VanDerWaalsContact C-N 3.3Å; Q318-T320 PolarHBondContact O-N 3.14Å; Q318-S321 PolarHBondContact O-N 3.27Å; Q318-T322 WeakPolarHBondContact O-CG2 3.33Å; Q318-T322 PolarHBondContact O-N 2.71Å; Q318-T322 PolarHBondContact O-OG1 3.48Å
319T95.1Very high93.5Very high19 Ų1934.6 Ų34.612%0.11719%0.19CC..Hα-helixtrans-62.2-37177.5-59.60000112.3N246 Y253 E315 L316 H317 T322 F323N246-T319 WeakPolarHBondContact OD1-CB 3.14Å; N246-T319 PolarHBondContact OD1-OG1 2.98Å; Y253-T319 HydrophobicContact CD2-CG2 4.14Å; Y253-T319 HydrophobicContact CE2-CG2 4.45Å; E315-T319 PolarHBondContact O-N 3.31Å; E315-T319 PolarHBondContact O-OG1 3.34Å; L316-T319 PolarHBondContact O-N 2.77Å; H317-T319 PolarHBondContact O-N 2.91Å; T319-T322 WeakPolarHBondContact CA-OG1 3.08Å; T319-T322 PolarHBondContact O-OG1 3.35Å; T319-F323 PolarHBondContact O-N 3.31Å
320T94.8Very high93.4Very high0 Ų032.5 Ų32.50%019%0.186CC..Hα-helixtrans-70.5-40.1174.9-50.40000111.6Y253 L316 H317 Q318 F323 G324 L350 Y354Y253-T320 HydrophobicContact CE2-CG2 4.31Å; Y253-T320 PolarHBondContact OH-OG1 3.27Å; L316-T320 PolarHBondContact O-N 3.25Å; L316-T320 VanDerWaalsContact O-N 3.09Å; L316-T320 PolarHBondContact O-OG1 3.37Å; H317-T320 PolarHBondContact O-N 3.38Å; Q318-T320 VanDerWaalsContact C-N 3.3Å; Q318-T320 PolarHBondContact O-N 3.14Å; T320-F323 PolarHBondContact O-N 3.19Å; T320-G324 PolarHBondContact O-N 3Å; T320-L350 HydrophobicContact CG2-CB 4.43Å; T320-Y354 HydrophobicContact CG2-CE2 3.91Å; T320-Y354 WeakPolarHBondContact OG1-CE2 3.49Å; T320-Y354 PolarHBondContact OG1-OH 3.02Å
321S92.8Very high93.3Very high19 Ų1932.4 Ų32.413%0.13319%0.185CC..Hα-helixtrans-66.7-41.5178.1175.80000111.8H317 Q318 F323 G324 H325H317-S321 WeakPolarHBondContact O-CB 3.35Å; H317-S321 PolarHBondContact O-N 3.02Å; Q318-S321 PolarHBondContact O-N 3.27Å; S321-F323 VanDerWaalsContact C-N 3.32Å; S321-F323 PolarHBondContact O-N 3.1Å; S321-G324 PolarHBondContact O-N 3.08Å; S321-H325 PolarHBondContact O-CD2 2.86Å; S321-H325 VanDerWaalsContact O-CD2 3.26Å; S321-H325 PolarHBondContact O-N 2.9Å
322T94.6Very high93Very high68 Ų6834.2 Ų34.242%0.41719%0.194SC..Hα-helixtrans-60.1-43.8174.148.80000111.4Q318 T319 H325 S326Q318-T322 WeakPolarHBondContact O-CG2 3.33Å; Q318-T322 PolarHBondContact O-N 2.71Å; Q318-T322 PolarHBondContact O-OG1 3.48Å; T319-T322 WeakPolarHBondContact CA-OG1 3.08Å; T319-T322 PolarHBondContact O-OG1 3.35Å; T322-H325 PolarHBondContact O-N 3.45Å; T322-S326 PolarHBondContact O-N 3.23Å; T322-S326 PolarHBondContact O-OG 2.97Å; T322-S326 VanDerWaalsContact O-OG 3.07Å
323F96Very high92.6Very high8 Ų837.3 Ų37.34%0.03521%0.214CC..Hα-helixtrans-63-44.6174.5172.8-118.1000112.3Y253 L256 L257 T319 T320 S321 H325 S326 L327 L350Y253-F323 AromaticContact CD1-CD1 3.69Å; Y253-F323 HydrophobicContact CD1-CD1 3.69Å; Y253-F323 AromaticContact CD1-CE1 3.83Å; Y253-F323 HydrophobicContact CD1-CE1 3.83Å; Y253-F323 HydrophobicContact CD1-CG 4.08Å; Y253-F323 HydrophobicContact CD1-CZ 4.33Å; Y253-F323 HydrophobicContact CD2-CB 3.81Å; Y253-F323 HydrophobicContact CD2-CD1 4.22Å; Y253-F323 HydrophobicContact CD2-CG 4.1Å; Y253-F323 HydrophobicContact CE1-CD1 4.13Å; Y253-F323 HydrophobicContact CE1-CE1 4.29Å; Y253-F323 HydrophobicContact CG-CB 3.87Å; Y253-F323 AromaticContact CG-CD1 3.75Å; Y253-F323 HydrophobicContact CG-CD1 3.75Å; Y253-F323 HydrophobicContact CG-CD2 4.18Å; Y253-F323 HydrophobicContact CG-CE1 4.28Å; Y253-F323 AromaticContact CG-CG 3.67Å; Y253-F323 HydrophobicContact CG-CG 3.67Å; Y253-F323 WeakPolarHBondContact O-CD2 3.38Å; Y253-F323 WeakPolarHBondContact O-CE2 3.49Å; L256-F323 HydrophobicContact CB-CE2 4.03Å; L256-F323 HydrophobicContact CB-CZ 3.77Å; L256-F323 HydrophobicContact CD1-CE1 4.39Å; L256-F323 HydrophobicContact CD1-CZ 4.03Å; L257-F323 HydrophobicContact CB-CD2 4.37Å; L257-F323 HydrophobicContact CB-CE2 3.97Å; T319-F323 PolarHBondContact O-N 3.31Å; T320-F323 PolarHBondContact O-N 3.19Å; S321-F323 VanDerWaalsContact C-N 3.32Å; S321-F323 PolarHBondContact O-N 3.1Å; F323-H325 PolarHBondContact O-N 2.74Å; F323-S326 PolarHBondContact O-N 2.95Å; F323-L327 HydrophobicContact CD1-CD1 4.15Å; F323-L327 HydrophobicContact CD2-CD1 4.45Å; F323-L327 HydrophobicContact CD2-CG 4.35Å; F323-L327 HydrophobicContact CE1-CD1 3.5Å; F323-L327 HydrophobicContact CE1-CG 4.37Å; F323-L327 HydrophobicContact CE2-CD1 3.85Å; F323-L327 HydrophobicContact CE2-CD2 4.33Å; F323-L327 HydrophobicContact CE2-CG 3.88Å; F323-L327 HydrophobicContact CZ-CD1 3.34Å; F323-L327 HydrophobicContact CZ-CD2 4.39Å; F323-L327 HydrophobicContact CZ-CG 3.91Å; F323-L327 PolarHBondContact O-N 2.98Å; F323-L350 HydrophobicContact CD1-CD1 4.24Å; F323-L350 HydrophobicContact CD1-CD2 3.91Å; F323-L350 HydrophobicContact CE1-CD1 4.1Å; F323-L350 HydrophobicContact CE1-CD2 3.65Å
324G93.8Very high92Very high0 Ų040 Ų400%023%0.227CC..Hα-helixtrans-58.6-44.717600000112.6T320 S321 L327 E328 W528T320-G324 PolarHBondContact O-N 3Å; S321-G324 PolarHBondContact O-N 3.08Å; G324-L327 PolarHBondContact O-N 3.05Å; G324-E328 WeakPolarHBondContact O-CB 3.44Å; G324-E328 PolarHBondContact O-N 3.25Å; G324-W528 WeakPolarHBondContact O-CZ3 3.11Å
325H92.6Very high91.2Very high106 Ų10641 Ų4149%0.49123%0.232SC..Hα-helixtrans-66.2-36.6175.1-75.8-50.4000113S321 T322 F323 E328 A329S321-H325 PolarHBondContact O-CD2 2.86Å; S321-H325 VanDerWaalsContact O-CD2 3.26Å; S321-H325 PolarHBondContact O-N 2.9Å; T322-H325 PolarHBondContact O-N 3.45Å; F323-H325 PolarHBondContact O-N 2.74Å; H325-E328 IonicContact ND1-OE2 2.82Å; H325-E328 PolarHBondContact ND1-OE2 3.35Å; H325-E328 PolarHBondContact O-N 2.92Å; H325-A329 VanDerWaalsContact O-CB 3.31Å; H325-A329 WeakPolarHBondContact O-CB 3.2Å; H325-A329 PolarHBondContact O-N 3.33Å
326S94.3Very high90.1Very high53 Ų5339.6 Ų39.637%0.37125%0.246SC..Hα-helixtrans-64.3-41.7173.3-630000112T322 F323 A330T322-S326 PolarHBondContact O-N 3.23Å; T322-S326 PolarHBondContact O-OG 2.97Å; T322-S326 VanDerWaalsContact O-OG 3.07Å; F323-S326 PolarHBondContact O-N 2.95Å; S326-A330 WeakPolarHBondContact O-CB 3.24Å; S326-A330 PolarHBondContact O-N 3.28Å
327L92.9Very high89.2Confident0 Ų046 Ų460%028%0.276CS..Hα-helixtrans-65.9-43.7173.7-78.2177.7000112.2L257 W260 L282 F323 G324 A329 A330 M331 L346 L350 W528L257-L327 HydrophobicContact CD1-CD2 3.77Å; L257-L327 HydrophobicContact CD1-CG 4.23Å; W260-L327 HydrophobicContact CB-CD2 4.47Å; W260-L327 HydrophobicContact CG-CD2 4.22Å; L282-L327 HydrophobicContact CD1-CD1 4.44Å; L282-L327 HydrophobicContact CD1-CD2 4.12Å; F323-L327 HydrophobicContact CD1-CD1 4.15Å; F323-L327 HydrophobicContact CD2-CD1 4.45Å; F323-L327 HydrophobicContact CD2-CG 4.35Å; F323-L327 HydrophobicContact CE1-CD1 3.5Å; F323-L327 HydrophobicContact CE1-CG 4.37Å; F323-L327 HydrophobicContact CE2-CD1 3.85Å; F323-L327 HydrophobicContact CE2-CD2 4.33Å; F323-L327 HydrophobicContact CE2-CG 3.88Å; F323-L327 HydrophobicContact CZ-CD1 3.34Å; F323-L327 HydrophobicContact CZ-CD2 4.39Å; F323-L327 HydrophobicContact CZ-CG 3.91Å; F323-L327 PolarHBondContact O-N 2.98Å; G324-L327 PolarHBondContact O-N 3.05Å; L327-A329 PolarHBondContact O-N 3.38Å; L327-A330 PolarHBondContact O-N 3.21Å; L327-M331 WeakPolarHBondContact O-CB 3.23Å; L327-M331 VanDerWaalsContact O-CG 3.31Å; L327-M331 WeakPolarHBondContact O-CG 3.22Å; L327-M331 PolarHBondContact O-N 3.01Å; L327-L346 HydrophobicContact CD1-CD2 4.39Å; L327-L350 HydrophobicContact CD1-CD1 4.05Å; L327-W528 HydrophobicContact CB-CH2 3.65Å; L327-W528 HydrophobicContact CB-CZ2 3.86Å; L327-W528 HydrophobicContact CB-CZ3 4.44Å; L327-W528 HydrophobicContact CD1-CH2 3.93Å; L327-W528 HydrophobicContact CG-CH2 4.49Å
328E91.9Very high88.4Confident24 Ų2446 Ų4611%0.11228%0.276CS..Hα-helixtrans-56.4-51.2174.7-179-177.1-168.800110.3G324 H325 A330 M331 L332 N526 W528 Q529G324-E328 WeakPolarHBondContact O-CB 3.44Å; G324-E328 PolarHBondContact O-N 3.25Å; H325-E328 IonicContact ND1-OE2 2.82Å; H325-E328 PolarHBondContact ND1-OE2 3.35Å; H325-E328 PolarHBondContact O-N 2.92Å; E328-A330 VanDerWaalsContact C-N 3.27Å; E328-A330 PolarHBondContact O-N 3.32Å; E328-M331 PolarHBondContact O-N 3.45Å; E328-M331 VanDerWaalsContact O-N 3.16Å; E328-L332 VanDerWaalsContact O-CB 3.29Å; E328-L332 WeakPolarHBondContact O-CB 3.27Å; E328-L332 PolarHBondContact O-N 3.41Å; E328-N526 PolarHBondContact OE1-ND2 3.12Å; E328-W528 HydrophobicContact CB-CB 4.17Å; E328-W528 HydrophobicContact CB-CD2 3.82Å; E328-W528 HydrophobicContact CB-CE3 4.25Å; E328-W528 HydrophobicContact CB-CG 3.75Å; E328-W528 HydrophobicContact CG-CB 3.75Å; E328-W528 HydrophobicContact CG-CD2 4.31Å; E328-W528 HydrophobicContact CG-CG 3.69Å; E328-Q529 WeakPolarHBondContact OE1-CG 3.46Å; E328-Q529 PolarHBondContact OE1-NE2 3.36Å; E328-Q529 VanDerWaalsContact OE1-NE2 3.1Å
329A91.4Very high87.9Confident67 Ų6744.8 Ų44.855%0.55427%0.273SS*.Hα-helixtrans-60.2-36.5179.200000112.6H325 L327 P333H325-A329 VanDerWaalsContact O-CB 3.31Å; H325-A329 WeakPolarHBondContact O-CB 3.2Å; H325-A329 PolarHBondContact O-N 3.33Å; L327-A329 PolarHBondContact O-N 3.38Å; A329-P333 WeakPolarHBondContact O-CD 3.48Å
330A89.8Confident87.5Confident19 Ų1946.5 Ų46.516%0.15728%0.281CS..Hα-helixtrans-73.3-34.2177.400000112.8W260 S326 L327 E328W260-A330 HydrophobicContact CE3-CB 4.08Å; W260-A330 HydrophobicContact CH2-CB 3.73Å; W260-A330 WeakPolarHBondContact CH2-O 3.4Å; W260-A330 HydrophobicContact CZ2-CB 4.47Å; W260-A330 HydrophobicContact CZ3-CB 3.51Å; S326-A330 WeakPolarHBondContact O-CB 3.24Å; S326-A330 PolarHBondContact O-N 3.28Å; L327-A330 PolarHBondContact O-N 3.21Å; E328-A330 VanDerWaalsContact C-N 3.27Å; E328-A330 PolarHBondContact O-N 3.32Å
331M88.8Confident87.2Confident0 Ų052.6 Ų52.60%031%0.313CS..Hα-helixtrans-86.7-25.2-179.2-72.1-177.1143.600114W260 T279 L327 E328 P333 H334 L335 V343 L346 W528W260-M331 HydrophobicContact CZ2-CG 3.75Å; T279-M331 HydrophobicContact CG2-CE 4.2Å; T279-M331 WeakPolarHBondContact OG1-CE 3.35Å; L327-M331 WeakPolarHBondContact O-CB 3.23Å; L327-M331 VanDerWaalsContact O-CG 3.31Å; L327-M331 WeakPolarHBondContact O-CG 3.22Å; L327-M331 PolarHBondContact O-N 3.01Å; E328-M331 PolarHBondContact O-N 3.45Å; E328-M331 VanDerWaalsContact O-N 3.16Å; M331-P333 VanDerWaalsContact C-CD 3.45Å; M331-H334 CarbonylContact O-C 3.53Å; M331-H334 PolarHBondContact O-N 3.34Å; M331-L335 PolarHBondContact O-N 3.01Å; M331-L335 VanDerWaalsContact O-N 3.12Å; M331-V343 HydrophobicContact SD-CG1 4.44Å; M331-L346 HydrophobicContact CE-CD2 4.07Å; M331-L346 HydrophobicContact SD-CD2 4.43Å; M331-W528 HydrophobicContact SD-CZ2 3.87Å
332L86.3Confident87.1Confident94 Ų9454.4 Ų54.449%0.49232%0.318SS..G310 helixtrans-54.5-43.5-174.5-167.172.8000113.7E328 H334 L335E328-L332 VanDerWaalsContact O-CB 3.29Å; E328-L332 WeakPolarHBondContact O-CB 3.27Å; E328-L332 PolarHBondContact O-N 3.41Å; L332-H334 PolarHBondContact O-N 3Å; L332-L335 PolarHBondContact O-N 2.95Å
333P84.9Confident86.9Confident100 Ų10051.1 Ų51.165%0.64930%0.298SS*.G310 helixtrans-63.2-23178.6-2133.7000113.7A329 M331A329-P333 WeakPolarHBondContact O-CD 3.48Å; M331-P333 VanDerWaalsContact C-CD 3.45Å
334H80.8Confident86.6Confident59 Ų5953.4 Ų53.427%0.27331%0.311SS..G310 helixtrans-115.216.2-174-56.6-68.6000112.4Y275 M331 L332 G336 E337 N338Y275-H334 HydrophobicContact CD1-CB 4.28Å; Y275-H334 HydrophobicContact CD2-CB 4.3Å; Y275-H334 HydrophobicContact CE1-CB 3.88Å; Y275-H334 AromaticContact CE1-CD2 3.68Å; Y275-H334 AromaticContact CE1-CG 3.71Å; Y275-H334 HydrophobicContact CE2-CB 3.91Å; Y275-H334 AromaticContact CE2-CG 3.93Å; Y275-H334 HydrophobicContact CG-CB 4.49Å; Y275-H334 AromaticContact CZ-CD2 3.64Å; Y275-H334 AromaticContact CZ-CG 3.35Å; Y275-H334 AromaticContact CZ-ND1 3.65Å; Y275-H334 PolarHBondContact OH-CD2 3.29Å; Y275-H334 PolarHBondContact OH-CE1 3.27Å; Y275-H334 VanDerWaalsContact OH-CG 3.24Å; Y275-H334 PolarHBondContact OH-ND1 2.94Å; Y275-H334 VanDerWaalsContact OH-ND1 3.14Å; Y275-H334 PolarHBondContact OH-NE2 3.38Å; M331-H334 CarbonylContact O-C 3.53Å; M331-H334 PolarHBondContact O-N 3.34Å; L332-H334 PolarHBondContact O-N 3Å; H334-G336 PolarHBondContact O-N 3.3Å; H334-E337 IonicContact ND1-OE2 3.99Å; H334-E337 PolarHBondContact O-N 3.04Å; H334-N338 PolarHBondContact O-N 3.19Å; H334-N338 PolarHBondContact O-ND2 2.99Å
335L76.5Confident86.5Confident21 Ų2157.3 Ų57.311%0.1133%0.329CS..THydrogen-bonded Turntrans-62.3-30.3-174.4-159.974.8000112.8M331 L332 E337 N338 L340 N526M331-L335 PolarHBondContact O-N 3.01Å; M331-L335 VanDerWaalsContact O-N 3.12Å; L332-L335 PolarHBondContact O-N 2.95Å; L335-E337 VanDerWaalsContact C-N 3.31Å; L335-E337 PolarHBondContact O-N 3.31Å; L335-N338 PolarHBondContact O-N 3.41Å; L335-L340 HydrophobicContact CD1-CD2 4.1Å; L335-L340 HydrophobicContact CD2-CD2 4.48Å; L335-L340 HydrophobicContact CG-CD2 3.89Å; L335-N526 HydrophobicContact CD2-CB 4.25Å
336G71.3Confident86.6Confident79 Ų7952.2 Ų52.281%0.81431%0.306SS*.THydrogen-bonded Turntrans-72.1-20.3175.400000114.7H334H334-G336 PolarHBondContact O-N 3.3Å
337E75.4Confident86.5Confident137 Ų13749.7 Ų49.764%0.6429%0.288SS*.THydrogen-bonded Turntrans-94.2-9176.7-62.5175.4-178.700111.8Y275 H334 L335Y275-E337 HydrophobicContact CD2-CB 4.48Å; Y275-E337 VanDerWaalsContact CE2-OE2 3.31Å; Y275-E337 WeakPolarHBondContact CE2-OE2 3.41Å; H334-E337 IonicContact ND1-OE2 3.99Å; H334-E337 PolarHBondContact O-N 3.04Å; L335-E337 VanDerWaalsContact C-N 3.31Å; L335-E337 PolarHBondContact O-N 3.31Å
338N77.4Confident86.5Confident13 Ų1350.4 Ų50.47%0.0729%0.292CS..SBendtrans-89.8143.9-176.4-91.1-46.8000112.8Y275 H334 L335 L340 V343Y275-N338 WeakPolarHBondContact CB-OD1 3.44Å; H334-N338 PolarHBondContact O-N 3.19Å; H334-N338 PolarHBondContact O-ND2 2.99Å; L335-N338 PolarHBondContact O-N 3.41Å; N338-L340 PolarHBondContact O-N 3.46Å; N338-V343 HydrophobicContact CB-CG2 4Å
339N85.3Confident86.5Confident54 Ų5450.6 Ų50.629%0.28930%0.298SS..  trans-72.9100.2165.8-173-17.8000109.4E276 L341 K342 V343E276-N339 HydrophobicContact CG-CB 4.14Å; E276-N339 PolarHBondContact OE1-ND2 3.25Å; N339-L341 PolarHBondContact O-N 3.27Å; N339-L341 VanDerWaalsContact O-N 3.12Å; N339-L341 WeakPolarHBondContact OD1-CB 3.37Å; N339-L341 PolarHBondContact OD1-N 2.85Å; N339-K342 HydrophobicContact CB-CB 4.3Å; N339-K342 HydrophobicContact CB-CG 4.19Å; N339-K342 PolarHBondContact O-N 3.25Å; N339-V343 PolarHBondContact O-N 2.92Å
340L86.3Confident86.6Confident56 Ų5647.4 Ų47.429%0.29327%0.272SS..Hα-helixtrans-57.7-27.6-176.2-60.8177.9000113.5L335 N338 V343 N344 T524 P527L335-L340 HydrophobicContact CD1-CD2 4.1Å; L335-L340 HydrophobicContact CD2-CD2 4.48Å; L335-L340 HydrophobicContact CG-CD2 3.89Å; N338-L340 PolarHBondContact O-N 3.46Å; L340-V343 PolarHBondContact O-N 3.39Å; L340-N344 WeakPolarHBondContact O-CB 3.49Å; L340-N344 PolarHBondContact O-N 3.31Å; L340-T524 HydrophobicContact CD1-CG2 4.05Å; L340-P527 HydrophobicContact CB-CG 4.35Å; L340-P527 HydrophobicContact CD2-CG 4.24Å
341L88.2Confident86.7Confident128 Ų12847.6 Ų47.667%0.6727%0.269SS*.Hα-helixtrans-66.8-40.5174.8-63.4175.1000111.3N339 N344 E345N339-L341 PolarHBondContact O-N 3.27Å; N339-L341 VanDerWaalsContact O-N 3.12Å; N339-L341 WeakPolarHBondContact OD1-CB 3.37Å; N339-L341 PolarHBondContact OD1-N 2.85Å; L341-N344 PolarHBondContact O-N 2.84Å; L341-E345 PolarHBondContact O-N 3.22Å
342K89.9Confident86.9Confident56 Ų5650.5 Ų50.524%0.24328%0.284CS..Hα-helixtrans-70.4-38.2175.6-64.7-50.1-172.2-171.30112E276 T279 V280 I283 N339 N344 E345 L346E276-K342 HydrophobicContact CG-CG 4.43Å; T279-K342 HydrophobicContact CG2-CB 4.02Å; V280-K342 HydrophobicContact CG2-CD 4.21Å; V280-K342 HydrophobicContact CG2-CG 4.19Å; I283-K342 HydrophobicContact CD1-CB 4.45Å; I283-K342 WeakPolarHBondContact CD1-O 3.25Å; N339-K342 HydrophobicContact CB-CB 4.3Å; N339-K342 HydrophobicContact CB-CG 4.19Å; N339-K342 PolarHBondContact O-N 3.25Å; K342-N344 VanDerWaalsContact C-N 3.29Å; K342-N344 PolarHBondContact O-N 3.4Å; K342-E345 WeakPolarHBondContact CD-OE2 3.33Å; K342-E345 IonicContact NZ-OE1 3.83Å; K342-E345 PolarHBondContact NZ-OE1 2.93Å; K342-E345 IonicContact NZ-OE2 3.33Å; K342-E345 PolarHBondContact NZ-OE2 3.41Å; K342-E345 PolarHBondContact O-N 2.82Å; K342-L346 PolarHBondContact O-N 3.11Å
343V90.8Very high87.2Confident0 Ų046.9 Ų46.90%027%0.267CS..Hα-helixtrans-59.7-43.4171.8-178.10000110.2M331 N338 N339 L340 L346 V347 P527M331-V343 HydrophobicContact SD-CG1 4.44Å; N338-V343 HydrophobicContact CB-CG2 4Å; N339-V343 PolarHBondContact O-N 2.92Å; L340-V343 PolarHBondContact O-N 3.39Å; V343-L346 WeakPolarHBondContact O-CB 3.46Å; V343-L346 PolarHBondContact O-N 3.35Å; V343-V347 VanDerWaalsContact O-CG2 3.32Å; V343-V347 WeakPolarHBondContact O-CG2 3.3Å; V343-V347 PolarHBondContact O-N 2.96Å; V343-P527 HydrophobicContact CB-CG 4.27Å; V343-P527 HydrophobicContact CG1-CB 4.15Å; V343-P527 HydrophobicContact CG1-CG 4.12Å
344N90.8Very high87.6Confident56 Ų5642.2 Ų42.230%0.29924%0.236SC..Hα-helixtrans-61.7-45.4175.3-167-32.2000112.4L340 L341 K342 L346 V347 C348 P527L340-N344 WeakPolarHBondContact O-CB 3.49Å; L340-N344 PolarHBondContact O-N 3.31Å; L341-N344 PolarHBondContact O-N 2.84Å; K342-N344 VanDerWaalsContact C-N 3.29Å; K342-N344 PolarHBondContact O-N 3.4Å; N344-L346 PolarHBondContact O-N 3.01Å; N344-V347 PolarHBondContact O-N 3.25Å; N344-V347 VanDerWaalsContact O-N 3.16Å; N344-C348 PolarHBondContact O-N 3.15Å; N344-C348 PolarHBondContact O-SG 3.18Å; N344-C348 PolarHBondContact OD1-SG 3.27Å; N344-P527 HydrophobicContact CB-CB 4.17Å
345E92Very high88.1Confident81 Ų8141.9 Ų41.938%0.37923%0.234SC..Hα-helixtrans-55.7-38.8173.6-74.9174.6-154.100112.4I283 L341 K342 C348 A349I283-E345 HydrophobicContact CD1-CB 3.77Å; I283-E345 HydrophobicContact CG1-CB 4.47Å; L341-E345 PolarHBondContact O-N 3.22Å; K342-E345 WeakPolarHBondContact CD-OE2 3.33Å; K342-E345 IonicContact NZ-OE1 3.83Å; K342-E345 PolarHBondContact NZ-OE1 2.93Å; K342-E345 IonicContact NZ-OE2 3.33Å; K342-E345 PolarHBondContact NZ-OE2 3.41Å; K342-E345 PolarHBondContact O-N 2.82Å; E345-C348 WeakPolarHBondContact O-CB 3.49Å; E345-C348 PolarHBondContact O-N 3.24Å; E345-A349 PolarHBondContact O-N 3.37Å
346L93.8Very high88.8Confident0 Ų043.7 Ų43.70%025%0.248CC..Hα-helixtrans-66.4-45.7175.3179.261.8000112.1T279 L282 I283 L286 L327 M331 K342 V343 N344 C348 A349 L350 W528T279-L346 HydrophobicContact CG2-CB 4.17Å; T279-L346 HydrophobicContact CG2-CD2 4.12Å; L282-L346 HydrophobicContact CB-CD1 3.83Å; L282-L346 HydrophobicContact CD1-CD2 4.23Å; I283-L346 HydrophobicContact CD1-CB 4.18Å; I283-L346 HydrophobicContact CG1-CB 3.78Å; I283-L346 HydrophobicContact CG1-CD1 4.07Å; L286-L346 HydrophobicContact CD1-CD1 3.77Å; L327-L346 HydrophobicContact CD1-CD2 4.39Å; M331-L346 HydrophobicContact CE-CD2 4.07Å; M331-L346 HydrophobicContact SD-CD2 4.43Å; K342-L346 PolarHBondContact O-N 3.11Å; V343-L346 WeakPolarHBondContact O-CB 3.46Å; V343-L346 PolarHBondContact O-N 3.35Å; N344-L346 PolarHBondContact O-N 3.01Å; L346-C348 VanDerWaalsContact C-N 3.27Å; L346-C348 PolarHBondContact O-N 3.45Å; L346-A349 PolarHBondContact O-N 3.21Å; L346-L350 PolarHBondContact O-N 2.92Å; L346-W528 HydrophobicContact CD2-CH2 4.31Å; L346-W528 HydrophobicContact CD2-CZ2 4.16Å; L346-W528 HydrophobicContact CG-CH2 4.42Å
347V92.8Very high89.8Confident0 Ų041.7 Ų41.70%022%0.217CC..Hα-helixtrans-58.1-42.8175.4178.10000110.5V343 N344 L350 Y351 W528 Y531V343-V347 VanDerWaalsContact O-CG2 3.32Å; V343-V347 WeakPolarHBondContact O-CG2 3.3Å; V343-V347 PolarHBondContact O-N 2.96Å; N344-V347 PolarHBondContact O-N 3.25Å; N344-V347 VanDerWaalsContact O-N 3.16Å; V347-L350 PolarHBondContact O-N 3.31Å; V347-Y351 HydrophobicContact CG1-CD2 3.71Å; V347-Y351 HydrophobicContact CG1-CE2 4.08Å; V347-Y351 WeakPolarHBondContact O-CD2 3.49Å; V347-Y351 PolarHBondContact O-N 3.34Å; V347-W528 HydrophobicContact CG2-CD2 3.51Å; V347-W528 HydrophobicContact CG2-CE3 3.59Å; V347-W528 HydrophobicContact CG2-CG 4Å; V347-W528 HydrophobicContact CG2-CH2 4.16Å; V347-W528 HydrophobicContact CG2-CZ2 4.14Å; V347-W528 HydrophobicContact CG2-CZ3 3.9Å; V347-Y531 HydrophobicContact CG1-CD2 3.81Å; V347-Y531 HydrophobicContact CG1-CG 3.92Å
348C91.9Very high90.6Very high14 Ų1435.6 Ų35.610%0.09519%0.188CC..Hα-helixtrans-60.5-47.2175-62.80000111.9N344 E345 L346 L350 Y351 D352 R536N344-C348 PolarHBondContact O-N 3.15Å; N344-C348 PolarHBondContact O-SG 3.18Å; N344-C348 PolarHBondContact OD1-SG 3.27Å; E345-C348 WeakPolarHBondContact O-CB 3.49Å; E345-C348 PolarHBondContact O-N 3.24Å; L346-C348 VanDerWaalsContact C-N 3.27Å; L346-C348 PolarHBondContact O-N 3.45Å; C348-L350 PolarHBondContact O-N 3.15Å; C348-L350 VanDerWaalsContact O-N 3.17Å; C348-Y351 PolarHBondContact O-N 3.05Å; C348-D352 WeakPolarHBondContact CB-OD2 3.42Å; C348-D352 WeakPolarHBondContact O-CB 3.5Å; C348-D352 VanDerWaalsContact O-CG 3.29Å; C348-D352 PolarHBondContact O-N 3.49Å; C348-R536 PolarHBondContact SG-NH1 2.69Å; C348-R536 PolarHBondContact SG-NH2 3.08Å
349A92.8Very high91.2Very high29 Ų2937.8 Ų37.824%0.2420%0.199CC..Hα-helixtrans-59-29.1-18000000113L286 E345 L346L286-A349 HydrophobicContact CB-CB 4.34Å; L286-A349 HydrophobicContact CD1-CB 4.12Å; E345-A349 PolarHBondContact O-N 3.37Å; L346-A349 PolarHBondContact O-N 3.21Å
350L93.4Very high91.5Very high0 Ų039.7 Ų39.70%021%0.206CC..Hα-helixtrans-83.5-45.7178-66.3173.7000113.5L286 T320 F323 L327 L346 V347 C348 W528L286-L350 HydrophobicContact CD1-CD2 3.56Å; L286-L350 HydrophobicContact CD1-CG 4.08Å; L286-L350 HydrophobicContact CD2-CD2 4.16Å; T320-L350 HydrophobicContact CG2-CB 4.43Å; F323-L350 HydrophobicContact CD1-CD1 4.24Å; F323-L350 HydrophobicContact CD1-CD2 3.91Å; F323-L350 HydrophobicContact CE1-CD1 4.1Å; F323-L350 HydrophobicContact CE1-CD2 3.65Å; L327-L350 HydrophobicContact CD1-CD1 4.05Å; L346-L350 PolarHBondContact O-N 2.92Å; V347-L350 PolarHBondContact O-N 3.31Å; C348-L350 PolarHBondContact O-N 3.15Å; C348-L350 VanDerWaalsContact O-N 3.17Å; L350-W528 HydrophobicContact CD1-CH2 3.87Å; L350-W528 HydrophobicContact CD1-CZ3 3.91Å
351Y92.7Very high91.8Very high22 Ų2237 Ų379%0.08619%0.192CC..Hα-helixtrans-100.8-24-169.2-64.6-66.1000115V347 C348 P353 Y354 W528 Y531V347-Y351 HydrophobicContact CG1-CD2 3.71Å; V347-Y351 HydrophobicContact CG1-CE2 4.08Å; V347-Y351 WeakPolarHBondContact O-CD2 3.49Å; V347-Y351 PolarHBondContact O-N 3.34Å; C348-Y351 PolarHBondContact O-N 3.05Å; Y351-P353 VanDerWaalsContact C-N 3.31Å; Y351-Y354 PolarHBondContact O-N 3.44Å; Y351-W528 HydrophobicContact CE2-CE3 4.44Å; Y351-W528 HydrophobicContact CE2-CZ3 4.41Å; Y351-Y531 VanDerWaalsContact C-OH 3.28Å; Y351-Y531 VanDerWaalsContact CB-CE1 3.41Å; Y351-Y531 HydrophobicContact CD2-CD1 4.34Å; Y351-Y531 HydrophobicContact CD2-CG 4.46Å; Y351-Y531 HydrophobicContact CG-CD1 4.31Å; Y351-Y531 HydrophobicContact CG-CE1 4.14Å; Y351-Y531 PolarHBondContact O-OH 3.06Å
352D91.3Very high92Very high62 Ų6231 Ų3133%0.33216%0.162SC..Hα-helixtrans-58.7-33.8177.3-73.9-19.1000113.3C348 Y354 K355 Y531 R536C348-D352 WeakPolarHBondContact CB-OD2 3.42Å; C348-D352 WeakPolarHBondContact O-CB 3.5Å; C348-D352 VanDerWaalsContact O-CG 3.29Å; C348-D352 PolarHBondContact O-N 3.49Å; D352-Y354 PolarHBondContact O-N 2.94Å; D352-Y354 VanDerWaalsContact O-N 3.14Å; D352-K355 WeakPolarHBondContact O-CB 3.35Å; D352-K355 PolarHBondContact O-N 2.9Å; D352-Y531 PolarHBondContact N-OH 3.11Å; D352-Y531 PolarHBondContact OD1-OH 2.94Å; D352-R536 IonicContact OD1-NH1 3.93Å; D352-R536 PolarHBondContact OD1-NH1 2.95Å; D352-R536 IonicContact OD2-NH1 2.69Å
353P93.5Very high92.2Very high18 Ų1834.1 Ų34.112%0.11718%0.177CC..Hα-helixtrans-56.6-26.5173.7-28.336.9000114.9I293 P294 L297 Y351I293-P353 HydrophobicContact CB-CB 4.34Å; I293-P353 HydrophobicContact CB-CG 4.27Å; I293-P353 HydrophobicContact CG2-CB 3.76Å; I293-P353 HydrophobicContact CG2-CG 4.07Å; P294-P353 HydrophobicContact CG-CB 4.04Å; P294-P353 HydrophobicContact CG-CG 4.25Å; L297-P353 HydrophobicContact CD1-CB 3.89Å; Y351-P353 VanDerWaalsContact C-N 3.31Å
354Y93.1Very high92.3Very high1 Ų135.3 Ų35.30%0.00418%0.183CC..Hα-helixtrans-90.5-13.8179.5-67.1-87000113.1L297 L313 L316 H317 T320 Y351 D352 S356 Y357 Q358L297-Y354 HydrophobicContact CD1-CD1 4.05Å; L297-Y354 HydrophobicContact CD1-CD2 4.4Å; L297-Y354 HydrophobicContact CD1-CE1 3.84Å; L297-Y354 HydrophobicContact CD1-CE2 4.2Å; L297-Y354 HydrophobicContact CD1-CG 4.32Å; L297-Y354 HydrophobicContact CD2-CE1 3.71Å; L297-Y354 HydrophobicContact CG-CE1 4.44Å; L313-Y354 HydrophobicContact CD1-CD1 3.97Å; L313-Y354 HydrophobicContact CD1-CE1 4.29Å; L316-Y354 HydrophobicContact CB-CE1 4.19Å; L316-Y354 PolarHBondContact O-OH 3.17Å; L316-Y354 VanDerWaalsContact O-OH 3.09Å; H317-Y354 HydrophobicContact CB-CD1 4.04Å; H317-Y354 HydrophobicContact CB-CE1 3.96Å; H317-Y354 AromaticContact ND1-CD1 3.87Å; H317-Y354 AromaticContact ND1-CG 3.71Å; T320-Y354 HydrophobicContact CG2-CE2 3.91Å; T320-Y354 WeakPolarHBondContact OG1-CE2 3.49Å; T320-Y354 PolarHBondContact OG1-OH 3.02Å; Y351-Y354 PolarHBondContact O-N 3.44Å; D352-Y354 PolarHBondContact O-N 2.94Å; D352-Y354 VanDerWaalsContact O-N 3.14Å; Y354-S356 VanDerWaalsContact C-N 3.34Å; Y354-S356 PolarHBondContact O-N 3.45Å; Y354-Y357 PolarHBondContact O-N 3.31Å; Y354-Y357 VanDerWaalsContact O-N 3.08Å; Y354-Q358 WeakPolarHBondContact O-CG 3.42Å; Y354-Q358 PolarHBondContact O-N 3.15Å
355K91.4Very high92.5Very high52 Ų5232.6 Ų32.623%0.22617%0.169CC..Hα-helixtrans-55.7-43.6-172.4-179.1-177.7178.2-172.80113.2D352 Y357 Q358 L359 R536D352-K355 WeakPolarHBondContact O-CB 3.35Å; D352-K355 PolarHBondContact O-N 2.9Å; K355-Y357 VanDerWaalsContact C-N 3.31Å; K355-Y357 PolarHBondContact O-N 3.46Å; K355-Q358 PolarHBondContact O-N 2.97Å; K355-L359 HydrophobicContact CG-CD1 4.26Å; K355-L359 WeakPolarHBondContact O-CG 3.49Å; K355-L359 PolarHBondContact O-N 3.12Å; K355-R536 VanDerWaalsContact NZ-C 3.33Å; K355-R536 PolarHBondContact NZ-O 3.32Å
356S91.2Very high92.6Very high60 Ų6031.1 Ų31.142%0.4216%0.162SC..Hα-helixtrans-60.3-43.2179.251.20000111.7Y354 L359 Q360Y354-S356 VanDerWaalsContact C-N 3.34Å; Y354-S356 PolarHBondContact O-N 3.45Å; S356-L359 PolarHBondContact O-N 3.37Å; S356-Q360 WeakPolarHBondContact O-CG 3.43Å; S356-Q360 PolarHBondContact O-N 2.82Å; S356-Q360 VanDerWaalsContact O-N 3.14Å
357Y91.6Very high92.6Very high37 Ų3732.4 Ų32.415%0.14517%0.172CC..Hα-helixtrans-73.1-34.9179.1-55.8-72.7000112.4L297 S298 M301 L313 Y354 K355 Q360 Y361L297-Y357 HydrophobicContact CB-CE2 4.02Å; L297-Y357 HydrophobicContact CD1-CE2 4.34Å; S298-Y357 WeakPolarHBondContact CA-OH 3.4Å; S298-Y357 PolarHBondContact N-OH 3.06Å; M301-Y357 HydrophobicContact CB-CE1 4.46Å; M301-Y357 HydrophobicContact CG-CD1 4.46Å; M301-Y357 HydrophobicContact CG-CE1 3.79Å; L313-Y357 HydrophobicContact CD1-CD2 4.16Å; L313-Y357 HydrophobicContact CD1-CG 4.02Å; L313-Y357 HydrophobicContact CD2-CG 4.43Å; Y354-Y357 PolarHBondContact O-N 3.31Å; Y354-Y357 VanDerWaalsContact O-N 3.08Å; K355-Y357 VanDerWaalsContact C-N 3.31Å; K355-Y357 PolarHBondContact O-N 3.46Å; Y357-Q360 CarbonylContact O-C 3.57Å; Y357-Q360 PolarHBondContact O-N 3.38Å; Y357-Y361 PolarHBondContact O-N 3.22Å
358Q91.9Very high92.7Very high8 Ų833 Ų334%0.03718%0.175CC..Hα-helixtrans-64.5-38.9173.6-71.8176.1-38.900111.9Y354 K355 Q360 Y361 L411 T412 Y533Y354-Q358 WeakPolarHBondContact O-CG 3.42Å; Y354-Q358 PolarHBondContact O-N 3.15Å; K355-Q358 PolarHBondContact O-N 2.97Å; Q358-Q360 VanDerWaalsContact C-N 3.34Å; Q358-Y361 WeakPolarHBondContact O-CB 3.49Å; Q358-Y361 PolarHBondContact O-N 3.05Å; Q358-L411 HydrophobicContact CG-CG 4.28Å; Q358-L411 PolarHBondContact NE2-O 3.31Å; Q358-T412 HydrophobicContact CB-CG2 4.35Å; Q358-T412 HydrophobicContact CG-CG2 4.29Å; Q358-Y533 HydrophobicContact CB-CD1 4.42Å; Q358-Y533 HydrophobicContact CB-CD2 3.69Å; Q358-Y533 HydrophobicContact CB-CE1 4.42Å; Q358-Y533 HydrophobicContact CB-CE2 3.72Å; Q358-Y533 HydrophobicContact CB-CG 4.09Å; Q358-Y533 VanDerWaalsContact OE1-CG 3.32Å
359L90.9Very high92.9Very high59 Ų5932.3 Ų32.331%0.30917%0.17SC..Hα-helixtrans-67.1-35.3173.4-68.8171.4000112.1K355 S356 Y361 Y533 L534 N538K355-L359 HydrophobicContact CG-CD1 4.26Å; K355-L359 WeakPolarHBondContact O-CG 3.49Å; K355-L359 PolarHBondContact O-N 3.12Å; S356-L359 PolarHBondContact O-N 3.37Å; L359-Y361 VanDerWaalsContact C-N 3.27Å; L359-Y361 PolarHBondContact O-N 3.43Å; L359-Y533 HydrophobicContact CD2-CD2 4.22Å; L359-Y533 HydrophobicContact CD2-CE2 4.26Å; L359-Y533 HydrophobicContact CG-CD2 4.47Å; L359-L534 HydrophobicContact CD2-CD1 3.95Å; L359-N538 HydrophobicContact CD2-CB 4.06Å
360Q91.2Very high93Very high94 Ų9433.1 Ų33.144%0.43917%0.171SC..THydrogen-bonded Turntrans-83.52.7176.5-68.9174.8-7.700113.7S356 Y357 Q358 G362 E363 L364S356-Q360 WeakPolarHBondContact O-CG 3.43Å; S356-Q360 PolarHBondContact O-N 2.82Å; S356-Q360 VanDerWaalsContact O-N 3.14Å; Y357-Q360 CarbonylContact O-C 3.57Å; Y357-Q360 PolarHBondContact O-N 3.38Å; Q358-Q360 VanDerWaalsContact C-N 3.34Å; Q360-G362 VanDerWaalsContact C-N 3.26Å; Q360-G362 PolarHBondContact O-N 2.78Å; Q360-G362 VanDerWaalsContact O-N 3.14Å; Q360-E363 PolarHBondContact O-N 3.33Å; Q360-L364 PolarHBondContact O-N 2.71Å
361Y93.2Very high93Very high0 Ų035.3 Ų35.30%018%0.182CC..Hα-helixtrans-53.5-41.7-173.4173.8-103.6000112.9L310 Y357 Q358 L359 E363 L364 E365 A404 C408 L411 T412 A416L310-Y361 HydrophobicContact CD1-CD2 4.1Å; L310-Y361 HydrophobicContact CD1-CE2 3.93Å; Y357-Y361 PolarHBondContact O-N 3.22Å; Q358-Y361 WeakPolarHBondContact O-CB 3.49Å; Q358-Y361 PolarHBondContact O-N 3.05Å; L359-Y361 VanDerWaalsContact C-N 3.27Å; L359-Y361 PolarHBondContact O-N 3.43Å; Y361-E363 VanDerWaalsContact C-N 3.26Å; Y361-E363 PolarHBondContact O-N 3.23Å; Y361-L364 PolarHBondContact O-N 2.95Å; Y361-E365 HydrophobicContact CE1-CB 4.13Å; Y361-E365 HydrophobicContact CE1-CG 4.35Å; Y361-E365 HydrophobicContact CE2-CB 4.22Å; Y361-E365 WeakPolarHBondContact O-CB 3.28Å; Y361-E365 PolarHBondContact O-N 3Å; Y361-E365 PolarHBondContact OH-OE2 3.38Å; Y361-A404 PolarHBondContact OH-O 2.89Å; Y361-C408 HydrophobicContact CE1-CB 3.76Å; Y361-C408 WeakPolarHBondContact OH-CA 3.43Å; Y361-C408 WeakPolarHBondContact OH-CB 3.32Å; Y361-C408 PolarHBondContact OH-N 3.46Å; Y361-L411 HydrophobicContact CD2-CD2 3.44Å; Y361-L411 VanDerWaalsContact CD2-CD2 3.44Å; Y361-L411 HydrophobicContact CE2-CD2 3.99Å; Y361-L411 HydrophobicContact CG-CD2 4.28Å; Y361-T412 HydrophobicContact CG-CG2 4.49Å; Y361-A416 HydrophobicContact CD1-CB 3.59Å; Y361-A416 HydrophobicContact CE1-CB 4.35Å; Y361-A416 HydrophobicContact CG-CB 4.24Å
362G92.1Very high93Very high3 Ų337.3 Ų37.33%0.03119%0.192CC..Hα-helixtrans-60-34.7179.800000113.5Q360 E366Q360-G362 VanDerWaalsContact C-N 3.26Å; Q360-G362 PolarHBondContact O-N 2.78Å; Q360-G362 VanDerWaalsContact O-N 3.14Å; G362-E366 VanDerWaalsContact O-CB 3.22Å; G362-E366 WeakPolarHBondContact O-CB 3.46Å; G362-E366 PolarHBondContact O-N 2.9Å; G362-E366 VanDerWaalsContact O-N 3.12Å
363E93.3Very high93.2Very high121 Ų12134.5 Ų34.557%0.56518%0.177SC*.Hα-helixtrans-76-40.1177.1-60.1-179.9178.500111.6Q360 Y361 E366 A367 R422Q360-E363 PolarHBondContact O-N 3.33Å; Y361-E363 VanDerWaalsContact C-N 3.26Å; Y361-E363 PolarHBondContact O-N 3.23Å; E363-E366 PolarHBondContact O-N 3.21Å; E363-A367 WeakPolarHBondContact O-CB 3.49Å; E363-A367 PolarHBondContact O-N 3.02Å; E363-R422 VanDerWaalsContact CG-NH2 3.3Å; E363-R422 VanDerWaalsContact N-NH2 3.15Å
364L92.7Very high93Very high24 Ų2436.9 Ų36.913%0.12619%0.194CC..Hα-helixtrans-65.9-44.7178.1-65.7174.6000111.6L310 L313 Q360 Y361 A367 F368L310-L364 HydrophobicContact CD1-CB 4.27Å; L313-L364 HydrophobicContact CD2-CD1 4.1Å; Q360-L364 PolarHBondContact O-N 2.71Å; Y361-L364 PolarHBondContact O-N 2.95Å; L364-A367 PolarHBondContact O-N 3.43Å; L364-F368 WeakPolarHBondContact O-CB 3.06Å; L364-F368 PolarHBondContact O-N 3.17Å
365E95.1Very high92.9Very high0 Ų040.4 Ų40.40%022%0.224CC..Hα-helixtrans-66.2-42176.7-17466.2-146.500111L310 Y361 F368 L369 A404 R407 A423L310-E365 WeakPolarHBondContact CD2-OE2 3.35Å; Y361-E365 HydrophobicContact CE1-CB 4.13Å; Y361-E365 HydrophobicContact CE1-CG 4.35Å; Y361-E365 HydrophobicContact CE2-CB 4.22Å; Y361-E365 WeakPolarHBondContact O-CB 3.28Å; Y361-E365 PolarHBondContact O-N 3Å; Y361-E365 PolarHBondContact OH-OE2 3.38Å; E365-F368 PolarHBondContact O-N 3.42Å; E365-L369 HydrophobicContact CG-CD1 3.94Å; E365-L369 HydrophobicContact CG-CG 4.3Å; E365-L369 WeakPolarHBondContact O-CB 3.35Å; E365-L369 VanDerWaalsContact O-CG 3.26Å; E365-L369 WeakPolarHBondContact O-CG 3.28Å; E365-L369 PolarHBondContact O-N 2.91Å; E365-L369 WeakPolarHBondContact OE1-CG 3.46Å; E365-A404 HydrophobicContact CG-CB 4.29Å; E365-A404 WeakPolarHBondContact OE1-CA 3.24Å; E365-A404 WeakPolarHBondContact OE1-CB 3.41Å; E365-R407 IonicContact OE1-CZ 3.15Å; E365-R407 IonicContact OE1-NE 2.71Å; E365-R407 PolarHBondContact OE1-NE 3.06Å; E365-R407 VanDerWaalsContact OE1-NE 3.14Å; E365-R407 IonicContact OE1-NH2 3.83Å; E365-R407 PolarHBondContact OE1-NH2 3.2Å; E365-R407 IonicContact OE2-NE 2.7Å; E365-R407 PolarHBondContact OE2-NE 3.49Å; E365-A423 HydrophobicContact CB-CB 4.17Å; E365-A423 HydrophobicContact CG-CB 4.01Å
366E95.1Very high92.8Very high50 Ų5038.9 Ų38.923%0.23422%0.218CC..Hα-helixtrans-59.7-49.7175.1-178.2175.7155.700111.3G362 E363 F368 L369 L370 R422 A423 A426G362-E366 VanDerWaalsContact O-CB 3.22Å; G362-E366 WeakPolarHBondContact O-CB 3.46Å; G362-E366 PolarHBondContact O-N 2.9Å; G362-E366 VanDerWaalsContact O-N 3.12Å; E363-E366 PolarHBondContact O-N 3.21Å; E366-F368 VanDerWaalsContact C-N 3.34Å; E366-F368 PolarHBondContact O-N 3.11Å; E366-L369 PolarHBondContact O-N 3.15Å; E366-L370 HydrophobicContact CG-CD1 3.88Å; E366-L370 HydrophobicContact CG-CG 4.28Å; E366-L370 WeakPolarHBondContact O-CB 3.2Å; E366-L370 WeakPolarHBondContact O-CG 3.34Å; E366-L370 PolarHBondContact O-N 3.23Å; E366-R422 IonicContact OE2-CZ 2.78Å; E366-R422 IonicContact OE2-NH1 3.53Å; E366-R422 PolarHBondContact OE2-NH1 2.98Å; E366-A423 HydrophobicContact CB-CB 3.93Å; E366-A426 HydrophobicContact CG-CB 3.75Å
367A94.6Very high92.4Very high26 Ų2639.1 Ų39.122%0.21522%0.219CC..Hα-helixtrans-60.3-43.5178.200000112E363 L364 I371E363-A367 WeakPolarHBondContact O-CB 3.49Å; E363-A367 PolarHBondContact O-N 3.02Å; L364-A367 PolarHBondContact O-N 3.43Å; A367-I371 WeakPolarHBondContact O-CD1 3.36Å; A367-I371 VanDerWaalsContact O-CG1 3.27Å; A367-I371 WeakPolarHBondContact O-CG1 3.44Å; A367-I371 PolarHBondContact O-N 3.06Å; A367-I371 VanDerWaalsContact O-N 3.08Å
368F94.7Very high92Very high12 Ų1238 Ų385%0.05322%0.215CC..Hα-helixtrans-60.4-51.9176.7177.3-94.3000111.6E307 L310 L364 E365 E366 L370 I371 Q372E307-F368 VanDerWaalsContact O-CD2 3.26Å; E307-F368 WeakPolarHBondContact O-CD2 3.45Å; E307-F368 VanDerWaalsContact O-CE2 3.26Å; E307-F368 WeakPolarHBondContact O-CE2 3.34Å; L310-F368 HydrophobicContact CB-CB 4.49Å; L310-F368 HydrophobicContact CB-CD2 4.37Å; L310-F368 HydrophobicContact CD2-CB 3.96Å; L310-F368 HydrophobicContact CD2-CD1 4.09Å; L310-F368 HydrophobicContact CD2-CD2 4.33Å; L310-F368 HydrophobicContact CD2-CG 3.87Å; L364-F368 WeakPolarHBondContact O-CB 3.06Å; L364-F368 PolarHBondContact O-N 3.17Å; E365-F368 PolarHBondContact O-N 3.42Å; E366-F368 VanDerWaalsContact C-N 3.34Å; E366-F368 PolarHBondContact O-N 3.11Å; F368-L370 VanDerWaalsContact C-N 3.34Å; F368-L370 PolarHBondContact O-N 2.97Å; F368-I371 PolarHBondContact O-N 3.24Å; F368-Q372 HydrophobicContact CD1-CG 4.22Å; F368-Q372 HydrophobicContact CE1-CG 3.83Å; F368-Q372 HydrophobicContact CE2-CG 4.25Å; F368-Q372 HydrophobicContact CZ-CG 3.86Å; F368-Q372 WeakPolarHBondContact O-CG 3.29Å; F368-Q372 PolarHBondContact O-N 3.21Å
369L95.5Very high91.2Very high0 Ų042.4 Ų42.40%024%0.236CC..Hα-helixtrans-61.9-41.3-179.8-74.3176.8000112.2E365 E366 I371 Q372 I373 L400 A404 A423 L427E365-L369 HydrophobicContact CG-CD1 3.94Å; E365-L369 HydrophobicContact CG-CG 4.3Å; E365-L369 WeakPolarHBondContact O-CB 3.35Å; E365-L369 VanDerWaalsContact O-CG 3.26Å; E365-L369 WeakPolarHBondContact O-CG 3.28Å; E365-L369 PolarHBondContact O-N 2.91Å; E365-L369 WeakPolarHBondContact OE1-CG 3.46Å; E366-L369 PolarHBondContact O-N 3.15Å; L369-I371 VanDerWaalsContact C-N 3.34Å; L369-I371 PolarHBondContact O-N 3.46Å; L369-Q372 PolarHBondContact O-N 2.94Å; L369-I373 WeakPolarHBondContact O-CB 3.33Å; L369-I373 WeakPolarHBondContact O-CG2 3.46Å; L369-I373 PolarHBondContact O-N 3.45Å; L369-L400 HydrophobicContact CD2-CB 4.13Å; L369-A404 HydrophobicContact CD1-CB 3.99Å; L369-A404 HydrophobicContact CD2-CB 4.29Å; L369-A423 HydrophobicContact CD1-CB 4.21Å; L369-L427 HydrophobicContact CB-CB 4.46Å; L369-L427 HydrophobicContact CB-CD1 4.3Å; L369-L427 HydrophobicContact CD1-CB 4.34Å; L369-L427 HydrophobicContact CD1-CD2 4.26Å; L369-L427 HydrophobicContact CD2-CD2 4.27Å
370L95.1Very high90.4Very high47 Ų4745.9 Ų45.925%0.24625%0.25CC..Hα-helixtrans-64-39.2177.5-69.8177.3000111.3E366 F368 I373 S374 K430E366-L370 HydrophobicContact CG-CD1 3.88Å; E366-L370 HydrophobicContact CG-CG 4.28Å; E366-L370 WeakPolarHBondContact O-CB 3.2Å; E366-L370 WeakPolarHBondContact O-CG 3.34Å; E366-L370 PolarHBondContact O-N 3.23Å; F368-L370 VanDerWaalsContact C-N 3.34Å; F368-L370 PolarHBondContact O-N 2.97Å; L370-I373 WeakPolarHBondContact O-CG2 3.31Å; L370-S374 PolarHBondContact O-N 2.66Å; L370-S374 PolarHBondContact O-OG 3.48Å; L370-K430 HydrophobicContact CB-CD 4.5Å; L370-K430 HydrophobicContact CD2-CB 3.81Å; L370-K430 HydrophobicContact CD2-CD 3.5Å; L370-K430 VanDerWaalsContact CD2-CD 3.5Å; L370-K430 HydrophobicContact CD2-CG 4.28Å; L370-K430 PolarHBondContact O-NZ 3.47Å
371I93.5Very high89.7Confident46 Ų4643.5 Ų43.524%0.23625%0.251CS..Hα-helixtrans-64.6-49.5175.6-69163.9000110.4Q306 E307 A367 F368 L369 I373 S374 A375Q306-I371 HydrophobicContact CB-CD1 4.22Å; Q306-I371 HydrophobicContact CG-CD1 3.66Å; E307-I371 HydrophobicContact CB-CG2 4.31Å; E307-I371 HydrophobicContact CG-CD1 4.3Å; E307-I371 HydrophobicContact CG-CG2 3.92Å; A367-I371 WeakPolarHBondContact O-CD1 3.36Å; A367-I371 VanDerWaalsContact O-CG1 3.27Å; A367-I371 WeakPolarHBondContact O-CG1 3.44Å; A367-I371 PolarHBondContact O-N 3.06Å; A367-I371 VanDerWaalsContact O-N 3.08Å; F368-I371 PolarHBondContact O-N 3.24Å; L369-I371 VanDerWaalsContact C-N 3.34Å; L369-I371 PolarHBondContact O-N 3.46Å; I371-I373 PolarHBondContact O-N 3.42Å; I371-S374 PolarHBondContact O-N 3.44Å; I371-S374 PolarHBondContact O-OG 3.34Å; I371-A375 PolarHBondContact O-N 2.9Å
372Q92.6Very high89.2Confident63 Ų6350.2 Ų50.229%0.29428%0.282SS..Hα-helixtrans-62.1-40.9-177.9-66.7-61.4-2900112.5F368 L369 A375 L400F368-Q372 HydrophobicContact CD1-CG 4.22Å; F368-Q372 HydrophobicContact CE1-CG 3.83Å; F368-Q372 HydrophobicContact CE2-CG 4.25Å; F368-Q372 HydrophobicContact CZ-CG 3.86Å; F368-Q372 WeakPolarHBondContact O-CG 3.29Å; F368-Q372 PolarHBondContact O-N 3.21Å; L369-Q372 PolarHBondContact O-N 2.94Å; Q372-A375 WeakPolarHBondContact O-CB 3.31Å; Q372-A375 PolarHBondContact O-N 3.2Å; Q372-L400 HydrophobicContact CB-CD1 4.06Å; Q372-L400 HydrophobicContact CB-CD2 3.81Å; Q372-L400 HydrophobicContact CG-CD2 4.32Å
373I94.1Very high88.7Confident3 Ų351.2 Ų51.22%0.01529%0.288CS..Hα-helixtrans-71.2-31.3179.3-163.164.2000112.4L369 L370 I371 A375 V376 L397 L400 L427 K430 Y431L369-I373 WeakPolarHBondContact O-CB 3.33Å; L369-I373 WeakPolarHBondContact O-CG2 3.46Å; L369-I373 PolarHBondContact O-N 3.45Å; L370-I373 WeakPolarHBondContact O-CG2 3.31Å; I371-I373 PolarHBondContact O-N 3.42Å; I373-A375 PolarHBondContact O-N 3.44Å; I373-V376 HydrophobicContact CD1-CB 4.49Å; I373-V376 HydrophobicContact CD1-CG2 4.18Å; I373-V376 WeakPolarHBondContact O-CB 3.36Å; I373-V376 PolarHBondContact O-N 2.85Å; I373-V376 VanDerWaalsContact O-N 3.11Å; I373-L397 HydrophobicContact CD1-CD1 4.29Å; I373-L400 HydrophobicContact CB-CD1 4.38Å; I373-L400 HydrophobicContact CD1-CD1 4.07Å; I373-L427 HydrophobicContact CB-CD1 3.7Å; I373-L427 HydrophobicContact CD1-CD1 4.21Å; I373-L427 HydrophobicContact CG1-CD1 3.91Å; I373-L427 HydrophobicContact CG2-CD1 4.02Å; I373-K430 HydrophobicContact CG2-CB 4.49Å; I373-K430 HydrophobicContact CG2-CD 3.52Å; I373-K430 HydrophobicContact CG2-CG 4.01Å; I373-Y431 HydrophobicContact CD1-CD2 3.99Å; I373-Y431 HydrophobicContact CG1-CD2 4.41Å
374S90.9Very high88.3Confident69 Ų6948.6 Ų48.648%0.48328%0.277SS..Hα-helixtrans-66.7-23.5171.623.70000113.7L370 I371 V376 K430L370-S374 PolarHBondContact O-N 2.66Å; L370-S374 PolarHBondContact O-OG 3.48Å; I371-S374 PolarHBondContact O-N 3.44Å; I371-S374 PolarHBondContact O-OG 3.34Å; S374-V376 PolarHBondContact O-N 3.19Å; S374-K430 PolarHBondContact OG-NZ 3.47Å
375A89.8Confident88Confident75 Ų7550.4 Ų50.462%0.6229%0.287SS*.THydrogen-bonded Turntrans-76.3-9.1175.600000112.3I371 Q372 I373 P377I371-A375 PolarHBondContact O-N 2.9Å; Q372-A375 WeakPolarHBondContact O-CB 3.31Å; Q372-A375 PolarHBondContact O-N 3.2Å; I373-A375 PolarHBondContact O-N 3.44Å; A375-P377 WeakPolarHBondContact O-CD 3.33Å
376V89.1Confident87.6Confident19 Ų1950.4 Ų50.412%0.11529%0.287CS..SBendtrans-84.7107.3174.3-1770000108.8I373 S374 L378 K396I373-V376 HydrophobicContact CD1-CB 4.49Å; I373-V376 HydrophobicContact CD1-CG2 4.18Å; I373-V376 WeakPolarHBondContact O-CB 3.36Å; I373-V376 PolarHBondContact O-N 2.85Å; I373-V376 VanDerWaalsContact O-N 3.11Å; S374-V376 PolarHBondContact O-N 3.19Å; V376-L378 HydrophobicContact CG1-CD2 4.21Å; V376-L378 PolarHBondContact O-N 3.14Å; V376-K396 HydrophobicContact CG1-CD 3.72Å; V376-K396 HydrophobicContact CG2-CB 4.28Å; V376-K396 HydrophobicContact CG2-CD 4.04Å
377P83.4Confident87.2Confident66 Ų6648.2 Ų48.243%0.42928%0.277SS..  trans-70.4128.5177.130.2-33.8000109.6A375A375-P377 WeakPolarHBondContact O-CD 3.33Å
378L82.7Confident86.9Confident14 Ų1451.7 Ų51.77%0.07329%0.289CS..  trans-106.2-16.4171.5-58.3-175.3000112.6V376 L390 S393 Y431 D434 F435 T438V376-L378 HydrophobicContact CG1-CD2 4.21Å; V376-L378 PolarHBondContact O-N 3.14Å; L378-L390 HydrophobicContact CB-CD2 4.27Å; L378-L390 HydrophobicContact CD1-CD2 4.48Å; L378-L390 HydrophobicContact CD2-CD2 4.36Å; L378-S393 WeakPolarHBondContact CD2-OG 3.25Å; L378-Y431 HydrophobicContact CD2-CE2 4.35Å; L378-D434 HydrophobicContact CD1-CB 3.59Å; L378-F435 HydrophobicContact CD1-CB 4.43Å; L378-T438 WeakPolarHBondContact CB-OG1 3.49Å; L378-T438 VanDerWaalsContact O-CG2 3.25Å; L378-T438 WeakPolarHBondContact O-CG2 3.43Å
379E76.4Confident86.7Confident100 Ų10053.8 Ų53.847%0.46730%0.299SS..  trans-126.1112.3-177.5-172.3174.3-170.400110.1S441 K445E379-S441 WeakPolarHBondContact OE1-CB 3.35Å; E379-S441 PolarHBondContact OE1-OG 2.84Å; E379-K445 IonicContact OE1-NZ 3.08Å
380H73.4Confident86.4Confident131 Ų13153.8 Ų53.861%0.60630%0.299SS*.  trans-151.3142.6174-170.969.3000109.7D385 C386H380-D385 WeakPolarHBondContact O-CB 3.48Å; H380-C386 PolarHBondContact O-SG 2.91Å
381G76.7Confident86.2Confident45 Ų4554.7 Ų54.746%0.46431%0.309SS..SBendtrans60.7-140.516900000115.9K445G381-K445 PolarHBondContact O-NZ 3.23Å
382E82.2Confident86.1Confident141 Ų14158 Ų5866%0.65932%0.323SS*.SBendtrans-79.4174.8-177.8-64.1-17017200112I384 D385 C386E382-I384 VanDerWaalsContact C-N 3.26Å; E382-I384 HydrophobicContact CB-CG2 4.47Å; E382-I384 PolarHBondContact O-N 3.4Å; E382-D385 PolarHBondContact N-OD2 2.69Å; E382-D385 PolarHBondContact O-N 2.88Å; E382-C386 PolarHBondContact O-N 3.42Å; E382-C386 VanDerWaalsContact O-N 3.13Å; E382-C386 PolarHBondContact O-SG 2.97Å
383V82.2Confident86.1Confident23 Ų2355 Ų5514%0.13931%0.309CS..Hα-helixtrans-60.6-38-179.41750000111.3C386 V387 I442 K445 N466V383-C386 WeakPolarHBondContact O-CB 3.46Å; V383-C386 PolarHBondContact O-N 3.49Å; V383-V387 HydrophobicContact CG1-CG2 4.43Å; V383-V387 VanDerWaalsContact O-CG2 3.27Å; V383-V387 WeakPolarHBondContact O-CG2 3.46Å; V383-V387 PolarHBondContact O-N 2.96Å; V383-I442 HydrophobicContact CG1-CG2 3.86Å; V383-K445 HydrophobicContact CG2-CB 3.63Å; V383-K445 HydrophobicContact CG2-CD 4.07Å; V383-K445 HydrophobicContact CG2-CG 4.5Å; V383-N466 HydrophobicContact CG1-CB 4.28Å
384I84.3Confident86.1Confident66 Ų6655 Ų5534%0.33831%0.309SS..Hα-helixtrans-67.1-40.6-179.5-164.8161.2000112.1E382 C386 V387 E388E382-I384 VanDerWaalsContact C-N 3.26Å; E382-I384 HydrophobicContact CB-CG2 4.47Å; E382-I384 PolarHBondContact O-N 3.4Å; I384-C386 VanDerWaalsContact C-N 3.33Å; I384-C386 PolarHBondContact O-N 3.38Å; I384-V387 PolarHBondContact O-N 3.04Å; I384-E388 PolarHBondContact O-N 3.29Å
385D86.1Confident86.2Confident62 Ų6253.9 Ų53.933%0.33231%0.309SS..Hα-helixtrans-62.7-42.1175.6-55.3-37.8000110.6H380 E382 V387 E388 E389H380-D385 WeakPolarHBondContact O-CB 3.48Å; E382-D385 PolarHBondContact N-OD2 2.69Å; E382-D385 PolarHBondContact O-N 2.88Å; D385-V387 VanDerWaalsContact C-N 3.34Å; D385-V387 PolarHBondContact O-N 2.55Å; D385-E388 PolarHBondContact O-N 2.83Å; D385-E389 WeakPolarHBondContact O-CG 3.44Å; D385-E389 PolarHBondContact O-N 3.41Å
386C86.4Confident86.4Confident1 Ų154.6 Ų54.61%0.00730%0.298CS..Hα-helixtrans-61.2-41.9174.9-63.80000111.5H380 E382 V383 I384 E389 L390 T438 I442H380-C386 PolarHBondContact O-SG 2.91Å; E382-C386 PolarHBondContact O-N 3.42Å; E382-C386 VanDerWaalsContact O-N 3.13Å; E382-C386 PolarHBondContact O-SG 2.97Å; V383-C386 WeakPolarHBondContact O-CB 3.46Å; V383-C386 PolarHBondContact O-N 3.49Å; I384-C386 VanDerWaalsContact C-N 3.33Å; I384-C386 PolarHBondContact O-N 3.38Å; C386-E389 PolarHBondContact O-N 3.44Å; C386-L390 WeakPolarHBondContact O-CB 3.25Å; C386-L390 WeakPolarHBondContact O-CG 3.31Å; C386-L390 PolarHBondContact O-N 2.87Å; C386-T438 HydrophobicContact CB-CG2 4.38Å; C386-I442 HydrophobicContact CB-CD1 4Å; C386-I442 HydrophobicContact CB-CG1 4.18Å
387V87.9Confident86.7Confident4 Ų453.7 Ų53.72%0.02429%0.292CS..Hα-helixtrans-65.1-41.1178173.20000111.4V383 I384 D385 L390 S391 N466 R469 I470V383-V387 HydrophobicContact CG1-CG2 4.43Å; V383-V387 VanDerWaalsContact O-CG2 3.27Å; V383-V387 WeakPolarHBondContact O-CG2 3.46Å; V383-V387 PolarHBondContact O-N 2.96Å; I384-V387 PolarHBondContact O-N 3.04Å; D385-V387 VanDerWaalsContact C-N 3.34Å; D385-V387 PolarHBondContact O-N 2.55Å; V387-L390 PolarHBondContact O-N 3.34Å; V387-S391 PolarHBondContact O-N 3.13Å; V387-S391 VanDerWaalsContact O-N 3.12Å; V387-N466 HydrophobicContact CG2-CB 4.12Å; V387-R469 HydrophobicContact CG1-CB 3.66Å; V387-I470 HydrophobicContact CG1-CG1 4.29Å; V387-I470 HydrophobicContact CG2-CD1 3.93Å; V387-I470 HydrophobicContact CG2-CG1 3.86Å
388E88.3Confident87.3Confident98 Ų9851.2 Ų51.246%0.45828%0.275SS..Hα-helixtrans-65.8-44.1176.2-71.4-173.7-179.600111.7I384 D385 L390 S391 H392I384-E388 PolarHBondContact O-N 3.29Å; D385-E388 PolarHBondContact O-N 2.83Å; E388-L390 PolarHBondContact O-N 3.26Å; E388-S391 WeakPolarHBondContact O-CB 3.4Å; E388-S391 PolarHBondContact O-N 3.17Å; E388-S391 VanDerWaalsContact O-N 3.13Å; E388-H392 PolarHBondContact O-N 2.93Å; E388-H392 PolarHBondContact O-ND1 3.38Å
389E89.3Confident87.8Confident57 Ų5752.8 Ų52.827%0.26629%0.294SS..Hα-helixtrans-63.3-38.8176.3-73.1-62158.600112.3D385 C386 S391 H392 S393D385-E389 WeakPolarHBondContact O-CG 3.44Å; D385-E389 PolarHBondContact O-N 3.41Å; C386-E389 PolarHBondContact O-N 3.44Å; E389-S391 VanDerWaalsContact C-N 3.27Å; E389-S391 PolarHBondContact O-N 2.88Å; E389-H392 PolarHBondContact O-N 3.02Å; E389-S393 WeakPolarHBondContact O-CB 3.47Å; E389-S393 PolarHBondContact O-N 3.01Å; E389-S393 PolarHBondContact O-OG 3.35Å
390L91Very high88.7Confident0 Ų049.5 Ų49.50%028%0.28CS..Hα-helixtrans-61.3-35.6172.8-70.8171.2000112.2L378 C386 V387 E388 S393 F435 T438 I442 I470 T473L378-L390 HydrophobicContact CB-CD2 4.27Å; L378-L390 HydrophobicContact CD1-CD2 4.48Å; L378-L390 HydrophobicContact CD2-CD2 4.36Å; C386-L390 WeakPolarHBondContact O-CB 3.25Å; C386-L390 WeakPolarHBondContact O-CG 3.31Å; C386-L390 PolarHBondContact O-N 2.87Å; V387-L390 PolarHBondContact O-N 3.34Å; E388-L390 PolarHBondContact O-N 3.26Å; L390-S393 WeakPolarHBondContact CA-OG 3.2Å; L390-S393 PolarHBondContact O-OG 2.85Å; L390-F435 HydrophobicContact CB-CE2 4Å; L390-F435 HydrophobicContact CB-CZ 4.18Å; L390-F435 HydrophobicContact CD1-CE1 4.2Å; L390-F435 HydrophobicContact CD1-CZ 4.09Å; L390-F435 HydrophobicContact CD2-CD1 4.07Å; L390-F435 HydrophobicContact CD2-CD2 3.49Å; L390-F435 VanDerWaalsContact CD2-CD2 3.49Å; L390-F435 HydrophobicContact CD2-CE1 4.16Å; L390-F435 HydrophobicContact CD2-CE2 3.57Å; L390-F435 HydrophobicContact CD2-CG 3.77Å; L390-F435 HydrophobicContact CD2-CZ 3.92Å; L390-F435 HydrophobicContact CG-CE2 4.22Å; L390-F435 HydrophobicContact CG-CZ 4.29Å; L390-T438 HydrophobicContact CD1-CG2 4.04Å; L390-T438 HydrophobicContact CD2-CG2 4.07Å; L390-T438 HydrophobicContact CG-CG2 4.22Å; L390-I442 HydrophobicContact CD1-CD1 3.89Å; L390-I470 HydrophobicContact CD1-CG1 4.47Å; L390-T473 WeakPolarHBondContact O-CG2 3.24Å
391S90.3Very high89.8Confident65 Ų6543.3 Ų43.346%0.45525%0.251SS..Hα-helixtrans-70-43.4175-169.40000111.7V387 E388 E389 S393V387-S391 PolarHBondContact O-N 3.13Å; V387-S391 VanDerWaalsContact O-N 3.12Å; E388-S391 WeakPolarHBondContact O-CB 3.4Å; E388-S391 PolarHBondContact O-N 3.17Å; E388-S391 VanDerWaalsContact O-N 3.13Å; E389-S391 VanDerWaalsContact C-N 3.27Å; E389-S391 PolarHBondContact O-N 2.88Å; S391-S393 VanDerWaalsContact C-N 3.32Å; S391-S393 PolarHBondContact O-N 3.25Å
392H91.1Very high90.7Very high115 Ų11543.3 Ų43.353%0.53224%0.244SC..Hα-helixtrans-69.4-28.9178.2-70.294.4000112.8E388 E389 V394 G395E388-H392 PolarHBondContact O-N 2.93Å; E388-H392 PolarHBondContact O-ND1 3.38Å; E389-H392 PolarHBondContact O-N 3.02Å; H392-V394 VanDerWaalsContact C-N 3.26Å; H392-V394 PolarHBondContact O-N 3.46Å; H392-G395 PolarHBondContact O-N 3.36Å
393S93.1Very high91.3Very high0 Ų037.6 Ų37.60%022%0.223CC..Hα-helixtrans-67.6-24.8-179.467.60000113.3L378 E389 L390 S391 K396 L397 Y431L378-S393 WeakPolarHBondContact CD2-OG 3.25Å; E389-S393 WeakPolarHBondContact O-CB 3.47Å; E389-S393 PolarHBondContact O-N 3.01Å; E389-S393 PolarHBondContact O-OG 3.35Å; L390-S393 WeakPolarHBondContact CA-OG 3.2Å; L390-S393 PolarHBondContact O-OG 2.85Å; S391-S393 VanDerWaalsContact C-N 3.32Å; S391-S393 PolarHBondContact O-N 3.25Å; S393-K396 PolarHBondContact O-N 3.41Å; S393-L397 WeakPolarHBondContact O-CB 3.2Å; S393-L397 PolarHBondContact O-N 2.84Å; S393-Y431 PolarHBondContact OG-OH 3.3Å
394V93.4Very high91.9Very high4 Ų436.5 Ų36.52%0.02422%0.217CC..Hα-helixtrans-58.5-50.7175.2-177.40000111H392 K396 L397 F398 T473 E476 L477H392-V394 VanDerWaalsContact C-N 3.26Å; H392-V394 PolarHBondContact O-N 3.46Å; V394-K396 VanDerWaalsContact C-N 3.31Å; V394-K396 PolarHBondContact O-N 3.29Å; V394-L397 WeakPolarHBondContact O-CB 3.42Å; V394-L397 PolarHBondContact O-N 3.35Å; V394-F398 HydrophobicContact CG1-CD2 3.98Å; V394-F398 HydrophobicContact CG1-CE2 4.04Å; V394-F398 WeakPolarHBondContact O-CD2 3.25Å; V394-F398 PolarHBondContact O-N 3.25Å; V394-F398 VanDerWaalsContact O-N 3.15Å; V394-T473 HydrophobicContact CG2-CG2 3.52Å; V394-E476 HydrophobicContact CG1-CG 4.24Å; V394-L477 HydrophobicContact CB-CD2 4.26Å; V394-L477 HydrophobicContact CG1-CD2 3.86Å; V394-L477 HydrophobicContact CG1-CG 4.13Å; V394-L477 HydrophobicContact CG2-CD1 4.29Å; V394-L477 HydrophobicContact CG2-CD2 3.84Å; V394-L477 HydrophobicContact CG2-CG 3.71Å
395G92.8Very high92.3Very high46 Ų4633.9 Ų33.947%0.47420%0.204SC..Hα-helixtrans-62.4-38.3178.700000112.5H392 G399H392-G395 PolarHBondContact O-N 3.36Å; G395-G399 PolarHBondContact O-N 2.89Å
396K93.4Very high92.7Very high90 Ų9035.9 Ų35.939%0.39121%0.211SC..Hα-helixtrans-65.3-43.5176-65.6175.2-176.6167.40111.6V376 S393 V394 G399 L400V376-K396 HydrophobicContact CG1-CD 3.72Å; V376-K396 HydrophobicContact CG2-CB 4.28Å; V376-K396 HydrophobicContact CG2-CD 4.04Å; S393-K396 PolarHBondContact O-N 3.41Å; V394-K396 VanDerWaalsContact C-N 3.31Å; V394-K396 PolarHBondContact O-N 3.29Å; K396-G399 PolarHBondContact O-N 3.47Å; K396-L400 WeakPolarHBondContact O-CG 3.13Å; K396-L400 PolarHBondContact O-N 2.93Å
397L95.6Very high93Very high0 Ų037.3 Ų37.30%022%0.216CC..Hα-helixtrans-57.7-52.5177.5174.865.6000111.8I373 S393 V394 G399 L400 A401 L427 F428 Y431 L477I373-L397 HydrophobicContact CD1-CD1 4.29Å; S393-L397 WeakPolarHBondContact O-CB 3.2Å; S393-L397 PolarHBondContact O-N 2.84Å; V394-L397 WeakPolarHBondContact O-CB 3.42Å; V394-L397 PolarHBondContact O-N 3.35Å; L397-G399 VanDerWaalsContact C-N 3.35Å; L397-L400 PolarHBondContact O-N 3.42Å; L397-A401 WeakPolarHBondContact O-CB 3.43Å; L397-A401 PolarHBondContact O-N 3.15Å; L397-L427 HydrophobicContact CD1-CD1 4.09Å; L397-L427 HydrophobicContact CD1-CD2 4.02Å; L397-L427 HydrophobicContact CD1-CG 3.81Å; L397-F428 HydrophobicContact CD1-CD1 4.43Å; L397-F428 HydrophobicContact CD1-CE1 4.41Å; L397-F428 HydrophobicContact CD2-CD1 3.95Å; L397-F428 HydrophobicContact CD2-CE1 3.7Å; L397-F428 HydrophobicContact CG-CE1 4.14Å; L397-Y431 HydrophobicContact CB-CD2 4.48Å; L397-Y431 HydrophobicContact CB-CE2 4.39Å; L397-Y431 HydrophobicContact CD1-CD1 4.5Å; L397-Y431 HydrophobicContact CD1-CD2 4.3Å; L397-Y431 HydrophobicContact CD1-CG 4.01Å; L397-Y431 HydrophobicContact CD2-CD1 3.47Å; L397-Y431 VanDerWaalsContact CD2-CD1 3.47Å; L397-Y431 HydrophobicContact CD2-CD2 4.28Å; L397-Y431 HydrophobicContact CD2-CE1 3.63Å; L397-Y431 HydrophobicContact CD2-CE2 4.38Å; L397-Y431 HydrophobicContact CD2-CG 3.8Å; L397-Y431 HydrophobicContact CG-CG 4.39Å; L397-L477 HydrophobicContact CD2-CD2 3.93Å
398F95.6Very high93.3Very high14 Ų1437.1 Ų37.16%0.06122%0.215CC..Hα-helixtrans-74.4-26.1-178.4-73.4-73.8000113.2V394 S402 F428 L477 Q480 C481 F484V394-F398 HydrophobicContact CG1-CD2 3.98Å; V394-F398 HydrophobicContact CG1-CE2 4.04Å; V394-F398 WeakPolarHBondContact O-CD2 3.25Å; V394-F398 PolarHBondContact O-N 3.25Å; V394-F398 VanDerWaalsContact O-N 3.15Å; F398-S402 VanDerWaalsContact O-CB 3.29Å; F398-S402 WeakPolarHBondContact O-CB 3.5Å; F398-S402 PolarHBondContact O-N 2.96Å; F398-S402 PolarHBondContact O-OG 3.38Å; F398-F428 HydrophobicContact CD1-CZ 4.44Å; F398-F428 HydrophobicContact CE1-CE1 4Å; F398-F428 AromaticContact CE1-CZ 3.79Å; F398-F428 HydrophobicContact CE1-CZ 3.79Å; F398-F428 HydrophobicContact CZ-CE1 4.04Å; F398-F428 HydrophobicContact CZ-CZ 4.31Å; F398-L477 HydrophobicContact CE2-CD2 4.09Å; F398-Q480 HydrophobicContact CD1-CB 4.39Å; F398-Q480 HydrophobicContact CD2-CB 3.66Å; F398-Q480 HydrophobicContact CD2-CG 4.39Å; F398-Q480 HydrophobicContact CE1-CB 4.18Å; F398-Q480 HydrophobicContact CE2-CB 3.37Å; F398-Q480 HydrophobicContact CE2-CG 4.41Å; F398-Q480 HydrophobicContact CG-CB 4.15Å; F398-Q480 HydrophobicContact CZ-CB 3.67Å; F398-C481 HydrophobicContact CE1-CB 4.32Å; F398-C481 HydrophobicContact CZ-CB 3.93Å; F398-C481 VanDerWaalsContact CZ-N 3.26Å; F398-F484 HydrophobicContact CD1-CB 3.86Å; F398-F484 HydrophobicContact CD1-CD2 4.44Å; F398-F484 HydrophobicContact CD1-CG 4.02Å; F398-F484 HydrophobicContact CE1-CB 3.85Å; F398-F484 HydrophobicContact CE1-CD1 4.44Å; F398-F484 HydrophobicContact CE1-CG 4.22Å
399G95.2Very high93.4Very high47 Ų4733.9 Ų33.949%0.48520%0.202SC..Hα-helixtrans-62.4-46167.400000112G395 K396 L397 G403G395-G399 PolarHBondContact O-N 2.89Å; K396-G399 PolarHBondContact O-N 3.47Å; L397-G399 VanDerWaalsContact C-N 3.35Å; G399-G403 PolarHBondContact O-N 3.38Å
400L95.1Very high93.4Very high31 Ų3136.6 Ų36.616%0.16221%0.21CC..Hα-helixtrans-64.3-44.7175.4-71.7174.2000111.8L369 Q372 I373 K396 L397 G403 A404 L427L369-L400 HydrophobicContact CD2-CB 4.13Å; Q372-L400 HydrophobicContact CB-CD1 4.06Å; Q372-L400 HydrophobicContact CB-CD2 3.81Å; Q372-L400 HydrophobicContact CG-CD2 4.32Å; I373-L400 HydrophobicContact CB-CD1 4.38Å; I373-L400 HydrophobicContact CD1-CD1 4.07Å; K396-L400 WeakPolarHBondContact O-CG 3.13Å; K396-L400 PolarHBondContact O-N 2.93Å; L397-L400 PolarHBondContact O-N 3.42Å; L400-G403 PolarHBondContact O-N 2.79Å; L400-A404 PolarHBondContact O-N 2.69Å; L400-L427 HydrophobicContact CB-CD2 4.49Å
401A95.7Very high93.3Very high0 Ų036.6 Ų36.60%021%0.21CC..Hα-helixtrans-62.5-45.3178.200000112.1L397 A404 V405 L424 L427 F484L397-A401 WeakPolarHBondContact O-CB 3.43Å; L397-A401 PolarHBondContact O-N 3.15Å; A401-A404 WeakPolarHBondContact O-CB 3.32Å; A401-A404 PolarHBondContact O-N 3.01Å; A401-V405 WeakPolarHBondContact O-CG2 3.38Å; A401-V405 PolarHBondContact O-N 3.23Å; A401-L424 HydrophobicContact CB-CD2 3.85Å; A401-L427 HydrophobicContact CB-CD2 4.15Å; A401-F484 HydrophobicContact CB-CE1 4.04Å; A401-F484 HydrophobicContact CB-CE2 3.92Å; A401-F484 HydrophobicContact CB-CZ 3.61Å
402S95.3Very high93.1Very high46 Ų4633.6 Ų33.632%0.32219%0.189SC..Hα-helixtrans-65.3-40.3176.1-56.60000111.8F398 A404 V405 E406F398-S402 VanDerWaalsContact O-CB 3.29Å; F398-S402 WeakPolarHBondContact O-CB 3.5Å; F398-S402 PolarHBondContact O-N 2.96Å; F398-S402 PolarHBondContact O-OG 3.38Å; S402-A404 VanDerWaalsContact C-N 3.27Å; S402-A404 PolarHBondContact O-N 3.4Å; S402-V405 WeakPolarHBondContact O-CB 3.41Å; S402-V405 PolarHBondContact O-N 2.95Å; S402-E406 PolarHBondContact O-N 3.32Å; S402-E406 VanDerWaalsContact O-N 3.15Å
403G94.4Very high92.7Very high21 Ų2132.2 Ų32.222%0.21619%0.185CC..Hα-helixtrans-59-37.9172.900000112.7G399 L400 V405 E406 R407G399-G403 PolarHBondContact O-N 3.38Å; L400-G403 PolarHBondContact O-N 2.79Å; G403-V405 VanDerWaalsContact C-N 3.32Å; G403-V405 PolarHBondContact O-N 3.29Å; G403-E406 PolarHBondContact O-N 2.92Å; G403-R407 VanDerWaalsContact C-CZ 3.5Å; G403-R407 WeakPolarHBondContact O-CG 3.25Å; G403-R407 PolarHBondContact O-N 3.19Å
404A95Very high92.1Very high0 Ų032.3 Ų32.30%019%0.186CC..Hα-helixtrans-63.8-37.1176.900000112.4Y361 E365 L369 L400 A401 S402 R407 C408 L420 L424Y361-A404 PolarHBondContact OH-O 2.89Å; E365-A404 HydrophobicContact CG-CB 4.29Å; E365-A404 WeakPolarHBondContact OE1-CA 3.24Å; E365-A404 WeakPolarHBondContact OE1-CB 3.41Å; L369-A404 HydrophobicContact CD1-CB 3.99Å; L369-A404 HydrophobicContact CD2-CB 4.29Å; L400-A404 PolarHBondContact O-N 2.69Å; A401-A404 WeakPolarHBondContact O-CB 3.32Å; A401-A404 PolarHBondContact O-N 3.01Å; S402-A404 VanDerWaalsContact C-N 3.27Å; S402-A404 PolarHBondContact O-N 3.4Å; A404-R407 VanDerWaalsContact CA-NH2 3.34Å; A404-R407 VanDerWaalsContact N-NH2 3.19Å; A404-C408 VanDerWaalsContact O-CB 3.32Å; A404-C408 WeakPolarHBondContact O-CB 3.39Å; A404-C408 PolarHBondContact O-N 3.26Å; A404-L420 HydrophobicContact CB-CD1 3.75Å; A404-L420 WeakPolarHBondContact O-CD1 3.39Å; A404-L424 HydrophobicContact CB-CD2 4.28Å
405V94Very high91.7Very high11 Ų1132.3 Ų32.37%0.06719%0.186CC..Hα-helixtrans-64-48.5174.7-177.60000110.6A401 S402 G403 R407 C408 V409 L420 F484 L488 K491A401-V405 WeakPolarHBondContact O-CG2 3.38Å; A401-V405 PolarHBondContact O-N 3.23Å; S402-V405 WeakPolarHBondContact O-CB 3.41Å; S402-V405 PolarHBondContact O-N 2.95Å; G403-V405 VanDerWaalsContact C-N 3.32Å; G403-V405 PolarHBondContact O-N 3.29Å; V405-R407 PolarHBondContact O-N 2.84Å; V405-C408 WeakPolarHBondContact O-CB 3.47Å; V405-C408 PolarHBondContact O-N 3.32Å; V405-V409 WeakPolarHBondContact O-CG2 3.43Å; V405-V409 PolarHBondContact O-N 2.93Å; V405-L420 HydrophobicContact CG2-CD2 4.28Å; V405-F484 HydrophobicContact CG2-CE2 4.08Å; V405-F484 HydrophobicContact CG2-CZ 3.9Å; V405-L488 HydrophobicContact CG1-CD1 4.29Å; V405-L488 HydrophobicContact CG2-CD1 3.64Å; V405-K491 HydrophobicContact CG1-CB 4.28Å; V405-K491 HydrophobicContact CG1-CG 3.84Å
406E93.2Very high91.5Very high103 Ų10330.6 Ų30.648%0.48117%0.167SC..Hα-helixtrans-64.6-40.3179.4-65-58.6151.300112.1S402 G403 C408 V409 R410 K491S402-E406 PolarHBondContact O-N 3.32Å; S402-E406 VanDerWaalsContact O-N 3.15Å; G403-E406 PolarHBondContact O-N 2.92Å; E406-C408 VanDerWaalsContact C-N 3.32Å; E406-C408 PolarHBondContact O-N 2.73Å; E406-V409 PolarHBondContact O-N 3.4Å; E406-R410 WeakPolarHBondContact O-CB 3.49Å; E406-R410 PolarHBondContact O-N 3.38Å; E406-K491 IonicContact OE1-NZ 2.72Å; E406-K491 PolarHBondContact OE1-NZ 3.28Å; E406-K491 IonicContact OE2-NZ 2.76Å; E406-K491 PolarHBondContact OE2-NZ 2.9Å
407R93.8Very high91.3Very high31 Ų3126.4 Ų26.412%0.11715%0.149CC..Hα-helixtrans-61.5-40.2173.6-71.8-171.7-68.3-86.4-1.7112.1L314 E365 G403 A404 V405 V409 R410 L411L314-R407 HydrophobicContact CD1-CB 4.03Å; L314-R407 HydrophobicContact CD1-CG 3.67Å; E365-R407 IonicContact OE1-CZ 3.15Å; E365-R407 IonicContact OE1-NE 2.71Å; E365-R407 PolarHBondContact OE1-NE 3.06Å; E365-R407 VanDerWaalsContact OE1-NE 3.14Å; E365-R407 IonicContact OE1-NH2 3.83Å; E365-R407 PolarHBondContact OE1-NH2 3.2Å; E365-R407 IonicContact OE2-NE 2.7Å; E365-R407 PolarHBondContact OE2-NE 3.49Å; G403-R407 VanDerWaalsContact C-CZ 3.5Å; G403-R407 WeakPolarHBondContact O-CG 3.25Å; G403-R407 PolarHBondContact O-N 3.19Å; A404-R407 VanDerWaalsContact CA-NH2 3.34Å; A404-R407 VanDerWaalsContact N-NH2 3.19Å; V405-R407 PolarHBondContact O-N 2.84Å; R407-V409 VanDerWaalsContact C-N 3.35Å; R407-V409 PolarHBondContact O-N 3.03Å; R407-R410 PolarHBondContact O-N 2.97Å; R407-L411 PolarHBondContact O-N 3.05Å
408C92.8Very high91Very high1 Ų128.1 Ų28.11%0.00716%0.161CC..Hα-helixtrans-63.2-43.7178.6-176.30000111Y361 A404 V405 E406 T412 L420Y361-C408 HydrophobicContact CE1-CB 3.76Å; Y361-C408 WeakPolarHBondContact OH-CA 3.43Å; Y361-C408 WeakPolarHBondContact OH-CB 3.32Å; Y361-C408 PolarHBondContact OH-N 3.46Å; A404-C408 VanDerWaalsContact O-CB 3.32Å; A404-C408 WeakPolarHBondContact O-CB 3.39Å; A404-C408 PolarHBondContact O-N 3.26Å; V405-C408 WeakPolarHBondContact O-CB 3.47Å; V405-C408 PolarHBondContact O-N 3.32Å; E406-C408 VanDerWaalsContact C-N 3.32Å; E406-C408 PolarHBondContact O-N 2.73Å; C408-T412 PolarHBondContact O-N 3.19Å; C408-T412 PolarHBondContact O-OG1 3.12Å; C408-L420 HydrophobicContact CB-CB 4.47Å; C408-L420 HydrophobicContact CB-CD1 4.26Å; C408-L420 HydrophobicContact CB-CD2 3.85Å; C408-L420 HydrophobicContact CB-CG 4.42Å
409V90.7Very high90.7Very high29 Ų2928.2 Ų28.218%0.17617%0.166CC..Hα-helixtrans-64.4-46.1175.7175.40000110.2V405 E406 R407 L411 D413 K491 T495V405-V409 WeakPolarHBondContact O-CG2 3.43Å; V405-V409 PolarHBondContact O-N 2.93Å; E406-V409 PolarHBondContact O-N 3.4Å; R407-V409 VanDerWaalsContact C-N 3.35Å; R407-V409 PolarHBondContact O-N 3.03Å; V409-L411 PolarHBondContact O-N 3.05Å; V409-D413 VanDerWaalsContact O-CA 3.28Å; V409-D413 WeakPolarHBondContact O-CA 3.46Å; V409-D413 PolarHBondContact O-N 3.42Å; V409-K491 HydrophobicContact CG2-CG 4.36Å; V409-T495 HydrophobicContact CG1-CG2 4.01Å; V409-T495 HydrophobicContact CG2-CG2 4.06Å
410R89.6Confident90.6Very high114 Ų11426 Ų2643%0.4314%0.143SC..Hα-helixtrans-62.1-37-177.9-171.3171.368.8-176.23.2113.9L314 E406 R407L314-R410 HydrophobicContact CD2-CB 4.44Å; E406-R410 WeakPolarHBondContact O-CB 3.49Å; E406-R410 PolarHBondContact O-N 3.38Å; R407-R410 PolarHBondContact O-N 2.97Å
411L88.8Confident90.5Very high1 Ų125.3 Ų25.31%0.00514%0.139CC..Hα-helixtrans-90-30.1-178-168.862.5000114.1L313 L314 H317 Q358 Y361 R407 V409L313-L411 HydrophobicContact CD2-CD1 4.4Å; L313-L411 HydrophobicContact CD2-CD2 3.88Å; L313-L411 HydrophobicContact CG-CD1 4.24Å; L314-L411 HydrophobicContact CD2-CB 3.63Å; L314-L411 HydrophobicContact CD2-CD1 4.19Å; L314-L411 HydrophobicContact CD2-CD2 4.44Å; L314-L411 HydrophobicContact CD2-CG 4.28Å; H317-L411 HydrophobicContact CB-CD1 3.63Å; H317-L411 PolarHBondContact NE2-O 2.82Å; Q358-L411 HydrophobicContact CG-CG 4.28Å; Q358-L411 PolarHBondContact NE2-O 3.31Å; Y361-L411 HydrophobicContact CD2-CD2 3.44Å; Y361-L411 VanDerWaalsContact CD2-CD2 3.44Å; Y361-L411 HydrophobicContact CE2-CD2 3.99Å; Y361-L411 HydrophobicContact CG-CD2 4.28Å; R407-L411 PolarHBondContact O-N 3.05Å; V409-L411 PolarHBondContact O-N 3.05Å
412T86.8Confident90.4Very high2 Ų230.3 Ų30.31%0.01216%0.158CC..Hα-helixtrans-133.56.9-164.872.60000114.5Q358 Y361 C408 G414 L415 A416 Y533Q358-T412 HydrophobicContact CB-CG2 4.35Å; Q358-T412 HydrophobicContact CG-CG2 4.29Å; Y361-T412 HydrophobicContact CG-CG2 4.49Å; C408-T412 PolarHBondContact O-N 3.19Å; C408-T412 PolarHBondContact O-OG1 3.12Å; T412-G414 PolarHBondContact O-N 3.47Å; T412-L415 VanDerWaalsContact O-CB 3.29Å; T412-L415 WeakPolarHBondContact O-CB 3.48Å; T412-L415 WeakPolarHBondContact O-CG 3.46Å; T412-L415 PolarHBondContact O-N 2.91Å; T412-A416 HydrophobicContact CG2-CB 3.72Å; T412-A416 WeakPolarHBondContact OG1-CB 3.46Å; T412-A416 PolarHBondContact OG1-N 2.91Å; T412-Y533 WeakPolarHBondContact CB-OH 3.38Å; T412-Y533 HydrophobicContact CG2-CE1 4.1Å
413D82.9Confident90.4Very high86 Ų8628.1 Ų28.146%0.4614%0.143SC..THydrogen-bonded Turntrans53.126.6-174.7-68.5-39.9000113.9V409V409-D413 VanDerWaalsContact O-CA 3.28Å; V409-D413 WeakPolarHBondContact O-CA 3.46Å; V409-D413 PolarHBondContact O-N 3.42Å
414G80.9Confident90.5Very high1 Ų127.1 Ų27.11%0.0113%0.132CC..THydrogen-bonded Turntrans819.4-17700000114.7T412 V417 A496T412-G414 PolarHBondContact O-N 3.47Å; G414-V417 WeakPolarHBondContact O-CG2 3.49Å; G414-A496 WeakPolarHBondContact O-CB 3.41Å
415L84.8Confident90.5Very high4 Ų430.2 Ų30.22%0.02115%0.146CC..THydrogen-bonded Turntrans-74.8-27.3176.1-65.8170.9000112.6T412 V417 Y499 Y533 L545T412-L415 VanDerWaalsContact O-CB 3.29Å; T412-L415 WeakPolarHBondContact O-CB 3.48Å; T412-L415 WeakPolarHBondContact O-CG 3.46Å; T412-L415 PolarHBondContact O-N 2.91Å; L415-V417 PolarHBondContact O-N 3.08Å; L415-V417 VanDerWaalsContact O-N 3.15Å; L415-Y499 HydrophobicContact CD1-CE2 4.49Å; L415-Y499 HydrophobicContact CD2-CD2 3.68Å; L415-Y499 HydrophobicContact CD2-CE2 3.66Å; L415-Y499 HydrophobicContact CD2-CG 4.28Å; L415-Y499 HydrophobicContact CG-CE2 4.09Å; L415-Y533 HydrophobicContact CB-CE1 3.68Å; L415-Y533 WeakPolarHBondContact CB-OH 3.47Å; L415-Y533 HydrophobicContact CD1-CD1 3.98Å; L415-Y533 HydrophobicContact CD1-CE1 3.7Å; L415-Y533 HydrophobicContact CG-CE1 4.31Å; L415-L545 HydrophobicContact CB-CD2 4.48Å; L415-L545 HydrophobicContact CD2-CD2 3.84Å
416A87.8Confident90.6Very high11 Ų1130.6 Ų30.69%0.09115%0.15CC..THydrogen-bonded Turntrans-83.724.4-179.700000114.2Y361 T412 C418 G419 L420 Y533Y361-A416 HydrophobicContact CD1-CB 3.59Å; Y361-A416 HydrophobicContact CE1-CB 4.35Å; Y361-A416 HydrophobicContact CG-CB 4.24Å; T412-A416 HydrophobicContact CG2-CB 3.72Å; T412-A416 WeakPolarHBondContact OG1-CB 3.46Å; T412-A416 PolarHBondContact OG1-N 2.91Å; A416-C418 VanDerWaalsContact C-N 3.28Å; A416-C418 PolarHBondContact O-N 3.17Å; A416-G419 WeakPolarHBondContact O-CA 3.45Å; A416-G419 PolarHBondContact O-N 2.81Å; A416-L420 PolarHBondContact O-N 3Å; A416-Y533 WeakPolarHBondContact CB-OH 3.5Å; A416-Y533 PolarHBondContact N-OH 3.5Å; A416-Y533 VanDerWaalsContact N-OH 3.15Å
417V89.2Confident90.7Very high2 Ų225.7 Ų25.71%0.01213%0.127CC..Hα-helixtrans-58.6-36.8-176.3162.50000112.7G414 L415 G419 L420 L421 I492 L545G414-V417 WeakPolarHBondContact O-CG2 3.49Å; L415-V417 PolarHBondContact O-N 3.08Å; L415-V417 VanDerWaalsContact O-N 3.15Å; V417-G419 VanDerWaalsContact C-N 3.31Å; V417-G419 PolarHBondContact O-N 2.79Å; V417-L420 WeakPolarHBondContact O-CB 3.34Å; V417-L420 PolarHBondContact O-N 3.37Å; V417-L421 HydrophobicContact CG1-CD1 4.01Å; V417-L421 HydrophobicContact CG1-CG 4.2Å; V417-L421 WeakPolarHBondContact O-CB 3.48Å; V417-L421 VanDerWaalsContact O-CG 3.3Å; V417-L421 WeakPolarHBondContact O-CG 3.29Å; V417-L421 PolarHBondContact O-N 3.13Å; V417-I492 HydrophobicContact CG1-CD1 3.6Å; V417-I492 HydrophobicContact CG1-CG1 4.08Å; V417-I492 HydrophobicContact CG1-CG2 4.22Å; V417-I492 HydrophobicContact CG2-CB 4.49Å; V417-I492 HydrophobicContact CG2-CD1 4.2Å; V417-I492 HydrophobicContact CG2-CG1 3.75Å; V417-I492 HydrophobicContact CG2-CG2 4.14Å; V417-L545 HydrophobicContact CB-CD1 3.83Å; V417-L545 HydrophobicContact CG1-CD1 4.37Å
418C88.7Confident90.8Very high35 Ų3524.2 Ų24.224%0.23612%0.122CC..Hα-helixtrans-59-43.4174.9-61.30000111.8A416 R422A416-C418 VanDerWaalsContact C-N 3.28Å; A416-C418 PolarHBondContact O-N 3.17Å; C418-R422 PolarHBondContact O-N 3.11Å
419G90.5Very high90.9Very high16 Ų1628.6 Ų28.617%0.16515%0.149CC..Hα-helixtrans-68-40.8175.500000112.6A416 V417 R422 A423A416-G419 WeakPolarHBondContact O-CA 3.45Å; A416-G419 PolarHBondContact O-N 2.81Å; V417-G419 VanDerWaalsContact C-N 3.31Å; V417-G419 PolarHBondContact O-N 2.79Å; G419-R422 PolarHBondContact O-N 3.37Å; G419-A423 PolarHBondContact O-N 3.4Å
420L93.6Very high91.1Very high1 Ų129.7 Ų29.71%0.00515%0.151CC..Hα-helixtrans-60.1-46174.7176.665.4000112A404 V405 C408 A416 V417 R422 A423 L424 L488A404-L420 HydrophobicContact CB-CD1 3.75Å; A404-L420 WeakPolarHBondContact O-CD1 3.39Å; V405-L420 HydrophobicContact CG2-CD2 4.28Å; C408-L420 HydrophobicContact CB-CB 4.47Å; C408-L420 HydrophobicContact CB-CD1 4.26Å; C408-L420 HydrophobicContact CB-CD2 3.85Å; C408-L420 HydrophobicContact CB-CG 4.42Å; A416-L420 PolarHBondContact O-N 3Å; V417-L420 WeakPolarHBondContact O-CB 3.34Å; V417-L420 PolarHBondContact O-N 3.37Å; L420-R422 VanDerWaalsContact C-N 3.29Å; L420-R422 PolarHBondContact O-N 3.41Å; L420-A423 PolarHBondContact O-N 3.34Å; L420-L424 HydrophobicContact CD1-CD1 4.2Å; L420-L424 HydrophobicContact CD1-CG 4.12Å; L420-L424 HydrophobicContact CG-CD1 3.97Å; L420-L424 HydrophobicContact CG-CG 4.32Å; L420-L424 WeakPolarHBondContact O-CB 3.42Å; L420-L424 WeakPolarHBondContact O-CG 3.41Å; L420-L424 PolarHBondContact O-N 3.31Å; L420-L488 HydrophobicContact CD2-CD1 4.2Å
421L92.7Very high91.4Very high17 Ų1724.3 Ų24.39%0.08913%0.131CC..Hα-helixtrans-61.3-39.2178.7-71.6173.7000111.4V417 K425 L488 I548 L562V417-L421 HydrophobicContact CG1-CD1 4.01Å; V417-L421 HydrophobicContact CG1-CG 4.2Å; V417-L421 WeakPolarHBondContact O-CB 3.48Å; V417-L421 VanDerWaalsContact O-CG 3.3Å; V417-L421 WeakPolarHBondContact O-CG 3.29Å; V417-L421 PolarHBondContact O-N 3.13Å; L421-K425 WeakPolarHBondContact O-CB 3.23Å; L421-K425 VanDerWaalsContact O-CG 3.25Å; L421-K425 WeakPolarHBondContact O-CG 3.44Å; L421-K425 PolarHBondContact O-N 2.87Å; L421-L488 HydrophobicContact CD2-CD2 3.92Å; L421-I548 HydrophobicContact CD1-CD1 4.26Å; L421-L562 HydrophobicContact CD1-CD2 4.12Å; L421-L562 HydrophobicContact CD2-CB 4.07Å; L421-L562 HydrophobicContact CD2-CD1 4.5Å
422R93.6Very high91.7Very high105 Ų10525.3 Ų25.340%0.39614%0.137SC..Hα-helixtrans-62-48.8172.7178175.958.695.5-11.9111.7E363 E366 C418 G419 L420 L424 K425 A426E363-R422 VanDerWaalsContact CG-NH2 3.3Å; E363-R422 VanDerWaalsContact N-NH2 3.15Å; E366-R422 IonicContact OE2-CZ 2.78Å; E366-R422 IonicContact OE2-NH1 3.53Å; E366-R422 PolarHBondContact OE2-NH1 2.98Å; C418-R422 PolarHBondContact O-N 3.11Å; G419-R422 PolarHBondContact O-N 3.37Å; L420-R422 VanDerWaalsContact C-N 3.29Å; L420-R422 PolarHBondContact O-N 3.41Å; R422-L424 PolarHBondContact O-N 2.91Å; R422-K425 WeakPolarHBondContact O-CB 3.4Å; R422-K425 PolarHBondContact O-N 3.44Å; R422-A426 PolarHBondContact O-N 3.19Å
423A95.7Very high92.1Very high0 Ų028.4 Ų28.40%016%0.158CC..Hα-helixtrans-62-41.6179.300000112.4E365 E366 L369 G419 L420 A426 L427E365-A423 HydrophobicContact CB-CB 4.17Å; E365-A423 HydrophobicContact CG-CB 4.01Å; E366-A423 HydrophobicContact CB-CB 3.93Å; L369-A423 HydrophobicContact CD1-CB 4.21Å; G419-A423 PolarHBondContact O-N 3.4Å; L420-A423 PolarHBondContact O-N 3.34Å; A423-A426 PolarHBondContact O-N 2.98Å; A423-L427 PolarHBondContact O-N 3.41Å
424L95.4Very high92.5Very high0 Ų026.7 Ų26.70%015%0.149CC..Hα-helixtrans-62.9-43.9174.9-71.8174.1000111.6A401 A404 L420 R422 A426 L427 F428 F484 L488 L563A401-L424 HydrophobicContact CB-CD2 3.85Å; A404-L424 HydrophobicContact CB-CD2 4.28Å; L420-L424 HydrophobicContact CD1-CD1 4.2Å; L420-L424 HydrophobicContact CD1-CG 4.12Å; L420-L424 HydrophobicContact CG-CD1 3.97Å; L420-L424 HydrophobicContact CG-CG 4.32Å; L420-L424 WeakPolarHBondContact O-CB 3.42Å; L420-L424 WeakPolarHBondContact O-CG 3.41Å; L420-L424 PolarHBondContact O-N 3.31Å; R422-L424 PolarHBondContact O-N 2.91Å; L424-A426 VanDerWaalsContact C-N 3.31Å; L424-A426 PolarHBondContact O-N 3.41Å; L424-L427 HydrophobicContact CD2-CD2 4.42Å; L424-L427 WeakPolarHBondContact O-CB 3.35Å; L424-L427 PolarHBondContact O-N 3.01Å; L424-F428 WeakPolarHBondContact O-CD2 3.35Å; L424-F428 PolarHBondContact O-N 3.36Å; L424-F484 HydrophobicContact CD1-CE1 4.14Å; L424-F484 HydrophobicContact CD1-CZ 4.19Å; L424-F484 HydrophobicContact CD2-CE1 4.44Å; L424-F484 HydrophobicContact CD2-CZ 4.27Å; L424-L488 HydrophobicContact CD1-CD2 4Å; L424-L563 HydrophobicContact CB-CD2 4.44Å
425K94.7Very high93.1Very high64 Ų6426.6 Ų26.628%0.27815%0.149SC..Hα-helixtrans-58.5-43.1175-75.3175.6175.5-153.60111.8L421 R422 T429 E565 P566L421-K425 WeakPolarHBondContact O-CB 3.23Å; L421-K425 VanDerWaalsContact O-CG 3.25Å; L421-K425 WeakPolarHBondContact O-CG 3.44Å; L421-K425 PolarHBondContact O-N 2.87Å; R422-K425 WeakPolarHBondContact O-CB 3.4Å; R422-K425 PolarHBondContact O-N 3.44Å; K425-T429 WeakPolarHBondContact O-CB 3.44Å; K425-T429 PolarHBondContact O-N 2.77Å; K425-T429 PolarHBondContact O-OG1 2.89Å; K425-E565 WeakPolarHBondContact CD-OE2 3.14Å; K425-E565 WeakPolarHBondContact CE-OE2 3.29Å; K425-E565 VanDerWaalsContact NZ-CD 3.31Å; K425-E565 IonicContact NZ-OE1 3.55Å; K425-E565 PolarHBondContact NZ-OE1 3.45Å; K425-E565 IonicContact NZ-OE2 3.34Å; K425-E565 PolarHBondContact NZ-OE2 3.46Å; K425-P566 HydrophobicContact CG-CG 4.19Å
426A96Very high93.5Very high19 Ų1927.2 Ų27.216%0.15715%0.153CC..Hα-helixtrans-63.7-43.6176.300000112E366 R422 A423 L424 T429 K430E366-A426 HydrophobicContact CG-CB 3.75Å; R422-A426 PolarHBondContact O-N 3.19Å; A423-A426 PolarHBondContact O-N 2.98Å; L424-A426 VanDerWaalsContact C-N 3.31Å; L424-A426 PolarHBondContact O-N 3.41Å; A426-T429 PolarHBondContact O-N 2.94Å; A426-K430 PolarHBondContact O-N 3.42Å
427L96.3Very high93.6Very high0 Ų030 Ų300%017%0.169CC..Hα-helixtrans-55.9-54.2174.5172.767.6000111.7L369 I373 L397 L400 A401 A423 L424 T429 K430 Y431L369-L427 HydrophobicContact CB-CB 4.46Å; L369-L427 HydrophobicContact CB-CD1 4.3Å; L369-L427 HydrophobicContact CD1-CB 4.34Å; L369-L427 HydrophobicContact CD1-CD2 4.26Å; L369-L427 HydrophobicContact CD2-CD2 4.27Å; I373-L427 HydrophobicContact CB-CD1 3.7Å; I373-L427 HydrophobicContact CD1-CD1 4.21Å; I373-L427 HydrophobicContact CG1-CD1 3.91Å; I373-L427 HydrophobicContact CG2-CD1 4.02Å; L397-L427 HydrophobicContact CD1-CD1 4.09Å; L397-L427 HydrophobicContact CD1-CD2 4.02Å; L397-L427 HydrophobicContact CD1-CG 3.81Å; L400-L427 HydrophobicContact CB-CD2 4.49Å; A401-L427 HydrophobicContact CB-CD2 4.15Å; A423-L427 PolarHBondContact O-N 3.41Å; L424-L427 HydrophobicContact CD2-CD2 4.42Å; L424-L427 WeakPolarHBondContact O-CB 3.35Å; L424-L427 PolarHBondContact O-N 3.01Å; L427-T429 VanDerWaalsContact C-N 3.32Å; L427-T429 PolarHBondContact O-N 3.43Å; L427-K430 PolarHBondContact O-N 3Å; L427-Y431 WeakPolarHBondContact O-CB 3.42Å; L427-Y431 PolarHBondContact O-N 3.39Å
428F95.6Very high93.7Very high1 Ų130 Ų300%0.00417%0.169CC..Hα-helixtrans-63.5-37.9179.3-79.2-73.9000112.1L397 F398 L424 Y431 V432 F484 L563 P566L397-F428 HydrophobicContact CD1-CD1 4.43Å; L397-F428 HydrophobicContact CD1-CE1 4.41Å; L397-F428 HydrophobicContact CD2-CD1 3.95Å; L397-F428 HydrophobicContact CD2-CE1 3.7Å; L397-F428 HydrophobicContact CG-CE1 4.14Å; F398-F428 HydrophobicContact CD1-CZ 4.44Å; F398-F428 HydrophobicContact CE1-CE1 4Å; F398-F428 AromaticContact CE1-CZ 3.79Å; F398-F428 HydrophobicContact CE1-CZ 3.79Å; F398-F428 HydrophobicContact CZ-CE1 4.04Å; F398-F428 HydrophobicContact CZ-CZ 4.31Å; L424-F428 WeakPolarHBondContact O-CD2 3.35Å; L424-F428 PolarHBondContact O-N 3.36Å; F428-Y431 PolarHBondContact O-N 2.86Å; F428-V432 WeakPolarHBondContact O-CB 3.44Å; F428-V432 VanDerWaalsContact O-CG2 3.24Å; F428-V432 WeakPolarHBondContact O-CG2 3.47Å; F428-V432 PolarHBondContact O-N 3.15Å; F428-F484 HydrophobicContact CE2-CE1 4.49Å; F428-L563 HydrophobicContact CE2-CD1 4.26Å; F428-P566 HydrophobicContact CB-CB 3.78Å; F428-P566 HydrophobicContact CB-CG 4.07Å; F428-P566 HydrophobicContact CD1-CB 4.46Å; F428-P566 HydrophobicContact CD2-CB 4.07Å; F428-P566 HydrophobicContact CD2-CG 4.19Å; F428-P566 HydrophobicContact CG-CB 3.87Å; F428-P566 HydrophobicContact CG-CG 4.32Å
429T95.5Very high93.7Very high93 Ų9328.7 Ų28.757%0.57116%0.16SC*.Hα-helixtrans-63.7-45.3178.3-58.50000111.4K425 A426 L427 S433K425-T429 WeakPolarHBondContact O-CB 3.44Å; K425-T429 PolarHBondContact O-N 2.77Å; K425-T429 PolarHBondContact O-OG1 2.89Å; A426-T429 PolarHBondContact O-N 2.94Å; L427-T429 VanDerWaalsContact C-N 3.32Å; L427-T429 PolarHBondContact O-N 3.43Å; T429-S433 WeakPolarHBondContact O-CB 3.35Å; T429-S433 PolarHBondContact O-N 3.23Å
430K94.9Very high93.5Very high52 Ų5233.1 Ų33.123%0.22618%0.176CC..Hα-helixtrans-62.7-48.1175.5178.4168.6172.7-177.20111.2L370 I373 S374 A426 L427 V432 S433 D434L370-K430 HydrophobicContact CB-CD 4.5Å; L370-K430 HydrophobicContact CD2-CB 3.81Å; L370-K430 HydrophobicContact CD2-CD 3.5Å; L370-K430 VanDerWaalsContact CD2-CD 3.5Å; L370-K430 HydrophobicContact CD2-CG 4.28Å; L370-K430 PolarHBondContact O-NZ 3.47Å; I373-K430 HydrophobicContact CG2-CB 4.49Å; I373-K430 HydrophobicContact CG2-CD 3.52Å; I373-K430 HydrophobicContact CG2-CG 4.01Å; S374-K430 PolarHBondContact OG-NZ 3.47Å; A426-K430 PolarHBondContact O-N 3.42Å; L427-K430 PolarHBondContact O-N 3Å; K430-V432 PolarHBondContact O-N 2.87Å; K430-S433 WeakPolarHBondContact O-CB 3.46Å; K430-S433 PolarHBondContact O-N 3.41Å; K430-S433 VanDerWaalsContact O-N 3.14Å; K430-D434 PolarHBondContact O-N 2.83Å
431Y95.6Very high93.2Very high1 Ų134.1 Ų34.10%0.00418%0.183CC..Hα-helixtrans-58-45.8178179.4-99.5000112.8I373 L378 S393 L397 L427 F428 S433 D434 F435 L477I373-Y431 HydrophobicContact CD1-CD2 3.99Å; I373-Y431 HydrophobicContact CG1-CD2 4.41Å; L378-Y431 HydrophobicContact CD2-CE2 4.35Å; S393-Y431 PolarHBondContact OG-OH 3.3Å; L397-Y431 HydrophobicContact CB-CD2 4.48Å; L397-Y431 HydrophobicContact CB-CE2 4.39Å; L397-Y431 HydrophobicContact CD1-CD1 4.5Å; L397-Y431 HydrophobicContact CD1-CD2 4.3Å; L397-Y431 HydrophobicContact CD1-CG 4.01Å; L397-Y431 HydrophobicContact CD2-CD1 3.47Å; L397-Y431 VanDerWaalsContact CD2-CD1 3.47Å; L397-Y431 HydrophobicContact CD2-CD2 4.28Å; L397-Y431 HydrophobicContact CD2-CE1 3.63Å; L397-Y431 HydrophobicContact CD2-CE2 4.38Å; L397-Y431 HydrophobicContact CD2-CG 3.8Å; L397-Y431 HydrophobicContact CG-CG 4.39Å; L427-Y431 WeakPolarHBondContact O-CB 3.42Å; L427-Y431 PolarHBondContact O-N 3.39Å; F428-Y431 PolarHBondContact O-N 2.86Å; Y431-S433 VanDerWaalsContact C-N 3.3Å; Y431-S433 PolarHBondContact O-N 3.43Å; Y431-D434 PolarHBondContact O-N 2.8Å; Y431-F435 AromaticContact CE1-CD2 3.93Å; Y431-F435 HydrophobicContact CE1-CD2 3.93Å; Y431-F435 AromaticContact CZ-CD2 3.82Å; Y431-F435 VanDerWaalsContact O-CB 3.31Å; Y431-F435 WeakPolarHBondContact O-CB 3.32Å; Y431-F435 PolarHBondContact O-N 3Å; Y431-L477 HydrophobicContact CE1-CD1 4.03Å; Y431-L477 HydrophobicContact CE1-CD2 3.65Å
432V94.9Very high92.9Very high22 Ų2233.3 Ų33.313%0.13318%0.179CC..Hα-helixtrans-63.5-38.2177.7170.20000111.3F428 K430 S436 A569 L570F428-V432 WeakPolarHBondContact O-CB 3.44Å; F428-V432 VanDerWaalsContact O-CG2 3.24Å; F428-V432 WeakPolarHBondContact O-CG2 3.47Å; F428-V432 PolarHBondContact O-N 3.15Å; K430-V432 PolarHBondContact O-N 2.87Å; V432-S436 VanDerWaalsContact O-CB 3.25Å; V432-S436 WeakPolarHBondContact O-CB 3.34Å; V432-S436 PolarHBondContact O-N 3Å; V432-A569 HydrophobicContact CG1-CB 4.26Å; V432-A569 HydrophobicContact CG2-CB 4.31Å; V432-L570 HydrophobicContact CG2-CD2 3.74Å; V432-L570 HydrophobicContact CG2-CG 4.33Å
433S93.9Very high92.5Very high67 Ų6731.3 Ų31.347%0.46917%0.172SC..Hα-helixtrans-61.5-52.7174.3-177.70000111T429 K430 Y431 F435 S436 T437T429-S433 WeakPolarHBondContact O-CB 3.35Å; T429-S433 PolarHBondContact O-N 3.23Å; K430-S433 WeakPolarHBondContact O-CB 3.46Å; K430-S433 PolarHBondContact O-N 3.41Å; K430-S433 VanDerWaalsContact O-N 3.14Å; Y431-S433 VanDerWaalsContact C-N 3.3Å; Y431-S433 PolarHBondContact O-N 3.43Å; S433-F435 PolarHBondContact O-N 3.02Å; S433-S436 PolarHBondContact O-N 2.82Å; S433-T437 WeakPolarHBondContact O-CG2 3.48Å; S433-T437 PolarHBondContact O-N 3.17Å; S433-T437 PolarHBondContact O-OG1 3.13Å
434D92.4Very high91.9Very high49 Ų4937.8 Ų37.826%0.26220%0.2SC..Hα-helixtrans-62.4-43.9-178.4-62.4-18.3000110.5L378 K430 Y431 S436 T437 T438L378-D434 HydrophobicContact CD1-CB 3.59Å; K430-D434 PolarHBondContact O-N 2.83Å; Y431-D434 PolarHBondContact O-N 2.8Å; D434-S436 PolarHBondContact O-N 3.22Å; D434-T437 WeakPolarHBondContact CA-OG1 3.45Å; D434-T437 PolarHBondContact O-N 3.45Å; D434-T437 PolarHBondContact O-OG1 3.48Å; D434-T438 PolarHBondContact O-N 3.46Å; D434-T438 PolarHBondContact O-OG1 2.9Å
435F93.5Very high91.2Very high0 Ų041.7 Ų41.70%022%0.217CC..Hα-helixtrans-60.5-44.5174.7-162.1-61.8000111.8L378 L390 Y431 S433 T437 T438 L439 I470 T473 L477 L573L378-F435 HydrophobicContact CD1-CB 4.43Å; L390-F435 HydrophobicContact CB-CE2 4Å; L390-F435 HydrophobicContact CB-CZ 4.18Å; L390-F435 HydrophobicContact CD1-CE1 4.2Å; L390-F435 HydrophobicContact CD1-CZ 4.09Å; L390-F435 HydrophobicContact CD2-CD1 4.07Å; L390-F435 HydrophobicContact CD2-CD2 3.49Å; L390-F435 VanDerWaalsContact CD2-CD2 3.49Å; L390-F435 HydrophobicContact CD2-CE1 4.16Å; L390-F435 HydrophobicContact CD2-CE2 3.57Å; L390-F435 HydrophobicContact CD2-CG 3.77Å; L390-F435 HydrophobicContact CD2-CZ 3.92Å; L390-F435 HydrophobicContact CG-CE2 4.22Å; L390-F435 HydrophobicContact CG-CZ 4.29Å; Y431-F435 AromaticContact CE1-CD2 3.93Å; Y431-F435 HydrophobicContact CE1-CD2 3.93Å; Y431-F435 AromaticContact CZ-CD2 3.82Å; Y431-F435 VanDerWaalsContact O-CB 3.31Å; Y431-F435 WeakPolarHBondContact O-CB 3.32Å; Y431-F435 PolarHBondContact O-N 3Å; S433-F435 PolarHBondContact O-N 3.02Å; F435-T437 VanDerWaalsContact C-N 3.3Å; F435-T437 PolarHBondContact O-N 3.46Å; F435-T438 PolarHBondContact O-N 2.68Å; F435-L439 WeakPolarHBondContact O-CB 3.48Å; F435-L439 PolarHBondContact O-N 2.96Å; F435-I470 HydrophobicContact CE1-CG2 4.04Å; F435-I470 HydrophobicContact CZ-CG2 4.18Å; F435-T473 HydrophobicContact CE2-CG2 4.25Å; F435-T473 HydrophobicContact CZ-CG2 4.39Å; F435-L477 HydrophobicContact CD2-CD1 4.31Å; F435-L477 HydrophobicContact CE2-CD1 3.87Å; F435-L477 HydrophobicContact CZ-CD1 4.46Å; F435-L573 HydrophobicContact CB-CD1 4.31Å; F435-L573 HydrophobicContact CB-CD2 4.01Å; F435-L573 HydrophobicContact CD1-CD1 3.69Å; F435-L573 HydrophobicContact CD1-CD2 3.59Å; F435-L573 HydrophobicContact CD1-CG 3.92Å; F435-L573 HydrophobicContact CD2-CD2 4.14Å; F435-L573 HydrophobicContact CE1-CD1 4.38Å; F435-L573 HydrophobicContact CE1-CD2 4.01Å; F435-L573 HydrophobicContact CE1-CG 4.25Å; F435-L573 HydrophobicContact CG-CD1 4.27Å; F435-L573 HydrophobicContact CG-CD2 3.65Å; F435-L573 HydrophobicContact CG-CG 4.43Å; F435-L573 HydrophobicContact CZ-CD2 4.46Å
436S92.3Very high90.3Very high17 Ų1739.7 Ų39.712%0.11921%0.21CC..Hα-helixtrans-63.5-37177.9-167.80000111.6V432 S433 D434 L439 Q440 Q576V432-S436 VanDerWaalsContact O-CB 3.25Å; V432-S436 WeakPolarHBondContact O-CB 3.34Å; V432-S436 PolarHBondContact O-N 3Å; S433-S436 PolarHBondContact O-N 2.82Å; D434-S436 PolarHBondContact O-N 3.22Å; S436-L439 WeakPolarHBondContact O-CB 3.26Å; S436-L439 PolarHBondContact O-N 2.76Å; S436-Q440 WeakPolarHBondContact O-CG 3.48Å; S436-Q440 PolarHBondContact O-N 2.69Å; S436-Q576 PolarHBondContact OG-OE1 2.61Å
437T91.4Very high89Confident68 Ų6846.7 Ų46.742%0.41723%0.233SC..Hα-helixtrans-65.9-41.3173.5580000112.5S433 D434 F435 L439 Q440 S441S433-T437 WeakPolarHBondContact O-CG2 3.48Å; S433-T437 PolarHBondContact O-N 3.17Å; S433-T437 PolarHBondContact O-OG1 3.13Å; D434-T437 WeakPolarHBondContact CA-OG1 3.45Å; D434-T437 PolarHBondContact O-N 3.45Å; D434-T437 PolarHBondContact O-OG1 3.48Å; F435-T437 VanDerWaalsContact C-N 3.3Å; F435-T437 PolarHBondContact O-N 3.46Å; T437-L439 VanDerWaalsContact C-N 3.33Å; T437-L439 PolarHBondContact O-N 2.97Å; T437-Q440 PolarHBondContact O-N 3.12Å; T437-S441 PolarHBondContact O-N 3.21Å
438T89.6Confident87.4Confident4 Ų447.7 Ų47.73%0.02524%0.238CC..Hα-helixtrans-61.8-42172.9-55.30000111.2L378 C386 L390 D434 F435 Q440 S441 I442L378-T438 WeakPolarHBondContact CB-OG1 3.49Å; L378-T438 VanDerWaalsContact O-CG2 3.25Å; L378-T438 WeakPolarHBondContact O-CG2 3.43Å; C386-T438 HydrophobicContact CB-CG2 4.38Å; L390-T438 HydrophobicContact CD1-CG2 4.04Å; L390-T438 HydrophobicContact CD2-CG2 4.07Å; L390-T438 HydrophobicContact CG-CG2 4.22Å; D434-T438 PolarHBondContact O-N 3.46Å; D434-T438 PolarHBondContact O-OG1 2.9Å; F435-T438 PolarHBondContact O-N 2.68Å; T438-Q440 VanDerWaalsContact C-N 3.31Å; T438-Q440 PolarHBondContact O-N 2.95Å; T438-S441 WeakPolarHBondContact O-CB 3.34Å; T438-S441 PolarHBondContact O-N 3.46Å; T438-S441 VanDerWaalsContact O-N 3.11Å; T438-I442 HydrophobicContact CG2-CD1 4.04Å; T438-I442 HydrophobicContact CG2-CG1 4.43Å; T438-I442 WeakPolarHBondContact O-CG1 3.42Å; T438-I442 PolarHBondContact O-N 3.43Å
439L89.1Confident85.6Confident7 Ų753.9 Ų53.94%0.03727%0.267CS..Hα-helixtrans-60.9-40.5176.6-168.775.6000111.7F435 S436 T437 I442 R443 I470 Q576 L580F435-L439 WeakPolarHBondContact O-CB 3.48Å; F435-L439 PolarHBondContact O-N 2.96Å; S436-L439 WeakPolarHBondContact O-CB 3.26Å; S436-L439 PolarHBondContact O-N 2.76Å; T437-L439 VanDerWaalsContact C-N 3.33Å; T437-L439 PolarHBondContact O-N 2.97Å; L439-I442 PolarHBondContact O-N 2.97Å; L439-R443 WeakPolarHBondContact O-CB 3.41Å; L439-R443 PolarHBondContact O-N 3.25Å; L439-I470 HydrophobicContact CD1-CD1 4.2Å; L439-I470 HydrophobicContact CD1-CG2 3.96Å; L439-Q576 HydrophobicContact CD2-CB 3.43Å; L439-Q576 VanDerWaalsContact CD2-CB 3.43Å; L439-L580 HydrophobicContact CD1-CD1 4.45Å; L439-L580 HydrophobicContact CD1-CD2 3.98Å
440Q87.8Confident83.7Confident108 Ų10854.5 Ų54.551%0.50526%0.263SS..Hα-helixtrans-66.5-37.5173.5-70.1173.920.100112.2S436 T437 T438 R443 K444S436-Q440 WeakPolarHBondContact O-CG 3.48Å; S436-Q440 PolarHBondContact O-N 2.69Å; T437-Q440 PolarHBondContact O-N 3.12Å; T438-Q440 VanDerWaalsContact C-N 3.31Å; T438-Q440 PolarHBondContact O-N 2.95Å; Q440-R443 WeakPolarHBondContact O-CB 3.36Å; Q440-R443 PolarHBondContact O-N 3.49Å; Q440-K444 WeakPolarHBondContact O-CG 3.34Å; Q440-K444 PolarHBondContact O-N 3.17Å; Q440-K444 VanDerWaalsContact O-N 3.11Å
441S86.9Confident81.7Confident22 Ų2258.2 Ų58.215%0.15429%0.29CS..Hα-helixtrans-64-46173.5-175.80000111.3E379 T437 T438 R443 K444 K445E379-S441 WeakPolarHBondContact OE1-CB 3.35Å; E379-S441 PolarHBondContact OE1-OG 2.84Å; T437-S441 PolarHBondContact O-N 3.21Å; T438-S441 WeakPolarHBondContact O-CB 3.34Å; T438-S441 PolarHBondContact O-N 3.46Å; T438-S441 VanDerWaalsContact O-N 3.11Å; S441-R443 VanDerWaalsContact C-N 3.32Å; S441-R443 PolarHBondContact O-N 3.44Å; S441-K444 WeakPolarHBondContact O-CB 3.18Å; S441-K444 PolarHBondContact O-N 3.36Å; S441-K444 VanDerWaalsContact O-N 3.13Å; S441-K445 WeakPolarHBondContact O-CG 3.49Å; S441-K445 PolarHBondContact O-N 3.05Å
442I86.1Confident79.7Confident1 Ų161.1 Ų61.11%0.00531%0.309CS..Hα-helixtrans-58.3-44.9174.5-68.4168.7000110.4V383 C386 L390 T438 L439 K444 K445 C446 I470 L580V383-I442 HydrophobicContact CG1-CG2 3.86Å; C386-I442 HydrophobicContact CB-CD1 4Å; C386-I442 HydrophobicContact CB-CG1 4.18Å; L390-I442 HydrophobicContact CD1-CD1 3.89Å; T438-I442 HydrophobicContact CG2-CD1 4.04Å; T438-I442 HydrophobicContact CG2-CG1 4.43Å; T438-I442 WeakPolarHBondContact O-CG1 3.42Å; T438-I442 PolarHBondContact O-N 3.43Å; L439-I442 PolarHBondContact O-N 2.97Å; I442-K444 VanDerWaalsContact C-N 3.29Å; I442-K444 PolarHBondContact O-N 2.71Å; I442-K445 PolarHBondContact O-N 3.45Å; I442-K445 VanDerWaalsContact O-N 3.15Å; I442-C446 WeakPolarHBondContact O-CB 3.35Å; I442-C446 PolarHBondContact O-N 2.92Å; I442-C446 PolarHBondContact O-SG 2.92Å; I442-I470 HydrophobicContact CD1-CD1 3.93Å; I442-I470 HydrophobicContact CG2-CD1 4.44Å; I442-L580 HydrophobicContact CG2-CD2 4.37Å
443R84.4Confident77.4Confident63 Ų6365.5 Ų65.524%0.23834%0.341CS..Hα-helixtrans-54.8-43175.5-171.4179.4177.7110.711.1112.3L439 Q440 S441 L448 E449 L580 D583L439-R443 WeakPolarHBondContact O-CB 3.41Å; L439-R443 PolarHBondContact O-N 3.25Å; Q440-R443 WeakPolarHBondContact O-CB 3.36Å; Q440-R443 PolarHBondContact O-N 3.49Å; S441-R443 VanDerWaalsContact C-N 3.32Å; S441-R443 PolarHBondContact O-N 3.44Å; R443-L448 HydrophobicContact CG-CB 4.17Å; R443-L448 HydrophobicContact CG-CD1 4.11Å; R443-L448 PolarHBondContact O-N 2.7Å; R443-E449 IonicContact NE-OE1 3.81Å; R443-L580 HydrophobicContact CB-CD1 3.56Å; R443-L580 HydrophobicContact CG-CD1 3.99Å; R443-D583 IonicContact CZ-OD2 3.83Å; R443-D583 IonicContact NH1-OD2 2.74Å; R443-D583 PolarHBondContact NH1-OD2 3.02Å; R443-D583 IonicContact NH2-OD2 2.64Å; R443-D583 PolarHBondContact NH2-OD2 2.96Å
444K83.4Confident75.1Confident136 Ų13666.2 Ų66.259%0.59135%0.346SS*.Hα-helixtrans-68.8-44.2175.6-70.2176.7-178.11770112.2Q440 S441 I442 C446 R447Q440-K444 WeakPolarHBondContact O-CG 3.34Å; Q440-K444 PolarHBondContact O-N 3.17Å; Q440-K444 VanDerWaalsContact O-N 3.11Å; S441-K444 WeakPolarHBondContact O-CB 3.18Å; S441-K444 PolarHBondContact O-N 3.36Å; S441-K444 VanDerWaalsContact O-N 3.13Å; I442-K444 VanDerWaalsContact C-N 3.29Å; I442-K444 PolarHBondContact O-N 2.71Å; K444-C446 VanDerWaalsContact C-N 3.28Å; K444-C446 PolarHBondContact O-N 3.19Å; K444-R447 PolarHBondContact O-N 2.82Å
445K80.5Confident72.9Confident82 Ų8269.5 Ų69.536%0.35737%0.373SS..Hα-helixtrans-62.4-34.4177.9-70.4180-175.2-178.70112.1E379 G381 V383 S441 I442 R447E379-K445 IonicContact OE1-NZ 3.08Å; G381-K445 PolarHBondContact O-NZ 3.23Å; V383-K445 HydrophobicContact CG2-CB 3.63Å; V383-K445 HydrophobicContact CG2-CD 4.07Å; V383-K445 HydrophobicContact CG2-CG 4.5Å; S441-K445 WeakPolarHBondContact O-CG 3.49Å; S441-K445 PolarHBondContact O-N 3.05Å; I442-K445 PolarHBondContact O-N 3.45Å; I442-K445 VanDerWaalsContact O-N 3.15Å; K445-R447 PolarHBondContact O-N 3.09Å
446C75.2Confident71Confident21 Ų2172.6 Ų72.614%0.14240%0.398CS..THydrogen-bonded Turntrans-75.52.9173.2-710000114.2I442 K444 L448 S463I442-C446 WeakPolarHBondContact O-CB 3.35Å; I442-C446 PolarHBondContact O-N 2.92Å; I442-C446 PolarHBondContact O-SG 2.92Å; K444-C446 VanDerWaalsContact C-N 3.28Å; K444-C446 PolarHBondContact O-N 3.19Å; C446-L448 HydrophobicContact CB-CD1 4.09Å; C446-L448 HydrophobicContact CB-CD2 4.48Å; C446-L448 HydrophobicContact CB-CG 3.85Å; C446-L448 PolarHBondContact O-N 3.44Å; C446-S463 PolarHBondContact SG-OG 3.22Å
447R70.3Confident69.5Low166 Ų16674 Ų7463%0.62640%0.402SS*.THydrogen-bonded Turntrans55.729.2179.2-59.1177.9178.81773.7114.5K444 K445 E449 E450K444-R447 PolarHBondContact O-N 2.82Å; K445-R447 PolarHBondContact O-N 3.09Å; R447-E449 PolarHBondContact O-N 3.05Å; R447-E450 HydrophobicContact CB-CG 4.23Å; R447-E450 WeakPolarHBondContact CD-OE2 3.27Å; R447-E450 IonicContact NE-OE2 3.64Å; R447-E450 PolarHBondContact O-N 3.03Å
448L63.1Low68.1Low21 Ų2176.8 Ų76.811%0.1141%0.411CS..THydrogen-bonded Turntrans-71.1-2-177.8-60175.2000114.1R443 C446 L580 L587R443-L448 HydrophobicContact CG-CB 4.17Å; R443-L448 HydrophobicContact CG-CD1 4.11Å; R443-L448 PolarHBondContact O-N 2.7Å; C446-L448 HydrophobicContact CB-CD1 4.09Å; C446-L448 HydrophobicContact CB-CD2 4.48Å; C446-L448 HydrophobicContact CB-CG 3.85Å; C446-L448 PolarHBondContact O-N 3.44Å; L448-L580 HydrophobicContact CD1-CD1 4.19Å; L448-L580 HydrophobicContact CD1-CG 4.43Å; L448-L587 HydrophobicContact CD2-CB 4.48Å; L448-L587 HydrophobicContact CD2-CD2 3.75Å
449E56.6Low66.8Low132 Ų13281.7 Ų81.762%0.61743%0.433SS*.THydrogen-bonded Turntrans-115.1-2.8179.3-62.6-171.9167.800113.7R443 R447R443-E449 IonicContact NE-OE1 3.81Å; R447-E449 PolarHBondContact O-N 3.05Å
450E54.9Low66Low106 Ų10685.6 Ų85.650%0.49545%0.454SS..  trans-79.4138.3-178.3-70.4-176.617700112R447R447-E450 HydrophobicContact CB-CG 4.23Å; R447-E450 WeakPolarHBondContact CD-OE2 3.27Å; R447-E450 IonicContact NE-OE2 3.64Å; R447-E450 PolarHBondContact O-N 3.03Å
451T52.7Low65.7Low129 Ų12981.4 Ų81.479%0.79143%0.434SS*.  trans-76.5145.7173.46.40000109.8S453T451-S453 PolarHBondContact O-N 3.4Å
452P54Low65.6Low62 Ų6283.5 Ų83.540%0.40345%0.446SS..  trans-64.9112.6-165.824.7-33000111.5
453S47.3Very low65.3Low114 Ų11484.9 Ų84.980%0.79746%0.455SS*.  trans-101.4-15177.360.90000113.9T451T451-S453 PolarHBondContact O-N 3.4Å
454S46.1Very low65.3Low82 Ų8282 Ų8257%0.57345%0.445SS*.  trans-123.2137.5178.755.70000112A456S454-A456 PolarHBondContact O-N 3.47Å
455S45.6Very low65.5Low119 Ų11979.8 Ų79.883%0.83244%0.436SS*.  trans-80.15.3175.256.70000113.6
456A53Low65.7Low64 Ų6476.9 Ų76.953%0.52943%0.425SS..  trans-95.6119.9-176.200000110.4S454 Q458S454-A456 PolarHBondContact O-N 3.47Å; A456-Q458 PolarHBondContact O-N 2.95Å
457F61.7Low66.3Low47 Ų4776 Ų7621%0.20642%0.419CS..  trans-69.8121169.8-174.9-108.3000109.2E459 Q588 Q592 N628 Y632F457-E459 HydrophobicContact CD1-CG 4.26Å; F457-E459 HydrophobicContact CE1-CG 3.6Å; F457-E459 HydrophobicContact CZ-CG 4.32Å; F457-Q588 HydrophobicContact CE2-CB 4.22Å; F457-Q592 HydrophobicContact CD2-CG 3.7Å; F457-Q592 HydrophobicContact CE2-CG 3.99Å; F457-N628 HydrophobicContact CD1-CB 4.39Å; F457-N628 HydrophobicContact CG-CB 4.49Å; F457-Y632 HydrophobicContact CE1-CD2 4.49Å; F457-Y632 AromaticContact CZ-CD2 3.8Å; F457-Y632 HydrophobicContact CZ-CD2 3.8Å; F457-Y632 AromaticContact CZ-CG 3.84Å; F457-Y632 HydrophobicContact CZ-CG 3.84Å
458Q61.4Low67Low127 Ų12769 Ų6959%0.59339%0.394SS*.  trans-119.5117.4179.8-114.9177.5-20.700109.7A456 D460A456-Q458 PolarHBondContact O-N 2.95Å; Q458-D460 VanDerWaalsContact C-N 3.3Å; Q458-D460 PolarHBondContact O-N 3.32Å
459E63.6Low68.1Low107 Ų10773.9 Ų73.950%0.541%0.411SS..  trans-80.272.6174.8-66.9-177171.200110.5F457 Y632F457-E459 HydrophobicContact CD1-CG 4.26Å; F457-E459 HydrophobicContact CE1-CG 3.6Å; F457-E459 HydrophobicContact CZ-CG 4.32Å; E459-Y632 HydrophobicContact CG-CD2 4.41Å
460D71.6Confident69.7Low89 Ų8967.7 Ų67.748%0.47638%0.382SS..  trans-102.795.6180-147.5-18.2000111.1Q458 T462Q458-D460 VanDerWaalsContact C-N 3.3Å; Q458-D460 PolarHBondContact O-N 3.32Å; D460-T462 VanDerWaalsContact C-N 3.3Å; D460-T462 WeakPolarHBondContact OD1-CG2 3.47Å; D460-T462 PolarHBondContact OD1-OG1 3.06Å
461W81.7Confident71.3Confident20 Ų2062.6 Ų62.68%0.07636%0.359CS..  trans-82.2-5.7-177.8-70.5100.3000114S463 F464 Q465 V585 Y632 S635 L636 H639W461-S463 VanDerWaalsContact C-N 3.33Å; W461-S463 PolarHBondContact O-N 3.49Å; W461-F464 HydrophobicContact CE3-CB 4.04Å; W461-F464 AromaticContact CE3-CD1 3.81Å; W461-F464 HydrophobicContact CE3-CD1 3.81Å; W461-F464 HydrophobicContact CE3-CG 4.14Å; W461-F464 HydrophobicContact CZ3-CD1 4.04Å; W461-F464 HydrophobicContact CZ3-CG 4.35Å; W461-F464 WeakPolarHBondContact O-CB 3.35Å; W461-F464 PolarHBondContact O-N 3.26Å; W461-F464 VanDerWaalsContact O-N 3.12Å; W461-Q465 WeakPolarHBondContact O-CG 3.18Å; W461-Q465 PolarHBondContact O-N 3.21Å; W461-V585 HydrophobicContact CZ3-CG1 4.47Å; W461-V585 HydrophobicContact CZ3-CG2 4.12Å; W461-Y632 AromaticContact CE2-CE2 3.74Å; W461-Y632 HydrophobicContact CH2-CD2 4.41Å; W461-Y632 HydrophobicContact CH2-CE1 4.27Å; W461-Y632 AromaticContact CH2-CE2 3.69Å; W461-Y632 HydrophobicContact CH2-CE2 3.69Å; W461-Y632 AromaticContact CH2-CZ 3.6Å; W461-Y632 AromaticContact CZ2-CD2 3.76Å; W461-Y632 HydrophobicContact CZ2-CD2 3.76Å; W461-Y632 AromaticContact CZ2-CE2 3.23Å; W461-Y632 HydrophobicContact CZ2-CE2 3.23Å; W461-Y632 AromaticContact CZ2-CZ 3.69Å; W461-S635 WeakPolarHBondContact CZ2-OG 3.44Å; W461-L636 HydrophobicContact CH2-CB 3.94Å; W461-L636 HydrophobicContact CH2-CD1 3.63Å; W461-L636 HydrophobicContact CH2-CG 4.39Å; W461-L636 HydrophobicContact CZ3-CD1 3.62Å; W461-H639 AromaticContact CD1-CD2 3.82Å; W461-H639 AromaticContact CD1-CE1 3.93Å; W461-H639 AromaticContact CD1-NE2 3.32Å; W461-H639 VanDerWaalsContact CD1-NE2 3.32Å; W461-H639 HydrophobicContact CD2-CB 4.44Å; W461-H639 AromaticContact CD2-CD2 3.31Å; W461-H639 AromaticContact CD2-CG 3.8Å; W461-H639 AromaticContact CD2-NE2 3.68Å; W461-H639 AromaticContact CE2-CD2 3.27Å; W461-H639 AromaticContact CE2-NE2 3.61Å; W461-H639 HydrophobicContact CE3-CB 4.06Å; W461-H639 AromaticContact CE3-CD2 3.78Å; W461-H639 AromaticContact CE3-CG 3.92Å; W461-H639 AromaticContact CG-CD2 3.68Å; W461-H639 AromaticContact CG-CE1 3.87Å; W461-H639 AromaticContact CG-NE2 3.52Å; W461-H639 AromaticContact CZ2-CD2 3.73Å; W461-H639 HydrophobicContact CZ3-CB 4.25Å; W461-H639 AromaticContact NE1-CD2 3.56Å; W461-H639 AromaticContact NE1-NE2 3.35Å; W461-H639 PolarHBondContact NE1-NE2 3.41Å
462T83.5Confident72.9Confident66 Ų6657.6 Ų57.641%0.40533%0.33SS..Hα-helixtrans-57.5-43-176.952.10000112.6D460 F464 Q465 N466D460-T462 VanDerWaalsContact C-N 3.3Å; D460-T462 WeakPolarHBondContact OD1-CG2 3.47Å; D460-T462 PolarHBondContact OD1-OG1 3.06Å; T462-F464 PolarHBondContact O-N 3.17Å; T462-Q465 PolarHBondContact O-N 3.06Å; T462-N466 WeakPolarHBondContact O-CB 3.25Å; T462-N466 VanDerWaalsContact O-CG 3.26Å; T462-N466 PolarHBondContact O-N 2.98Å; T462-N466 PolarHBondContact O-ND2 3.24Å
463S81.1Confident74.7Confident29 Ų2955 Ų5520%0.20331%0.314CS..Hα-helixtrans-65.7-37.5177.2-67.40000112.4C446 W461 S467C446-S463 PolarHBondContact SG-OG 3.22Å; W461-S463 VanDerWaalsContact C-N 3.33Å; W461-S463 PolarHBondContact O-N 3.49Å; S463-S467 WeakPolarHBondContact O-CB 3.36Å; S463-S467 PolarHBondContact O-N 2.99Å; S463-S467 PolarHBondContact O-OG 3.39Å
464F84.9Confident76.7Confident4 Ų449.8 Ų49.82%0.01828%0.277CS..Hα-helixtrans-67.1-48.5175.2179.9-113.1000111W461 T462 N466 S467 V468 A581 S584 V585 H639 L640 F643W461-F464 HydrophobicContact CE3-CB 4.04Å; W461-F464 AromaticContact CE3-CD1 3.81Å; W461-F464 HydrophobicContact CE3-CD1 3.81Å; W461-F464 HydrophobicContact CE3-CG 4.14Å; W461-F464 HydrophobicContact CZ3-CD1 4.04Å; W461-F464 HydrophobicContact CZ3-CG 4.35Å; W461-F464 WeakPolarHBondContact O-CB 3.35Å; W461-F464 PolarHBondContact O-N 3.26Å; W461-F464 VanDerWaalsContact O-N 3.12Å; T462-F464 PolarHBondContact O-N 3.17Å; F464-N466 VanDerWaalsContact C-N 3.33Å; F464-N466 PolarHBondContact O-N 3.28Å; F464-S467 CarbonylContact O-C 3.53Å; F464-S467 WeakPolarHBondContact O-CA 3.5Å; F464-S467 WeakPolarHBondContact O-CB 3.49Å; F464-S467 PolarHBondContact O-N 2.91Å; F464-V468 HydrophobicContact CD1-CG2 4.22Å; F464-V468 HydrophobicContact CD2-CG2 4.46Å; F464-V468 HydrophobicContact CE1-CG2 3.86Å; F464-V468 HydrophobicContact CE2-CG2 4.14Å; F464-V468 HydrophobicContact CZ-CG2 3.82Å; F464-V468 WeakPolarHBondContact O-CG2 3.43Å; F464-V468 PolarHBondContact O-N 3.38Å; F464-A581 HydrophobicContact CD2-CB 4.39Å; F464-A581 HydrophobicContact CE2-CB 4.28Å; F464-S584 WeakPolarHBondContact CA-OG 3.48Å; F464-V585 HydrophobicContact CB-CG2 4.19Å; F464-V585 HydrophobicContact CD1-CG2 4.49Å; F464-V585 HydrophobicContact CD2-CG2 3.22Å; F464-V585 HydrophobicContact CE2-CG2 3.59Å; F464-V585 HydrophobicContact CG-CG2 3.72Å; F464-V585 HydrophobicContact CZ-CG2 4.37Å; F464-H639 HydrophobicContact CD1-CB 4.28Å; F464-H639 HydrophobicContact CE1-CB 4.16Å; F464-L640 HydrophobicContact CE1-CD2 4.05Å; F464-L640 HydrophobicContact CZ-CD2 3.55Å; F464-F643 HydrophobicContact CZ-CE2 4.05Å
465Q85.9Confident78.8Confident88 Ų8845.9 Ų45.941%0.41125%0.249SC..Hα-helixtrans-59-41.1177.9-70.4175-4.700112.6W461 T462 S467 V468 R469W461-Q465 WeakPolarHBondContact O-CG 3.18Å; W461-Q465 PolarHBondContact O-N 3.21Å; T462-Q465 PolarHBondContact O-N 3.06Å; Q465-S467 VanDerWaalsContact C-N 3.34Å; Q465-V468 PolarHBondContact O-N 3.16Å; Q465-R469 WeakPolarHBondContact O-CG 3.37Å; Q465-R469 PolarHBondContact O-N 3.39Å; Q465-R469 VanDerWaalsContact O-N 3.1Å
466N86.4Confident80.9Confident22 Ų2242.3 Ų42.312%0.11822%0.219CC..Hα-helixtrans-63.2-40.9173.3-74-27000111.6V383 V387 T462 F464 R469 I470V383-N466 HydrophobicContact CG1-CB 4.28Å; V387-N466 HydrophobicContact CG2-CB 4.12Å; T462-N466 WeakPolarHBondContact O-CB 3.25Å; T462-N466 VanDerWaalsContact O-CG 3.26Å; T462-N466 PolarHBondContact O-N 2.98Å; T462-N466 PolarHBondContact O-ND2 3.24Å; F464-N466 VanDerWaalsContact C-N 3.33Å; F464-N466 PolarHBondContact O-N 3.28Å; N466-R469 PolarHBondContact O-N 3.06Å; N466-I470 WeakPolarHBondContact O-CG1 3.5Å; N466-I470 PolarHBondContact O-N 3.17Å; N466-I470 VanDerWaalsContact O-N 3.07Å
467S86.6Confident82.8Confident2 Ų239.3 Ų39.31%0.01419%0.194CC..Hα-helixtrans-65.8-37.6176.5-52.60000112.3S463 F464 Q465 I470 I471 L580 A581S463-S467 WeakPolarHBondContact O-CB 3.36Å; S463-S467 PolarHBondContact O-N 2.99Å; S463-S467 PolarHBondContact O-OG 3.39Å; F464-S467 CarbonylContact O-C 3.53Å; F464-S467 WeakPolarHBondContact O-CA 3.5Å; F464-S467 WeakPolarHBondContact O-CB 3.49Å; F464-S467 PolarHBondContact O-N 2.91Å; Q465-S467 VanDerWaalsContact C-N 3.34Å; S467-I470 PolarHBondContact O-N 3.34Å; S467-I471 WeakPolarHBondContact O-CG1 3.39Å; S467-I471 PolarHBondContact O-N 2.91Å; S467-L580 WeakPolarHBondContact OG-CD2 3.34Å; S467-A581 VanDerWaalsContact CB-CA 3.5Å
468V85.2Confident84.1Confident19 Ų1937.6 Ų37.612%0.11519%0.187CC..Hα-helixtrans-60.8-43.8173.1173.70000111.2F464 Q465 I470 I471 A472 F643F464-V468 HydrophobicContact CD1-CG2 4.22Å; F464-V468 HydrophobicContact CD2-CG2 4.46Å; F464-V468 HydrophobicContact CE1-CG2 3.86Å; F464-V468 HydrophobicContact CE2-CG2 4.14Å; F464-V468 HydrophobicContact CZ-CG2 3.82Å; F464-V468 WeakPolarHBondContact O-CG2 3.43Å; F464-V468 PolarHBondContact O-N 3.38Å; Q465-V468 PolarHBondContact O-N 3.16Å; V468-I470 VanDerWaalsContact C-N 3.33Å; V468-I470 PolarHBondContact O-N 3.46Å; V468-I471 WeakPolarHBondContact O-CB 3.39Å; V468-I471 PolarHBondContact O-N 2.9Å; V468-A472 PolarHBondContact O-N 3.04Å; V468-F643 HydrophobicContact CB-CE1 4.43Å; V468-F643 HydrophobicContact CB-CZ 4.12Å; V468-F643 HydrophobicContact CG1-CE1 3.55Å; V468-F643 HydrophobicContact CG1-CZ 3.69Å; V468-F643 HydrophobicContact CG2-CE1 4.23Å; V468-F643 HydrophobicContact CG2-CE2 4.12Å; V468-F643 HydrophobicContact CG2-CZ 3.46Å; V468-F643 VanDerWaalsContact CG2-CZ 3.46Å
469R86.9Confident85.5Confident124 Ų12436.2 Ų36.247%0.46818%0.177SC..Hα-helixtrans-60.6-41.3174.8-69.5177.5-177.6-172.31.3111.9V387 Q465 N466 I471 A472 T473V387-R469 HydrophobicContact CG1-CB 3.66Å; Q465-R469 WeakPolarHBondContact O-CG 3.37Å; Q465-R469 PolarHBondContact O-N 3.39Å; Q465-R469 VanDerWaalsContact O-N 3.1Å; N466-R469 PolarHBondContact O-N 3.06Å; R469-I471 VanDerWaalsContact C-N 3.34Å; R469-I471 PolarHBondContact O-N 3.34Å; R469-A472 WeakPolarHBondContact O-CB 3.33Å; R469-A472 PolarHBondContact O-N 3.4Å; R469-T473 PolarHBondContact O-N 2.79Å; R469-T473 PolarHBondContact O-OG1 3.12Å
470I89.6Confident86.8Confident1 Ų133.3 Ų33.31%0.00516%0.163CC..Hα-helixtrans-63.5-39.2175.4-62.4166.4000111.3V387 L390 F435 L439 I442 N466 S467 V468 T473 C474 A577 L580V387-I470 HydrophobicContact CG1-CG1 4.29Å; V387-I470 HydrophobicContact CG2-CD1 3.93Å; V387-I470 HydrophobicContact CG2-CG1 3.86Å; L390-I470 HydrophobicContact CD1-CG1 4.47Å; F435-I470 HydrophobicContact CE1-CG2 4.04Å; F435-I470 HydrophobicContact CZ-CG2 4.18Å; L439-I470 HydrophobicContact CD1-CD1 4.2Å; L439-I470 HydrophobicContact CD1-CG2 3.96Å; I442-I470 HydrophobicContact CD1-CD1 3.93Å; I442-I470 HydrophobicContact CG2-CD1 4.44Å; N466-I470 WeakPolarHBondContact O-CG1 3.5Å; N466-I470 PolarHBondContact O-N 3.17Å; N466-I470 VanDerWaalsContact O-N 3.07Å; S467-I470 PolarHBondContact O-N 3.34Å; V468-I470 VanDerWaalsContact C-N 3.33Å; V468-I470 PolarHBondContact O-N 3.46Å; I470-T473 WeakPolarHBondContact O-CB 3.42Å; I470-T473 PolarHBondContact O-N 3.24Å; I470-C474 PolarHBondContact O-N 3.27Å; I470-C474 PolarHBondContact O-SG 3.09Å; I470-A577 HydrophobicContact CG2-CB 3.86Å; I470-L580 HydrophobicContact CD1-CD2 4.06Å
471I88.2Confident87.8Confident0 Ų029.1 Ų29.10%014%0.141CC..Hα-helixtrans-62.8-43.9175-67.4165.7000110.3S467 V468 R469 T473 C474 G475 A577 A581 L651 A654 L655 W680S467-I471 WeakPolarHBondContact O-CG1 3.39Å; S467-I471 PolarHBondContact O-N 2.91Å; V468-I471 WeakPolarHBondContact O-CB 3.39Å; V468-I471 PolarHBondContact O-N 2.9Å; R469-I471 VanDerWaalsContact C-N 3.34Å; R469-I471 PolarHBondContact O-N 3.34Å; I471-T473 VanDerWaalsContact C-N 3.32Å; I471-T473 PolarHBondContact O-N 2.91Å; I471-C474 WeakPolarHBondContact O-CB 3.44Å; I471-C474 PolarHBondContact O-N 3.43Å; I471-C474 VanDerWaalsContact O-N 3.12Å; I471-G475 PolarHBondContact O-N 3.41Å; I471-A577 HydrophobicContact CG1-CB 4.02Å; I471-A581 HydrophobicContact CD1-CB 3.66Å; I471-L651 HydrophobicContact CG2-CD1 4.06Å; I471-A654 HydrophobicContact CG2-CB 3.74Å; I471-A654 WeakPolarHBondContact O-CB 3.3Å; I471-L655 HydrophobicContact CG2-CD2 4.38Å; I471-W680 HydrophobicContact CD1-CZ2 4.07Å
472A87.4Confident88.2Confident23 Ų2329.2 Ų29.219%0.1915%0.148CC..Hα-helixtrans-58.2-43.8173.800000111.7V468 R469 C474 G475 E476 L651V468-A472 PolarHBondContact O-N 3.04Å; R469-A472 WeakPolarHBondContact O-CB 3.33Å; R469-A472 PolarHBondContact O-N 3.4Å; A472-C474 VanDerWaalsContact C-N 3.34Å; A472-C474 PolarHBondContact O-N 2.93Å; A472-G475 WeakPolarHBondContact O-CA 3.47Å; A472-G475 PolarHBondContact O-N 3.17Å; A472-G475 VanDerWaalsContact O-N 3.14Å; A472-E476 PolarHBondContact O-N 2.91Å; A472-L651 HydrophobicContact CB-CD1 3.94Å
473T90.4Very high88.5Confident9 Ų927.9 Ų27.96%0.05514%0.144CC..Hα-helixtrans-60.4-40.2173.8-53.20000112.5L390 V394 F435 R469 I470 I471 G475 E476 L477L390-T473 WeakPolarHBondContact O-CG2 3.24Å; V394-T473 HydrophobicContact CG2-CG2 3.52Å; F435-T473 HydrophobicContact CE2-CG2 4.25Å; F435-T473 HydrophobicContact CZ-CG2 4.39Å; R469-T473 PolarHBondContact O-N 2.79Å; R469-T473 PolarHBondContact O-OG1 3.12Å; I470-T473 WeakPolarHBondContact O-CB 3.42Å; I470-T473 PolarHBondContact O-N 3.24Å; I471-T473 VanDerWaalsContact C-N 3.32Å; I471-T473 PolarHBondContact O-N 2.91Å; T473-G475 VanDerWaalsContact C-N 3.32Å; T473-E476 PolarHBondContact O-N 3.43Å; T473-L477 WeakPolarHBondContact O-CG 3.43Å; T473-L477 PolarHBondContact O-N 3.44Å
474C90.9Very high89.1Confident3 Ų326.9 Ų26.92%0.0214%0.136CC..Hα-helixtrans-65.3-36.4174.6-67.40000112.2I470 I471 A472 L477 L478 N574I470-C474 PolarHBondContact O-N 3.27Å; I470-C474 PolarHBondContact O-SG 3.09Å; I471-C474 WeakPolarHBondContact O-CB 3.44Å; I471-C474 PolarHBondContact O-N 3.43Å; I471-C474 VanDerWaalsContact O-N 3.12Å; A472-C474 VanDerWaalsContact C-N 3.34Å; A472-C474 PolarHBondContact O-N 2.93Å; C474-L477 WeakPolarHBondContact O-CB 3.44Å; C474-L477 PolarHBondContact O-N 3.42Å; C474-L478 WeakPolarHBondContact O-CG 3.5Å; C474-L478 PolarHBondContact O-N 2.9Å; C474-N574 HydrophobicContact CB-CB 3.89Å
475G88.3Confident89.5Confident0 Ų027.1 Ų27.10%014%0.137CC..Hα-helixtrans-60.1-48.1170.800000113.1I471 A472 T473 L477 L478 R479 A650 A654I471-G475 PolarHBondContact O-N 3.41Å; A472-G475 WeakPolarHBondContact O-CA 3.47Å; A472-G475 PolarHBondContact O-N 3.17Å; A472-G475 VanDerWaalsContact O-N 3.14Å; T473-G475 VanDerWaalsContact C-N 3.32Å; G475-L477 VanDerWaalsContact C-N 3.31Å; G475-L477 PolarHBondContact O-N 3.29Å; G475-L478 PolarHBondContact O-N 2.81Å; G475-R479 WeakPolarHBondContact O-CB 3.39Å; G475-R479 PolarHBondContact O-N 3.01Å; G475-A650 WeakPolarHBondContact CA-O 3.46Å; G475-A654 VanDerWaalsContact CA-CB 3.48Å
476E90.1Very high89.6Confident44 Ų4427.6 Ų27.621%0.20614%0.139CC..Hα-helixtrans-64.2-38.3178-176.959.3-170.500111.4V394 A472 T473 R479 Q480 A650V394-E476 HydrophobicContact CG1-CG 4.24Å; A472-E476 PolarHBondContact O-N 2.91Å; T473-E476 PolarHBondContact O-N 3.43Å; E476-R479 VanDerWaalsContact CD-NH2 3.3Å; E476-R479 PolarHBondContact O-N 3.04Å; E476-R479 IonicContact OE1-CZ 3.64Å; E476-R479 IonicContact OE1-NE 3.94Å; E476-R479 IonicContact OE1-NH2 2.8Å; E476-R479 PolarHBondContact OE1-NH2 3.38Å; E476-R479 IonicContact OE2-CZ 3.24Å; E476-R479 IonicContact OE2-NE 2.68Å; E476-R479 PolarHBondContact OE2-NE 3.05Å; E476-R479 IonicContact OE2-NH2 2.83Å; E476-R479 PolarHBondContact OE2-NH2 3.49Å; E476-R479 VanDerWaalsContact OE2-NH2 3.08Å; E476-Q480 HydrophobicContact CG-CG 4.34Å; E476-Q480 WeakPolarHBondContact O-CB 3.4Å; E476-Q480 WeakPolarHBondContact O-CG 3.09Å; E476-Q480 PolarHBondContact O-N 2.86Å; E476-Q480 WeakPolarHBondContact OE1-CG 3.39Å; E476-Q480 PolarHBondContact OE1-NE2 3.07Å; E476-A650 HydrophobicContact CB-CB 4.18Å
477L92.5Very high89.9Confident1 Ų132.2 Ų32.21%0.00516%0.16CC..Hα-helixtrans-58.5-46.5171.4-79.9164.7000112.3V394 L397 F398 Y431 F435 T473 C474 G475 C481 L570 L573V394-L477 HydrophobicContact CB-CD2 4.26Å; V394-L477 HydrophobicContact CG1-CD2 3.86Å; V394-L477 HydrophobicContact CG1-CG 4.13Å; V394-L477 HydrophobicContact CG2-CD1 4.29Å; V394-L477 HydrophobicContact CG2-CD2 3.84Å; V394-L477 HydrophobicContact CG2-CG 3.71Å; L397-L477 HydrophobicContact CD2-CD2 3.93Å; F398-L477 HydrophobicContact CE2-CD2 4.09Å; Y431-L477 HydrophobicContact CE1-CD1 4.03Å; Y431-L477 HydrophobicContact CE1-CD2 3.65Å; F435-L477 HydrophobicContact CD2-CD1 4.31Å; F435-L477 HydrophobicContact CE2-CD1 3.87Å; F435-L477 HydrophobicContact CZ-CD1 4.46Å; T473-L477 WeakPolarHBondContact O-CG 3.43Å; T473-L477 PolarHBondContact O-N 3.44Å; C474-L477 WeakPolarHBondContact O-CB 3.44Å; C474-L477 PolarHBondContact O-N 3.42Å; G475-L477 VanDerWaalsContact C-N 3.31Å; G475-L477 PolarHBondContact O-N 3.29Å; L477-C481 WeakPolarHBondContact O-CB 3.15Å; L477-C481 PolarHBondContact O-N 3.43Å; L477-L570 HydrophobicContact CB-CD2 4.34Å; L477-L570 HydrophobicContact CD1-CD2 4.41Å; L477-L570 HydrophobicContact CD2-CD2 4.47Å; L477-L573 HydrophobicContact CD1-CD2 4.49Å
478L90.4Very high90.1Very high11 Ų1132.2 Ų32.26%0.05816%0.16CC..Hα-helixtrans-65.5-43178.9-73170.5000111.7C474 G475 C481 G482 L570 N574 M653 A657C474-L478 WeakPolarHBondContact O-CG 3.5Å; C474-L478 PolarHBondContact O-N 2.9Å; G475-L478 PolarHBondContact O-N 2.81Å; L478-C481 PolarHBondContact O-N 3.33Å; L478-G482 PolarHBondContact O-N 3.2Å; L478-G482 VanDerWaalsContact O-N 3.09Å; L478-L570 HydrophobicContact CD2-CB 3.77Å; L478-N574 HydrophobicContact CD1-CB 4.36Å; L478-M653 HydrophobicContact CB-SD 4.18Å; L478-A657 HydrophobicContact CD1-CB 3.85Å
479R90Very high90.3Very high99 Ų9931.3 Ų31.337%0.37415%0.154SC..Hα-helixtrans-63.7-51.6178.3-171.6-175.57776.93.9111.6G475 E476 C481 G482 A483 M653G475-R479 WeakPolarHBondContact O-CB 3.39Å; G475-R479 PolarHBondContact O-N 3.01Å; E476-R479 VanDerWaalsContact CD-NH2 3.3Å; E476-R479 PolarHBondContact O-N 3.04Å; E476-R479 IonicContact OE1-CZ 3.64Å; E476-R479 IonicContact OE1-NE 3.94Å; E476-R479 IonicContact OE1-NH2 2.8Å; E476-R479 PolarHBondContact OE1-NH2 3.38Å; E476-R479 IonicContact OE2-CZ 3.24Å; E476-R479 IonicContact OE2-NE 2.68Å; E476-R479 PolarHBondContact OE2-NE 3.05Å; E476-R479 IonicContact OE2-NH2 2.83Å; E476-R479 PolarHBondContact OE2-NH2 3.49Å; E476-R479 VanDerWaalsContact OE2-NH2 3.08Å; R479-C481 VanDerWaalsContact C-N 3.3Å; R479-C481 PolarHBondContact O-N 3.03Å; R479-G482 PolarHBondContact O-N 3.44Å; R479-A483 PolarHBondContact O-N 2.95Å; R479-M653 HydrophobicContact CB-CE 3.6Å; R479-M653 HydrophobicContact CB-SD 3.87Å; R479-M653 HydrophobicContact CG-CE 3.61Å; R479-M653 HydrophobicContact CG-SD 4.47Å
480Q92.1Very high90.5Very high46 Ų4629.1 Ų29.122%0.21515%0.152CC..Hα-helixtrans-64.3-34.6177.4-71.2-165.92200111.7F398 E476 G482 A483 F484F398-Q480 HydrophobicContact CD1-CB 4.39Å; F398-Q480 HydrophobicContact CD2-CB 3.66Å; F398-Q480 HydrophobicContact CD2-CG 4.39Å; F398-Q480 HydrophobicContact CE1-CB 4.18Å; F398-Q480 HydrophobicContact CE2-CB 3.37Å; F398-Q480 HydrophobicContact CE2-CG 4.41Å; F398-Q480 HydrophobicContact CG-CB 4.15Å; F398-Q480 HydrophobicContact CZ-CB 3.67Å; E476-Q480 HydrophobicContact CG-CG 4.34Å; E476-Q480 WeakPolarHBondContact O-CB 3.4Å; E476-Q480 WeakPolarHBondContact O-CG 3.09Å; E476-Q480 PolarHBondContact O-N 2.86Å; E476-Q480 WeakPolarHBondContact OE1-CG 3.39Å; E476-Q480 PolarHBondContact OE1-NE2 3.07Å; Q480-G482 PolarHBondContact O-N 3.25Å; Q480-A483 PolarHBondContact O-N 2.76Å; Q480-F484 WeakPolarHBondContact O-CB 3.21Å; Q480-F484 PolarHBondContact O-N 3.29Å
481C92.1Very high90.5Very high0 Ų032.4 Ų32.40%017%0.166CC..Hα-helixtrans-61.8-44175-1720000112F398 L477 L478 R479 E485 L570F398-C481 HydrophobicContact CE1-CB 4.32Å; F398-C481 HydrophobicContact CZ-CB 3.93Å; F398-C481 VanDerWaalsContact CZ-N 3.26Å; L477-C481 WeakPolarHBondContact O-CB 3.15Å; L477-C481 PolarHBondContact O-N 3.43Å; L478-C481 PolarHBondContact O-N 3.33Å; R479-C481 VanDerWaalsContact C-N 3.3Å; R479-C481 PolarHBondContact O-N 3.03Å; C481-E485 WeakPolarHBondContact O-CB 3.1Å; C481-E485 PolarHBondContact O-N 3.24Å; C481-L570 HydrophobicContact CB-CD1 3.85Å
482G89.4Confident90.5Very high22 Ų2232.6 Ų32.623%0.22717%0.167CC..Hα-helixtrans-64.6-44.717600000112.6L478 R479 Q480 E485 Q486L478-G482 PolarHBondContact O-N 3.2Å; L478-G482 VanDerWaalsContact O-N 3.09Å; R479-G482 PolarHBondContact O-N 3.44Å; Q480-G482 PolarHBondContact O-N 3.25Å; G482-E485 PolarHBondContact O-N 2.83Å; G482-Q486 PolarHBondContact O-N 3.4Å; G482-Q486 VanDerWaalsContact O-N 3.16Å
483A91.1Very high90.4Very high39 Ų3934.1 Ų34.132%0.32217%0.172SC..Hα-helixtrans-62.7-43176.600000112R479 Q480 Q486 Q487R479-A483 PolarHBondContact O-N 2.95Å; Q480-A483 PolarHBondContact O-N 2.76Å; A483-Q486 PolarHBondContact O-N 3.1Å; A483-Q487 WeakPolarHBondContact O-CG 3.34Å; A483-Q487 PolarHBondContact O-N 2.9Å
484F93.4Very high90.1Very high7 Ų736.8 Ų36.83%0.03120%0.201CC..Hα-helixtrans-64.4-42.9177.2176.9-104.6000112F398 A401 V405 L424 F428 Q480 Q486 Q487 L488 L563F398-F484 HydrophobicContact CD1-CB 3.86Å; F398-F484 HydrophobicContact CD1-CD2 4.44Å; F398-F484 HydrophobicContact CD1-CG 4.02Å; F398-F484 HydrophobicContact CE1-CB 3.85Å; F398-F484 HydrophobicContact CE1-CD1 4.44Å; F398-F484 HydrophobicContact CE1-CG 4.22Å; A401-F484 HydrophobicContact CB-CE1 4.04Å; A401-F484 HydrophobicContact CB-CE2 3.92Å; A401-F484 HydrophobicContact CB-CZ 3.61Å; V405-F484 HydrophobicContact CG2-CE2 4.08Å; V405-F484 HydrophobicContact CG2-CZ 3.9Å; L424-F484 HydrophobicContact CD1-CE1 4.14Å; L424-F484 HydrophobicContact CD1-CZ 4.19Å; L424-F484 HydrophobicContact CD2-CE1 4.44Å; L424-F484 HydrophobicContact CD2-CZ 4.27Å; F428-F484 HydrophobicContact CE2-CE1 4.49Å; Q480-F484 WeakPolarHBondContact O-CB 3.21Å; Q480-F484 PolarHBondContact O-N 3.29Å; F484-Q486 VanDerWaalsContact C-N 3.3Å; F484-Q486 PolarHBondContact O-N 3.02Å; F484-Q487 PolarHBondContact O-N 3.08Å; F484-L488 HydrophobicContact CE1-CD2 4.32Å; F484-L488 VanDerWaalsContact O-CB 3.26Å; F484-L488 WeakPolarHBondContact O-CB 3.42Å; F484-L488 PolarHBondContact O-N 2.68Å; F484-L563 HydrophobicContact CD1-CD1 3.67Å; F484-L563 HydrophobicContact CE1-CD1 3.83Å
485E91.5Very high89.8Confident9 Ų937.9 Ų37.94%0.04221%0.208CC..Hα-helixtrans-59.7-41.2176.6-176.7165.8-149.400111.8C481 G482 L488 S489 S560 L562 L563C481-E485 WeakPolarHBondContact O-CB 3.1Å; C481-E485 PolarHBondContact O-N 3.24Å; G482-E485 PolarHBondContact O-N 2.83Å; E485-L488 PolarHBondContact O-N 2.95Å; E485-S489 WeakPolarHBondContact O-CB 3.21Å; E485-S489 PolarHBondContact O-N 3.32Å; E485-S489 PolarHBondContact O-OG 3.31Å; E485-S560 VanDerWaalsContact CD-O 3.27Å; E485-L562 PolarHBondContact OE1-N 3.12Å; E485-L563 HydrophobicContact CB-CD1 4.27Å; E485-L563 PolarHBondContact OE1-N 3.17Å
486Q89.9Confident89.5Confident99 Ų9937.9 Ų37.946%0.46321%0.208SC..Hα-helixtrans-65.8-43.8175.2-169.61801400112.1G482 A483 F484 S489 N490G482-Q486 PolarHBondContact O-N 3.4Å; G482-Q486 VanDerWaalsContact O-N 3.16Å; A483-Q486 PolarHBondContact O-N 3.1Å; F484-Q486 VanDerWaalsContact C-N 3.3Å; F484-Q486 PolarHBondContact O-N 3.02Å; Q486-S489 PolarHBondContact O-N 2.9Å; Q486-N490 WeakPolarHBondContact O-CB 3.46Å; Q486-N490 VanDerWaalsContact O-CG 3.29Å; Q486-N490 PolarHBondContact O-N 2.95Å; Q486-N490 PolarHBondContact O-ND2 2.98Å
487Q91.4Very high88.9Confident118 Ų11836.6 Ų36.655%0.55121%0.206SC*.Hα-helixtrans-62-43175.8-73.3176.3-1.500111.8A483 F484 N490 K491A483-Q487 WeakPolarHBondContact O-CG 3.34Å; A483-Q487 PolarHBondContact O-N 2.9Å; F484-Q487 PolarHBondContact O-N 3.08Å; Q487-N490 PolarHBondContact O-N 3.44Å; Q487-K491 WeakPolarHBondContact O-CB 3.43Å; Q487-K491 PolarHBondContact O-N 2.95Å
488L91.2Very high88.2Confident2 Ų242.8 Ų42.81%0.0123%0.233CC..Hα-helixtrans-59.2-51176.3177.662.8000110.6V405 L420 L421 L424 F484 E485 N490 K491 I492 L562 L563V405-L488 HydrophobicContact CG1-CD1 4.29Å; V405-L488 HydrophobicContact CG2-CD1 3.64Å; L420-L488 HydrophobicContact CD2-CD1 4.2Å; L421-L488 HydrophobicContact CD2-CD2 3.92Å; L424-L488 HydrophobicContact CD1-CD2 4Å; F484-L488 HydrophobicContact CE1-CD2 4.32Å; F484-L488 VanDerWaalsContact O-CB 3.26Å; F484-L488 WeakPolarHBondContact O-CB 3.42Å; F484-L488 PolarHBondContact O-N 2.68Å; E485-L488 PolarHBondContact O-N 2.95Å; L488-N490 VanDerWaalsContact C-N 3.35Å; L488-N490 PolarHBondContact O-N 3.49Å; L488-K491 PolarHBondContact O-N 3.45Å; L488-I492 HydrophobicContact CD1-CD1 3.68Å; L488-I492 HydrophobicContact CD1-CG1 4.07Å; L488-I492 HydrophobicContact CD2-CD1 4.48Å; L488-I492 HydrophobicContact CG-CD1 3.66Å; L488-I492 HydrophobicContact CG-CG1 4.43Å; L488-I492 WeakPolarHBondContact O-CB 3.38Å; L488-I492 WeakPolarHBondContact O-CG1 3.41Å; L488-I492 PolarHBondContact O-N 3.31Å; L488-L562 HydrophobicContact CD2-CD1 4.32Å; L488-L562 HydrophobicContact CG-CD1 4.39Å; L488-L563 HydrophobicContact CD2-CD1 4.38Å
489S90.3Very high87.5Confident0 Ų044.5 Ų44.50%024%0.239CC..Hα-helixtrans-58.3-43.9177.2-71.30000112.7E485 Q486 L493 S560 L562E485-S489 WeakPolarHBondContact O-CB 3.21Å; E485-S489 PolarHBondContact O-N 3.32Å; E485-S489 PolarHBondContact O-OG 3.31Å; Q486-S489 PolarHBondContact O-N 2.9Å; S489-L493 WeakPolarHBondContact O-CB 3.41Å; S489-L493 PolarHBondContact O-N 2.94Å; S489-S560 WeakPolarHBondContact OG-CB 3.24Å; S489-S560 PolarHBondContact OG-OG 3.39Å; S489-L562 WeakPolarHBondContact OG-CD1 3.38Å
490N89.4Confident86.7Confident78 Ų7840.8 Ų40.842%0.41723%0.227SC..Hα-helixtrans-63.2-44.5176.3-72.9-24.4000112.1Q486 Q487 L488 L493 G494 T557Q486-N490 WeakPolarHBondContact O-CB 3.46Å; Q486-N490 VanDerWaalsContact O-CG 3.29Å; Q486-N490 PolarHBondContact O-N 2.95Å; Q486-N490 PolarHBondContact O-ND2 2.98Å; Q487-N490 PolarHBondContact O-N 3.44Å; L488-N490 VanDerWaalsContact C-N 3.35Å; L488-N490 PolarHBondContact O-N 3.49Å; N490-L493 PolarHBondContact O-N 3.27Å; N490-G494 PolarHBondContact O-N 3.43Å; N490-T557 WeakPolarHBondContact OD1-CB 3.38Å; N490-T557 WeakPolarHBondContact OD1-CG2 3.24Å; N490-T557 PolarHBondContact OD1-OG1 3.31Å
491K89.6Confident85.5Confident71 Ų7141.5 Ų41.531%0.30924%0.236SC..Hα-helixtrans-67.7-42.1-179.6-16982.9177-146.40111.6V405 E406 V409 Q487 L488 G494 T495V405-K491 HydrophobicContact CG1-CB 4.28Å; V405-K491 HydrophobicContact CG1-CG 3.84Å; E406-K491 IonicContact OE1-NZ 2.72Å; E406-K491 PolarHBondContact OE1-NZ 3.28Å; E406-K491 IonicContact OE2-NZ 2.76Å; E406-K491 PolarHBondContact OE2-NZ 2.9Å; V409-K491 HydrophobicContact CG2-CG 4.36Å; Q487-K491 WeakPolarHBondContact O-CB 3.43Å; Q487-K491 PolarHBondContact O-N 2.95Å; L488-K491 PolarHBondContact O-N 3.45Å; K491-G494 PolarHBondContact O-N 2.91Å; K491-T495 WeakPolarHBondContact O-CB 3.35Å; K491-T495 WeakPolarHBondContact O-CG2 3.49Å; K491-T495 PolarHBondContact O-N 3Å; K491-T495 PolarHBondContact O-OG1 3.01Å
492I88.1Confident83.6Confident4 Ų450.8 Ų50.82%0.02128%0.28CS..Hα-helixtrans-59.9-49.2175.2-69.6167.9000109.9V417 L488 G494 T495 A496 G497 L549 L552 L562V417-I492 HydrophobicContact CG1-CD1 3.6Å; V417-I492 HydrophobicContact CG1-CG1 4.08Å; V417-I492 HydrophobicContact CG1-CG2 4.22Å; V417-I492 HydrophobicContact CG2-CB 4.49Å; V417-I492 HydrophobicContact CG2-CD1 4.2Å; V417-I492 HydrophobicContact CG2-CG1 3.75Å; V417-I492 HydrophobicContact CG2-CG2 4.14Å; L488-I492 HydrophobicContact CD1-CD1 3.68Å; L488-I492 HydrophobicContact CD1-CG1 4.07Å; L488-I492 HydrophobicContact CD2-CD1 4.48Å; L488-I492 HydrophobicContact CG-CD1 3.66Å; L488-I492 HydrophobicContact CG-CG1 4.43Å; L488-I492 WeakPolarHBondContact O-CB 3.38Å; L488-I492 WeakPolarHBondContact O-CG1 3.41Å; L488-I492 PolarHBondContact O-N 3.31Å; I492-G494 PolarHBondContact O-N 3.39Å; I492-T495 PolarHBondContact O-N 2.84Å; I492-T495 PolarHBondContact O-OG1 2.8Å; I492-A496 WeakPolarHBondContact O-CA 3.34Å; I492-A496 WeakPolarHBondContact O-CB 3.43Å; I492-A496 PolarHBondContact O-N 2.73Å; I492-G497 PolarHBondContact O-N 3.35Å; I492-L549 HydrophobicContact CG2-CD2 3.45Å; I492-L549 VanDerWaalsContact CG2-CD2 3.45Å; I492-L552 HydrophobicContact CG2-CD1 4Å; I492-L562 HydrophobicContact CD1-CD1 3.99Å
493L85.8Confident81.5Confident54 Ų5454.5 Ų54.528%0.28330%0.303SS..Hα-helixtrans-66.9-38.5-179.2-168.664.6000111.9S489 N490 T495 G497 T557S489-L493 WeakPolarHBondContact O-CB 3.41Å; S489-L493 PolarHBondContact O-N 2.94Å; N490-L493 PolarHBondContact O-N 3.27Å; L493-T495 VanDerWaalsContact C-N 3.35Å; L493-T495 PolarHBondContact O-N 3.47Å; L493-G497 WeakPolarHBondContact O-CA 3.48Å; L493-G497 PolarHBondContact O-N 3.38Å; L493-T557 HydrophobicContact CD2-CG2 4.12Å
494G85.5Confident80Confident65 Ų6555.8 Ų55.867%0.6730%0.3SS*.Hα-helixtrans-67.8-30.4177.700000114.2N490 K491 I492N490-G494 PolarHBondContact O-N 3.43Å; K491-G494 PolarHBondContact O-N 2.91Å; I492-G494 PolarHBondContact O-N 3.39Å
495T84.2Confident78.2Confident27 Ų2758 Ų5817%0.16632%0.316CS..Hα-helixtrans-96.9-56.2-177.651.60000112.4V409 K491 I492 L493 K498V409-T495 HydrophobicContact CG1-CG2 4.01Å; V409-T495 HydrophobicContact CG2-CG2 4.06Å; K491-T495 WeakPolarHBondContact O-CB 3.35Å; K491-T495 WeakPolarHBondContact O-CG2 3.49Å; K491-T495 PolarHBondContact O-N 3Å; K491-T495 PolarHBondContact O-OG1 3.01Å; I492-T495 PolarHBondContact O-N 2.84Å; I492-T495 PolarHBondContact O-OG1 2.8Å; L493-T495 VanDerWaalsContact C-N 3.35Å; L493-T495 PolarHBondContact O-N 3.47Å; T495-K498 VanDerWaalsContact O-CD 3.24Å; T495-K498 WeakPolarHBondContact O-CD 3.26Å; T495-K498 VanDerWaalsContact O-CE 3.28Å; T495-K498 WeakPolarHBondContact O-CE 3.34Å; T495-K498 VanDerWaalsContact O-CG 3.25Å; T495-K498 WeakPolarHBondContact O-CG 3.45Å
496A81.4Confident76.4Confident0 Ų060.5 Ų60.50%033%0.333CS..Hα-helixtrans-88.6-18.2-176.400000113.2G414 I492 K498 Y499 L549G414-A496 WeakPolarHBondContact O-CB 3.41Å; I492-A496 WeakPolarHBondContact O-CA 3.34Å; I492-A496 WeakPolarHBondContact O-CB 3.43Å; I492-A496 PolarHBondContact O-N 2.73Å; A496-K498 PolarHBondContact O-N 2.88Å; A496-Y499 WeakPolarHBondContact O-CB 3.48Å; A496-Y499 WeakPolarHBondContact O-CD2 3.44Å; A496-Y499 PolarHBondContact O-N 3.46Å; A496-L549 HydrophobicContact CB-CD1 4.01Å; A496-L549 HydrophobicContact CB-CD2 3.96Å
497G77Confident74.5Confident16 Ų1667.3 Ų67.317%0.16535%0.354CS..G310 helixtrans-62.5-21.4176.400000113.9I492 L493 Y499 L500I492-G497 PolarHBondContact O-N 3.35Å; L493-G497 WeakPolarHBondContact O-CA 3.48Å; L493-G497 PolarHBondContact O-N 3.38Å; G497-Y499 PolarHBondContact O-N 3.39Å; G497-Y499 VanDerWaalsContact O-N 3.15Å; G497-L500 WeakPolarHBondContact O-CB 3.37Å; G497-L500 PolarHBondContact O-N 2.66Å
498K78.9Confident72.3Confident132 Ų13264.5 Ų64.557%0.57435%0.347SS*.G310 helixtrans-59.7-22.2172.573.7-169.8176.31770113.5T495 A496T495-K498 VanDerWaalsContact O-CD 3.24Å; T495-K498 WeakPolarHBondContact O-CD 3.26Å; T495-K498 VanDerWaalsContact O-CE 3.28Å; T495-K498 WeakPolarHBondContact O-CE 3.34Å; T495-K498 VanDerWaalsContact O-CG 3.25Å; T495-K498 WeakPolarHBondContact O-CG 3.45Å; A496-K498 PolarHBondContact O-N 2.88Å
499Y74.7Confident70.1Confident46 Ų4672.2 Ų72.218%0.1839%0.388CS..G310 helixtrans-88.2-12.6178.5-61.4-74.1000113.4L415 A496 G497 S501L415-Y499 HydrophobicContact CD1-CE2 4.49Å; L415-Y499 HydrophobicContact CD2-CD2 3.68Å; L415-Y499 HydrophobicContact CD2-CE2 3.66Å; L415-Y499 HydrophobicContact CD2-CG 4.28Å; L415-Y499 HydrophobicContact CG-CE2 4.09Å; A496-Y499 WeakPolarHBondContact O-CB 3.48Å; A496-Y499 WeakPolarHBondContact O-CD2 3.44Å; A496-Y499 PolarHBondContact O-N 3.46Å; G497-Y499 PolarHBondContact O-N 3.39Å; G497-Y499 VanDerWaalsContact O-N 3.15Å; Y499-S501 PolarHBondContact O-N 3.38Å
500L73.8Confident67.8Low22 Ų2274.8 Ų74.812%0.11541%0.409CS..SBendtrans-75.5118.7171.4-77.1174.1000109.4G497 Y504 M546 L549 K553G497-L500 WeakPolarHBondContact O-CB 3.37Å; G497-L500 PolarHBondContact O-N 2.66Å; L500-Y504 HydrophobicContact CD2-CD1 3.81Å; L500-Y504 HydrophobicContact CD2-CE1 4.36Å; L500-Y504 HydrophobicContact CD2-CG 4.24Å; L500-M546 HydrophobicContact CD2-SD 3.78Å; L500-M546 HydrophobicContact CG-SD 4.39Å; L500-L549 HydrophobicContact CD1-CB 3.48Å; L500-L549 VanDerWaalsContact CD1-CB 3.48Å; L500-L549 HydrophobicContact CD2-CB 3.96Å; L500-L549 HydrophobicContact CG-CB 3.76Å; L500-L549 HydrophobicContact CG-CD1 4.15Å; L500-K553 HydrophobicContact CD1-CD 4.47Å
501S66.4Low65.3Low60 Ų6074.5 Ų74.542%0.4242%0.424SS..  trans-67.4147.2167.866.30000110.2Y499 S503 Y504Y499-S501 PolarHBondContact O-N 3.38Å; S501-S503 PolarHBondContact O-N 2.69Å; S501-S503 PolarHBondContact OG-OG 3.23Å; S501-Y504 WeakPolarHBondContact O-CB 3.41Å; S501-Y504 PolarHBondContact O-N 3.17Å; S501-Y504 PolarHBondContact OG-N 2.95Å
502E52.8Low63.2Low195 Ų19578.6 Ų78.691%0.91145%0.448SS*.THydrogen-bonded Turntrans-58.1-21.5174.9-71.8-177.4161.400112.8
503S45.8Very low60.8Low101 Ų10186 Ų8671%0.70648%0.482SS*.THydrogen-bonded Turntrans-94.6-1.417954.70000115.3S501 S505S501-S503 PolarHBondContact O-N 2.69Å; S501-S503 PolarHBondContact OG-OG 3.23Å; S503-S505 PolarHBondContact O-N 3.47Å
504Y58.8Low58.5Low66 Ų6691 Ų9126%0.25951%0.505SS..  trans-67.5121.2-175.9-176.7-98.5000111.2L500 S501 P506 M546 F550L500-Y504 HydrophobicContact CD2-CD1 3.81Å; L500-Y504 HydrophobicContact CD2-CE1 4.36Å; L500-Y504 HydrophobicContact CD2-CG 4.24Å; S501-Y504 WeakPolarHBondContact O-CB 3.41Å; S501-Y504 PolarHBondContact O-N 3.17Å; S501-Y504 PolarHBondContact OG-N 2.95Å; Y504-P506 HydrophobicContact CE1-CG 4.22Å; Y504-M546 HydrophobicContact CE1-CB 3.87Å; Y504-M546 HydrophobicContact CE2-CB 4.05Å; Y504-M546 VanDerWaalsContact CZ-CB 3.49Å; Y504-M546 VanDerWaalsContact OH-CB 3.31Å; Y504-M546 WeakPolarHBondContact OH-CB 3.47Å; Y504-F550 HydrophobicContact CD1-CB 4.2Å; Y504-F550 HydrophobicContact CD1-CD2 4.05Å; Y504-F550 HydrophobicContact CD1-CG 4.45Å; Y504-F550 HydrophobicContact CE1-CB 4.09Å; Y504-F550 WeakPolarHBondContact O-CE2 3.26Å
505S55.1Low56Low53 Ų5392.3 Ų92.337%0.37151%0.509SS..  trans-131.4129.7168.761.30000109.8S503 R507 S508S503-S505 PolarHBondContact O-N 3.47Å; S505-R507 PolarHBondContact O-N 2.96Å; S505-S508 PolarHBondContact O-N 3.42Å; S505-S508 VanDerWaalsContact OG-CB 3.23Å; S505-S508 WeakPolarHBondContact OG-CB 3.35Å
506P54.8Low53.5Low61 Ų6193.7 Ų93.740%0.39652%0.52SS..THydrogen-bonded Turntrans-61.1-17.6-178.3-22.330.8000114.2Y504 F550Y504-P506 HydrophobicContact CE1-CG 4.22Å; P506-F550 HydrophobicContact CG-CB 4.35Å; P506-F550 HydrophobicContact CG-CD1 3.57Å; P506-F550 HydrophobicContact CG-CD2 4.33Å; P506-F550 HydrophobicContact CG-CE1 3.91Å; P506-F550 HydrophobicContact CG-CG 3.81Å; P506-F550 HydrophobicContact CG-CZ 4.42Å
507R48.6Very low51.4Low243 Ų24398.4 Ų98.492%0.91755%0.553SS**THydrogen-bonded Turntrans-101.7-1.7-176-66.4-175.8178169.70.9114.3S505 L509S505-R507 PolarHBondContact O-N 2.96Å; R507-L509 PolarHBondContact O-N 3.15Å
508S47Very low49.3Very low58 Ų58103.1 Ų103.141%0.40658%0.579SS.*  trans-82.5117173.6179.50000110.1S505 A510 G511S505-S508 PolarHBondContact O-N 3.42Å; S505-S508 VanDerWaalsContact OG-CB 3.23Å; S505-S508 WeakPolarHBondContact OG-CB 3.35Å; S508-A510 PolarHBondContact O-N 3.42Å; S508-A510 WeakPolarHBondContact OG-CB 3.37Å; S508-A510 PolarHBondContact OG-N 2.9Å; S508-A510 VanDerWaalsContact OG-N 3.15Å; S508-G511 PolarHBondContact O-N 3.14Å
509L45Very low47.1Very low164 Ų164104.7 Ų104.786%0.85959%0.593SS**G310 helixtrans-60.9-6.2167.4-93.4145.3000113.2R507 G511R507-L509 PolarHBondContact O-N 3.15Å; L509-G511 PolarHBondContact O-N 3.42Å
510A40.4Very low45.4Very low55 Ų55112.6 Ų112.646%0.45562%0.622SS.*G310 helixtrans-77.52.3177.800000114.5S508 I512S508-A510 PolarHBondContact O-N 3.42Å; S508-A510 WeakPolarHBondContact OG-CB 3.37Å; S508-A510 PolarHBondContact OG-N 2.9Å; S508-A510 VanDerWaalsContact OG-N 3.15Å; A510-I512 VanDerWaalsContact C-N 3.33Å
511G37.9Very low43.5Very low71 Ų71119.8 Ų119.873%0.73265%0.653SS**G310 helixtrans-75.9-18172.200000114.3S508 L509S508-G511 PolarHBondContact O-N 3.14Å; L509-G511 PolarHBondContact O-N 3.42Å
512I44.7Very low42Very low158 Ų158124.8 Ų124.881%0.8168%0.675SS**THydrogen-bonded Turntrans-111.3-20.4-172.6-63.9175.1000112.4A510A510-I512 VanDerWaalsContact C-N 3.33Å
513Q38.4Very low41.5Very low158 Ų158119 Ų11974%0.73866%0.66SS**SBendtrans-139133.8172.9-81169.8-9.800108
514E36.8Very low41.9Very low161 Ų161119.4 Ų119.475%0.75266%0.659SS**  trans94.252.5-174.7-51.8-162.6158.400117.3S516E514-S516 WeakPolarHBondContact CA-OG 3.45Å; E514-S516 VanDerWaalsContact CB-OG 3.22Å; E514-S516 WeakPolarHBondContact CB-OG 3.44Å; E514-S516 VanDerWaalsContact CG-OG 3.23Å; E514-S516 WeakPolarHBondContact CG-OG 3.49Å; E514-S516 PolarHBondContact O-N 3.46Å
515A33.9Very low42.4Very low92 Ų92122.8 Ų122.876%0.7668%0.675SS**  trans-77.637.3133.600000111.1S517A515-S517 PolarHBondContact O-N 2.77Å
516S31.1Very low43.5Very low55 Ų55120.8 Ų120.839%0.38566%0.66SS.*  trans-87.296.4177.443.80000110.5E514 T518E514-S516 WeakPolarHBondContact CA-OG 3.45Å; E514-S516 VanDerWaalsContact CB-OG 3.22Å; E514-S516 WeakPolarHBondContact CB-OG 3.44Å; E514-S516 VanDerWaalsContact CG-OG 3.23Å; E514-S516 WeakPolarHBondContact CG-OG 3.49Å; E514-S516 PolarHBondContact O-N 3.46Å; S516-T518 PolarHBondContact O-N 3.06Å
517S37.9Very low44.7Very low99 Ų99118.2 Ų118.269%0.69264%0.643SS**SBend67.31.1125.761.10000122.9A515A515-S517 PolarHBondContact O-N 2.77Å
518T32.7Very low46.4Very low116 Ų116107.6 Ų107.671%0.71260%0.603SS**SBendtrans-115-25.9179.545.70000117.2S516S516-T518 PolarHBondContact O-N 3.06Å
519D32.8Very low48Very low164 Ų164110.9 Ų110.988%0.87761%0.612SS**SBendtrans-1016.9177.6-79.4-23.1000115.1K521D519-K521 PolarHBondContact O-N 3.41Å
520R38.5Very low49.4Very low212 Ų212107.8 Ų107.880%0.859%0.593SS**  trans-84.622.2175.4-75.5-169.2180-173.90.1114.4
521K35Very low51.3Low173 Ų173106.6 Ų106.675%0.75258%0.577SS**SBendtrans-106.494.8172.8-68.8-177.5-179.3177.40107.9D519D519-K521 PolarHBondContact O-N 3.41Å
522N33.9Very low53.5Low166 Ų166103.5 Ų103.589%0.88854%0.544SS*.SBendtrans130.631.9156.3-59-13.6000118.1
523A43.4Very low55.4Low72 Ų7296.2 Ų96.260%0.59551%0.506SS*.  trans-144.5110.2151.100000109.4K525A523-K525 HydrophobicContact CB-CG 4.14Å; A523-K525 PolarHBondContact O-N 2.9Å
524T53.9Low57.5Low110 Ų11089 Ų8968%0.67547%0.473SS*.  trans-59.986.5157.514.20000106.8L340 N526L340-T524 HydrophobicContact CD1-CG2 4.05Å; T524-N526 PolarHBondContact O-N 3.49Å
525K68.4Low59.6Low137 Ų13786.4 Ų86.460%0.59646%0.46SS*.  trans-67.6134.7-177.3-67.5-175.3178.2-173.10108.9A523 P527 E530A523-K525 HydrophobicContact CB-CG 4.14Å; A523-K525 PolarHBondContact O-N 2.9Å; K525-P527 WeakPolarHBondContact O-CD 3.34Å; K525-E530 HydrophobicContact CB-CG 4.13Å; K525-E530 WeakPolarHBondContact CB-OE1 3.44Å; K525-E530 WeakPolarHBondContact CD-OE1 3.48Å
526N78Confident61.8Low12 Ų1287.3 Ų87.36%0.06444%0.444CS..  trans-73.8116.9-174-179.7-1.6000110.1E328 L335 T524 W528 Q529 E530E328-N526 PolarHBondContact OE1-ND2 3.12Å; L335-N526 HydrophobicContact CD2-CB 4.25Å; T524-N526 PolarHBondContact O-N 3.49Å; N526-W528 PolarHBondContact O-N 3.1Å; N526-W528 VanDerWaalsContact O-N 3.1Å; N526-W528 WeakPolarHBondContact OD1-CB 3.36Å; N526-W528 PolarHBondContact OD1-N 3.36Å; N526-Q529 HydrophobicContact CB-CB 4.37Å; N526-Q529 HydrophobicContact CB-CG 4.23Å; N526-Q529 PolarHBondContact ND2-NE2 2.95Å; N526-Q529 PolarHBondContact O-N 2.86Å; N526-E530 PolarHBondContact O-N 3.01Å
527P81.4Confident64Low7 Ų786.4 Ų86.45%0.04544%0.444CS..Hα-helixtrans-57.6-27.2-178.3-25.635.2000114.1L340 V343 N344 K525 Q529 Y531L340-P527 HydrophobicContact CB-CG 4.35Å; L340-P527 HydrophobicContact CD2-CG 4.24Å; V343-P527 HydrophobicContact CB-CG 4.27Å; V343-P527 HydrophobicContact CG1-CB 4.15Å; V343-P527 HydrophobicContact CG1-CG 4.12Å; N344-P527 HydrophobicContact CB-CB 4.17Å; K525-P527 WeakPolarHBondContact O-CD 3.34Å; P527-Q529 VanDerWaalsContact C-N 3.3Å; P527-Q529 PolarHBondContact O-N 3.35Å; P527-Y531 PolarHBondContact O-N 2.96Å
528W83.8Confident66.1Low20 Ų2084.1 Ų84.18%0.07642%0.424CS..Hα-helixtrans-65.1-32.9175.8-64.597.2000112.5G324 L327 E328 M331 L346 V347 L350 Y351 N526G324-W528 WeakPolarHBondContact O-CZ3 3.11Å; L327-W528 HydrophobicContact CB-CH2 3.65Å; L327-W528 HydrophobicContact CB-CZ2 3.86Å; L327-W528 HydrophobicContact CB-CZ3 4.44Å; L327-W528 HydrophobicContact CD1-CH2 3.93Å; L327-W528 HydrophobicContact CG-CH2 4.49Å; E328-W528 HydrophobicContact CB-CB 4.17Å; E328-W528 HydrophobicContact CB-CD2 3.82Å; E328-W528 HydrophobicContact CB-CE3 4.25Å; E328-W528 HydrophobicContact CB-CG 3.75Å; E328-W528 HydrophobicContact CG-CB 3.75Å; E328-W528 HydrophobicContact CG-CD2 4.31Å; E328-W528 HydrophobicContact CG-CG 3.69Å; M331-W528 HydrophobicContact SD-CZ2 3.87Å; L346-W528 HydrophobicContact CD2-CH2 4.31Å; L346-W528 HydrophobicContact CD2-CZ2 4.16Å; L346-W528 HydrophobicContact CG-CH2 4.42Å; V347-W528 HydrophobicContact CG2-CD2 3.51Å; V347-W528 HydrophobicContact CG2-CE3 3.59Å; V347-W528 HydrophobicContact CG2-CG 4Å; V347-W528 HydrophobicContact CG2-CH2 4.16Å; V347-W528 HydrophobicContact CG2-CZ2 4.14Å; V347-W528 HydrophobicContact CG2-CZ3 3.9Å; L350-W528 HydrophobicContact CD1-CH2 3.87Å; L350-W528 HydrophobicContact CD1-CZ3 3.91Å; Y351-W528 HydrophobicContact CE2-CE3 4.44Å; Y351-W528 HydrophobicContact CE2-CZ3 4.41Å; N526-W528 PolarHBondContact O-N 3.1Å; N526-W528 VanDerWaalsContact O-N 3.1Å; N526-W528 WeakPolarHBondContact OD1-CB 3.36Å; N526-W528 PolarHBondContact OD1-N 3.36Å
529Q79.3Confident68.6Low127 Ų12782.7 Ų82.759%0.59341%0.414SS*.Hα-helixtrans-92.9-20.6-177.8-62.9174.7400112.8E328 N526 P527 Y531E328-Q529 WeakPolarHBondContact OE1-CG 3.46Å; E328-Q529 PolarHBondContact OE1-NE2 3.36Å; E328-Q529 VanDerWaalsContact OE1-NE2 3.1Å; N526-Q529 HydrophobicContact CB-CB 4.37Å; N526-Q529 HydrophobicContact CB-CG 4.23Å; N526-Q529 PolarHBondContact ND2-NE2 2.95Å; N526-Q529 PolarHBondContact O-N 2.86Å; P527-Q529 VanDerWaalsContact C-N 3.3Å; P527-Q529 PolarHBondContact O-N 3.35Å; Q529-Y531 VanDerWaalsContact C-N 3.35Å
530E75.3Confident71Confident98 Ų9877.7 Ų77.746%0.45840%0.396SS..Hα-helixtrans-82-12.1176.9-69.8-165.5148.100113.5K525 N526 N532K525-E530 HydrophobicContact CB-CG 4.13Å; K525-E530 WeakPolarHBondContact CB-OE1 3.44Å; K525-E530 WeakPolarHBondContact CD-OE1 3.48Å; N526-E530 PolarHBondContact O-N 3.01Å; E530-N532 PolarHBondContact O-N 3.27Å
531Y80.8Confident73.1Confident30 Ų3071.1 Ų71.112%0.11838%0.375CS..  trans-61.8112.4-178.5-176.4-93.6000110.8V347 Y351 D352 P527 Q529V347-Y531 HydrophobicContact CG1-CD2 3.81Å; V347-Y531 HydrophobicContact CG1-CG 3.92Å; Y351-Y531 VanDerWaalsContact C-OH 3.28Å; Y351-Y531 VanDerWaalsContact CB-CE1 3.41Å; Y351-Y531 HydrophobicContact CD2-CD1 4.34Å; Y351-Y531 HydrophobicContact CD2-CG 4.46Å; Y351-Y531 HydrophobicContact CG-CD1 4.31Å; Y351-Y531 HydrophobicContact CG-CE1 4.14Å; Y351-Y531 PolarHBondContact O-OH 3.06Å; D352-Y531 PolarHBondContact N-OH 3.11Å; D352-Y531 PolarHBondContact OD1-OH 2.94Å; P527-Y531 PolarHBondContact O-N 2.96Å; Q529-Y531 VanDerWaalsContact C-N 3.35Å
532N83.1Confident75.5Confident6 Ų664.6 Ų64.63%0.03235%0.346CS..  trans-126.3102.8178.3-168.8-49.3000109.4E530 L534 Q535 R536E530-N532 PolarHBondContact O-N 3.27Å; N532-L534 VanDerWaalsContact C-N 3.26Å; N532-L534 PolarHBondContact O-N 3.1Å; N532-L534 WeakPolarHBondContact OD1-CB 3.35Å; N532-L534 PolarHBondContact OD1-N 2.88Å; N532-L534 VanDerWaalsContact OD1-N 3.07Å; N532-Q535 HydrophobicContact CB-CB 4.15Å; N532-Q535 PolarHBondContact OD1-N 3.28Å; N532-R536 WeakPolarHBondContact O-CG 3.34Å; N532-R536 PolarHBondContact O-N 2.9Å
533Y85.1Confident77.9Confident5 Ų560.2 Ų60.22%0.0232%0.322CS..Hα-helixtrans-64.1-33.3-178.475.2-91.1000112Q358 L359 T412 L415 A416 R536 G537Q358-Y533 HydrophobicContact CB-CD1 4.42Å; Q358-Y533 HydrophobicContact CB-CD2 3.69Å; Q358-Y533 HydrophobicContact CB-CE1 4.42Å; Q358-Y533 HydrophobicContact CB-CE2 3.72Å; Q358-Y533 HydrophobicContact CB-CG 4.09Å; Q358-Y533 VanDerWaalsContact OE1-CG 3.32Å; L359-Y533 HydrophobicContact CD2-CD2 4.22Å; L359-Y533 HydrophobicContact CD2-CE2 4.26Å; L359-Y533 HydrophobicContact CG-CD2 4.47Å; T412-Y533 WeakPolarHBondContact CB-OH 3.38Å; T412-Y533 HydrophobicContact CG2-CE1 4.1Å; L415-Y533 HydrophobicContact CB-CE1 3.68Å; L415-Y533 WeakPolarHBondContact CB-OH 3.47Å; L415-Y533 HydrophobicContact CD1-CD1 3.98Å; L415-Y533 HydrophobicContact CD1-CE1 3.7Å; L415-Y533 HydrophobicContact CG-CE1 4.31Å; A416-Y533 WeakPolarHBondContact CB-OH 3.5Å; A416-Y533 PolarHBondContact N-OH 3.5Å; A416-Y533 VanDerWaalsContact N-OH 3.15Å; Y533-R536 PolarHBondContact O-N 3.43Å; Y533-G537 PolarHBondContact O-N 3.31Å
534L82.1Confident79.9Confident7 Ų760.8 Ų60.84%0.03732%0.315CS..Hα-helixtrans-72.5-45.4-175.2-167.566.3000110.9L359 N532 R536 G537 N538 E541 Y542 L545L359-L534 HydrophobicContact CD2-CD1 3.95Å; N532-L534 VanDerWaalsContact C-N 3.26Å; N532-L534 PolarHBondContact O-N 3.1Å; N532-L534 WeakPolarHBondContact OD1-CB 3.35Å; N532-L534 PolarHBondContact OD1-N 2.88Å; N532-L534 VanDerWaalsContact OD1-N 3.07Å; L534-R536 PolarHBondContact O-N 2.76Å; L534-G537 PolarHBondContact O-N 3.25Å; L534-G537 VanDerWaalsContact O-N 3.16Å; L534-N538 HydrophobicContact CD1-CB 4.4Å; L534-N538 CarbonylContact O-C 3.46Å; L534-N538 VanDerWaalsContact O-C 3.25Å; L534-N538 PolarHBondContact O-N 3.13Å; L534-E541 HydrophobicContact CD1-CB 3.95Å; L534-Y542 HydrophobicContact CB-CD2 4.45Å; L534-Y542 HydrophobicContact CD2-CD2 4.26Å; L534-Y542 HydrophobicContact CG-CD2 4.49Å; L534-L545 HydrophobicContact CD2-CD2 4.06Å
535Q82.1Confident81.5Confident106 Ų10655.5 Ų55.550%0.49528%0.283SS..Hα-helixtrans-61.3-33.7175.2-169.2179.211.400112.2N532 V539 Y542N532-Q535 HydrophobicContact CB-CB 4.15Å; N532-Q535 PolarHBondContact OD1-N 3.28Å; Q535-V539 WeakPolarHBondContact O-CG2 3.24Å; Q535-Y542 HydrophobicContact CB-CD2 4.21Å; Q535-Y542 HydrophobicContact CB-CE2 4.39Å; Q535-Y542 HydrophobicContact CB-CG 4.39Å
536R78.6Confident82.3Confident112 Ų11249.2 Ų49.242%0.42326%0.255SS..Hα-helixtrans-82.2-20.3178.2-64.2176.5113.4-1549.3113.6C348 D352 K355 N532 Y533 L534C348-R536 PolarHBondContact SG-NH1 2.69Å; C348-R536 PolarHBondContact SG-NH2 3.08Å; D352-R536 IonicContact OD1-NH1 3.93Å; D352-R536 PolarHBondContact OD1-NH1 2.95Å; D352-R536 IonicContact OD2-NH1 2.69Å; K355-R536 VanDerWaalsContact NZ-C 3.33Å; K355-R536 PolarHBondContact NZ-O 3.32Å; N532-R536 WeakPolarHBondContact O-CG 3.34Å; N532-R536 PolarHBondContact O-N 2.9Å; Y533-R536 PolarHBondContact O-N 3.43Å; L534-R536 PolarHBondContact O-N 2.76Å
537G77.9Confident82.6Confident36 Ų3653.6 Ų53.637%0.37128%0.276SS..Hα-helixtrans-108.7-44-170.900000113.9Y533 L534Y533-G537 PolarHBondContact O-N 3.31Å; L534-G537 PolarHBondContact O-N 3.25Å; L534-G537 VanDerWaalsContact O-N 3.16Å
538N82.9Confident82.7Confident51 Ų5155.1 Ų55.127%0.27328%0.283SS..  trans-149.689.4-175.9-168.2-13.8000110.9L359 L534 A540 E541 Y542L359-N538 HydrophobicContact CD2-CB 4.06Å; L534-N538 HydrophobicContact CD1-CB 4.4Å; L534-N538 CarbonylContact O-C 3.46Å; L534-N538 VanDerWaalsContact O-C 3.25Å; L534-N538 PolarHBondContact O-N 3.13Å; N538-A540 PolarHBondContact O-N 3.47Å; N538-A540 PolarHBondContact OD1-N 3.44Å; N538-E541 HydrophobicContact CB-CB 4.24Å; N538-E541 VanDerWaalsContact ND2-CG 3.29Å; N538-E541 WeakPolarHBondContact ND2-CG 3.36Å; N538-E541 PolarHBondContact ND2-OE1 3.43Å; N538-E541 PolarHBondContact ND2-OE2 3.31Å; N538-E541 PolarHBondContact O-N 3.35Å; N538-E541 PolarHBondContact OD1-N 3.5Å; N538-Y542 PolarHBondContact O-N 3.42Å; N538-Y542 VanDerWaalsContact O-N 3.14Å
539V84.1Confident82.8Confident85 Ų8554.1 Ų54.152%0.51528%0.279SS..Hα-helixtrans-62.8-30.8-178.5-178.20000112Q535 Y542 N543Q535-V539 WeakPolarHBondContact O-CG2 3.24Å; V539-Y542 WeakPolarHBondContact O-CB 3.48Å; V539-Y542 PolarHBondContact O-N 3.22Å; V539-N543 VanDerWaalsContact O-CG 3.27Å; V539-N543 PolarHBondContact O-N 3.45Å; V539-N543 PolarHBondContact O-ND2 3.3Å
540A83.4Confident83Confident60 Ų6050.9 Ų50.950%0.49626%0.263SS..Hα-helixtrans-68.1-45.8179.500000111.7N538 Y542 N543 N544N538-A540 PolarHBondContact O-N 3.47Å; N538-A540 PolarHBondContact OD1-N 3.44Å; A540-Y542 VanDerWaalsContact C-N 3.29Å; A540-Y542 PolarHBondContact O-N 2.91Å; A540-N543 PolarHBondContact O-N 2.92Å; A540-N544 PolarHBondContact O-N 3.47Å
541E82.8Confident83.4Confident74 Ų7448 Ų4835%0.34625%0.254SS..Hα-helixtrans-64.7-34.8174.6-79.9178.2171.600112.5L534 N538 N544 L545L534-E541 HydrophobicContact CD1-CB 3.95Å; N538-E541 HydrophobicContact CB-CB 4.24Å; N538-E541 VanDerWaalsContact ND2-CG 3.29Å; N538-E541 WeakPolarHBondContact ND2-CG 3.36Å; N538-E541 PolarHBondContact ND2-OE1 3.43Å; N538-E541 PolarHBondContact ND2-OE2 3.31Å; N538-E541 PolarHBondContact O-N 3.35Å; N538-E541 PolarHBondContact OD1-N 3.5Å; E541-N544 PolarHBondContact O-N 3.2Å; E541-L545 PolarHBondContact O-N 3.23Å
542Y85.6Confident83.5Confident36 Ų3646.8 Ų46.814%0.14125%0.25CC..Hα-helixtrans-61.1-43.1172.5-178.2-97.4000112L534 Q535 N538 V539 A540 L545 M546L534-Y542 HydrophobicContact CB-CD2 4.45Å; L534-Y542 HydrophobicContact CD2-CD2 4.26Å; L534-Y542 HydrophobicContact CG-CD2 4.49Å; Q535-Y542 HydrophobicContact CB-CD2 4.21Å; Q535-Y542 HydrophobicContact CB-CE2 4.39Å; Q535-Y542 HydrophobicContact CB-CG 4.39Å; N538-Y542 PolarHBondContact O-N 3.42Å; N538-Y542 VanDerWaalsContact O-N 3.14Å; V539-Y542 WeakPolarHBondContact O-CB 3.48Å; V539-Y542 PolarHBondContact O-N 3.22Å; A540-Y542 VanDerWaalsContact C-N 3.29Å; A540-Y542 PolarHBondContact O-N 2.91Å; Y542-L545 WeakPolarHBondContact O-CB 3.31Å; Y542-L545 PolarHBondContact O-N 3.22Å; Y542-M546 HydrophobicContact CD1-CG 4.27Å; Y542-M546 HydrophobicContact CD2-CE 4.26Å; Y542-M546 HydrophobicContact CE1-CE 4.38Å; Y542-M546 HydrophobicContact CE1-CG 3.9Å; Y542-M546 HydrophobicContact CE2-CE 3.59Å; Y542-M546 WeakPolarHBondContact O-CG 3.49Å; Y542-M546 PolarHBondContact O-N 3.41Å
543N84.1Confident83.5Confident74 Ų7452.1 Ų52.140%0.39627%0.272SS..Hα-helixtrans-64.6-43.1176.5-68.3-23.7000111.8V539 A540 L545 M546 E547V539-N543 VanDerWaalsContact O-CG 3.27Å; V539-N543 PolarHBondContact O-N 3.45Å; V539-N543 PolarHBondContact O-ND2 3.3Å; A540-N543 PolarHBondContact O-N 2.92Å; N543-L545 VanDerWaalsContact C-N 3.29Å; N543-L545 PolarHBondContact O-N 3.27Å; N543-M546 PolarHBondContact O-N 2.88Å; N543-M546 VanDerWaalsContact O-N 3.12Å; N543-E547 PolarHBondContact O-N 2.94Å
544N85.6Confident83.3Confident83 Ų8358.7 Ų58.744%0.44430%0.303SS..Hα-helixtrans-59.4-40.9174.8-68-15.6000111.7A540 E541 E547 I548A540-N544 PolarHBondContact O-N 3.47Å; E541-N544 PolarHBondContact O-N 3.2Å; N544-E547 PolarHBondContact O-N 3.23Å; N544-I548 WeakPolarHBondContact O-CG1 3.49Å; N544-I548 PolarHBondContact O-N 3.49Å
545L86.4Confident82.8Confident0 Ų064 Ų640%033%0.326CS..Hα-helixtrans-60-46.2174.217670.3000111L415 V417 L534 E541 Y542 N543 E547 I548 L549L415-L545 HydrophobicContact CB-CD2 4.48Å; L415-L545 HydrophobicContact CD2-CD2 3.84Å; V417-L545 HydrophobicContact CB-CD1 3.83Å; V417-L545 HydrophobicContact CG1-CD1 4.37Å; L534-L545 HydrophobicContact CD2-CD2 4.06Å; E541-L545 PolarHBondContact O-N 3.23Å; Y542-L545 WeakPolarHBondContact O-CB 3.31Å; Y542-L545 PolarHBondContact O-N 3.22Å; N543-L545 VanDerWaalsContact C-N 3.29Å; N543-L545 PolarHBondContact O-N 3.27Å; L545-E547 VanDerWaalsContact C-N 3.32Å; L545-E547 PolarHBondContact O-N 3.36Å; L545-I548 PolarHBondContact O-N 3.1Å; L545-L549 HydrophobicContact CD1-CD1 4.3Å; L545-L549 HydrophobicContact CD1-CG 4.29Å; L545-L549 HydrophobicContact CD2-CD1 4.49Å; L545-L549 HydrophobicContact CG-CD1 3.97Å; L545-L549 HydrophobicContact CG-CG 4.35Å; L545-L549 VanDerWaalsContact O-CG 3.29Å; L545-L549 WeakPolarHBondContact O-CG 3.5Å; L545-L549 PolarHBondContact O-N 3.44Å
546M85.1Confident82.1Confident4 Ų460.5 Ų60.52%0.0232%0.318CS..Hα-helixtrans-63.6-37179.7-67.5-60.812700112.4L500 Y504 Y542 N543 L549 F550L500-M546 HydrophobicContact CD2-SD 3.78Å; L500-M546 HydrophobicContact CG-SD 4.39Å; Y504-M546 HydrophobicContact CE1-CB 3.87Å; Y504-M546 HydrophobicContact CE2-CB 4.05Å; Y504-M546 VanDerWaalsContact CZ-CB 3.49Å; Y504-M546 VanDerWaalsContact OH-CB 3.31Å; Y504-M546 WeakPolarHBondContact OH-CB 3.47Å; Y542-M546 HydrophobicContact CD1-CG 4.27Å; Y542-M546 HydrophobicContact CD2-CE 4.26Å; Y542-M546 HydrophobicContact CE1-CE 4.38Å; Y542-M546 HydrophobicContact CE1-CG 3.9Å; Y542-M546 HydrophobicContact CE2-CE 3.59Å; Y542-M546 WeakPolarHBondContact O-CG 3.49Å; Y542-M546 PolarHBondContact O-N 3.41Å; N543-M546 PolarHBondContact O-N 2.88Å; N543-M546 VanDerWaalsContact O-N 3.12Å; M546-L549 HydrophobicContact CE-CD1 3.84Å; M546-L549 PolarHBondContact O-N 3.34Å; M546-L549 HydrophobicContact SD-CD1 4.27Å; M546-F550 VanDerWaalsContact O-CB 3.31Å; M546-F550 WeakPolarHBondContact O-CB 3.45Å; M546-F550 PolarHBondContact O-N 2.9Å
547E84.8Confident81.6Confident105 Ų10556.7 Ų56.749%0.49131%0.307SS..Hα-helixtrans-62.9-44.7172.5-71.7-177-178.500112.2N543 N544 L545 F550 S551N543-E547 PolarHBondContact O-N 2.94Å; N544-E547 PolarHBondContact O-N 3.23Å; L545-E547 VanDerWaalsContact C-N 3.32Å; L545-E547 PolarHBondContact O-N 3.36Å; E547-F550 PolarHBondContact O-N 3.14Å; E547-S551 WeakPolarHBondContact O-CB 3.46Å; E547-S551 PolarHBondContact O-N 3.37Å
548I84.8Confident80.7Confident38 Ų3857.6 Ų57.620%0.19532%0.317CS..Hα-helixtrans-60.4-50176.3-68.7168.1000109.9L421 N544 L545 F550 S551 L552 L562L421-I548 HydrophobicContact CD1-CD1 4.26Å; N544-I548 WeakPolarHBondContact O-CG1 3.49Å; N544-I548 PolarHBondContact O-N 3.49Å; L545-I548 PolarHBondContact O-N 3.1Å; I548-F550 VanDerWaalsContact C-N 3.33Å; I548-F550 PolarHBondContact O-N 3.41Å; I548-S551 PolarHBondContact O-N 2.82Å; I548-S551 PolarHBondContact O-OG 3.33Å; I548-L552 HydrophobicContact CG2-CD1 4Å; I548-L552 HydrophobicContact CG2-CG 4.42Å; I548-L552 WeakPolarHBondContact O-CG 3.28Å; I548-L552 PolarHBondContact O-N 2.98Å; I548-L562 HydrophobicContact CG2-CD2 4.03Å
549L85.2Confident79.6Confident0 Ų061.2 Ų61.20%034%0.336CS..Hα-helixtrans-61.3-41.2180-67.4173.7000112I492 A496 L500 L545 M546 L552 K553I492-L549 HydrophobicContact CG2-CD2 3.45Å; I492-L549 VanDerWaalsContact CG2-CD2 3.45Å; A496-L549 HydrophobicContact CB-CD1 4.01Å; A496-L549 HydrophobicContact CB-CD2 3.96Å; L500-L549 HydrophobicContact CD1-CB 3.48Å; L500-L549 VanDerWaalsContact CD1-CB 3.48Å; L500-L549 HydrophobicContact CD2-CB 3.96Å; L500-L549 HydrophobicContact CG-CB 3.76Å; L500-L549 HydrophobicContact CG-CD1 4.15Å; L545-L549 HydrophobicContact CD1-CD1 4.3Å; L545-L549 HydrophobicContact CD1-CG 4.29Å; L545-L549 HydrophobicContact CD2-CD1 4.49Å; L545-L549 HydrophobicContact CG-CD1 3.97Å; L545-L549 HydrophobicContact CG-CG 4.35Å; L545-L549 VanDerWaalsContact O-CG 3.29Å; L545-L549 WeakPolarHBondContact O-CG 3.5Å; L545-L549 PolarHBondContact O-N 3.44Å; M546-L549 HydrophobicContact CE-CD1 3.84Å; M546-L549 PolarHBondContact O-N 3.34Å; M546-L549 HydrophobicContact SD-CD1 4.27Å; L549-L552 PolarHBondContact O-N 3.17Å; L549-K553 PolarHBondContact O-N 2.94Å
550F83.5Confident78.9Confident58 Ų5857.8 Ų57.825%0.25432%0.316SS..Hα-helixtrans-61.1-46.8175.1-179.6-92000111.2Y504 P506 M546 E547 I548 L552 K553 E554Y504-F550 HydrophobicContact CD1-CB 4.2Å; Y504-F550 HydrophobicContact CD1-CD2 4.05Å; Y504-F550 HydrophobicContact CD1-CG 4.45Å; Y504-F550 HydrophobicContact CE1-CB 4.09Å; Y504-F550 WeakPolarHBondContact O-CE2 3.26Å; P506-F550 HydrophobicContact CG-CB 4.35Å; P506-F550 HydrophobicContact CG-CD1 3.57Å; P506-F550 HydrophobicContact CG-CD2 4.33Å; P506-F550 HydrophobicContact CG-CE1 3.91Å; P506-F550 HydrophobicContact CG-CG 3.81Å; P506-F550 HydrophobicContact CG-CZ 4.42Å; M546-F550 VanDerWaalsContact O-CB 3.31Å; M546-F550 WeakPolarHBondContact O-CB 3.45Å; M546-F550 PolarHBondContact O-N 2.9Å; E547-F550 PolarHBondContact O-N 3.14Å; I548-F550 VanDerWaalsContact C-N 3.33Å; I548-F550 PolarHBondContact O-N 3.41Å; F550-L552 VanDerWaalsContact C-N 3.29Å; F550-L552 PolarHBondContact O-N 3.22Å; F550-K553 PolarHBondContact O-N 3.35Å; F550-K553 VanDerWaalsContact O-N 3.17Å; F550-E554 WeakPolarHBondContact CE1-OE2 3.38Å; F550-E554 PolarHBondContact O-N 3.11Å
551S83.4Confident78.6Confident39 Ų3958.7 Ų58.727%0.27332%0.319SS..Hα-helixtrans-62.8-35.4179.278.40000113E547 I548 K555E547-S551 WeakPolarHBondContact O-CB 3.46Å; E547-S551 PolarHBondContact O-N 3.37Å; I548-S551 PolarHBondContact O-N 2.82Å; I548-S551 PolarHBondContact O-OG 3.33Å; S551-K555 WeakPolarHBondContact O-CB 3.5Å; S551-K555 WeakPolarHBondContact O-CG 3.26Å; S551-K555 PolarHBondContact O-N 3.08Å
552L83.8Confident78.8Confident4 Ų456.2 Ų56.22%0.02131%0.308CS..Hα-helixtrans-69.8-38.3175.4-70.2174.6000111.9I492 I548 L549 F550 G556 L562I492-L552 HydrophobicContact CG2-CD1 4Å; I548-L552 HydrophobicContact CG2-CD1 4Å; I548-L552 HydrophobicContact CG2-CG 4.42Å; I548-L552 WeakPolarHBondContact O-CG 3.28Å; I548-L552 PolarHBondContact O-N 2.98Å; L549-L552 PolarHBondContact O-N 3.17Å; F550-L552 VanDerWaalsContact C-N 3.29Å; F550-L552 PolarHBondContact O-N 3.22Å; L552-G556 PolarHBondContact O-N 3.42Å; L552-L562 HydrophobicContact CD1-CD1 4.24Å; L552-L562 HydrophobicContact CD2-CD1 4.03Å; L552-L562 HydrophobicContact CD2-CD2 4.23Å; L552-L562 HydrophobicContact CD2-CG 4.13Å
553K81.9Confident78.9Confident118 Ų11854.5 Ų54.551%0.51330%0.301SS..Hα-helixtrans-66.5-40.4176-169.3-178.5-177.9-177.90111.8L500 L549 F550L500-K553 HydrophobicContact CD1-CD 4.47Å; L549-K553 PolarHBondContact O-N 2.94Å; F550-K553 PolarHBondContact O-N 3.35Å; F550-K553 VanDerWaalsContact O-N 3.17Å
554E80.5Confident79.1Confident143 Ų14353.4 Ų53.467%0.66830%0.302SS*.Hα-helixtrans-75.9-44.8-177.8-169.3-178.3-168.900112.8F550F550-E554 WeakPolarHBondContact CE1-OE2 3.38Å; F550-E554 PolarHBondContact O-N 3.11Å
555K71.8Confident79.3Confident118 Ų11855.1 Ų55.151%0.51331%0.308SS..Hα-helixtrans-81.5-14.6-176-66178.6178.8178.90114S551S551-K555 WeakPolarHBondContact O-CB 3.5Å; S551-K555 WeakPolarHBondContact O-CG 3.26Å; S551-K555 PolarHBondContact O-N 3.08Å
556G68.4Low79.5Confident32 Ų3255.3 Ų55.333%0.3331%0.309SS..  trans74.7153-170.700000112.5L552 G558 N559L552-G556 PolarHBondContact O-N 3.42Å; G556-G558 PolarHBondContact O-N 3.34Å; G556-N559 PolarHBondContact O-N 2.97Å
557T66.8Low79.7Confident32 Ų3261 Ų6120%0.19633%0.33CS..THydrogen-bonded Turntrans-70.8-12.3-171.457.80000114.5N490 L493 S560N490-T557 WeakPolarHBondContact OD1-CB 3.38Å; N490-T557 WeakPolarHBondContact OD1-CG2 3.24Å; N490-T557 PolarHBondContact OD1-OG1 3.31Å; L493-T557 HydrophobicContact CD2-CG2 4.12Å; T557-S560 PolarHBondContact O-OG 3.17Å
558G58.9Low80Confident56 Ų5659.2 Ų59.258%0.57733%0.329SS*.THydrogen-bonded Turntrans-82.5-18.7175.300000115.1G556G556-G558 PolarHBondContact O-N 3.34Å
559N60.5Low80.3Confident126 Ų12658.7 Ų58.767%0.67433%0.331SS*.SBendtrans-115.617.6-177-68-24.3000112.7G556 S561G556-N559 PolarHBondContact O-N 2.97Å; N559-S561 PolarHBondContact O-N 3.35Å
560S69.4Low80.7Confident13 Ų1358.9 Ų58.99%0.09133%0.332CS..  trans-66.4131.7176.657.70000110.2E485 S489 T557E485-S560 VanDerWaalsContact CD-O 3.27Å; S489-S560 WeakPolarHBondContact OG-CB 3.24Å; S489-S560 PolarHBondContact OG-OG 3.39Å; T557-S560 PolarHBondContact O-OG 3.17Å
561S78.5Confident81Confident80 Ų8057.9 Ų57.956%0.55933%0.331SS*.  trans-105.141.7177.7660000111.8N559N559-S561 PolarHBondContact O-N 3.35Å
562L85.5Confident81.3Confident22 Ų2263.7 Ų63.712%0.11535%0.346CS..THydrogen-bonded Turntrans-70.5-35.2-175.4-65.4178.6000111.8L421 E485 L488 S489 I492 I548 L552L421-L562 HydrophobicContact CD1-CD2 4.12Å; L421-L562 HydrophobicContact CD2-CB 4.07Å; L421-L562 HydrophobicContact CD2-CD1 4.5Å; E485-L562 PolarHBondContact OE1-N 3.12Å; L488-L562 HydrophobicContact CD2-CD1 4.32Å; L488-L562 HydrophobicContact CG-CD1 4.39Å; S489-L562 WeakPolarHBondContact OG-CD1 3.38Å; I492-L562 HydrophobicContact CD1-CD1 3.99Å; I548-L562 HydrophobicContact CG2-CD2 4.03Å; L552-L562 HydrophobicContact CD1-CD1 4.24Å; L552-L562 HydrophobicContact CD2-CD1 4.03Å; L552-L562 HydrophobicContact CD2-CD2 4.23Å; L552-L562 HydrophobicContact CD2-CG 4.13Å
563L87.8Confident81.6Confident0 Ų063.6 Ų63.60%035%0.346CS..THydrogen-bonded Turntrans-114.428.7-177.6-59.9178.5000112.5L424 F428 F484 E485 L488 E565 P566 R567L424-L563 HydrophobicContact CB-CD2 4.44Å; F428-L563 HydrophobicContact CE2-CD1 4.26Å; F484-L563 HydrophobicContact CD1-CD1 3.67Å; F484-L563 HydrophobicContact CE1-CD1 3.83Å; E485-L563 HydrophobicContact CB-CD1 4.27Å; E485-L563 PolarHBondContact OE1-N 3.17Å; L488-L563 HydrophobicContact CD2-CD1 4.38Å; L563-E565 VanDerWaalsContact C-N 3.33Å; L563-E565 PolarHBondContact O-N 3.28Å; L563-P566 HydrophobicContact CB-CB 4.44Å; L563-P566 HydrophobicContact CB-CG 4.32Å; L563-P566 HydrophobicContact CD2-CG 4.26Å; L563-P566 VanDerWaalsContact O-CD 3.32Å; L563-P566 WeakPolarHBondContact O-CD 3.37Å; L563-R567 WeakPolarHBondContact O-CB 3.5Å; L563-R567 PolarHBondContact O-N 2.88Å
564A88.4Confident82.1Confident50 Ų5058 Ų5841%0.41332%0.322SS..Hα-helixtrans-57-41.7-179.100000113.5R567 S568A564-R567 PolarHBondContact O-N 3.44Å; A564-S568 WeakPolarHBondContact O-CB 3.32Å; A564-S568 PolarHBondContact O-N 2.9Å
565E89.4Confident82.5Confident120 Ų12054 Ų5456%0.56130%0.303SS*.Hα-helixtrans-61.6-58.1175.8-80.4164.9-159.300111.7K425 L563 R567 S568 A569K425-E565 WeakPolarHBondContact CD-OE2 3.14Å; K425-E565 WeakPolarHBondContact CE-OE2 3.29Å; K425-E565 VanDerWaalsContact NZ-CD 3.31Å; K425-E565 IonicContact NZ-OE1 3.55Å; K425-E565 PolarHBondContact NZ-OE1 3.45Å; K425-E565 IonicContact NZ-OE2 3.34Å; K425-E565 PolarHBondContact NZ-OE2 3.46Å; L563-E565 VanDerWaalsContact C-N 3.33Å; L563-E565 PolarHBondContact O-N 3.28Å; E565-R567 VanDerWaalsContact C-N 3.3Å; E565-R567 PolarHBondContact O-N 3.31Å; E565-S568 PolarHBondContact O-N 3.43Å; E565-S568 VanDerWaalsContact O-N 3.17Å; E565-S568 PolarHBondContact O-OG 3.48Å; E565-A569 PolarHBondContact O-N 3.15Å; E565-A569 VanDerWaalsContact O-N 3.08Å
566P90.8Very high83.3Confident4 Ų451.3 Ų51.33%0.02629%0.292CS..Hα-helixtrans-50.6-44.9171.6-31.534.5000114.3K425 F428 L563 S568 A569 L570K425-P566 HydrophobicContact CG-CG 4.19Å; F428-P566 HydrophobicContact CB-CB 3.78Å; F428-P566 HydrophobicContact CB-CG 4.07Å; F428-P566 HydrophobicContact CD1-CB 4.46Å; F428-P566 HydrophobicContact CD2-CB 4.07Å; F428-P566 HydrophobicContact CD2-CG 4.19Å; F428-P566 HydrophobicContact CG-CB 3.87Å; F428-P566 HydrophobicContact CG-CG 4.32Å; L563-P566 HydrophobicContact CB-CB 4.44Å; L563-P566 HydrophobicContact CB-CG 4.32Å; L563-P566 HydrophobicContact CD2-CG 4.26Å; L563-P566 VanDerWaalsContact O-CD 3.32Å; L563-P566 WeakPolarHBondContact O-CD 3.37Å; P566-S568 VanDerWaalsContact C-N 3.34Å; P566-S568 PolarHBondContact O-N 3.24Å; P566-A569 WeakPolarHBondContact O-CB 3.37Å; P566-A569 PolarHBondContact O-N 2.97Å; P566-A569 VanDerWaalsContact O-N 3.12Å; P566-L570 WeakPolarHBondContact O-CG 3.46Å; P566-L570 PolarHBondContact O-N 3.26Å
567R90.3Very high84.3Confident122 Ų12249.8 Ų49.846%0.4628%0.276SS..Hα-helixtrans-60.2-44.3179.4-173.3173.7-179.2152.70111.5L563 A564 E565 A569 L570 T571L563-R567 WeakPolarHBondContact O-CB 3.5Å; L563-R567 PolarHBondContact O-N 2.88Å; A564-R567 PolarHBondContact O-N 3.44Å; E565-R567 VanDerWaalsContact C-N 3.3Å; E565-R567 PolarHBondContact O-N 3.31Å; R567-A569 VanDerWaalsContact C-N 3.3Å; R567-A569 PolarHBondContact O-N 3.47Å; R567-L570 PolarHBondContact O-N 2.96Å; R567-T571 PolarHBondContact O-N 3.29Å; R567-T571 PolarHBondContact O-OG1 3.5Å; R567-T571 VanDerWaalsContact O-OG1 3.06Å
568S90.3Very high85.3Confident68 Ų6848.3 Ų48.348%0.47627%0.267SS..Hα-helixtrans-63.5-35.3176.277.40000112.8A564 E565 P566 T571 R572A564-S568 WeakPolarHBondContact O-CB 3.32Å; A564-S568 PolarHBondContact O-N 2.9Å; E565-S568 PolarHBondContact O-N 3.43Å; E565-S568 VanDerWaalsContact O-N 3.17Å; E565-S568 PolarHBondContact O-OG 3.48Å; P566-S568 VanDerWaalsContact C-N 3.34Å; P566-S568 PolarHBondContact O-N 3.24Å; S568-T571 PolarHBondContact O-N 3.41Å; S568-R572 PolarHBondContact O-N 3.37Å
569A91.9Very high86.6Confident28 Ų2849.9 Ų49.923%0.23126%0.26CS..Hα-helixtrans-69.5-41.3176.700000111.6V432 E565 P566 R567 R572 L573V432-A569 HydrophobicContact CG1-CB 4.26Å; V432-A569 HydrophobicContact CG2-CB 4.31Å; E565-A569 PolarHBondContact O-N 3.15Å; E565-A569 VanDerWaalsContact O-N 3.08Å; P566-A569 WeakPolarHBondContact O-CB 3.37Å; P566-A569 PolarHBondContact O-N 2.97Å; P566-A569 VanDerWaalsContact O-N 3.12Å; R567-A569 VanDerWaalsContact C-N 3.3Å; R567-A569 PolarHBondContact O-N 3.47Å; A569-R572 WeakPolarHBondContact O-CB 3.35Å; A569-R572 PolarHBondContact O-N 3.48Å; A569-L573 PolarHBondContact O-N 3.38Å
570L92Very high87.9Confident3 Ų344 Ų442%0.01623%0.228CC..Hα-helixtrans-63.8-39.5173-68.1173.4000111.9V432 L477 L478 C481 P566 R567 R572 L573 N574V432-L570 HydrophobicContact CG2-CD2 3.74Å; V432-L570 HydrophobicContact CG2-CG 4.33Å; L477-L570 HydrophobicContact CB-CD2 4.34Å; L477-L570 HydrophobicContact CD1-CD2 4.41Å; L477-L570 HydrophobicContact CD2-CD2 4.47Å; L478-L570 HydrophobicContact CD2-CB 3.77Å; C481-L570 HydrophobicContact CB-CD1 3.85Å; P566-L570 WeakPolarHBondContact O-CG 3.46Å; P566-L570 PolarHBondContact O-N 3.26Å; R567-L570 PolarHBondContact O-N 2.96Å; L570-R572 VanDerWaalsContact C-N 3.31Å; L570-R572 PolarHBondContact O-N 3.39Å; L570-L573 WeakPolarHBondContact O-CB 3.29Å; L570-L573 PolarHBondContact O-N 3.43Å; L570-N574 WeakPolarHBondContact O-CB 3.25Å; L570-N574 PolarHBondContact O-N 2.87Å
571T89.9Confident88.7Confident37 Ų3743.3 Ų43.323%0.22722%0.224CC..Hα-helixtrans-62.8-38.8173.5-55.70000111.7R567 S568 N574 Q575R567-T571 PolarHBondContact O-N 3.29Å; R567-T571 PolarHBondContact O-OG1 3.5Å; R567-T571 VanDerWaalsContact O-OG1 3.06Å; S568-T571 PolarHBondContact O-N 3.41Å; T571-N574 WeakPolarHBondContact O-CB 3.47Å; T571-N574 PolarHBondContact O-N 3.44Å; T571-Q575 WeakPolarHBondContact O-CG 3.45Å; T571-Q575 PolarHBondContact O-N 3.36Å
572R90.8Very high89.1Confident161 Ų16139.7 Ų39.761%0.60820%0.198SC*.Hα-helixtrans-65.6-40174.1-170.9-175.6-58.1179.43.4111.9S568 A569 L570 N574 Q575 Q576S568-R572 PolarHBondContact O-N 3.37Å; A569-R572 WeakPolarHBondContact O-CB 3.35Å; A569-R572 PolarHBondContact O-N 3.48Å; L570-R572 VanDerWaalsContact C-N 3.31Å; L570-R572 PolarHBondContact O-N 3.39Å; R572-N574 VanDerWaalsContact C-N 3.33Å; R572-Q575 WeakPolarHBondContact O-CB 3.45Å; R572-Q575 PolarHBondContact O-N 3.35Å; R572-Q576 WeakPolarHBondContact O-CG 3.3Å; R572-Q576 PolarHBondContact O-N 2.93Å
573L90.7Very high89.1Confident2 Ų240.1 Ų40.11%0.0120%0.2CC..Hα-helixtrans-61.6-43.9175.4-174.371.1000111.3F435 L477 A569 L570 Q575 Q576 A577F435-L573 HydrophobicContact CB-CD1 4.31Å; F435-L573 HydrophobicContact CB-CD2 4.01Å; F435-L573 HydrophobicContact CD1-CD1 3.69Å; F435-L573 HydrophobicContact CD1-CD2 3.59Å; F435-L573 HydrophobicContact CD1-CG 3.92Å; F435-L573 HydrophobicContact CD2-CD2 4.14Å; F435-L573 HydrophobicContact CE1-CD1 4.38Å; F435-L573 HydrophobicContact CE1-CD2 4.01Å; F435-L573 HydrophobicContact CE1-CG 4.25Å; F435-L573 HydrophobicContact CG-CD1 4.27Å; F435-L573 HydrophobicContact CG-CD2 3.65Å; F435-L573 HydrophobicContact CG-CG 4.43Å; F435-L573 HydrophobicContact CZ-CD2 4.46Å; L477-L573 HydrophobicContact CD1-CD2 4.49Å; A569-L573 PolarHBondContact O-N 3.38Å; L570-L573 WeakPolarHBondContact O-CB 3.29Å; L570-L573 PolarHBondContact O-N 3.43Å; L573-Q575 VanDerWaalsContact C-N 3.3Å; L573-Q575 PolarHBondContact O-N 3.2Å; L573-Q576 WeakPolarHBondContact O-CB 3.3Å; L573-Q576 PolarHBondContact O-N 3.01Å; L573-Q576 VanDerWaalsContact O-N 3.09Å; L573-A577 PolarHBondContact O-N 2.92Å
574N90.6Very high88.9Confident0 Ų040.7 Ų40.70%020%0.204CC..Hα-helixtrans-59-40.3173.4-176.733.4000111.9C474 L478 L570 T571 R572 Q576 A577 N578 A654 G658C474-N574 HydrophobicContact CB-CB 3.89Å; L478-N574 HydrophobicContact CD1-CB 4.36Å; L570-N574 WeakPolarHBondContact O-CB 3.25Å; L570-N574 PolarHBondContact O-N 2.87Å; T571-N574 WeakPolarHBondContact O-CB 3.47Å; T571-N574 PolarHBondContact O-N 3.44Å; R572-N574 VanDerWaalsContact C-N 3.33Å; N574-Q576 VanDerWaalsContact C-N 3.33Å; N574-Q576 PolarHBondContact O-N 3.46Å; N574-A577 PolarHBondContact O-N 3Å; N574-N578 PolarHBondContact O-N 3.45Å; N574-N578 PolarHBondContact O-ND2 3.24Å; N574-N578 PolarHBondContact OD1-ND2 3.08Å; N574-A654 PolarHBondContact ND2-O 3.28Å; N574-G658 PolarHBondContact ND2-N 2.88Å
575Q89Confident88.7Confident60 Ų6038.3 Ų38.328%0.2819%0.185SC..Hα-helixtrans-61.6-39.9173.6-71166.96.300112.4T571 R572 L573 N578 Q579 K659T571-Q575 WeakPolarHBondContact O-CG 3.45Å; T571-Q575 PolarHBondContact O-N 3.36Å; R572-Q575 WeakPolarHBondContact O-CB 3.45Å; R572-Q575 PolarHBondContact O-N 3.35Å; L573-Q575 VanDerWaalsContact C-N 3.3Å; L573-Q575 PolarHBondContact O-N 3.2Å; Q575-N578 PolarHBondContact O-N 3.39Å; Q575-Q579 WeakPolarHBondContact O-CB 3.42Å; Q575-Q579 PolarHBondContact O-N 3.32Å; Q575-K659 HydrophobicContact CG-CB 4.32Å
576Q89.1Confident88.4Confident61 Ų6133.6 Ų33.629%0.28516%0.162SC..Hα-helixtrans-64.8-38.9175.2-65177.4-16.700111.9S436 L439 R572 L573 N574 Q579 L580S436-Q576 PolarHBondContact OG-OE1 2.61Å; L439-Q576 HydrophobicContact CD2-CB 3.43Å; L439-Q576 VanDerWaalsContact CD2-CB 3.43Å; R572-Q576 WeakPolarHBondContact O-CG 3.3Å; R572-Q576 PolarHBondContact O-N 2.93Å; L573-Q576 WeakPolarHBondContact O-CB 3.3Å; L573-Q576 PolarHBondContact O-N 3.01Å; L573-Q576 VanDerWaalsContact O-N 3.09Å; N574-Q576 VanDerWaalsContact C-N 3.33Å; N574-Q576 PolarHBondContact O-N 3.46Å; Q576-Q579 PolarHBondContact O-N 3.39Å; Q576-L580 PolarHBondContact O-N 3.49Å
577A89.6Confident88Confident0 Ų034.7 Ų34.70%017%0.168CC..Hα-helixtrans-65.9-42.1175.400000112I470 I471 L573 N574 Q579 L580 A581I470-A577 HydrophobicContact CG2-CB 3.86Å; I471-A577 HydrophobicContact CG1-CB 4.02Å; L573-A577 PolarHBondContact O-N 2.92Å; N574-A577 PolarHBondContact O-N 3Å; A577-Q579 VanDerWaalsContact C-N 3.32Å; A577-Q579 PolarHBondContact O-N 3.45Å; A577-L580 WeakPolarHBondContact O-CB 3.44Å; A577-L580 PolarHBondContact O-N 3.46Å; A577-A581 PolarHBondContact O-N 2.72Å
578N87.1Confident87.4Confident1 Ų130.9 Ų30.91%0.00516%0.155CC..Hα-helixtrans-61.5-40.4172.6-80.5-83.1000111.6N574 Q575 A581 F582 L660 W680N574-N578 PolarHBondContact O-N 3.45Å; N574-N578 PolarHBondContact O-ND2 3.24Å; N574-N578 PolarHBondContact OD1-ND2 3.08Å; Q575-N578 PolarHBondContact O-N 3.39Å; N578-A581 PolarHBondContact O-N 3.06Å; N578-F582 WeakPolarHBondContact O-CB 3.26Å; N578-F582 PolarHBondContact O-N 3.19Å; N578-L660 HydrophobicContact CB-CD2 4.09Å; N578-W680 HydrophobicContact CB-CZ2 4.47Å; N578-W680 WeakPolarHBondContact O-CH2 3.47Å; N578-W680 WeakPolarHBondContact OD1-CZ2 3.33Å
579Q87.2Confident86.8Confident89 Ų8927.7 Ų27.742%0.41613%0.133SC..Hα-helixtrans-65.8-39.8175.2-172.3176.44.600112.3Q575 Q576 A577 F582 D583Q575-Q579 WeakPolarHBondContact O-CB 3.42Å; Q575-Q579 PolarHBondContact O-N 3.32Å; Q576-Q579 PolarHBondContact O-N 3.39Å; A577-Q579 VanDerWaalsContact C-N 3.32Å; A577-Q579 PolarHBondContact O-N 3.45Å; Q579-F582 PolarHBondContact O-N 3.24Å; Q579-D583 WeakPolarHBondContact O-CB 3.46Å; Q579-D583 PolarHBondContact O-N 3.43Å
580L86.8Confident86.1Confident2 Ų231.3 Ų31.31%0.0114%0.143CC..Hα-helixtrans-60-47.7174.5-177.9104.4000111.4L439 I442 R443 L448 S467 I470 Q576 A577 D583 S584L439-L580 HydrophobicContact CD1-CD1 4.45Å; L439-L580 HydrophobicContact CD1-CD2 3.98Å; I442-L580 HydrophobicContact CG2-CD2 4.37Å; R443-L580 HydrophobicContact CB-CD1 3.56Å; R443-L580 HydrophobicContact CG-CD1 3.99Å; L448-L580 HydrophobicContact CD1-CD1 4.19Å; L448-L580 HydrophobicContact CD1-CG 4.43Å; S467-L580 WeakPolarHBondContact OG-CD2 3.34Å; I470-L580 HydrophobicContact CD1-CD2 4.06Å; Q576-L580 PolarHBondContact O-N 3.49Å; A577-L580 WeakPolarHBondContact O-CB 3.44Å; A577-L580 PolarHBondContact O-N 3.46Å; L580-D583 PolarHBondContact O-N 3.36Å; L580-S584 WeakPolarHBondContact O-CB 3.24Å; L580-S584 PolarHBondContact O-N 3.17Å
581A87.3Confident85.5Confident0 Ų033.2 Ų33.20%015%0.152CC..Hα-helixtrans-60.1-45.4175.700000111.6F464 S467 I471 A577 N578 S584 V585 W680F464-A581 HydrophobicContact CD2-CB 4.39Å; F464-A581 HydrophobicContact CE2-CB 4.28Å; S467-A581 VanDerWaalsContact CB-CA 3.5Å; I471-A581 HydrophobicContact CD1-CB 3.66Å; A577-A581 PolarHBondContact O-N 2.72Å; N578-A581 PolarHBondContact O-N 3.06Å; A581-S584 PolarHBondContact O-N 2.73Å; A581-S584 PolarHBondContact O-OG 3.28Å; A581-V585 PolarHBondContact O-N 3.31Å; A581-W680 HydrophobicContact CB-CH2 3.61Å; A581-W680 HydrophobicContact CB-CZ2 4.36Å; A581-W680 HydrophobicContact CB-CZ3 4.38Å
582F86.4Confident84.6Confident4 Ų432.2 Ų32.22%0.01815%0.145CC..Hα-helixtrans-59.7-50.5176-179.1-86.5000112.1N578 Q579 S584 V585 F586 P661 F662 W680 S683 I684 A687N578-F582 WeakPolarHBondContact O-CB 3.26Å; N578-F582 PolarHBondContact O-N 3.19Å; Q579-F582 PolarHBondContact O-N 3.24Å; F582-S584 PolarHBondContact O-N 3.06Å; F582-V585 PolarHBondContact O-N 3.13Å; F582-F586 HydrophobicContact CD1-CB 4.18Å; F582-F586 HydrophobicContact CE1-CB 3.82Å; F582-F586 HydrophobicContact CE1-CD1 4.19Å; F582-F586 HydrophobicContact CE1-CD2 4.42Å; F582-F586 AromaticContact CE1-CG 3.87Å; F582-F586 HydrophobicContact CE1-CG 3.87Å; F582-F586 HydrophobicContact CZ-CB 4.28Å; F582-F586 HydrophobicContact CZ-CD2 4.23Å; F582-F586 HydrophobicContact CZ-CG 4.14Å; F582-F586 VanDerWaalsContact O-CB 3.26Å; F582-F586 WeakPolarHBondContact O-CB 3.28Å; F582-F586 PolarHBondContact O-N 3.2Å; F582-P661 HydrophobicContact CB-CG 4.38Å; F582-P661 HydrophobicContact CD1-CB 4.29Å; F582-P661 HydrophobicContact CD1-CG 3.78Å; F582-P661 HydrophobicContact CD2-CG 4.36Å; F582-P661 HydrophobicContact CE1-CB 4.15Å; F582-P661 HydrophobicContact CE1-CG 4.15Å; F582-P661 HydrophobicContact CG-CG 3.9Å; F582-P661 HydrophobicContact CZ-CB 4.3Å; F582-F662 HydrophobicContact CZ-CD2 4.47Å; F582-W680 HydrophobicContact CB-CH2 4.28Å; F582-W680 HydrophobicContact CB-CZ3 4Å; F582-W680 HydrophobicContact CD2-CZ3 4.38Å; F582-S683 WeakPolarHBondContact CE2-OG 3Å; F582-I684 HydrophobicContact CD2-CG1 3.97Å; F582-I684 HydrophobicContact CE2-CG1 3.75Å; F582-A687 HydrophobicContact CE1-CB 4.49Å; F582-A687 HydrophobicContact CE2-CB 4.33Å; F582-A687 HydrophobicContact CZ-CB 3.55Å
583D85.6Confident83.8Confident31 Ų3124.7 Ų24.717%0.16612%0.117CC..Hα-helixtrans-60.4-35180-71.3-22.3000111.2R443 Q579 L580 V585 F586 L587R443-D583 IonicContact CZ-OD2 3.83Å; R443-D583 IonicContact NH1-OD2 2.74Å; R443-D583 PolarHBondContact NH1-OD2 3.02Å; R443-D583 IonicContact NH2-OD2 2.64Å; R443-D583 PolarHBondContact NH2-OD2 2.96Å; Q579-D583 WeakPolarHBondContact O-CB 3.46Å; Q579-D583 PolarHBondContact O-N 3.43Å; L580-D583 PolarHBondContact O-N 3.36Å; D583-V585 PolarHBondContact O-N 2.96Å; D583-F586 PolarHBondContact O-N 2.99Å; D583-L587 VanDerWaalsContact O-CB 3.26Å; D583-L587 WeakPolarHBondContact O-CB 3.41Å; D583-L587 PolarHBondContact O-N 2.93Å
584S83.5Confident83Confident12 Ų1226.9 Ų26.98%0.08413%0.132CC..Hα-helixtrans-63.6-39178.577.30000113.9F464 L580 A581 F582F464-S584 WeakPolarHBondContact CA-OG 3.48Å; L580-S584 WeakPolarHBondContact O-CB 3.24Å; L580-S584 PolarHBondContact O-N 3.17Å; A581-S584 PolarHBondContact O-N 2.73Å; A581-S584 PolarHBondContact O-OG 3.28Å; F582-S584 PolarHBondContact O-N 3.06Å
585V83.9Confident82.1Confident0 Ų030.7 Ų30.70%015%0.151CC..Hα-helixtrans-78.9-42.5176-179.50000110.3W461 F464 A581 F582 D583 L587 Y632 L636 I684W461-V585 HydrophobicContact CZ3-CG1 4.47Å; W461-V585 HydrophobicContact CZ3-CG2 4.12Å; F464-V585 HydrophobicContact CB-CG2 4.19Å; F464-V585 HydrophobicContact CD1-CG2 4.49Å; F464-V585 HydrophobicContact CD2-CG2 3.22Å; F464-V585 HydrophobicContact CE2-CG2 3.59Å; F464-V585 HydrophobicContact CG-CG2 3.72Å; F464-V585 HydrophobicContact CZ-CG2 4.37Å; A581-V585 PolarHBondContact O-N 3.31Å; F582-V585 PolarHBondContact O-N 3.13Å; D583-V585 PolarHBondContact O-N 2.96Å; V585-L587 PolarHBondContact O-N 3.2Å; V585-Y632 HydrophobicContact CG1-CE1 3.85Å; V585-L636 HydrophobicContact CG1-CD1 4.07Å; V585-L636 HydrophobicContact CG1-CD2 4.45Å; V585-L636 HydrophobicContact CG2-CD1 4.4Å; V585-I684 HydrophobicContact CB-CD1 4.47Å; V585-I684 HydrophobicContact CG1-CD1 4.1Å
586F83.6Confident81.1Confident21 Ų2128 Ų289%0.09214%0.139CC..Hα-helixtrans-72.6-27.8-171.9-165.6-110.3000113.6F582 D583 Q588 I589 K590 A687 T691F582-F586 HydrophobicContact CD1-CB 4.18Å; F582-F586 HydrophobicContact CE1-CB 3.82Å; F582-F586 HydrophobicContact CE1-CD1 4.19Å; F582-F586 HydrophobicContact CE1-CD2 4.42Å; F582-F586 AromaticContact CE1-CG 3.87Å; F582-F586 HydrophobicContact CE1-CG 3.87Å; F582-F586 HydrophobicContact CZ-CB 4.28Å; F582-F586 HydrophobicContact CZ-CD2 4.23Å; F582-F586 HydrophobicContact CZ-CG 4.14Å; F582-F586 VanDerWaalsContact O-CB 3.26Å; F582-F586 WeakPolarHBondContact O-CB 3.28Å; F582-F586 PolarHBondContact O-N 3.2Å; D583-F586 PolarHBondContact O-N 2.99Å; F586-Q588 VanDerWaalsContact C-N 3.32Å; F586-Q588 PolarHBondContact O-N 2.96Å; F586-I589 HydrophobicContact CD2-CB 4.43Å; F586-I589 HydrophobicContact CD2-CD1 4.37Å; F586-I589 HydrophobicContact CE2-CB 4.49Å; F586-I589 HydrophobicContact CE2-CG2 4.27Å; F586-I589 WeakPolarHBondContact O-CB 3.32Å; F586-I589 PolarHBondContact O-N 3.03Å; F586-K590 HydrophobicContact CE1-CB 4.33Å; F586-K590 WeakPolarHBondContact O-CB 3.46Å; F586-K590 PolarHBondContact O-N 3.05Å; F586-A687 HydrophobicContact CD2-CB 4.13Å; F586-A687 HydrophobicContact CE2-CB 3.67Å; F586-A687 HydrophobicContact CZ-CB 4Å; F586-A687 WeakPolarHBondContact CZ-O 3.36Å; F586-T691 HydrophobicContact CZ-CG2 4.27Å; F586-T691 VanDerWaalsContact CZ-OG1 3.28Å; F586-T691 WeakPolarHBondContact CZ-OG1 3.45Å
587L81.9Confident79.8Confident27 Ų2727.1 Ų27.114%0.14114%0.14CC..Hα-helixtrans-57.7-42.3-179.7-176.466.9000112.8L448 D583 V585 I589 K590 H591L448-L587 HydrophobicContact CD2-CB 4.48Å; L448-L587 HydrophobicContact CD2-CD2 3.75Å; D583-L587 VanDerWaalsContact O-CB 3.26Å; D583-L587 WeakPolarHBondContact O-CB 3.41Å; D583-L587 PolarHBondContact O-N 2.93Å; V585-L587 PolarHBondContact O-N 3.2Å; L587-I589 VanDerWaalsContact C-N 3.33Å; L587-I589 PolarHBondContact O-N 3.48Å; L587-K590 PolarHBondContact O-N 2.86Å; L587-H591 PolarHBondContact O-N 2.99Å
588Q77.4Confident78.5Confident42 Ų4232.6 Ų32.620%0.19616%0.164CC..Hα-helixtrans-64.9-40.1179.7-63.6-57.7-23.600111.6F457 F586 H591 Q592 Y632F457-Q588 HydrophobicContact CE2-CB 4.22Å; F586-Q588 VanDerWaalsContact C-N 3.32Å; F586-Q588 PolarHBondContact O-N 2.96Å; Q588-H591 PolarHBondContact O-N 3.16Å; Q588-Q592 WeakPolarHBondContact O-CG 3.26Å; Q588-Q592 PolarHBondContact O-N 2.9Å; Q588-Y632 HydrophobicContact CB-CE1 4.38Å
589I77.7Confident77Confident0 Ų035.7 Ų35.70%018%0.179CC..Hα-helixtrans-64.3-46.4175.2-59.4174.1000109.8F586 L587 H591 Q592 L593 I629 Y632 L633 I684 T688F586-I589 HydrophobicContact CD2-CB 4.43Å; F586-I589 HydrophobicContact CD2-CD1 4.37Å; F586-I589 HydrophobicContact CE2-CB 4.49Å; F586-I589 HydrophobicContact CE2-CG2 4.27Å; F586-I589 WeakPolarHBondContact O-CB 3.32Å; F586-I589 PolarHBondContact O-N 3.03Å; L587-I589 VanDerWaalsContact C-N 3.33Å; L587-I589 PolarHBondContact O-N 3.48Å; I589-H591 VanDerWaalsContact C-N 3.35Å; I589-H591 PolarHBondContact O-N 2.69Å; I589-Q592 PolarHBondContact O-N 3.1Å; I589-L593 HydrophobicContact CG2-CD1 3.84Å; I589-L593 HydrophobicContact CG2-CG 4.27Å; I589-L593 VanDerWaalsContact O-CG 3.3Å; I589-L593 WeakPolarHBondContact O-CG 3.39Å; I589-L593 PolarHBondContact O-N 3.16Å; I589-I629 HydrophobicContact CG2-CD1 4.48Å; I589-I629 HydrophobicContact CG2-CG1 4.48Å; I589-I629 HydrophobicContact CG2-CG2 4.3Å; I589-Y632 HydrophobicContact CD1-CD1 4.23Å; I589-Y632 HydrophobicContact CD1-CE1 4.27Å; I589-Y632 HydrophobicContact CG1-CD1 3.89Å; I589-Y632 HydrophobicContact CG1-CE1 4.03Å; I589-L633 HydrophobicContact CD1-CD2 3.76Å; I589-L633 HydrophobicContact CD1-CG 4.4Å; I589-I684 HydrophobicContact CD1-CG2 4.03Å; I589-T688 HydrophobicContact CG2-CG2 3.64Å
590K78.3Confident75.2Confident104 Ų10434.7 Ų34.745%0.45217%0.174SC..Hα-helixtrans-60-42.1178.4-171.9179.3180-1790112.2F586 L587 Q592 L593 C594F586-K590 HydrophobicContact CE1-CB 4.33Å; F586-K590 WeakPolarHBondContact O-CB 3.46Å; F586-K590 PolarHBondContact O-N 3.05Å; L587-K590 PolarHBondContact O-N 2.86Å; K590-Q592 PolarHBondContact O-N 3.18Å; K590-L593 PolarHBondContact O-N 3.38Å; K590-C594 WeakPolarHBondContact O-CB 3.48Å; K590-C594 PolarHBondContact O-N 3.44Å; K590-C594 PolarHBondContact O-SG 3.19Å
591H78.3Confident73.3Confident44 Ų4438.8 Ų38.820%0.20420%0.203CC..Hα-helixtrans-60.8-43.8176.2-73.7169.8000112.5L587 Q588 I589 C594L587-H591 PolarHBondContact O-N 2.99Å; Q588-H591 PolarHBondContact O-N 3.16Å; I589-H591 VanDerWaalsContact C-N 3.35Å; I589-H591 PolarHBondContact O-N 2.69Å; H591-C594 PolarHBondContact O-N 3.27Å
592Q72.5Confident71.2Confident16 Ų1646 Ų468%0.07524%0.237CC..Hα-helixtrans-66-41.6176.5-67.8-61.1-43.600112F457 Q588 I589 K590 C594 L595 I629F457-Q592 HydrophobicContact CD2-CG 3.7Å; F457-Q592 HydrophobicContact CE2-CG 3.99Å; Q588-Q592 WeakPolarHBondContact O-CG 3.26Å; Q588-Q592 PolarHBondContact O-N 2.9Å; I589-Q592 PolarHBondContact O-N 3.1Å; K590-Q592 PolarHBondContact O-N 3.18Å; Q592-C594 VanDerWaalsContact C-N 3.35Å; Q592-C594 PolarHBondContact O-N 3.04Å; Q592-L595 WeakPolarHBondContact O-CB 3.46Å; Q592-L595 PolarHBondContact O-N 2.82Å; Q592-I629 HydrophobicContact CB-CD1 3.8Å; Q592-I629 HydrophobicContact CB-CG1 3.78Å; Q592-I629 HydrophobicContact CG-CG1 4.34Å
593L74.2Confident69.1Low3 Ų351.6 Ų51.62%0.01627%0.267CS..Hα-helixtrans-67.8-31.7177.5-68.2178.3000113I589 K590 L595 V596 I629 T688 T691 Y692I589-L593 HydrophobicContact CG2-CD1 3.84Å; I589-L593 HydrophobicContact CG2-CG 4.27Å; I589-L593 VanDerWaalsContact O-CG 3.3Å; I589-L593 WeakPolarHBondContact O-CG 3.39Å; I589-L593 PolarHBondContact O-N 3.16Å; K590-L593 PolarHBondContact O-N 3.38Å; L593-L595 PolarHBondContact O-N 3.15Å; L593-V596 VanDerWaalsContact O-CB 3.29Å; L593-V596 WeakPolarHBondContact O-CB 3.47Å; L593-V596 WeakPolarHBondContact O-CG2 3.14Å; L593-V596 PolarHBondContact O-N 2.92Å; L593-I629 HydrophobicContact CD2-CD1 3.48Å; L593-I629 VanDerWaalsContact CD2-CD1 3.48Å; L593-I629 HydrophobicContact CG-CD1 3.74Å; L593-T688 HydrophobicContact CD1-CG2 4.47Å; L593-T691 HydrophobicContact CD1-CG2 3.81Å; L593-Y692 HydrophobicContact CD2-CD2 3.51Å; L593-Y692 HydrophobicContact CD2-CE2 4.27Å; L593-Y692 HydrophobicContact CD2-CG 4.05Å
594C73.5Confident67.1Low48 Ų4854.3 Ų54.332%0.32429%0.293SS..Hα-helixtrans-63.9-26.2174-77.30000113.1K590 H591 Q592 V596 S597K590-C594 WeakPolarHBondContact O-CB 3.48Å; K590-C594 PolarHBondContact O-N 3.44Å; K590-C594 PolarHBondContact O-SG 3.19Å; H591-C594 PolarHBondContact O-N 3.27Å; Q592-C594 VanDerWaalsContact C-N 3.35Å; Q592-C594 PolarHBondContact O-N 3.04Å; C594-V596 VanDerWaalsContact C-N 3.26Å; C594-V596 PolarHBondContact O-N 3.14Å; C594-S597 PolarHBondContact O-N 3.46Å; C594-S597 PolarHBondContact O-OG 2.97Å
595L70.4Confident65.1Low79 Ų7959 Ų5941%0.41433%0.326SS..Hα-helixtrans-65.6-30.5176.2-61.3172.9000111.9Q592 L593 S597 K598 M599Q592-L595 WeakPolarHBondContact O-CB 3.46Å; Q592-L595 PolarHBondContact O-N 2.82Å; L593-L595 PolarHBondContact O-N 3.15Å; L595-S597 VanDerWaalsContact C-N 3.34Å; L595-S597 PolarHBondContact O-N 3.35Å; L595-K598 PolarHBondContact O-N 3.33Å; L595-K598 VanDerWaalsContact O-N 3.13Å; L595-M599 PolarHBondContact O-N 2.88Å
596V68.7Low62.9Low5 Ų562.9 Ų62.93%0.0336%0.358CS..Hα-helixtrans-60.6-42.5177.7-175.70000111.5L593 C594 K598 M599 Y625 I699L593-V596 VanDerWaalsContact O-CB 3.29Å; L593-V596 WeakPolarHBondContact O-CB 3.47Å; L593-V596 WeakPolarHBondContact O-CG2 3.14Å; L593-V596 PolarHBondContact O-N 2.92Å; C594-V596 VanDerWaalsContact C-N 3.26Å; C594-V596 PolarHBondContact O-N 3.14Å; V596-K598 PolarHBondContact O-N 2.91Å; V596-M599 WeakPolarHBondContact O-CB 3.29Å; V596-M599 PolarHBondContact O-N 3.08Å; V596-Y625 HydrophobicContact CG2-CD1 4.18Å; V596-Y625 HydrophobicContact CG2-CD2 3.46Å; V596-Y625 VanDerWaalsContact CG2-CD2 3.46Å; V596-Y625 HydrophobicContact CG2-CE1 4.04Å; V596-Y625 HydrophobicContact CG2-CE2 3.32Å; V596-Y625 HydrophobicContact CG2-CG 3.92Å; V596-I699 HydrophobicContact CG1-CD1 4.29Å
597S61.9Low60.9Low42 Ų4268.6 Ų68.629%0.29439%0.388SS..Hα-helixtrans-67.5-19.5178.968.50000114C594 L595C594-S597 PolarHBondContact O-N 3.46Å; C594-S597 PolarHBondContact O-OG 2.97Å; L595-S597 VanDerWaalsContact C-N 3.34Å; L595-S597 PolarHBondContact O-N 3.35Å
598K62Low58.7Low115 Ų11570.4 Ų70.450%0.541%0.414SS..THydrogen-bonded Turntrans-97.3-4.8-178-64.9-179.3-178.7177.30113.4L595 V596 E600 S601L595-K598 PolarHBondContact O-N 3.33Å; L595-K598 VanDerWaalsContact O-N 3.13Å; V596-K598 PolarHBondContact O-N 2.91Å; K598-E600 PolarHBondContact O-N 3.25Å; K598-S601 PolarHBondContact O-N 3.01Å; K598-S601 VanDerWaalsContact O-N 3.08Å; K598-S601 PolarHBondContact O-OG 3.28Å
599M56Low57Low66 Ų6678.2 Ų78.233%0.32545%0.45SS..Hα-helixtrans-64.1-35.1-163.1-148.3159-150.300114.4L595 V596 S601 Q623 Y625L595-M599 PolarHBondContact O-N 2.88Å; V596-M599 WeakPolarHBondContact O-CB 3.29Å; V596-M599 PolarHBondContact O-N 3.08Å; M599-S601 VanDerWaalsContact C-N 3.31Å; M599-S601 PolarHBondContact O-N 2.91Å; M599-Q623 HydrophobicContact CE-CG 4.39Å; M599-Q623 PolarHBondContact SD-OE1 3.11Å; M599-Y625 HydrophobicContact CE-CD1 4.29Å
600E50Low54.9Low67 Ų6782.2 Ų82.231%0.31348%0.478SS..Hα-helixtrans-76.6-13.7177.7-73.1-163.6160.600114.1K598 S703 S706K598-E600 PolarHBondContact O-N 3.25Å; E600-S703 PolarHBondContact OE1-N 2.95Å; E600-S706 PolarHBondContact OE1-OG 3.3Å
601S47Very low53.1Low88 Ų8888.1 Ų88.162%0.61550%0.499SS*.Hα-helixtrans-81.3-20.3-177.866.30000114.2K598 M599K598-S601 PolarHBondContact O-N 3.01Å; K598-S601 VanDerWaalsContact O-N 3.08Å; K598-S601 PolarHBondContact O-OG 3.28Å; M599-S601 VanDerWaalsContact C-N 3.31Å; M599-S601 PolarHBondContact O-N 2.91Å
602Q41.5Very low51.3Low153 Ų15391.3 Ų91.372%0.71552%0.522SS*.Hα-helixtrans-92.5-37.1179.3-73.6-177-25.700112.6S605Q602-S605 PolarHBondContact O-N 2.94Å
603D44.1Very low49.8Very low120 Ų12099.8 Ų99.864%0.64256%0.562SS**Hα-helixtrans-76.8-23.3-178.3-75.6-26.8000113.7S605D603-S605 VanDerWaalsContact C-N 3.27Å; D603-S605 PolarHBondContact O-N 3.01Å
604A42.5Very low48.1Very low88 Ų88107.5 Ų107.573%0.72760%0.603SS**THydrogen-bonded Turntrans-72.7-16176.300000113.9
605S40.9Very low46.5Very low111 Ų111111.4 Ų111.478%0.77662%0.62SS**THydrogen-bonded Turntrans-107.3-3.9-175.4-162.70000114.6Q602 D603Q602-S605 PolarHBondContact O-N 2.94Å; D603-S605 VanDerWaalsContact C-N 3.27Å; D603-S605 PolarHBondContact O-N 3.01Å
606A39.4Very low44.9Very low81 Ų81112.5 Ų112.567%0.66963%0.632SS**SBendtrans-111.7-2.4-173.300000115.5
607I40.7Very low43.7Very low141 Ų141116.8 Ų116.872%0.72366%0.658SS**  trans-122.295.1174.5-55.8179.4000108.6
608G35Very low42.7Very low66 Ų66123.7 Ų123.768%0.6868%0.683SS**  trans-54146.5162.900000110.8S610G608-S610 PolarHBondContact O-N 3.38Å; G608-S610 VanDerWaalsContact O-N 3.08Å
609E43.3Very low42.1Very low205 Ų205123.3 Ų123.396%0.95870%0.695SS**SBendtrans-30.6107.6169.5-62.8174149.200113.1
610S32.3Very low42.2Very low85 Ų85122.5 Ų122.559%0.59469%0.692SS**  trans-174.9101.5154.6170.30000111.5G608 T612G608-S610 PolarHBondContact O-N 3.38Å; G608-S610 VanDerWaalsContact O-N 3.08Å; S610-T612 PolarHBondContact O-N 3.31Å
611Y40.5Very low42.9Very low227 Ų227123.2 Ų123.289%0.8970%0.704SS**  trans28.682.1142.1-60.1-81.4000118.6
612T41.1Very low43.7Very low111 Ų111120.9 Ų120.968%0.68169%0.687SS**  trans-152.171.5152.755.60000110.5S610 L615S610-T612 PolarHBondContact O-N 3.31Å; T612-L615 HydrophobicContact CG2-CD1 4.01Å
613E39.8Very low45.1Very low195 Ų195116.1 Ų116.191%0.91167%0.665SS**SBendtrans-88.1-5.9172.1-103.7-175.8164.200114
614D38.8Very low46.5Very low165 Ų165117.4 Ų117.488%0.88267%0.667SS**  trans-136.371-177.9-81.7-39.5000113
615L40.8Very low47.9Very low129 Ų129113.7 Ų113.768%0.67563%0.634SS**  trans-119.3131.6159.4-92.2136.9000108.8T612 T617T612-L615 HydrophobicContact CG2-CD1 4.01Å; L615-T617 PolarHBondContact O-N 3.44Å; L615-T617 VanDerWaalsContact O-N 3.07Å
616P37.3Very low49.4Very low102 Ų102108.5 Ų108.566%0.66260%0.598SS**  trans-65.3114.1176.227.2-30.7000108.1F618P616-F618 PolarHBondContact O-N 3.44Å
617T42.2Very low51Low96 Ų96106.6 Ų106.659%0.58958%0.578SS**  trans-68.699.3176.8-60000107.8L615 S619 L620L615-T617 PolarHBondContact O-N 3.44Å; L615-T617 VanDerWaalsContact O-N 3.07Å; T617-S619 PolarHBondContact O-N 3.1Å; T617-L620 HydrophobicContact CG2-CD2 4.3Å
618F41.9Very low52.7Low186 Ų186101.1 Ų101.182%0.81655%0.55SS**  trans-55.2124.5171.5-84.3-96.5000109P616P616-F618 PolarHBondContact O-N 3.44Å
619S49.3Very low54.5Low108 Ų10898 Ų9876%0.75552%0.518SS*.  trans24.995.1170.357.30000115.6T617 S621T617-S619 PolarHBondContact O-N 3.1Å; S619-S621 PolarHBondContact O-N 2.93Å
620L59Low55.9Low48 Ų4888.9 Ų88.925%0.25148%0.478SS..PPolyproline II helixtrans-57.8122.2168.9-60.1169.9000108.7T617 K708 T712T617-L620 HydrophobicContact CG2-CD2 4.3Å; L620-K708 HydrophobicContact CD1-CB 3.8Å; L620-T712 HydrophobicContact CB-CG2 3.73Å; L620-T712 WeakPolarHBondContact CD1-OG1 3.42Å; L620-T712 VanDerWaalsContact O-CG2 3.29Å; L620-T712 WeakPolarHBondContact O-CG2 3.02Å
621S63.3Low58Low82 Ų8290.3 Ų90.357%0.57348%0.476SS*.PPolyproline II helixtrans-94.2153.7172.156.80000110S619 Q709S619-S621 PolarHBondContact O-N 2.93Å; S621-Q709 PolarHBondContact O-NE2 3.13Å
622P65.1Low59.7Low40 Ų4079.7 Ų79.726%0.2643%0.434SS..PPolyproline II helixtrans-59.1141172.3-1.67.2000110.8I626 T627 D713 T716P622-I626 HydrophobicContact CB-CG2 3.74Å; P622-T627 HydrophobicContact CB-CG2 3.94Å; P622-T627 HydrophobicContact CG-CG2 4.34Å; P622-D713 VanDerWaalsContact CA-OD1 3.23Å; P622-D713 WeakPolarHBondContact CA-OD1 3.42Å; P622-T716 WeakPolarHBondContact CG-OG1 3.47Å
623Q70.6Confident61.3Low52 Ų5274.6 Ų74.624%0.24340%0.402CS..PPolyproline II helixtrans-73157179.7-68.7-178-28.300112.3M599 Y625 I626 T627 Q709 D713M599-Q623 HydrophobicContact CE-CG 4.39Å; M599-Q623 PolarHBondContact SD-OE1 3.11Å; Q623-Y625 HydrophobicContact CB-CD1 3.62Å; Q623-Y625 HydrophobicContact CB-CE1 3.63Å; Q623-Y625 HydrophobicContact CG-CE1 4.42Å; Q623-Y625 PolarHBondContact O-N 2.73Å; Q623-Y625 VanDerWaalsContact O-N 3.14Å; Q623-Y625 VanDerWaalsContact OE1-CE1 3.23Å; Q623-I626 WeakPolarHBondContact O-CG2 3.37Å; Q623-I626 PolarHBondContact O-N 2.98Å; Q623-I626 VanDerWaalsContact O-N 3.1Å; Q623-T627 PolarHBondContact O-N 2.91Å; Q623-T627 PolarHBondContact O-OG1 3.47Å; Q623-Q709 HydrophobicContact CG-CG 4.08Å; Q623-Q709 VanDerWaalsContact NE2-CG 3.3Å; Q623-D713 PolarHBondContact N-OD1 3.41Å; Q623-D713 PolarHBondContact OE1-OD2 3.44Å
624E73.1Confident63.1Low147 Ų14770.6 Ų70.669%0.68739%0.385SS*.Hα-helixtrans-57.2-34.9-172.8-162.7178.7169.500113I626 T627 N628E624-I626 PolarHBondContact O-N 3.14Å; E624-T627 WeakPolarHBondContact CA-OG1 3.26Å; E624-T627 PolarHBondContact O-N 3.4Å; E624-T627 PolarHBondContact O-OG1 2.95Å; E624-N628 VanDerWaalsContact O-CB 3.28Å; E624-N628 WeakPolarHBondContact O-CB 3.49Å; E624-N628 PolarHBondContact O-N 2.94Å; E624-N628 PolarHBondContact O-ND2 3.32Å; E624-N628 PolarHBondContact O-OD1 3.43Å
625Y72.6Confident65Low11 Ų1163.8 Ų63.84%0.04335%0.351CS..Hα-helixtrans-62.5-42178.981.1-91.2000112.5V596 M599 Q623 I629 Y692 D713V596-Y625 HydrophobicContact CG2-CD1 4.18Å; V596-Y625 HydrophobicContact CG2-CD2 3.46Å; V596-Y625 VanDerWaalsContact CG2-CD2 3.46Å; V596-Y625 HydrophobicContact CG2-CE1 4.04Å; V596-Y625 HydrophobicContact CG2-CE2 3.32Å; V596-Y625 HydrophobicContact CG2-CG 3.92Å; M599-Y625 HydrophobicContact CE-CD1 4.29Å; Q623-Y625 HydrophobicContact CB-CD1 3.62Å; Q623-Y625 HydrophobicContact CB-CE1 3.63Å; Q623-Y625 HydrophobicContact CG-CE1 4.42Å; Q623-Y625 PolarHBondContact O-N 2.73Å; Q623-Y625 VanDerWaalsContact O-N 3.14Å; Q623-Y625 VanDerWaalsContact OE1-CE1 3.23Å; Y625-I629 HydrophobicContact CD2-CD1 4.32Å; Y625-I629 WeakPolarHBondContact O-CD1 3.19Å; Y625-I629 VanDerWaalsContact O-CG1 3.24Å; Y625-I629 WeakPolarHBondContact O-CG1 3.33Å; Y625-I629 PolarHBondContact O-N 3.04Å; Y625-I629 VanDerWaalsContact O-N 3.13Å; Y625-Y692 AromaticContact CE2-CE2 3.82Å; Y625-Y692 HydrophobicContact CE2-CE2 3.82Å; Y625-Y692 PolarHBondContact OH-OH 3.22Å; Y625-D713 WeakPolarHBondContact OH-CB 3.48Å
626I71.6Confident66.8Low2 Ų257.7 Ų57.71%0.0132%0.319CS..Hα-helixtrans-80.3-31-176.7-165.367.6000111.2P622 Q623 E624 G630 D713 T718 L722P622-I626 HydrophobicContact CB-CG2 3.74Å; Q623-I626 WeakPolarHBondContact O-CG2 3.37Å; Q623-I626 PolarHBondContact O-N 2.98Å; Q623-I626 VanDerWaalsContact O-N 3.1Å; E624-I626 PolarHBondContact O-N 3.14Å; I626-G630 PolarHBondContact O-N 3.42Å; I626-D713 HydrophobicContact CG2-CB 4.21Å; I626-T718 HydrophobicContact CG1-CG2 4.37Å; I626-T718 HydrophobicContact CG2-CG2 4.47Å; I626-L722 HydrophobicContact CD1-CD1 3.94Å
627T73.9Confident68.7Low41 Ų4155.6 Ų55.625%0.25231%0.305SS..Hα-helixtrans-68.7-39.5172.753.10000111.9P622 Q623 E624 G630 Q631 T718P622-T627 HydrophobicContact CB-CG2 3.94Å; P622-T627 HydrophobicContact CG-CG2 4.34Å; Q623-T627 PolarHBondContact O-N 2.91Å; Q623-T627 PolarHBondContact O-OG1 3.47Å; E624-T627 WeakPolarHBondContact CA-OG1 3.26Å; E624-T627 PolarHBondContact O-N 3.4Å; E624-T627 PolarHBondContact O-OG1 2.95Å; T627-G630 PolarHBondContact O-N 2.9Å; T627-Q631 WeakPolarHBondContact O-CG 3.41Å; T627-Q631 PolarHBondContact O-N 3.2Å; T627-T718 HydrophobicContact CG2-CG2 4.36Å
628N74.7Confident70.4Confident26 Ų2656.8 Ų56.814%0.13931%0.307CS..Hα-helixtrans-67.5-44.2177.8-68.5-9.6000111.4F457 E624 G630 Q631 Y632F457-N628 HydrophobicContact CD1-CB 4.39Å; F457-N628 HydrophobicContact CG-CB 4.49Å; E624-N628 VanDerWaalsContact O-CB 3.28Å; E624-N628 WeakPolarHBondContact O-CB 3.49Å; E624-N628 PolarHBondContact O-N 2.94Å; E624-N628 PolarHBondContact O-ND2 3.32Å; E624-N628 PolarHBondContact O-OD1 3.43Å; N628-G630 VanDerWaalsContact C-N 3.31Å; N628-G630 PolarHBondContact O-N 3.47Å; N628-Q631 PolarHBondContact O-N 3.34Å; N628-Y632 VanDerWaalsContact O-CB 3.32Å; N628-Y632 WeakPolarHBondContact O-CB 3.48Å; N628-Y632 PolarHBondContact O-N 3.22Å
629I73.9Confident72Confident1 Ų150.4 Ų50.41%0.00528%0.28CS..Hα-helixtrans-59.5-43.8172.7-67.9166.1000110.6I589 Q592 L593 Y625 Y632 L633 T688I589-I629 HydrophobicContact CG2-CD1 4.48Å; I589-I629 HydrophobicContact CG2-CG1 4.48Å; I589-I629 HydrophobicContact CG2-CG2 4.3Å; Q592-I629 HydrophobicContact CB-CD1 3.8Å; Q592-I629 HydrophobicContact CB-CG1 3.78Å; Q592-I629 HydrophobicContact CG-CG1 4.34Å; L593-I629 HydrophobicContact CD2-CD1 3.48Å; L593-I629 VanDerWaalsContact CD2-CD1 3.48Å; L593-I629 HydrophobicContact CG-CD1 3.74Å; Y625-I629 HydrophobicContact CD2-CD1 4.32Å; Y625-I629 WeakPolarHBondContact O-CD1 3.19Å; Y625-I629 VanDerWaalsContact O-CG1 3.24Å; Y625-I629 WeakPolarHBondContact O-CG1 3.33Å; Y625-I629 PolarHBondContact O-N 3.04Å; Y625-I629 VanDerWaalsContact O-N 3.13Å; I629-Y632 PolarHBondContact O-N 2.99Å; I629-L633 HydrophobicContact CG2-CD1 3.91Å; I629-L633 HydrophobicContact CG2-CG 4.38Å; I629-L633 WeakPolarHBondContact O-CB 3.2Å; I629-L633 WeakPolarHBondContact O-CG 3.26Å; I629-L633 PolarHBondContact O-N 3.2Å; I629-T688 HydrophobicContact CG2-CG2 4.24Å
630G71.8Confident73.2Confident12 Ų1245.3 Ų45.312%0.12424%0.244CC..Hα-helixtrans-62.1-43.5178.300000113.3I626 T627 N628 M634I626-G630 PolarHBondContact O-N 3.42Å; T627-G630 PolarHBondContact O-N 2.9Å; N628-G630 VanDerWaalsContact C-N 3.31Å; N628-G630 PolarHBondContact O-N 3.47Å; G630-M634 WeakPolarHBondContact O-CG 3.38Å; G630-M634 PolarHBondContact O-N 3.45Å
631Q75.9Confident73.8Confident115 Ų11548.2 Ų48.254%0.53726%0.256SS..Hα-helixtrans-66.6-42176.7-73.6174.8-3.500111.9T627 N628 M634 S635T627-Q631 WeakPolarHBondContact O-CG 3.41Å; T627-Q631 PolarHBondContact O-N 3.2Å; N628-Q631 PolarHBondContact O-N 3.34Å; Q631-M634 WeakPolarHBondContact O-CB 3.35Å; Q631-M634 PolarHBondContact O-N 2.95Å; Q631-S635 PolarHBondContact O-N 3.38Å
632Y76.4Confident74Confident4 Ų446.3 Ų46.32%0.01624%0.242CC..Hα-helixtrans-61.3-48.7177.9-174.2-113.4000112.6F457 E459 W461 V585 Q588 I589 N628 I629 M634 S635 L636F457-Y632 HydrophobicContact CE1-CD2 4.49Å; F457-Y632 AromaticContact CZ-CD2 3.8Å; F457-Y632 HydrophobicContact CZ-CD2 3.8Å; F457-Y632 AromaticContact CZ-CG 3.84Å; F457-Y632 HydrophobicContact CZ-CG 3.84Å; E459-Y632 HydrophobicContact CG-CD2 4.41Å; W461-Y632 AromaticContact CE2-CE2 3.74Å; W461-Y632 HydrophobicContact CH2-CD2 4.41Å; W461-Y632 HydrophobicContact CH2-CE1 4.27Å; W461-Y632 AromaticContact CH2-CE2 3.69Å; W461-Y632 HydrophobicContact CH2-CE2 3.69Å; W461-Y632 AromaticContact CH2-CZ 3.6Å; W461-Y632 AromaticContact CZ2-CD2 3.76Å; W461-Y632 HydrophobicContact CZ2-CD2 3.76Å; W461-Y632 AromaticContact CZ2-CE2 3.23Å; W461-Y632 HydrophobicContact CZ2-CE2 3.23Å; W461-Y632 AromaticContact CZ2-CZ 3.69Å; V585-Y632 HydrophobicContact CG1-CE1 3.85Å; Q588-Y632 HydrophobicContact CB-CE1 4.38Å; I589-Y632 HydrophobicContact CD1-CD1 4.23Å; I589-Y632 HydrophobicContact CD1-CE1 4.27Å; I589-Y632 HydrophobicContact CG1-CD1 3.89Å; I589-Y632 HydrophobicContact CG1-CE1 4.03Å; N628-Y632 VanDerWaalsContact O-CB 3.32Å; N628-Y632 WeakPolarHBondContact O-CB 3.48Å; N628-Y632 PolarHBondContact O-N 3.22Å; I629-Y632 PolarHBondContact O-N 2.99Å; Y632-M634 PolarHBondContact O-N 2.99Å; Y632-S635 PolarHBondContact O-N 3.06Å; Y632-S635 PolarHBondContact O-OG 3.44Å; Y632-L636 PolarHBondContact O-N 3.2Å
633L76.5Confident74Confident4 Ų445.1 Ų45.12%0.02123%0.233CC..Hα-helixtrans-63.4-27.7176.9-71.8176000113I589 I629 L636 P637 I684 T688 L725I589-L633 HydrophobicContact CD1-CD2 3.76Å; I589-L633 HydrophobicContact CD1-CG 4.4Å; I629-L633 HydrophobicContact CG2-CD1 3.91Å; I629-L633 HydrophobicContact CG2-CG 4.38Å; I629-L633 WeakPolarHBondContact O-CB 3.2Å; I629-L633 WeakPolarHBondContact O-CG 3.26Å; I629-L633 PolarHBondContact O-N 3.2Å; L633-L636 HydrophobicContact CD2-CD2 4.42Å; L633-P637 WeakPolarHBondContact O-CD 3.37Å; L633-I684 HydrophobicContact CD2-CG2 3.84Å; L633-T688 HydrophobicContact CD1-CG2 4.46Å; L633-L725 HydrophobicContact CB-CD1 4.03Å; L633-L725 HydrophobicContact CD1-CD1 4.15Å
634M75.9Confident73.6Confident111 Ų11146.6 Ų46.655%0.54725%0.245SC..Hα-helixtrans-74-25.2174.6-73-64.4-56.200113.2G630 Q631 Y632G630-M634 WeakPolarHBondContact O-CG 3.38Å; G630-M634 PolarHBondContact O-N 3.45Å; Q631-M634 WeakPolarHBondContact O-CB 3.35Å; Q631-M634 PolarHBondContact O-N 2.95Å; Y632-M634 PolarHBondContact O-N 2.99Å
635S78.8Confident73Confident23 Ų2343.8 Ų43.816%0.16124%0.238CC..Hα-helixtrans-84.7-21.817669.60000113.5W461 Q631 Y632 L638 H639W461-S635 WeakPolarHBondContact CZ2-OG 3.44Å; Q631-S635 PolarHBondContact O-N 3.38Å; Y632-S635 PolarHBondContact O-N 3.06Å; Y632-S635 PolarHBondContact O-OG 3.44Å; S635-L638 WeakPolarHBondContact O-CB 3.37Å; S635-L638 PolarHBondContact O-N 3.25Å; S635-L638 VanDerWaalsContact O-N 3.16Å; S635-H639 PolarHBondContact O-CD2 2.91Å
636L78.8Confident72.2Confident0 Ų048.7 Ų48.70%026%0.262CS..Hα-helixtrans-54.9-44.7-179.1176.465.3000114W461 V585 Y632 L633 L638 H639 L640 L681 I684W461-L636 HydrophobicContact CH2-CB 3.94Å; W461-L636 HydrophobicContact CH2-CD1 3.63Å; W461-L636 HydrophobicContact CH2-CG 4.39Å; W461-L636 HydrophobicContact CZ3-CD1 3.62Å; V585-L636 HydrophobicContact CG1-CD1 4.07Å; V585-L636 HydrophobicContact CG1-CD2 4.45Å; V585-L636 HydrophobicContact CG2-CD1 4.4Å; Y632-L636 PolarHBondContact O-N 3.2Å; L633-L636 HydrophobicContact CD2-CD2 4.42Å; L636-L638 PolarHBondContact O-N 3.33Å; L636-H639 PolarHBondContact O-N 2.99Å; L636-L640 HydrophobicContact CD1-CD1 4.26Å; L636-L640 HydrophobicContact CD1-CD2 4.3Å; L636-L640 HydrophobicContact CD1-CG 4.09Å; L636-L640 HydrophobicContact CD2-CD1 4.41Å; L636-L640 HydrophobicContact CG-CD1 3.91Å; L636-L640 HydrophobicContact CG-CG 4.18Å; L636-L640 WeakPolarHBondContact O-CG 3.33Å; L636-L640 PolarHBondContact O-N 2.97Å; L636-L681 HydrophobicContact CD2-CD2 3.71Å; L636-L681 HydrophobicContact CG-CD2 4.03Å; L636-I684 HydrophobicContact CD1-CD1 4.48Å; L636-I684 HydrophobicContact CD2-CD1 3.64Å; L636-I684 HydrophobicContact CD2-CG2 4.26Å
637P77.3Confident71.5Confident59 Ų5957.9 Ų57.938%0.38331%0.305SS..Hα-helixtrans-56.3-33.4177.6-27.135.2000114.5L633 H639 L640 E641 L681L633-P637 WeakPolarHBondContact O-CD 3.37Å; P637-H639 PolarHBondContact O-N 2.76Å; P637-L640 CarbonylContact O-C 3.47Å; P637-L640 PolarHBondContact O-N 2.86Å; P637-E641 PolarHBondContact O-N 3.5Å; P637-L681 HydrophobicContact CG-CD1 4.42Å; P637-L681 HydrophobicContact CG-CD2 4.17Å
638L77.5Confident71.1Confident120 Ų12058.8 Ų58.863%0.62831%0.308SS*.Hα-helixtrans-66.1-30.2176.8-61.8170.9000111.8S635 L636 E641S635-L638 WeakPolarHBondContact O-CB 3.37Å; S635-L638 PolarHBondContact O-N 3.25Å; S635-L638 VanDerWaalsContact O-N 3.16Å; L636-L638 PolarHBondContact O-N 3.33Å; L638-E641 WeakPolarHBondContact O-CB 3.38Å
639H76.4Confident71Confident52 Ų5261 Ų6124%0.24132%0.324CS..Hα-helixtrans-88-14.6176.4-65.7-61.5000113.3W461 F464 S635 L636 P637 P642W461-H639 AromaticContact CD1-CD2 3.82Å; W461-H639 AromaticContact CD1-CE1 3.93Å; W461-H639 AromaticContact CD1-NE2 3.32Å; W461-H639 VanDerWaalsContact CD1-NE2 3.32Å; W461-H639 HydrophobicContact CD2-CB 4.44Å; W461-H639 AromaticContact CD2-CD2 3.31Å; W461-H639 AromaticContact CD2-CG 3.8Å; W461-H639 AromaticContact CD2-NE2 3.68Å; W461-H639 AromaticContact CE2-CD2 3.27Å; W461-H639 AromaticContact CE2-NE2 3.61Å; W461-H639 HydrophobicContact CE3-CB 4.06Å; W461-H639 AromaticContact CE3-CD2 3.78Å; W461-H639 AromaticContact CE3-CG 3.92Å; W461-H639 AromaticContact CG-CD2 3.68Å; W461-H639 AromaticContact CG-CE1 3.87Å; W461-H639 AromaticContact CG-NE2 3.52Å; W461-H639 AromaticContact CZ2-CD2 3.73Å; W461-H639 HydrophobicContact CZ3-CB 4.25Å; W461-H639 AromaticContact NE1-CD2 3.56Å; W461-H639 AromaticContact NE1-NE2 3.35Å; W461-H639 PolarHBondContact NE1-NE2 3.41Å; F464-H639 HydrophobicContact CD1-CB 4.28Å; F464-H639 HydrophobicContact CE1-CB 4.16Å; S635-H639 PolarHBondContact O-CD2 2.91Å; L636-H639 PolarHBondContact O-N 2.99Å; P637-H639 PolarHBondContact O-N 2.76Å; H639-P642 WeakPolarHBondContact O-CD 3.48Å
640L74.3Confident70.9Confident2 Ų261 Ų611%0.0132%0.324CS..Hα-helixtrans-89.7-5.9169.5-60.5177.8000112.5F464 L636 P637 P642 F643 A677 W680 L681F464-L640 HydrophobicContact CE1-CD2 4.05Å; F464-L640 HydrophobicContact CZ-CD2 3.55Å; L636-L640 HydrophobicContact CD1-CD1 4.26Å; L636-L640 HydrophobicContact CD1-CD2 4.3Å; L636-L640 HydrophobicContact CD1-CG 4.09Å; L636-L640 HydrophobicContact CD2-CD1 4.41Å; L636-L640 HydrophobicContact CG-CD1 3.91Å; L636-L640 HydrophobicContact CG-CG 4.18Å; L636-L640 WeakPolarHBondContact O-CG 3.33Å; L636-L640 PolarHBondContact O-N 2.97Å; P637-L640 CarbonylContact O-C 3.47Å; P637-L640 PolarHBondContact O-N 2.86Å; L640-P642 VanDerWaalsContact C-N 3.28Å; L640-F643 HydrophobicContact CB-CD2 3.98Å; L640-F643 HydrophobicContact CD2-CD2 3.43Å; L640-F643 VanDerWaalsContact CD2-CD2 3.43Å; L640-F643 HydrophobicContact CD2-CE2 3.36Å; L640-F643 HydrophobicContact CG-CD2 4.29Å; L640-F643 WeakPolarHBondContact O-CA 3.45Å; L640-F643 VanDerWaalsContact O-CB 3.26Å; L640-F643 WeakPolarHBondContact O-CB 3.47Å; L640-F643 PolarHBondContact O-N 3.37Å; L640-A677 HydrophobicContact CB-CB 4.46Å; L640-W680 HydrophobicContact CD1-CB 4.42Å; L640-L681 HydrophobicContact CD1-CD1 4.36Å; L640-L681 HydrophobicContact CD1-CD2 3.62Å; L640-L681 HydrophobicContact CD1-CG 3.63Å
641E71.4Confident71.1Confident108 Ų10860.7 Ų60.751%0.50532%0.32SS..Hα-helixtrans-50.5-39.1175.4-172.3178.7-170.400113.4P637 L638 F643 V644 T645P637-E641 PolarHBondContact O-N 3.5Å; L638-E641 WeakPolarHBondContact O-CB 3.38Å; E641-F643 PolarHBondContact O-N 2.94Å; E641-F643 VanDerWaalsContact O-N 3.16Å; E641-V644 PolarHBondContact O-N 3.26Å; E641-T645 HydrophobicContact CG-CG2 3.66Å; E641-T645 WeakPolarHBondContact O-CB 3.43Å; E641-T645 PolarHBondContact O-N 2.97Å; E641-T645 PolarHBondContact O-OG1 3.33Å
642P67Low70.9Confident43 Ų4360.5 Ų60.528%0.27932%0.319SS..Hα-helixtrans-57.8-26.9173.5-24.935.5000114H639 L640 Q646H639-P642 WeakPolarHBondContact O-CD 3.48Å; L640-P642 VanDerWaalsContact C-N 3.28Å; P642-Q646 VanDerWaalsContact O-CB 3.29Å; P642-Q646 WeakPolarHBondContact O-CB 3.34Å; P642-Q646 PolarHBondContact O-N 3.24Å
643F66.4Low70.8Confident14 Ų1463.7 Ų63.76%0.06134%0.335CS..Hα-helixtrans-79.7-18.5176.1-57.3-48.7000114F464 V468 L640 E641 L651 L655F464-F643 HydrophobicContact CZ-CE2 4.05Å; V468-F643 HydrophobicContact CB-CE1 4.43Å; V468-F643 HydrophobicContact CB-CZ 4.12Å; V468-F643 HydrophobicContact CG1-CE1 3.55Å; V468-F643 HydrophobicContact CG1-CZ 3.69Å; V468-F643 HydrophobicContact CG2-CE1 4.23Å; V468-F643 HydrophobicContact CG2-CE2 4.12Å; V468-F643 HydrophobicContact CG2-CZ 3.46Å; V468-F643 VanDerWaalsContact CG2-CZ 3.46Å; L640-F643 HydrophobicContact CB-CD2 3.98Å; L640-F643 HydrophobicContact CD2-CD2 3.43Å; L640-F643 VanDerWaalsContact CD2-CD2 3.43Å; L640-F643 HydrophobicContact CD2-CE2 3.36Å; L640-F643 HydrophobicContact CG-CD2 4.29Å; L640-F643 WeakPolarHBondContact O-CA 3.45Å; L640-F643 VanDerWaalsContact O-CB 3.26Å; L640-F643 WeakPolarHBondContact O-CB 3.47Å; L640-F643 PolarHBondContact O-N 3.37Å; E641-F643 PolarHBondContact O-N 2.94Å; E641-F643 VanDerWaalsContact O-N 3.16Å; F643-L651 HydrophobicContact CD1-CD1 4.28Å; F643-L651 HydrophobicContact CD1-CD2 3.75Å; F643-L651 HydrophobicContact CD1-CG 4.1Å; F643-L651 HydrophobicContact CE1-CD1 3.99Å; F643-L651 HydrophobicContact CE1-CD2 4.12Å; F643-L651 HydrophobicContact CE1-CG 4.31Å; F643-L655 HydrophobicContact CB-CD1 4.33Å; F643-L655 HydrophobicContact CD1-CD1 3.69Å; F643-L655 HydrophobicContact CD1-CD2 4.39Å; F643-L655 HydrophobicContact CE1-CD1 4.22Å; F643-L655 HydrophobicContact CE1-CD2 4.2Å; F643-L655 HydrophobicContact CG-CD1 4.23Å
644V61.4Low70.9Confident83 Ų8363.5 Ų63.550%0.50333%0.334SS..Hα-helixtrans-101.9-30.4-177.6-176.50000111.5E641 A677E641-V644 PolarHBondContact O-N 3.26Å; V644-A677 HydrophobicContact CG2-CB 3.34Å
645T60.1Low70.9Confident88 Ų8858.9 Ų58.954%0.5431%0.311SS..Hα-helixtrans-108.6-22-169.357.10000114.7E641E641-T645 HydrophobicContact CG-CG2 3.66Å; E641-T645 WeakPolarHBondContact O-CB 3.43Å; E641-T645 PolarHBondContact O-N 2.97Å; E641-T645 PolarHBondContact O-OG1 3.33Å
646Q56.8Low70.5Confident114 Ų11463.6 Ų63.653%0.53333%0.33SS..  trans-87.9113.1176.8-64.6-175.3-19.800109.6P642 D648P642-Q646 VanDerWaalsContact O-CB 3.29Å; P642-Q646 WeakPolarHBondContact O-CB 3.34Å; P642-Q646 PolarHBondContact O-N 3.24Å; Q646-D648 HydrophobicContact CB-CB 4.46Å; Q646-D648 PolarHBondContact O-N 3.15Å
647E56.3Low70.1Confident195 Ų19565.1 Ų65.191%0.91134%0.343SS*.  trans-69.550.4162.9-62.5-176176.300110.3P649E647-P649 WeakPolarHBondContact O-CD 3.45Å
648D66.3Low69.6Low60 Ų6062.7 Ų62.732%0.32133%0.328SS..  trans-88.3102.5171.2-172.8-3.2000108.6Q646 A650 L651 E652Q646-D648 HydrophobicContact CB-CB 4.46Å; Q646-D648 PolarHBondContact O-N 3.15Å; D648-A650 PolarHBondContact O-N 2.89Å; D648-A650 VanDerWaalsContact O-N 3.11Å; D648-A650 WeakPolarHBondContact OD1-CB 3.27Å; D648-A650 PolarHBondContact OD1-N 3.36Å; D648-L651 HydrophobicContact CB-CB 4Å; D648-L651 WeakPolarHBondContact O-CB 3.23Å; D648-L651 PolarHBondContact O-N 2.9Å; D648-E652 PolarHBondContact O-N 3.44Å; D648-E652 VanDerWaalsContact O-N 3.11Å
649P70.8Confident69.4Low73 Ų7364.2 Ų64.247%0.47433%0.33SS..Hα-helixtrans-63.2-20.7-177.728.4-36.9000112.3E647 M653E647-P649 WeakPolarHBondContact O-CD 3.45Å; P649-M653 VanDerWaalsContact O-CB 3.24Å; P649-M653 WeakPolarHBondContact O-CB 3.22Å; P649-M653 PolarHBondContact O-N 3.41Å
650A73.1Confident69.3Low2 Ų262.3 Ų62.32%0.01732%0.321CS..Hα-helixtrans-69-45.5173.200000110.9G475 E476 D648 M653 A654G475-A650 WeakPolarHBondContact CA-O 3.46Å; E476-A650 HydrophobicContact CB-CB 4.18Å; D648-A650 PolarHBondContact O-N 2.89Å; D648-A650 VanDerWaalsContact O-N 3.11Å; D648-A650 WeakPolarHBondContact OD1-CB 3.27Å; D648-A650 PolarHBondContact OD1-N 3.36Å; A650-M653 PolarHBondContact O-N 2.82Å; A650-A654 PolarHBondContact O-N 3.27Å
651L74.8Confident68.9Low5 Ų563.8 Ų63.83%0.02633%0.331CS..Hα-helixtrans-66.5-45.3-179.4-17257.3000111.7I471 A472 F643 D648 M653 A654 L655I471-L651 HydrophobicContact CG2-CD1 4.06Å; A472-L651 HydrophobicContact CB-CD1 3.94Å; F643-L651 HydrophobicContact CD1-CD1 4.28Å; F643-L651 HydrophobicContact CD1-CD2 3.75Å; F643-L651 HydrophobicContact CD1-CG 4.1Å; F643-L651 HydrophobicContact CE1-CD1 3.99Å; F643-L651 HydrophobicContact CE1-CD2 4.12Å; F643-L651 HydrophobicContact CE1-CG 4.31Å; D648-L651 HydrophobicContact CB-CB 4Å; D648-L651 WeakPolarHBondContact O-CB 3.23Å; D648-L651 PolarHBondContact O-N 2.9Å; L651-M653 VanDerWaalsContact C-N 3.32Å; L651-M653 PolarHBondContact O-N 2.79Å; L651-A654 WeakPolarHBondContact O-CB 3.2Å; L651-A654 PolarHBondContact O-N 3.38Å; L651-A654 VanDerWaalsContact O-N 3.15Å; L651-L655 HydrophobicContact CD1-CD1 4.44Å; L651-L655 HydrophobicContact CG-CD1 4.04Å; L651-L655 VanDerWaalsContact O-CG 3.24Å; L651-L655 WeakPolarHBondContact O-CG 3.32Å; L651-L655 PolarHBondContact O-N 3Å
652E73.7Confident68.5Low110 Ų11062.8 Ų62.851%0.51433%0.325SS..Hα-helixtrans-56.8-46.6175.5-172-176.5176.200111.1D648 A654 L655 H656D648-E652 PolarHBondContact O-N 3.44Å; D648-E652 VanDerWaalsContact O-N 3.11Å; E652-A654 PolarHBondContact O-N 3.44Å; E652-L655 PolarHBondContact O-N 2.84Å; E652-H656 PolarHBondContact O-CD2 2.85Å; E652-H656 PolarHBondContact O-N 3.12Å
653M74.3Confident68.4Low72 Ų7264.2 Ų64.236%0.35534%0.335SS..Hα-helixtrans-62.7-38.9176.3-170.4-176.6-41.200113L478 R479 P649 A650 L651 L655 A657L478-M653 HydrophobicContact CB-SD 4.18Å; R479-M653 HydrophobicContact CB-CE 3.6Å; R479-M653 HydrophobicContact CB-SD 3.87Å; R479-M653 HydrophobicContact CG-CE 3.61Å; R479-M653 HydrophobicContact CG-SD 4.47Å; P649-M653 VanDerWaalsContact O-CB 3.24Å; P649-M653 WeakPolarHBondContact O-CB 3.22Å; P649-M653 PolarHBondContact O-N 3.41Å; A650-M653 PolarHBondContact O-N 2.82Å; L651-M653 VanDerWaalsContact C-N 3.32Å; L651-M653 PolarHBondContact O-N 2.79Å; M653-L655 VanDerWaalsContact C-N 3.33Å; M653-A657 VanDerWaalsContact O-CB 3.26Å; M653-A657 WeakPolarHBondContact O-CB 3.23Å; M653-A657 PolarHBondContact O-N 2.82Å; M653-A657 VanDerWaalsContact O-N 3.1Å
654A78Confident68.1Low0 Ų064.7 Ų64.70%034%0.339CS..Hα-helixtrans-62.6-42.8174.300000111.3I471 G475 N574 A650 L651 E652 A657 G658I471-A654 HydrophobicContact CG2-CB 3.74Å; I471-A654 WeakPolarHBondContact O-CB 3.3Å; G475-A654 VanDerWaalsContact CA-CB 3.48Å; N574-A654 PolarHBondContact ND2-O 3.28Å; A650-A654 PolarHBondContact O-N 3.27Å; L651-A654 WeakPolarHBondContact O-CB 3.2Å; L651-A654 PolarHBondContact O-N 3.38Å; L651-A654 VanDerWaalsContact O-N 3.15Å; E652-A654 PolarHBondContact O-N 3.44Å; A654-A657 PolarHBondContact O-N 3.21Å; A654-G658 PolarHBondContact O-N 2.82Å
655L75Confident67.6Low13 Ų1369.1 Ų69.17%0.06835%0.354CS..Hα-helixtrans-70.1-41-176.3-69167000111.7I471 F643 L651 E652 M653 A657 G658 T676 W680I471-L655 HydrophobicContact CG2-CD2 4.38Å; F643-L655 HydrophobicContact CB-CD1 4.33Å; F643-L655 HydrophobicContact CD1-CD1 3.69Å; F643-L655 HydrophobicContact CD1-CD2 4.39Å; F643-L655 HydrophobicContact CE1-CD1 4.22Å; F643-L655 HydrophobicContact CE1-CD2 4.2Å; F643-L655 HydrophobicContact CG-CD1 4.23Å; L651-L655 HydrophobicContact CD1-CD1 4.44Å; L651-L655 HydrophobicContact CG-CD1 4.04Å; L651-L655 VanDerWaalsContact O-CG 3.24Å; L651-L655 WeakPolarHBondContact O-CG 3.32Å; L651-L655 PolarHBondContact O-N 3Å; E652-L655 PolarHBondContact O-N 2.84Å; M653-L655 VanDerWaalsContact C-N 3.33Å; L655-A657 VanDerWaalsContact C-N 3.34Å; L655-A657 PolarHBondContact O-N 3.4Å; L655-G658 PolarHBondContact O-N 2.88Å; L655-T676 HydrophobicContact CB-CG2 3.75Å; L655-T676 HydrophobicContact CD1-CG2 4.36Å; L655-W680 VanDerWaalsContact CD2-NE1 3.31Å
656H71.7Confident67Low123 Ų12374.7 Ų74.757%0.56937%0.374SS*.Hα-helixtrans-67.6-32.8173.8-73.8-66.8000113.3E652E652-H656 PolarHBondContact O-CD2 2.85Å; E652-H656 PolarHBondContact O-N 3.12Å
657A69.1Low66.1Low31 Ų3171.5 Ų71.526%0.25637%0.372SS..Hα-helixtrans-81.4-19177.500000113.4L478 M653 A654 L655L478-A657 HydrophobicContact CD1-CB 3.85Å; M653-A657 VanDerWaalsContact O-CB 3.26Å; M653-A657 WeakPolarHBondContact O-CB 3.23Å; M653-A657 PolarHBondContact O-N 2.82Å; M653-A657 VanDerWaalsContact O-N 3.1Å; A654-A657 PolarHBondContact O-N 3.21Å; L655-A657 VanDerWaalsContact C-N 3.34Å; L655-A657 PolarHBondContact O-N 3.4Å
658G66.6Low65.2Low8 Ų870 Ų708%0.08237%0.37CS..  trans-79.1135.7-179.700000111.8N574 A654 L655N574-G658 PolarHBondContact ND2-N 2.88Å; A654-G658 PolarHBondContact O-N 2.82Å; L655-G658 PolarHBondContact O-N 2.88Å
659K75Confident63.8Low153 Ų15374.9 Ų74.967%0.66540%0.396SS*.  trans-105.1120.9171.2-67.5-173.6178.5-1740108.7Q575Q575-K659 HydrophobicContact CG-CB 4.32Å
660L74.3Confident62.3Low11 Ų1177 Ų776%0.05840%0.403CS..  trans-84.3151.7175.4-64176.6000111.9N578 Y679 W680N578-L660 HydrophobicContact CB-CD2 4.09Å; L660-Y679 HydrophobicContact CB-CE1 3.96Å; L660-Y679 HydrophobicContact CD1-CD1 3.48Å; L660-Y679 VanDerWaalsContact CD1-CD1 3.48Å; L660-Y679 HydrophobicContact CD1-CE1 3.6Å; L660-Y679 HydrophobicContact CG-CD1 4.16Å; L660-Y679 HydrophobicContact CG-CE1 3.8Å; L660-W680 HydrophobicContact CD1-CB 4.23Å; L660-W680 HydrophobicContact CD1-CD2 3.53Å; L660-W680 HydrophobicContact CD1-CE3 4.03Å; L660-W680 HydrophobicContact CD1-CG 3.59Å; L660-W680 HydrophobicContact CD1-CZ2 4.45Å; L660-W680 HydrophobicContact CD2-CD2 3.87Å; L660-W680 VanDerWaalsContact CD2-CE2 3.49Å; L660-W680 HydrophobicContact CD2-CE3 4.03Å; L660-W680 HydrophobicContact CD2-CH2 3.47Å; L660-W680 VanDerWaalsContact CD2-CH2 3.47Å; L660-W680 HydrophobicContact CD2-CZ2 3.31Å; L660-W680 HydrophobicContact CD2-CZ3 3.84Å; L660-W680 HydrophobicContact CG-CD2 4.36Å; L660-W680 HydrophobicContact CG-CZ2 4.45Å
661P65.1Low60.8Low34 Ų3482 Ų8222%0.22144%0.435CS..SBendtrans-59.6141.8166.1-19.232.9000110.5F582 S683F582-P661 HydrophobicContact CB-CG 4.38Å; F582-P661 HydrophobicContact CD1-CB 4.29Å; F582-P661 HydrophobicContact CD1-CG 3.78Å; F582-P661 HydrophobicContact CD2-CG 4.36Å; F582-P661 HydrophobicContact CE1-CB 4.15Å; F582-P661 HydrophobicContact CE1-CG 4.15Å; F582-P661 HydrophobicContact CG-CG 3.9Å; F582-P661 HydrophobicContact CZ-CB 4.3Å; P661-S683 PolarHBondContact O-OG 2.71Å
662F63.7Low59.3Low86 Ų8689.8 Ų89.838%0.37747%0.472SS..SBendtrans55.560.5-178.9-50.9-83.5000114.5F582 R686 A687 Q690F582-F662 HydrophobicContact CZ-CD2 4.47Å; F662-R686 HydrophobicContact CB-CB 4.36Å; F662-R686 PolarHBondContact O-NE 3.05Å; F662-R686 PolarHBondContact O-NH2 3.21Å; F662-A687 HydrophobicContact CD2-CB 3.66Å; F662-A687 HydrophobicContact CE2-CB 4.02Å; F662-A687 HydrophobicContact CG-CB 4.27Å; F662-Q690 VanDerWaalsContact CD1-OE1 3.31Å
663P65.2Low58.2Low73 Ų7388.1 Ų88.147%0.47447%0.466SS..  trans-59.3156.3174.728.9-35.8000111E665 Y679 R686P663-E665 PolarHBondContact O-N 3.49Å; P663-Y679 WeakPolarHBondContact CB-OH 3.23Å; P663-R686 VanDerWaalsContact C-NH2 3.3Å; P663-R686 PolarHBondContact O-NE 3.28Å
664P59Low57.2Low24 Ų2491.4 Ų91.416%0.15649%0.485CS..  trans-59.5137173.210.6-7.3000108.8Q666 L673 Y679 R686P664-Q666 PolarHBondContact O-N 2.81Å; P664-L673 HydrophobicContact CG-CD1 4.26Å; P664-Y679 HydrophobicContact CG-CD2 3.72Å; P664-Y679 HydrophobicContact CG-CE2 3.59Å; P664-R686 VanDerWaalsContact N-CZ 3.31Å
665E51.7Low56.6Low177 Ų17793.5 Ų93.583%0.82750%0.496SS*.  trans-57.7113.3174.7-68.8-174.5166.200108P663 G667P663-E665 PolarHBondContact O-N 3.49Å; E665-G667 PolarHBondContact O-N 3.07Å
666Q47.4Very low56.4Low204 Ų20493.8 Ų93.895%0.95350%0.498SS*.  trans-73.975.6172.7-70.7-179.6-25.700108.1P664P664-Q666 PolarHBondContact O-N 2.81Å
667G37.8Very low56.4Low47 Ų4788 Ų8849%0.48547%0.472SS..  trans-89.9133.8160.800000108.7E665E665-G667 PolarHBondContact O-N 3.07Å
668D36.2Very low56.5Low164 Ų16488.3 Ų88.388%0.87747%0.469SS*.SBendtrans-40.9136.6178.3-78.6-37.4000112.3
669D38.5Very low56.9Low163 Ų16391 Ų9187%0.87248%0.478SS*.  trans80.139.4176.7-53.1-33.2000118.3
670L38.9Very low57Low116 Ų11684 Ų8461%0.60745%0.447SS*.  trans-103.2128.2154-76.7162.6000109.2E672L670-E672 PolarHBondContact O-N 3.5Å
671P41Very low57.1Low108 Ų10885.1 Ų85.170%0.70145%0.453SS*.  trans-55.8140.4173.323.8-30.5000108.5L673P671-L673 PolarHBondContact O-N 2.63Å
672E43.7Very low57.6Low169 Ų16983.9 Ų83.979%0.7945%0.446SS*.  trans-42.1116.6171.8-69.2175.5153.200107.6L670 D674L670-E672 PolarHBondContact O-N 3.5Å; E672-D674 PolarHBondContact O-N 3.05Å
673L49.9Very low58.3Low74 Ų7479.8 Ų79.839%0.38743%0.428SS..  trans-66.885.3176-82.2145.6000106.3P664 P671 N675 D678P664-L673 HydrophobicContact CG-CD1 4.26Å; P671-L673 PolarHBondContact O-N 2.63Å; L673-N675 PolarHBondContact O-N 3.47Å; L673-D678 HydrophobicContact CD2-CB 3.82Å
674D52.7Low59Low142 Ų14276.3 Ų76.376%0.75941%0.406SS*.  trans-59-18.2-177.2-79-23000112E672E672-D674 PolarHBondContact O-N 3.05Å
675N66.6Low59.7Low43 Ų4375.7 Ų75.723%0.2340%0.402CS..  trans-104.8108.9-179.6-172.718.2000111.6L673 A677 D678 Y679L673-N675 PolarHBondContact O-N 3.47Å; N675-A677 PolarHBondContact O-N 3.44Å; N675-A677 VanDerWaalsContact O-N 3.17Å; N675-D678 HydrophobicContact CB-CB 4.44Å; N675-D678 WeakPolarHBondContact CB-OD2 3.49Å; N675-D678 PolarHBondContact ND2-OD1 3.41Å; N675-D678 PolarHBondContact ND2-OD2 3.36Å; N675-D678 WeakPolarHBondContact O-CB 3.42Å; N675-D678 PolarHBondContact O-N 2.89Å; N675-Y679 PolarHBondContact O-N 3.37Å
676T70.4Confident60.8Low19 Ų1970 Ų7012%0.11737%0.373CS..Hα-helixtrans-58.8-26.5179.447.50000113.4L655 Y679 W680L655-T676 HydrophobicContact CB-CG2 3.75Å; L655-T676 HydrophobicContact CD1-CG2 4.36Å; T676-Y679 WeakPolarHBondContact O-CB 3.44Å; T676-Y679 PolarHBondContact O-N 2.99Å; T676-W680 PolarHBondContact O-N 3.47Å
677A72.2Confident62.3Low3 Ų360.3 Ų60.33%0.02533%0.328CS..Hα-helixtrans-66.8-35.3173.600000112.9L640 V644 N675 Y679 W680 L681L640-A677 HydrophobicContact CB-CB 4.46Å; V644-A677 HydrophobicContact CG2-CB 3.34Å; N675-A677 PolarHBondContact O-N 3.44Å; N675-A677 VanDerWaalsContact O-N 3.17Å; A677-Y679 VanDerWaalsContact C-N 3.33Å; A677-W680 PolarHBondContact O-N 3Å; A677-L681 WeakPolarHBondContact O-CG 3.47Å; A677-L681 PolarHBondContact O-N 3.28Å
678D71.3Confident64.2Low36 Ų3658.1 Ų58.119%0.19331%0.305CS..Hα-helixtrans-70.1-35.6178.3-64.7-27.5000110.9L673 N675 L681 G682L673-D678 HydrophobicContact CD2-CB 3.82Å; N675-D678 HydrophobicContact CB-CB 4.44Å; N675-D678 WeakPolarHBondContact CB-OD2 3.49Å; N675-D678 PolarHBondContact ND2-OD1 3.41Å; N675-D678 PolarHBondContact ND2-OD2 3.36Å; N675-D678 WeakPolarHBondContact O-CB 3.42Å; N675-D678 PolarHBondContact O-N 2.89Å; D678-L681 PolarHBondContact O-N 3.2Å; D678-G682 PolarHBondContact O-N 3Å
679Y73.9Confident66Low66 Ų6653 Ų5326%0.25928%0.276SS..Hα-helixtrans-61.4-43.6172.5-172.8-99.4000112.1L660 P663 P664 N675 T676 A677 S683L660-Y679 HydrophobicContact CB-CE1 3.96Å; L660-Y679 HydrophobicContact CD1-CD1 3.48Å; L660-Y679 VanDerWaalsContact CD1-CD1 3.48Å; L660-Y679 HydrophobicContact CD1-CE1 3.6Å; L660-Y679 HydrophobicContact CG-CD1 4.16Å; L660-Y679 HydrophobicContact CG-CE1 3.8Å; P663-Y679 WeakPolarHBondContact CB-OH 3.23Å; P664-Y679 HydrophobicContact CG-CD2 3.72Å; P664-Y679 HydrophobicContact CG-CE2 3.59Å; N675-Y679 PolarHBondContact O-N 3.37Å; T676-Y679 WeakPolarHBondContact O-CB 3.44Å; T676-Y679 PolarHBondContact O-N 2.99Å; A677-Y679 VanDerWaalsContact C-N 3.33Å; Y679-S683 WeakPolarHBondContact O-CB 3.36Å; Y679-S683 PolarHBondContact O-N 3.2Å; Y679-S683 VanDerWaalsContact O-N 3.08Å
680W77.6Confident67.8Low4 Ų449.6 Ų49.62%0.01526%0.255CS..Hα-helixtrans-64.3-48.1174.9-92.994000113I471 N578 A581 F582 L640 L655 L660 T676 A677 G682 S683 I684I471-W680 HydrophobicContact CD1-CZ2 4.07Å; N578-W680 HydrophobicContact CB-CZ2 4.47Å; N578-W680 WeakPolarHBondContact O-CH2 3.47Å; N578-W680 WeakPolarHBondContact OD1-CZ2 3.33Å; A581-W680 HydrophobicContact CB-CH2 3.61Å; A581-W680 HydrophobicContact CB-CZ2 4.36Å; A581-W680 HydrophobicContact CB-CZ3 4.38Å; F582-W680 HydrophobicContact CB-CH2 4.28Å; F582-W680 HydrophobicContact CB-CZ3 4Å; F582-W680 HydrophobicContact CD2-CZ3 4.38Å; L640-W680 HydrophobicContact CD1-CB 4.42Å; L655-W680 VanDerWaalsContact CD2-NE1 3.31Å; L660-W680 HydrophobicContact CD1-CB 4.23Å; L660-W680 HydrophobicContact CD1-CD2 3.53Å; L660-W680 HydrophobicContact CD1-CE3 4.03Å; L660-W680 HydrophobicContact CD1-CG 3.59Å; L660-W680 HydrophobicContact CD1-CZ2 4.45Å; L660-W680 HydrophobicContact CD2-CD2 3.87Å; L660-W680 VanDerWaalsContact CD2-CE2 3.49Å; L660-W680 HydrophobicContact CD2-CE3 4.03Å; L660-W680 HydrophobicContact CD2-CH2 3.47Å; L660-W680 VanDerWaalsContact CD2-CH2 3.47Å; L660-W680 HydrophobicContact CD2-CZ2 3.31Å; L660-W680 HydrophobicContact CD2-CZ3 3.84Å; L660-W680 HydrophobicContact CG-CD2 4.36Å; L660-W680 HydrophobicContact CG-CZ2 4.45Å; T676-W680 PolarHBondContact O-N 3.47Å; A677-W680 PolarHBondContact O-N 3Å; W680-G682 VanDerWaalsContact C-N 3.34Å; W680-G682 PolarHBondContact O-N 2.92Å; W680-S683 PolarHBondContact O-N 3.39Å; W680-I684 HydrophobicContact CE3-CD1 4.08Å; W680-I684 PolarHBondContact O-N 2.82Å
681L76.9Confident69.6Low36 Ų3645.6 Ų45.619%0.18824%0.236CC..Hα-helixtrans-60.1-44.6177.7-74.3170.9000111.5L636 P637 L640 A677 D678 S683 I684 A685L636-L681 HydrophobicContact CD2-CD2 3.71Å; L636-L681 HydrophobicContact CG-CD2 4.03Å; P637-L681 HydrophobicContact CG-CD1 4.42Å; P637-L681 HydrophobicContact CG-CD2 4.17Å; L640-L681 HydrophobicContact CD1-CD1 4.36Å; L640-L681 HydrophobicContact CD1-CD2 3.62Å; L640-L681 HydrophobicContact CD1-CG 3.63Å; A677-L681 WeakPolarHBondContact O-CG 3.47Å; A677-L681 PolarHBondContact O-N 3.28Å; D678-L681 PolarHBondContact O-N 3.2Å; L681-S683 VanDerWaalsContact C-N 3.34Å; L681-S683 PolarHBondContact O-N 3.47Å; L681-I684 PolarHBondContact O-N 3.19Å; L681-A685 VanDerWaalsContact O-CB 3.26Å; L681-A685 WeakPolarHBondContact O-CB 3.46Å; L681-A685 PolarHBondContact O-N 3.12Å
682G74.5Confident71.2Confident7 Ų741.4 Ų41.47%0.07221%0.206CC..Hα-helixtrans-61.6-40.4176.800000112.8D678 W680 R686D678-G682 PolarHBondContact O-N 3Å; W680-G682 VanDerWaalsContact C-N 3.34Å; W680-G682 PolarHBondContact O-N 2.92Å; G682-R686 WeakPolarHBondContact O-CB 3.44Å; G682-R686 WeakPolarHBondContact O-CG 3.12Å; G682-R686 PolarHBondContact O-N 2.73Å; G682-R686 PolarHBondContact O-NH1 3.36Å; G682-R686 PolarHBondContact O-NH2 3.2Å
683S78.7Confident72.4Confident0 Ų036.8 Ų36.80%019%0.192CC..Hα-helixtrans-64.2-48.2178.1163.10000111.8F582 P661 Y679 W680 L681 A685 R686 A687F582-S683 WeakPolarHBondContact CE2-OG 3Å; P661-S683 PolarHBondContact O-OG 2.71Å; Y679-S683 WeakPolarHBondContact O-CB 3.36Å; Y679-S683 PolarHBondContact O-N 3.2Å; Y679-S683 VanDerWaalsContact O-N 3.08Å; W680-S683 PolarHBondContact O-N 3.39Å; L681-S683 VanDerWaalsContact C-N 3.34Å; L681-S683 PolarHBondContact O-N 3.47Å; S683-A685 PolarHBondContact O-N 3.13Å; S683-R686 VanDerWaalsContact CA-NH2 3.32Å; S683-R686 VanDerWaalsContact N-NH2 3.14Å; S683-R686 PolarHBondContact O-N 2.98Å; S683-A687 WeakPolarHBondContact O-CB 3.44Å; S683-A687 PolarHBondContact O-N 3.27Å
684I80.9Confident73.7Confident1 Ų137 Ų371%0.00519%0.194CC..Hα-helixtrans-65.3-40.4178.3-67.3165.1000111F582 V585 I589 L633 L636 W680 L681 A687 T688F582-I684 HydrophobicContact CD2-CG1 3.97Å; F582-I684 HydrophobicContact CE2-CG1 3.75Å; V585-I684 HydrophobicContact CB-CD1 4.47Å; V585-I684 HydrophobicContact CG1-CD1 4.1Å; I589-I684 HydrophobicContact CD1-CG2 4.03Å; L633-I684 HydrophobicContact CD2-CG2 3.84Å; L636-I684 HydrophobicContact CD1-CD1 4.48Å; L636-I684 HydrophobicContact CD2-CD1 3.64Å; L636-I684 HydrophobicContact CD2-CG2 4.26Å; W680-I684 HydrophobicContact CE3-CD1 4.08Å; W680-I684 PolarHBondContact O-N 2.82Å; L681-I684 PolarHBondContact O-N 3.19Å; I684-A687 PolarHBondContact O-N 3.07Å; I684-T688 WeakPolarHBondContact O-CB 3.34Å; I684-T688 PolarHBondContact O-N 2.59Å; I684-T688 PolarHBondContact O-OG1 3.47Å
685A73.4Confident74.7Confident10 Ų1030.7 Ų30.78%0.08316%0.161CC..Hα-helixtrans-61-47.4176.700000111.8L681 S683 T688 M689 L725L681-A685 VanDerWaalsContact O-CB 3.26Å; L681-A685 WeakPolarHBondContact O-CB 3.46Å; L681-A685 PolarHBondContact O-N 3.12Å; S683-A685 PolarHBondContact O-N 3.13Å; A685-T688 PolarHBondContact O-N 2.78Å; A685-M689 WeakPolarHBondContact O-CG 3.12Å; A685-M689 PolarHBondContact O-N 2.78Å; A685-L725 HydrophobicContact CB-CB 4.39Å; A685-L725 HydrophobicContact CB-CD2 3.81Å
686R74.8Confident74.9Confident58 Ų5830.2 Ų30.222%0.21916%0.158CC..Hα-helixtrans-62-46.5177.3-77.5-174.9-64.4-81.6-7.2112.4F662 P663 P664 G682 S683 T688 M689 Q690F662-R686 HydrophobicContact CB-CB 4.36Å; F662-R686 PolarHBondContact O-NE 3.05Å; F662-R686 PolarHBondContact O-NH2 3.21Å; P663-R686 VanDerWaalsContact C-NH2 3.3Å; P663-R686 PolarHBondContact O-NE 3.28Å; P664-R686 VanDerWaalsContact N-CZ 3.31Å; G682-R686 WeakPolarHBondContact O-CB 3.44Å; G682-R686 WeakPolarHBondContact O-CG 3.12Å; G682-R686 PolarHBondContact O-N 2.73Å; G682-R686 PolarHBondContact O-NH1 3.36Å; G682-R686 PolarHBondContact O-NH2 3.2Å; S683-R686 VanDerWaalsContact CA-NH2 3.32Å; S683-R686 VanDerWaalsContact N-NH2 3.14Å; S683-R686 PolarHBondContact O-N 2.98Å; R686-T688 VanDerWaalsContact C-N 3.29Å; R686-T688 PolarHBondContact O-N 3.21Å; R686-M689 HydrophobicContact CB-CE 4.47Å; R686-M689 HydrophobicContact CG-CE 4.06Å; R686-M689 PolarHBondContact O-N 2.66Å; R686-Q690 WeakPolarHBondContact O-CB 3.42Å; R686-Q690 PolarHBondContact O-N 2.76Å
687A78.9Confident75.2Confident0 Ų036 Ų360%019%0.187CC..Hα-helixtrans-61.5-38.8177.400000112.5F582 F586 F662 S683 I684 T691F582-A687 HydrophobicContact CE1-CB 4.49Å; F582-A687 HydrophobicContact CE2-CB 4.33Å; F582-A687 HydrophobicContact CZ-CB 3.55Å; F586-A687 HydrophobicContact CD2-CB 4.13Å; F586-A687 HydrophobicContact CE2-CB 3.67Å; F586-A687 HydrophobicContact CZ-CB 4Å; F586-A687 WeakPolarHBondContact CZ-O 3.36Å; F662-A687 HydrophobicContact CD2-CB 3.66Å; F662-A687 HydrophobicContact CE2-CB 4.02Å; F662-A687 HydrophobicContact CG-CB 4.27Å; S683-A687 WeakPolarHBondContact O-CB 3.44Å; S683-A687 PolarHBondContact O-N 3.27Å; I684-A687 PolarHBondContact O-N 3.07Å; A687-T691 VanDerWaalsContact O-CB 3.3Å; A687-T691 WeakPolarHBondContact O-CB 3.48Å; A687-T691 PolarHBondContact O-N 3.21Å; A687-T691 PolarHBondContact O-OG1 2.72Å
688T77.8Confident75.4Confident2 Ų241.8 Ų41.81%0.01222%0.217CC..Hα-helixtrans-64.3-46.9176.1-57.80000111.1I589 L593 I629 L633 I684 A685 R686 T691 Y692 L722I589-T688 HydrophobicContact CG2-CG2 3.64Å; L593-T688 HydrophobicContact CD1-CG2 4.47Å; I629-T688 HydrophobicContact CG2-CG2 4.24Å; L633-T688 HydrophobicContact CD1-CG2 4.46Å; I684-T688 WeakPolarHBondContact O-CB 3.34Å; I684-T688 PolarHBondContact O-N 2.59Å; I684-T688 PolarHBondContact O-OG1 3.47Å; A685-T688 PolarHBondContact O-N 2.78Å; R686-T688 VanDerWaalsContact C-N 3.29Å; R686-T688 PolarHBondContact O-N 3.21Å; T688-T691 PolarHBondContact O-N 2.72Å; T688-Y692 VanDerWaalsContact O-CB 3.26Å; T688-Y692 WeakPolarHBondContact O-CB 3.15Å; T688-Y692 PolarHBondContact O-N 3.23Å; T688-L722 HydrophobicContact CG2-CD2 4.38Å
689M72.8Confident75.6Confident55 Ų5541.6 Ų41.627%0.27122%0.216SC..Hα-helixtrans-61.4-48177.2-72.7-175-65.600111.8A685 R686 T691 Y692 C693 L722 L726A685-M689 WeakPolarHBondContact O-CG 3.12Å; A685-M689 PolarHBondContact O-N 2.78Å; R686-M689 HydrophobicContact CB-CE 4.47Å; R686-M689 HydrophobicContact CG-CE 4.06Å; R686-M689 PolarHBondContact O-N 2.66Å; M689-T691 PolarHBondContact O-N 3.19Å; M689-Y692 PolarHBondContact O-N 3.15Å; M689-C693 PolarHBondContact O-N 2.8Å; M689-C693 PolarHBondContact O-SG 3.32Å; M689-C693 VanDerWaalsContact O-SG 3.33Å; M689-L722 HydrophobicContact CG-CD2 3.81Å; M689-L726 HydrophobicContact CE-CD1 3.57Å; M689-L726 HydrophobicContact SD-CD1 3.72Å
690Q76.8Confident75.1Confident92 Ų9243.8 Ų43.843%0.4324%0.238SC..Hα-helixtrans-61.7-45.9179.9-177.6167.6-8.500111.4F662 R686 Y692 C693 D694F662-Q690 VanDerWaalsContact CD1-OE1 3.31Å; R686-Q690 WeakPolarHBondContact O-CB 3.42Å; R686-Q690 PolarHBondContact O-N 2.76Å; Q690-Y692 VanDerWaalsContact C-N 3.3Å; Q690-Y692 PolarHBondContact O-N 3.4Å; Q690-C693 WeakPolarHBondContact O-CB 3.29Å; Q690-C693 PolarHBondContact O-N 2.86Å; Q690-D694 VanDerWaalsContact O-CG 3.27Å; Q690-D694 PolarHBondContact O-N 3.45Å
691T76Confident74.6Confident32 Ų3253.4 Ų53.420%0.19627%0.274CS..Hα-helixtrans-68.3-31.4178.7-57.40000112.1F586 L593 A687 T688 M689 A695F586-T691 HydrophobicContact CZ-CG2 4.27Å; F586-T691 VanDerWaalsContact CZ-OG1 3.28Å; F586-T691 WeakPolarHBondContact CZ-OG1 3.45Å; L593-T691 HydrophobicContact CD1-CG2 3.81Å; A687-T691 VanDerWaalsContact O-CB 3.3Å; A687-T691 WeakPolarHBondContact O-CB 3.48Å; A687-T691 PolarHBondContact O-N 3.21Å; A687-T691 PolarHBondContact O-OG1 2.72Å; T688-T691 PolarHBondContact O-N 2.72Å; M689-T691 PolarHBondContact O-N 3.19Å; T691-A695 VanDerWaalsContact O-CB 3.25Å; T691-A695 WeakPolarHBondContact O-CB 3.34Å; T691-A695 PolarHBondContact O-N 3.05Å
692Y74.6Confident74.1Confident21 Ų2155.7 Ų55.78%0.08229%0.286CS..Hα-helixtrans-68.1-44.6173.8-175.6-138.4000111.5L593 Y625 T688 M689 Q690 D694 A695 I696 I714L593-Y692 HydrophobicContact CD2-CD2 3.51Å; L593-Y692 HydrophobicContact CD2-CE2 4.27Å; L593-Y692 HydrophobicContact CD2-CG 4.05Å; Y625-Y692 AromaticContact CE2-CE2 3.82Å; Y625-Y692 HydrophobicContact CE2-CE2 3.82Å; Y625-Y692 PolarHBondContact OH-OH 3.22Å; T688-Y692 VanDerWaalsContact O-CB 3.26Å; T688-Y692 WeakPolarHBondContact O-CB 3.15Å; T688-Y692 PolarHBondContact O-N 3.23Å; M689-Y692 PolarHBondContact O-N 3.15Å; Q690-Y692 VanDerWaalsContact C-N 3.3Å; Q690-Y692 PolarHBondContact O-N 3.4Å; Y692-D694 PolarHBondContact O-N 3.4Å; Y692-A695 PolarHBondContact O-N 3.47Å; Y692-I696 HydrophobicContact CD1-CD1 4.07Å; Y692-I696 HydrophobicContact CD2-CD1 4Å; Y692-I696 HydrophobicContact CD2-CG1 4.22Å; Y692-I696 HydrophobicContact CE1-CD1 3.88Å; Y692-I696 HydrophobicContact CE2-CD1 3.83Å; Y692-I696 HydrophobicContact CE2-CG1 4.1Å; Y692-I696 HydrophobicContact CG-CD1 4.16Å; Y692-I696 VanDerWaalsContact O-CG1 3.26Å; Y692-I696 WeakPolarHBondContact O-CG1 3.45Å; Y692-I696 PolarHBondContact O-N 3.09Å; Y692-I714 HydrophobicContact CE1-CG1 4.04Å
693C70.7Confident74.1Confident72 Ų7257.7 Ų57.749%0.48630%0.299SS..Hα-helixtrans-57.6-48.1172.1-70.80000111.4M689 Q690 A695 I696 L697M689-C693 PolarHBondContact O-N 2.8Å; M689-C693 PolarHBondContact O-SG 3.32Å; M689-C693 VanDerWaalsContact O-SG 3.33Å; Q690-C693 WeakPolarHBondContact O-CB 3.29Å; Q690-C693 PolarHBondContact O-N 2.86Å; C693-A695 VanDerWaalsContact C-N 3.35Å; C693-A695 PolarHBondContact O-N 3.29Å; C693-I696 PolarHBondContact O-N 3.4Å; C693-L697 VanDerWaalsContact O-CG 3.29Å; C693-L697 WeakPolarHBondContact O-CG 3.42Å; C693-L697 PolarHBondContact O-N 2.91Å
694D77.1Confident73.5Confident79 Ų7962.8 Ų62.842%0.42233%0.332SS..Hα-helixtrans-61.5-42.1178.1-68.9-20.7000111.6Q690 Y692 I696 L697 L698Q690-D694 VanDerWaalsContact O-CG 3.27Å; Q690-D694 PolarHBondContact O-N 3.45Å; Y692-D694 PolarHBondContact O-N 3.4Å; D694-I696 VanDerWaalsContact C-N 3.35Å; D694-I696 PolarHBondContact O-N 3.24Å; D694-L697 PolarHBondContact O-N 3.05Å; D694-L698 VanDerWaalsContact O-CG 3.31Å; D694-L698 WeakPolarHBondContact O-CG 3.29Å; D694-L698 PolarHBondContact O-N 3.18Å; D694-L698 VanDerWaalsContact O-N 3.15Å
695A73.6Confident73Confident8 Ų867.8 Ų67.87%0.06636%0.355CS..Hα-helixtrans-64-37.2176.900000112.8T691 Y692 C693 L698T691-A695 VanDerWaalsContact O-CB 3.25Å; T691-A695 WeakPolarHBondContact O-CB 3.34Å; T691-A695 PolarHBondContact O-N 3.05Å; Y692-A695 PolarHBondContact O-N 3.47Å; C693-A695 VanDerWaalsContact C-N 3.35Å; C693-A695 PolarHBondContact O-N 3.29Å; A695-L698 PolarHBondContact O-N 2.97Å
696I71.1Confident72.6Confident34 Ų3468.8 Ų68.817%0.17436%0.362CS..Hα-helixtrans-67.1-41.6174.5-69164.9000110.8Y692 C693 D694 L698 I699 L710 I714Y692-I696 HydrophobicContact CD1-CD1 4.07Å; Y692-I696 HydrophobicContact CD2-CD1 4Å; Y692-I696 HydrophobicContact CD2-CG1 4.22Å; Y692-I696 HydrophobicContact CE1-CD1 3.88Å; Y692-I696 HydrophobicContact CE2-CD1 3.83Å; Y692-I696 HydrophobicContact CE2-CG1 4.1Å; Y692-I696 HydrophobicContact CG-CD1 4.16Å; Y692-I696 VanDerWaalsContact O-CG1 3.26Å; Y692-I696 WeakPolarHBondContact O-CG1 3.45Å; Y692-I696 PolarHBondContact O-N 3.09Å; C693-I696 PolarHBondContact O-N 3.4Å; D694-I696 VanDerWaalsContact C-N 3.35Å; D694-I696 PolarHBondContact O-N 3.24Å; I696-L698 PolarHBondContact O-N 2.95Å; I696-I699 WeakPolarHBondContact O-CB 3.41Å; I696-I699 VanDerWaalsContact O-CG1 3.32Å; I696-I699 WeakPolarHBondContact O-CG1 3.47Å; I696-I699 PolarHBondContact O-N 3.01Å; I696-I699 VanDerWaalsContact O-N 3.17Å; I696-L710 HydrophobicContact CD1-CD1 4.06Å; I696-L710 HydrophobicContact CG1-CD1 4.01Å; I696-L710 HydrophobicContact CG1-CD2 4.41Å; I696-L710 HydrophobicContact CG2-CD2 3.82Å; I696-I714 HydrophobicContact CD1-CD1 4.12Å
697L74.8Confident72.2Confident139 Ų13969.4 Ų69.473%0.72837%0.372SS*.Hα-helixtrans-66.9-20.2179.1-69.7173.4000113.2C693 D694 I699C693-L697 VanDerWaalsContact O-CG 3.29Å; C693-L697 WeakPolarHBondContact O-CG 3.42Å; C693-L697 PolarHBondContact O-N 2.91Å; D694-L697 PolarHBondContact O-N 3.05Å; L697-I699 VanDerWaalsContact C-N 3.29Å
698L78.3Confident71.7Confident125 Ų12575.9 Ų75.965%0.65440%0.4SS*.THydrogen-bonded Turntrans-80.2-4.6175.6-71.6168.9000113.8D694 A695 I696 P700D694-L698 VanDerWaalsContact O-CG 3.31Å; D694-L698 WeakPolarHBondContact O-CG 3.29Å; D694-L698 PolarHBondContact O-N 3.18Å; D694-L698 VanDerWaalsContact O-N 3.15Å; A695-L698 PolarHBondContact O-N 2.97Å; I696-L698 PolarHBondContact O-N 2.95Å; L698-P700 WeakPolarHBondContact O-CD 3.45Å
699I73.8Confident71.3Confident33 Ų3376.8 Ų76.817%0.16941%0.405CS..  trans-74.9118.9179.3-59.8172.1000109.6V596 I696 L697 R701 L702V596-I699 HydrophobicContact CG1-CD1 4.29Å; I696-I699 WeakPolarHBondContact O-CB 3.41Å; I696-I699 VanDerWaalsContact O-CG1 3.32Å; I696-I699 WeakPolarHBondContact O-CG1 3.47Å; I696-I699 PolarHBondContact O-N 3.01Å; I696-I699 VanDerWaalsContact O-N 3.17Å; L697-I699 VanDerWaalsContact C-N 3.29Å; I699-R701 WeakPolarHBondContact CG2-O 3.43Å; I699-L702 HydrophobicContact CG2-CD1 4.35Å; I699-L702 HydrophobicContact CG2-CG 4.28Å
700P63.7Low71.1Confident111 Ų11175.4 Ų75.472%0.72140%0.398SS*.SBendtrans-75.7-27.2-170.526-32.1000115.1L698L698-P700 WeakPolarHBondContact O-CD 3.45Å
701R66.6Low70.7Confident206 Ų20673.9 Ų73.978%0.77740%0.401SS*.  trans-146152.4173.2-67.3-171.8178.6-180-0.1109.1I699I699-R701 WeakPolarHBondContact CG2-O 3.43Å
702L68.3Low70.3Confident85 Ų8573.4 Ų73.445%0.44540%0.398SS..  trans-123.3116.1174.9-90.6120.3000109.3I699 L710I699-L702 HydrophobicContact CG2-CD1 4.35Å; I699-L702 HydrophobicContact CG2-CG 4.28Å; L702-L710 HydrophobicContact CD2-CD2 4.15Å
703S72.8Confident70Confident48 Ų4872.5 Ų72.534%0.33640%0.395SS..  trans-68.615716778.60000111.7E600 H705 S706 T707E600-S703 PolarHBondContact OE1-N 2.95Å; S703-H705 PolarHBondContact O-N 3.35Å; S703-H705 PolarHBondContact OG-N 2.81Å; S703-S706 PolarHBondContact N-OG 3.25Å; S703-S706 PolarHBondContact O-N 3.31Å; S703-S706 PolarHBondContact O-OG 3.21Å; S703-S706 WeakPolarHBondContact OG-CB 3.33Å; S703-S706 PolarHBondContact OG-N 2.96Å; S703-S706 PolarHBondContact OG-OG 3.46Å; S703-T707 WeakPolarHBondContact O-CB 3.46Å; S703-T707 PolarHBondContact O-N 3.34Å; S703-T707 PolarHBondContact O-OG1 3.2Å
704P67.7Low69.8Low108 Ų10873.1 Ų73.170%0.70139%0.392SS*.Hα-helixtrans-62.7-24.717522.4-31000113.1K708P704-K708 WeakPolarHBondContact O-CG 3.22Å; P704-K708 PolarHBondContact O-N 3.48Å
705H68.7Low68.6Low105 Ų10571.5 Ų71.549%0.48639%0.394SS..Hα-helixtrans-75.5-48.2172.5-174.45.4000111.8S703 T707 K708 Q709S703-H705 PolarHBondContact O-N 3.35Å; S703-H705 PolarHBondContact OG-N 2.81Å; H705-T707 VanDerWaalsContact C-N 3.26Å; H705-T707 PolarHBondContact O-N 2.98Å; H705-K708 PolarHBondContact O-N 3.03Å; H705-K708 VanDerWaalsContact O-N 3.15Å; H705-Q709 WeakPolarHBondContact O-CB 3.5Å; H705-Q709 PolarHBondContact O-N 3.42Å
706S65.5Low67.5Low32 Ų3273.2 Ų73.222%0.22440%0.404CS..Hα-helixtrans-64.9-30.4177.356.50000112.1E600 S703 Q709 L710E600-S706 PolarHBondContact OE1-OG 3.3Å; S703-S706 PolarHBondContact N-OG 3.25Å; S703-S706 PolarHBondContact O-N 3.31Å; S703-S706 PolarHBondContact O-OG 3.21Å; S703-S706 WeakPolarHBondContact OG-CB 3.33Å; S703-S706 PolarHBondContact OG-N 2.96Å; S703-S706 PolarHBondContact OG-OG 3.46Å; S706-Q709 PolarHBondContact O-N 3.01Å; S706-L710 VanDerWaalsContact O-CB 3.23Å; S706-L710 WeakPolarHBondContact O-CB 3.47Å; S706-L710 PolarHBondContact O-N 3.29Å
707T67.6Low66.3Low71 Ų7177.7 Ų77.744%0.43642%0.424SS..Hα-helixtrans-62.9-46.5170.5-52.40000112.1S703 H705 A711S703-T707 WeakPolarHBondContact O-CB 3.46Å; S703-T707 PolarHBondContact O-N 3.34Å; S703-T707 PolarHBondContact O-OG1 3.2Å; H705-T707 VanDerWaalsContact C-N 3.26Å; H705-T707 PolarHBondContact O-N 2.98Å; T707-A711 VanDerWaalsContact O-CB 3.27Å; T707-A711 WeakPolarHBondContact O-CB 3.29Å; T707-A711 PolarHBondContact O-N 3.47Å
708K67.8Low64.8Low135 Ų13571.5 Ų71.559%0.58739%0.393SS*.Hα-helixtrans-68.8-34.9177.5-73.2176.9-178.6176.90112L620 P704 H705 T712L620-K708 HydrophobicContact CD1-CB 3.8Å; P704-K708 WeakPolarHBondContact O-CG 3.22Å; P704-K708 PolarHBondContact O-N 3.48Å; H705-K708 PolarHBondContact O-N 3.03Å; H705-K708 VanDerWaalsContact O-N 3.15Å; K708-T712 WeakPolarHBondContact O-CB 3.46Å; K708-T712 PolarHBondContact O-N 3.1Å; K708-T712 PolarHBondContact O-OG1 3.15Å
709Q69.1Low63.1Low22 Ų2266.2 Ų66.210%0.10337%0.368CS..Hα-helixtrans-68-49.1175.9-173.756.151.600111.3S621 Q623 H705 S706 A711 T712 D713S621-Q709 PolarHBondContact O-NE2 3.13Å; Q623-Q709 HydrophobicContact CG-CG 4.08Å; Q623-Q709 VanDerWaalsContact NE2-CG 3.3Å; H705-Q709 WeakPolarHBondContact O-CB 3.5Å; H705-Q709 PolarHBondContact O-N 3.42Å; S706-Q709 PolarHBondContact O-N 3.01Å; Q709-A711 VanDerWaalsContact C-N 3.32Å; Q709-A711 PolarHBondContact O-N 3.29Å; Q709-T712 CarbonylContact O-C 3.46Å; Q709-T712 VanDerWaalsContact O-CA 3.3Å; Q709-T712 WeakPolarHBondContact O-CA 3.31Å; Q709-T712 VanDerWaalsContact O-CB 3.22Å; Q709-T712 WeakPolarHBondContact O-CB 3.29Å; Q709-T712 PolarHBondContact O-N 3.12Å; Q709-D713 PolarHBondContact NE2-OD1 2.9Å; Q709-D713 PolarHBondContact NE2-OD2 2.82Å; Q709-D713 PolarHBondContact O-N 2.87Å; Q709-D713 VanDerWaalsContact O-OD2 3.08Å
710L69.1Low61.8Low25 Ų2571 Ų7113%0.13139%0.387CS..Hα-helixtrans-61.5-39.4175.5-173.669000111.9I696 L702 S706 T712 D713 I714I696-L710 HydrophobicContact CD1-CD1 4.06Å; I696-L710 HydrophobicContact CG1-CD1 4.01Å; I696-L710 HydrophobicContact CG1-CD2 4.41Å; I696-L710 HydrophobicContact CG2-CD2 3.82Å; L702-L710 HydrophobicContact CD2-CD2 4.15Å; S706-L710 VanDerWaalsContact O-CB 3.23Å; S706-L710 WeakPolarHBondContact O-CB 3.47Å; S706-L710 PolarHBondContact O-N 3.29Å; L710-T712 PolarHBondContact O-N 2.81Å; L710-D713 PolarHBondContact O-N 3.45Å; L710-I714 HydrophobicContact CD1-CD1 4.21Å; L710-I714 HydrophobicContact CD2-CD1 4.36Å; L710-I714 HydrophobicContact CG-CD1 3.81Å; L710-I714 HydrophobicContact CG-CG1 4.45Å; L710-I714 WeakPolarHBondContact O-CB 3.22Å; L710-I714 WeakPolarHBondContact O-CG1 3.43Å; L710-I714 PolarHBondContact O-N 3.01Å
711A67.4Low61Low60 Ų6071.1 Ų71.150%0.49637%0.373SS..Hα-helixtrans-64.7-28.6172.200000112.7T707 Q709 G715T707-A711 VanDerWaalsContact O-CB 3.27Å; T707-A711 WeakPolarHBondContact O-CB 3.29Å; T707-A711 PolarHBondContact O-N 3.47Å; Q709-A711 VanDerWaalsContact C-N 3.32Å; Q709-A711 PolarHBondContact O-N 3.29Å; A711-G715 VanDerWaalsContact O-CA 3.22Å; A711-G715 WeakPolarHBondContact O-CA 3.28Å; A711-G715 PolarHBondContact O-N 3.27Å
712T68.8Low60Low23 Ų2362.5 Ų62.514%0.14134%0.343CS..Hα-helixtrans-74.6-44.1172.2-57.40000110.2L620 K708 Q709 L710 I714 G715 T716L620-T712 HydrophobicContact CB-CG2 3.73Å; L620-T712 WeakPolarHBondContact CD1-OG1 3.42Å; L620-T712 VanDerWaalsContact O-CG2 3.29Å; L620-T712 WeakPolarHBondContact O-CG2 3.02Å; K708-T712 WeakPolarHBondContact O-CB 3.46Å; K708-T712 PolarHBondContact O-N 3.1Å; K708-T712 PolarHBondContact O-OG1 3.15Å; Q709-T712 CarbonylContact O-C 3.46Å; Q709-T712 VanDerWaalsContact O-CA 3.3Å; Q709-T712 WeakPolarHBondContact O-CA 3.31Å; Q709-T712 VanDerWaalsContact O-CB 3.22Å; Q709-T712 WeakPolarHBondContact O-CB 3.29Å; Q709-T712 PolarHBondContact O-N 3.12Å; L710-T712 PolarHBondContact O-N 2.81Å; T712-I714 VanDerWaalsContact C-N 3.32Å; T712-I714 PolarHBondContact O-N 3.41Å; T712-G715 PolarHBondContact O-N 3.48Å; T712-T716 HydrophobicContact CG2-CG2 3.47Å; T712-T716 VanDerWaalsContact CG2-CG2 3.47Å; T712-T716 VanDerWaalsContact O-CB 3.31Å; T712-T716 WeakPolarHBondContact O-CB 3.06Å; T712-T716 WeakPolarHBondContact O-CG2 3.43Å; T712-T716 PolarHBondContact O-N 3.37Å; T712-T716 PolarHBondContact O-OG1 3.35Å
713D67.6Low58.8Low1 Ų164.2 Ų64.21%0.00535%0.348CS..Hα-helixtrans-65.4-34.3178-62.9-41.4000112.2P622 Q623 Y625 I626 Q709 L710P622-D713 VanDerWaalsContact CA-OD1 3.23Å; P622-D713 WeakPolarHBondContact CA-OD1 3.42Å; Q623-D713 PolarHBondContact N-OD1 3.41Å; Q623-D713 PolarHBondContact OE1-OD2 3.44Å; Y625-D713 WeakPolarHBondContact OH-CB 3.48Å; I626-D713 HydrophobicContact CG2-CB 4.21Å; Q709-D713 PolarHBondContact NE2-OD1 2.9Å; Q709-D713 PolarHBondContact NE2-OD2 2.82Å; Q709-D713 PolarHBondContact O-N 2.87Å; Q709-D713 VanDerWaalsContact O-OD2 3.08Å; L710-D713 PolarHBondContact O-N 3.45Å
714I66.1Low57.4Low85 Ų8565 Ų6544%0.43635%0.351SS..Hα-helixtrans-80.3-31.6172.2-63.7168.9000112.1Y692 I696 L710 T712 G719Y692-I714 HydrophobicContact CE1-CG1 4.04Å; I696-I714 HydrophobicContact CD1-CD1 4.12Å; L710-I714 HydrophobicContact CD1-CD1 4.21Å; L710-I714 HydrophobicContact CD2-CD1 4.36Å; L710-I714 HydrophobicContact CG-CD1 3.81Å; L710-I714 HydrophobicContact CG-CG1 4.45Å; L710-I714 WeakPolarHBondContact O-CB 3.22Å; L710-I714 WeakPolarHBondContact O-CG1 3.43Å; L710-I714 PolarHBondContact O-N 3.01Å; T712-I714 VanDerWaalsContact C-N 3.32Å; T712-I714 PolarHBondContact O-N 3.41Å; I714-G719 WeakPolarHBondContact O-CA 3.43Å
715G52Low56.2Low45 Ų4561.1 Ų61.146%0.46433%0.325SS..Hα-helixtrans-102.5-21.2-16800000116.5A711 T712A711-G715 VanDerWaalsContact O-CA 3.22Å; A711-G715 WeakPolarHBondContact O-CA 3.28Å; A711-G715 PolarHBondContact O-N 3.27Å; T712-G715 PolarHBondContact O-N 3.48Å
716T50.4Low54.9Low45 Ų4559.9 Ų59.928%0.27632%0.321SS..SBendtrans-82.2173.9177.153.50000111.7P622 T712 T718 G719 K720P622-T716 WeakPolarHBondContact CG-OG1 3.47Å; T712-T716 HydrophobicContact CG2-CG2 3.47Å; T712-T716 VanDerWaalsContact CG2-CG2 3.47Å; T712-T716 VanDerWaalsContact O-CB 3.31Å; T712-T716 WeakPolarHBondContact O-CB 3.06Å; T712-T716 WeakPolarHBondContact O-CG2 3.43Å; T712-T716 PolarHBondContact O-N 3.37Å; T712-T716 PolarHBondContact O-OG1 3.35Å; T716-T718 PolarHBondContact O-N 2.91Å; T716-G719 PolarHBondContact O-N 3.47Å; T716-K720 PolarHBondContact O-N 2.82Å
717E46.6Very low53.7Low127 Ų12761.4 Ų61.459%0.59333%0.329SS*.Hα-helixtrans-40.8-26.5-174.1-95.4-168.7-179.200115.8K720 R721E717-K720 CarbonylContact O-C 3.51Å; E717-R721 WeakPolarHBondContact O-CA 3.48Å; E717-R721 WeakPolarHBondContact O-CB 3.44Å; E717-R721 WeakPolarHBondContact O-CD 3.43Å; E717-R721 WeakPolarHBondContact O-CG 3.43Å; E717-R721 PolarHBondContact O-N 3.21Å; E717-R721 IonicContact OE2-CZ 3.02Å; E717-R721 IonicContact OE2-NE 3.72Å; E717-R721 IonicContact OE2-NH2 3.82Å; E717-R721 PolarHBondContact OE2-NH2 3.1Å
718T42.3Very low52.4Low10 Ų1062 Ų626%0.06133%0.329CS..Hα-helixtrans-71.6-41.9173.932.40000114.4I626 T627 T716 R721 L722I626-T718 HydrophobicContact CG1-CG2 4.37Å; I626-T718 HydrophobicContact CG2-CG2 4.47Å; T627-T718 HydrophobicContact CG2-CG2 4.36Å; T716-T718 PolarHBondContact O-N 2.91Å; T718-R721 CarbonylContact O-C 3.49Å; T718-R721 WeakPolarHBondContact O-CA 3.49Å; T718-R721 PolarHBondContact O-N 3.05Å; T718-R721 VanDerWaalsContact O-N 3.12Å; T718-L722 PolarHBondContact O-N 2.93Å
719G43.5Very low50.9Low13 Ų1358.6 Ų58.613%0.13432%0.322CS..Hα-helixtrans-71.2-35.1171.100000112.3I714 T716 R721 L722 Q723I714-G719 WeakPolarHBondContact O-CA 3.43Å; T716-G719 PolarHBondContact O-N 3.47Å; G719-R721 VanDerWaalsContact C-N 3.29Å; G719-R721 PolarHBondContact O-N 3.31Å; G719-L722 PolarHBondContact O-N 3.08Å; G719-Q723 VanDerWaalsContact O-CB 3.29Å; G719-Q723 WeakPolarHBondContact O-CB 3.45Å; G719-Q723 PolarHBondContact O-N 3.37Å
720K46.5Very low49.2Very low133 Ų13363.6 Ų63.658%0.57835%0.349SS*.Hα-helixtrans-65.3-29164.5-74.8-178.6-179175.80112.4T716 E717 Q723 V724T716-K720 PolarHBondContact O-N 2.82Å; E717-K720 CarbonylContact O-C 3.51Å; K720-Q723 CarbonylContact O-C 3.32Å; K720-Q723 WeakPolarHBondContact O-CB 3.41Å; K720-Q723 PolarHBondContact O-N 3.45Å; K720-V724 WeakPolarHBondContact O-CB 3.38Å; K720-V724 WeakPolarHBondContact O-CG2 3.01Å; K720-V724 PolarHBondContact O-N 2.99Å
721R47.6Very low47.5Very low114 Ų11465.2 Ų65.243%0.4336%0.361SS..Hα-helixtrans-78.7-33176.5-81.8165.4-165-160.89.6112.8E717 T718 G719 Q723 V724 L725E717-R721 WeakPolarHBondContact O-CA 3.48Å; E717-R721 WeakPolarHBondContact O-CB 3.44Å; E717-R721 WeakPolarHBondContact O-CD 3.43Å; E717-R721 WeakPolarHBondContact O-CG 3.43Å; E717-R721 PolarHBondContact O-N 3.21Å; E717-R721 IonicContact OE2-CZ 3.02Å; E717-R721 IonicContact OE2-NE 3.72Å; E717-R721 IonicContact OE2-NH2 3.82Å; E717-R721 PolarHBondContact OE2-NH2 3.1Å; T718-R721 CarbonylContact O-C 3.49Å; T718-R721 WeakPolarHBondContact O-CA 3.49Å; T718-R721 PolarHBondContact O-N 3.05Å; T718-R721 VanDerWaalsContact O-N 3.12Å; G719-R721 VanDerWaalsContact C-N 3.29Å; G719-R721 PolarHBondContact O-N 3.31Å; R721-Q723 VanDerWaalsContact C-N 3.32Å; R721-V724 CarbonylContact O-C 3.57Å; R721-V724 WeakPolarHBondContact O-CA 3.16Å; R721-V724 WeakPolarHBondContact O-CB 3.41Å; R721-V724 PolarHBondContact O-N 3.38Å; R721-V724 VanDerWaalsContact O-N 3.15Å; R721-L725 PolarHBondContact O-N 3.05Å
722L45.2Very low46Very low26 Ų2666 Ų6614%0.13636%0.36CS..Hα-helixtrans-65.1-38.4163.7-99.7115.4000110.9I626 T688 M689 T718 G719 V724 L725 L726I626-L722 HydrophobicContact CD1-CD1 3.94Å; T688-L722 HydrophobicContact CG2-CD2 4.38Å; M689-L722 HydrophobicContact CG-CD2 3.81Å; T718-L722 PolarHBondContact O-N 2.93Å; G719-L722 PolarHBondContact O-N 3.08Å; L722-V724 VanDerWaalsContact C-N 3.29Å; L722-L725 WeakPolarHBondContact O-CB 3.47Å; L722-L725 PolarHBondContact O-N 3.41Å; L722-L726 PolarHBondContact O-N 3.16Å
723Q42.3Very low44.4Very low120 Ų12074.3 Ų74.356%0.56140%0.397SS*.Hα-helixtrans-70.2-24.4169.4-152.4162.718.100112.2G719 K720 R721 L726 V727G719-Q723 VanDerWaalsContact O-CB 3.29Å; G719-Q723 WeakPolarHBondContact O-CB 3.45Å; G719-Q723 PolarHBondContact O-N 3.37Å; K720-Q723 CarbonylContact O-C 3.32Å; K720-Q723 WeakPolarHBondContact O-CB 3.41Å; K720-Q723 PolarHBondContact O-N 3.45Å; R721-Q723 VanDerWaalsContact C-N 3.32Å; Q723-L726 CarbonylContact O-C 3.4Å; Q723-L726 WeakPolarHBondContact O-CA 3.47Å; Q723-L726 VanDerWaalsContact O-CB 3.23Å; Q723-L726 WeakPolarHBondContact O-CB 3.22Å; Q723-L726 PolarHBondContact O-N 3.45Å; Q723-V727 WeakPolarHBondContact O-CB 3.21Å; Q723-V727 WeakPolarHBondContact O-CG2 3.4Å; Q723-V727 PolarHBondContact O-N 3.27Å
724V44.3Very low42.7Very low66 Ų6678.6 Ų78.640%0.443%0.427SS..Hα-helixtrans-77.6-25.3169.5170.50000110.9K720 R721 L722 L726 V727 L728K720-V724 WeakPolarHBondContact O-CB 3.38Å; K720-V724 WeakPolarHBondContact O-CG2 3.01Å; K720-V724 PolarHBondContact O-N 2.99Å; R721-V724 CarbonylContact O-C 3.57Å; R721-V724 WeakPolarHBondContact O-CA 3.16Å; R721-V724 WeakPolarHBondContact O-CB 3.41Å; R721-V724 PolarHBondContact O-N 3.38Å; R721-V724 VanDerWaalsContact O-N 3.15Å; L722-V724 VanDerWaalsContact C-N 3.29Å; V724-L726 VanDerWaalsContact C-N 3.34Å; V724-V727 CarbonylContact O-C 3.51Å; V724-V727 PolarHBondContact O-N 3.04Å; V724-L728 HydrophobicContact CG1-CD1 3.88Å; V724-L728 HydrophobicContact CG1-CG 4.15Å; V724-L728 WeakPolarHBondContact O-CA 3.4Å; V724-L728 WeakPolarHBondContact O-CB 3.26Å; V724-L728 WeakPolarHBondContact O-CD1 3.39Å; V724-L728 WeakPolarHBondContact O-CG 3.46Å; V724-L728 PolarHBondContact O-N 3.22Å
725L42.9Very low41Very low26 Ų2684 Ų8414%0.13645%0.448CS..Hα-helixtrans-68-36.6162.8-101.3111.9000111.1L633 A685 R721 L722 S729L633-L725 HydrophobicContact CB-CD1 4.03Å; L633-L725 HydrophobicContact CD1-CD1 4.15Å; A685-L725 HydrophobicContact CB-CB 4.39Å; A685-L725 HydrophobicContact CB-CD2 3.81Å; R721-L725 PolarHBondContact O-N 3.05Å; L722-L725 WeakPolarHBondContact O-CB 3.47Å; L722-L725 PolarHBondContact O-N 3.41Å; L725-S729 PolarHBondContact O-N 3.38Å
726L40.4Very low40Very low79 Ų7984.8 Ų84.841%0.41446%0.457SS..Hα-helixtrans-66-36.3170.6-141.899.6000112.3M689 L722 Q723 V724 S729M689-L726 HydrophobicContact CE-CD1 3.57Å; M689-L726 HydrophobicContact SD-CD1 3.72Å; L722-L726 PolarHBondContact O-N 3.16Å; Q723-L726 CarbonylContact O-C 3.4Å; Q723-L726 WeakPolarHBondContact O-CA 3.47Å; Q723-L726 VanDerWaalsContact O-CB 3.23Å; Q723-L726 WeakPolarHBondContact O-CB 3.22Å; Q723-L726 PolarHBondContact O-N 3.45Å; V724-L726 VanDerWaalsContact C-N 3.34Å; L726-S729 WeakPolarHBondContact O-CB 3.38Å
727V40.5Very low38.9Very low64 Ų6490.8 Ų90.839%0.38848%0.479SS..Hα-helixtrans-82.7-27.8177.1172.40000111.6Q723 V724 S729 L730 C731Q723-V727 WeakPolarHBondContact O-CB 3.21Å; Q723-V727 WeakPolarHBondContact O-CG2 3.4Å; Q723-V727 PolarHBondContact O-N 3.27Å; V724-V727 CarbonylContact O-C 3.51Å; V724-V727 PolarHBondContact O-N 3.04Å; V727-S729 VanDerWaalsContact C-N 3.28Å; V727-S729 PolarHBondContact O-N 3.07Å; V727-L730 CarbonylContact O-C 3.17Å; V727-L730 VanDerWaalsContact O-CA 3.28Å; V727-L730 WeakPolarHBondContact O-CA 3.47Å; V727-L730 PolarHBondContact O-N 3.38Å; V727-C731 HydrophobicContact CG1-CB 3.99Å; V727-C731 WeakPolarHBondContact CG1-SG 3.31Å; V727-C731 WeakPolarHBondContact O-CA 3.29Å; V727-C731 WeakPolarHBondContact O-CB 3.21Å; V727-C731 PolarHBondContact O-N 3.24Å
728L39.8Very low38Very low84 Ų8490 Ų9044%0.4448%0.483SS..Hα-helixtrans-66.4-34.4169.6-84.2157.8000109.9V724 L730 C731V724-L728 HydrophobicContact CG1-CD1 3.88Å; V724-L728 HydrophobicContact CG1-CG 4.15Å; V724-L728 WeakPolarHBondContact O-CA 3.4Å; V724-L728 WeakPolarHBondContact O-CB 3.26Å; V724-L728 WeakPolarHBondContact O-CD1 3.39Å; V724-L728 WeakPolarHBondContact O-CG 3.46Å; V724-L728 PolarHBondContact O-N 3.22Å; L728-L730 PolarHBondContact O-N 3.36Å; L728-C731 PolarHBondContact O-N 2.84Å
729S35.8Very low37.4Very low63 Ų6395.3 Ų95.344%0.44152%0.52SS..Hα-helixtrans-65.2-10.5165.7-172.40000114L725 L726 V727L725-S729 PolarHBondContact O-N 3.38Å; L726-S729 WeakPolarHBondContact O-CB 3.38Å; V727-S729 VanDerWaalsContact C-N 3.28Å; V727-S729 PolarHBondContact O-N 3.07Å
730L35.2Very low36.7Very low126 Ų126102.2 Ų102.266%0.6655%0.553SS**Hα-helixtrans-121.9-1.9179-85.8156.2000113.7V727 L728V727-L730 CarbonylContact O-C 3.17Å; V727-L730 VanDerWaalsContact O-CA 3.28Å; V727-L730 WeakPolarHBondContact O-CA 3.47Å; V727-L730 PolarHBondContact O-N 3.38Å; L728-L730 PolarHBondContact O-N 3.36Å
731C31.6Very low35.8Very low59 Ų59105.3 Ų105.340%0.39956%0.561SS.*Hα-helixtrans-135.914.7-166-78.30000116.3V727 L728 E733 S734V727-C731 HydrophobicContact CG1-CB 3.99Å; V727-C731 WeakPolarHBondContact CG1-SG 3.31Å; V727-C731 WeakPolarHBondContact O-CA 3.29Å; V727-C731 WeakPolarHBondContact O-CB 3.21Å; V727-C731 PolarHBondContact O-N 3.24Å; L728-C731 PolarHBondContact O-N 2.84Å; C731-E733 PolarHBondContact O-N 3.42Å; C731-S734 PolarHBondContact O-N 3.45Å
732V37Very low34.9Very low78 Ų78105.8 Ų105.847%0.47358%0.576SS.*G310 helixtrans-73.5-1.3170.5-179.50000112.8S734V732-S734 PolarHBondContact O-N 3.1Å
733E34.2Very low34.2Very low196 Ų196109.4 Ų109.492%0.91660%0.604SS**G310 helixtrans-69-12.9164.6-80.8-167.715000114.4C731C731-E733 PolarHBondContact O-N 3.42Å
734S31.8Very low33.7Very low91 Ų91112 Ų11264%0.63662%0.616SS**G310 helixtrans-103-4.4-173.6-700000116.6C731 V732C731-S734 PolarHBondContact O-N 3.45Å; V732-S734 PolarHBondContact O-N 3.1Å
735F32.1Very low33Very low198 Ų198117.8 Ų117.887%0.86864%0.639SS**SBendtrans-126.314.8-179.1-98.1-85.3000115.8
736G30.5Very low32.5Very low63 Ų63128 Ų12865%0.64968%0.675SS**SBendtrans-97.1-0.2176.700000117
737F27.4Very low32Very low171 Ų171132.4 Ų132.475%0.7570%0.699SS**SBendtrans-128.90.3-171.6-112.2-85.4000117.5
738V28.1Very low31.4Very low111 Ų111133 Ų13367%0.67372%0.719SS**SBendtrans-99.2-16.8-176.1178.70000114
739S28.4Very low31Very low121 Ų121140.7 Ų140.785%0.84674%0.742SS**SBendtrans-92.8-4-177.1-147.80000115.9
740L28.8Very low30.7Very low157 Ų157143.4 Ų143.482%0.82276%0.761SS**SBendtrans-113.76.5-179.8-96.1157000115
741R27.5Very low30.3Very low198 Ų198140.9 Ų140.975%0.74777%0.766SS**SBendtrans-118.53.5175.6-104.5-175.7-175.8170.43.8115.9
742V29.6Very low30.9Very low124 Ų124144.3 Ų144.375%0.75279%0.787SS**SBendtrans-89.2-7178.2179.30000112.6
743S30.1Very low30.4Very low102 Ų102145.4 Ų145.471%0.71381%0.805SS**SBendtrans-97.52.5-18049.60000116
744E31.7Very low30Very low175 Ų175140.8 Ų140.882%0.81880%0.8SS**SBendtrans-125.114-175-99.3-172.1165.300116.8
745Q30.3Very low29.8Very low187 Ų187142.8 Ų142.887%0.87481%0.808SS**  trans-132.571.4170.9-85.9-177.1-24.300112.9
746R30.9Very low30.5Very low240 Ų240138.1 Ų138.191%0.90680%0.798SS**  trans-13781.6147.7-90.4-171.1-178173.52.5108.9
747D29.9Very low30.3Very low172 Ų172144.3 Ų144.392%0.9281%0.809SS**  trans179.3138.6135.4-94.5-22.8000110.3
748G29Very low30.3Very low78 Ų78140.3 Ų140.380%0.80481%0.808SS**  trans116.771.9161.300000118.3
749R30.2Very low30.2Very low245 Ų245139.5 Ų139.593%0.92581%0.812SS**  trans6.4139.2145.7-74.9175.3172.7172.8-1.7121.7
750S30.6Very low30.2Very low120 Ų120137.8 Ų137.884%0.83981%0.806SS**  trans88.3108.113165.40000122.1
751G27.6Very low30.2Very low73 Ų73139.2 Ų139.275%0.75381%0.808SS**  96.3151.3121.800000118.4
752P43.6Very low30.2Very low131 Ų131140.4 Ų140.485%0.85181%0.812SS**  -128.9-177.5-119.540.1-26.1000116.5
753A26.7Very low30.1Very low101 Ų101142.8 Ų142.884%0.83582%0.815SS**  trans85.4141.4158.500000116.2
754A25.9Very low30.1Very low99 Ų99141.7 Ų141.782%0.81881%0.812SS**  cis-156.9157.53.800000109.7
755V26.6Very low30Very low132 Ų132137.7 Ų137.780%0.881%0.809SS**  trans-87.5175.1174-179.40000108.3
756P46.8Very low30Very low101 Ų101137.3 Ų137.366%0.65681%0.807SS**  cis-125.7-178.3-47.836.7-22.1000111.7
757H26.6Very low29.9Very low192 Ų192130.4 Ų130.489%0.88980%0.796SS**  trans-156.4135131.1-120.1-73000113.9
758A27.2Very low30.1Very low88 Ų88130.8 Ų130.873%0.72779%0.792SS**  trans-77.5156175.300000113.3
759A26.8Very low30.6Very low93 Ų93137.1 Ų137.177%0.76982%0.815SS**  trans157.1111.8142.400000108.5
760A27.8Very low30.6Very low85 Ų85131.7 Ų131.770%0.70281%0.81SS**  63.9113.192.600000113.7
761H27.9Very low30.6Very low188 Ų188132.3 Ų132.387%0.8781%0.808SS**  -177.5134.4116.1-105-76.2000112.9
762R28.6Very low30.8Very low222 Ų222135.6 Ų135.684%0.83881%0.811SS**  trans-60146.5161.2-70.6170.8169.4169.6-4.5111.3
763H27.7Very low30Very low175 Ų175135.9 Ų135.981%0.8181%0.809SS**  176.1123.7121.3-102.6-76.2000108.7
764A30.1Very low30.2Very low78 Ų78138.1 Ų138.165%0.64581%0.807SS**  61.5104.699.400000111.9
765A30.3Very low30.5Very low92 Ų92140.7 Ų140.776%0.7681%0.807SS**  93139.487.100000111.8
766E29.6Very low30.8Very low178 Ų178141.3 Ų141.383%0.83281%0.807SS**  trans85.2102162.6-64.6-178.7168.800120.4
767S29.3Very low29.6Very low95 Ų95144.4 Ų144.466%0.66482%0.819SS**  85146.3115.979.40000121
768Q34.1Very low29.8Very low180 Ų180140.4 Ų140.484%0.84181%0.813SS**  trans81.3120.3164.1-63.4179.75.600114
769T38.2Very low30Very low211 Ų211145.2 Ų145.2100%1.29482%0.821SS**  cis-157.4028.3210000109.8

Retrieved 769 of 769 residues in 1204.3 ms (Link to these results)

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