A0A087X2Z9_POEFO Loading...

ER lumen protein-retaining receptor

AlphaFold DB , UniProt , Accession A0A087X2Z9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 215 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
1M75Confident90.1Very high136 Ų13656.9 Ų56.967%0.6730%0.295SS*.  0126.70-16870.479.500106.7R5 Y59M1-R5 HydrophobicContact SD-CB 4.4Å; M1-R5 HydrophobicContact SD-CG 4.02Å; M1-Y59 HydrophobicContact CE-CD1 4Å; M1-Y59 HydrophobicContact CE-CE1 3.95Å
2N89.5Confident90.5Very high22 Ų2253 Ų5312%0.11828%0.275CS..  trans-120.8169.9176.864.246.2000110.5F4 R5 L6 N165N2-F4 VanDerWaalsContact C-N 3.3Å; N2-F4 PolarHBondContact O-N 2.88Å; N2-F4 PolarHBondContact OD1-N 3.42Å; N2-R5 PolarHBondContact O-N 2.83Å; N2-R5 PolarHBondContact OD1-N 3.15Å; N2-L6 PolarHBondContact O-N 2.94Å; N2-L6 VanDerWaalsContact O-N 3.09Å; N2-N165 PolarHBondContact ND2-OD1 3.04Å; N2-N165 PolarHBondContact OD1-OD1 3.41Å
3I90.8Very high90.8Very high118 Ų11851.6 Ų51.661%0.60527%0.268SS*.Hα-helixtrans-61.8-36.4-175-168.961.8000112.7L6 A7I3-L6 PolarHBondContact O-N 3.45Å; I3-A7 VanDerWaalsContact O-CB 3.27Å; I3-A7 WeakPolarHBondContact O-CB 3.22Å; I3-A7 PolarHBondContact O-N 3.39Å
4F91.3Very high91.1Very high65 Ų6551.4 Ų51.429%0.28527%0.269SS..Hα-helixtrans-66.3-43.9179.9-60.4-67.1000111.6N2 G8 L161 A164 N165 W168N2-F4 VanDerWaalsContact C-N 3.3Å; N2-F4 PolarHBondContact O-N 2.88Å; N2-F4 PolarHBondContact OD1-N 3.42Å; F4-G8 PolarHBondContact O-N 3.07Å; F4-L161 HydrophobicContact CD1-CD2 4.49Å; F4-A164 HydrophobicContact CB-CB 4.42Å; F4-A164 HydrophobicContact CD1-CB 3.76Å; F4-A164 HydrophobicContact CE1-CB 4.15Å; F4-A164 HydrophobicContact CG-CB 4.03Å; F4-N165 HydrophobicContact CB-CB 3.78Å; F4-W168 HydrophobicContact CD2-CB 4.06Å; F4-W168 HydrophobicContact CD2-CD2 4.48Å; F4-W168 HydrophobicContact CD2-CG 4.27Å; F4-W168 HydrophobicContact CE2-CB 4.2Å; F4-W168 HydrophobicContact CE2-CD2 4.09Å; F4-W168 AromaticContact CE2-CE3 3.78Å; F4-W168 HydrophobicContact CE2-CE3 3.78Å; F4-W168 HydrophobicContact CE2-CG 4.29Å
5R89Confident91.3Very high78 Ų7847.9 Ų47.929%0.29425%0.251SS..Hα-helixtrans-63.2-46.1175.4-174.4172.3177.3173.91.3111.6M1 N2 G8 D9 N165M1-R5 HydrophobicContact SD-CB 4.4Å; M1-R5 HydrophobicContact SD-CG 4.02Å; N2-R5 PolarHBondContact O-N 2.83Å; N2-R5 PolarHBondContact OD1-N 3.15Å; R5-G8 PolarHBondContact O-N 3.2Å; R5-D9 VanDerWaalsContact O-CG 3.27Å; R5-D9 PolarHBondContact O-N 3.21Å; R5-N165 HydrophobicContact CB-CB 4.43Å
6L90.4Very high91.5Very high69 Ų6945.8 Ų45.836%0.36124%0.24SC..Hα-helixtrans-61.7-48.2179-178.565.5000111.4N2 I3 G8 D9 V10 Y59N2-L6 PolarHBondContact O-N 2.94Å; N2-L6 VanDerWaalsContact O-N 3.09Å; I3-L6 PolarHBondContact O-N 3.45Å; L6-G8 VanDerWaalsContact C-N 3.29Å; L6-G8 PolarHBondContact O-N 3.02Å; L6-D9 PolarHBondContact O-N 2.91Å; L6-V10 WeakPolarHBondContact O-CG2 3.36Å; L6-V10 PolarHBondContact O-N 2.83Å; L6-Y59 HydrophobicContact CD1-CE2 4.4Å; L6-Y59 WeakPolarHBondContact CD1-OH 3.37Å
7A92.7Very high91.7Very high39 Ų3946.8 Ų46.832%0.32225%0.245SC..Hα-helixtrans-62.5-37.8177.100000111.8I3 S11 L161I3-A7 VanDerWaalsContact O-CB 3.27Å; I3-A7 WeakPolarHBondContact O-CB 3.22Å; I3-A7 PolarHBondContact O-N 3.39Å; A7-S11 VanDerWaalsContact O-CB 3.31Å; A7-S11 WeakPolarHBondContact O-CB 3.32Å; A7-S11 PolarHBondContact O-N 3.37Å; A7-L161 HydrophobicContact CB-CD1 3.93Å; A7-L161 HydrophobicContact CB-CD2 4.43Å
8G92.9Very high91.8Very high0 Ų046.1 Ų46.10%024%0.241CC..Hα-helixtrans-60.4-53.1172.800000111.6F4 R5 L6 V10 S11 H12 Y158F4-G8 PolarHBondContact O-N 3.07Å; R5-G8 PolarHBondContact O-N 3.2Å; L6-G8 VanDerWaalsContact C-N 3.29Å; L6-G8 PolarHBondContact O-N 3.02Å; G8-V10 VanDerWaalsContact C-N 3.28Å; G8-V10 PolarHBondContact O-N 2.74Å; G8-S11 WeakPolarHBondContact O-CB 3.29Å; G8-S11 PolarHBondContact O-N 3.04Å; G8-S11 VanDerWaalsContact O-N 3.1Å; G8-H12 PolarHBondContact O-N 3.45Å; G8-Y158 VanDerWaalsContact O-CB 3.27Å; G8-Y158 WeakPolarHBondContact O-CB 3.28Å
9D91.2Very high92Very high19 Ų1943.8 Ų43.810%0.10223%0.229CC..Hα-helixtrans-58.2-41.4179.8-67.7-16000111.9R5 L6 H12 L13 M63 Y162R5-D9 VanDerWaalsContact O-CG 3.27Å; R5-D9 PolarHBondContact O-N 3.21Å; L6-D9 PolarHBondContact O-N 2.91Å; D9-H12 PolarHBondContact O-N 2.88Å; D9-L13 WeakPolarHBondContact O-CB 3.4Å; D9-L13 PolarHBondContact O-N 3.43Å; D9-M63 HydrophobicContact CB-CE 4.5Å; D9-Y162 WeakPolarHBondContact OD1-CE2 3.32Å; D9-Y162 PolarHBondContact OD1-OH 2.96Å
10V93.7Very high92.1Very high73 Ų7343.3 Ų43.344%0.44223%0.226SC..Hα-helixtrans-66.1-44.2175.3173.20000111.4L6 G8 H12 L13 V14L6-V10 WeakPolarHBondContact O-CG2 3.36Å; L6-V10 PolarHBondContact O-N 2.83Å; G8-V10 VanDerWaalsContact C-N 3.28Å; G8-V10 PolarHBondContact O-N 2.74Å; V10-H12 VanDerWaalsContact C-N 3.29Å; V10-H12 PolarHBondContact O-N 3.22Å; V10-L13 PolarHBondContact O-N 2.92Å; V10-V14 HydrophobicContact CG1-CG2 4.3Å; V10-V14 WeakPolarHBondContact O-CB 3.37Å; V10-V14 VanDerWaalsContact O-CG2 3.28Å; V10-V14 WeakPolarHBondContact O-CG2 3.21Å; V10-V14 PolarHBondContact O-N 3.48Å
11S94.6Very high92.2Very high7 Ų745.5 Ų45.55%0.04924%0.237CC..Hα-helixtrans-59.4-41.7176.3-174.40000111.5A7 G8 V14 A15 F154 Y158A7-S11 VanDerWaalsContact O-CB 3.31Å; A7-S11 WeakPolarHBondContact O-CB 3.32Å; A7-S11 PolarHBondContact O-N 3.37Å; G8-S11 WeakPolarHBondContact O-CB 3.29Å; G8-S11 PolarHBondContact O-N 3.04Å; G8-S11 VanDerWaalsContact O-N 3.1Å; S11-V14 PolarHBondContact O-N 3.36Å; S11-A15 PolarHBondContact O-N 3.43Å; S11-F154 PolarHBondContact OG-O 2.93Å; S11-Y158 PolarHBondContact OG-N 3.2Å
12H94.5Very high93.1Very high10 Ų1039.7 Ų39.75%0.04621%0.208CC..Hα-helixtrans-64.5-45.5176.8-165.6177.4000111.4G8 D9 V10 V14 A15 I16 F44 F67 E127 Y158G8-H12 PolarHBondContact O-N 3.45Å; D9-H12 PolarHBondContact O-N 2.88Å; V10-H12 VanDerWaalsContact C-N 3.29Å; V10-H12 PolarHBondContact O-N 3.22Å; H12-V14 VanDerWaalsContact C-N 3.33Å; H12-V14 PolarHBondContact O-N 2.89Å; H12-A15 WeakPolarHBondContact O-CB 3.5Å; H12-A15 PolarHBondContact O-N 3.37Å; H12-I16 PolarHBondContact O-N 3.09Å; H12-I16 VanDerWaalsContact O-N 3.16Å; H12-F44 AromaticContact CE1-CE1 3.9Å; H12-F44 AromaticContact CE1-CZ 3.54Å; H12-F44 AromaticContact NE2-CZ 3.77Å; H12-F67 HydrophobicContact CB-CE1 4.25Å; H12-F67 HydrophobicContact CB-CZ 4.23Å; H12-F67 AromaticContact CG-CE1 3.93Å; H12-E127 IonicContact CE1-OE1 3.76Å; H12-Y158 HydrophobicContact CB-CD1 4.21Å; H12-Y158 HydrophobicContact CB-CD2 3.84Å; H12-Y158 HydrophobicContact CB-CE2 4.24Å; H12-Y158 HydrophobicContact CB-CG 3.79Å; H12-Y158 AromaticContact CE1-CE2 3.8Å; H12-Y158 AromaticContact CE1-CZ 3.68Å; H12-Y158 AromaticContact CG-CD2 3.97Å; H12-Y158 AromaticContact CG-CE2 3.85Å; H12-Y158 AromaticContact ND1-CD2 3.88Å; H12-Y158 AromaticContact ND1-CE2 3.4Å; H12-Y158 WeakPolarHBondContact ND1-CE2 3.38Å; H12-Y158 AromaticContact ND1-CZ 3.72Å
13L94.7Very high93.3Very high35 Ų3538.6 Ų38.618%0.18320%0.202CC..Hα-helixtrans-60.3-43.8176.2179.761.5000111.7D9 V10 A15 I16 L17 M63 V66 F67 L70D9-L13 WeakPolarHBondContact O-CB 3.4Å; D9-L13 PolarHBondContact O-N 3.43Å; V10-L13 PolarHBondContact O-N 2.92Å; L13-A15 VanDerWaalsContact C-N 3.33Å; L13-A15 PolarHBondContact O-N 3.22Å; L13-I16 PolarHBondContact O-N 2.85Å; L13-L17 HydrophobicContact CD1-CD1 4.23Å; L13-L17 HydrophobicContact CD1-CG 4.24Å; L13-L17 HydrophobicContact CG-CD1 3.97Å; L13-L17 HydrophobicContact CG-CG 4.4Å; L13-L17 WeakPolarHBondContact O-CB 3.35Å; L13-L17 WeakPolarHBondContact O-CG 3.46Å; L13-L17 PolarHBondContact O-N 3.47Å; L13-M63 HydrophobicContact CB-CE 4.37Å; L13-M63 HydrophobicContact CD2-CE 4.12Å; L13-M63 HydrophobicContact CD2-SD 4.38Å; L13-V66 HydrophobicContact CD1-CG1 3.7Å; L13-F67 HydrophobicContact CB-CE1 4.37Å; L13-F67 HydrophobicContact CB-CZ 4.37Å; L13-L70 HydrophobicContact CD1-CD1 3.55Å
14V95.3Very high93.5Very high48 Ų4839.7 Ų39.729%0.29120%0.199SC..Hα-helixtrans-60-42.7176.4168.20000111.1V10 S11 H12 I16 L17 I18 F154V10-V14 HydrophobicContact CG1-CG2 4.3Å; V10-V14 WeakPolarHBondContact O-CB 3.37Å; V10-V14 VanDerWaalsContact O-CG2 3.28Å; V10-V14 WeakPolarHBondContact O-CG2 3.21Å; V10-V14 PolarHBondContact O-N 3.48Å; S11-V14 PolarHBondContact O-N 3.36Å; H12-V14 VanDerWaalsContact C-N 3.33Å; H12-V14 PolarHBondContact O-N 2.89Å; V14-I16 PolarHBondContact O-N 3.46Å; V14-L17 PolarHBondContact O-N 2.94Å; V14-I18 HydrophobicContact CG1-CD1 3.63Å; V14-I18 HydrophobicContact CG1-CG1 4.25Å; V14-I18 WeakPolarHBondContact O-CB 3.49Å; V14-I18 VanDerWaalsContact O-CG1 3.24Å; V14-I18 WeakPolarHBondContact O-CG1 3.43Å; V14-I18 PolarHBondContact O-N 2.84Å; V14-F154 HydrophobicContact CG1-CD1 3.99Å; V14-F154 HydrophobicContact CG1-CD2 3.92Å; V14-F154 HydrophobicContact CG1-CE1 4.05Å; V14-F154 HydrophobicContact CG1-CE2 3.99Å; V14-F154 HydrophobicContact CG1-CG 3.93Å; V14-F154 HydrophobicContact CG1-CZ 4.06Å
15A94Very high93.6Very high0 Ų046.3 Ų46.30%022%0.222CC..Hα-helixtrans-56.7-50.3176.100000111.5S11 H12 L13 L17 I18 L19 Y151 F154 L155S11-A15 PolarHBondContact O-N 3.43Å; H12-A15 WeakPolarHBondContact O-CB 3.5Å; H12-A15 PolarHBondContact O-N 3.37Å; L13-A15 VanDerWaalsContact C-N 3.33Å; L13-A15 PolarHBondContact O-N 3.22Å; A15-L17 PolarHBondContact O-N 3.39Å; A15-I18 PolarHBondContact O-N 2.86Å; A15-L19 PolarHBondContact O-N 3.24Å; A15-L19 VanDerWaalsContact O-N 3.08Å; A15-Y151 HydrophobicContact CB-CD2 4.04Å; A15-Y151 HydrophobicContact CB-CE2 4.48Å; A15-Y151 WeakPolarHBondContact O-CD2 3.44Å; A15-F154 HydrophobicContact CB-CB 3.71Å; A15-L155 HydrophobicContact CB-CB 4.17Å; A15-L155 HydrophobicContact CB-CD1 4.28Å
16I94.6Very high93.8Very high14 Ų1445.4 Ų45.47%0.07223%0.228CC..Hα-helixtrans-63.9-42.8-179.3-63.7171.3000111H12 L13 V14 L19 L20 F44 F67 L70H12-I16 PolarHBondContact O-N 3.09Å; H12-I16 VanDerWaalsContact O-N 3.16Å; L13-I16 PolarHBondContact O-N 2.85Å; V14-I16 PolarHBondContact O-N 3.46Å; I16-L19 PolarHBondContact O-N 3.43Å; I16-L20 WeakPolarHBondContact O-CB 3.26Å; I16-L20 PolarHBondContact O-N 2.93Å; I16-F44 HydrophobicContact CD1-CE2 4.12Å; I16-F44 HydrophobicContact CD1-CZ 4.14Å; I16-F67 HydrophobicContact CD1-CD1 3.47Å; I16-F67 VanDerWaalsContact CD1-CD1 3.47Å; I16-F67 HydrophobicContact CD1-CE1 3.67Å; I16-L70 HydrophobicContact CG2-CB 3.57Å; I16-L70 HydrophobicContact CG2-CD1 4.06Å; I16-L70 HydrophobicContact CG2-CG 4.43Å
17L95.2Very high94Very high63 Ų6347.2 Ų47.233%0.3323%0.233SC..Hα-helixtrans-64.2-40.5177.4-71.4174.6000112.2L13 V14 A15 L19 L20 M21 L70L13-L17 HydrophobicContact CD1-CD1 4.23Å; L13-L17 HydrophobicContact CD1-CG 4.24Å; L13-L17 HydrophobicContact CG-CD1 3.97Å; L13-L17 HydrophobicContact CG-CG 4.4Å; L13-L17 WeakPolarHBondContact O-CB 3.35Å; L13-L17 WeakPolarHBondContact O-CG 3.46Å; L13-L17 PolarHBondContact O-N 3.47Å; V14-L17 PolarHBondContact O-N 2.94Å; A15-L17 PolarHBondContact O-N 3.39Å; L17-L19 VanDerWaalsContact C-N 3.35Å; L17-L19 PolarHBondContact O-N 2.89Å; L17-L20 PolarHBondContact O-N 3.2Å; L17-M21 HydrophobicContact CB-CE 4.26Å; L17-M21 VanDerWaalsContact O-CB 3.24Å; L17-M21 WeakPolarHBondContact O-CB 3.43Å; L17-M21 WeakPolarHBondContact O-CE 3.24Å; L17-M21 VanDerWaalsContact O-CG 3.24Å; L17-M21 WeakPolarHBondContact O-CG 3.24Å; L17-M21 PolarHBondContact O-N 3.06Å; L17-L70 HydrophobicContact CD2-CD1 3.79Å; L17-L70 HydrophobicContact CD2-CD2 4.04Å; L17-L70 HydrophobicContact CG-CD1 4.25Å
18I93.8Very high94Very high33 Ų3346.9 Ų46.917%0.16923%0.228CC..Hα-helixtrans-59.3-47.6175.2-73.3167000110.3V14 A15 M21 K22 I147 F154V14-I18 HydrophobicContact CG1-CD1 3.63Å; V14-I18 HydrophobicContact CG1-CG1 4.25Å; V14-I18 WeakPolarHBondContact O-CB 3.49Å; V14-I18 VanDerWaalsContact O-CG1 3.24Å; V14-I18 WeakPolarHBondContact O-CG1 3.43Å; V14-I18 PolarHBondContact O-N 2.84Å; A15-I18 PolarHBondContact O-N 2.86Å; I18-M21 PolarHBondContact O-N 2.74Å; I18-K22 VanDerWaalsContact O-CB 3.32Å; I18-K22 WeakPolarHBondContact O-CB 3.43Å; I18-K22 PolarHBondContact O-N 2.87Å; I18-I147 HydrophobicContact CG2-CG2 4Å; I18-F154 HydrophobicContact CD1-CD2 3.39Å; I18-F154 HydrophobicContact CD1-CE2 3.52Å; I18-F154 HydrophobicContact CD1-CG 4.43Å
19L94.3Very high94Very high3 Ų346.9 Ų46.92%0.01623%0.228CC..Hα-helixtrans-62.3-48.2179.3179.461.5000111.7A15 I16 L17 M21 K22 I23 I32 Q37 T74 Y151A15-L19 PolarHBondContact O-N 3.24Å; A15-L19 VanDerWaalsContact O-N 3.08Å; I16-L19 PolarHBondContact O-N 3.43Å; L17-L19 VanDerWaalsContact C-N 3.35Å; L17-L19 PolarHBondContact O-N 2.89Å; L19-M21 PolarHBondContact O-N 2.9Å; L19-K22 WeakPolarHBondContact O-CB 3.35Å; L19-K22 PolarHBondContact O-N 3.45Å; L19-I23 HydrophobicContact CD1-CD1 4.09Å; L19-I23 HydrophobicContact CD1-CG1 4.46Å; L19-I23 HydrophobicContact CG-CD1 4.11Å; L19-I23 WeakPolarHBondContact O-CG1 3.37Å; L19-I23 PolarHBondContact O-N 3.05Å; L19-I32 HydrophobicContact CD1-CD1 3.57Å; L19-I32 HydrophobicContact CD1-CG1 3.9Å; L19-I32 HydrophobicContact CD1-CG2 4.06Å; L19-Q37 VanDerWaalsContact CD2-CD 3.46Å; L19-Q37 HydrophobicContact CD2-CG 4.35Å; L19-T74 HydrophobicContact CD2-CG2 3.99Å; L19-T74 HydrophobicContact CG-CG2 4.35Å; L19-Y151 HydrophobicContact CB-CD2 3.93Å; L19-Y151 HydrophobicContact CB-CE2 4.33Å; L19-Y151 HydrophobicContact CB-CG 4.22Å; L19-Y151 HydrophobicContact CD2-CD2 4.4Å; L19-Y151 HydrophobicContact CD2-CE1 4.48Å; L19-Y151 HydrophobicContact CD2-CE2 4.01Å
20L94.5Very high93.9Very high33 Ų3347.7 Ų47.717%0.17324%0.237CC..Hα-helixtrans-62.4-45.3179.8-167.979.6000111.3I16 L17 K22 I23 W24 L70 A73 T74 L77I16-L20 WeakPolarHBondContact O-CB 3.26Å; I16-L20 PolarHBondContact O-N 2.93Å; L17-L20 PolarHBondContact O-N 3.2Å; L20-K22 VanDerWaalsContact C-N 3.32Å; L20-K22 PolarHBondContact O-N 3.46Å; L20-I23 PolarHBondContact O-N 3.48Å; L20-W24 VanDerWaalsContact O-CB 3.32Å; L20-W24 WeakPolarHBondContact O-CB 3.17Å; L20-W24 PolarHBondContact O-N 3.46Å; L20-L70 HydrophobicContact CD2-CD2 3.78Å; L20-A73 HydrophobicContact CD1-CB 4.13Å; L20-T74 WeakPolarHBondContact CD1-OG1 3.34Å; L20-L77 HydrophobicContact CD1-CD1 3.57Å; L20-L77 HydrophobicContact CD1-CG 4.44Å; L20-L77 HydrophobicContact CG-CD1 4.27Å
21M93.9Very high93.6Very high90 Ų9045.4 Ų45.444%0.44323%0.229SC..Hα-helixtrans-62.9-38.5176.3-76.1-170.3-70.600112L17 I18 L19 W24 R25L17-M21 HydrophobicContact CB-CE 4.26Å; L17-M21 VanDerWaalsContact O-CB 3.24Å; L17-M21 WeakPolarHBondContact O-CB 3.43Å; L17-M21 WeakPolarHBondContact O-CE 3.24Å; L17-M21 VanDerWaalsContact O-CG 3.24Å; L17-M21 WeakPolarHBondContact O-CG 3.24Å; L17-M21 PolarHBondContact O-N 3.06Å; I18-M21 PolarHBondContact O-N 2.74Å; L19-M21 PolarHBondContact O-N 2.9Å; M21-W24 PolarHBondContact O-N 3.32Å; M21-R25 VanDerWaalsContact O-CB 3.29Å; M21-R25 WeakPolarHBondContact O-CB 3.34Å; M21-R25 WeakPolarHBondContact O-CG 3.46Å; M21-R25 PolarHBondContact O-N 2.94Å
22K93.2Very high93.6Very high14 Ų1445.1 Ų45.16%0.06123%0.226CC..Hα-helixtrans-56-57174.4-176.9-98-177.41700109.9I18 L19 L20 W24 R25 S26 A30 E145 I147I18-K22 VanDerWaalsContact O-CB 3.32Å; I18-K22 WeakPolarHBondContact O-CB 3.43Å; I18-K22 PolarHBondContact O-N 2.87Å; L19-K22 WeakPolarHBondContact O-CB 3.35Å; L19-K22 PolarHBondContact O-N 3.45Å; L20-K22 VanDerWaalsContact C-N 3.32Å; L20-K22 PolarHBondContact O-N 3.46Å; K22-W24 VanDerWaalsContact C-N 3.32Å; K22-W24 PolarHBondContact O-N 3.35Å; K22-R25 PolarHBondContact O-N 3.18Å; K22-S26 WeakPolarHBondContact O-CB 3.32Å; K22-S26 PolarHBondContact O-N 3.37Å; K22-S26 PolarHBondContact O-OG 3.01Å; K22-A30 PolarHBondContact NZ-O 3.24Å; K22-E145 WeakPolarHBondContact CE-OE2 3.35Å; K22-E145 IonicContact NZ-OE2 3.38Å; K22-E145 PolarHBondContact NZ-OE2 3.28Å; K22-I147 HydrophobicContact CB-CG2 3.72Å; K22-I147 HydrophobicContact CG-CB 4.12Å; K22-I147 HydrophobicContact CG-CD1 4.36Å; K22-I147 HydrophobicContact CG-CG2 3.6Å
23I94.7Very high93.6Very high0 Ų044.6 Ų44.60%022%0.224CC..Hα-helixtrans-61-42.8-178.3-61.8165.9000110.8L19 L20 K27 S28 C29 T74 L77 I78 F82L19-I23 HydrophobicContact CD1-CD1 4.09Å; L19-I23 HydrophobicContact CD1-CG1 4.46Å; L19-I23 HydrophobicContact CG-CD1 4.11Å; L19-I23 WeakPolarHBondContact O-CG1 3.37Å; L19-I23 PolarHBondContact O-N 3.05Å; L20-I23 PolarHBondContact O-N 3.48Å; I23-K27 WeakPolarHBondContact O-CA 3.48Å; I23-K27 PolarHBondContact O-N 3.38Å; I23-S28 PolarHBondContact O-N 3.31Å; I23-C29 HydrophobicContact CG1-CB 4.4Å; I23-C29 HydrophobicContact CG2-CB 4.28Å; I23-T74 HydrophobicContact CD1-CG2 4.02Å; I23-L77 HydrophobicContact CB-CD1 4.36Å; I23-L77 HydrophobicContact CG2-CB 3.89Å; I23-L77 HydrophobicContact CG2-CD1 3.98Å; I23-I78 HydrophobicContact CD1-CD1 4.33Å; I23-I78 HydrophobicContact CD1-CG1 4.13Å; I23-F82 HydrophobicContact CG2-CD2 3.57Å; I23-F82 HydrophobicContact CG2-CE2 3.98Å
24W94.4Very high93.7Very high141 Ų14143 Ų4353%0.53422%0.215SC..Hα-helixtrans-68.3-39.9-178.2-175.9-97.6000113.7L20 M21 K22 K27 L77L20-W24 VanDerWaalsContact O-CB 3.32Å; L20-W24 WeakPolarHBondContact O-CB 3.17Å; L20-W24 PolarHBondContact O-N 3.46Å; M21-W24 PolarHBondContact O-N 3.32Å; K22-W24 VanDerWaalsContact C-N 3.32Å; K22-W24 PolarHBondContact O-N 3.35Å; W24-K27 VanDerWaalsContact O-CD 3.28Å; W24-K27 WeakPolarHBondContact O-CD 3.33Å; W24-K27 WeakPolarHBondContact O-CE 2.88Å; W24-K27 PolarHBondContact O-NZ 2.98Å; W24-L77 HydrophobicContact CE3-CD1 4.36Å; W24-L77 HydrophobicContact CE3-CD2 4.08Å; W24-L77 HydrophobicContact CZ3-CD2 4.21Å
25R94.1Very high93.8Very high203 Ų20343.3 Ų43.377%0.76621%0.213SC*.Hα-helixtrans-79.1-41.5-178.8-72.3-173.9177.3-171.20.6112.1M21 K22 K27M21-R25 VanDerWaalsContact O-CB 3.29Å; M21-R25 WeakPolarHBondContact O-CB 3.34Å; M21-R25 WeakPolarHBondContact O-CG 3.46Å; M21-R25 PolarHBondContact O-N 2.94Å; K22-R25 PolarHBondContact O-N 3.18Å; R25-K27 PolarHBondContact O-N 3.46Å
26S92.9Very high93.9Very high60 Ų6043.3 Ų43.342%0.4221%0.213SC..Hα-helixtrans-75.1-15.8177.268.10000113.1K22 S28K22-S26 WeakPolarHBondContact O-CB 3.32Å; K22-S26 PolarHBondContact O-N 3.37Å; K22-S26 PolarHBondContact O-OG 3.01Å; S26-S28 PolarHBondContact O-N 3.34Å; S26-S28 PolarHBondContact OG-N 3.17Å; S26-S28 VanDerWaalsContact OG-N 3.15Å; S26-S28 PolarHBondContact OG-O 3.48Å
27K94.2Very high94.1Very high107 Ų10743 Ų4347%0.46521%0.211SC..THydrogen-bonded Turntrans54.829.1-170.1-54.2-62.3178.3-1570112.4I23 W24 R25 F82I23-K27 WeakPolarHBondContact O-CA 3.48Å; I23-K27 PolarHBondContact O-N 3.38Å; W24-K27 VanDerWaalsContact O-CD 3.28Å; W24-K27 WeakPolarHBondContact O-CD 3.33Å; W24-K27 WeakPolarHBondContact O-CE 2.88Å; W24-K27 PolarHBondContact O-NZ 2.98Å; R25-K27 PolarHBondContact O-N 3.46Å; K27-F82 HydrophobicContact CB-CD1 4.27Å; K27-F82 HydrophobicContact CB-CE1 3.69Å; K27-F82 HydrophobicContact CB-CZ 4.2Å; K27-F82 HydrophobicContact CD-CE1 3.65Å; K27-F82 HydrophobicContact CD-CZ 3.51Å; K27-F82 HydrophobicContact CG-CE1 4.28Å; K27-F82 HydrophobicContact CG-CZ 4.48Å; K27-F82 WeakPolarHBondContact O-CD1 3.39Å
28S92.8Very high94.2Very high32 Ų3243 Ų4322%0.22421%0.214CC..  trans-148.8136.1-174.9173.80000111.6I23 S26 A30 S85I23-S28 PolarHBondContact O-N 3.31Å; S26-S28 PolarHBondContact O-N 3.34Å; S26-S28 PolarHBondContact OG-N 3.17Å; S26-S28 VanDerWaalsContact OG-N 3.15Å; S26-S28 PolarHBondContact OG-O 3.48Å; S28-A30 WeakPolarHBondContact OG-CB 3.47Å; S28-A30 PolarHBondContact OG-N 2.74Å; S28-S85 WeakPolarHBondContact CA-OG 3.36Å; S28-S85 WeakPolarHBondContact OG-CB 3.3Å
29C92.7Very high94.4Very high0 Ų041.7 Ų41.70%021%0.207CC..  trans-102.417.2171.7580000113.4I23 G31 I32 I78 F82 S85I23-C29 HydrophobicContact CG1-CB 4.4Å; I23-C29 HydrophobicContact CG2-CB 4.28Å; C29-G31 PolarHBondContact O-N 2.89Å; C29-I32 WeakPolarHBondContact O-CB 3.47Å; C29-I32 PolarHBondContact O-N 3.27Å; C29-I78 HydrophobicContact CB-CB 4.49Å; C29-I78 HydrophobicContact CB-CG1 3.87Å; C29-F82 PolarHBondContact SG-O 3.24Å; C29-F82 VanDerWaalsContact SG-O 3.37Å; C29-S85 PolarHBondContact N-OG 3.45Å; C29-S85 PolarHBondContact SG-OG 3.44Å
30A90.1Very high94.6Very high35 Ų3541.9 Ų41.929%0.28921%0.208SC..THydrogen-bonded Turntrans-54.5137.8175.700000111.8K22 S28 I32 S85K22-A30 PolarHBondContact NZ-O 3.24Å; S28-A30 WeakPolarHBondContact OG-CB 3.47Å; S28-A30 PolarHBondContact OG-N 2.74Å; A30-I32 VanDerWaalsContact C-N 3.27Å; A30-I32 PolarHBondContact O-N 3.25Å; A30-S85 WeakPolarHBondContact CA-O 3.44Å; A30-S85 PolarHBondContact N-O 3.49Å
31G87.8Confident94.8Very high26 Ų2640.6 Ų40.627%0.26820%0.202SC..THydrogen-bonded Turntrans74.76-178.800000115.7C29 Q134C29-G31 PolarHBondContact O-N 2.89Å; G31-Q134 PolarHBondContact O-NE2 3.48Å
32I93Very high95Very high0 Ų039.3 Ų39.30%020%0.196CC..  trans-108.6126.3176.2-53.4-57.1000109.6L19 C29 A30 G34 Q37 I78 T148L19-I32 HydrophobicContact CD1-CD1 3.57Å; L19-I32 HydrophobicContact CD1-CG1 3.9Å; L19-I32 HydrophobicContact CD1-CG2 4.06Å; C29-I32 WeakPolarHBondContact O-CB 3.47Å; C29-I32 PolarHBondContact O-N 3.27Å; A30-I32 VanDerWaalsContact C-N 3.27Å; A30-I32 PolarHBondContact O-N 3.25Å; I32-G34 PolarHBondContact O-N 3.11Å; I32-Q37 HydrophobicContact CG2-CG 4.29Å; I32-I78 HydrophobicContact CG2-CD1 3.98Å; I32-T148 HydrophobicContact CD1-CG2 3.83Å
33S95.1Very high95.2Very high0 Ų038.6 Ų38.60%019%0.193CC..  trans-73.5115.5173.3171.90000109.4K35 S36 Q37 D91 P133S33-K35 VanDerWaalsContact C-N 3.27Å; S33-K35 PolarHBondContact OG-N 2.9Å; S33-S36 PolarHBondContact OG-N 3.34Å; S33-Q37 PolarHBondContact O-N 3.5Å; S33-D91 WeakPolarHBondContact CA-OD2 3.45Å; S33-D91 PolarHBondContact OG-OD1 3.03Å; S33-D91 PolarHBondContact OG-OD2 3.5Å; S33-P133 VanDerWaalsContact OG-CB 3.26Å; S33-P133 WeakPolarHBondContact OG-CB 3.46Å
34G96.6Very high95.4Very high0 Ų038.7 Ų38.70%019%0.194CC..Hα-helixtrans-68.2-33.3174.100000110.8I32 S36 Q37 V38 Y79 D91I32-G34 PolarHBondContact O-N 3.11Å; G34-S36 PolarHBondContact O-N 3.42Å; G34-Q37 PolarHBondContact O-N 3.33Å; G34-Q37 VanDerWaalsContact O-N 3.15Å; G34-V38 WeakPolarHBondContact O-CG2 3.4Å; G34-V38 PolarHBondContact O-N 3.47Å; G34-Y79 VanDerWaalsContact CA-OH 3.31Å; G34-Y79 WeakPolarHBondContact CA-OH 3.42Å; G34-D91 PolarHBondContact N-OD2 3.16Å
35K97.7Very high95.6Very high55 Ų5534 Ų3424%0.23918%0.18CC..Hα-helixtrans-58.7-47.8176.3-72.1174.9174.7171.50111.7S33 Q37 V38 L39 Y79 D91 F93 V95 P133S33-K35 VanDerWaalsContact C-N 3.27Å; S33-K35 PolarHBondContact OG-N 2.9Å; K35-Q37 VanDerWaalsContact C-N 3.31Å; K35-Q37 PolarHBondContact O-N 3.08Å; K35-V38 PolarHBondContact O-N 3.34Å; K35-L39 WeakPolarHBondContact O-CG 3.31Å; K35-L39 PolarHBondContact O-N 3.45Å; K35-Y79 PolarHBondContact N-OH 3.18Å; K35-D91 VanDerWaalsContact CE-O 3.28Å; K35-D91 WeakPolarHBondContact CE-O 3.48Å; K35-D91 PolarHBondContact N-OD2 3.39Å; K35-D91 VanDerWaalsContact N-OD2 3.08Å; K35-D91 PolarHBondContact NZ-O 3.34Å; K35-F93 VanDerWaalsContact CD-O 3.29Å; K35-F93 WeakPolarHBondContact CD-O 3.42Å; K35-F93 WeakPolarHBondContact CE-O 3.2Å; K35-F93 PolarHBondContact NZ-O 2.91Å; K35-V95 HydrophobicContact CB-CG1 3.95Å; K35-V95 HydrophobicContact CD-CG1 4.03Å; K35-V95 HydrophobicContact CG-CG1 4.15Å; K35-P133 HydrophobicContact CB-CB 3.83Å; K35-P133 HydrophobicContact CB-CG 4.14Å
36S96.6Very high95.7Very high0 Ų025 Ų250%015%0.148CC..Hα-helixtrans-58.6-41.7174.8-84.20000112.6S33 G34 V38 L39 F40 A130 P133 Q134S33-S36 PolarHBondContact OG-N 3.34Å; G34-S36 PolarHBondContact O-N 3.42Å; S36-V38 VanDerWaalsContact C-N 3.35Å; S36-V38 PolarHBondContact O-N 3.46Å; S36-L39 PolarHBondContact O-N 3.28Å; S36-F40 WeakPolarHBondContact O-CD2 3.27Å; S36-F40 PolarHBondContact O-N 2.98Å; S36-A130 WeakPolarHBondContact CA-O 3.32Å; S36-A130 VanDerWaalsContact CB-O 3.3Å; S36-A130 WeakPolarHBondContact CB-O 3.32Å; S36-A130 PolarHBondContact OG-O 3.44Å; S36-P133 WeakPolarHBondContact OG-CB 3.48Å; S36-P133 WeakPolarHBondContact OG-CD 3.24Å; S36-Q134 PolarHBondContact OG-N 2.93Å
37Q97.9Very high95.9Very high9 Ų923.6 Ų23.64%0.04213%0.134CC..Hα-helixtrans-66.9-35.9179.5-60.4-51.8-49.800112.6L19 I32 S33 G34 K35 F40 A41 T74 V75 I78 Y151L19-Q37 VanDerWaalsContact CD2-CD 3.46Å; L19-Q37 HydrophobicContact CD2-CG 4.35Å; I32-Q37 HydrophobicContact CG2-CG 4.29Å; S33-Q37 PolarHBondContact O-N 3.5Å; G34-Q37 PolarHBondContact O-N 3.33Å; G34-Q37 VanDerWaalsContact O-N 3.15Å; K35-Q37 VanDerWaalsContact C-N 3.31Å; K35-Q37 PolarHBondContact O-N 3.08Å; Q37-F40 PolarHBondContact O-N 3.31Å; Q37-A41 WeakPolarHBondContact O-CB 3.37Å; Q37-A41 PolarHBondContact O-N 2.87Å; Q37-T74 HydrophobicContact CB-CG2 4.4Å; Q37-T74 HydrophobicContact CG-CG2 3.96Å; Q37-V75 HydrophobicContact CB-CG2 4.1Å; Q37-I78 HydrophobicContact CB-CD1 4.07Å; Q37-I78 HydrophobicContact CG-CD1 3.63Å; Q37-Y151 PolarHBondContact NE2-OH 3.09Å
38V98.4Very high96Very high62 Ų6220 Ų2038%0.37612%0.117SC..Hα-helixtrans-64.4-42.5172.1171.10000111G34 K35 S36 A41 L42 V75 Y79G34-V38 WeakPolarHBondContact O-CG2 3.4Å; G34-V38 PolarHBondContact O-N 3.47Å; K35-V38 PolarHBondContact O-N 3.34Å; S36-V38 VanDerWaalsContact C-N 3.35Å; S36-V38 PolarHBondContact O-N 3.46Å; V38-A41 PolarHBondContact O-N 3.24Å; V38-L42 WeakPolarHBondContact O-CB 3.38Å; V38-L42 PolarHBondContact O-N 3.12Å; V38-V75 HydrophobicContact CG2-CG1 4.06Å; V38-V75 HydrophobicContact CG2-CG2 4.19Å; V38-Y79 HydrophobicContact CG2-CD2 4.39Å; V38-Y79 HydrophobicContact CG2-CE2 3.65Å
39L98.3Very high96.1Very high5 Ų521.2 Ų21.23%0.02612%0.121CC..Hα-helixtrans-63.4-42.7176.3-63.7-177.9000111.7K35 S36 L42 V43 V95 L98 L99 L126 A130 P133K35-L39 WeakPolarHBondContact O-CG 3.31Å; K35-L39 PolarHBondContact O-N 3.45Å; S36-L39 PolarHBondContact O-N 3.28Å; L39-L42 PolarHBondContact O-N 3.09Å; L39-V43 WeakPolarHBondContact O-CG2 3.46Å; L39-V43 PolarHBondContact O-N 3.41Å; L39-V95 HydrophobicContact CD1-CG1 4.32Å; L39-L98 HydrophobicContact CD1-CD1 3.88Å; L39-L99 HydrophobicContact CD2-CD2 4.08Å; L39-L99 HydrophobicContact CD2-CG 4.4Å; L39-L126 HydrophobicContact CD2-CD1 4.24Å; L39-A130 HydrophobicContact CB-CB 3.81Å; L39-P133 HydrophobicContact CD1-CG 4.04Å
40F97.6Very high96Very high8 Ų823.2 Ų23.24%0.03513%0.132CC..Hα-helixtrans-63.9-40.4174.8-73.8-55.7000112.8S36 Q37 L42 V43 F44 E127 A130 I131 L155S36-F40 WeakPolarHBondContact O-CD2 3.27Å; S36-F40 PolarHBondContact O-N 2.98Å; Q37-F40 PolarHBondContact O-N 3.31Å; F40-L42 VanDerWaalsContact C-N 3.33Å; F40-L42 PolarHBondContact O-N 3.17Å; F40-V43 WeakPolarHBondContact O-CB 3.41Å; F40-V43 PolarHBondContact O-N 3.03Å; F40-F44 WeakPolarHBondContact O-CD2 3.26Å; F40-F44 PolarHBondContact O-N 3.33Å; F40-F44 VanDerWaalsContact O-N 3.09Å; F40-E127 HydrophobicContact CE1-CG 4.49Å; F40-A130 HydrophobicContact CD1-CB 3.81Å; F40-A130 HydrophobicContact CE1-CB 3.62Å; F40-A130 HydrophobicContact CG-CB 4.32Å; F40-A130 HydrophobicContact CZ-CB 3.99Å; F40-I131 HydrophobicContact CE2-CD1 3.96Å; F40-I131 HydrophobicContact CZ-CB 4.18Å; F40-I131 HydrophobicContact CZ-CD1 4.03Å; F40-L155 HydrophobicContact CE2-CD2 4.3Å; F40-L155 HydrophobicContact CZ-CD2 3.98Å
41A98.3Very high96.1Very high6 Ų623.3 Ų23.35%0.0513%0.127CC..Hα-helixtrans-60.4-44.317300000111Q37 V38 V43 F44 T45 V75Q37-A41 WeakPolarHBondContact O-CB 3.37Å; Q37-A41 PolarHBondContact O-N 2.87Å; V38-A41 PolarHBondContact O-N 3.24Å; A41-V43 VanDerWaalsContact C-N 3.35Å; A41-V43 PolarHBondContact O-N 3.35Å; A41-F44 PolarHBondContact O-N 2.83Å; A41-T45 WeakPolarHBondContact O-CB 3.46Å; A41-T45 PolarHBondContact O-N 2.86Å; A41-T45 PolarHBondContact O-OG1 2.76Å; A41-V75 HydrophobicContact CB-CG2 4.12Å
42L98.4Very high96.1Very high62 Ų6230.7 Ų30.733%0.32515%0.152SC..Hα-helixtrans-62.6-38.6176.7-177.361.1000112.7V38 L39 F40 T45 T46 L99 F122 L126V38-L42 WeakPolarHBondContact O-CB 3.38Å; V38-L42 PolarHBondContact O-N 3.12Å; L39-L42 PolarHBondContact O-N 3.09Å; F40-L42 VanDerWaalsContact C-N 3.33Å; F40-L42 PolarHBondContact O-N 3.17Å; L42-T45 PolarHBondContact O-N 3.27Å; L42-T46 HydrophobicContact CD1-CG2 4.06Å; L42-T46 WeakPolarHBondContact O-CG2 3.38Å; L42-T46 PolarHBondContact O-N 3.44Å; L42-T46 PolarHBondContact O-OG1 2.87Å; L42-L99 HydrophobicContact CD2-CD2 4.13Å; L42-F122 HydrophobicContact CD2-CE1 4.2Å; L42-F122 HydrophobicContact CD2-CZ 3.98Å; L42-F122 HydrophobicContact CG-CE1 4.11Å; L42-F122 HydrophobicContact CG-CZ 4.4Å; L42-L126 HydrophobicContact CB-CD2 4.23Å; L42-L126 HydrophobicContact CD2-CD2 3.81Å; L42-L126 HydrophobicContact CG-CD2 3.99Å
43V98.3Very high95.9Very high0 Ų035.1 Ų35.10%018%0.179CC..Hα-helixtrans-56.6-53.6172.5164.70000110.4L39 F40 A41 T45 T46 R47 L126 E127L39-V43 WeakPolarHBondContact O-CG2 3.46Å; L39-V43 PolarHBondContact O-N 3.41Å; F40-V43 WeakPolarHBondContact O-CB 3.41Å; F40-V43 PolarHBondContact O-N 3.03Å; A41-V43 VanDerWaalsContact C-N 3.35Å; A41-V43 PolarHBondContact O-N 3.35Å; V43-T45 VanDerWaalsContact C-N 3.34Å; V43-T45 PolarHBondContact O-N 2.97Å; V43-T46 PolarHBondContact O-N 3.01Å; V43-T46 PolarHBondContact O-OG1 2.91Å; V43-R47 WeakPolarHBondContact O-CB 3.44Å; V43-R47 PolarHBondContact O-N 3.38Å; V43-L126 HydrophobicContact CG2-CB 3.86Å; V43-L126 HydrophobicContact CG2-CD2 3.8Å; V43-L126 HydrophobicContact CG2-CG 3.71Å; V43-E127 HydrophobicContact CG1-CB 3.81Å; V43-E127 HydrophobicContact CG1-CG 4.06Å; V43-E127 HydrophobicContact CG2-CB 3.89Å
44F97.8Very high95.6Very high2 Ų238.5 Ų38.51%0.00920%0.2CC..Hα-helixtrans-65.6-39.1-178.2-64.3-48.6000112.1H12 I16 F40 A41 T46 R47 Y48 F67 L68H12-F44 AromaticContact CE1-CE1 3.9Å; H12-F44 AromaticContact CE1-CZ 3.54Å; H12-F44 AromaticContact NE2-CZ 3.77Å; I16-F44 HydrophobicContact CD1-CE2 4.12Å; I16-F44 HydrophobicContact CD1-CZ 4.14Å; F40-F44 WeakPolarHBondContact O-CD2 3.26Å; F40-F44 PolarHBondContact O-N 3.33Å; F40-F44 VanDerWaalsContact O-N 3.09Å; A41-F44 PolarHBondContact O-N 2.83Å; F44-T46 PolarHBondContact O-N 3.02Å; F44-R47 PolarHBondContact O-N 2.77Å; F44-Y48 HydrophobicContact CB-CD2 3.96Å; F44-Y48 HydrophobicContact CB-CE2 3.87Å; F44-Y48 HydrophobicContact CD1-CD2 4.31Å; F44-Y48 AromaticContact CD1-CE2 3.4Å; F44-Y48 HydrophobicContact CD1-CE2 3.4Å; F44-Y48 VanDerWaalsContact CD1-CE2 3.4Å; F44-Y48 AromaticContact CD1-CZ 3.75Å; F44-Y48 HydrophobicContact CE1-CE2 4.26Å; F44-Y48 AromaticContact CG-CE2 3.95Å; F44-Y48 HydrophobicContact CG-CE2 3.95Å; F44-Y48 VanDerWaalsContact O-CB 3.3Å; F44-Y48 WeakPolarHBondContact O-CB 3.45Å; F44-Y48 VanDerWaalsContact O-CD2 3.32Å; F44-Y48 WeakPolarHBondContact O-CD2 3.31Å; F44-Y48 PolarHBondContact O-N 3.3Å; F44-F67 HydrophobicContact CD1-CB 4.22Å; F44-F67 HydrophobicContact CD2-CB 4.38Å; F44-F67 HydrophobicContact CE1-CB 4.25Å; F44-F67 HydrophobicContact CE1-CD1 4.27Å; F44-F67 HydrophobicContact CE1-CG 4.25Å; F44-F67 HydrophobicContact CE2-CB 4.41Å; F44-F67 HydrophobicContact CE2-CD1 4.41Å; F44-F67 HydrophobicContact CG-CB 4.28Å; F44-F67 HydrophobicContact CZ-CB 4.34Å; F44-F67 AromaticContact CZ-CD1 3.92Å; F44-F67 HydrophobicContact CZ-CD1 3.92Å; F44-F67 HydrophobicContact CZ-CG 4.31Å; F44-L68 HydrophobicContact CB-CD2 3.86Å; F44-L68 HydrophobicContact CB-CG 4.37Å
45T98.2Very high95.4Very high41 Ų4146.5 Ų46.525%0.25223%0.231SC..Hα-helixtrans-61.7-44.8178.3-62.60000112.1A41 L42 V43 L49 Y72A41-T45 WeakPolarHBondContact O-CB 3.46Å; A41-T45 PolarHBondContact O-N 2.86Å; A41-T45 PolarHBondContact O-OG1 2.76Å; L42-T45 PolarHBondContact O-N 3.27Å; V43-T45 VanDerWaalsContact C-N 3.34Å; V43-T45 PolarHBondContact O-N 2.97Å; T45-L49 WeakPolarHBondContact O-CD2 3.33Å; T45-L49 VanDerWaalsContact O-CG 3.32Å; T45-L49 WeakPolarHBondContact O-CG 3.31Å; T45-Y72 WeakPolarHBondContact OG1-CE2 3.42Å; T45-Y72 PolarHBondContact OG1-OH 2.94Å
46T97.7Very high95.1Very high15 Ų1548.9 Ų48.99%0.09225%0.246CC..Hα-helixtrans-76-36.5179.750.70000112.5L42 V43 F44 L119 F122 S123L42-T46 HydrophobicContact CD1-CG2 4.06Å; L42-T46 WeakPolarHBondContact O-CG2 3.38Å; L42-T46 PolarHBondContact O-N 3.44Å; L42-T46 PolarHBondContact O-OG1 2.87Å; V43-T46 PolarHBondContact O-N 3.01Å; V43-T46 PolarHBondContact O-OG1 2.91Å; F44-T46 PolarHBondContact O-N 3.02Å; T46-L119 HydrophobicContact CG2-CD2 3.97Å; T46-F122 HydrophobicContact CG2-CD1 3.93Å; T46-F122 HydrophobicContact CG2-CE1 3.88Å; T46-S123 WeakPolarHBondContact OG1-CB 3.35Å
47R97.1Very high94.9Very high31 Ų3150.8 Ų50.812%0.11726%0.259CS..Hα-helixtrans-68.7-36.3179.7-168.5170.3-66.9170.2-3.1113.9V43 F44 S123 E127V43-R47 WeakPolarHBondContact O-CB 3.44Å; V43-R47 PolarHBondContact O-N 3.38Å; F44-R47 PolarHBondContact O-N 2.77Å; R47-S123 WeakPolarHBondContact CB-OG 3.47Å; R47-S123 PolarHBondContact NE-OG 2.79Å; R47-S123 VanDerWaalsContact NH2-C 3.31Å; R47-S123 PolarHBondContact NH2-O 2.82Å; R47-E127 IonicContact CZ-OE2 3.15Å; R47-E127 IonicContact NH1-OE1 2.7Å; R47-E127 PolarHBondContact NH1-OE1 3.15Å; R47-E127 IonicContact NH1-OE2 2.67Å; R47-E127 PolarHBondContact NH1-OE2 3.46Å; R47-E127 IonicContact NH2-OE2 2.71Å; R47-E127 PolarHBondContact NH2-OE2 3.49Å
48Y96.5Very high94.6Very high31 Ų3153.1 Ų53.112%0.12228%0.279CS..THydrogen-bonded Turntrans-102.418.3-169.9-56.7-30.7000113.6F44 D50 L51 K64 F67 L68F44-Y48 HydrophobicContact CB-CD2 3.96Å; F44-Y48 HydrophobicContact CB-CE2 3.87Å; F44-Y48 HydrophobicContact CD1-CD2 4.31Å; F44-Y48 AromaticContact CD1-CE2 3.4Å; F44-Y48 HydrophobicContact CD1-CE2 3.4Å; F44-Y48 VanDerWaalsContact CD1-CE2 3.4Å; F44-Y48 AromaticContact CD1-CZ 3.75Å; F44-Y48 HydrophobicContact CE1-CE2 4.26Å; F44-Y48 AromaticContact CG-CE2 3.95Å; F44-Y48 HydrophobicContact CG-CE2 3.95Å; F44-Y48 VanDerWaalsContact O-CB 3.3Å; F44-Y48 WeakPolarHBondContact O-CB 3.45Å; F44-Y48 VanDerWaalsContact O-CD2 3.32Å; F44-Y48 WeakPolarHBondContact O-CD2 3.31Å; F44-Y48 PolarHBondContact O-N 3.3Å; Y48-D50 WeakPolarHBondContact CA-OD1 3.36Å; Y48-D50 PolarHBondContact O-N 3.05Å; Y48-L51 WeakPolarHBondContact O-CB 3.49Å; Y48-L51 VanDerWaalsContact O-CG 3.32Å; Y48-L51 WeakPolarHBondContact O-CG 3.43Å; Y48-L51 PolarHBondContact O-N 3.25Å; Y48-K64 HydrophobicContact CD1-CB 4.35Å; Y48-K64 HydrophobicContact CD1-CD 3.71Å; Y48-K64 HydrophobicContact CD1-CG 3.61Å; Y48-K64 HydrophobicContact CD2-CB 3.88Å; Y48-K64 HydrophobicContact CD2-CG 4Å; Y48-K64 HydrophobicContact CE1-CD 4.31Å; Y48-K64 HydrophobicContact CE1-CG 3.81Å; Y48-K64 HydrophobicContact CE2-CB 4.25Å; Y48-K64 HydrophobicContact CE2-CG 4.18Å; Y48-K64 HydrophobicContact CG-CB 3.94Å; Y48-K64 HydrophobicContact CG-CD 3.91Å; Y48-K64 HydrophobicContact CG-CG 3.72Å; Y48-F67 HydrophobicContact CE2-CB 3.92Å; Y48-F67 HydrophobicContact CE2-CD2 4.45Å; Y48-L68 HydrophobicContact CD2-CD1 4.32Å; Y48-L68 HydrophobicContact CD2-CG 4.13Å
49L94.4Very high94.2Very high57 Ų5754.3 Ų54.330%0.29828%0.278SS..G310 helixtrans-59.9-23.9171.2-68.1177.3000112.6T45 L51 F52 L116 L119T45-L49 WeakPolarHBondContact O-CD2 3.33Å; T45-L49 VanDerWaalsContact O-CG 3.32Å; T45-L49 WeakPolarHBondContact O-CG 3.31Å; L49-L51 PolarHBondContact O-N 2.95Å; L49-F52 PolarHBondContact O-N 3.27Å; L49-L116 HydrophobicContact CB-CD2 3.84Å; L49-L119 HydrophobicContact CD1-CB 4.39Å; L49-L119 HydrophobicContact CD1-CD1 3.45Å; L49-L119 VanDerWaalsContact CD1-CD1 3.45Å; L49-L119 HydrophobicContact CD1-CG 4.47Å
50D90.9Very high93.8Very high43 Ų4355.1 Ų55.123%0.2328%0.282CS..G310 helixtrans-65.9-9172.871.3-23000113.7Y48 F52 T53 V54 K64Y48-D50 WeakPolarHBondContact CA-OD1 3.36Å; Y48-D50 PolarHBondContact O-N 3.05Å; D50-F52 PolarHBondContact O-N 3.33Å; D50-F52 VanDerWaalsContact O-N 3.15Å; D50-T53 WeakPolarHBondContact CA-OG1 3.28Å; D50-T53 PolarHBondContact O-N 3.45Å; D50-T53 VanDerWaalsContact O-N 3.08Å; D50-T53 PolarHBondContact O-OG1 3.33Å; D50-V54 PolarHBondContact O-N 3.07Å; D50-K64 IonicContact OD1-NZ 2.68Å; D50-K64 PolarHBondContact OD1-NZ 3.22Å; D50-K64 IonicContact OD2-NZ 3.27Å; D50-K64 PolarHBondContact OD2-NZ 3.31Å
51L91.7Very high93.7Very high37 Ų3756.7 Ų56.719%0.19429%0.292CS..G310 helixtrans-53.7-31.6172-88.4170.3000113.2Y48 L49 T61 K64 V65 L68Y48-L51 WeakPolarHBondContact O-CB 3.49Å; Y48-L51 VanDerWaalsContact O-CG 3.32Å; Y48-L51 WeakPolarHBondContact O-CG 3.43Å; Y48-L51 PolarHBondContact O-N 3.25Å; L49-L51 PolarHBondContact O-N 2.95Å; L51-T61 HydrophobicContact CD2-CG2 3.88Å; L51-K64 HydrophobicContact CD1-CB 3.95Å; L51-K64 HydrophobicContact CD1-CD 4.49Å; L51-K64 HydrophobicContact CD2-CB 3.9Å; L51-K64 HydrophobicContact CD2-CD 3.78Å; L51-K64 HydrophobicContact CD2-CG 4.5Å; L51-K64 HydrophobicContact CG-CB 4.08Å; L51-K64 HydrophobicContact CG-CD 3.81Å; L51-V65 HydrophobicContact CD1-CG2 4.37Å; L51-V65 HydrophobicContact CD2-CG2 4.5Å; L51-L68 HydrophobicContact CD1-CD1 3.77Å
52F87.4Confident93.5Very high181 Ų18160.6 Ų60.679%0.79432%0.315SS*.G310 helixtrans-91.1-9.7-177.4-55.8-70.3000113.3L49 D50L49-F52 PolarHBondContact O-N 3.27Å; D50-F52 PolarHBondContact O-N 3.33Å; D50-F52 VanDerWaalsContact O-N 3.15Å
53T88.6Confident93.3Very high92 Ų9258.8 Ų58.856%0.56431%0.306SS*.THydrogen-bonded Turntrans-121-29.2-171.658.50000113.2D50D50-T53 WeakPolarHBondContact CA-OG1 3.28Å; D50-T53 PolarHBondContact O-N 3.45Å; D50-T53 VanDerWaalsContact O-N 3.08Å; D50-T53 PolarHBondContact O-OG1 3.33Å
54V90.1Very high93.2Very high72 Ų7259.4 Ų59.444%0.43631%0.308SS..  trans-132119.8-173.9-176.10000110.9D50 I56D50-V54 PolarHBondContact O-N 3.07Å; V54-I56 HydrophobicContact CG1-CG1 3.96Å
55Y92.1Very high93.1Very high168 Ų16863 Ų6366%0.65933%0.33SS*.  trans-96.5114.1167.7177.9-100.2000110.3A58Y55-A58 PolarHBondContact OH-N 3.08Å
56I90.2Very high93.1Very high105 Ų10563.4 Ų63.454%0.53833%0.333SS..  trans-94.2-54.7176.4-56.4177000110.3V54 N60V54-I56 HydrophobicContact CG1-CG1 3.96Å; I56-N60 HydrophobicContact CB-CB 4.18Å
57S91.9Very high93Very high39 Ų3963 Ų6327%0.27333%0.329SS..  trans-167.3159.8177.968.60000110.8Y59 N60 T61S57-Y59 VanDerWaalsContact C-N 3.28Å; S57-Y59 PolarHBondContact O-N 2.74Å; S57-N60 PolarHBondContact O-N 3.48Å; S57-N60 VanDerWaalsContact O-N 3.08Å; S57-N60 PolarHBondContact OG-N 3.39Å; S57-T61 PolarHBondContact O-N 3.48Å; S57-T61 PolarHBondContact O-OG1 2.91Å
58A92.9Very high93Very high58 Ų5863 Ų6348%0.47933%0.332SS..Hα-helixtrans-55.4-43.4176.100000112Y55 N60 T61 V62Y55-A58 PolarHBondContact OH-N 3.08Å; A58-N60 PolarHBondContact O-N 2.75Å; A58-T61 PolarHBondContact O-N 3.01Å; A58-V62 WeakPolarHBondContact O-CB 3.4Å; A58-V62 WeakPolarHBondContact O-CG2 3.35Å; A58-V62 PolarHBondContact O-N 2.91Å
59Y89.3Confident93.1Very high87 Ų8764.4 Ų64.434%0.34135%0.35SS..Hα-helixtrans-58.3-46.9175.5174.4-94.3000111.9M1 L6 S57 M63M1-Y59 HydrophobicContact CE-CD1 4Å; M1-Y59 HydrophobicContact CE-CE1 3.95Å; L6-Y59 HydrophobicContact CD1-CE2 4.4Å; L6-Y59 WeakPolarHBondContact CD1-OH 3.37Å; S57-Y59 VanDerWaalsContact C-N 3.28Å; S57-Y59 PolarHBondContact O-N 2.74Å; Y59-M63 HydrophobicContact CD1-CG 4.34Å; Y59-M63 HydrophobicContact CD2-CG 4.15Å; Y59-M63 HydrophobicContact CE1-CG 3.96Å; Y59-M63 HydrophobicContact CE2-CG 3.75Å; Y59-M63 HydrophobicContact CE2-SD 4.23Å; Y59-M63 HydrophobicContact CG-CG 4.43Å; Y59-M63 WeakPolarHBondContact O-CB 3.42Å; Y59-M63 VanDerWaalsContact O-CG 3.26Å; Y59-M63 WeakPolarHBondContact O-CG 3.28Å; Y59-M63 PolarHBondContact O-N 3.09Å
60N91.4Very high93.3Very high23 Ų2362.9 Ų62.912%0.12334%0.342CS..Hα-helixtrans-63.1-48.6-179.5-177.9-96.3000111.7I56 S57 A58 M63 K64I56-N60 HydrophobicContact CB-CB 4.18Å; S57-N60 PolarHBondContact O-N 3.48Å; S57-N60 VanDerWaalsContact O-N 3.08Å; S57-N60 PolarHBondContact OG-N 3.39Å; A58-N60 PolarHBondContact O-N 2.75Å; N60-M63 PolarHBondContact O-N 2.77Å; N60-K64 WeakPolarHBondContact O-CG 3.29Å; N60-K64 PolarHBondContact O-N 3.02Å; N60-K64 WeakPolarHBondContact OD1-CE 3.07Å; N60-K64 PolarHBondContact OD1-NZ 2.76Å
61T94.3Very high93.6Very high40 Ų4061 Ų6125%0.24533%0.332CS..Hα-helixtrans-60.7-48.1179-58.70000111.3L51 S57 A58 M63 K64 V65L51-T61 HydrophobicContact CD2-CG2 3.88Å; S57-T61 PolarHBondContact O-N 3.48Å; S57-T61 PolarHBondContact O-OG1 2.91Å; A58-T61 PolarHBondContact O-N 3.01Å; T61-M63 PolarHBondContact O-N 3.14Å; T61-K64 PolarHBondContact O-N 3.45Å; T61-V65 WeakPolarHBondContact O-CG2 3.47Å; T61-V65 PolarHBondContact O-N 2.91Å; T61-V65 VanDerWaalsContact O-N 3.11Å
62V94.9Very high93.9Very high88 Ų8865 Ų6553%0.53335%0.345SS..Hα-helixtrans-61.2-46.9179.21700000111.1A58 K64 V65 V66A58-V62 WeakPolarHBondContact O-CB 3.4Å; A58-V62 WeakPolarHBondContact O-CG2 3.35Å; A58-V62 PolarHBondContact O-N 2.91Å; V62-K64 PolarHBondContact O-N 2.92Å; V62-V65 PolarHBondContact O-N 3.44Å; V62-V66 HydrophobicContact CG1-CG2 4.25Å; V62-V66 VanDerWaalsContact O-CG2 3.31Å; V62-V66 WeakPolarHBondContact O-CG2 3.26Å; V62-V66 PolarHBondContact O-N 2.86Å
63M93.3Very high94.4Very high24 Ų2458.1 Ų58.112%0.11832%0.322CS..Hα-helixtrans-61.8-42.1180-74.5-63.6-65.800112.3D9 L13 Y59 N60 T61 V65 V66 F67D9-M63 HydrophobicContact CB-CE 4.5Å; L13-M63 HydrophobicContact CB-CE 4.37Å; L13-M63 HydrophobicContact CD2-CE 4.12Å; L13-M63 HydrophobicContact CD2-SD 4.38Å; Y59-M63 HydrophobicContact CD1-CG 4.34Å; Y59-M63 HydrophobicContact CD2-CG 4.15Å; Y59-M63 HydrophobicContact CE1-CG 3.96Å; Y59-M63 HydrophobicContact CE2-CG 3.75Å; Y59-M63 HydrophobicContact CE2-SD 4.23Å; Y59-M63 HydrophobicContact CG-CG 4.43Å; Y59-M63 WeakPolarHBondContact O-CB 3.42Å; Y59-M63 VanDerWaalsContact O-CG 3.26Å; Y59-M63 WeakPolarHBondContact O-CG 3.28Å; Y59-M63 PolarHBondContact O-N 3.09Å; N60-M63 PolarHBondContact O-N 2.77Å; T61-M63 PolarHBondContact O-N 3.14Å; M63-V65 PolarHBondContact O-N 3.27Å; M63-V66 PolarHBondContact O-N 3.44Å; M63-F67 HydrophobicContact CB-CE2 4.43Å; M63-F67 HydrophobicContact CE-CD2 4.45Å; M63-F67 HydrophobicContact CE-CE2 3.59Å; M63-F67 HydrophobicContact CE-CZ 3.84Å; M63-F67 WeakPolarHBondContact O-CD2 3.49Å; M63-F67 PolarHBondContact O-N 2.76Å
64K95.7Very high94.8Very high13 Ų1353.8 Ų53.86%0.05730%0.295CS..Hα-helixtrans-60-45.2175.8-71.9-179.5176.2178.20111.9Y48 D50 L51 N60 T61 V62 F67 L68Y48-K64 HydrophobicContact CD1-CB 4.35Å; Y48-K64 HydrophobicContact CD1-CD 3.71Å; Y48-K64 HydrophobicContact CD1-CG 3.61Å; Y48-K64 HydrophobicContact CD2-CB 3.88Å; Y48-K64 HydrophobicContact CD2-CG 4Å; Y48-K64 HydrophobicContact CE1-CD 4.31Å; Y48-K64 HydrophobicContact CE1-CG 3.81Å; Y48-K64 HydrophobicContact CE2-CB 4.25Å; Y48-K64 HydrophobicContact CE2-CG 4.18Å; Y48-K64 HydrophobicContact CG-CB 3.94Å; Y48-K64 HydrophobicContact CG-CD 3.91Å; Y48-K64 HydrophobicContact CG-CG 3.72Å; D50-K64 IonicContact OD1-NZ 2.68Å; D50-K64 PolarHBondContact OD1-NZ 3.22Å; D50-K64 IonicContact OD2-NZ 3.27Å; D50-K64 PolarHBondContact OD2-NZ 3.31Å; L51-K64 HydrophobicContact CD1-CB 3.95Å; L51-K64 HydrophobicContact CD1-CD 4.49Å; L51-K64 HydrophobicContact CD2-CB 3.9Å; L51-K64 HydrophobicContact CD2-CD 3.78Å; L51-K64 HydrophobicContact CD2-CG 4.5Å; L51-K64 HydrophobicContact CG-CB 4.08Å; L51-K64 HydrophobicContact CG-CD 3.81Å; N60-K64 WeakPolarHBondContact O-CG 3.29Å; N60-K64 PolarHBondContact O-N 3.02Å; N60-K64 WeakPolarHBondContact OD1-CE 3.07Å; N60-K64 PolarHBondContact OD1-NZ 2.76Å; T61-K64 PolarHBondContact O-N 3.45Å; V62-K64 PolarHBondContact O-N 2.92Å; K64-F67 PolarHBondContact O-N 3.36Å; K64-L68 WeakPolarHBondContact O-CG 3.36Å; K64-L68 PolarHBondContact O-N 3.08Å
65V96.9Very high95.2Very high78 Ų7851.6 Ų51.647%0.47328%0.282SS..Hα-helixtrans-63-42.3176.7173.30000111.1L51 T61 V62 M63 L68 A69L51-V65 HydrophobicContact CD1-CG2 4.37Å; L51-V65 HydrophobicContact CD2-CG2 4.5Å; T61-V65 WeakPolarHBondContact O-CG2 3.47Å; T61-V65 PolarHBondContact O-N 2.91Å; T61-V65 VanDerWaalsContact O-N 3.11Å; V62-V65 PolarHBondContact O-N 3.44Å; M63-V65 PolarHBondContact O-N 3.27Å; V65-L68 PolarHBondContact O-N 2.99Å; V65-A69 WeakPolarHBondContact O-CB 3.46Å; V65-A69 PolarHBondContact O-N 2.95Å
66V96.8Very high95.5Very high49 Ų4949.5 Ų49.530%0.29727%0.274SS..Hα-helixtrans-62.3-46.2176.71690000111.3L13 V62 M63 L68 A69 L70L13-V66 HydrophobicContact CD1-CG1 3.7Å; V62-V66 HydrophobicContact CG1-CG2 4.25Å; V62-V66 VanDerWaalsContact O-CG2 3.31Å; V62-V66 WeakPolarHBondContact O-CG2 3.26Å; V62-V66 PolarHBondContact O-N 2.86Å; M63-V66 PolarHBondContact O-N 3.44Å; V66-L68 PolarHBondContact O-N 3.4Å; V66-A69 PolarHBondContact O-N 3.4Å; V66-L70 HydrophobicContact CG1-CD1 3.64Å; V66-L70 HydrophobicContact CG1-CG 4.18Å; V66-L70 WeakPolarHBondContact O-CB 3.21Å; V66-L70 VanDerWaalsContact O-CG 3.27Å; V66-L70 WeakPolarHBondContact O-CG 3.09Å; V66-L70 PolarHBondContact O-N 3.24Å
67F96.4Very high95.9Very high6 Ų645 Ų453%0.02625%0.251CS..Hα-helixtrans-60.6-43.7177.1-79.5-59.7000112.3H12 L13 I16 F44 Y48 M63 K64 S71H12-F67 HydrophobicContact CB-CE1 4.25Å; H12-F67 HydrophobicContact CB-CZ 4.23Å; H12-F67 AromaticContact CG-CE1 3.93Å; L13-F67 HydrophobicContact CB-CE1 4.37Å; L13-F67 HydrophobicContact CB-CZ 4.37Å; I16-F67 HydrophobicContact CD1-CD1 3.47Å; I16-F67 VanDerWaalsContact CD1-CD1 3.47Å; I16-F67 HydrophobicContact CD1-CE1 3.67Å; F44-F67 HydrophobicContact CD1-CB 4.22Å; F44-F67 HydrophobicContact CD2-CB 4.38Å; F44-F67 HydrophobicContact CE1-CB 4.25Å; F44-F67 HydrophobicContact CE1-CD1 4.27Å; F44-F67 HydrophobicContact CE1-CG 4.25Å; F44-F67 HydrophobicContact CE2-CB 4.41Å; F44-F67 HydrophobicContact CE2-CD1 4.41Å; F44-F67 HydrophobicContact CG-CB 4.28Å; F44-F67 HydrophobicContact CZ-CB 4.34Å; F44-F67 AromaticContact CZ-CD1 3.92Å; F44-F67 HydrophobicContact CZ-CD1 3.92Å; F44-F67 HydrophobicContact CZ-CG 4.31Å; Y48-F67 HydrophobicContact CE2-CB 3.92Å; Y48-F67 HydrophobicContact CE2-CD2 4.45Å; M63-F67 HydrophobicContact CB-CE2 4.43Å; M63-F67 HydrophobicContact CE-CD2 4.45Å; M63-F67 HydrophobicContact CE-CE2 3.59Å; M63-F67 HydrophobicContact CE-CZ 3.84Å; M63-F67 WeakPolarHBondContact O-CD2 3.49Å; M63-F67 PolarHBondContact O-N 2.76Å; K64-F67 PolarHBondContact O-N 3.36Å; F67-S71 VanDerWaalsContact O-CB 3.31Å; F67-S71 WeakPolarHBondContact O-CB 3.33Å; F67-S71 PolarHBondContact O-N 3.37Å; F67-S71 PolarHBondContact O-OG 3.05Å
68L97.6Very high96.1Very high33 Ų3343.2 Ų43.217%0.17324%0.238CC..Hα-helixtrans-60.9-53174.2-75.7164.7000111F44 Y48 L51 K64 V65 V66 L70 S71 Y72F44-L68 HydrophobicContact CB-CD2 3.86Å; F44-L68 HydrophobicContact CB-CG 4.37Å; Y48-L68 HydrophobicContact CD2-CD1 4.32Å; Y48-L68 HydrophobicContact CD2-CG 4.13Å; L51-L68 HydrophobicContact CD1-CD1 3.77Å; K64-L68 WeakPolarHBondContact O-CG 3.36Å; K64-L68 PolarHBondContact O-N 3.08Å; V65-L68 PolarHBondContact O-N 2.99Å; V66-L68 PolarHBondContact O-N 3.4Å; L68-L70 PolarHBondContact O-N 2.99Å; L68-S71 PolarHBondContact O-N 3.49Å; L68-S71 PolarHBondContact O-OG 3.42Å; L68-Y72 HydrophobicContact CD2-CE2 4.06Å; L68-Y72 VanDerWaalsContact O-CD2 3.26Å; L68-Y72 WeakPolarHBondContact O-CD2 3.41Å; L68-Y72 PolarHBondContact O-N 3.16Å
69A98.2Very high96.3Very high59 Ų5944 Ų4449%0.48823%0.229SC..Hα-helixtrans-58.2-46-17800000112.2V65 V66 A73V65-A69 WeakPolarHBondContact O-CB 3.46Å; V65-A69 PolarHBondContact O-N 2.95Å; V66-A69 PolarHBondContact O-N 3.4Å; A69-A73 WeakPolarHBondContact O-CB 3.48Å; A69-A73 PolarHBondContact O-N 3.23Å
70L97.9Very high96.7Very high26 Ų2646.3 Ų46.314%0.13625%0.245CC..Hα-helixtrans-70.5-37.4-178.6-65.8176000112.9L13 I16 L17 L20 V66 L68 A73 T74L13-L70 HydrophobicContact CD1-CD1 3.55Å; I16-L70 HydrophobicContact CG2-CB 3.57Å; I16-L70 HydrophobicContact CG2-CD1 4.06Å; I16-L70 HydrophobicContact CG2-CG 4.43Å; L17-L70 HydrophobicContact CD2-CD1 3.79Å; L17-L70 HydrophobicContact CD2-CD2 4.04Å; L17-L70 HydrophobicContact CG-CD1 4.25Å; L20-L70 HydrophobicContact CD2-CD2 3.78Å; V66-L70 HydrophobicContact CG1-CD1 3.64Å; V66-L70 HydrophobicContact CG1-CG 4.18Å; V66-L70 WeakPolarHBondContact O-CB 3.21Å; V66-L70 VanDerWaalsContact O-CG 3.27Å; V66-L70 WeakPolarHBondContact O-CG 3.09Å; V66-L70 PolarHBondContact O-N 3.24Å; L68-L70 PolarHBondContact O-N 2.99Å; L70-A73 PolarHBondContact O-N 3.48Å; L70-T74 WeakPolarHBondContact O-CB 3.25Å; L70-T74 PolarHBondContact O-N 3.44Å; L70-T74 PolarHBondContact O-OG1 2.98Å
71S97.6Very high96.9Very high4 Ų452.5 Ų52.53%0.02827%0.266CS..Hα-helixtrans-66.8-47.4177580000111.5F67 L68 A73 T74 V75F67-S71 VanDerWaalsContact O-CB 3.31Å; F67-S71 WeakPolarHBondContact O-CB 3.33Å; F67-S71 PolarHBondContact O-N 3.37Å; F67-S71 PolarHBondContact O-OG 3.05Å; L68-S71 PolarHBondContact O-N 3.49Å; L68-S71 PolarHBondContact O-OG 3.42Å; S71-A73 PolarHBondContact O-N 3.04Å; S71-T74 WeakPolarHBondContact O-CB 3.32Å; S71-T74 PolarHBondContact O-N 3.34Å; S71-V75 WeakPolarHBondContact O-CG2 3.2Å; S71-V75 PolarHBondContact O-N 3.45Å
72Y98.4Very high97Very high120 Ų12051.6 Ų51.647%0.47126%0.259SS..Hα-helixtrans-63.6-38.9174-81-70.8000112.5T45 L68 T74 V75 Y76T45-Y72 WeakPolarHBondContact OG1-CE2 3.42Å; T45-Y72 PolarHBondContact OG1-OH 2.94Å; L68-Y72 HydrophobicContact CD2-CE2 4.06Å; L68-Y72 VanDerWaalsContact O-CD2 3.26Å; L68-Y72 WeakPolarHBondContact O-CD2 3.41Å; L68-Y72 PolarHBondContact O-N 3.16Å; Y72-T74 VanDerWaalsContact C-N 3.32Å; Y72-T74 PolarHBondContact O-N 3.39Å; Y72-V75 PolarHBondContact O-N 3.05Å; Y72-Y76 WeakPolarHBondContact O-CB 3.32Å; Y72-Y76 PolarHBondContact O-N 3.16Å
73A98.2Very high97Very high36 Ų3655.7 Ų55.730%0.29827%0.265SS..Hα-helixtrans-60.4-42.8173.700000111.5L20 A69 L70 S71 Y76 L77L20-A73 HydrophobicContact CD1-CB 4.13Å; A69-A73 WeakPolarHBondContact O-CB 3.48Å; A69-A73 PolarHBondContact O-N 3.23Å; L70-A73 PolarHBondContact O-N 3.48Å; S71-A73 PolarHBondContact O-N 3.04Å; A73-Y76 WeakPolarHBondContact O-CB 3.3Å; A73-Y76 PolarHBondContact O-N 3.23Å; A73-L77 VanDerWaalsContact O-CG 3.32Å; A73-L77 WeakPolarHBondContact O-CG 3.45Å; A73-L77 PolarHBondContact O-N 3.17Å
74T97.6Very high97.1Very high1 Ų162.6 Ų62.61%0.00630%0.303CS..Hα-helixtrans-62.1-46.7177.2-560000111.2L19 L20 I23 Q37 L70 S71 Y72 Y76 L77 I78L19-T74 HydrophobicContact CD2-CG2 3.99Å; L19-T74 HydrophobicContact CG-CG2 4.35Å; L20-T74 WeakPolarHBondContact CD1-OG1 3.34Å; I23-T74 HydrophobicContact CD1-CG2 4.02Å; Q37-T74 HydrophobicContact CB-CG2 4.4Å; Q37-T74 HydrophobicContact CG-CG2 3.96Å; L70-T74 WeakPolarHBondContact O-CB 3.25Å; L70-T74 PolarHBondContact O-N 3.44Å; L70-T74 PolarHBondContact O-OG1 2.98Å; S71-T74 WeakPolarHBondContact O-CB 3.32Å; S71-T74 PolarHBondContact O-N 3.34Å; Y72-T74 VanDerWaalsContact C-N 3.32Å; Y72-T74 PolarHBondContact O-N 3.39Å; T74-Y76 VanDerWaalsContact C-N 3.35Å; T74-Y76 PolarHBondContact O-N 2.98Å; T74-L77 PolarHBondContact O-N 3.08Å; T74-I78 HydrophobicContact CG2-CD1 4.05Å; T74-I78 WeakPolarHBondContact O-CG1 3.45Å; T74-I78 PolarHBondContact O-N 3.45Å
75V98.3Very high97Very high27 Ų2763.6 Ų63.616%0.16431%0.311CS..Hα-helixtrans-59.6-44.8175.7172.70000111.2Q37 V38 A41 S71 Y72 L77 I78 Y79Q37-V75 HydrophobicContact CB-CG2 4.1Å; V38-V75 HydrophobicContact CG2-CG1 4.06Å; V38-V75 HydrophobicContact CG2-CG2 4.19Å; A41-V75 HydrophobicContact CB-CG2 4.12Å; S71-V75 WeakPolarHBondContact O-CG2 3.2Å; S71-V75 PolarHBondContact O-N 3.45Å; Y72-V75 PolarHBondContact O-N 3.05Å; V75-L77 VanDerWaalsContact C-N 3.34Å; V75-L77 PolarHBondContact O-N 3.15Å; V75-I78 PolarHBondContact O-N 2.86Å; V75-Y79 HydrophobicContact CG1-CD2 3.93Å; V75-Y79 PolarHBondContact O-N 3.25Å
76Y98.3Very high96.9Very high124 Ų12461.6 Ų61.649%0.48630%0.295SS..Hα-helixtrans-59.9-43.1175.7169.9-97000112.2Y72 A73 T74 I78 M80 R81Y72-Y76 WeakPolarHBondContact O-CB 3.32Å; Y72-Y76 PolarHBondContact O-N 3.16Å; A73-Y76 WeakPolarHBondContact O-CB 3.3Å; A73-Y76 PolarHBondContact O-N 3.23Å; T74-Y76 VanDerWaalsContact C-N 3.35Å; T74-Y76 PolarHBondContact O-N 2.98Å; Y76-I78 VanDerWaalsContact C-N 3.31Å; Y76-I78 PolarHBondContact O-N 2.91Å; Y76-M80 HydrophobicContact CD2-CB 3.82Å; Y76-M80 HydrophobicContact CD2-CG 3.94Å; Y76-M80 HydrophobicContact CD2-SD 3.6Å; Y76-M80 VanDerWaalsContact CD2-SD 3.6Å; Y76-M80 HydrophobicContact CE2-CB 3.75Å; Y76-M80 HydrophobicContact CE2-CG 4.19Å; Y76-M80 HydrophobicContact CE2-SD 3.7Å; Y76-M80 WeakPolarHBondContact O-CA 3.18Å; Y76-M80 WeakPolarHBondContact O-CB 3.45Å; Y76-M80 PolarHBondContact O-N 3.15Å; Y76-R81 HydrophobicContact CE1-CB 4.06Å; Y76-R81 PolarHBondContact O-N 3.26Å; Y76-R81 VanDerWaalsContact O-N 3.07Å
77L97.8Very high96.6Very high11 Ų1161.3 Ų61.36%0.05829%0.292CS..Iπ-helixtrans-62.4-39.9177.7-70.9-173.5000111.8L20 I23 W24 A73 T74 V75 R81 F82L20-L77 HydrophobicContact CD1-CD1 3.57Å; L20-L77 HydrophobicContact CD1-CG 4.44Å; L20-L77 HydrophobicContact CG-CD1 4.27Å; I23-L77 HydrophobicContact CB-CD1 4.36Å; I23-L77 HydrophobicContact CG2-CB 3.89Å; I23-L77 HydrophobicContact CG2-CD1 3.98Å; W24-L77 HydrophobicContact CE3-CD1 4.36Å; W24-L77 HydrophobicContact CE3-CD2 4.08Å; W24-L77 HydrophobicContact CZ3-CD2 4.21Å; A73-L77 VanDerWaalsContact O-CG 3.32Å; A73-L77 WeakPolarHBondContact O-CG 3.45Å; A73-L77 PolarHBondContact O-N 3.17Å; T74-L77 PolarHBondContact O-N 3.08Å; V75-L77 VanDerWaalsContact C-N 3.34Å; V75-L77 PolarHBondContact O-N 3.15Å; L77-R81 HydrophobicContact CD2-CB 3.92Å; L77-R81 HydrophobicContact CD2-CG 4.09Å; L77-F82 HydrophobicContact CB-CD2 4.15Å; L77-F82 HydrophobicContact CD2-CD2 4.23Å; L77-F82 HydrophobicContact CD2-CE2 3.85Å; L77-F82 WeakPolarHBondContact O-CA 3.33Å; L77-F82 WeakPolarHBondContact O-CB 3.42Å; L77-F82 PolarHBondContact O-N 3.15Å
78I97.1Very high96.4Very high0 Ų064.6 Ų64.60%032%0.316CS..Iπ-helixtrans-72.9-52.3-178.6-65.1169.2000111.5I23 C29 I32 Q37 T74 V75 Y76 R83 Y86I23-I78 HydrophobicContact CD1-CD1 4.33Å; I23-I78 HydrophobicContact CD1-CG1 4.13Å; C29-I78 HydrophobicContact CB-CB 4.49Å; C29-I78 HydrophobicContact CB-CG1 3.87Å; I32-I78 HydrophobicContact CG2-CD1 3.98Å; Q37-I78 HydrophobicContact CB-CD1 4.07Å; Q37-I78 HydrophobicContact CG-CD1 3.63Å; T74-I78 HydrophobicContact CG2-CD1 4.05Å; T74-I78 WeakPolarHBondContact O-CG1 3.45Å; T74-I78 PolarHBondContact O-N 3.45Å; V75-I78 PolarHBondContact O-N 2.86Å; Y76-I78 VanDerWaalsContact C-N 3.31Å; Y76-I78 PolarHBondContact O-N 2.91Å; I78-R83 VanDerWaalsContact O-CA 3.26Å; I78-R83 WeakPolarHBondContact O-CA 3.32Å; I78-R83 PolarHBondContact O-N 3.33Å; I78-Y86 HydrophobicContact CG2-CD2 3.63Å; I78-Y86 HydrophobicContact CG2-CE2 4.16Å; I78-Y86 HydrophobicContact CG2-CG 4.07Å
79Y97.4Very high96.1Very high76 Ų7670.4 Ų70.430%0.29834%0.342SS..Iπ-helixtrans-91.2-17.3-169.7-72.8-73.9000114.8G34 K35 V38 V75 Y86G34-Y79 VanDerWaalsContact CA-OH 3.31Å; G34-Y79 WeakPolarHBondContact CA-OH 3.42Å; K35-Y79 PolarHBondContact N-OH 3.18Å; V38-Y79 HydrophobicContact CG2-CD2 4.39Å; V38-Y79 HydrophobicContact CG2-CE2 3.65Å; V75-Y79 HydrophobicContact CG1-CD2 3.93Å; V75-Y79 PolarHBondContact O-N 3.25Å; Y79-Y86 HydrophobicContact CE1-CD1 4.33Å; Y79-Y86 AromaticContact CE1-CE1 3.79Å; Y79-Y86 HydrophobicContact CE1-CE1 3.79Å; Y79-Y86 AromaticContact CE1-CZ 3.93Å; Y79-Y86 PolarHBondContact OH-OH 2.99Å
80M96.6Very high95.6Very high135 Ų13569.6 Ų69.667%0.66533%0.329SS*.Iπ-helixtrans-116.9-63.4179.3-53.8-162.48700112Y76Y76-M80 HydrophobicContact CD2-CB 3.82Å; Y76-M80 HydrophobicContact CD2-CG 3.94Å; Y76-M80 HydrophobicContact CD2-SD 3.6Å; Y76-M80 VanDerWaalsContact CD2-SD 3.6Å; Y76-M80 HydrophobicContact CE2-CB 3.75Å; Y76-M80 HydrophobicContact CE2-CG 4.19Å; Y76-M80 HydrophobicContact CE2-SD 3.7Å; Y76-M80 WeakPolarHBondContact O-CA 3.18Å; Y76-M80 WeakPolarHBondContact O-CB 3.45Å; Y76-M80 PolarHBondContact O-N 3.15Å
81R96.5Very high95.4Very high152 Ų15268.5 Ų68.557%0.57432%0.324SS*.Iπ-helixtrans-70-44.4-168.2-174.460.9174135-3.4113.7Y76 L77Y76-R81 HydrophobicContact CE1-CB 4.06Å; Y76-R81 PolarHBondContact O-N 3.26Å; Y76-R81 VanDerWaalsContact O-N 3.07Å; L77-R81 HydrophobicContact CD2-CB 3.92Å; L77-R81 HydrophobicContact CD2-CG 4.09Å
82F96.5Very high95.3Very high21 Ų2171.2 Ų71.29%0.09234%0.34CS..THydrogen-bonded Turntrans-11827.2-176.9-56-61.8000112.4I23 K27 C29 L77 N84 S85I23-F82 HydrophobicContact CG2-CD2 3.57Å; I23-F82 HydrophobicContact CG2-CE2 3.98Å; K27-F82 HydrophobicContact CB-CD1 4.27Å; K27-F82 HydrophobicContact CB-CE1 3.69Å; K27-F82 HydrophobicContact CB-CZ 4.2Å; K27-F82 HydrophobicContact CD-CE1 3.65Å; K27-F82 HydrophobicContact CD-CZ 3.51Å; K27-F82 HydrophobicContact CG-CE1 4.28Å; K27-F82 HydrophobicContact CG-CZ 4.48Å; K27-F82 WeakPolarHBondContact O-CD1 3.39Å; C29-F82 PolarHBondContact SG-O 3.24Å; C29-F82 VanDerWaalsContact SG-O 3.37Å; L77-F82 HydrophobicContact CB-CD2 4.15Å; L77-F82 HydrophobicContact CD2-CD2 4.23Å; L77-F82 HydrophobicContact CD2-CE2 3.85Å; L77-F82 WeakPolarHBondContact O-CA 3.33Å; L77-F82 WeakPolarHBondContact O-CB 3.42Å; L77-F82 PolarHBondContact O-N 3.15Å; F82-N84 PolarHBondContact O-N 3.2Å; F82-S85 PolarHBondContact O-N 3.01Å; F82-S85 PolarHBondContact O-OG 3.26Å
83R94.8Very high95.1Very high174 Ų17467 Ų6766%0.65732%0.324SS*.G310 helixtrans-49.1-35.8-179-177.4-176.8172.5-167.8-1.4113.9I78 S85 Y86I78-R83 VanDerWaalsContact O-CA 3.26Å; I78-R83 WeakPolarHBondContact O-CA 3.32Å; I78-R83 PolarHBondContact O-N 3.33Å; R83-S85 PolarHBondContact O-N 3.48Å; R83-Y86 WeakPolarHBondContact O-CB 3.15Å; R83-Y86 PolarHBondContact O-N 3.09Å; R83-Y86 VanDerWaalsContact O-N 3.09Å
84N95Very high95Very high170 Ų17072.2 Ų72.291%0.90934%0.336SS*.G310 helixtrans-66.2-20.3-178.6-62.5-13.6000113.5F82F82-N84 PolarHBondContact O-N 3.2Å
85S93.8Very high95Very high33 Ų3373.5 Ų73.523%0.23134%0.344CS..G310 helixtrans-97.5-1.3176.365.40000113.5S28 C29 A30 F82 R83 D87S28-S85 WeakPolarHBondContact CA-OG 3.36Å; S28-S85 WeakPolarHBondContact OG-CB 3.3Å; C29-S85 PolarHBondContact N-OG 3.45Å; C29-S85 PolarHBondContact SG-OG 3.44Å; A30-S85 WeakPolarHBondContact CA-O 3.44Å; A30-S85 PolarHBondContact N-O 3.49Å; F82-S85 PolarHBondContact O-N 3.01Å; F82-S85 PolarHBondContact O-OG 3.26Å; R83-S85 PolarHBondContact O-N 3.48Å; S85-D87 PolarHBondContact O-N 2.92Å
86Y94.8Very high94.9Very high36 Ų3676.5 Ų76.514%0.14136%0.357CS..  trans-77.9121.4178.3170.8-116000109.9I78 Y79 R83 S88 D91I78-Y86 HydrophobicContact CG2-CD2 3.63Å; I78-Y86 HydrophobicContact CG2-CE2 4.16Å; I78-Y86 HydrophobicContact CG2-CG 4.07Å; Y79-Y86 HydrophobicContact CE1-CD1 4.33Å; Y79-Y86 AromaticContact CE1-CE1 3.79Å; Y79-Y86 HydrophobicContact CE1-CE1 3.79Å; Y79-Y86 AromaticContact CE1-CZ 3.93Å; Y79-Y86 PolarHBondContact OH-OH 2.99Å; R83-Y86 WeakPolarHBondContact O-CB 3.15Å; R83-Y86 PolarHBondContact O-N 3.09Å; R83-Y86 VanDerWaalsContact O-N 3.09Å; Y86-S88 PolarHBondContact O-N 3.44Å; Y86-S88 VanDerWaalsContact O-N 3.17Å; Y86-D91 HydrophobicContact CE2-CB 4.19Å; Y86-D91 PolarHBondContact OH-OD2 3.43Å
87D90.6Very high94.7Very high43 Ų4376.7 Ų76.723%0.2336%0.36CS..  trans-88.781.3-177-177.8-4000110.9S85 E89 N90 D91 M137S85-D87 PolarHBondContact O-N 2.92Å; D87-E89 PolarHBondContact O-N 2.89Å; D87-E89 PolarHBondContact OD1-N 3.48Å; D87-N90 PolarHBondContact O-N 3.3Å; D87-N90 PolarHBondContact OD1-N 2.92Å; D87-N90 PolarHBondContact OD1-ND2 3.23Å; D87-N90 WeakPolarHBondContact OD2-CB 3.26Å; D87-N90 PolarHBondContact OD2-ND2 3.48Å; D87-D91 WeakPolarHBondContact O-CB 3.16Å; D87-D91 PolarHBondContact O-N 3.34Å; D87-D91 VanDerWaalsContact O-N 3.09Å; D87-M137 HydrophobicContact CB-CE 3.72Å
88S91.4Very high94.6Very high75 Ų7576.7 Ų76.752%0.52436%0.36SS..THydrogen-bonded Turntrans-68.7-20.8177.455.50000113.7Y86Y86-S88 PolarHBondContact O-N 3.44Å; Y86-S88 VanDerWaalsContact O-N 3.17Å
89E90.7Very high94.6Very high156 Ų15678.7 Ų78.773%0.72937%0.371SS*.THydrogen-bonded Turntrans-73.4-31.7179.9-64.6-174.6174.500111.6D87 T92 K140D87-E89 PolarHBondContact O-N 2.89Å; D87-E89 PolarHBondContact OD1-N 3.48Å; E89-T92 WeakPolarHBondContact O-CG2 3.37Å; E89-K140 PolarHBondContact O-NZ 3.09Å
90N89.1Confident94.6Very high41 Ų4180.8 Ų80.822%0.21939%0.386CS..THydrogen-bonded Turntrans-95.1-24.4174.9-67.8-51.1000114D87 T92 M137 K140 T141D87-N90 PolarHBondContact O-N 3.3Å; D87-N90 PolarHBondContact OD1-N 2.92Å; D87-N90 PolarHBondContact OD1-ND2 3.23Å; D87-N90 WeakPolarHBondContact OD2-CB 3.26Å; D87-N90 PolarHBondContact OD2-ND2 3.48Å; N90-T92 PolarHBondContact O-N 2.98Å; N90-M137 HydrophobicContact CB-CE 4.21Å; N90-M137 HydrophobicContact CB-CG 4.2Å; N90-K140 HydrophobicContact CB-CD 4.36Å; N90-K140 WeakPolarHBondContact OD1-CE 3.07Å; N90-T141 HydrophobicContact CB-CG2 3.7Å
91D93.9Very high94.6Very high3 Ų377.5 Ų77.52%0.01637%0.374CS..  trans-79.456.8173.3-161.79.9000112.5S33 G34 K35 Y86 D87 M137S33-D91 WeakPolarHBondContact CA-OD2 3.45Å; S33-D91 PolarHBondContact OG-OD1 3.03Å; S33-D91 PolarHBondContact OG-OD2 3.5Å; G34-D91 PolarHBondContact N-OD2 3.16Å; K35-D91 VanDerWaalsContact CE-O 3.28Å; K35-D91 WeakPolarHBondContact CE-O 3.48Å; K35-D91 PolarHBondContact N-OD2 3.39Å; K35-D91 VanDerWaalsContact N-OD2 3.08Å; K35-D91 PolarHBondContact NZ-O 3.34Å; Y86-D91 HydrophobicContact CE2-CB 4.19Å; Y86-D91 PolarHBondContact OH-OD2 3.43Å; D87-D91 WeakPolarHBondContact O-CB 3.16Å; D87-D91 PolarHBondContact O-N 3.34Å; D87-D91 VanDerWaalsContact O-N 3.09Å; D91-M137 HydrophobicContact CB-SD 4.32Å
92T95.1Very high94.6Very high62 Ų6270.8 Ų70.838%0.3835%0.35SS..  trans-93.25.9-172.353.80000114.8E89 N90 R94 K140E89-T92 WeakPolarHBondContact O-CG2 3.37Å; N90-T92 PolarHBondContact O-N 2.98Å; T92-R94 PolarHBondContact O-N 2.78Å; T92-K140 PolarHBondContact OG1-NZ 3.36Å; T92-K140 VanDerWaalsContact OG1-NZ 3.14Å
93F94.4Very high94.7Very high30 Ų3073.3 Ų73.313%0.13236%0.364CS..  trans-61.4133179.9-171.1-82000111.5K35 V95 L98 M132 P133 F136K35-F93 VanDerWaalsContact CD-O 3.29Å; K35-F93 WeakPolarHBondContact CD-O 3.42Å; K35-F93 WeakPolarHBondContact CE-O 3.2Å; K35-F93 PolarHBondContact NZ-O 2.91Å; F93-V95 HydrophobicContact CD1-CG1 4.42Å; F93-V95 PolarHBondContact O-N 3.25Å; F93-L98 HydrophobicContact CD1-CD1 4.4Å; F93-L98 HydrophobicContact CE1-CD1 3.52Å; F93-L98 HydrophobicContact CE1-CD2 4.36Å; F93-L98 HydrophobicContact CE1-CG 3.67Å; F93-L98 HydrophobicContact CZ-CD1 4Å; F93-L98 HydrophobicContact CZ-CD2 4.18Å; F93-L98 HydrophobicContact CZ-CG 3.99Å; F93-M132 HydrophobicContact CE2-CB 4.21Å; F93-M132 HydrophobicContact CE2-CE 4.4Å; F93-M132 HydrophobicContact CZ-CB 4.13Å; F93-M132 HydrophobicContact CZ-CE 4.02Å; F93-P133 HydrophobicContact CB-CB 3.95Å; F93-P133 HydrophobicContact CB-CG 4.35Å; F93-P133 HydrophobicContact CD1-CB 4.27Å; F93-P133 HydrophobicContact CD1-CG 3.74Å; F93-P133 HydrophobicContact CE1-CG 4.34Å; F93-P133 HydrophobicContact CG-CB 4.17Å; F93-P133 HydrophobicContact CG-CG 4.11Å; F93-F136 HydrophobicContact CB-CB 4.44Å; F93-F136 HydrophobicContact CB-CD1 4.1Å; F93-F136 HydrophobicContact CB-CG 4.37Å; F93-F136 HydrophobicContact CD2-CB 3.77Å; F93-F136 HydrophobicContact CD2-CD1 4.34Å; F93-F136 HydrophobicContact CD2-CD2 4.12Å; F93-F136 AromaticContact CD2-CG 3.81Å; F93-F136 HydrophobicContact CD2-CG 3.81Å
94R96.4Very high94.8Very high146 Ų14666.6 Ų66.655%0.55135%0.348SS*.  trans-87.499.5-179.7-72.4-174.863.9-169.93.9110.4T92 E96 F97T92-R94 PolarHBondContact O-N 2.78Å; R94-E96 VanDerWaalsContact C-OE2 3.23Å; R94-E96 WeakPolarHBondContact CA-OE2 3.36Å; R94-E96 WeakPolarHBondContact CB-OE2 3.44Å; R94-E96 PolarHBondContact O-N 3Å; R94-F97 HydrophobicContact CB-CD2 3.53Å; R94-F97 HydrophobicContact CB-CE2 3.68Å; R94-F97 HydrophobicContact CG-CE2 4.29Å; R94-F97 PolarHBondContact O-N 2.72Å
95V96.6Very high94.8Very high29 Ų2962.4 Ų62.418%0.17633%0.326CS..THydrogen-bonded Turntrans-65.8-18.9-174.2-650000113.3K35 L39 F93 F97 L98 L99 P133K35-V95 HydrophobicContact CB-CG1 3.95Å; K35-V95 HydrophobicContact CD-CG1 4.03Å; K35-V95 HydrophobicContact CG-CG1 4.15Å; L39-V95 HydrophobicContact CD1-CG1 4.32Å; F93-V95 HydrophobicContact CD1-CG1 4.42Å; F93-V95 PolarHBondContact O-N 3.25Å; V95-F97 PolarHBondContact O-N 2.92Å; V95-L98 WeakPolarHBondContact O-CB 3.26Å; V95-L98 PolarHBondContact O-N 3.01Å; V95-L99 HydrophobicContact CG2-CD1 4.44Å; V95-L99 PolarHBondContact O-N 3.45Å; V95-P133 HydrophobicContact CG1-CG 4.37Å
96E96.1Very high95Very high90 Ų9061 Ų6142%0.42132%0.316SS..Hα-helixtrans-61.1-34.4177.2-55.282.3178.200111.4R94 L98 L99 I100R94-E96 VanDerWaalsContact C-OE2 3.23Å; R94-E96 WeakPolarHBondContact CA-OE2 3.36Å; R94-E96 WeakPolarHBondContact CB-OE2 3.44Å; R94-E96 PolarHBondContact O-N 3Å; E96-L98 PolarHBondContact O-N 3.23Å; E96-L99 PolarHBondContact O-N 2.91Å; E96-I100 HydrophobicContact CB-CD1 4.22Å; E96-I100 WeakPolarHBondContact O-CB 3.45Å; E96-I100 WeakPolarHBondContact O-CG1 3.34Å; E96-I100 PolarHBondContact O-N 3.26Å
97F95Very high95.1Very high128 Ų12864.2 Ų64.256%0.56133%0.331SS*.Hα-helixtrans-68.6-14.5175.4-64.2-54.3000113.5R94 V95 P101R94-F97 HydrophobicContact CB-CD2 3.53Å; R94-F97 HydrophobicContact CB-CE2 3.68Å; R94-F97 HydrophobicContact CG-CE2 4.29Å; R94-F97 PolarHBondContact O-N 2.72Å; V95-F97 PolarHBondContact O-N 2.92Å; F97-P101 VanDerWaalsContact O-CD 3.32Å; F97-P101 WeakPolarHBondContact O-CD 3.42Å; F97-P101 WeakPolarHBondContact O-CG 3.42Å
98L95.7Very high95.3Very high11 Ų1168.7 Ų68.76%0.05835%0.354CS..Hα-helixtrans-94.7-50.7170.3-61178000110.6L39 F93 V95 E96 I100 P101 V102 V129 M132 P133L39-L98 HydrophobicContact CD1-CD1 3.88Å; F93-L98 HydrophobicContact CD1-CD1 4.4Å; F93-L98 HydrophobicContact CE1-CD1 3.52Å; F93-L98 HydrophobicContact CE1-CD2 4.36Å; F93-L98 HydrophobicContact CE1-CG 3.67Å; F93-L98 HydrophobicContact CZ-CD1 4Å; F93-L98 HydrophobicContact CZ-CD2 4.18Å; F93-L98 HydrophobicContact CZ-CG 3.99Å; V95-L98 WeakPolarHBondContact O-CB 3.26Å; V95-L98 PolarHBondContact O-N 3.01Å; E96-L98 PolarHBondContact O-N 3.23Å; L98-I100 PolarHBondContact O-N 3.37Å; L98-P101 WeakPolarHBondContact O-CD 3.42Å; L98-V102 WeakPolarHBondContact O-CB 3.31Å; L98-V102 WeakPolarHBondContact O-CG2 3.36Å; L98-V102 PolarHBondContact O-N 3.13Å; L98-V129 HydrophobicContact CB-CG2 4.23Å; L98-V129 HydrophobicContact CD1-CB 4.46Å; L98-V129 HydrophobicContact CD1-CG2 4.36Å; L98-V129 HydrophobicContact CD2-CB 3.82Å; L98-V129 HydrophobicContact CD2-CG1 4.39Å; L98-V129 HydrophobicContact CD2-CG2 3.93Å; L98-V129 HydrophobicContact CG-CG2 4.39Å; L98-M132 HydrophobicContact CD1-CB 4.21Å; L98-M132 HydrophobicContact CD2-CE 3.49Å; L98-M132 VanDerWaalsContact CD2-CE 3.49Å; L98-P133 HydrophobicContact CD1-CG 4.46Å
99L96.6Very high95.4Very high42 Ų4270.6 Ų70.622%0.2236%0.355CS..Hα-helixtrans-63.9-45.3-172.6-71.5175.7000112.2L39 L42 V95 E96 V102 I103 F122 L126L39-L99 HydrophobicContact CD2-CD2 4.08Å; L39-L99 HydrophobicContact CD2-CG 4.4Å; L42-L99 HydrophobicContact CD2-CD2 4.13Å; V95-L99 HydrophobicContact CG2-CD1 4.44Å; V95-L99 PolarHBondContact O-N 3.45Å; E96-L99 PolarHBondContact O-N 2.91Å; L99-V102 PolarHBondContact O-N 3.21Å; L99-I103 HydrophobicContact CB-CD1 4.47Å; L99-I103 WeakPolarHBondContact O-CB 3.39Å; L99-I103 WeakPolarHBondContact O-CD1 3.39Å; L99-I103 WeakPolarHBondContact O-CG1 3.36Å; L99-I103 PolarHBondContact O-N 2.97Å; L99-F122 HydrophobicContact CD2-CE2 4.46Å; L99-F122 HydrophobicContact CD2-CZ 4.21Å; L99-L126 HydrophobicContact CD2-CD1 3.89Å; L99-L126 HydrophobicContact CD2-CD2 4.3Å
100I96.9Very high95.6Very high120 Ų12064.8 Ų64.862%0.61533%0.328SS*.Hα-helixtrans-63.4-51.1-175.8-63.5168.4000111.1E96 L98 V102 I103 G104E96-I100 HydrophobicContact CB-CD1 4.22Å; E96-I100 WeakPolarHBondContact O-CB 3.45Å; E96-I100 WeakPolarHBondContact O-CG1 3.34Å; E96-I100 PolarHBondContact O-N 3.26Å; L98-I100 PolarHBondContact O-N 3.37Å; I100-V102 PolarHBondContact O-N 2.98Å; I100-I103 PolarHBondContact O-N 3.37Å; I100-G104 PolarHBondContact O-N 3.42Å
101P96.8Very high95.8Very high66 Ų6668.6 Ų68.643%0.42934%0.34SS..Hα-helixtrans-63.7-40.2176.4-24.736.4000113.2F97 L98 G104 L105F97-P101 VanDerWaalsContact O-CD 3.32Å; F97-P101 WeakPolarHBondContact O-CD 3.42Å; F97-P101 WeakPolarHBondContact O-CG 3.42Å; L98-P101 WeakPolarHBondContact O-CD 3.42Å; P101-G104 PolarHBondContact O-N 3.43Å; P101-L105 WeakPolarHBondContact O-CB 3.27Å; P101-L105 VanDerWaalsContact O-CG 3.3Å; P101-L105 WeakPolarHBondContact O-CG 3.48Å; P101-L105 PolarHBondContact O-N 2.85Å
102V97.2Very high95.9Very high10 Ų1070.5 Ų70.56%0.06136%0.357CS..Hα-helixtrans-66-40.7-179.31670000111.7L98 L99 I100 S106 F122 F125 L126 V129L98-V102 WeakPolarHBondContact O-CB 3.31Å; L98-V102 WeakPolarHBondContact O-CG2 3.36Å; L98-V102 PolarHBondContact O-N 3.13Å; L99-V102 PolarHBondContact O-N 3.21Å; I100-V102 PolarHBondContact O-N 2.98Å; V102-S106 WeakPolarHBondContact O-CB 3.4Å; V102-S106 PolarHBondContact O-N 3Å; V102-S106 PolarHBondContact O-OG 2.87Å; V102-F122 HydrophobicContact CG1-CD2 3.65Å; V102-F122 HydrophobicContact CG1-CE2 3.77Å; V102-F125 HydrophobicContact CB-CB 4.5Å; V102-F125 HydrophobicContact CG1-CB 3.7Å; V102-F125 HydrophobicContact CG2-CB 4.34Å; V102-L126 HydrophobicContact CG1-CB 3.91Å; V102-V129 HydrophobicContact CG2-CG2 4.01Å
103I97.5Very high95.9Very high75 Ų7574.7 Ų74.739%0.38537%0.37SS..Hα-helixtrans-61.1-53.5172.5-69.1166.1000108.9L99 I100 L105 S106 F107 F122L99-I103 HydrophobicContact CB-CD1 4.47Å; L99-I103 WeakPolarHBondContact O-CB 3.39Å; L99-I103 WeakPolarHBondContact O-CD1 3.39Å; L99-I103 WeakPolarHBondContact O-CG1 3.36Å; L99-I103 PolarHBondContact O-N 2.97Å; I100-I103 PolarHBondContact O-N 3.37Å; I103-L105 VanDerWaalsContact C-N 3.34Å; I103-L105 PolarHBondContact O-N 3.41Å; I103-S106 PolarHBondContact O-N 3.3Å; I103-S106 VanDerWaalsContact O-N 3.09Å; I103-S106 PolarHBondContact O-OG 3.29Å; I103-F107 HydrophobicContact CG2-CD2 4.09Å; I103-F107 HydrophobicContact CG2-CE2 4.02Å; I103-F107 WeakPolarHBondContact O-CD2 3.15Å; I103-F107 PolarHBondContact O-N 3.43Å; I103-F122 HydrophobicContact CD1-CE2 4.49Å; I103-F122 HydrophobicContact CG1-CD2 3.95Å; I103-F122 HydrophobicContact CG1-CE2 3.59Å
104G97.3Very high95.9Very high32 Ų3276.3 Ų76.333%0.3338%0.383SS..Hα-helixtrans-53.5-49.6179.100000112.6I100 P101 S106 F107 L108I100-G104 PolarHBondContact O-N 3.42Å; P101-G104 PolarHBondContact O-N 3.43Å; G104-S106 VanDerWaalsContact C-N 3.34Å; G104-S106 PolarHBondContact O-N 3.1Å; G104-F107 PolarHBondContact O-N 2.99Å; G104-L108 VanDerWaalsContact O-CG 3.32Å; G104-L108 WeakPolarHBondContact O-CG 2.78Å; G104-L108 PolarHBondContact O-N 2.89Å; G104-L108 VanDerWaalsContact O-N 3.14Å
105L96Very high95.9Very high83 Ų8374.4 Ų74.444%0.43539%0.389SS..Hα-helixtrans-60.6-39.4177.6-74.3170.4000112.5P101 I103 F107 L108 E109 F125P101-L105 WeakPolarHBondContact O-CB 3.27Å; P101-L105 VanDerWaalsContact O-CG 3.3Å; P101-L105 WeakPolarHBondContact O-CG 3.48Å; P101-L105 PolarHBondContact O-N 2.85Å; I103-L105 VanDerWaalsContact C-N 3.34Å; I103-L105 PolarHBondContact O-N 3.41Å; L105-F107 VanDerWaalsContact C-N 3.27Å; L105-F107 PolarHBondContact O-N 2.87Å; L105-L108 PolarHBondContact O-N 3.49Å; L105-E109 PolarHBondContact O-N 2.86Å; L105-F125 HydrophobicContact CB-CD2 3.94Å; L105-F125 HydrophobicContact CB-CE2 3.91Å
106S96.8Very high95.7Very high2 Ų277 Ų771%0.01440%0.402CS..Hα-helixtrans-64.5-30.1178.969.60000113.9V102 I103 G104 N110V102-S106 WeakPolarHBondContact O-CB 3.4Å; V102-S106 PolarHBondContact O-N 3Å; V102-S106 PolarHBondContact O-OG 2.87Å; I103-S106 PolarHBondContact O-N 3.3Å; I103-S106 VanDerWaalsContact O-N 3.09Å; I103-S106 PolarHBondContact O-OG 3.29Å; G104-S106 VanDerWaalsContact C-N 3.34Å; G104-S106 PolarHBondContact O-N 3.1Å; S106-N110 PolarHBondContact O-ND2 3.39Å
107F96.2Very high95.7Very high104 Ų10474.9 Ų74.946%0.45639%0.392SS..Hα-helixtrans-79.7-30.4174.4-82.8-89.5000112.7I103 G104 L105 N110 F113 I118I103-F107 HydrophobicContact CG2-CD2 4.09Å; I103-F107 HydrophobicContact CG2-CE2 4.02Å; I103-F107 WeakPolarHBondContact O-CD2 3.15Å; I103-F107 PolarHBondContact O-N 3.43Å; G104-F107 PolarHBondContact O-N 2.99Å; L105-F107 VanDerWaalsContact C-N 3.27Å; L105-F107 PolarHBondContact O-N 2.87Å; F107-N110 PolarHBondContact O-ND2 3.21Å; F107-F113 HydrophobicContact CD1-CE2 4.02Å; F107-F113 AromaticContact CD1-CZ 3.83Å; F107-F113 HydrophobicContact CD1-CZ 3.83Å; F107-F113 HydrophobicContact CE1-CZ 4.36Å; F107-I118 HydrophobicContact CD1-CD1 4.01Å; F107-I118 HydrophobicContact CD1-CG2 4.39Å; F107-I118 HydrophobicContact CD2-CG2 4.14Å; F107-I118 HydrophobicContact CE1-CD1 3.96Å; F107-I118 HydrophobicContact CE1-CG2 4.28Å; F107-I118 HydrophobicContact CE2-CG2 4.01Å; F107-I118 HydrophobicContact CG-CG2 4.33Å; F107-I118 HydrophobicContact CZ-CG2 4.08Å
108L95.6Very high95.8Very high137 Ų13769.4 Ų69.472%0.71737%0.368SS*.Hα-helixtrans-82.9-40.9-178.5-66.1173.2000112.7G104 L105G104-L108 VanDerWaalsContact O-CG 3.32Å; G104-L108 WeakPolarHBondContact O-CG 2.78Å; G104-L108 PolarHBondContact O-N 2.89Å; G104-L108 VanDerWaalsContact O-N 3.14Å; L105-L108 PolarHBondContact O-N 3.49Å
109E94.5Very high95.9Very high116 Ų11671.7 Ų71.754%0.54238%0.38SS..SBendtrans-121.597.2-174.1-67.3-64.5157.500109.5L105 T121 F125L105-E109 PolarHBondContact O-N 2.86Å; E109-T121 WeakPolarHBondContact O-CG2 3.15Å; E109-F125 HydrophobicContact CB-CZ 4.34Å
110N94.8Very high95.9Very high34 Ų3472.8 Ų72.818%0.18238%0.381CS..  trans-149.6162.3176.953.779.7000110.5S106 F107 A112 F113S106-N110 PolarHBondContact O-ND2 3.39Å; F107-N110 PolarHBondContact O-ND2 3.21Å; N110-A112 PolarHBondContact OD1-O 3.24Å; N110-A112 VanDerWaalsContact OD1-O 3.11Å; N110-F113 PolarHBondContact OD1-N 3.35Å
111Y92.9Very high95.9Very high120 Ų12067.1 Ų67.147%0.47135%0.352SS..SBendtrans-78.8-25.8179.1-65.2-56.6000113.4E117 W120 D177 Q178 I179Y111-E117 WeakPolarHBondContact CD2-OE1 3.28Å; Y111-W120 HydrophobicContact CD2-CZ3 4.07Å; Y111-W120 HydrophobicContact CE2-CH2 4.27Å; Y111-W120 AromaticContact CE2-CZ3 3.97Å; Y111-W120 HydrophobicContact CE2-CZ3 3.97Å; Y111-D177 PolarHBondContact OH-OD1 3.33Å; Y111-Q178 PolarHBondContact OH-N 3.17Å; Y111-Q178 VanDerWaalsContact OH-N 3.13Å; Y111-I179 HydrophobicContact CD2-CD1 4.1Å; Y111-I179 HydrophobicContact CE1-CD1 4.2Å; Y111-I179 HydrophobicContact CE1-CG1 4.45Å; Y111-I179 HydrophobicContact CE2-CB 4.25Å; Y111-I179 HydrophobicContact CE2-CD1 3.75Å; Y111-I179 HydrophobicContact CE2-CG1 4.13Å; Y111-I179 HydrophobicContact CG-CD1 4.47Å; Y111-I179 PolarHBondContact OH-N 3.39Å
112A94.6Very high96Very high44 Ų4464.7 Ų64.736%0.36434%0.335SS..SBendtrans-155.4139.717700000110.6N110 T114 E117N110-A112 PolarHBondContact OD1-O 3.24Å; N110-A112 VanDerWaalsContact OD1-O 3.11Å; A112-T114 HydrophobicContact CB-CG2 4.39Å; A112-T114 PolarHBondContact O-N 3.12Å; A112-E117 HydrophobicContact CB-CB 4.4Å; A112-E117 HydrophobicContact CB-CG 4.13Å; A112-E117 VanDerWaalsContact O-CB 3.3Å; A112-E117 WeakPolarHBondContact O-CB 3.4Å; A112-E117 WeakPolarHBondContact O-CG 3Å
113F95.5Very high96Very high149 Ų14964.2 Ų64.265%0.65433%0.332SS*.SBendtrans-80.862.3-179.4-152.7-96.2000111.8F107 N110 I118F107-F113 HydrophobicContact CD1-CE2 4.02Å; F107-F113 AromaticContact CD1-CZ 3.83Å; F107-F113 HydrophobicContact CD1-CZ 3.83Å; F107-F113 HydrophobicContact CE1-CZ 4.36Å; N110-F113 PolarHBondContact OD1-N 3.35Å; F113-I118 HydrophobicContact CD1-CD1 4.36Å; F113-I118 HydrophobicContact CD2-CD1 4.04Å; F113-I118 HydrophobicContact CE1-CD1 4.37Å; F113-I118 HydrophobicContact CE2-CD1 4.06Å; F113-I118 HydrophobicContact CG-CD1 4.2Å; F113-I118 HydrophobicContact CZ-CD1 4.24Å
114T95.7Very high96Very high65 Ų6561.7 Ų61.740%0.39932%0.319SS..SBendtrans-120.9151.217670.30000110A112 L116 E117 I118A112-T114 HydrophobicContact CB-CG2 4.39Å; A112-T114 PolarHBondContact O-N 3.12Å; T114-L116 VanDerWaalsContact C-N 3.31Å; T114-L116 PolarHBondContact O-N 2.85Å; T114-E117 PolarHBondContact O-N 3.08Å; T114-E117 VanDerWaalsContact OG1-CB 3.29Å; T114-E117 WeakPolarHBondContact OG1-CB 3.35Å; T114-E117 PolarHBondContact OG1-N 2.56Å; T114-I118 WeakPolarHBondContact O-CG1 3.47Å; T114-I118 PolarHBondContact O-N 2.82Å
115P94.8Very high96Very high105 Ų10561.7 Ų61.768%0.68231%0.31SS*.Hα-helixtrans-56.3-41.7-177.7-27.735.3000113.9L119P115-L119 VanDerWaalsContact O-CB 3.31Å; P115-L119 WeakPolarHBondContact O-CB 3.46Å; P115-L119 WeakPolarHBondContact O-CD1 2.86Å; P115-L119 WeakPolarHBondContact O-CG 3.35Å; P115-L119 PolarHBondContact O-N 3.14Å
116L94.4Very high96.1Very high84 Ų8457.7 Ų57.744%0.4429%0.289SS..Hα-helixtrans-66.9-41.9179.7-74.5175.2000112.1L49 T114 L119 W120L49-L116 HydrophobicContact CB-CD2 3.84Å; T114-L116 VanDerWaalsContact C-N 3.31Å; T114-L116 PolarHBondContact O-N 2.85Å; L116-L119 PolarHBondContact O-N 3.36Å; L116-W120 WeakPolarHBondContact O-CB 3.44Å; L116-W120 PolarHBondContact O-N 3.35Å
117E94.7Very high96.1Very high45 Ų4557.8 Ų57.821%0.2129%0.289CS..Hα-helixtrans-69.2-44.4179.8-173.160.1-15300111.3Y111 A112 T114 L119 W120 T121Y111-E117 WeakPolarHBondContact CD2-OE1 3.28Å; A112-E117 HydrophobicContact CB-CB 4.4Å; A112-E117 HydrophobicContact CB-CG 4.13Å; A112-E117 VanDerWaalsContact O-CB 3.3Å; A112-E117 WeakPolarHBondContact O-CB 3.4Å; A112-E117 WeakPolarHBondContact O-CG 3Å; T114-E117 PolarHBondContact O-N 3.08Å; T114-E117 VanDerWaalsContact OG1-CB 3.29Å; T114-E117 WeakPolarHBondContact OG1-CB 3.35Å; T114-E117 PolarHBondContact OG1-N 2.56Å; E117-L119 VanDerWaalsContact C-N 3.31Å; E117-L119 PolarHBondContact O-N 2.92Å; E117-W120 WeakPolarHBondContact O-CB 3.39Å; E117-W120 PolarHBondContact O-N 2.87Å; E117-W120 VanDerWaalsContact O-N 3.17Å; E117-T121 PolarHBondContact O-N 2.67Å; E117-T121 PolarHBondContact O-OG1 3.46Å; E117-T121 VanDerWaalsContact O-OG1 3.04Å
118I97.3Very high96Very high13 Ų1353.2 Ų53.27%0.06727%0.27CS..Hα-helixtrans-59.9-42.9175.6-66.5167.8000110.5F107 F113 T114 T121 F122F107-I118 HydrophobicContact CD1-CD1 4.01Å; F107-I118 HydrophobicContact CD1-CG2 4.39Å; F107-I118 HydrophobicContact CD2-CG2 4.14Å; F107-I118 HydrophobicContact CE1-CD1 3.96Å; F107-I118 HydrophobicContact CE1-CG2 4.28Å; F107-I118 HydrophobicContact CE2-CG2 4.01Å; F107-I118 HydrophobicContact CG-CG2 4.33Å; F107-I118 HydrophobicContact CZ-CG2 4.08Å; F113-I118 HydrophobicContact CD1-CD1 4.36Å; F113-I118 HydrophobicContact CD2-CD1 4.04Å; F113-I118 HydrophobicContact CE1-CD1 4.37Å; F113-I118 HydrophobicContact CE2-CD1 4.06Å; F113-I118 HydrophobicContact CG-CD1 4.2Å; F113-I118 HydrophobicContact CZ-CD1 4.24Å; T114-I118 WeakPolarHBondContact O-CG1 3.47Å; T114-I118 PolarHBondContact O-N 2.82Å; I118-T121 PolarHBondContact O-N 2.7Å; I118-F122 WeakPolarHBondContact O-CB 3.3Å; I118-F122 PolarHBondContact O-N 3.38Å
119L97.3Very high96Very high59 Ų5947.6 Ų47.631%0.30924%0.241SC..Hα-helixtrans-68-35.9177.3-73169.5000112.5T46 L49 P115 L116 E117 S123T46-L119 HydrophobicContact CG2-CD2 3.97Å; L49-L119 HydrophobicContact CD1-CB 4.39Å; L49-L119 HydrophobicContact CD1-CD1 3.45Å; L49-L119 VanDerWaalsContact CD1-CD1 3.45Å; L49-L119 HydrophobicContact CD1-CG 4.47Å; P115-L119 VanDerWaalsContact O-CB 3.31Å; P115-L119 WeakPolarHBondContact O-CB 3.46Å; P115-L119 WeakPolarHBondContact O-CD1 2.86Å; P115-L119 WeakPolarHBondContact O-CG 3.35Å; P115-L119 PolarHBondContact O-N 3.14Å; L116-L119 PolarHBondContact O-N 3.36Å; E117-L119 VanDerWaalsContact C-N 3.31Å; E117-L119 PolarHBondContact O-N 2.92Å; L119-S123 WeakPolarHBondContact O-CB 3.38Å; L119-S123 PolarHBondContact O-N 3.25Å
120W97.1Very high96.1Very high66 Ų6642 Ų4225%0.2522%0.216CC..Hα-helixtrans-63.2-50.1172178.188.7000110.7Y111 L116 E117 F122 S123 I124 D177Y111-W120 HydrophobicContact CD2-CZ3 4.07Å; Y111-W120 HydrophobicContact CE2-CH2 4.27Å; Y111-W120 AromaticContact CE2-CZ3 3.97Å; Y111-W120 HydrophobicContact CE2-CZ3 3.97Å; L116-W120 WeakPolarHBondContact O-CB 3.44Å; L116-W120 PolarHBondContact O-N 3.35Å; E117-W120 WeakPolarHBondContact O-CB 3.39Å; E117-W120 PolarHBondContact O-N 2.87Å; E117-W120 VanDerWaalsContact O-N 3.17Å; W120-F122 PolarHBondContact O-N 3.37Å; W120-S123 WeakPolarHBondContact O-CB 3.45Å; W120-S123 PolarHBondContact O-N 3Å; W120-S123 VanDerWaalsContact O-N 3.1Å; W120-S123 PolarHBondContact O-OG 2.8Å; W120-I124 HydrophobicContact CD2-CG1 4.22Å; W120-I124 HydrophobicContact CE3-CG1 4.39Å; W120-I124 HydrophobicContact CH2-CD1 4.48Å; W120-I124 HydrophobicContact CH2-CG1 4.07Å; W120-I124 HydrophobicContact CZ2-CD1 3.97Å; W120-I124 HydrophobicContact CZ2-CG1 3.91Å; W120-I124 HydrophobicContact CZ3-CG1 4.31Å; W120-I124 WeakPolarHBondContact O-CG1 3.36Å; W120-I124 PolarHBondContact O-N 2.68Å; W120-I124 VanDerWaalsContact O-N 3.11Å; W120-D177 WeakPolarHBondContact CH2-OD2 3.3Å
121T97.3Very high96Very high0 Ų040.4 Ų40.40%021%0.207CC..Hα-helixtrans-61.9-44.1177.8-54.60000112.1E109 E117 I118 S123 I124 F125 I179E109-T121 WeakPolarHBondContact O-CG2 3.15Å; E117-T121 PolarHBondContact O-N 2.67Å; E117-T121 PolarHBondContact O-OG1 3.46Å; E117-T121 VanDerWaalsContact O-OG1 3.04Å; I118-T121 PolarHBondContact O-N 2.7Å; T121-S123 VanDerWaalsContact C-N 3.27Å; T121-S123 PolarHBondContact O-N 3.32Å; T121-I124 WeakPolarHBondContact O-CB 3.35Å; T121-I124 PolarHBondContact O-N 3.4Å; T121-F125 HydrophobicContact CG2-CD2 3.87Å; T121-F125 HydrophobicContact CG2-CE2 3.4Å; T121-F125 HydrophobicContact CG2-CZ 3.85Å; T121-F125 PolarHBondContact O-N 2.9Å; T121-I179 HydrophobicContact CG2-CD1 4.09Å; T121-I179 HydrophobicContact CG2-CG2 3.93Å
122F98.3Very high96Very high16 Ų1637.1 Ų37.17%0.0720%0.196CC..Hα-helixtrans-52.5-46.5171.5167-98000111.4L42 T46 L99 V102 I103 I118 W120 I124 F125 L126L42-F122 HydrophobicContact CD2-CE1 4.2Å; L42-F122 HydrophobicContact CD2-CZ 3.98Å; L42-F122 HydrophobicContact CG-CE1 4.11Å; L42-F122 HydrophobicContact CG-CZ 4.4Å; T46-F122 HydrophobicContact CG2-CD1 3.93Å; T46-F122 HydrophobicContact CG2-CE1 3.88Å; L99-F122 HydrophobicContact CD2-CE2 4.46Å; L99-F122 HydrophobicContact CD2-CZ 4.21Å; V102-F122 HydrophobicContact CG1-CD2 3.65Å; V102-F122 HydrophobicContact CG1-CE2 3.77Å; I103-F122 HydrophobicContact CD1-CE2 4.49Å; I103-F122 HydrophobicContact CG1-CD2 3.95Å; I103-F122 HydrophobicContact CG1-CE2 3.59Å; I118-F122 WeakPolarHBondContact O-CB 3.3Å; I118-F122 PolarHBondContact O-N 3.38Å; W120-F122 PolarHBondContact O-N 3.37Å; F122-I124 VanDerWaalsContact C-N 3.28Å; F122-I124 PolarHBondContact O-N 2.84Å; F122-F125 PolarHBondContact O-N 2.91Å; F122-L126 HydrophobicContact CE1-CD2 3.81Å; F122-L126 HydrophobicContact CE2-CD2 4.45Å; F122-L126 HydrophobicContact CZ-CB 4.4Å; F122-L126 HydrophobicContact CZ-CD2 3.62Å; F122-L126 HydrophobicContact CZ-CG 4.48Å; F122-L126 VanDerWaalsContact O-CB 3.24Å; F122-L126 WeakPolarHBondContact O-CB 3.17Å; F122-L126 PolarHBondContact O-N 2.97Å
123S98.1Very high95.9Very high0 Ų035 Ų350%018%0.179CC..Hα-helixtrans-62.3-36.2178.984.90000112.3T46 R47 L119 W120 T121 E127T46-S123 WeakPolarHBondContact OG1-CB 3.35Å; R47-S123 WeakPolarHBondContact CB-OG 3.47Å; R47-S123 PolarHBondContact NE-OG 2.79Å; R47-S123 VanDerWaalsContact NH2-C 3.31Å; R47-S123 PolarHBondContact NH2-O 2.82Å; L119-S123 WeakPolarHBondContact O-CB 3.38Å; L119-S123 PolarHBondContact O-N 3.25Å; W120-S123 WeakPolarHBondContact O-CB 3.45Å; W120-S123 PolarHBondContact O-N 3Å; W120-S123 VanDerWaalsContact O-N 3.1Å; W120-S123 PolarHBondContact O-OG 2.8Å; T121-S123 VanDerWaalsContact C-N 3.27Å; T121-S123 PolarHBondContact O-N 3.32Å; S123-E127 VanDerWaalsContact O-CB 3.3Å; S123-E127 WeakPolarHBondContact O-CB 3.34Å; S123-E127 PolarHBondContact O-N 2.71Å
124I97.1Very high95.8Very high21 Ų2127.9 Ų27.911%0.10815%0.148CC..Hα-helixtrans-68-49.8179.1-64.4-70.2000110.2W120 T121 F122 E127 S128 I179 S183W120-I124 HydrophobicContact CD2-CG1 4.22Å; W120-I124 HydrophobicContact CE3-CG1 4.39Å; W120-I124 HydrophobicContact CH2-CD1 4.48Å; W120-I124 HydrophobicContact CH2-CG1 4.07Å; W120-I124 HydrophobicContact CZ2-CD1 3.97Å; W120-I124 HydrophobicContact CZ2-CG1 3.91Å; W120-I124 HydrophobicContact CZ3-CG1 4.31Å; W120-I124 WeakPolarHBondContact O-CG1 3.36Å; W120-I124 PolarHBondContact O-N 2.68Å; W120-I124 VanDerWaalsContact O-N 3.11Å; T121-I124 WeakPolarHBondContact O-CB 3.35Å; T121-I124 PolarHBondContact O-N 3.4Å; F122-I124 VanDerWaalsContact C-N 3.28Å; F122-I124 PolarHBondContact O-N 2.84Å; I124-E127 PolarHBondContact O-N 3.05Å; I124-S128 PolarHBondContact O-N 3.02Å; I124-I179 HydrophobicContact CB-CG2 4.46Å; I124-I179 HydrophobicContact CG2-CG2 4.02Å; I124-S183 WeakPolarHBondContact CG2-OG 3.41Å
125F97.5Very high95.4Very high32 Ų3226.3 Ų26.314%0.1414%0.137CC..Hα-helixtrans-63.1-44.3176.4-68.2-31000111.9V102 L105 E109 T121 F122 E127 S128 I179 S183V102-F125 HydrophobicContact CB-CB 4.5Å; V102-F125 HydrophobicContact CG1-CB 3.7Å; V102-F125 HydrophobicContact CG2-CB 4.34Å; L105-F125 HydrophobicContact CB-CD2 3.94Å; L105-F125 HydrophobicContact CB-CE2 3.91Å; E109-F125 HydrophobicContact CB-CZ 4.34Å; T121-F125 HydrophobicContact CG2-CD2 3.87Å; T121-F125 HydrophobicContact CG2-CE2 3.4Å; T121-F125 HydrophobicContact CG2-CZ 3.85Å; T121-F125 PolarHBondContact O-N 2.9Å; F122-F125 PolarHBondContact O-N 2.91Å; F125-E127 PolarHBondContact O-N 3.18Å; F125-S128 WeakPolarHBondContact O-CB 3.21Å; F125-S128 PolarHBondContact O-N 3.06Å; F125-S128 PolarHBondContact O-OG 3.07Å; F125-I179 HydrophobicContact CE1-CG2 3.79Å; F125-I179 HydrophobicContact CZ-CG2 3.93Å; F125-S183 WeakPolarHBondContact CD1-OG 3.35Å; F125-S183 WeakPolarHBondContact CE1-OG 3.39Å
126L98.1Very high95Very high0 Ų025.4 Ų25.40%012%0.122CC..Hα-helixtrans-63.1-42.9-179.5-175.960.3000112L39 L42 V43 L99 V102 F122 S128 V129 A130L39-L126 HydrophobicContact CD2-CD1 4.24Å; L42-L126 HydrophobicContact CB-CD2 4.23Å; L42-L126 HydrophobicContact CD2-CD2 3.81Å; L42-L126 HydrophobicContact CG-CD2 3.99Å; V43-L126 HydrophobicContact CG2-CB 3.86Å; V43-L126 HydrophobicContact CG2-CD2 3.8Å; V43-L126 HydrophobicContact CG2-CG 3.71Å; L99-L126 HydrophobicContact CD2-CD1 3.89Å; L99-L126 HydrophobicContact CD2-CD2 4.3Å; V102-L126 HydrophobicContact CG1-CB 3.91Å; F122-L126 HydrophobicContact CE1-CD2 3.81Å; F122-L126 HydrophobicContact CE2-CD2 4.45Å; F122-L126 HydrophobicContact CZ-CB 4.4Å; F122-L126 HydrophobicContact CZ-CD2 3.62Å; F122-L126 HydrophobicContact CZ-CG 4.48Å; F122-L126 VanDerWaalsContact O-CB 3.24Å; F122-L126 WeakPolarHBondContact O-CB 3.17Å; F122-L126 PolarHBondContact O-N 2.97Å; L126-S128 PolarHBondContact O-N 3.25Å; L126-V129 HydrophobicContact CD1-CG2 4.43Å; L126-V129 WeakPolarHBondContact O-CG2 3.31Å; L126-V129 PolarHBondContact O-N 2.62Å; L126-V129 VanDerWaalsContact O-N 3.13Å; L126-A130 WeakPolarHBondContact O-CB 3.26Å; L126-A130 PolarHBondContact O-N 2.88Å
127E97.1Very high94.7Very high4 Ų421.4 Ų21.42%0.01910%0.101CC..Hα-helixtrans-60.1-33.6179.7-167.6-178.4-154.500112.2H12 F40 V43 R47 S123 I124 F125 V129 A130 Y158 R159 Q187H12-E127 IonicContact CE1-OE1 3.76Å; F40-E127 HydrophobicContact CE1-CG 4.49Å; V43-E127 HydrophobicContact CG1-CB 3.81Å; V43-E127 HydrophobicContact CG1-CG 4.06Å; V43-E127 HydrophobicContact CG2-CB 3.89Å; R47-E127 IonicContact CZ-OE2 3.15Å; R47-E127 IonicContact NH1-OE1 2.7Å; R47-E127 PolarHBondContact NH1-OE1 3.15Å; R47-E127 IonicContact NH1-OE2 2.67Å; R47-E127 PolarHBondContact NH1-OE2 3.46Å; R47-E127 IonicContact NH2-OE2 2.71Å; R47-E127 PolarHBondContact NH2-OE2 3.49Å; S123-E127 VanDerWaalsContact O-CB 3.3Å; S123-E127 WeakPolarHBondContact O-CB 3.34Å; S123-E127 PolarHBondContact O-N 2.71Å; I124-E127 PolarHBondContact O-N 3.05Å; F125-E127 PolarHBondContact O-N 3.18Å; E127-V129 PolarHBondContact O-N 3.43Å; E127-A130 PolarHBondContact O-N 3.23Å; E127-Y158 PolarHBondContact OE1-OH 3.42Å; E127-R159 IonicContact OE1-CZ 3.96Å; E127-R159 IonicContact OE1-NH2 2.79Å; E127-R159 PolarHBondContact OE1-NH2 3.5Å; E127-R159 IonicContact OE2-CZ 3.78Å; E127-R159 IonicContact OE2-NH2 2.82Å; E127-R159 PolarHBondContact OE2-NH2 3.44Å; E127-Q187 PolarHBondContact O-NE2 3.26Å
128S94.4Very high94.3Very high8 Ų819.5 Ų19.56%0.0569%0.092CC..Hα-helixtrans-62.4-27.8-179.977.40000113.4I124 F125 L126 S183 F190I124-S128 PolarHBondContact O-N 3.02Å; F125-S128 WeakPolarHBondContact O-CB 3.21Å; F125-S128 PolarHBondContact O-N 3.06Å; F125-S128 PolarHBondContact O-OG 3.07Å; L126-S128 PolarHBondContact O-N 3.25Å; S128-S183 VanDerWaalsContact CB-O 3.31Å; S128-S183 WeakPolarHBondContact CB-O 3.38Å; S128-F190 WeakPolarHBondContact O-CD2 3.39Å
129V95.4Very high93.5Very high18 Ų1820.9 Ų20.911%0.10910%0.101CC..Hα-helixtrans-115.9-6.3-176.8-650000113.7L98 V102 L126 E127 I131 M132 F190L98-V129 HydrophobicContact CB-CG2 4.23Å; L98-V129 HydrophobicContact CD1-CB 4.46Å; L98-V129 HydrophobicContact CD1-CG2 4.36Å; L98-V129 HydrophobicContact CD2-CB 3.82Å; L98-V129 HydrophobicContact CD2-CG1 4.39Å; L98-V129 HydrophobicContact CD2-CG2 3.93Å; L98-V129 HydrophobicContact CG-CG2 4.39Å; V102-V129 HydrophobicContact CG2-CG2 4.01Å; L126-V129 HydrophobicContact CD1-CG2 4.43Å; L126-V129 WeakPolarHBondContact O-CG2 3.31Å; L126-V129 PolarHBondContact O-N 2.62Å; L126-V129 VanDerWaalsContact O-N 3.13Å; E127-V129 PolarHBondContact O-N 3.43Å; V129-I131 PolarHBondContact O-N 3.26Å; V129-M132 HydrophobicContact CB-CG 4.35Å; V129-M132 VanDerWaalsContact O-CB 3.29Å; V129-M132 WeakPolarHBondContact O-CB 3.24Å; V129-M132 VanDerWaalsContact O-CG 3.26Å; V129-M132 WeakPolarHBondContact O-CG 3.47Å; V129-M132 PolarHBondContact O-N 3.26Å; V129-F190 HydrophobicContact CG1-CE2 3.9Å; V129-F190 HydrophobicContact CG1-CZ 4.5Å
130A96.1Very high92.7Very high0 Ų022.4 Ų22.40%011%0.106CC..THydrogen-bonded Turntrans-59.5-22.1-17500000114S36 L39 F40 L126 E127 P133S36-A130 WeakPolarHBondContact CA-O 3.32Å; S36-A130 VanDerWaalsContact CB-O 3.3Å; S36-A130 WeakPolarHBondContact CB-O 3.32Å; S36-A130 PolarHBondContact OG-O 3.44Å; L39-A130 HydrophobicContact CB-CB 3.81Å; F40-A130 HydrophobicContact CD1-CB 3.81Å; F40-A130 HydrophobicContact CE1-CB 3.62Å; F40-A130 HydrophobicContact CG-CB 4.32Å; F40-A130 HydrophobicContact CZ-CB 3.99Å; L126-A130 WeakPolarHBondContact O-CB 3.26Å; L126-A130 PolarHBondContact O-N 2.88Å; E127-A130 PolarHBondContact O-N 3.23Å; A130-P133 WeakPolarHBondContact O-CD 3.29Å
131I92.9Very high91.9Very high0 Ų021.6 Ų21.60%011%0.108CC..THydrogen-bonded Turntrans-79.5-15.1177.6-160.361.2000113.8F40 V129 Q134 L135 L152 L155 F190 Y191F40-I131 HydrophobicContact CE2-CD1 3.96Å; F40-I131 HydrophobicContact CZ-CB 4.18Å; F40-I131 HydrophobicContact CZ-CD1 4.03Å; V129-I131 PolarHBondContact O-N 3.26Å; I131-Q134 HydrophobicContact CD1-CB 3.99Å; I131-Q134 HydrophobicContact CD1-CG 4.29Å; I131-Q134 WeakPolarHBondContact O-CB 3.43Å; I131-Q134 PolarHBondContact O-N 3.02Å; I131-Q134 VanDerWaalsContact O-N 3.07Å; I131-L135 HydrophobicContact CG1-CG 4.19Å; I131-L135 HydrophobicContact CG2-CD1 3.94Å; I131-L135 HydrophobicContact CG2-CG 4.44Å; I131-L135 PolarHBondContact O-N 3.46Å; I131-L152 HydrophobicContact CD1-CD2 3.71Å; I131-L152 HydrophobicContact CG1-CD2 4.21Å; I131-L155 HydrophobicContact CD1-CD2 3.82Å; I131-F190 HydrophobicContact CG2-CB 4.4Å; I131-Y191 HydrophobicContact CB-CE1 4.49Å; I131-Y191 HydrophobicContact CD1-CE1 4.5Å; I131-Y191 HydrophobicContact CG1-CE1 3.87Å; I131-Y191 HydrophobicContact CG2-CE1 4.45Å; I131-Y191 HydrophobicContact CG2-CE2 4.49Å
132M92.3Very high90.5Very high50 Ų5022.6 Ų22.625%0.24612%0.118CC..Hα-helixtrans-55.5-44.4-174.2-71.3-119.5-74.600114.1F93 L98 V129 Q134 L135 F136 F190F93-M132 HydrophobicContact CE2-CB 4.21Å; F93-M132 HydrophobicContact CE2-CE 4.4Å; F93-M132 HydrophobicContact CZ-CB 4.13Å; F93-M132 HydrophobicContact CZ-CE 4.02Å; L98-M132 HydrophobicContact CD1-CB 4.21Å; L98-M132 HydrophobicContact CD2-CE 3.49Å; L98-M132 VanDerWaalsContact CD2-CE 3.49Å; V129-M132 HydrophobicContact CB-CG 4.35Å; V129-M132 VanDerWaalsContact O-CB 3.29Å; V129-M132 WeakPolarHBondContact O-CB 3.24Å; V129-M132 VanDerWaalsContact O-CG 3.26Å; V129-M132 WeakPolarHBondContact O-CG 3.47Å; V129-M132 PolarHBondContact O-N 3.26Å; M132-Q134 VanDerWaalsContact C-N 3.33Å; M132-Q134 PolarHBondContact O-N 2.86Å; M132-L135 PolarHBondContact O-N 3.39Å; M132-F136 WeakPolarHBondContact O-CB 3.33Å; M132-F136 PolarHBondContact O-N 2.97Å; M132-F190 HydrophobicContact SD-CD1 4.07Å; M132-F190 HydrophobicContact SD-CE1 3.59Å; M132-F190 VanDerWaalsContact SD-CE1 3.59Å; M132-F190 HydrophobicContact SD-CZ 3.84Å
133P93.8Very high88.8Confident0 Ų027 Ų270%014%0.139CC..Hα-helixtrans-56.6-42.8174.7-24.932.6000113.7S33 K35 S36 L39 F93 V95 L98 A130 F136 M137S33-P133 VanDerWaalsContact OG-CB 3.26Å; S33-P133 WeakPolarHBondContact OG-CB 3.46Å; K35-P133 HydrophobicContact CB-CB 3.83Å; K35-P133 HydrophobicContact CB-CG 4.14Å; S36-P133 WeakPolarHBondContact OG-CB 3.48Å; S36-P133 WeakPolarHBondContact OG-CD 3.24Å; L39-P133 HydrophobicContact CD1-CG 4.04Å; F93-P133 HydrophobicContact CB-CB 3.95Å; F93-P133 HydrophobicContact CB-CG 4.35Å; F93-P133 HydrophobicContact CD1-CB 4.27Å; F93-P133 HydrophobicContact CD1-CG 3.74Å; F93-P133 HydrophobicContact CE1-CG 4.34Å; F93-P133 HydrophobicContact CG-CB 4.17Å; F93-P133 HydrophobicContact CG-CG 4.11Å; V95-P133 HydrophobicContact CG1-CG 4.37Å; L98-P133 HydrophobicContact CD1-CG 4.46Å; A130-P133 WeakPolarHBondContact O-CD 3.29Å; P133-F136 PolarHBondContact O-N 3.33Å; P133-M137 WeakPolarHBondContact O-CB 3.13Å; P133-M137 PolarHBondContact O-N 3.13Å
134Q91.9Very high87.2Confident0 Ų027.4 Ų27.40%014%0.142CC..Hα-helixtrans-64.4-44.6176.5-177.965.67100112.3G31 S36 I131 M132 F136 M137 I138 L152G31-Q134 PolarHBondContact O-NE2 3.48Å; S36-Q134 PolarHBondContact OG-N 2.93Å; I131-Q134 HydrophobicContact CD1-CB 3.99Å; I131-Q134 HydrophobicContact CD1-CG 4.29Å; I131-Q134 WeakPolarHBondContact O-CB 3.43Å; I131-Q134 PolarHBondContact O-N 3.02Å; I131-Q134 VanDerWaalsContact O-N 3.07Å; M132-Q134 VanDerWaalsContact C-N 3.33Å; M132-Q134 PolarHBondContact O-N 2.86Å; Q134-F136 VanDerWaalsContact C-N 3.35Å; Q134-M137 PolarHBondContact O-N 2.96Å; Q134-I138 HydrophobicContact CG-CD1 4.11Å; Q134-I138 VanDerWaalsContact O-CG1 3.26Å; Q134-I138 WeakPolarHBondContact O-CG1 3.39Å; Q134-I138 PolarHBondContact O-N 2.89Å; Q134-I138 VanDerWaalsContact O-N 3.09Å; Q134-L152 HydrophobicContact CG-CD2 4.45Å
135L87.4Confident85.7Confident32 Ų3231.1 Ų31.117%0.16816%0.159CC..Hα-helixtrans-63.1-43.9177.6-65.6177.4000111I131 M132 M137 I138 T139 F190 F194I131-L135 HydrophobicContact CG1-CG 4.19Å; I131-L135 HydrophobicContact CG2-CD1 3.94Å; I131-L135 HydrophobicContact CG2-CG 4.44Å; I131-L135 PolarHBondContact O-N 3.46Å; M132-L135 PolarHBondContact O-N 3.39Å; L135-M137 VanDerWaalsContact C-N 3.32Å; L135-M137 PolarHBondContact O-N 2.98Å; L135-I138 PolarHBondContact O-N 2.99Å; L135-T139 PolarHBondContact O-N 3.21Å; L135-T139 PolarHBondContact O-OG1 2.85Å; L135-F190 HydrophobicContact CD1-CB 4.31Å; L135-F194 HydrophobicContact CD2-CB 4.27Å
136F87.8Confident83.9Confident86 Ų8632.7 Ų32.738%0.37717%0.174SC..Hα-helixtrans-61.8-38.7176.4-175.4-90.1000112.6F93 M132 P133 Q134 T139 K140F93-F136 HydrophobicContact CB-CB 4.44Å; F93-F136 HydrophobicContact CB-CD1 4.1Å; F93-F136 HydrophobicContact CB-CG 4.37Å; F93-F136 HydrophobicContact CD2-CB 3.77Å; F93-F136 HydrophobicContact CD2-CD1 4.34Å; F93-F136 HydrophobicContact CD2-CD2 4.12Å; F93-F136 AromaticContact CD2-CG 3.81Å; F93-F136 HydrophobicContact CD2-CG 3.81Å; M132-F136 WeakPolarHBondContact O-CB 3.33Å; M132-F136 PolarHBondContact O-N 2.97Å; P133-F136 PolarHBondContact O-N 3.33Å; Q134-F136 VanDerWaalsContact C-N 3.35Å; F136-T139 WeakPolarHBondContact CA-OG1 3.33Å; F136-T139 PolarHBondContact O-OG1 3.43Å; F136-K140 WeakPolarHBondContact O-CB 3.44Å; F136-K140 PolarHBondContact O-N 2.92Å; F136-K140 VanDerWaalsContact O-N 3.13Å
137M87.8Confident82.3Confident0 Ų036.9 Ų36.90%020%0.196CC..Hα-helixtrans-63.9-43.6175.4-172.7-175.7-176.900111.1D87 N90 D91 P133 Q134 L135 K140 T141D87-M137 HydrophobicContact CB-CE 3.72Å; N90-M137 HydrophobicContact CB-CE 4.21Å; N90-M137 HydrophobicContact CB-CG 4.2Å; D91-M137 HydrophobicContact CB-SD 4.32Å; P133-M137 WeakPolarHBondContact O-CB 3.13Å; P133-M137 PolarHBondContact O-N 3.13Å; Q134-M137 PolarHBondContact O-N 2.96Å; L135-M137 VanDerWaalsContact C-N 3.32Å; L135-M137 PolarHBondContact O-N 2.98Å; M137-K140 PolarHBondContact O-N 3.25Å; M137-T141 HydrophobicContact CG-CG2 4.47Å; M137-T141 WeakPolarHBondContact O-CG2 3.42Å; M137-T141 PolarHBondContact O-N 3.33Å; M137-T141 PolarHBondContact O-OG1 3.42Å
138I84.7Confident81.2Confident4 Ų436.9 Ų36.92%0.02120%0.196CC..Hα-helixtrans-67.6-38.6-179.7-59.2163.1000111.2Q134 L135 K140 T141 G142 A144 L152 L211Q134-I138 HydrophobicContact CG-CD1 4.11Å; Q134-I138 VanDerWaalsContact O-CG1 3.26Å; Q134-I138 WeakPolarHBondContact O-CG1 3.39Å; Q134-I138 PolarHBondContact O-N 2.89Å; Q134-I138 VanDerWaalsContact O-N 3.09Å; L135-I138 PolarHBondContact O-N 2.99Å; I138-K140 VanDerWaalsContact C-N 3.27Å; I138-K140 PolarHBondContact O-N 3.27Å; I138-T141 PolarHBondContact O-OG1 2.89Å; I138-G142 PolarHBondContact O-N 3.09Å; I138-A144 HydrophobicContact CG2-CB 3.75Å; I138-L152 HydrophobicContact CD1-CD1 3.72Å; I138-L211 HydrophobicContact CB-CD1 3.86Å; I138-L211 HydrophobicContact CG2-CD1 3.42Å; I138-L211 VanDerWaalsContact CG2-CD1 3.42Å
139T80.5Confident80.3Confident42 Ų4236.5 Ų36.526%0.25819%0.193SC..Hα-helixtrans-63.8-35.6175.654.80000111.7L135 F136 L211L135-T139 PolarHBondContact O-N 3.21Å; L135-T139 PolarHBondContact O-OG1 2.85Å; F136-T139 WeakPolarHBondContact CA-OG1 3.33Å; F136-T139 PolarHBondContact O-OG1 3.43Å; T139-L211 HydrophobicContact CG2-CB 4.15Å; T139-L211 HydrophobicContact CG2-CD1 3.55Å; T139-L211 HydrophobicContact CG2-CD2 4.11Å; T139-L211 HydrophobicContact CG2-CG 4.15Å
140K80.8Confident79.7Confident91 Ų9139.1 Ų39.140%0.39620%0.204SC..Hα-helixtrans-72.8-42178.7-169.7-179.7179.3-174.90113E89 N90 T92 F136 M137 I138E89-K140 PolarHBondContact O-NZ 3.09Å; N90-K140 HydrophobicContact CB-CD 4.36Å; N90-K140 WeakPolarHBondContact OD1-CE 3.07Å; T92-K140 PolarHBondContact OG1-NZ 3.36Å; T92-K140 VanDerWaalsContact OG1-NZ 3.14Å; F136-K140 WeakPolarHBondContact O-CB 3.44Å; F136-K140 PolarHBondContact O-N 2.92Å; F136-K140 VanDerWaalsContact O-N 3.13Å; M137-K140 PolarHBondContact O-N 3.25Å; I138-K140 VanDerWaalsContact C-N 3.27Å; I138-K140 PolarHBondContact O-N 3.27Å
141T80.9Confident79.3Confident50 Ų5039.3 Ų39.331%0.30721%0.205SC..Hα-helixtrans-81.7-19.8-177.558.90000113.3N90 M137 I138 E143N90-T141 HydrophobicContact CB-CG2 3.7Å; M137-T141 HydrophobicContact CG-CG2 4.47Å; M137-T141 WeakPolarHBondContact O-CG2 3.42Å; M137-T141 PolarHBondContact O-N 3.33Å; M137-T141 PolarHBondContact O-OG1 3.42Å; I138-T141 PolarHBondContact O-OG1 2.89Å; T141-E143 PolarHBondContact O-N 3.2Å; T141-E143 PolarHBondContact OG1-O 3.33Å
142G67.8Low78.9Confident20 Ų2039.3 Ų39.321%0.20621%0.205CC..SBendtrans68.42.9178.900000114.7I138 S210I138-G142 PolarHBondContact O-N 3.09Å; G142-S210 WeakPolarHBondContact O-CA 3.27Å; G142-S210 WeakPolarHBondContact O-CB 3.31Å
143E63.2Low78.7Confident109 Ų10939.9 Ų39.951%0.50921%0.206SC..  trans-134.4126.6173.9-66.5-159168.600110.6T141 K208 M209T141-E143 PolarHBondContact O-N 3.2Å; T141-E143 PolarHBondContact OG1-O 3.33Å; E143-K208 IonicContact OE1-NZ 2.86Å; E143-K208 PolarHBondContact OE1-NZ 3.43Å; E143-K208 IonicContact OE2-NZ 2.74Å; E143-K208 PolarHBondContact OE2-NZ 3.46Å; E143-M209 WeakPolarHBondContact CA-O 3.4Å
144A62.9Low78.6Confident8 Ų842.6 Ų42.67%0.06622%0.218CC..BIsolated β-bridgetrans-105.5126.4158.600000110.3I138 M209I138-A144 HydrophobicContact CG2-CB 3.75Å; A144-M209 HydrophobicContact CB-CB 4.18Å; A144-M209 HydrophobicContact CB-CG 4.3Å; A144-M209 HydrophobicContact CB-SD 3.78Å; A144-M209 PolarHBondContact N-O 3.26Å; A144-M209 VanDerWaalsContact N-O 3.15Å
145E66.3Low78.5Confident99 Ų9942.7 Ų42.746%0.46322%0.219SC..  trans-60.6140.1168.3-70.5-178.1160.600110.5K22 I147 T148 T149K22-E145 WeakPolarHBondContact CE-OE2 3.35Å; K22-E145 IonicContact NZ-OE2 3.38Å; K22-E145 PolarHBondContact NZ-OE2 3.28Å; E145-I147 PolarHBondContact O-N 2.91Å; E145-I147 VanDerWaalsContact O-N 3.09Å; E145-T148 WeakPolarHBondContact O-CB 3.47Å; E145-T148 PolarHBondContact O-N 3.44Å; E145-T149 PolarHBondContact O-N 2.95Å; E145-T149 VanDerWaalsContact O-N 3.17Å; E145-T149 PolarHBondContact O-OG1 3.11Å
146S60.3Low78.5Confident66 Ų6641.2 Ų41.246%0.46221%0.211SC..Hα-helixtrans-52.2-36.4-178.1-178.50000113.2T149 H150S146-T149 WeakPolarHBondContact CA-OG1 3.4Å; S146-T149 VanDerWaalsContact O-CB 3.25Å; S146-T149 WeakPolarHBondContact O-CB 3.37Å; S146-T149 PolarHBondContact O-N 3.08Å; S146-T149 VanDerWaalsContact O-N 3.15Å; S146-T149 PolarHBondContact O-OG1 3.26Å; S146-H150 PolarHBondContact O-N 3.03Å; S146-H150 VanDerWaalsContact O-N 3.16Å; S146-H150 PolarHBondContact O-ND1 3Å
147I64.3Low78.6Confident87 Ų8739.8 Ų39.845%0.44621%0.207SC..Hα-helixtrans-68.6-41179.1-59.1172.9000111.5I18 K22 E145 T149 H150 Y151I18-I147 HydrophobicContact CG2-CG2 4Å; K22-I147 HydrophobicContact CB-CG2 3.72Å; K22-I147 HydrophobicContact CG-CB 4.12Å; K22-I147 HydrophobicContact CG-CD1 4.36Å; K22-I147 HydrophobicContact CG-CG2 3.6Å; E145-I147 PolarHBondContact O-N 2.91Å; E145-I147 VanDerWaalsContact O-N 3.09Å; I147-T149 PolarHBondContact O-N 2.87Å; I147-H150 PolarHBondContact O-N 3.34Å; I147-H150 VanDerWaalsContact O-N 3.17Å; I147-Y151 PolarHBondContact O-N 2.98Å; I147-Y151 VanDerWaalsContact O-N 3.12Å
148T74.3Confident78.8Confident4 Ų439.9 Ų39.93%0.02521%0.207CC..Hα-helixtrans-58.8-32.9172.8-52.60000110.4I32 E145 Y151 L152I32-T148 HydrophobicContact CD1-CG2 3.83Å; E145-T148 WeakPolarHBondContact O-CB 3.47Å; E145-T148 PolarHBondContact O-N 3.44Å; T148-Y151 HydrophobicContact CG2-CD1 4.38Å; T148-Y151 WeakPolarHBondContact O-CB 3.44Å; T148-Y151 PolarHBondContact O-N 3.1Å; T148-L152 HydrophobicContact CG2-CD1 4.27Å; T148-L152 WeakPolarHBondContact O-CG 3.38Å; T148-L152 PolarHBondContact O-N 3.02Å
149T74.8Confident79.1Confident0 Ų040.3 Ų40.30%021%0.209CC..Hα-helixtrans-69.8-38.1178-25.80000113.7E145 S146 I147 L152 F153 F194 Y198 V202 M209E145-T149 PolarHBondContact O-N 2.95Å; E145-T149 VanDerWaalsContact O-N 3.17Å; E145-T149 PolarHBondContact O-OG1 3.11Å; S146-T149 WeakPolarHBondContact CA-OG1 3.4Å; S146-T149 VanDerWaalsContact O-CB 3.25Å; S146-T149 WeakPolarHBondContact O-CB 3.37Å; S146-T149 PolarHBondContact O-N 3.08Å; S146-T149 VanDerWaalsContact O-N 3.15Å; S146-T149 PolarHBondContact O-OG1 3.26Å; I147-T149 PolarHBondContact O-N 2.87Å; T149-L152 PolarHBondContact O-N 3.29Å; T149-F153 WeakPolarHBondContact O-CB 3.44Å; T149-F153 PolarHBondContact O-N 3.25Å; T149-F194 HydrophobicContact CG2-CE2 3.86Å; T149-F194 HydrophobicContact CG2-CZ 3.46Å; T149-F194 VanDerWaalsContact CG2-CZ 3.46Å; T149-Y198 HydrophobicContact CG2-CD2 3.1Å; T149-Y198 HydrophobicContact CG2-CE2 3.5Å; T149-Y198 HydrophobicContact CG2-CG 4.05Å; T149-V202 HydrophobicContact CG2-CG2 4.18Å; T149-M209 HydrophobicContact CG2-CE 3.24Å; T149-M209 HydrophobicContact CG2-SD 4Å
150H83.9Confident79.5Confident73 Ų7340.6 Ų40.634%0.33822%0.215SC..Hα-helixtrans-66.7-41.3173.6-67.781.5000111.5S146 I147 L152 F153 F154S146-H150 PolarHBondContact O-N 3.03Å; S146-H150 VanDerWaalsContact O-N 3.16Å; S146-H150 PolarHBondContact O-ND1 3Å; I147-H150 PolarHBondContact O-N 3.34Å; I147-H150 VanDerWaalsContact O-N 3.17Å; H150-L152 PolarHBondContact O-N 3.38Å; H150-F153 WeakPolarHBondContact O-CB 3.14Å; H150-F153 PolarHBondContact O-N 3.37Å; H150-F154 WeakPolarHBondContact O-CD2 3.48Å; H150-F154 PolarHBondContact O-N 3.4Å
151Y87Confident80Confident4 Ų438 Ų382%0.01621%0.205CC..Hα-helixtrans-53.6-53.2172.2149.9-110.3000111.2A15 L19 Q37 I147 T148 F153 F154 L155A15-Y151 HydrophobicContact CB-CD2 4.04Å; A15-Y151 HydrophobicContact CB-CE2 4.48Å; A15-Y151 WeakPolarHBondContact O-CD2 3.44Å; L19-Y151 HydrophobicContact CB-CD2 3.93Å; L19-Y151 HydrophobicContact CB-CE2 4.33Å; L19-Y151 HydrophobicContact CB-CG 4.22Å; L19-Y151 HydrophobicContact CD2-CD2 4.4Å; L19-Y151 HydrophobicContact CD2-CE1 4.48Å; L19-Y151 HydrophobicContact CD2-CE2 4.01Å; Q37-Y151 PolarHBondContact NE2-OH 3.09Å; I147-Y151 PolarHBondContact O-N 2.98Å; I147-Y151 VanDerWaalsContact O-N 3.12Å; T148-Y151 HydrophobicContact CG2-CD1 4.38Å; T148-Y151 WeakPolarHBondContact O-CB 3.44Å; T148-Y151 PolarHBondContact O-N 3.1Å; Y151-F153 VanDerWaalsContact C-N 3.3Å; Y151-F153 PolarHBondContact O-N 2.71Å; Y151-F154 PolarHBondContact O-N 3.07Å; Y151-L155 HydrophobicContact CE2-CD2 3.9Å; Y151-L155 WeakPolarHBondContact O-CB 3.47Å; Y151-L155 PolarHBondContact O-N 2.98Å; Y151-L155 WeakPolarHBondContact OH-CD2 3.27Å
152L85.3Confident80.5Confident0 Ų037.4 Ų37.40%020%0.198CC..Hα-helixtrans-64.8-33.9-180-70.1171.4000112.4I131 Q134 I138 T148 T149 H150 L155 G156 F194I131-L152 HydrophobicContact CD1-CD2 3.71Å; I131-L152 HydrophobicContact CG1-CD2 4.21Å; Q134-L152 HydrophobicContact CG-CD2 4.45Å; I138-L152 HydrophobicContact CD1-CD1 3.72Å; T148-L152 HydrophobicContact CG2-CD1 4.27Å; T148-L152 WeakPolarHBondContact O-CG 3.38Å; T148-L152 PolarHBondContact O-N 3.02Å; T149-L152 PolarHBondContact O-N 3.29Å; H150-L152 PolarHBondContact O-N 3.38Å; L152-L155 CarbonylContact O-C 3.56Å; L152-L155 PolarHBondContact O-N 3.26Å; L152-G156 PolarHBondContact O-N 3.29Å; L152-F194 HydrophobicContact CB-CD1 4Å; L152-F194 HydrophobicContact CB-CD2 4.44Å; L152-F194 HydrophobicContact CB-CE1 3.28Å; L152-F194 HydrophobicContact CB-CE2 3.79Å; L152-F194 HydrophobicContact CB-CZ 3.15Å; L152-F194 HydrophobicContact CD1-CD2 3.77Å; L152-F194 HydrophobicContact CD1-CE1 4.34Å; L152-F194 HydrophobicContact CD1-CE2 3.22Å; L152-F194 HydrophobicContact CD1-CZ 3.57Å; L152-F194 HydrophobicContact CG-CE1 4.41Å; L152-F194 HydrophobicContact CG-CE2 4.12Å; L152-F194 HydrophobicContact CG-CZ 3.98Å
153F86.5Confident81.6Confident62 Ų6239 Ų3927%0.27220%0.201SC..Hα-helixtrans-61.3-51.6174.1171.9-96.8000112T149 H150 Y151 L155 G156 L157 F195 Y198T149-F153 WeakPolarHBondContact O-CB 3.44Å; T149-F153 PolarHBondContact O-N 3.25Å; H150-F153 WeakPolarHBondContact O-CB 3.14Å; H150-F153 PolarHBondContact O-N 3.37Å; Y151-F153 VanDerWaalsContact C-N 3.3Å; Y151-F153 PolarHBondContact O-N 2.71Å; F153-L155 PolarHBondContact O-N 2.82Å; F153-G156 PolarHBondContact O-N 3.25Å; F153-G156 VanDerWaalsContact O-N 3.14Å; F153-L157 HydrophobicContact CE1-CD2 4.11Å; F153-L157 HydrophobicContact CZ-CD2 4.39Å; F153-L157 WeakPolarHBondContact O-CB 3.48Å; F153-L157 PolarHBondContact O-N 3.4Å; F153-F195 HydrophobicContact CD2-CD1 4.32Å; F153-F195 AromaticContact CD2-CE1 3.79Å; F153-F195 HydrophobicContact CD2-CE1 3.79Å; F153-F195 HydrophobicContact CE2-CE1 4.32Å; F153-Y198 HydrophobicContact CB-CD1 4.41Å; F153-Y198 HydrophobicContact CB-CE1 3.97Å; F153-Y198 AromaticContact CD2-CD1 3.84Å; F153-Y198 HydrophobicContact CD2-CD1 3.84Å; F153-Y198 AromaticContact CD2-CE1 3.51Å; F153-Y198 HydrophobicContact CD2-CE1 3.51Å; F153-Y198 HydrophobicContact CE2-CE1 4.24Å; F153-Y198 HydrophobicContact CG-CD1 4.45Å; F153-Y198 AromaticContact CG-CE1 3.85Å; F153-Y198 HydrophobicContact CG-CE1 3.85Å
154F91.5Very high82.9Confident58 Ų5835.4 Ų35.425%0.25419%0.19SC..Hα-helixtrans-65.3-31.1177.6-76.3-71.4000112.1S11 V14 A15 I18 H150 Y151 L157 Y158S11-F154 PolarHBondContact OG-O 2.93Å; V14-F154 HydrophobicContact CG1-CD1 3.99Å; V14-F154 HydrophobicContact CG1-CD2 3.92Å; V14-F154 HydrophobicContact CG1-CE1 4.05Å; V14-F154 HydrophobicContact CG1-CE2 3.99Å; V14-F154 HydrophobicContact CG1-CG 3.93Å; V14-F154 HydrophobicContact CG1-CZ 4.06Å; A15-F154 HydrophobicContact CB-CB 3.71Å; I18-F154 HydrophobicContact CD1-CD2 3.39Å; I18-F154 HydrophobicContact CD1-CE2 3.52Å; I18-F154 HydrophobicContact CD1-CG 4.43Å; H150-F154 WeakPolarHBondContact O-CD2 3.48Å; H150-F154 PolarHBondContact O-N 3.4Å; Y151-F154 PolarHBondContact O-N 3.07Å; F154-L157 HydrophobicContact CD1-CD2 4.31Å; F154-L157 PolarHBondContact O-N 2.97Å; F154-Y158 PolarHBondContact O-N 3.45Å; F154-Y158 VanDerWaalsContact O-N 3.08Å
155L89.8Confident84.4Confident2 Ų235.2 Ų35.21%0.0119%0.188CC..Hα-helixtrans-71.7-27.4174.1-160.569.7000113A15 F40 I131 Y151 L152 F153 Y158 Y191A15-L155 HydrophobicContact CB-CB 4.17Å; A15-L155 HydrophobicContact CB-CD1 4.28Å; F40-L155 HydrophobicContact CE2-CD2 4.3Å; F40-L155 HydrophobicContact CZ-CD2 3.98Å; I131-L155 HydrophobicContact CD1-CD2 3.82Å; Y151-L155 HydrophobicContact CE2-CD2 3.9Å; Y151-L155 WeakPolarHBondContact O-CB 3.47Å; Y151-L155 PolarHBondContact O-N 2.98Å; Y151-L155 WeakPolarHBondContact OH-CD2 3.27Å; L152-L155 CarbonylContact O-C 3.56Å; L152-L155 PolarHBondContact O-N 3.26Å; F153-L155 PolarHBondContact O-N 2.82Å; L155-Y158 VanDerWaalsContact C-CD1 3.44Å; L155-Y158 HydrophobicContact CD1-CD1 4.05Å; L155-Y158 HydrophobicContact CD1-CE1 3.51Å; L155-Y158 HydrophobicContact CG-CD1 4.38Å; L155-Y158 HydrophobicContact CG-CE1 3.86Å; L155-Y158 WeakPolarHBondContact O-CD1 3.44Å; L155-Y158 WeakPolarHBondContact O-CE1 3.46Å; L155-Y191 HydrophobicContact CB-CE1 4.4Å; L155-Y191 HydrophobicContact CD2-CE1 4.18Å; L155-Y191 WeakPolarHBondContact CD2-OH 3.37Å; L155-Y191 HydrophobicContact CG-CE1 4.32Å; L155-Y191 VanDerWaalsContact CG-OH 3.28Å; L155-Y191 WeakPolarHBondContact CG-OH 3.45Å
156G88.1Confident85.6Confident1 Ų132 Ų321%0.0117%0.172CC..Hα-helixtrans-83.2-37.2169.100000112L152 F153 Y158 R159 A160 F195L152-G156 PolarHBondContact O-N 3.29Å; F153-G156 PolarHBondContact O-N 3.25Å; F153-G156 VanDerWaalsContact O-N 3.14Å; G156-Y158 VanDerWaalsContact C-N 3.31Å; G156-Y158 PolarHBondContact O-N 3.19Å; G156-R159 WeakPolarHBondContact O-CB 3.11Å; G156-R159 PolarHBondContact O-N 3.1Å; G156-A160 PolarHBondContact O-N 3.36Å; G156-A160 VanDerWaalsContact O-N 3.11Å; G156-F195 VanDerWaalsContact C-CZ 3.4Å
157L90.4Very high87.1Confident56 Ų5632.5 Ų32.529%0.29317%0.172SC..Hα-helixtrans-61-41.2-178.3177.161.2000111.2F153 F154 R159 A160 L161F153-L157 HydrophobicContact CE1-CD2 4.11Å; F153-L157 HydrophobicContact CZ-CD2 4.39Å; F153-L157 WeakPolarHBondContact O-CB 3.48Å; F153-L157 PolarHBondContact O-N 3.4Å; F154-L157 HydrophobicContact CD1-CD2 4.31Å; F154-L157 PolarHBondContact O-N 2.97Å; L157-R159 PolarHBondContact O-N 3.11Å; L157-A160 PolarHBondContact O-N 3.06Å; L157-L161 HydrophobicContact CD1-CD1 4.31Å; L157-L161 HydrophobicContact CD1-CG 4.34Å; L157-L161 HydrophobicContact CG-CD1 4.02Å; L157-L161 HydrophobicContact CG-CG 4.5Å; L157-L161 WeakPolarHBondContact O-CG 3.35Å; L157-L161 PolarHBondContact O-N 3.38Å
158Y92.4Very high88.4Confident1 Ų134.3 Ų34.30%0.00417%0.173CC..Hα-helixtrans-61.8-32177.397.3-89.4000112.2G8 S11 H12 E127 F154 L155 G156 L161 Y162 Q187G8-Y158 VanDerWaalsContact O-CB 3.27Å; G8-Y158 WeakPolarHBondContact O-CB 3.28Å; S11-Y158 PolarHBondContact OG-N 3.2Å; H12-Y158 HydrophobicContact CB-CD1 4.21Å; H12-Y158 HydrophobicContact CB-CD2 3.84Å; H12-Y158 HydrophobicContact CB-CE2 4.24Å; H12-Y158 HydrophobicContact CB-CG 3.79Å; H12-Y158 AromaticContact CE1-CE2 3.8Å; H12-Y158 AromaticContact CE1-CZ 3.68Å; H12-Y158 AromaticContact CG-CD2 3.97Å; H12-Y158 AromaticContact CG-CE2 3.85Å; H12-Y158 AromaticContact ND1-CD2 3.88Å; H12-Y158 AromaticContact ND1-CE2 3.4Å; H12-Y158 WeakPolarHBondContact ND1-CE2 3.38Å; H12-Y158 AromaticContact ND1-CZ 3.72Å; E127-Y158 PolarHBondContact OE1-OH 3.42Å; F154-Y158 PolarHBondContact O-N 3.45Å; F154-Y158 VanDerWaalsContact O-N 3.08Å; L155-Y158 VanDerWaalsContact C-CD1 3.44Å; L155-Y158 HydrophobicContact CD1-CD1 4.05Å; L155-Y158 HydrophobicContact CD1-CE1 3.51Å; L155-Y158 HydrophobicContact CG-CD1 4.38Å; L155-Y158 HydrophobicContact CG-CE1 3.86Å; L155-Y158 WeakPolarHBondContact O-CD1 3.44Å; L155-Y158 WeakPolarHBondContact O-CE1 3.46Å; G156-Y158 VanDerWaalsContact C-N 3.31Å; G156-Y158 PolarHBondContact O-N 3.19Å; Y158-L161 PolarHBondContact O-N 3.23Å; Y158-Y162 HydrophobicContact CD2-CD2 4.11Å; Y158-Y162 HydrophobicContact CD2-CE2 4.38Å; Y158-Y162 WeakPolarHBondContact O-CD2 3.49Å; Y158-Y162 PolarHBondContact O-N 3.33Å; Y158-Q187 PolarHBondContact OH-NE2 3.47Å
159R89.6Confident89.3Confident13 Ų1336.2 Ų36.25%0.04918%0.18CC..Hα-helixtrans-71.5-43.1176.3-73.7-67.8146.5-1579.5112.8E127 G156 L157 L161 Y162 I163 Q187 Y191E127-R159 IonicContact OE1-CZ 3.96Å; E127-R159 IonicContact OE1-NH2 2.79Å; E127-R159 PolarHBondContact OE1-NH2 3.5Å; E127-R159 IonicContact OE2-CZ 3.78Å; E127-R159 IonicContact OE2-NH2 2.82Å; E127-R159 PolarHBondContact OE2-NH2 3.44Å; G156-R159 WeakPolarHBondContact O-CB 3.11Å; G156-R159 PolarHBondContact O-N 3.1Å; L157-R159 PolarHBondContact O-N 3.11Å; R159-L161 PolarHBondContact O-N 3.25Å; R159-Y162 PolarHBondContact O-N 3.31Å; R159-Y162 VanDerWaalsContact O-N 3.08Å; R159-I163 PolarHBondContact O-N 3.4Å; R159-Q187 HydrophobicContact CG-CG 4.19Å; R159-Y191 HydrophobicContact CG-CE2 4.5Å
160A88.9Confident90.1Very high48 Ų4842.8 Ų42.840%0.39721%0.206SC..Hα-helixtrans-57-41.6172.400000111.5G156 L157 I163 A164G156-A160 PolarHBondContact O-N 3.36Å; G156-A160 VanDerWaalsContact O-N 3.11Å; L157-A160 PolarHBondContact O-N 3.06Å; A160-I163 PolarHBondContact O-N 2.94Å; A160-A164 PolarHBondContact O-N 3.2Å; A160-A164 VanDerWaalsContact O-N 3.08Å
161L92.8Very high90.5Very high36 Ų3646.2 Ų46.219%0.18822%0.222CC..Hα-helixtrans-66.6-35.6175.6-69.2168.6000112.6F4 A7 L157 Y158 R159 A164 N165F4-L161 HydrophobicContact CD1-CD2 4.49Å; A7-L161 HydrophobicContact CB-CD1 3.93Å; A7-L161 HydrophobicContact CB-CD2 4.43Å; L157-L161 HydrophobicContact CD1-CD1 4.31Å; L157-L161 HydrophobicContact CD1-CG 4.34Å; L157-L161 HydrophobicContact CG-CD1 4.02Å; L157-L161 HydrophobicContact CG-CG 4.5Å; L157-L161 WeakPolarHBondContact O-CG 3.35Å; L157-L161 PolarHBondContact O-N 3.38Å; Y158-L161 PolarHBondContact O-N 3.23Å; R159-L161 PolarHBondContact O-N 3.25Å; L161-A164 PolarHBondContact O-N 2.88Å; L161-N165 WeakPolarHBondContact O-CB 3.31Å; L161-N165 PolarHBondContact O-N 2.8Å
162Y91.3Very high90.8Very high38 Ų3849.7 Ų49.715%0.14924%0.244CC..Hα-helixtrans-67.7-36.1174.4-100-102.5000112.8D9 Y158 R159 N165 W166D9-Y162 WeakPolarHBondContact OD1-CE2 3.32Å; D9-Y162 PolarHBondContact OD1-OH 2.96Å; Y158-Y162 HydrophobicContact CD2-CD2 4.11Å; Y158-Y162 HydrophobicContact CD2-CE2 4.38Å; Y158-Y162 WeakPolarHBondContact O-CD2 3.49Å; Y158-Y162 PolarHBondContact O-N 3.33Å; R159-Y162 PolarHBondContact O-N 3.31Å; R159-Y162 VanDerWaalsContact O-N 3.08Å; Y162-N165 WeakPolarHBondContact O-CB 3.46Å; Y162-N165 PolarHBondContact O-N 3.4Å; Y162-W166 HydrophobicContact CD1-CZ2 4.04Å; Y162-W166 VanDerWaalsContact O-CD2 3.23Å; Y162-W166 VanDerWaalsContact O-CG 3.32Å; Y162-W166 PolarHBondContact O-N 3.02Å
163I90.2Very high91.1Very high54 Ų5454.5 Ų54.528%0.27727%0.266SS..Hα-helixtrans-60.7-49.1170.7-68.4170.2000110.2R159 A160 N165 W166 V167 T188R159-I163 PolarHBondContact O-N 3.4Å; A160-I163 PolarHBondContact O-N 2.94Å; I163-N165 VanDerWaalsContact C-N 3.27Å; I163-N165 PolarHBondContact O-N 2.82Å; I163-W166 HydrophobicContact CB-CE3 4.34Å; I163-W166 HydrophobicContact CG1-CE3 3.94Å; I163-W166 HydrophobicContact CG1-CZ3 3.7Å; I163-W166 PolarHBondContact O-N 2.82Å; I163-V167 WeakPolarHBondContact O-CG2 3.34Å; I163-V167 PolarHBondContact O-N 2.63Å; I163-T188 HydrophobicContact CD1-CG2 4.05Å; I163-T188 VanDerWaalsContact CD1-OG1 3.3Å; I163-T188 WeakPolarHBondContact CD1-OG1 3.46Å
164A91.5Very high91.2Very high34 Ų3454.4 Ų54.428%0.28128%0.282SS..Hα-helixtrans-59-39.117600000112.1F4 A160 L161 V167 W168F4-A164 HydrophobicContact CB-CB 4.42Å; F4-A164 HydrophobicContact CD1-CB 3.76Å; F4-A164 HydrophobicContact CE1-CB 4.15Å; F4-A164 HydrophobicContact CG-CB 4.03Å; A160-A164 PolarHBondContact O-N 3.2Å; A160-A164 VanDerWaalsContact O-N 3.08Å; L161-A164 PolarHBondContact O-N 2.88Å; A164-V167 PolarHBondContact O-N 3.47Å; A164-W168 WeakPolarHBondContact O-CB 3.29Å; A164-W168 PolarHBondContact O-N 3.23Å
165N92.4Very high91Very high4 Ų455.3 Ų55.32%0.02129%0.286CS..Hα-helixtrans-60.8-43.4172.5161.776.5000112.3N2 F4 R5 L161 Y162 I163 W168 R169N2-N165 PolarHBondContact ND2-OD1 3.04Å; N2-N165 PolarHBondContact OD1-OD1 3.41Å; F4-N165 HydrophobicContact CB-CB 3.78Å; R5-N165 HydrophobicContact CB-CB 4.43Å; L161-N165 WeakPolarHBondContact O-CB 3.31Å; L161-N165 PolarHBondContact O-N 2.8Å; Y162-N165 WeakPolarHBondContact O-CB 3.46Å; Y162-N165 PolarHBondContact O-N 3.4Å; I163-N165 VanDerWaalsContact C-N 3.27Å; I163-N165 PolarHBondContact O-N 2.82Å; N165-W168 PolarHBondContact O-N 3.17Å; N165-R169 WeakPolarHBondContact O-CB 3.44Å; N165-R169 VanDerWaalsContact O-CG 3.29Å; N165-R169 WeakPolarHBondContact O-CG 3.3Å; N165-R169 PolarHBondContact O-N 3.38Å
166W92.4Very high91Very high30 Ų3061.4 Ų61.411%0.11431%0.31CS..Hα-helixtrans-65-43.5178-62.7-42.1000111.9Y162 I163 W168 R169 Y170 A180 I181Y162-W166 HydrophobicContact CD1-CZ2 4.04Å; Y162-W166 VanDerWaalsContact O-CD2 3.23Å; Y162-W166 VanDerWaalsContact O-CG 3.32Å; Y162-W166 PolarHBondContact O-N 3.02Å; I163-W166 HydrophobicContact CB-CE3 4.34Å; I163-W166 HydrophobicContact CG1-CE3 3.94Å; I163-W166 HydrophobicContact CG1-CZ3 3.7Å; I163-W166 PolarHBondContact O-N 2.82Å; W166-W168 VanDerWaalsContact C-N 3.33Å; W166-W168 PolarHBondContact O-N 3.25Å; W166-R169 PolarHBondContact O-N 2.97Å; W166-Y170 WeakPolarHBondContact O-CB 3.26Å; W166-Y170 PolarHBondContact O-N 3.06Å; W166-A180 VanDerWaalsContact CH2-O 3.31Å; W166-A180 WeakPolarHBondContact CH2-O 3.29Å; W166-A180 HydrophobicContact CZ2-CB 4.27Å; W166-I181 HydrophobicContact CB-CD1 4.45Å; W166-I181 HydrophobicContact CB-CG1 4.12Å; W166-I181 HydrophobicContact CD2-CG1 3.95Å; W166-I181 HydrophobicContact CE3-CG1 4.08Å; W166-I181 HydrophobicContact CG-CG1 3.95Å
167V92.1Very high91.1Very high77 Ų7762.3 Ų62.347%0.46731%0.314SS..Hα-helixtrans-58.8-46.5174.4177.10000110.9I163 A164 R169 Y170 H171I163-V167 WeakPolarHBondContact O-CG2 3.34Å; I163-V167 PolarHBondContact O-N 2.63Å; A164-V167 PolarHBondContact O-N 3.47Å; V167-R169 PolarHBondContact O-N 3.39Å; V167-Y170 PolarHBondContact O-N 3.48Å; V167-H171 PolarHBondContact O-CD2 3.34Å; V167-H171 VanDerWaalsContact O-CD2 3.25Å; V167-H171 PolarHBondContact O-N 3.26Å; V167-H171 VanDerWaalsContact O-N 3.15Å
168W92.4Very high91.2Very high126 Ų12664.9 Ų64.948%0.47733%0.325SS..Hα-helixtrans-58.9-48.6177.1-179.4-84.1000112.2F4 A164 N165 W166 Y170 H171 T172F4-W168 HydrophobicContact CD2-CB 4.06Å; F4-W168 HydrophobicContact CD2-CD2 4.48Å; F4-W168 HydrophobicContact CD2-CG 4.27Å; F4-W168 HydrophobicContact CE2-CB 4.2Å; F4-W168 HydrophobicContact CE2-CD2 4.09Å; F4-W168 AromaticContact CE2-CE3 3.78Å; F4-W168 HydrophobicContact CE2-CE3 3.78Å; F4-W168 HydrophobicContact CE2-CG 4.29Å; A164-W168 WeakPolarHBondContact O-CB 3.29Å; A164-W168 PolarHBondContact O-N 3.23Å; N165-W168 PolarHBondContact O-N 3.17Å; W166-W168 VanDerWaalsContact C-N 3.33Å; W166-W168 PolarHBondContact O-N 3.25Å; W168-Y170 VanDerWaalsContact C-N 3.33Å; W168-Y170 PolarHBondContact O-N 2.83Å; W168-H171 PolarHBondContact O-N 2.67Å; W168-T172 HydrophobicContact CD2-CG2 4.21Å; W168-T172 HydrophobicContact CZ2-CG2 3.99Å; W168-T172 PolarHBondContact NE1-OG1 3.09Å; W168-T172 WeakPolarHBondContact O-CB 3.43Å; W168-T172 PolarHBondContact O-N 3.43Å; W168-T172 PolarHBondContact O-OG1 3.31Å
169R91.8Very high91.2Very high44 Ų4465.6 Ų65.617%0.16633%0.329CS..Hα-helixtrans-67.2-33.6-178.8-70-174.272.9-147.8-7.7112.5N165 W166 V167 E173 G174 F175N165-R169 WeakPolarHBondContact O-CB 3.44Å; N165-R169 VanDerWaalsContact O-CG 3.29Å; N165-R169 WeakPolarHBondContact O-CG 3.3Å; N165-R169 PolarHBondContact O-N 3.38Å; W166-R169 PolarHBondContact O-N 2.97Å; V167-R169 PolarHBondContact O-N 3.39Å; R169-E173 IonicContact CZ-OE2 3.32Å; R169-E173 IonicContact NE-OE1 3.74Å; R169-E173 IonicContact NE-OE2 2.79Å; R169-E173 PolarHBondContact NE-OE2 3.18Å; R169-E173 IonicContact NH2-OE2 2.96Å; R169-E173 PolarHBondContact NH2-OE2 2.74Å; R169-E173 CarbonylContact O-C 3.57Å; R169-E173 WeakPolarHBondContact O-CA 3.37Å; R169-E173 VanDerWaalsContact O-CB 3.3Å; R169-E173 WeakPolarHBondContact O-CB 3.11Å; R169-E173 PolarHBondContact O-N 3.49Å; R169-G174 PolarHBondContact O-N 3.33Å; R169-G174 VanDerWaalsContact O-N 3.15Å; R169-F175 HydrophobicContact CB-CB 4.33Å; R169-F175 VanDerWaalsContact CZ-CG 3.47Å; R169-F175 PolarHBondContact O-N 3.48Å
170Y92.5Very high91.3Very high137 Ų13765.5 Ų65.554%0.53733%0.331SS..Hα-helixtrans-61.6-47.9173.1-179.4-103.3000111.2W166 V167 W168 G174 F175 Y176W166-Y170 WeakPolarHBondContact O-CB 3.26Å; W166-Y170 PolarHBondContact O-N 3.06Å; V167-Y170 PolarHBondContact O-N 3.48Å; W168-Y170 VanDerWaalsContact C-N 3.33Å; W168-Y170 PolarHBondContact O-N 2.83Å; Y170-G174 VanDerWaalsContact O-CA 3.31Å; Y170-G174 WeakPolarHBondContact O-CA 3.35Å; Y170-G174 PolarHBondContact O-N 2.93Å; Y170-F175 WeakPolarHBondContact CA-O 3.2Å; Y170-Y176 HydrophobicContact CD2-CD2 4.38Å
171H92.8Very high91.4Very high146 Ų14665.1 Ų65.168%0.67632%0.322SS*.Hα-helixtrans-72.7-33.4-179-77.4-67.3000114.5V167 W168V167-H171 PolarHBondContact O-CD2 3.34Å; V167-H171 VanDerWaalsContact O-CD2 3.25Å; V167-H171 PolarHBondContact O-N 3.26Å; V167-H171 VanDerWaalsContact O-N 3.15Å; W168-H171 PolarHBondContact O-N 2.67Å
172T92.8Very high91.4Very high77 Ų7767.2 Ų67.247%0.47234%0.336SS..Hα-helixtrans-99.3-33.7-173.1550000114.1W168W168-T172 HydrophobicContact CD2-CG2 4.21Å; W168-T172 HydrophobicContact CZ2-CG2 3.99Å; W168-T172 PolarHBondContact NE1-OG1 3.09Å; W168-T172 WeakPolarHBondContact O-CB 3.43Å; W168-T172 PolarHBondContact O-N 3.43Å; W168-T172 PolarHBondContact O-OG1 3.31Å
173E90.6Very high91.5Very high101 Ų10165.7 Ų65.747%0.47233%0.331SS..Hα-helixtrans-113.5-8.6-174.9-57.2169.8-16000112.2R169 F175R169-E173 IonicContact CZ-OE2 3.32Å; R169-E173 IonicContact NE-OE1 3.74Å; R169-E173 IonicContact NE-OE2 2.79Å; R169-E173 PolarHBondContact NE-OE2 3.18Å; R169-E173 IonicContact NH2-OE2 2.96Å; R169-E173 PolarHBondContact NH2-OE2 2.74Å; R169-E173 CarbonylContact O-C 3.57Å; R169-E173 WeakPolarHBondContact O-CA 3.37Å; R169-E173 VanDerWaalsContact O-CB 3.3Å; R169-E173 WeakPolarHBondContact O-CB 3.11Å; R169-E173 PolarHBondContact O-N 3.49Å; E173-F175 HydrophobicContact CB-CB 4.18Å; E173-F175 PolarHBondContact O-N 3.01Å
174G88.4Confident91.5Very high59 Ų5963.3 Ų63.361%0.60832%0.319SS*.  trans64.713.6-170.900000113.5R169 Y170R169-G174 PolarHBondContact O-N 3.33Å; R169-G174 VanDerWaalsContact O-N 3.15Å; Y170-G174 VanDerWaalsContact O-CA 3.31Å; Y170-G174 WeakPolarHBondContact O-CA 3.35Å; Y170-G174 PolarHBondContact O-N 2.93Å
175F88.7Confident91.4Very high77 Ų7764.9 Ų64.934%0.33833%0.325SS..  trans-80.7130.3-174.8178.1-87000111.2R169 Y170 E173 D177R169-F175 HydrophobicContact CB-CB 4.33Å; R169-F175 VanDerWaalsContact CZ-CG 3.47Å; R169-F175 PolarHBondContact O-N 3.48Å; Y170-F175 WeakPolarHBondContact CA-O 3.2Å; E173-F175 HydrophobicContact CB-CB 4.18Å; E173-F175 PolarHBondContact O-N 3.01Å; F175-D177 HydrophobicContact CE1-CB 3.67Å; F175-D177 HydrophobicContact CZ-CB 3.86Å
176Y88.8Confident91.4Very high130 Ų13067.2 Ų67.251%0.5134%0.34SS..  trans-138.7122178.5-178.6-102.1000110.8Y170 Q178 I181Y170-Y176 HydrophobicContact CD2-CD2 4.38Å; Y176-Q178 HydrophobicContact CE1-CB 3.74Å; Y176-Q178 HydrophobicContact CE1-CG 4.31Å; Y176-I181 HydrophobicContact CD2-CD1 3.56Å; Y176-I181 HydrophobicContact CE2-CD1 3.54Å; Y176-I181 HydrophobicContact CG-CD1 4.45Å
177D90.7Very high91.2Very high20 Ų2066 Ų6611%0.10734%0.335CS..  trans-123.597.4177.3179.7-27.2000108.2Y111 W120 F175 I179 A180 I181Y111-D177 PolarHBondContact OH-OD1 3.33Å; W120-D177 WeakPolarHBondContact CH2-OD2 3.3Å; F175-D177 HydrophobicContact CE1-CB 3.67Å; F175-D177 HydrophobicContact CZ-CB 3.86Å; D177-I179 VanDerWaalsContact C-N 3.32Å; D177-I179 PolarHBondContact O-N 3.38Å; D177-I179 PolarHBondContact OD1-N 3.28Å; D177-A180 HydrophobicContact CB-CB 4.08Å; D177-A180 VanDerWaalsContact CG-CB 3.43Å; D177-A180 PolarHBondContact O-N 2.88Å; D177-A180 WeakPolarHBondContact OD1-CB 3.33Å; D177-A180 PolarHBondContact OD1-N 3.35Å; D177-I181 WeakPolarHBondContact O-CB 3.48Å; D177-I181 WeakPolarHBondContact O-CD1 3.3Å; D177-I181 WeakPolarHBondContact O-CG1 3.46Å; D177-I181 PolarHBondContact O-N 2.96Å
178Q91.9Very high91Very high110 Ų11063.6 Ų63.651%0.51432%0.321SS..Hα-helixtrans-59.9-41.7-175.3-171.3174.7-57.400112.3Y111 Y176 I181 V182Y111-Q178 PolarHBondContact OH-N 3.17Å; Y111-Q178 VanDerWaalsContact OH-N 3.13Å; Y176-Q178 HydrophobicContact CE1-CB 3.74Å; Y176-Q178 HydrophobicContact CE1-CG 4.31Å; Q178-I181 PolarHBondContact O-N 2.98Å; Q178-V182 HydrophobicContact CG-CG2 4.25Å; Q178-V182 WeakPolarHBondContact O-CB 3.36Å; Q178-V182 VanDerWaalsContact O-CG2 3.3Å; Q178-V182 WeakPolarHBondContact O-CG2 3.42Å; Q178-V182 PolarHBondContact O-N 3.08Å
179I92.2Very high90.8Very high17 Ų1762.6 Ų62.69%0.08732%0.324CS..Hα-helixtrans-65.8-47.4-176.5-65.5179.9000109.4Y111 T121 I124 F125 D177 S183Y111-I179 HydrophobicContact CD2-CD1 4.1Å; Y111-I179 HydrophobicContact CE1-CD1 4.2Å; Y111-I179 HydrophobicContact CE1-CG1 4.45Å; Y111-I179 HydrophobicContact CE2-CB 4.25Å; Y111-I179 HydrophobicContact CE2-CD1 3.75Å; Y111-I179 HydrophobicContact CE2-CG1 4.13Å; Y111-I179 HydrophobicContact CG-CD1 4.47Å; Y111-I179 PolarHBondContact OH-N 3.39Å; T121-I179 HydrophobicContact CG2-CD1 4.09Å; T121-I179 HydrophobicContact CG2-CG2 3.93Å; I124-I179 HydrophobicContact CB-CG2 4.46Å; I124-I179 HydrophobicContact CG2-CG2 4.02Å; F125-I179 HydrophobicContact CE1-CG2 3.79Å; F125-I179 HydrophobicContact CZ-CG2 3.93Å; D177-I179 VanDerWaalsContact C-N 3.32Å; D177-I179 PolarHBondContact O-N 3.38Å; D177-I179 PolarHBondContact OD1-N 3.28Å; I179-S183 VanDerWaalsContact O-CB 3.23Å; I179-S183 WeakPolarHBondContact O-CB 3.32Å; I179-S183 PolarHBondContact O-N 3.06Å; I179-S183 VanDerWaalsContact O-N 3.11Å; I179-S183 PolarHBondContact O-OG 2.92Å
180A91.4Very high90.4Very high11 Ų1163.6 Ų63.69%0.09133%0.329CS..Hα-helixtrans-65.1-43178.600000112.4W166 D177 G184W166-A180 VanDerWaalsContact CH2-O 3.31Å; W166-A180 WeakPolarHBondContact CH2-O 3.29Å; W166-A180 HydrophobicContact CZ2-CB 4.27Å; D177-A180 HydrophobicContact CB-CB 4.08Å; D177-A180 VanDerWaalsContact CG-CB 3.43Å; D177-A180 PolarHBondContact O-N 2.88Å; D177-A180 WeakPolarHBondContact OD1-CB 3.33Å; D177-A180 PolarHBondContact OD1-N 3.35Å; A180-G184 PolarHBondContact O-N 3.34Å
181I92.3Very high89.8Confident40 Ų4057.1 Ų57.121%0.20530%0.304CS..Hα-helixtrans-65.9-51.9-178.3-69.7166.2000110.7W166 Y176 D177 Q178 S183 G184 V185W166-I181 HydrophobicContact CB-CD1 4.45Å; W166-I181 HydrophobicContact CB-CG1 4.12Å; W166-I181 HydrophobicContact CD2-CG1 3.95Å; W166-I181 HydrophobicContact CE3-CG1 4.08Å; W166-I181 HydrophobicContact CG-CG1 3.95Å; Y176-I181 HydrophobicContact CD2-CD1 3.56Å; Y176-I181 HydrophobicContact CE2-CD1 3.54Å; Y176-I181 HydrophobicContact CG-CD1 4.45Å; D177-I181 WeakPolarHBondContact O-CB 3.48Å; D177-I181 WeakPolarHBondContact O-CD1 3.3Å; D177-I181 WeakPolarHBondContact O-CG1 3.46Å; D177-I181 PolarHBondContact O-N 2.96Å; Q178-I181 PolarHBondContact O-N 2.98Å; I181-S183 PolarHBondContact O-N 3.48Å; I181-G184 PolarHBondContact O-N 2.93Å; I181-V185 WeakPolarHBondContact O-CG2 3.38Å; I181-V185 PolarHBondContact O-N 2.76Å
182V92.5Very high89.3Confident80 Ų8053.3 Ų53.349%0.48529%0.293SS..Hα-helixtrans-62.1-46.4-178.3172.70000110.6Q178 G184 V185 V186Q178-V182 HydrophobicContact CG-CG2 4.25Å; Q178-V182 WeakPolarHBondContact O-CB 3.36Å; Q178-V182 VanDerWaalsContact O-CG2 3.3Å; Q178-V182 WeakPolarHBondContact O-CG2 3.42Å; Q178-V182 PolarHBondContact O-N 3.08Å; V182-G184 VanDerWaalsContact C-N 3.28Å; V182-G184 PolarHBondContact O-N 2.9Å; V182-V185 PolarHBondContact O-N 2.97Å; V182-V186 WeakPolarHBondContact O-CG2 3.46Å; V182-V186 PolarHBondContact O-N 3.18Å
183S92.7Very high88.3Confident6 Ų654.3 Ų54.34%0.04230%0.296CS..Hα-helixtrans-63.1-37.1177.6-53.30000112I124 F125 S128 I179 I181 V186 Q187I124-S183 WeakPolarHBondContact CG2-OG 3.41Å; F125-S183 WeakPolarHBondContact CD1-OG 3.35Å; F125-S183 WeakPolarHBondContact CE1-OG 3.39Å; S128-S183 VanDerWaalsContact CB-O 3.31Å; S128-S183 WeakPolarHBondContact CB-O 3.38Å; I179-S183 VanDerWaalsContact O-CB 3.23Å; I179-S183 WeakPolarHBondContact O-CB 3.32Å; I179-S183 PolarHBondContact O-N 3.06Å; I179-S183 VanDerWaalsContact O-N 3.11Å; I179-S183 PolarHBondContact O-OG 2.92Å; I181-S183 PolarHBondContact O-N 3.48Å; S183-V186 PolarHBondContact O-N 3.2Å; S183-Q187 WeakPolarHBondContact O-CB 3.43Å; S183-Q187 PolarHBondContact O-N 3.47Å
184G90.2Very high87.4Confident3 Ų349.9 Ų49.93%0.03128%0.275CS..Hα-helixtrans-63.9-38.8174.100000114.1A180 I181 V182 T188A180-G184 PolarHBondContact O-N 3.34Å; I181-G184 PolarHBondContact O-N 2.93Å; V182-G184 VanDerWaalsContact C-N 3.28Å; V182-G184 PolarHBondContact O-N 2.9Å; G184-T188 WeakPolarHBondContact O-CB 3.4Å; G184-T188 PolarHBondContact O-N 3.25Å; G184-T188 PolarHBondContact O-OG1 2.93Å
185V90.1Very high86.8Confident68 Ų6849.2 Ų49.241%0.41226%0.255SS..Hα-helixtrans-65.8-48.5174.1171.70000110.2I181 V182 Q187 T188 I189I181-V185 WeakPolarHBondContact O-CG2 3.38Å; I181-V185 PolarHBondContact O-N 2.76Å; V182-V185 PolarHBondContact O-N 2.97Å; V185-Q187 VanDerWaalsContact C-N 3.29Å; V185-Q187 PolarHBondContact O-N 3.37Å; V185-T188 PolarHBondContact O-N 2.96Å; V185-T188 VanDerWaalsContact O-N 3.09Å; V185-I189 HydrophobicContact CG1-CD1 4Å; V185-I189 WeakPolarHBondContact O-CG1 3.31Å; V185-I189 PolarHBondContact O-N 3.26Å
186V91.3Very high86.1Confident53 Ų5352.8 Ų52.832%0.32127%0.268SS..Hα-helixtrans-54.1-48.3174.9169.40000110.8V182 S183 T188 I189 F190V182-V186 WeakPolarHBondContact O-CG2 3.46Å; V182-V186 PolarHBondContact O-N 3.18Å; S183-V186 PolarHBondContact O-N 3.2Å; V186-T188 VanDerWaalsContact C-N 3.31Å; V186-T188 PolarHBondContact O-N 3.49Å; V186-I189 PolarHBondContact O-N 2.88Å; V186-F190 HydrophobicContact CG1-CD2 4.13Å; V186-F190 HydrophobicContact CG1-CE2 3.56Å; V186-F190 HydrophobicContact CG1-CZ 4.45Å; V186-F190 VanDerWaalsContact O-CD2 3.26Å; V186-F190 WeakPolarHBondContact O-CD2 3.23Å; V186-F190 PolarHBondContact O-N 3.11Å
187Q89.8Confident85.1Confident3 Ų347 Ų471%0.01425%0.245CC..Hα-helixtrans-58.8-43.9177.9-166.91691200112.1E127 Y158 R159 S183 V185 I189 F190 Y191E127-Q187 PolarHBondContact O-NE2 3.26Å; Y158-Q187 PolarHBondContact OH-NE2 3.47Å; R159-Q187 HydrophobicContact CG-CG 4.19Å; S183-Q187 WeakPolarHBondContact O-CB 3.43Å; S183-Q187 PolarHBondContact O-N 3.47Å; V185-Q187 VanDerWaalsContact C-N 3.29Å; V185-Q187 PolarHBondContact O-N 3.37Å; Q187-I189 VanDerWaalsContact C-N 3.35Å; Q187-I189 PolarHBondContact O-N 2.7Å; Q187-F190 PolarHBondContact O-N 3.09Å; Q187-Y191 HydrophobicContact CG-CD2 4.22Å; Q187-Y191 HydrophobicContact CG-CE2 3.75Å; Q187-Y191 WeakPolarHBondContact O-CD2 3.21Å; Q187-Y191 PolarHBondContact O-N 3.38Å
188T86.9Confident84Confident27 Ų2746.4 Ų46.417%0.16624%0.242CC..Hα-helixtrans-65.5-38.2-179.5-57.80000111.6I163 G184 V185 V186 F190 Y191 C192I163-T188 HydrophobicContact CD1-CG2 4.05Å; I163-T188 VanDerWaalsContact CD1-OG1 3.3Å; I163-T188 WeakPolarHBondContact CD1-OG1 3.46Å; G184-T188 WeakPolarHBondContact O-CB 3.4Å; G184-T188 PolarHBondContact O-N 3.25Å; G184-T188 PolarHBondContact O-OG1 2.93Å; V185-T188 PolarHBondContact O-N 2.96Å; V185-T188 VanDerWaalsContact O-N 3.09Å; V186-T188 VanDerWaalsContact C-N 3.31Å; V186-T188 PolarHBondContact O-N 3.49Å; T188-F190 VanDerWaalsContact C-N 3.32Å; T188-F190 PolarHBondContact O-N 3.4Å; T188-Y191 CarbonylContact O-C 3.5Å; T188-Y191 WeakPolarHBondContact O-CA 3.41Å; T188-Y191 PolarHBondContact O-N 2.89Å; T188-C192 PolarHBondContact O-N 2.97Å; T188-C192 PolarHBondContact O-SG 3.11Å
189I87.4Confident83Confident106 Ų10644.1 Ų44.154%0.54424%0.235SC..Hα-helixtrans-58.2-44176.1-69.8164.4000111V185 V186 Q187 Y191 C192V185-I189 HydrophobicContact CG1-CD1 4Å; V185-I189 WeakPolarHBondContact O-CG1 3.31Å; V185-I189 PolarHBondContact O-N 3.26Å; V186-I189 PolarHBondContact O-N 2.88Å; Q187-I189 VanDerWaalsContact C-N 3.35Å; Q187-I189 PolarHBondContact O-N 2.7Å; I189-Y191 PolarHBondContact O-N 3.42Å; I189-C192 WeakPolarHBondContact O-CB 3.33Å; I189-C192 PolarHBondContact O-N 3.36Å; I189-C192 VanDerWaalsContact O-N 3.09Å
190F84.1Confident81.9Confident65 Ų6544.9 Ų44.929%0.28524%0.241SC..Hα-helixtrans-63.1-28.7176.3-68.9-57.6000113.1S128 V129 I131 M132 L135 V186 Q187 T188S128-F190 WeakPolarHBondContact O-CD2 3.39Å; V129-F190 HydrophobicContact CG1-CE2 3.9Å; V129-F190 HydrophobicContact CG1-CZ 4.5Å; I131-F190 HydrophobicContact CG2-CB 4.4Å; M132-F190 HydrophobicContact SD-CD1 4.07Å; M132-F190 HydrophobicContact SD-CE1 3.59Å; M132-F190 VanDerWaalsContact SD-CE1 3.59Å; M132-F190 HydrophobicContact SD-CZ 3.84Å; L135-F190 HydrophobicContact CD1-CB 4.31Å; V186-F190 HydrophobicContact CG1-CD2 4.13Å; V186-F190 HydrophobicContact CG1-CE2 3.56Å; V186-F190 HydrophobicContact CG1-CZ 4.45Å; V186-F190 VanDerWaalsContact O-CD2 3.26Å; V186-F190 WeakPolarHBondContact O-CD2 3.23Å; V186-F190 PolarHBondContact O-N 3.11Å; Q187-F190 PolarHBondContact O-N 3.09Å; T188-F190 VanDerWaalsContact C-N 3.32Å; T188-F190 PolarHBondContact O-N 3.4Å
191Y81.3Confident80.6Confident0 Ų048.3 Ų48.30%025%0.251CS..Hα-helixtrans-81.2-21.8173.6-72.1-69.5000113.8I131 L155 R159 Q187 T188 I189 D193 F194 F195I131-Y191 HydrophobicContact CB-CE1 4.49Å; I131-Y191 HydrophobicContact CD1-CE1 4.5Å; I131-Y191 HydrophobicContact CG1-CE1 3.87Å; I131-Y191 HydrophobicContact CG2-CE1 4.45Å; I131-Y191 HydrophobicContact CG2-CE2 4.49Å; L155-Y191 HydrophobicContact CB-CE1 4.4Å; L155-Y191 HydrophobicContact CD2-CE1 4.18Å; L155-Y191 WeakPolarHBondContact CD2-OH 3.37Å; L155-Y191 HydrophobicContact CG-CE1 4.32Å; L155-Y191 VanDerWaalsContact CG-OH 3.28Å; L155-Y191 WeakPolarHBondContact CG-OH 3.45Å; R159-Y191 HydrophobicContact CG-CE2 4.5Å; Q187-Y191 HydrophobicContact CG-CD2 4.22Å; Q187-Y191 HydrophobicContact CG-CE2 3.75Å; Q187-Y191 WeakPolarHBondContact O-CD2 3.21Å; Q187-Y191 PolarHBondContact O-N 3.38Å; T188-Y191 CarbonylContact O-C 3.5Å; T188-Y191 WeakPolarHBondContact O-CA 3.41Å; T188-Y191 PolarHBondContact O-N 2.89Å; I189-Y191 PolarHBondContact O-N 3.42Å; Y191-D193 PolarHBondContact O-N 2.83Å; Y191-F194 WeakPolarHBondContact O-CB 3.2Å; Y191-F194 PolarHBondContact O-N 3.07Å; Y191-F195 WeakPolarHBondContact O-CB 3.32Å; Y191-F195 WeakPolarHBondContact O-CD2 3.3Å; Y191-F195 WeakPolarHBondContact O-CG 3.44Å; Y191-F195 PolarHBondContact O-N 2.84Å
192C82Confident79.4Confident67 Ų6748 Ų4845%0.45325%0.251SS..Hα-helixtrans-59.7-45.3-175.9-75.20000112.9T188 I189 F194 F195 Y196T188-C192 PolarHBondContact O-N 2.97Å; T188-C192 PolarHBondContact O-SG 3.11Å; I189-C192 WeakPolarHBondContact O-CB 3.33Å; I189-C192 PolarHBondContact O-N 3.36Å; I189-C192 VanDerWaalsContact O-N 3.09Å; C192-F194 VanDerWaalsContact C-N 3.34Å; C192-F195 PolarHBondContact O-N 3.14Å; C192-Y196 PolarHBondContact O-N 2.79Å
193D71.2Confident78.1Confident98 Ų9849.4 Ų49.452%0.52426%0.255SS..Hα-helixtrans-64.1-42.4178.5-172.345.1000111.2Y191 F195 Y196 L197Y191-D193 PolarHBondContact O-N 2.83Å; D193-F195 PolarHBondContact O-N 3.18Å; D193-Y196 PolarHBondContact O-N 2.86Å; D193-L197 PolarHBondContact O-N 3.43Å
194F71.8Confident76.9Confident8 Ų857.1 Ų57.14%0.03528%0.283CS..Hα-helixtrans-59.6-45.5173172.2-94.7000112.4L135 T149 L152 Y191 C192 L197 Y198 M209L135-F194 HydrophobicContact CD2-CB 4.27Å; T149-F194 HydrophobicContact CG2-CE2 3.86Å; T149-F194 HydrophobicContact CG2-CZ 3.46Å; T149-F194 VanDerWaalsContact CG2-CZ 3.46Å; L152-F194 HydrophobicContact CB-CD1 4Å; L152-F194 HydrophobicContact CB-CD2 4.44Å; L152-F194 HydrophobicContact CB-CE1 3.28Å; L152-F194 HydrophobicContact CB-CE2 3.79Å; L152-F194 HydrophobicContact CB-CZ 3.15Å; L152-F194 HydrophobicContact CD1-CD2 3.77Å; L152-F194 HydrophobicContact CD1-CE1 4.34Å; L152-F194 HydrophobicContact CD1-CE2 3.22Å; L152-F194 HydrophobicContact CD1-CZ 3.57Å; L152-F194 HydrophobicContact CG-CE1 4.41Å; L152-F194 HydrophobicContact CG-CE2 4.12Å; L152-F194 HydrophobicContact CG-CZ 3.98Å; Y191-F194 WeakPolarHBondContact O-CB 3.2Å; Y191-F194 PolarHBondContact O-N 3.07Å; C192-F194 VanDerWaalsContact C-N 3.34Å; F194-L197 PolarHBondContact O-N 2.96Å; F194-Y198 WeakPolarHBondContact O-CB 3.43Å; F194-Y198 PolarHBondContact O-N 3.47Å; F194-M209 HydrophobicContact CD2-CE 4.32Å; F194-M209 HydrophobicContact CD2-SD 4.29Å; F194-M209 HydrophobicContact CE2-CE 3.7Å; F194-M209 HydrophobicContact CE2-SD 3.77Å; F194-M209 HydrophobicContact CZ-CE 4.16Å
195F75.3Confident75.3Confident45 Ų4560.2 Ų60.220%0.19732%0.316CS..Hα-helixtrans-63.7-42.3179.8-81.5-53.2000112.7F153 G156 Y191 C192 D193 L197 Y198 V199F153-F195 HydrophobicContact CD2-CD1 4.32Å; F153-F195 AromaticContact CD2-CE1 3.79Å; F153-F195 HydrophobicContact CD2-CE1 3.79Å; F153-F195 HydrophobicContact CE2-CE1 4.32Å; G156-F195 VanDerWaalsContact C-CZ 3.4Å; Y191-F195 WeakPolarHBondContact O-CB 3.32Å; Y191-F195 WeakPolarHBondContact O-CD2 3.3Å; Y191-F195 WeakPolarHBondContact O-CG 3.44Å; Y191-F195 PolarHBondContact O-N 2.84Å; C192-F195 PolarHBondContact O-N 3.14Å; D193-F195 PolarHBondContact O-N 3.18Å; F195-L197 VanDerWaalsContact C-N 3.28Å; F195-L197 PolarHBondContact O-N 3.34Å; F195-Y198 PolarHBondContact O-N 3.37Å; F195-V199 WeakPolarHBondContact O-CG2 3.39Å; F195-V199 PolarHBondContact O-N 2.96Å
196Y74.9Confident73.5Confident152 Ų15267.1 Ų67.160%0.59633%0.334SS*.Hα-helixtrans-55.9-46.9175.6173.8-103.8000110.8C192 D193 T200C192-Y196 PolarHBondContact O-N 2.79Å; D193-Y196 PolarHBondContact O-N 2.86Å; Y196-T200 HydrophobicContact CD2-CG2 4.24Å; Y196-T200 HydrophobicContact CE2-CG2 3.91Å; Y196-T200 WeakPolarHBondContact O-CB 3.34Å; Y196-T200 VanDerWaalsContact O-CG2 3.27Å; Y196-T200 WeakPolarHBondContact O-CG2 3.4Å; Y196-T200 PolarHBondContact O-N 2.9Å; Y196-T200 VanDerWaalsContact O-N 3.1Å; Y196-T200 PolarHBondContact O-OG1 2.67Å
197L66.8Low71.7Confident8 Ų866.8 Ų66.84%0.04234%0.342CS..Hα-helixtrans-69.7-36.5178.7-68.4167.1000113.1D193 F194 F195 T200 R201 M209 L211D193-L197 PolarHBondContact O-N 3.43Å; F194-L197 PolarHBondContact O-N 2.96Å; F195-L197 VanDerWaalsContact C-N 3.28Å; F195-L197 PolarHBondContact O-N 3.34Å; L197-T200 WeakPolarHBondContact CA-OG1 3.17Å; L197-T200 PolarHBondContact O-OG1 3.15Å; L197-R201 WeakPolarHBondContact O-CB 3.49Å; L197-R201 PolarHBondContact O-N 3.32Å; L197-M209 HydrophobicContact CB-CE 4.35Å; L197-L211 HydrophobicContact CD1-CD2 3.04Å; L197-L211 HydrophobicContact CD1-CG 3.87Å
198Y68.3Low69.9Low8 Ų873.6 Ų73.63%0.03137%0.371CS..Iπ-helixtrans-60.9-51.7176.4178.1-119.8000112.1T149 F153 F194 F195 V202 L203 M209T149-Y198 HydrophobicContact CG2-CD2 3.1Å; T149-Y198 HydrophobicContact CG2-CE2 3.5Å; T149-Y198 HydrophobicContact CG2-CG 4.05Å; F153-Y198 HydrophobicContact CB-CD1 4.41Å; F153-Y198 HydrophobicContact CB-CE1 3.97Å; F153-Y198 AromaticContact CD2-CD1 3.84Å; F153-Y198 HydrophobicContact CD2-CD1 3.84Å; F153-Y198 AromaticContact CD2-CE1 3.51Å; F153-Y198 HydrophobicContact CD2-CE1 3.51Å; F153-Y198 HydrophobicContact CE2-CE1 4.24Å; F153-Y198 HydrophobicContact CG-CD1 4.45Å; F153-Y198 AromaticContact CG-CE1 3.85Å; F153-Y198 HydrophobicContact CG-CE1 3.85Å; F194-Y198 WeakPolarHBondContact O-CB 3.43Å; F194-Y198 PolarHBondContact O-N 3.47Å; F195-Y198 PolarHBondContact O-N 3.37Å; Y198-V202 HydrophobicContact CD2-CB 3.64Å; Y198-V202 HydrophobicContact CD2-CG1 4.06Å; Y198-V202 HydrophobicContact CD2-CG2 3.9Å; Y198-V202 HydrophobicContact CE2-CB 3.8Å; Y198-V202 HydrophobicContact CE2-CG1 3.68Å; Y198-V202 HydrophobicContact CE2-CG2 4.34Å; Y198-V202 WeakPolarHBondContact O-CA 3.38Å; Y198-V202 WeakPolarHBondContact O-CB 3.3Å; Y198-V202 PolarHBondContact O-N 3.3Å; Y198-L203 HydrophobicContact CD1-CD1 4.09Å; Y198-L203 HydrophobicContact CD1-CG 4.34Å; Y198-L203 HydrophobicContact CE1-CD1 3.78Å; Y198-L203 HydrophobicContact CE1-CD2 4.24Å; Y198-L203 HydrophobicContact CE1-CG 3.88Å; Y198-L203 PolarHBondContact O-N 2.94Å; Y198-M209 VanDerWaalsContact CA-CE 3.48Å; Y198-M209 HydrophobicContact CD2-CE 4.26Å
199V71.7Confident68.2Low62 Ų6272.4 Ų72.438%0.37636%0.364SS..Iπ-helixtrans-65.2-44.1-1781740000110.6F195 L203 R204F195-V199 WeakPolarHBondContact O-CG2 3.39Å; F195-V199 PolarHBondContact O-N 2.96Å; V199-L203 HydrophobicContact CG2-CD1 4.11Å; V199-R204 WeakPolarHBondContact O-CG 3.45Å
200T67.9Low66.4Low33 Ų3369.7 Ų69.720%0.20235%0.354CS..Iπ-helixtrans-73.6-33.2-174.453.60000113.5Y196 L197Y196-T200 HydrophobicContact CD2-CG2 4.24Å; Y196-T200 HydrophobicContact CE2-CG2 3.91Å; Y196-T200 WeakPolarHBondContact O-CB 3.34Å; Y196-T200 VanDerWaalsContact O-CG2 3.27Å; Y196-T200 WeakPolarHBondContact O-CG2 3.4Å; Y196-T200 PolarHBondContact O-N 2.9Å; Y196-T200 VanDerWaalsContact O-N 3.1Å; Y196-T200 PolarHBondContact O-OG1 2.67Å; L197-T200 WeakPolarHBondContact CA-OG1 3.17Å; L197-T200 PolarHBondContact O-OG1 3.15Å
201R65.1Low65Low82 Ų8267.6 Ų67.631%0.30935%0.346SS..Iπ-helixtrans-105.5-43.2-174.3-57.7-156.2-178.6-172.311.9114.2L197 R206 S210L197-R201 WeakPolarHBondContact O-CB 3.49Å; L197-R201 PolarHBondContact O-N 3.32Å; R201-R206 PolarHBondContact O-N 3.45Å; R201-R206 VanDerWaalsContact O-N 3.12Å; R201-S210 PolarHBondContact NH1-O 3.48Å; R201-S210 PolarHBondContact NH1-OG 2.97Å; R201-S210 PolarHBondContact NH2-O 3.3Å
202V67.1Low63.4Low35 Ų3572 Ų7221%0.21237%0.374CS..Iπ-helixtrans-87-54.4-173.8-176.90000111.7T149 Y198 R204 G205 M209T149-V202 HydrophobicContact CG2-CG2 4.18Å; Y198-V202 HydrophobicContact CD2-CB 3.64Å; Y198-V202 HydrophobicContact CD2-CG1 4.06Å; Y198-V202 HydrophobicContact CD2-CG2 3.9Å; Y198-V202 HydrophobicContact CE2-CB 3.8Å; Y198-V202 HydrophobicContact CE2-CG1 3.68Å; Y198-V202 HydrophobicContact CE2-CG2 4.34Å; Y198-V202 WeakPolarHBondContact O-CA 3.38Å; Y198-V202 WeakPolarHBondContact O-CB 3.3Å; Y198-V202 PolarHBondContact O-N 3.3Å; V202-R204 VanDerWaalsContact C-N 3.32Å; V202-R204 PolarHBondContact O-N 2.93Å; V202-G205 PolarHBondContact O-N 3.45Å; V202-G205 VanDerWaalsContact O-N 3.17Å; V202-M209 HydrophobicContact CG2-CB 4.2Å; V202-M209 HydrophobicContact CG2-CE 4.08Å
203L65Low61.4Low108 Ų10875.6 Ų75.657%0.56539%0.386SS*.Iπ-helixtrans-68.1-30.9-177.5-70.5173.9000113.2Y198 V199 G205Y198-L203 HydrophobicContact CD1-CD1 4.09Å; Y198-L203 HydrophobicContact CD1-CG 4.34Å; Y198-L203 HydrophobicContact CE1-CD1 3.78Å; Y198-L203 HydrophobicContact CE1-CD2 4.24Å; Y198-L203 HydrophobicContact CE1-CG 3.88Å; Y198-L203 PolarHBondContact O-N 2.94Å; V199-L203 HydrophobicContact CG2-CD1 4.11Å; L203-G205 PolarHBondContact O-N 3.25Å
204R66.4Low59.9Low168 Ų16876.3 Ų76.363%0.63440%0.396SS*.THydrogen-bonded Turntrans-837.4176.5-69-179.5179.4-175-1.4113.8V199 V202 R206V199-R204 WeakPolarHBondContact O-CG 3.45Å; V202-R204 VanDerWaalsContact C-N 3.32Å; V202-R204 PolarHBondContact O-N 2.93Å; R204-R206 VanDerWaalsContact C-N 3.25Å; R204-R206 PolarHBondContact O-N 3.02Å
205G57.5Low58.4Low69 Ų6986 Ų8671%0.71146%0.456SS*.THydrogen-bonded Turntrans65.920.5173.900000115V202 L203 G207V202-G205 PolarHBondContact O-N 3.45Å; V202-G205 VanDerWaalsContact O-N 3.17Å; L203-G205 PolarHBondContact O-N 3.25Å; G205-G207 VanDerWaalsContact C-N 3.29Å; G205-G207 PolarHBondContact O-N 3.15Å
206R52.4Low57.5Low213 Ų21388.1 Ų88.180%0.80447%0.469SS*.  trans-88.418.6-175-72.9-170.8177.3-174.8-1.2114.3R201 R204R201-R206 PolarHBondContact O-N 3.45Å; R201-R206 VanDerWaalsContact O-N 3.12Å; R204-R206 VanDerWaalsContact C-N 3.25Å; R204-R206 PolarHBondContact O-N 3.02Å
207G52.8Low56.6Low46 Ų4684.7 Ų84.747%0.47446%0.462SS..  trans100.5-173.8174.600000114.9G205G205-G207 VanDerWaalsContact C-N 3.29Å; G205-G207 PolarHBondContact O-N 3.15Å
208K53Low56Low145 Ų14588.9 Ų88.963%0.6349%0.485SS*.SBendtrans-58.8144.4-176.2-69.4-177.9172.5-1710112E143 S210E143-K208 IonicContact OE1-NZ 2.86Å; E143-K208 PolarHBondContact OE1-NZ 3.43Å; E143-K208 IonicContact OE2-NZ 2.74Å; E143-K208 PolarHBondContact OE2-NZ 3.46Å; K208-S210 PolarHBondContact O-N 3.13Å
209M49.5Very low55.3Low2 Ų293.7 Ų93.71%0.0151%0.512CS..BIsolated β-bridgetrans-71.9111.4178.1179.4-176.1-82.500109.8E143 A144 T149 F194 L197 Y198 V202E143-M209 WeakPolarHBondContact CA-O 3.4Å; A144-M209 HydrophobicContact CB-CB 4.18Å; A144-M209 HydrophobicContact CB-CG 4.3Å; A144-M209 HydrophobicContact CB-SD 3.78Å; A144-M209 PolarHBondContact N-O 3.26Å; A144-M209 VanDerWaalsContact N-O 3.15Å; T149-M209 HydrophobicContact CG2-CE 3.24Å; T149-M209 HydrophobicContact CG2-SD 4Å; F194-M209 HydrophobicContact CD2-CE 4.32Å; F194-M209 HydrophobicContact CD2-SD 4.29Å; F194-M209 HydrophobicContact CE2-CE 3.7Å; F194-M209 HydrophobicContact CE2-SD 3.77Å; F194-M209 HydrophobicContact CZ-CE 4.16Å; L197-M209 HydrophobicContact CB-CE 4.35Å; Y198-M209 VanDerWaalsContact CA-CE 3.48Å; Y198-M209 HydrophobicContact CD2-CE 4.26Å; V202-M209 HydrophobicContact CG2-CB 4.2Å; V202-M209 HydrophobicContact CG2-CE 4.08Å
210S51.2Low54.3Low50 Ų5095.7 Ų95.735%0.3552%0.52SS..  trans-114.5123.8164.9620000110.5G142 R201 K208G142-S210 WeakPolarHBondContact O-CA 3.27Å; G142-S210 WeakPolarHBondContact O-CB 3.31Å; R201-S210 PolarHBondContact NH1-O 3.48Å; R201-S210 PolarHBondContact NH1-OG 2.97Å; R201-S210 PolarHBondContact NH2-O 3.3Å; K208-S210 PolarHBondContact O-N 3.13Å
211L53.3Low53.4Low21 Ų2199.9 Ų99.911%0.1154%0.542CS..PPolyproline II helixtrans-73.6140.2172.2-82.3149.2000108.8I138 T139 L197 M213I138-L211 HydrophobicContact CB-CD1 3.86Å; I138-L211 HydrophobicContact CG2-CD1 3.42Å; I138-L211 VanDerWaalsContact CG2-CD1 3.42Å; T139-L211 HydrophobicContact CG2-CB 4.15Å; T139-L211 HydrophobicContact CG2-CD1 3.55Å; T139-L211 HydrophobicContact CG2-CD2 4.11Å; T139-L211 HydrophobicContact CG2-CG 4.15Å; L197-L211 HydrophobicContact CD1-CD2 3.04Å; L197-L211 HydrophobicContact CD1-CG 3.87Å; L211-M213 PolarHBondContact O-N 3.2Å
212P47.5Very low52.6Low91 Ų91101.1 Ų101.159%0.59156%0.558SS**PPolyproline II helixtrans-60.4125.9168.325.6-30000108.4
213M40.5Very low51.4Low144 Ų144106.2 Ų106.271%0.70959%0.585SS**PPolyproline II helixtrans-65.4136.5174.3-64.9-156-61.300108.7L211 V215L211-M213 PolarHBondContact O-N 3.2Å; M213-V215 PolarHBondContact O-N 3.19Å
214P41.1Very low50.3Low112 Ų112106.1 Ų106.173%0.72759%0.586SS**PPolyproline II helixtrans-60.6126.1168.423.5-27.8000108.4
215V38.5Very low48.8Very low212 Ų212100.5 Ų100.5100%1.28558%0.582SS**  trans-68.30172.8-173.70000109.5M213M213-V215 PolarHBondContact O-N 3.19Å

Retrieved 215 of 215 residues in 284.3 ms (Link to these results)

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