A0A060W2L3_ONCMY Loading...

Charged multivesicular body protein 1b

AlphaFold DB (A0A674B9I5), UniProt , Accession A0A060W2L3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene chmp1b, Length 199 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
1M57Low87.6Confident193 Ų19394.2 Ų94.295%0.95147%0.468SS*.  0127.30-89-176.4-96.500108.7E5M1-E5 WeakPolarHBondContact CA-OE2 3.4Å; M1-E5 HydrophobicContact CB-CB 4.42Å; M1-E5 HydrophobicContact CG-CB 4.37Å
2S78.8Confident88.3Confident63 Ų6394 Ų9444%0.44146%0.462SS..  trans-66.1150.2170.6-165.60000109.4M4 E5 K6S2-M4 PolarHBondContact O-N 3.42Å; S2-E5 PolarHBondContact N-OE2 2.69Å; S2-E5 WeakPolarHBondContact O-CB 3.49Å; S2-E5 PolarHBondContact O-N 3.47Å; S2-K6 PolarHBondContact O-N 3.42Å
3N88.3Confident88.9Confident125 Ų12595.6 Ų95.667%0.66847%0.465SS*.Hα-helixtrans-51.6-35.9179-73.2-18.3000111.9E5 K6 H7N3-E5 PolarHBondContact O-N 3.45Å; N3-K6 PolarHBondContact O-N 3.12Å; N3-H7 PolarHBondContact O-CD2 3.36Å; N3-H7 PolarHBondContact O-N 3.45Å
4M85.9Confident89.5Confident92 Ų9291.1 Ų91.145%0.45345%0.451SS..Hα-helixtrans-65-34.6177.5-163.8176.4-83.100113.4S2 H7 L8 V79 V83S2-M4 PolarHBondContact O-N 3.42Å; M4-H7 PolarHBondContact O-N 3.05Å; M4-L8 VanDerWaalsContact O-CB 3.26Å; M4-L8 WeakPolarHBondContact O-CB 3.46Å; M4-L8 PolarHBondContact O-N 3.46Å; M4-V79 HydrophobicContact CG-CG1 4.06Å; M4-V83 HydrophobicContact CB-CG2 4.05Å; M4-V83 HydrophobicContact CG-CG2 3.47Å; M4-V83 VanDerWaalsContact CG-CG2 3.47Å; M4-V83 HydrophobicContact SD-CG2 3.63Å
5E90.1Very high89.9Confident47 Ų4785.3 Ų85.322%0.2242%0.423CS..Hα-helixtrans-68.7-37.4175.1-64.9177.7140.400111.6M1 S2 N3 L8 F9 V83 K87M1-E5 WeakPolarHBondContact CA-OE2 3.4Å; M1-E5 HydrophobicContact CB-CB 4.42Å; M1-E5 HydrophobicContact CG-CB 4.37Å; S2-E5 PolarHBondContact N-OE2 2.69Å; S2-E5 WeakPolarHBondContact O-CB 3.49Å; S2-E5 PolarHBondContact O-N 3.47Å; N3-E5 PolarHBondContact O-N 3.45Å; E5-L8 PolarHBondContact O-N 3.21Å; E5-F9 PolarHBondContact O-N 3.24Å; E5-V83 HydrophobicContact CG-CG1 3.85Å; E5-K87 WeakPolarHBondContact OE1-CE 3.19Å; E5-K87 IonicContact OE1-NZ 3.48Å; E5-K87 PolarHBondContact OE1-NZ 2.83Å
6K93.3Very high90.4Very high128 Ų12887.9 Ų87.956%0.55743%0.432SS*.Hα-helixtrans-66.3-44.3175.3-172.7178.6-179.8-179.40111.4S2 N3 L8 F9 N10S2-K6 PolarHBondContact O-N 3.42Å; N3-K6 PolarHBondContact O-N 3.12Å; K6-L8 VanDerWaalsContact C-N 3.35Å; K6-F9 PolarHBondContact O-N 2.93Å; K6-N10 PolarHBondContact O-N 3.33Å
7H91.7Very high90.8Very high118 Ų11889 Ų8955%0.54644%0.435SS..Hα-helixtrans-64.9-38.8175.4-69.5-60.2000112.2N3 M4 N10 L11N3-H7 PolarHBondContact O-CD2 3.36Å; N3-H7 PolarHBondContact O-N 3.45Å; M4-H7 PolarHBondContact O-N 3.05Å; H7-N10 PolarHBondContact O-N 3.48Å; H7-L11 WeakPolarHBondContact O-CG 3.4Å; H7-L11 PolarHBondContact O-N 3.05Å
8L93.1Very high91.1Very high9 Ų985.4 Ų85.45%0.04742%0.418CS..Hα-helixtrans-60.6-44.3174176.659000112.4M4 E5 K6 L11 K12 A76 V79 Q80 V83M4-L8 VanDerWaalsContact O-CB 3.26Å; M4-L8 WeakPolarHBondContact O-CB 3.46Å; M4-L8 PolarHBondContact O-N 3.46Å; E5-L8 PolarHBondContact O-N 3.21Å; K6-L8 VanDerWaalsContact C-N 3.35Å; L8-L11 PolarHBondContact O-N 3Å; L8-K12 HydrophobicContact CD1-CG 4.47Å; L8-K12 PolarHBondContact O-N 3.11Å; L8-A76 HydrophobicContact CD1-CB 4.21Å; L8-A76 WeakPolarHBondContact CD1-O 3.32Å; L8-V79 HydrophobicContact CB-CG1 3.99Å; L8-V79 HydrophobicContact CD1-CB 4.06Å; L8-V79 HydrophobicContact CD1-CG1 4.03Å; L8-V79 HydrophobicContact CG-CG1 4.46Å; L8-Q80 HydrophobicContact CD1-CB 4.07Å; L8-Q80 HydrophobicContact CD2-CB 4Å; L8-Q80 HydrophobicContact CD2-CG 4.45Å; L8-V83 HydrophobicContact CD2-CB 4.5Å; L8-V83 HydrophobicContact CD2-CG2 4.21Å
9F95.6Very high91.4Very high132 Ų13285.3 Ų85.358%0.57942%0.417SS*.Hα-helixtrans-58.9-48.5173.9175.1-93.9000111.3E5 K6 L11 K12 F13E5-F9 PolarHBondContact O-N 3.24Å; K6-F9 PolarHBondContact O-N 2.93Å; F9-L11 VanDerWaalsContact C-N 3.3Å; F9-L11 PolarHBondContact O-N 3.04Å; F9-K12 PolarHBondContact O-N 3.41Å; F9-F13 WeakPolarHBondContact O-CB 3.46Å; F9-F13 PolarHBondContact O-N 2.96Å
10N95.2Very high91.7Very high79 Ų7989.7 Ų89.742%0.42243%0.429SS..Hα-helixtrans-60.5-38.7178.8-70.3-7.5000112.3K6 H7 F13 A14K6-N10 PolarHBondContact O-N 3.33Å; H7-N10 PolarHBondContact O-N 3.48Å; N10-F13 PolarHBondContact O-N 3.06Å; N10-A14 VanDerWaalsContact O-CB 3.28Å; N10-A14 WeakPolarHBondContact O-CB 3.37Å; N10-A14 PolarHBondContact O-N 3.13Å
11L95.1Very high91.9Very high50 Ų5087.4 Ų87.426%0.26242%0.422SS..Hα-helixtrans-65-48176.4-73.9168.9000111.8H7 L8 F9 F13 A14 A15 I72 V75 A76 V79H7-L11 WeakPolarHBondContact O-CG 3.4Å; H7-L11 PolarHBondContact O-N 3.05Å; L8-L11 PolarHBondContact O-N 3Å; F9-L11 VanDerWaalsContact C-N 3.3Å; F9-L11 PolarHBondContact O-N 3.04Å; L11-F13 VanDerWaalsContact C-N 3.29Å; L11-F13 PolarHBondContact O-N 3.04Å; L11-A14 PolarHBondContact O-N 2.91Å; L11-A15 WeakPolarHBondContact O-CB 3.37Å; L11-A15 PolarHBondContact O-N 3.49Å; L11-I72 HydrophobicContact CB-CG2 4.31Å; L11-I72 HydrophobicContact CD2-CG2 4Å; L11-I72 VanDerWaalsContact O-CG2 3.29Å; L11-I72 WeakPolarHBondContact O-CG2 3.49Å; L11-V75 HydrophobicContact CD1-CG1 4.31Å; L11-A76 HydrophobicContact CB-CB 3.97Å; L11-V79 HydrophobicContact CD1-CG2 4.2Å
12K95.4Very high93.8Very high92 Ų9278.4 Ų78.440%0.438%0.378SS..Hα-helixtrans-61.8-39.1176.2-71.3-171.3179179.80111.8L8 F9 K16 A76L8-K12 HydrophobicContact CD1-CG 4.47Å; L8-K12 PolarHBondContact O-N 3.11Å; F9-K12 PolarHBondContact O-N 3.41Å; K12-K16 PolarHBondContact O-N 2.98Å; K12-K16 VanDerWaalsContact O-N 3.16Å; K12-A76 HydrophobicContact CG-CB 3.89Å
13F96.7Very high94.7Very high115 Ų11581.7 Ų81.750%0.50439%0.385SS..Hα-helixtrans-63.6-49.7176-175.3-94.8000111.3F9 N10 L11 A15 K16 E17F9-F13 WeakPolarHBondContact O-CB 3.46Å; F9-F13 PolarHBondContact O-N 2.96Å; N10-F13 PolarHBondContact O-N 3.06Å; L11-F13 VanDerWaalsContact C-N 3.29Å; L11-F13 PolarHBondContact O-N 3.04Å; F13-A15 PolarHBondContact O-N 3.48Å; F13-K16 PolarHBondContact O-N 3.05Å; F13-K16 VanDerWaalsContact O-N 3.17Å; F13-E17 WeakPolarHBondContact O-CB 3.38Å; F13-E17 PolarHBondContact O-N 2.79Å
14A96.1Very high95.1Very high32 Ų3282 Ų8226%0.26438%0.38SS..Hα-helixtrans-60.7-41.9177.800000112.3N10 L11 K16 E17 L18N10-A14 VanDerWaalsContact O-CB 3.28Å; N10-A14 WeakPolarHBondContact O-CB 3.37Å; N10-A14 PolarHBondContact O-N 3.13Å; L11-A14 PolarHBondContact O-N 2.91Å; A14-K16 VanDerWaalsContact C-N 3.31Å; A14-K16 PolarHBondContact O-N 3.47Å; A14-E17 PolarHBondContact O-N 3.44Å; A14-L18 WeakPolarHBondContact O-CG 3.27Å; A14-L18 PolarHBondContact O-N 2.71Å
15A96.1Very high95.6Very high4 Ų478.1 Ų78.13%0.03336%0.361CS..Hα-helixtrans-57.2-45.4174.900000111.5L11 F13 L18 Q19 S69 I72 D73L11-A15 WeakPolarHBondContact O-CB 3.37Å; L11-A15 PolarHBondContact O-N 3.49Å; F13-A15 PolarHBondContact O-N 3.48Å; A15-L18 PolarHBondContact O-N 3.42Å; A15-Q19 PolarHBondContact O-N 2.86Å; A15-S69 PolarHBondContact O-OG 3.19Å; A15-I72 HydrophobicContact CB-CB 4.19Å; A15-I72 HydrophobicContact CB-CG2 3.89Å; A15-D73 HydrophobicContact CB-CB 4.17Å
16K97.2Very high95.9Very high128 Ų12879 Ų7956%0.55737%0.367SS*.Hα-helixtrans-70.7-35.3179.4-165.6162.7-171.9163.90112.8K12 F13 A14 Q19 R20K12-K16 PolarHBondContact O-N 2.98Å; K12-K16 VanDerWaalsContact O-N 3.16Å; F13-K16 PolarHBondContact O-N 3.05Å; F13-K16 VanDerWaalsContact O-N 3.17Å; A14-K16 VanDerWaalsContact C-N 3.31Å; A14-K16 PolarHBondContact O-N 3.47Å; K16-Q19 PolarHBondContact O-N 3.44Å; K16-R20 WeakPolarHBondContact O-CG 3.43Å; K16-R20 PolarHBondContact O-N 3.44Å
17E97.2Very high96.1Very high106 Ų10680.6 Ų80.650%0.49537%0.374SS..Hα-helixtrans-63.3-46.3173.8-171.6175-175.300111F13 A14 Q19 R20 S21F13-E17 WeakPolarHBondContact O-CB 3.38Å; F13-E17 PolarHBondContact O-N 2.79Å; A14-E17 PolarHBondContact O-N 3.44Å; E17-Q19 VanDerWaalsContact C-N 3.33Å; E17-Q19 PolarHBondContact O-N 3.24Å; E17-R20 WeakPolarHBondContact O-CB 3.26Å; E17-R20 PolarHBondContact O-N 2.88Å; E17-R20 VanDerWaalsContact O-N 3.14Å; E17-S21 PolarHBondContact O-N 3.11Å; E17-S21 PolarHBondContact O-OG 2.88Å
18L96.3Very high96.3Very high25 Ų2578.3 Ų78.313%0.13136%0.364CS..Hα-helixtrans-61.7-39.4174.7-69.5173.3000112.4A14 A15 R20 S21 S22 F65 M68 I72A14-L18 WeakPolarHBondContact O-CG 3.27Å; A14-L18 PolarHBondContact O-N 2.71Å; A15-L18 PolarHBondContact O-N 3.42Å; L18-R20 VanDerWaalsContact C-N 3.31Å; L18-R20 PolarHBondContact O-N 3.44Å; L18-S21 PolarHBondContact O-N 3.1Å; L18-S22 PolarHBondContact O-N 3.36Å; L18-F65 HydrophobicContact CD2-CD1 3.67Å; L18-F65 HydrophobicContact CD2-CE1 4.13Å; L18-M68 HydrophobicContact CD1-CB 3.86Å; L18-M68 HydrophobicContact CD1-CE 4.37Å; L18-I72 HydrophobicContact CD1-CD1 3.52Å
19Q96.8Very high96.4Very high83 Ų8378.7 Ų78.739%0.38837%0.366SS..Hα-helixtrans-63-38.5175.4-163.3-172.66.600111.8A15 K16 E17 K23A15-Q19 PolarHBondContact O-N 2.86Å; K16-Q19 PolarHBondContact O-N 3.44Å; E17-Q19 VanDerWaalsContact C-N 3.33Å; E17-Q19 PolarHBondContact O-N 3.24Å; Q19-K23 WeakPolarHBondContact O-CG 3.5Å; Q19-K23 PolarHBondContact O-N 3.41Å; Q19-K23 VanDerWaalsContact O-N 3.13Å
20R97.7Very high96.4Very high173 Ų17379.5 Ų79.565%0.65337%0.369SS*.Hα-helixtrans-66.6-42.1173.6-73.3174.7175.2-171.8-1.8111.5K16 E17 L18 K23 K24K16-R20 WeakPolarHBondContact O-CG 3.43Å; K16-R20 PolarHBondContact O-N 3.44Å; E17-R20 WeakPolarHBondContact O-CB 3.26Å; E17-R20 PolarHBondContact O-N 2.88Å; E17-R20 VanDerWaalsContact O-N 3.14Å; L18-R20 VanDerWaalsContact C-N 3.31Å; L18-R20 PolarHBondContact O-N 3.44Å; R20-K23 PolarHBondContact O-N 3.15Å; R20-K24 WeakPolarHBondContact O-CB 3.32Å; R20-K24 PolarHBondContact O-N 3.29Å
21S96.2Very high96.4Very high41 Ų4178 Ų7829%0.28737%0.367SS..Hα-helixtrans-62.4-41.6176-65.60000112.1E17 L18 K24 C25E17-S21 PolarHBondContact O-N 3.11Å; E17-S21 PolarHBondContact O-OG 2.88Å; L18-S21 PolarHBondContact O-N 3.1Å; S21-K24 WeakPolarHBondContact O-CB 3.38Å; S21-K24 PolarHBondContact O-N 2.88Å; S21-C25 PolarHBondContact O-N 2.82Å; S21-C25 PolarHBondContact O-SG 3.28Å
22S96.9Very high96.3Very high5 Ų576.9 Ų76.94%0.03536%0.361CS..Hα-helixtrans-57.3-51.4171.8163.90000111.7L18 K24 C25 D26 S62L18-S22 PolarHBondContact O-N 3.36Å; S22-K24 PolarHBondContact O-N 3.36Å; S22-C25 WeakPolarHBondContact O-CB 3.44Å; S22-C25 PolarHBondContact O-N 3.4Å; S22-C25 VanDerWaalsContact O-N 3.12Å; S22-D26 PolarHBondContact O-N 3.16Å; S22-S62 PolarHBondContact O-OG 3.48Å; S22-S62 VanDerWaalsContact O-OG 3.12Å; S22-S62 PolarHBondContact OG-O 2.78Å; S22-S62 PolarHBondContact OG-OG 3.36Å
23K97.5Very high96.2Very high132 Ų13277.2 Ų77.257%0.57436%0.362SS*.Hα-helixtrans-60.3-33.9177.2-70.8179.8-179.4-175.20113Q19 R20 K27Q19-K23 WeakPolarHBondContact O-CG 3.5Å; Q19-K23 PolarHBondContact O-N 3.41Å; Q19-K23 VanDerWaalsContact O-N 3.13Å; R20-K23 PolarHBondContact O-N 3.15Å; K23-K27 PolarHBondContact O-N 3.04Å; K23-K27 VanDerWaalsContact O-N 3.12Å
24K97.8Very high96.1Very high132 Ų13274 Ų7457%0.57436%0.357SS*.Hα-helixtrans-67-46.8175.3-173.9-178.7173.8-173.10110.9R20 S21 S22 D26 K27 E28R20-K24 WeakPolarHBondContact O-CB 3.32Å; R20-K24 PolarHBondContact O-N 3.29Å; S21-K24 WeakPolarHBondContact O-CB 3.38Å; S21-K24 PolarHBondContact O-N 2.88Å; S22-K24 PolarHBondContact O-N 3.36Å; K24-D26 VanDerWaalsContact C-N 3.32Å; K24-D26 PolarHBondContact O-N 3.42Å; K24-K27 WeakPolarHBondContact O-CB 3.44Å; K24-K27 PolarHBondContact O-N 2.99Å; K24-K27 VanDerWaalsContact O-N 3.14Å; K24-E28 WeakPolarHBondContact CE-OE1 3.3Å; K24-E28 WeakPolarHBondContact O-CG 3.19Å; K24-E28 PolarHBondContact O-N 3.09Å
25C96.2Very high95.9Very high9 Ų976.9 Ų76.96%0.06136%0.363CS..Hα-helixtrans-58.4-41.4174.2-71.80000111.9S21 S22 K27 E28 E29 Q58S21-C25 PolarHBondContact O-N 2.82Å; S21-C25 PolarHBondContact O-SG 3.28Å; S22-C25 WeakPolarHBondContact O-CB 3.44Å; S22-C25 PolarHBondContact O-N 3.4Å; S22-C25 VanDerWaalsContact O-N 3.12Å; C25-K27 VanDerWaalsContact C-N 3.33Å; C25-K27 PolarHBondContact O-N 3.32Å; C25-E28 PolarHBondContact O-N 3.21Å; C25-E29 WeakPolarHBondContact O-CB 3.34Å; C25-E29 PolarHBondContact O-N 3.36Å; C25-Q58 PolarHBondContact SG-OE1 2.97Å
26D95.9Very high95.7Very high65 Ų6577.8 Ų77.835%0.34837%0.368SS..Hα-helixtrans-62.2-38.8175.1-75.8-14.3000112.8S22 K24 E29 K30 S62S22-D26 PolarHBondContact O-N 3.16Å; K24-D26 VanDerWaalsContact C-N 3.32Å; K24-D26 PolarHBondContact O-N 3.42Å; D26-E29 PolarHBondContact O-N 3.34Å; D26-K30 WeakPolarHBondContact O-CG 3.33Å; D26-K30 PolarHBondContact O-N 2.93Å; D26-K30 VanDerWaalsContact O-N 3.14Å; D26-S62 WeakPolarHBondContact OD1-CB 3.42Å; D26-S62 PolarHBondContact OD1-OG 2.89Å; D26-S62 PolarHBondContact OD2-OG 2.85Å
27K97.8Very high95.3Very high162 Ų16278.6 Ų78.670%0.70437%0.372SS*.Hα-helixtrans-66.9-42176.2-174.3178.9177.3-179.20111K23 K24 C25 K30 A31K23-K27 PolarHBondContact O-N 3.04Å; K23-K27 VanDerWaalsContact O-N 3.12Å; K24-K27 WeakPolarHBondContact O-CB 3.44Å; K24-K27 PolarHBondContact O-N 2.99Å; K24-K27 VanDerWaalsContact O-N 3.14Å; C25-K27 VanDerWaalsContact C-N 3.33Å; C25-K27 PolarHBondContact O-N 3.32Å; K27-K30 PolarHBondContact O-N 3.35Å; K27-A31 PolarHBondContact O-N 3.49Å; K27-A31 VanDerWaalsContact O-N 3.1Å
28E96.1Very high95.1Very high71 Ų7180.1 Ų80.133%0.33238%0.377SS..Hα-helixtrans-65.7-39.2176.3-71.4176-174.400111.3K24 C25 K30 A31 E32 Q58K24-E28 WeakPolarHBondContact CE-OE1 3.3Å; K24-E28 WeakPolarHBondContact O-CG 3.19Å; K24-E28 PolarHBondContact O-N 3.09Å; C25-E28 PolarHBondContact O-N 3.21Å; E28-K30 PolarHBondContact O-N 2.85Å; E28-A31 WeakPolarHBondContact O-CB 3.01Å; E28-A31 PolarHBondContact O-N 2.73Å; E28-A31 VanDerWaalsContact O-N 3.14Å; E28-E32 WeakPolarHBondContact O-CG 3.44Å; E28-E32 PolarHBondContact O-N 2.93Å; E28-Q58 HydrophobicContact CB-CG 4.4Å; E28-Q58 PolarHBondContact OE2-NE2 3.18Å
29E94.3Very high94.7Very high17 Ų1779.2 Ų79.28%0.07937%0.373CS..Hα-helixtrans-57.6-46.8174.1-171.7-116.6-154.100112.1C25 D26 A31 E32 K33 A55 Q58 K59C25-E29 WeakPolarHBondContact O-CB 3.34Å; C25-E29 PolarHBondContact O-N 3.36Å; D26-E29 PolarHBondContact O-N 3.34Å; E29-A31 VanDerWaalsContact C-N 3.32Å; E29-A31 PolarHBondContact O-N 2.66Å; E29-E32 PolarHBondContact O-N 2.75Å; E29-K33 VanDerWaalsContact CD-CE 3.42Å; E29-K33 WeakPolarHBondContact O-CG 3.29Å; E29-K33 PolarHBondContact O-N 2.83Å; E29-K33 WeakPolarHBondContact OE1-CE 3.3Å; E29-K33 IonicContact OE1-NZ 2.82Å; E29-K33 PolarHBondContact OE1-NZ 3.34Å; E29-K33 WeakPolarHBondContact OE2-CE 3.26Å; E29-K33 IonicContact OE2-NZ 3.92Å; E29-K33 PolarHBondContact OE2-NZ 2.8Å; E29-A55 HydrophobicContact CG-CB 4.38Å; E29-A55 WeakPolarHBondContact CG-O 3.39Å; E29-Q58 HydrophobicContact CB-CB 4.05Å; E29-K59 HydrophobicContact CG-CB 4.16Å
30K95.4Very high94.3Very high148 Ų14880.5 Ų80.564%0.64338%0.382SS*.Hα-helixtrans-62.5-39.3175.6-70.5175.6-176.4-179.70112D26 K27 E28 A34D26-K30 WeakPolarHBondContact O-CG 3.33Å; D26-K30 PolarHBondContact O-N 2.93Å; D26-K30 VanDerWaalsContact O-N 3.14Å; K27-K30 PolarHBondContact O-N 3.35Å; E28-K30 PolarHBondContact O-N 2.85Å; K30-A34 PolarHBondContact O-N 2.86Å; K30-A34 VanDerWaalsContact O-N 3.1Å
31A96.1Very high94Very high47 Ų4780 Ų8039%0.38839%0.387SS..Hα-helixtrans-66.1-43.617700000111.8K27 E28 E29 A34 K35K27-A31 PolarHBondContact O-N 3.49Å; K27-A31 VanDerWaalsContact O-N 3.1Å; E28-A31 WeakPolarHBondContact O-CB 3.01Å; E28-A31 PolarHBondContact O-N 2.73Å; E28-A31 VanDerWaalsContact O-N 3.14Å; E29-A31 VanDerWaalsContact C-N 3.32Å; E29-A31 PolarHBondContact O-N 2.66Å; A31-A34 WeakPolarHBondContact O-CB 3.33Å; A31-A34 PolarHBondContact O-N 3.13Å; A31-K35 WeakPolarHBondContact O-CG 3.34Å; A31-K35 PolarHBondContact O-N 2.92Å; A31-K35 VanDerWaalsContact O-N 3.09Å
32E93.1Very high93.7Very high28 Ų2885.9 Ų85.913%0.13141%0.407CS..Hα-helixtrans-64.6-42.6176.4-69.2-54.8132.700111.6E28 E29 A34 K35 V36 H51 N54 A55E28-E32 WeakPolarHBondContact O-CG 3.44Å; E28-E32 PolarHBondContact O-N 2.93Å; E29-E32 PolarHBondContact O-N 2.75Å; E32-A34 VanDerWaalsContact C-N 3.28Å; E32-A34 PolarHBondContact O-N 3.36Å; E32-K35 CarbonylContact O-C 3.58Å; E32-K35 WeakPolarHBondContact O-CA 3.31Å; E32-K35 WeakPolarHBondContact O-CB 3.42Å; E32-K35 PolarHBondContact O-N 2.76Å; E32-K35 IonicContact OE1-NZ 3.46Å; E32-K35 PolarHBondContact OE1-NZ 2.85Å; E32-V36 WeakPolarHBondContact O-CG2 3.37Å; E32-V36 PolarHBondContact O-N 3.11Å; E32-H51 IonicContact OE2-CE1 2.71Å; E32-H51 IonicContact OE2-CG 3.65Å; E32-H51 IonicContact OE2-ND1 3.57Å; E32-H51 PolarHBondContact OE2-ND1 3.43Å; E32-N54 HydrophobicContact CG-CB 4.24Å; E32-A55 HydrophobicContact CB-CB 3.94Å
33K92.2Very high93.3Very high98 Ų9888.2 Ų88.243%0.42643%0.432SS..Hα-helixtrans-57.1-39.1172.1-77.9175.4175.4165.60113E29 K35 V36 K37 A55E29-K33 VanDerWaalsContact CD-CE 3.42Å; E29-K33 WeakPolarHBondContact O-CG 3.29Å; E29-K33 PolarHBondContact O-N 2.83Å; E29-K33 WeakPolarHBondContact OE1-CE 3.3Å; E29-K33 IonicContact OE1-NZ 2.82Å; E29-K33 PolarHBondContact OE1-NZ 3.34Å; E29-K33 WeakPolarHBondContact OE2-CE 3.26Å; E29-K33 IonicContact OE2-NZ 3.92Å; E29-K33 PolarHBondContact OE2-NZ 2.8Å; K33-K35 VanDerWaalsContact C-N 3.33Å; K33-V36 PolarHBondContact O-N 3.27Å; K33-K37 WeakPolarHBondContact O-CG 3.43Å; K33-K37 PolarHBondContact O-N 2.69Å; K33-K37 VanDerWaalsContact O-N 3.12Å; K33-A55 HydrophobicContact CG-CB 4.17Å
34A94.8Very high92.9Very high47 Ų4786.2 Ų86.239%0.38843%0.427SS..Hα-helixtrans-65.9-36.8175.400000111.9K30 A31 E32 K38K30-A34 PolarHBondContact O-N 2.86Å; K30-A34 VanDerWaalsContact O-N 3.1Å; A31-A34 WeakPolarHBondContact O-CB 3.33Å; A31-A34 PolarHBondContact O-N 3.13Å; E32-A34 VanDerWaalsContact C-N 3.28Å; E32-A34 PolarHBondContact O-N 3.36Å; A34-K38 WeakPolarHBondContact O-CG 3.17Å; A34-K38 PolarHBondContact O-N 3.02Å
35K92.2Very high92.5Very high93 Ų9384.8 Ų84.840%0.40443%0.43SS..Hα-helixtrans-67.4-40.4173.8-65.4173.9-169.6169.80111.9A31 E32 K33 K37 K38 A39 H51A31-K35 WeakPolarHBondContact O-CG 3.34Å; A31-K35 PolarHBondContact O-N 2.92Å; A31-K35 VanDerWaalsContact O-N 3.09Å; E32-K35 CarbonylContact O-C 3.58Å; E32-K35 WeakPolarHBondContact O-CA 3.31Å; E32-K35 WeakPolarHBondContact O-CB 3.42Å; E32-K35 PolarHBondContact O-N 2.76Å; E32-K35 IonicContact OE1-NZ 3.46Å; E32-K35 PolarHBondContact OE1-NZ 2.85Å; K33-K35 VanDerWaalsContact C-N 3.33Å; K35-K37 PolarHBondContact O-N 2.73Å; K35-K38 PolarHBondContact O-N 2.81Å; K35-A39 WeakPolarHBondContact O-CB 3.33Å; K35-A39 PolarHBondContact O-N 3.26Å; K35-H51 HydrophobicContact CB-CB 4.48Å
36V91.7Very high92.1Very high23 Ų2391.7 Ų91.714%0.13946%0.461CS..Hα-helixtrans-55.2-50.7173.3175.10000110.5E32 K33 K38 A39 I40 H51 A52E32-V36 WeakPolarHBondContact O-CG2 3.37Å; E32-V36 PolarHBondContact O-N 3.11Å; K33-V36 PolarHBondContact O-N 3.27Å; V36-K38 VanDerWaalsContact C-N 3.3Å; V36-K38 PolarHBondContact O-N 2.93Å; V36-A39 PolarHBondContact O-N 2.81Å; V36-A39 VanDerWaalsContact O-N 3.12Å; V36-I40 HydrophobicContact CG1-CD1 3.7Å; V36-I40 HydrophobicContact CG1-CG1 4.3Å; V36-I40 WeakPolarHBondContact O-CG1 3.2Å; V36-I40 PolarHBondContact O-N 3.08Å; V36-H51 VanDerWaalsContact CG2-C 3.45Å; V36-H51 HydrophobicContact CG2-CB 3.45Å; V36-H51 VanDerWaalsContact CG2-CB 3.45Å; V36-A52 HydrophobicContact CG2-CB 4.04Å; V36-A52 VanDerWaalsContact CG2-N 3.32Å
37K90.3Very high91.7Very high146 Ų14691.6 Ų91.664%0.63546%0.463SS*.Hα-helixtrans-56-44.7178.4-71.2-178.9179.9-174.10112K33 K35 Q41K33-K37 WeakPolarHBondContact O-CG 3.43Å; K33-K37 PolarHBondContact O-N 2.69Å; K33-K37 VanDerWaalsContact O-N 3.12Å; K35-K37 PolarHBondContact O-N 2.73Å; K37-Q41 WeakPolarHBondContact O-CG 3.16Å; K37-Q41 PolarHBondContact O-N 3.43Å; K37-Q41 VanDerWaalsContact O-N 3.11Å
38K92.2Very high91.1Very high137 Ų13784.3 Ų84.360%0.59643%0.432SS*.Hα-helixtrans-66.4-38177.4-70.2178.4-179.8-177.30112.8A34 K35 V36 K42A34-K38 WeakPolarHBondContact O-CG 3.17Å; A34-K38 PolarHBondContact O-N 3.02Å; K35-K38 PolarHBondContact O-N 2.81Å; V36-K38 VanDerWaalsContact C-N 3.3Å; V36-K38 PolarHBondContact O-N 2.93Å; K38-K42 WeakPolarHBondContact O-CG 3.33Å; K38-K42 PolarHBondContact O-N 3.38Å
39A87.8Confident90.7Very high7 Ų789.2 Ų89.26%0.05845%0.448CS..Hα-helixtrans-68.7-39.3178.800000111.8K35 V36 K42 G43 N44 V47 A48K35-A39 WeakPolarHBondContact O-CB 3.33Å; K35-A39 PolarHBondContact O-N 3.26Å; V36-A39 PolarHBondContact O-N 2.81Å; V36-A39 VanDerWaalsContact O-N 3.12Å; A39-K42 PolarHBondContact O-N 3.49Å; A39-G43 PolarHBondContact O-N 3.22Å; A39-N44 PolarHBondContact O-N 2.84Å; A39-N44 VanDerWaalsContact O-N 3.08Å; A39-V47 HydrophobicContact CB-CB 4.43Å; A39-V47 HydrophobicContact CB-CG1 4.13Å; A39-A48 HydrophobicContact CB-CB 3.88Å
40I88.3Confident90.6Very high109 Ų10993.1 Ų93.156%0.55947%0.468SS*.Hα-helixtrans-63-45.6174.3-67171.4000110.8V36 K42 G43 A48V36-I40 HydrophobicContact CG1-CD1 3.7Å; V36-I40 HydrophobicContact CG1-CG1 4.3Å; V36-I40 WeakPolarHBondContact O-CG1 3.2Å; V36-I40 PolarHBondContact O-N 3.08Å; I40-K42 PolarHBondContact O-N 3.26Å; I40-G43 PolarHBondContact O-N 3Å; I40-A48 HydrophobicContact CG1-CB 3.76Å
41Q90.4Very high90.2Very high163 Ų16388.1 Ų88.176%0.76245%0.447SS*.Hα-helixtrans-59.6-29.4177.1-75.3173.5-10.400113.2K37 G43K37-Q41 WeakPolarHBondContact O-CG 3.16Å; K37-Q41 PolarHBondContact O-N 3.43Å; K37-Q41 VanDerWaalsContact O-N 3.11Å; Q41-G43 VanDerWaalsContact C-N 3.34Å
42K90.9Very high89.9Confident165 Ų16587.5 Ų87.572%0.71744%0.442SS*.THydrogen-bonded Turntrans-85.5-3.4176.9-68.5179179.4-168.80113.6K38 A39 I40 N44K38-K42 WeakPolarHBondContact O-CG 3.33Å; K38-K42 PolarHBondContact O-N 3.38Å; A39-K42 PolarHBondContact O-N 3.49Å; I40-K42 PolarHBondContact O-N 3.26Å; K42-N44 VanDerWaalsContact C-N 3.28Å; K42-N44 PolarHBondContact O-N 3.45Å
43G88.9Confident89.9Confident53 Ų5392.5 Ų92.555%0.54647%0.465SS..THydrogen-bonded Turntrans76.66.7-176.900000115.1A39 I40 Q41 V45A39-G43 PolarHBondContact O-N 3.22Å; I40-G43 PolarHBondContact O-N 3Å; Q41-G43 VanDerWaalsContact C-N 3.34Å; G43-V45 PolarHBondContact O-N 3.13Å; G43-V45 VanDerWaalsContact O-N 3.12Å
44N89.6Confident89.7Confident90 Ų9090 Ų9048%0.48146%0.457SS..  trans-8880.9-177.9-73.2-14.1000111.1A39 K42 E46 V47 A48A39-N44 PolarHBondContact O-N 2.84Å; A39-N44 VanDerWaalsContact O-N 3.08Å; K42-N44 VanDerWaalsContact C-N 3.28Å; K42-N44 PolarHBondContact O-N 3.45Å; N44-E46 PolarHBondContact O-N 3.38Å; N44-V47 HydrophobicContact CB-CB 4.18Å; N44-V47 HydrophobicContact CB-CG2 4.3Å; N44-V47 PolarHBondContact O-N 2.85Å; N44-A48 PolarHBondContact O-N 3.19Å
45V87.4Confident89.5Confident103 Ų10388 Ų8862%0.62444%0.44SS*.Hα-helixtrans-63-37.9-174.6-177.60000112.9G43 A48 R49G43-V45 PolarHBondContact O-N 3.13Å; G43-V45 VanDerWaalsContact O-N 3.12Å; V45-A48 PolarHBondContact O-N 2.78Å; V45-R49 PolarHBondContact O-N 2.74Å
46E88.6Confident89.5Confident154 Ų15488.6 Ų88.672%0.7245%0.446SS*.Hα-helixtrans-65.4-44.2178.7-67-168.3151.100112.4N44 A48 R49 I50N44-E46 PolarHBondContact O-N 3.38Å; E46-A48 VanDerWaalsContact C-N 3.33Å; E46-A48 PolarHBondContact O-N 3.14Å; E46-R49 WeakPolarHBondContact O-CB 3.42Å; E46-R49 PolarHBondContact O-N 3.23Å; E46-I50 PolarHBondContact O-N 3.44Å; E46-I50 VanDerWaalsContact O-N 3.15Å
47V86.6Confident89.6Confident63 Ų6393.6 Ų93.638%0.38246%0.463SS..Hα-helixtrans-65.8-38.6177.1176.90000110.8A39 N44 R49 I50 H51A39-V47 HydrophobicContact CB-CB 4.43Å; A39-V47 HydrophobicContact CB-CG1 4.13Å; N44-V47 HydrophobicContact CB-CB 4.18Å; N44-V47 HydrophobicContact CB-CG2 4.3Å; N44-V47 PolarHBondContact O-N 2.85Å; V47-R49 VanDerWaalsContact C-N 3.33Å; V47-R49 PolarHBondContact O-N 3.28Å; V47-I50 PolarHBondContact O-N 2.8Å; V47-H51 PolarHBondContact O-CD2 2.91Å; V47-H51 PolarHBondContact O-N 2.75Å; V47-H51 VanDerWaalsContact O-N 3.12Å
48A86.9Confident89.7Confident8 Ų887.6 Ų87.67%0.06644%0.437CS..Hα-helixtrans-61.9-39.7174.300000112.2A39 I40 N44 V45 E46 H51 A52A39-A48 HydrophobicContact CB-CB 3.88Å; I40-A48 HydrophobicContact CG1-CB 3.76Å; N44-A48 PolarHBondContact O-N 3.19Å; V45-A48 PolarHBondContact O-N 2.78Å; E46-A48 VanDerWaalsContact C-N 3.33Å; E46-A48 PolarHBondContact O-N 3.14Å; A48-H51 PolarHBondContact O-N 3.29Å; A48-A52 VanDerWaalsContact O-CB 3.3Å; A48-A52 WeakPolarHBondContact O-CB 3.49Å; A48-A52 PolarHBondContact O-N 2.94Å
49R87.3Confident89.8Confident175 Ų17586.5 Ų86.566%0.6643%0.432SS*.Hα-helixtrans-63.3-45.1177.1-175.2-178.9-79148.6-6111.8V45 E46 V47 A52 E53V45-R49 PolarHBondContact O-N 2.74Å; E46-R49 WeakPolarHBondContact O-CB 3.42Å; E46-R49 PolarHBondContact O-N 3.23Å; V47-R49 VanDerWaalsContact C-N 3.33Å; V47-R49 PolarHBondContact O-N 3.28Å; R49-A52 PolarHBondContact O-N 3.42Å; R49-E53 PolarHBondContact O-N 3.5Å
50I91.8Very high89.8Confident98 Ų9891 Ų9150%0.50346%0.456SS..Hα-helixtrans-62.5-45.1178.4-64.3168.3000111.2E46 V47 A52 E53 N54E46-I50 PolarHBondContact O-N 3.44Å; E46-I50 VanDerWaalsContact O-N 3.15Å; V47-I50 PolarHBondContact O-N 2.8Å; I50-A52 VanDerWaalsContact C-N 3.31Å; I50-A52 PolarHBondContact O-N 3.35Å; I50-E53 PolarHBondContact O-N 3.04Å; I50-N54 PolarHBondContact O-N 3.38Å; I50-N54 PolarHBondContact O-ND2 2.76Å
51H87.9Confident90Very high44 Ų4489.4 Ų89.420%0.20445%0.446CS..Hα-helixtrans-66.9-32.8177-72.7-59.9000112.5E32 K35 V36 V47 A48 N54 A55E32-H51 IonicContact OE2-CE1 2.71Å; E32-H51 IonicContact OE2-CG 3.65Å; E32-H51 IonicContact OE2-ND1 3.57Å; E32-H51 PolarHBondContact OE2-ND1 3.43Å; K35-H51 HydrophobicContact CB-CB 4.48Å; V36-H51 VanDerWaalsContact CG2-C 3.45Å; V36-H51 HydrophobicContact CG2-CB 3.45Å; V36-H51 VanDerWaalsContact CG2-CB 3.45Å; V47-H51 PolarHBondContact O-CD2 2.91Å; V47-H51 PolarHBondContact O-N 2.75Å; V47-H51 VanDerWaalsContact O-N 3.12Å; A48-H51 PolarHBondContact O-N 3.29Å; H51-N54 PolarHBondContact O-N 2.87Å; H51-A55 WeakPolarHBondContact O-CB 3.28Å; H51-A55 PolarHBondContact O-N 3.38Å
52A89.8Confident90.1Very high34 Ų3481.8 Ų81.828%0.28141%0.411SS..Hα-helixtrans-68.3-43.317600000111.7V36 A48 R49 I50 N54 A55 I56V36-A52 HydrophobicContact CG2-CB 4.04Å; V36-A52 VanDerWaalsContact CG2-N 3.32Å; A48-A52 VanDerWaalsContact O-CB 3.3Å; A48-A52 WeakPolarHBondContact O-CB 3.49Å; A48-A52 PolarHBondContact O-N 2.94Å; R49-A52 PolarHBondContact O-N 3.42Å; I50-A52 VanDerWaalsContact C-N 3.31Å; I50-A52 PolarHBondContact O-N 3.35Å; A52-N54 VanDerWaalsContact C-N 3.34Å; A52-N54 PolarHBondContact O-N 3.08Å; A52-A55 WeakPolarHBondContact O-CB 3.42Å; A52-A55 PolarHBondContact O-N 3.31Å; A52-I56 WeakPolarHBondContact O-CG1 3.4Å; A52-I56 PolarHBondContact O-N 3.34Å
53E91.6Very high90.3Very high133 Ų13377.4 Ų77.462%0.62140%0.397SS*.Hα-helixtrans-59.9-45.5174.1-173.2-176.9167.600111.2R49 I50 A55 I56 R57R49-E53 PolarHBondContact O-N 3.5Å; I50-E53 PolarHBondContact O-N 3.04Å; E53-A55 VanDerWaalsContact C-N 3.32Å; E53-A55 PolarHBondContact O-N 2.76Å; E53-I56 PolarHBondContact O-N 2.86Å; E53-R57 WeakPolarHBondContact O-CB 3.22Å; E53-R57 PolarHBondContact O-N 3.02Å
54N89.2Confident90.4Very high45 Ų4579 Ų7924%0.24139%0.393CS..Hα-helixtrans-60-40.8175.1-81.7-41.4000112.6E32 I50 H51 A52 R57 Q58E32-N54 HydrophobicContact CG-CB 4.24Å; I50-N54 PolarHBondContact O-N 3.38Å; I50-N54 PolarHBondContact O-ND2 2.76Å; H51-N54 PolarHBondContact O-N 2.87Å; A52-N54 VanDerWaalsContact C-N 3.34Å; A52-N54 PolarHBondContact O-N 3.08Å; N54-R57 PolarHBondContact O-N 2.77Å; N54-R57 PolarHBondContact OD1-NH2 3.15Å; N54-Q58 WeakPolarHBondContact O-CB 3.41Å; N54-Q58 WeakPolarHBondContact O-CG 3.27Å; N54-Q58 PolarHBondContact O-N 3.39Å
55A90.1Very high90.6Very high5 Ų577.5 Ų77.54%0.04138%0.383CS..Hα-helixtrans-62.3-44.5176.100000112E29 E32 K33 H51 A52 E53 Q58 K59E29-A55 HydrophobicContact CG-CB 4.38Å; E29-A55 WeakPolarHBondContact CG-O 3.39Å; E32-A55 HydrophobicContact CB-CB 3.94Å; K33-A55 HydrophobicContact CG-CB 4.17Å; H51-A55 WeakPolarHBondContact O-CB 3.28Å; H51-A55 PolarHBondContact O-N 3.38Å; A52-A55 WeakPolarHBondContact O-CB 3.42Å; A52-A55 PolarHBondContact O-N 3.31Å; E53-A55 VanDerWaalsContact C-N 3.32Å; E53-A55 PolarHBondContact O-N 2.76Å; A55-Q58 PolarHBondContact O-N 3.24Å; A55-K59 PolarHBondContact O-N 2.9Å
56I91.9Very high90.8Very high105 Ų10577 Ų7754%0.53838%0.376SS..Hα-helixtrans-63.6-44.2177.5-66.6169.9000110.7A52 E53 Q58 K59 N60A52-I56 WeakPolarHBondContact O-CG1 3.4Å; A52-I56 PolarHBondContact O-N 3.34Å; E53-I56 PolarHBondContact O-N 2.86Å; I56-Q58 VanDerWaalsContact C-N 3.32Å; I56-Q58 PolarHBondContact O-N 2.82Å; I56-K59 PolarHBondContact O-N 3.45Å; I56-N60 PolarHBondContact O-N 2.71Å
57R93.1Very high91Very high128 Ų12876.2 Ų76.248%0.48337%0.367SS..Hα-helixtrans-57.8-45.8176.4-176.9173.263.6115.1-1.2111.5E53 N54 N60 Q61E53-R57 WeakPolarHBondContact O-CB 3.22Å; E53-R57 PolarHBondContact O-N 3.02Å; N54-R57 PolarHBondContact O-N 2.77Å; N54-R57 PolarHBondContact OD1-NH2 3.15Å; R57-N60 PolarHBondContact O-N 3Å; R57-Q61 WeakPolarHBondContact O-CB 3.45Å; R57-Q61 WeakPolarHBondContact O-CG 3.41Å; R57-Q61 PolarHBondContact O-N 3.49Å
58Q93.9Very high91.3Very high21 Ų2177 Ų7710%0.09837%0.367CS..Hα-helixtrans-66.1-39.5178.9-69.7-7323.100112.6C25 E28 E29 N54 A55 I56 N60 Q61 S62C25-Q58 PolarHBondContact SG-OE1 2.97Å; E28-Q58 HydrophobicContact CB-CG 4.4Å; E28-Q58 PolarHBondContact OE2-NE2 3.18Å; E29-Q58 HydrophobicContact CB-CB 4.05Å; N54-Q58 WeakPolarHBondContact O-CB 3.41Å; N54-Q58 WeakPolarHBondContact O-CG 3.27Å; N54-Q58 PolarHBondContact O-N 3.39Å; A55-Q58 PolarHBondContact O-N 3.24Å; I56-Q58 VanDerWaalsContact C-N 3.32Å; I56-Q58 PolarHBondContact O-N 2.82Å; Q58-N60 PolarHBondContact O-N 3.46Å; Q58-Q61 PolarHBondContact O-N 3.4Å; Q58-S62 WeakPolarHBondContact O-CB 3.12Å; Q58-S62 PolarHBondContact O-N 3.21Å
59K92.8Very high91.6Very high114 Ų11477.1 Ų77.150%0.49637%0.367SS..Hα-helixtrans-58.4-48.3173-175.2176.3179.4179.30111.4E29 A55 I56 Q61 S62 V63E29-K59 HydrophobicContact CG-CB 4.16Å; A55-K59 PolarHBondContact O-N 2.9Å; I56-K59 PolarHBondContact O-N 3.45Å; K59-Q61 PolarHBondContact O-N 3.11Å; K59-S62 WeakPolarHBondContact O-CB 3.47Å; K59-S62 PolarHBondContact O-N 3.45Å; K59-V63 WeakPolarHBondContact O-CG2 3.37Å; K59-V63 PolarHBondContact O-N 3.46Å; K59-V63 VanDerWaalsContact O-N 3.11Å
60N89.9Confident91.8Very high102 Ų10271.7 Ų71.755%0.54536%0.36SS..Hα-helixtrans-65.1-40.4179.7-70.4-12.8000111.9I56 R57 Q58 V63 N64I56-N60 PolarHBondContact O-N 2.71Å; R57-N60 PolarHBondContact O-N 3Å; Q58-N60 PolarHBondContact O-N 3.46Å; N60-V63 PolarHBondContact O-N 2.88Å; N60-N64 WeakPolarHBondContact O-CB 3.44Å; N60-N64 PolarHBondContact O-N 2.95Å
61Q91.7Very high91.8Very high74 Ų7475 Ų7535%0.34637%0.366SS..Hα-helixtrans-63-41.8174.6-77.6-177.1-16.100112.1R57 Q58 K59 N64 F65R57-Q61 WeakPolarHBondContact O-CB 3.45Å; R57-Q61 WeakPolarHBondContact O-CG 3.41Å; R57-Q61 PolarHBondContact O-N 3.49Å; Q58-Q61 PolarHBondContact O-N 3.4Å; K59-Q61 PolarHBondContact O-N 3.11Å; Q61-N64 PolarHBondContact O-N 3.09Å; Q61-F65 HydrophobicContact CB-CE2 4.4Å; Q61-F65 VanDerWaalsContact O-CD2 3.25Å; Q61-F65 WeakPolarHBondContact O-CD2 3.34Å; Q61-F65 WeakPolarHBondContact O-CG 3.34Å; Q61-F65 PolarHBondContact O-N 3.35Å
62S93.3Very high92.1Very high4 Ų474.9 Ų74.93%0.02837%0.366CS..Hα-helixtrans-58.8-50.1176.5-179.30000112S22 D26 Q58 K59 N64 F65 L66S22-S62 PolarHBondContact O-OG 3.48Å; S22-S62 VanDerWaalsContact O-OG 3.12Å; S22-S62 PolarHBondContact OG-O 2.78Å; S22-S62 PolarHBondContact OG-OG 3.36Å; D26-S62 WeakPolarHBondContact OD1-CB 3.42Å; D26-S62 PolarHBondContact OD1-OG 2.89Å; D26-S62 PolarHBondContact OD2-OG 2.85Å; Q58-S62 WeakPolarHBondContact O-CB 3.12Å; Q58-S62 PolarHBondContact O-N 3.21Å; K59-S62 WeakPolarHBondContact O-CB 3.47Å; K59-S62 PolarHBondContact O-N 3.45Å; S62-N64 VanDerWaalsContact C-N 3.29Å; S62-N64 PolarHBondContact O-N 3.31Å; S62-F65 PolarHBondContact O-N 2.79Å; S62-L66 WeakPolarHBondContact O-CB 3.36Å; S62-L66 PolarHBondContact O-N 3.3Å
63V93.2Very high92.2Very high72 Ų7277.6 Ų77.644%0.43638%0.376SS..Hα-helixtrans-60.9-40.5178.5174.60000111.1K59 N60 L66 R67K59-V63 WeakPolarHBondContact O-CG2 3.37Å; K59-V63 PolarHBondContact O-N 3.46Å; K59-V63 VanDerWaalsContact O-N 3.11Å; N60-V63 PolarHBondContact O-N 2.88Å; V63-L66 PolarHBondContact O-N 2.86Å; V63-R67 WeakPolarHBondContact O-CB 3.25Å; V63-R67 PolarHBondContact O-N 2.84Å
64N91.6Very high92.2Very high86 Ų8673.6 Ų73.646%0.4637%0.366SS..Hα-helixtrans-66.2-44.6178.6-1639.6000111.9N60 Q61 S62 L66 R67 M68N60-N64 WeakPolarHBondContact O-CB 3.44Å; N60-N64 PolarHBondContact O-N 2.95Å; Q61-N64 PolarHBondContact O-N 3.09Å; S62-N64 VanDerWaalsContact C-N 3.29Å; S62-N64 PolarHBondContact O-N 3.31Å; N64-L66 VanDerWaalsContact C-N 3.33Å; N64-L66 PolarHBondContact O-N 3.17Å; N64-R67 PolarHBondContact O-N 2.89Å; N64-M68 WeakPolarHBondContact O-CB 3.4Å; N64-M68 WeakPolarHBondContact O-CG 3.44Å; N64-M68 PolarHBondContact O-N 3.43Å
65F93.5Very high92.3Very high60 Ų6074.7 Ų74.726%0.26337%0.374SS..Hα-helixtrans-62.1-39.8174.8-73.8-41.8000112.6L18 Q61 S62 M68 S69L18-F65 HydrophobicContact CD2-CD1 3.67Å; L18-F65 HydrophobicContact CD2-CE1 4.13Å; Q61-F65 HydrophobicContact CB-CE2 4.4Å; Q61-F65 VanDerWaalsContact O-CD2 3.25Å; Q61-F65 WeakPolarHBondContact O-CD2 3.34Å; Q61-F65 WeakPolarHBondContact O-CG 3.34Å; Q61-F65 PolarHBondContact O-N 3.35Å; S62-F65 PolarHBondContact O-N 2.79Å; F65-M68 PolarHBondContact O-N 3.18Å; F65-S69 VanDerWaalsContact O-CB 3.25Å; F65-S69 WeakPolarHBondContact O-CB 3.31Å; F65-S69 PolarHBondContact O-N 3.37Å
66L92.2Very high92.5Very high93 Ų9374.4 Ų74.449%0.48737%0.372SS..Hα-helixtrans-63.7-44.9176-174.662.6000111.4S62 V63 N64 S69 A70S62-L66 WeakPolarHBondContact O-CB 3.36Å; S62-L66 PolarHBondContact O-N 3.3Å; V63-L66 PolarHBondContact O-N 2.86Å; N64-L66 VanDerWaalsContact C-N 3.33Å; N64-L66 PolarHBondContact O-N 3.17Å; L66-S69 WeakPolarHBondContact O-CB 3.47Å; L66-S69 PolarHBondContact O-N 2.83Å; L66-A70 PolarHBondContact O-N 2.96Å
67R92.3Very high92.5Very high137 Ų13772 Ų7252%0.51737%0.367SS..Hα-helixtrans-62.1-44.1176.3-173.6-176.4-66.2162.1-2.7111.9V63 N64 R71V63-R67 WeakPolarHBondContact O-CB 3.25Å; V63-R67 PolarHBondContact O-N 2.84Å; N64-R67 PolarHBondContact O-N 2.89Å; R67-R71 WeakPolarHBondContact O-CG 3.49Å; R67-R71 PolarHBondContact O-N 3.39Å; R67-R71 VanDerWaalsContact O-N 3.11Å
68M92.4Very high92.3Very high79 Ų7974.8 Ų74.839%0.38938%0.378SS..Hα-helixtrans-64.3-43175.6-72.4176.760.600111.5L18 N64 F65 A70 R71 I72L18-M68 HydrophobicContact CD1-CB 3.86Å; L18-M68 HydrophobicContact CD1-CE 4.37Å; N64-M68 WeakPolarHBondContact O-CB 3.4Å; N64-M68 WeakPolarHBondContact O-CG 3.44Å; N64-M68 PolarHBondContact O-N 3.43Å; F65-M68 PolarHBondContact O-N 3.18Å; M68-A70 PolarHBondContact O-N 3.13Å; M68-R71 PolarHBondContact O-N 2.94Å; M68-I72 WeakPolarHBondContact O-CG1 3.42Å; M68-I72 PolarHBondContact O-N 3.09Å
69S94.2Very high92.2Very high10 Ų1075.5 Ų75.57%0.0738%0.383CS..Hα-helixtrans-56.6-50.2176.2179.40000111.2A15 F65 L66 R71 I72 D73A15-S69 PolarHBondContact O-OG 3.19Å; F65-S69 VanDerWaalsContact O-CB 3.25Å; F65-S69 WeakPolarHBondContact O-CB 3.31Å; F65-S69 PolarHBondContact O-N 3.37Å; L66-S69 WeakPolarHBondContact O-CB 3.47Å; L66-S69 PolarHBondContact O-N 2.83Å; S69-R71 VanDerWaalsContact C-N 3.34Å; S69-R71 PolarHBondContact O-N 3.4Å; S69-I72 PolarHBondContact O-N 3.47Å; S69-D73 WeakPolarHBondContact O-CB 3.47Å; S69-D73 PolarHBondContact O-N 3.23Å
70A92.1Very high92.2Very high61 Ų6173.2 Ų73.250%0.50437%0.374SS..Hα-helixtrans-60.2-41.6178.100000112.5L66 M68 D73 A74L66-A70 PolarHBondContact O-N 2.96Å; M68-A70 PolarHBondContact O-N 3.13Å; A70-D73 PolarHBondContact O-N 3.05Å; A70-A74 WeakPolarHBondContact O-CB 3.33Å; A70-A74 PolarHBondContact O-N 2.77Å
71R91.8Very high92.3Very high168 Ų16873 Ų7363%0.63438%0.377SS*.Hα-helixtrans-64.5-43.8176.4-72.5175179.3-171.4-1.3112.2R67 M68 S69 A74 V75R67-R71 WeakPolarHBondContact O-CG 3.49Å; R67-R71 PolarHBondContact O-N 3.39Å; R67-R71 VanDerWaalsContact O-N 3.11Å; M68-R71 PolarHBondContact O-N 2.94Å; S69-R71 VanDerWaalsContact C-N 3.34Å; S69-R71 PolarHBondContact O-N 3.4Å; R71-A74 PolarHBondContact O-N 2.7Å; R71-V75 WeakPolarHBondContact O-CG2 3.37Å; R71-V75 PolarHBondContact O-N 3.49Å; R71-V75 VanDerWaalsContact O-N 3.12Å
72I93.4Very high92.1Very high41 Ų4171.8 Ų71.821%0.2138%0.38CS..Hα-helixtrans-67.3-39.4178.6-66.1-178.6000110.6L11 A15 L18 M68 S69 V75 A76L11-I72 HydrophobicContact CB-CG2 4.31Å; L11-I72 HydrophobicContact CD2-CG2 4Å; L11-I72 VanDerWaalsContact O-CG2 3.29Å; L11-I72 WeakPolarHBondContact O-CG2 3.49Å; A15-I72 HydrophobicContact CB-CB 4.19Å; A15-I72 HydrophobicContact CB-CG2 3.89Å; L18-I72 HydrophobicContact CD1-CD1 3.52Å; M68-I72 WeakPolarHBondContact O-CG1 3.42Å; M68-I72 PolarHBondContact O-N 3.09Å; S69-I72 PolarHBondContact O-N 3.47Å; I72-V75 PolarHBondContact O-N 2.85Å; I72-A76 WeakPolarHBondContact O-CB 3.09Å; I72-A76 PolarHBondContact O-N 2.9Å
73D92Very high92Very high91 Ų9172 Ų7249%0.48738%0.381SS..Hα-helixtrans-64.1-42178-163.551.2000111.7A15 S69 A70 V75 A76 A77A15-D73 HydrophobicContact CB-CB 4.17Å; S69-D73 WeakPolarHBondContact O-CB 3.47Å; S69-D73 PolarHBondContact O-N 3.23Å; A70-D73 PolarHBondContact O-N 3.05Å; D73-V75 VanDerWaalsContact C-N 3.33Å; D73-V75 PolarHBondContact O-N 3.49Å; D73-A76 WeakPolarHBondContact O-CB 3.26Å; D73-A76 PolarHBondContact O-N 3.34Å; D73-A76 VanDerWaalsContact O-N 3.16Å; D73-A77 PolarHBondContact O-N 2.99Å
74A91.4Very high91.8Very high49 Ų4971.9 Ų71.941%0.40538%0.38SS..Hα-helixtrans-60.3-40.8172.900000112.6A70 R71 A77 R78A70-A74 WeakPolarHBondContact O-CB 3.33Å; A70-A74 PolarHBondContact O-N 2.77Å; R71-A74 PolarHBondContact O-N 2.7Å; A74-A77 PolarHBondContact O-N 3.44Å; A74-R78 PolarHBondContact O-N 2.83Å
75V92.7Very high91.7Very high68 Ų6873.6 Ų73.641%0.41239%0.387SS..Hα-helixtrans-66.3-42.7174.4174.20000110.7L11 R71 I72 D73 A77 R78 V79L11-V75 HydrophobicContact CD1-CG1 4.31Å; R71-V75 WeakPolarHBondContact O-CG2 3.37Å; R71-V75 PolarHBondContact O-N 3.49Å; R71-V75 VanDerWaalsContact O-N 3.12Å; I72-V75 PolarHBondContact O-N 2.85Å; D73-V75 VanDerWaalsContact C-N 3.33Å; D73-V75 PolarHBondContact O-N 3.49Å; V75-A77 VanDerWaalsContact C-N 3.31Å; V75-A77 PolarHBondContact O-N 2.91Å; V75-R78 PolarHBondContact O-N 3.18Å; V75-V79 HydrophobicContact CG1-CG2 4.37Å; V75-V79 WeakPolarHBondContact O-CG2 3.09Å; V75-V79 PolarHBondContact O-N 3.41Å
76A93.2Very high91.5Very high0 Ų074.3 Ų74.30%039%0.394CS..Hα-helixtrans-60.8-40.1176.900000111.7L8 L11 K12 I72 D73 V79 Q80L8-A76 HydrophobicContact CD1-CB 4.21Å; L8-A76 WeakPolarHBondContact CD1-O 3.32Å; L11-A76 HydrophobicContact CB-CB 3.97Å; K12-A76 HydrophobicContact CG-CB 3.89Å; I72-A76 WeakPolarHBondContact O-CB 3.09Å; I72-A76 PolarHBondContact O-N 2.9Å; D73-A76 WeakPolarHBondContact O-CB 3.26Å; D73-A76 PolarHBondContact O-N 3.34Å; D73-A76 VanDerWaalsContact O-N 3.16Å; A76-V79 PolarHBondContact O-N 2.83Å; A76-Q80 WeakPolarHBondContact O-CB 3.4Å; A76-Q80 PolarHBondContact O-N 3.07Å
77A91.8Very high91.3Very high53 Ų5375 Ų7544%0.43839%0.393SS..Hα-helixtrans-61.4-46.2175.100000111.8D73 A74 V75 V79 Q80 T81D73-A77 PolarHBondContact O-N 2.99Å; A74-A77 PolarHBondContact O-N 3.44Å; V75-A77 VanDerWaalsContact C-N 3.31Å; V75-A77 PolarHBondContact O-N 2.91Å; A77-V79 PolarHBondContact O-N 3.11Å; A77-Q80 WeakPolarHBondContact O-CB 3.34Å; A77-Q80 PolarHBondContact O-N 2.96Å; A77-T81 PolarHBondContact O-N 3.26Å; A77-T81 PolarHBondContact O-OG1 2.99Å
78R90.3Very high91.3Very high188 Ų18871.6 Ų71.671%0.70939%0.387SS*.Hα-helixtrans-61.4-42.1175.3-70.8-179.4-178.4146.20.6112.5A74 V75 Q80 T81 A82A74-R78 PolarHBondContact O-N 2.83Å; V75-R78 PolarHBondContact O-N 3.18Å; R78-Q80 VanDerWaalsContact C-N 3.34Å; R78-T81 PolarHBondContact O-N 3.36Å; R78-A82 PolarHBondContact O-N 3.49Å
79V91.8Very high91.2Very high35 Ų3571.6 Ų71.621%0.21239%0.391CS..Hα-helixtrans-65.8-38.3176.6175.40000110.9M4 L8 L11 V75 A76 A77 T81 A82 V83M4-V79 HydrophobicContact CG-CG1 4.06Å; L8-V79 HydrophobicContact CB-CG1 3.99Å; L8-V79 HydrophobicContact CD1-CB 4.06Å; L8-V79 HydrophobicContact CD1-CG1 4.03Å; L8-V79 HydrophobicContact CG-CG1 4.46Å; L11-V79 HydrophobicContact CD1-CG2 4.2Å; V75-V79 HydrophobicContact CG1-CG2 4.37Å; V75-V79 WeakPolarHBondContact O-CG2 3.09Å; V75-V79 PolarHBondContact O-N 3.41Å; A76-V79 PolarHBondContact O-N 2.83Å; A77-V79 PolarHBondContact O-N 3.11Å; V79-T81 PolarHBondContact O-N 3.2Å; V79-A82 PolarHBondContact O-N 3.25Å; V79-V83 HydrophobicContact CG1-CG2 4.38Å; V79-V83 WeakPolarHBondContact O-CG2 3.4Å; V79-V83 PolarHBondContact O-N 2.94Å
80Q91.6Very high91Very high66 Ų6677.4 Ų77.431%0.30842%0.415SS..Hα-helixtrans-58.8-46.9174.1179.570.669.900111.2L8 A76 A77 R78 A82 V83 T84L8-Q80 HydrophobicContact CD1-CB 4.07Å; L8-Q80 HydrophobicContact CD2-CB 4Å; L8-Q80 HydrophobicContact CD2-CG 4.45Å; A76-Q80 WeakPolarHBondContact O-CB 3.4Å; A76-Q80 PolarHBondContact O-N 3.07Å; A77-Q80 WeakPolarHBondContact O-CB 3.34Å; A77-Q80 PolarHBondContact O-N 2.96Å; R78-Q80 VanDerWaalsContact C-N 3.34Å; Q80-A82 VanDerWaalsContact C-N 3.33Å; Q80-A82 PolarHBondContact O-N 3.17Å; Q80-V83 PolarHBondContact O-N 3.1Å; Q80-T84 PolarHBondContact O-N 3.08Å; Q80-T84 PolarHBondContact O-OG1 3.37Å; Q80-T84 VanDerWaalsContact O-OG1 3.08Å
81T92.2Very high91Very high97 Ų9778.3 Ų78.360%0.59542%0.418SS*.Hα-helixtrans-59-46175.9-56.50000111A77 R78 V79 V83 T84 M85A77-T81 PolarHBondContact O-N 3.26Å; A77-T81 PolarHBondContact O-OG1 2.99Å; R78-T81 PolarHBondContact O-N 3.36Å; V79-T81 PolarHBondContact O-N 3.2Å; T81-V83 PolarHBondContact O-N 3.02Å; T81-T84 PolarHBondContact O-N 3.33Å; T81-M85 WeakPolarHBondContact O-CB 3.47Å; T81-M85 PolarHBondContact O-N 3.03Å
82A88.4Confident90.8Very high49 Ų4976.1 Ų76.141%0.40542%0.417SS..Hα-helixtrans-61.5-40.8177.800000112.7R78 V79 Q80 N86R78-A82 PolarHBondContact O-N 3.49Å; V79-A82 PolarHBondContact O-N 3.25Å; Q80-A82 VanDerWaalsContact C-N 3.33Å; Q80-A82 PolarHBondContact O-N 3.17Å; A82-N86 WeakPolarHBondContact O-CB 3.49Å; A82-N86 PolarHBondContact O-N 3.26Å
83V89.7Confident90.6Very high9 Ų976.6 Ų76.66%0.05543%0.427CS..Hα-helixtrans-63.4-46.9175.4168.60000111M4 E5 L8 V79 Q80 T81 N86 K87M4-V83 HydrophobicContact CB-CG2 4.05Å; M4-V83 HydrophobicContact CG-CG2 3.47Å; M4-V83 VanDerWaalsContact CG-CG2 3.47Å; M4-V83 HydrophobicContact SD-CG2 3.63Å; E5-V83 HydrophobicContact CG-CG1 3.85Å; L8-V83 HydrophobicContact CD2-CB 4.5Å; L8-V83 HydrophobicContact CD2-CG2 4.21Å; V79-V83 HydrophobicContact CG1-CG2 4.38Å; V79-V83 WeakPolarHBondContact O-CG2 3.4Å; V79-V83 PolarHBondContact O-N 2.94Å; Q80-V83 PolarHBondContact O-N 3.1Å; T81-V83 PolarHBondContact O-N 3.02Å; V83-N86 PolarHBondContact O-N 3.49Å; V83-K87 WeakPolarHBondContact O-CG 3.34Å; V83-K87 PolarHBondContact O-N 3.27Å
84T89.6Confident90.6Very high69 Ų6974.4 Ų74.442%0.42343%0.426SS..Hα-helixtrans-63.1-45.3178.8-58.50000110.6Q80 T81 N86 K87 V88Q80-T84 PolarHBondContact O-N 3.08Å; Q80-T84 PolarHBondContact O-OG1 3.37Å; Q80-T84 VanDerWaalsContact O-OG1 3.08Å; T81-T84 PolarHBondContact O-N 3.33Å; T84-N86 VanDerWaalsContact C-N 3.32Å; T84-N86 PolarHBondContact O-N 3.08Å; T84-K87 WeakPolarHBondContact O-CB 3.34Å; T84-K87 PolarHBondContact O-N 3.44Å; T84-K87 VanDerWaalsContact O-N 3.11Å; T84-V88 WeakPolarHBondContact O-CG2 2.98Å; T84-V88 PolarHBondContact O-N 3.23Å
85M89.6Confident90.5Very high122 Ų12276.9 Ų76.960%0.60144%0.436SS*.Hα-helixtrans-61.8-41.3177.4-162.365.6176.900111.3T81 K87 V88 T89T81-M85 WeakPolarHBondContact O-CB 3.47Å; T81-M85 PolarHBondContact O-N 3.03Å; M85-K87 VanDerWaalsContact C-N 3.3Å; M85-K87 PolarHBondContact O-N 3.21Å; M85-V88 PolarHBondContact O-N 3.47Å; M85-T89 PolarHBondContact O-N 3.35Å; M85-T89 PolarHBondContact O-OG1 3.16Å
86N88.6Confident90.3Very high76 Ų7677.9 Ų77.941%0.40644%0.441SS..Hα-helixtrans-60.7-38.5175.2-167.2-88.3000112.4A82 V83 T84 K90A82-N86 WeakPolarHBondContact O-CB 3.49Å; A82-N86 PolarHBondContact O-N 3.26Å; V83-N86 PolarHBondContact O-N 3.49Å; T84-N86 VanDerWaalsContact C-N 3.32Å; T84-N86 PolarHBondContact O-N 3.08Å; N86-K90 WeakPolarHBondContact O-CB 3.38Å; N86-K90 WeakPolarHBondContact O-CG 3.42Å; N86-K90 PolarHBondContact O-N 3.44Å; N86-K90 WeakPolarHBondContact OD1-CE 3.34Å; N86-K90 PolarHBondContact OD1-NZ 2.93Å
87K89.3Confident90.1Very high107 Ų10785.6 Ų85.647%0.46548%0.475SS..Hα-helixtrans-64-46.3174.4-71177.3-178.4-177.90111.2E5 V83 T84 M85 K90 S91E5-K87 WeakPolarHBondContact OE1-CE 3.19Å; E5-K87 IonicContact OE1-NZ 3.48Å; E5-K87 PolarHBondContact OE1-NZ 2.83Å; V83-K87 WeakPolarHBondContact O-CG 3.34Å; V83-K87 PolarHBondContact O-N 3.27Å; T84-K87 WeakPolarHBondContact O-CB 3.34Å; T84-K87 PolarHBondContact O-N 3.44Å; T84-K87 VanDerWaalsContact O-N 3.11Å; M85-K87 VanDerWaalsContact C-N 3.3Å; M85-K87 PolarHBondContact O-N 3.21Å; K87-K90 PolarHBondContact O-N 3.01Å; K87-S91 PolarHBondContact O-N 3.49Å; K87-S91 PolarHBondContact O-OG 3.45Å
88V91.2Very high89.8Confident65 Ų6584.8 Ų84.839%0.39447%0.472SS..Hα-helixtrans-58.8-48.6175.7174.70000110.6T84 M85 K90 S91 M92T84-V88 WeakPolarHBondContact O-CG2 2.98Å; T84-V88 PolarHBondContact O-N 3.23Å; M85-V88 PolarHBondContact O-N 3.47Å; V88-K90 VanDerWaalsContact C-N 3.32Å; V88-K90 PolarHBondContact O-N 2.89Å; V88-S91 PolarHBondContact O-N 3.27Å; V88-S91 VanDerWaalsContact O-N 3.17Å; V88-M92 HydrophobicContact CG1-CG 4.32Å; V88-M92 HydrophobicContact CG1-SD 3.99Å; V88-M92 WeakPolarHBondContact O-CG 3.48Å; V88-M92 PolarHBondContact O-N 3.42Å
89T90.1Very high89.3Confident79 Ų7981 Ų8149%0.48546%0.464SS..Hα-helixtrans-58.9-41.4177.4-54.50000112.1M85 M92 A93M85-T89 PolarHBondContact O-N 3.35Å; M85-T89 PolarHBondContact O-OG1 3.16Å; T89-M92 PolarHBondContact O-N 2.7Å; T89-A93 WeakPolarHBondContact O-CB 3.34Å; T89-A93 PolarHBondContact O-N 3.4Å
90K90.6Very high88.8Confident132 Ų13283.3 Ų83.357%0.57448%0.475SS*.Hα-helixtrans-64.9-43.2175.8-79.2177.9178.2171.50112.4N86 K87 V88 A93 G94N86-K90 WeakPolarHBondContact O-CB 3.38Å; N86-K90 WeakPolarHBondContact O-CG 3.42Å; N86-K90 PolarHBondContact O-N 3.44Å; N86-K90 WeakPolarHBondContact OD1-CE 3.34Å; N86-K90 PolarHBondContact OD1-NZ 2.93Å; K87-K90 PolarHBondContact O-N 3.01Å; V88-K90 VanDerWaalsContact C-N 3.32Å; V88-K90 PolarHBondContact O-N 2.89Å; K90-A93 PolarHBondContact O-N 3.12Å; K90-G94 PolarHBondContact O-N 2.85Å
91S91.3Very high88.4Confident81 Ų8183 Ų8357%0.56648%0.484SS*.Hα-helixtrans-62.5-47175.8-63.20000111.2K87 V88 A93 G94 V95K87-S91 PolarHBondContact O-N 3.49Å; K87-S91 PolarHBondContact O-OG 3.45Å; V88-S91 PolarHBondContact O-N 3.27Å; V88-S91 VanDerWaalsContact O-N 3.17Å; S91-A93 VanDerWaalsContact C-N 3.35Å; S91-A93 PolarHBondContact O-N 3.46Å; S91-G94 PolarHBondContact O-N 3.34Å; S91-G94 VanDerWaalsContact O-N 3.13Å; S91-V95 WeakPolarHBondContact O-CG2 3.41Å; S91-V95 PolarHBondContact O-N 3.16Å
92M87.9Confident87.6Confident122 Ų12281.8 Ų81.860%0.60148%0.477SS*.Hα-helixtrans-60-42.6175.8-72.3179.980.800111.8V88 T89 G94 V95 V96V88-M92 HydrophobicContact CG1-CG 4.32Å; V88-M92 HydrophobicContact CG1-SD 3.99Å; V88-M92 WeakPolarHBondContact O-CG 3.48Å; V88-M92 PolarHBondContact O-N 3.42Å; T89-M92 PolarHBondContact O-N 2.7Å; M92-G94 VanDerWaalsContact C-N 3.28Å; M92-G94 PolarHBondContact O-N 3.41Å; M92-V95 PolarHBondContact O-N 2.95Å; M92-V96 VanDerWaalsContact O-CG2 3.31Å; M92-V96 WeakPolarHBondContact O-CG2 3.07Å; M92-V96 PolarHBondContact O-N 3.23Å
93A90.8Very high86.7Confident51 Ų5183.1 Ų83.142%0.42148%0.476SS..Hα-helixtrans-62.1-36.2176.200000112.4T89 K90 S91 K97T89-A93 WeakPolarHBondContact O-CB 3.34Å; T89-A93 PolarHBondContact O-N 3.4Å; K90-A93 PolarHBondContact O-N 3.12Å; S91-A93 VanDerWaalsContact C-N 3.35Å; S91-A93 PolarHBondContact O-N 3.46Å; A93-K97 WeakPolarHBondContact O-CB 3.45Å; A93-K97 WeakPolarHBondContact O-CG 3.41Å; A93-K97 PolarHBondContact O-N 3.44Å; A93-K97 VanDerWaalsContact O-N 3.09Å
94G90Very high85.9Confident45 Ų4590.6 Ų90.646%0.46451%0.508SS..Hα-helixtrans-64.2-45.9172.200000112.4K90 S91 M92 K97 G98K90-G94 PolarHBondContact O-N 2.85Å; S91-G94 PolarHBondContact O-N 3.34Å; S91-G94 VanDerWaalsContact O-N 3.13Å; M92-G94 VanDerWaalsContact C-N 3.28Å; M92-G94 PolarHBondContact O-N 3.41Å; G94-K97 PolarHBondContact O-N 2.9Å; G94-G98 PolarHBondContact O-N 3.45Å
95V89.8Confident84.9Confident101 Ų10192 Ų9261%0.61252%0.52SS*.Hα-helixtrans-62.1-47.3176.7175.30000111.1S91 M92 K97 G98 M99S91-V95 WeakPolarHBondContact O-CG2 3.41Å; S91-V95 PolarHBondContact O-N 3.16Å; M92-V95 PolarHBondContact O-N 2.95Å; V95-K97 VanDerWaalsContact C-N 3.33Å; V95-K97 PolarHBondContact O-N 2.8Å; V95-G98 CarbonylContact O-C 3.56Å; V95-G98 PolarHBondContact O-N 3.03Å; V95-G98 VanDerWaalsContact O-N 3.15Å; V95-M99 WeakPolarHBondContact O-CB 3.26Å; V95-M99 PolarHBondContact O-N 3.5Å
96V88.5Confident83.3Confident88 Ų8889.1 Ų89.153%0.53351%0.507SS..Hα-helixtrans-61.2-40.8179172.30000111.3M92 M99 D100M92-V96 VanDerWaalsContact O-CG2 3.31Å; M92-V96 WeakPolarHBondContact O-CG2 3.07Å; M92-V96 PolarHBondContact O-N 3.23Å; V96-M99 PolarHBondContact O-N 3.34Å; V96-D100 PolarHBondContact O-N 2.98Å
97K89.5Confident81.9Confident162 Ų16291.5 Ų91.570%0.70452%0.519SS*.Hα-helixtrans-65-42.7173.8-77-177.9179.5-175.60112.6A93 G94 V95 M99 D100 A101A93-K97 WeakPolarHBondContact O-CB 3.45Å; A93-K97 WeakPolarHBondContact O-CG 3.41Å; A93-K97 PolarHBondContact O-N 3.44Å; A93-K97 VanDerWaalsContact O-N 3.09Å; G94-K97 PolarHBondContact O-N 2.9Å; V95-K97 VanDerWaalsContact C-N 3.33Å; V95-K97 PolarHBondContact O-N 2.8Å; K97-M99 VanDerWaalsContact C-N 3.28Å; K97-M99 PolarHBondContact O-N 3.31Å; K97-D100 PolarHBondContact O-N 3.06Å; K97-A101 PolarHBondContact O-N 2.96Å; K97-A101 VanDerWaalsContact O-N 3.11Å
98G85.9Confident80.6Confident37 Ų3793.2 Ų93.238%0.38153%0.533SS..Hα-helixtrans-62.8-38.1174.800000111.9G94 V95 T102G94-G98 PolarHBondContact O-N 3.45Å; V95-G98 CarbonylContact O-C 3.56Å; V95-G98 PolarHBondContact O-N 3.03Å; V95-G98 VanDerWaalsContact O-N 3.15Å; G98-T102 WeakPolarHBondContact O-CB 3.42Å; G98-T102 PolarHBondContact O-N 3.29Å; G98-T102 PolarHBondContact O-OG1 2.92Å
99M79.4Confident79.3Confident107 Ų10798.1 Ų98.153%0.52755%0.551SS.*Hα-helixtrans-69.5-42.7177.5-159.9173.383.100111.5V95 V96 K97 A101 T102 L103V95-M99 WeakPolarHBondContact O-CB 3.26Å; V95-M99 PolarHBondContact O-N 3.5Å; V96-M99 PolarHBondContact O-N 3.34Å; K97-M99 VanDerWaalsContact C-N 3.28Å; K97-M99 PolarHBondContact O-N 3.31Å; M99-A101 PolarHBondContact O-N 3.48Å; M99-T102 PolarHBondContact O-N 2.83Å; M99-L103 HydrophobicContact CE-CD1 4.15Å; M99-L103 HydrophobicContact CG-CD1 3.93Å; M99-L103 HydrophobicContact CG-CG 4.25Å; M99-L103 VanDerWaalsContact O-CB 3.28Å; M99-L103 WeakPolarHBondContact O-CB 3.32Å; M99-L103 VanDerWaalsContact O-CG 3.22Å; M99-L103 WeakPolarHBondContact O-CG 3.45Å; M99-L103 PolarHBondContact O-N 3.23Å
100D80.8Confident78Confident84 Ų84101 Ų10145%0.44956%0.557SS.*Hα-helixtrans-59.8-43.3174.5-175.663.5000112.1V96 K97 T102 K104V96-D100 PolarHBondContact O-N 2.98Å; K97-D100 PolarHBondContact O-N 3.06Å; D100-T102 VanDerWaalsContact C-N 3.35Å; D100-K104 PolarHBondContact O-N 3.27Å; D100-K104 IonicContact OD1-NZ 2.78Å; D100-K104 IonicContact OD2-NZ 3.21Å; D100-K104 PolarHBondContact OD2-NZ 2.89Å
101A82.8Confident76.7Confident61 Ų6196.8 Ų96.850%0.50454%0.54SS..Hα-helixtrans-64.3-39.7175.100000112.1K97 M99 S105K97-A101 PolarHBondContact O-N 2.96Å; K97-A101 VanDerWaalsContact O-N 3.11Å; M99-A101 PolarHBondContact O-N 3.48Å; A101-S105 PolarHBondContact O-N 3.39Å
102T75.1Confident75.4Confident71 Ų7196.5 Ų96.544%0.43654%0.538SS..Hα-helixtrans-70.2-44.3178.4-52.90000111.2G98 M99 D100 K104 S105 M106G98-T102 WeakPolarHBondContact O-CB 3.42Å; G98-T102 PolarHBondContact O-N 3.29Å; G98-T102 PolarHBondContact O-OG1 2.92Å; M99-T102 PolarHBondContact O-N 2.83Å; D100-T102 VanDerWaalsContact C-N 3.35Å; T102-K104 VanDerWaalsContact C-N 3.33Å; T102-K104 PolarHBondContact O-N 3.11Å; T102-S105 CarbonylContact O-C 3.53Å; T102-S105 WeakPolarHBondContact O-CA 3.11Å; T102-S105 PolarHBondContact O-N 3.3Å; T102-S105 PolarHBondContact O-OG 2.94Å; T102-M106 HydrophobicContact CG2-CG 4.47Å; T102-M106 HydrophobicContact CG2-SD 4.01Å; T102-M106 WeakPolarHBondContact O-CB 3.45Å; T102-M106 PolarHBondContact O-N 2.92Å
103L70.1Confident74.8Confident76 Ų7692.6 Ų92.640%0.39853%0.529SS..Hα-helixtrans-62.4-35.5177.7-74.8168.6000112.2M99 S105 M106 I111M99-L103 HydrophobicContact CE-CD1 4.15Å; M99-L103 HydrophobicContact CG-CD1 3.93Å; M99-L103 HydrophobicContact CG-CG 4.25Å; M99-L103 VanDerWaalsContact O-CB 3.28Å; M99-L103 WeakPolarHBondContact O-CB 3.32Å; M99-L103 VanDerWaalsContact O-CG 3.22Å; M99-L103 WeakPolarHBondContact O-CG 3.45Å; M99-L103 PolarHBondContact O-N 3.23Å; L103-S105 PolarHBondContact O-N 2.71Å; L103-M106 PolarHBondContact O-N 2.87Å; L103-I111 HydrophobicContact CD2-CD1 3.41Å; L103-I111 VanDerWaalsContact CD2-CD1 3.41Å; L103-I111 HydrophobicContact CD2-CG1 3.93Å
104K73.3Confident73.7Confident166 Ų16694.7 Ų94.772%0.72253%0.533SS*.Hα-helixtrans-63.3-25.3170.5-87172.5-178.8139.40113.8D100 T102D100-K104 PolarHBondContact O-N 3.27Å; D100-K104 IonicContact OD1-NZ 2.78Å; D100-K104 IonicContact OD2-NZ 3.21Å; D100-K104 PolarHBondContact OD2-NZ 2.89Å; T102-K104 VanDerWaalsContact C-N 3.33Å; T102-K104 PolarHBondContact O-N 3.11Å
105S67.7Low72.8Confident98 Ų9898 Ų9869%0.68554%0.538SS*.Hα-helixtrans-100.1-9.1179.175.40000114A101 T102 L103A101-S105 PolarHBondContact O-N 3.39Å; T102-S105 CarbonylContact O-C 3.53Å; T102-S105 WeakPolarHBondContact O-CA 3.11Å; T102-S105 PolarHBondContact O-N 3.3Å; T102-S105 PolarHBondContact O-OG 2.94Å; L103-S105 PolarHBondContact O-N 2.71Å
106M56.8Low72.2Confident63 Ų6398 Ų9831%0.3154%0.535SS..SBendtrans-107.3123-175.4-105.4-176.7146.600111.4T102 L103 K110T102-M106 HydrophobicContact CG2-CG 4.47Å; T102-M106 HydrophobicContact CG2-SD 4.01Å; T102-M106 WeakPolarHBondContact O-CB 3.45Å; T102-M106 PolarHBondContact O-N 2.92Å; L103-M106 PolarHBondContact O-N 2.87Å; M106-K110 HydrophobicContact CE-CB 3.84Å; M106-K110 HydrophobicContact CE-CD 4.03Å
107N60.1Low71.5Confident126 Ų126100.5 Ų100.567%0.67454%0.538SS*.  trans-63.1141.8172.9-122.2-30.9000111.3E109 K110N107-E109 PolarHBondContact O-N 3.03Å; N107-K110 PolarHBondContact O-N 3.41Å
108L61.6Low70.8Confident142 Ų14298.2 Ų98.274%0.74353%0.528SS*.Hα-helixtrans-50.7-30.7-177.7-83.9156.1000114.4K110 I111 S112L108-K110 VanDerWaalsContact C-N 3.35Å; L108-K110 PolarHBondContact O-N 3.13Å; L108-I111 HydrophobicContact CD2-CD1 4.38Å; L108-I111 WeakPolarHBondContact O-CB 3.36Å; L108-I111 PolarHBondContact O-N 3.04Å; L108-I111 VanDerWaalsContact O-N 3.16Å; L108-S112 PolarHBondContact O-N 3.17Å
109E63Low70.4Confident168 Ų168103.1 Ų103.179%0.78554%0.541SS*.Hα-helixtrans-62.3-35.9175-83.9178.5152.700113.8N107 I111N107-E109 PolarHBondContact O-N 3.03Å; E109-I111 VanDerWaalsContact C-N 3.3Å
110K62.7Low70.5Confident141 Ų141103.9 Ų103.961%0.61354%0.543SS*.Hα-helixtrans-76.3-21176.6-66.3-172.6178.7178.10112.4M106 N107 L108 L114M106-K110 HydrophobicContact CE-CB 3.84Å; M106-K110 HydrophobicContact CE-CD 4.03Å; N107-K110 PolarHBondContact O-N 3.41Å; L108-K110 VanDerWaalsContact C-N 3.35Å; L108-K110 PolarHBondContact O-N 3.13Å; K110-L114 WeakPolarHBondContact O-CB 3.35Å; K110-L114 PolarHBondContact O-N 3.39Å; K110-L114 VanDerWaalsContact O-N 3.09Å
111I62.7Low69.8Low42 Ų42106.2 Ų106.222%0.21555%0.552CS.*Hα-helixtrans-72.3-39.4175.5-63.9174.7000110.3L103 L108 E109 L114 M115L103-I111 HydrophobicContact CD2-CD1 3.41Å; L103-I111 VanDerWaalsContact CD2-CD1 3.41Å; L103-I111 HydrophobicContact CD2-CG1 3.93Å; L108-I111 HydrophobicContact CD2-CD1 4.38Å; L108-I111 WeakPolarHBondContact O-CB 3.36Å; L108-I111 PolarHBondContact O-N 3.04Å; L108-I111 VanDerWaalsContact O-N 3.16Å; E109-I111 VanDerWaalsContact C-N 3.3Å; I111-L114 PolarHBondContact O-N 3.46Å; I111-M115 HydrophobicContact CG2-CG 4.45Å; I111-M115 WeakPolarHBondContact O-CG 3.25Å; I111-M115 PolarHBondContact O-N 3.44Å
112S65.4Low69.3Low75 Ų75108.6 Ų108.652%0.52455%0.551SS.*Hα-helixtrans-58-50173.4-170.90000111.4L108 L114 M115 D116L108-S112 PolarHBondContact O-N 3.17Å; S112-L114 VanDerWaalsContact C-N 3.27Å; S112-L114 PolarHBondContact O-N 3.16Å; S112-M115 PolarHBondContact O-N 2.89Å; S112-D116 PolarHBondContact O-N 3.31Å; S112-D116 VanDerWaalsContact O-N 3.15Å
113G74.1Confident69.5Low40 Ų40111.3 Ų111.341%0.41256%0.559SS.*Hα-helixtrans-69.7-20.8178.300000114.4K117G113-K117 PolarHBondContact O-N 2.87Å
114L69.4Low70Confident95 Ų95111.2 Ų111.250%0.49756%0.561SS.*Hα-helixtrans-82.4-33.9174.1-170.167.9000111.8K110 I111 S112 K117 F118K110-L114 WeakPolarHBondContact O-CB 3.35Å; K110-L114 PolarHBondContact O-N 3.39Å; K110-L114 VanDerWaalsContact O-N 3.09Å; I111-L114 PolarHBondContact O-N 3.46Å; S112-L114 VanDerWaalsContact C-N 3.27Å; S112-L114 PolarHBondContact O-N 3.16Å; L114-K117 PolarHBondContact O-N 2.85Å; L114-F118 WeakPolarHBondContact O-CB 3.29Å; L114-F118 PolarHBondContact O-N 3.45Å
115M70.1Confident70.2Confident116 Ų116107.9 Ų107.957%0.57155%0.551SS**Hα-helixtrans-66.9-42.6173.9-78-65.2159.300111.5I111 S112 K117 F118 E119I111-M115 HydrophobicContact CG2-CG 4.45Å; I111-M115 WeakPolarHBondContact O-CG 3.25Å; I111-M115 PolarHBondContact O-N 3.44Å; S112-M115 PolarHBondContact O-N 2.89Å; M115-K117 VanDerWaalsContact C-N 3.28Å; M115-K117 PolarHBondContact O-N 3.41Å; M115-F118 PolarHBondContact O-N 2.87Å; M115-F118 VanDerWaalsContact O-N 3.11Å; M115-E119 PolarHBondContact O-N 3.36Å
116D76.6Confident70.5Confident101 Ų101108 Ų10854%0.5454%0.544SS..Hα-helixtrans-60.2-39.8172.7-69.6-8.5000111.5S112 H120S112-D116 PolarHBondContact O-N 3.31Å; S112-D116 VanDerWaalsContact O-N 3.15Å; D116-H120 WeakPolarHBondContact O-CB 3.35Å; D116-H120 PolarHBondContact O-N 3.03Å; D116-H120 VanDerWaalsContact O-N 3.1Å
117K75.3Confident71.8Confident139 Ų139109.2 Ų109.260%0.60455%0.554SS**Hα-helixtrans-69.8-33.7175.3-107176.6179173.60113.2G113 L114 M115 Q121G113-K117 PolarHBondContact O-N 2.87Å; L114-K117 PolarHBondContact O-N 2.85Å; M115-K117 VanDerWaalsContact C-N 3.28Å; M115-K117 PolarHBondContact O-N 3.41Å; K117-Q121 WeakPolarHBondContact O-CB 3.48Å; K117-Q121 VanDerWaalsContact O-CG 3.3Å; K117-Q121 WeakPolarHBondContact O-CG 3.39Å; K117-Q121 PolarHBondContact O-N 2.98Å
118F73.9Confident72.4Confident114 Ų114109.3 Ų109.350%0.555%0.551SS.*Hα-helixtrans-70.1-45.7177.5-178.1-92.6000110.3L114 M115 H120 Q121 F122L114-F118 WeakPolarHBondContact O-CB 3.29Å; L114-F118 PolarHBondContact O-N 3.45Å; M115-F118 PolarHBondContact O-N 2.87Å; M115-F118 VanDerWaalsContact O-N 3.11Å; F118-H120 VanDerWaalsContact C-N 3.33Å; F118-H120 PolarHBondContact O-N 3.36Å; F118-Q121 PolarHBondContact O-N 3.28Å; F118-F122 AromaticContact CE1-CD2 3.82Å; F118-F122 HydrophobicContact CE1-CD2 3.82Å; F118-F122 HydrophobicContact CE1-CE2 4.38Å; F118-F122 HydrophobicContact CE1-CG 4.42Å; F118-F122 HydrophobicContact CE2-CD2 4.23Å; F118-F122 AromaticContact CZ-CD2 3.58Å; F118-F122 HydrophobicContact CZ-CD2 3.58Å; F118-F122 AromaticContact CZ-CE2 3.88Å; F118-F122 HydrophobicContact CZ-CE2 3.88Å; F118-F122 WeakPolarHBondContact O-CB 3.47Å; F118-F122 PolarHBondContact O-N 3.26Å
119E77.6Confident73Confident141 Ų141105.6 Ų105.666%0.65953%0.534SS*.Hα-helixtrans-56.7-48.2174-120175.7-17700110.9M115 Q121 F122 E123M115-E119 PolarHBondContact O-N 3.36Å; E119-Q121 PolarHBondContact O-N 2.9Å; E119-F122 PolarHBondContact O-N 3.27Å; E119-E123 WeakPolarHBondContact O-CB 3.28Å; E119-E123 PolarHBondContact O-N 2.58Å
120H80.6Confident73.6Confident123 Ų123100.2 Ų100.257%0.56952%0.518SS*.Hα-helixtrans-66.3-36.6180-161.747.2000113.1D116 F118 T124D116-H120 WeakPolarHBondContact O-CB 3.35Å; D116-H120 PolarHBondContact O-N 3.03Å; D116-H120 VanDerWaalsContact O-N 3.1Å; F118-H120 VanDerWaalsContact C-N 3.33Å; F118-H120 PolarHBondContact O-N 3.36Å; H120-T124 WeakPolarHBondContact O-CB 3.43Å; H120-T124 PolarHBondContact O-N 3.28Å; H120-T124 PolarHBondContact O-OG1 3.01Å
121Q67.9Low74.3Confident133 Ų13399.6 Ų99.662%0.62152%0.518SS*.Hα-helixtrans-70.7-36.9174.4-78.7179.80.700112.3K117 F118 E119 T124 L125K117-Q121 WeakPolarHBondContact O-CB 3.48Å; K117-Q121 VanDerWaalsContact O-CG 3.3Å; K117-Q121 WeakPolarHBondContact O-CG 3.39Å; K117-Q121 PolarHBondContact O-N 2.98Å; F118-Q121 PolarHBondContact O-N 3.28Å; E119-Q121 PolarHBondContact O-N 2.9Å; Q121-T124 PolarHBondContact O-N 3.03Å; Q121-L125 WeakPolarHBondContact O-CB 3.46Å; Q121-L125 PolarHBondContact O-N 3.48Å
122F71.7Confident74.9Confident111 Ų111102.9 Ų102.949%0.48753%0.533SS..Hα-helixtrans-70.6-41.7179-141-88.6000111.3F118 E119 T124 L125 D126F118-F122 AromaticContact CE1-CD2 3.82Å; F118-F122 HydrophobicContact CE1-CD2 3.82Å; F118-F122 HydrophobicContact CE1-CE2 4.38Å; F118-F122 HydrophobicContact CE1-CG 4.42Å; F118-F122 HydrophobicContact CE2-CD2 4.23Å; F118-F122 AromaticContact CZ-CD2 3.58Å; F118-F122 HydrophobicContact CZ-CD2 3.58Å; F118-F122 AromaticContact CZ-CE2 3.88Å; F118-F122 HydrophobicContact CZ-CE2 3.88Å; F118-F122 WeakPolarHBondContact O-CB 3.47Å; F118-F122 PolarHBondContact O-N 3.26Å; E119-F122 PolarHBondContact O-N 3.27Å; F122-T124 VanDerWaalsContact C-N 3.32Å; F122-T124 PolarHBondContact O-N 3.41Å; F122-L125 PolarHBondContact O-N 3.11Å; F122-L125 VanDerWaalsContact O-N 3.13Å; F122-D126 PolarHBondContact O-N 3.24Å
123E79.6Confident75.4Confident128 Ų128105.7 Ų105.760%0.59854%0.538SS*.Hα-helixtrans-61.5-41.7173-168.5177.4-150.900111.1E119 L125 D126 V127E119-E123 WeakPolarHBondContact O-CB 3.28Å; E119-E123 PolarHBondContact O-N 2.58Å; E123-L125 VanDerWaalsContact C-N 3.31Å; E123-L125 PolarHBondContact O-N 2.92Å; E123-D126 PolarHBondContact O-N 3.37Å; E123-V127 VanDerWaalsContact O-CG2 3.26Å; E123-V127 WeakPolarHBondContact O-CG2 3.37Å; E123-V127 PolarHBondContact O-N 2.9Å
124T78.9Confident75.6Confident73 Ų73109.1 Ų109.145%0.44855%0.547SS..Hα-helixtrans-63.8-37.4173.6-56.30000111.9H120 Q121 F122 Q128H120-T124 WeakPolarHBondContact O-CB 3.43Å; H120-T124 PolarHBondContact O-N 3.28Å; H120-T124 PolarHBondContact O-OG1 3.01Å; Q121-T124 PolarHBondContact O-N 3.03Å; F122-T124 VanDerWaalsContact C-N 3.32Å; F122-T124 PolarHBondContact O-N 3.41Å; T124-Q128 WeakPolarHBondContact O-CB 3.35Å; T124-Q128 PolarHBondContact O-N 3.43Å
125L78.1Confident75.7Confident96 Ų96108.3 Ų108.350%0.50355%0.546SS..Hα-helixtrans-72.3-38.6-179.6-148.4159.1000111.2Q121 F122 E123 Q128 T129Q121-L125 WeakPolarHBondContact O-CB 3.46Å; Q121-L125 PolarHBondContact O-N 3.48Å; F122-L125 PolarHBondContact O-N 3.11Å; F122-L125 VanDerWaalsContact O-N 3.13Å; E123-L125 VanDerWaalsContact C-N 3.31Å; E123-L125 PolarHBondContact O-N 2.92Å; L125-Q128 PolarHBondContact O-N 3.45Å; L125-T129 VanDerWaalsContact O-CB 3.26Å; L125-T129 WeakPolarHBondContact O-CB 3.5Å; L125-T129 PolarHBondContact O-N 3.45Å; L125-T129 PolarHBondContact O-OG1 3.12Å
126D75.1Confident75.7Confident102 Ų102108 Ų10855%0.54554%0.544SS..Hα-helixtrans-64.9-44.2172.7-96.3-8.3000111.3F122 E123 Q128 T129 A130F122-D126 PolarHBondContact O-N 3.24Å; E123-D126 PolarHBondContact O-N 3.37Å; D126-Q128 PolarHBondContact O-N 2.9Å; D126-T129 PolarHBondContact O-N 2.61Å; D126-A130 VanDerWaalsContact O-CB 3.3Å; D126-A130 WeakPolarHBondContact O-CB 3.09Å; D126-A130 PolarHBondContact O-N 3.42Å
127V83.4Confident75.3Confident87 Ų87106.1 Ų106.153%0.52754%0.54SS..Hα-helixtrans-63.4-42.7175.2173.20000111E123 A130 Q131E123-V127 VanDerWaalsContact O-CG2 3.26Å; E123-V127 WeakPolarHBondContact O-CG2 3.37Å; E123-V127 PolarHBondContact O-N 2.9Å; V127-A130 PolarHBondContact O-N 3.28Å; V127-Q131 VanDerWaalsContact O-CB 3.27Å; V127-Q131 WeakPolarHBondContact O-CB 3.39Å; V127-Q131 PolarHBondContact O-N 2.89Å
128Q72.6Confident75Confident129 Ų129103.5 Ų103.560%0.60354%0.539SS*.Hα-helixtrans-67.7-36.7178.4-170.9175.61000112T124 L125 D126 M132T124-Q128 WeakPolarHBondContact O-CB 3.35Å; T124-Q128 PolarHBondContact O-N 3.43Å; L125-Q128 PolarHBondContact O-N 3.45Å; D126-Q128 PolarHBondContact O-N 2.9Å; Q128-M132 WeakPolarHBondContact O-CB 3.47Å; Q128-M132 PolarHBondContact O-N 3.24Å
129T74.1Confident74.4Confident64 Ų64102.9 Ų102.939%0.39354%0.544SS..Hα-helixtrans-70.3-44.3176.6-56.20000110.5L125 D126 Q131 M132 E133L125-T129 VanDerWaalsContact O-CB 3.26Å; L125-T129 WeakPolarHBondContact O-CB 3.5Å; L125-T129 PolarHBondContact O-N 3.45Å; L125-T129 PolarHBondContact O-OG1 3.12Å; D126-T129 PolarHBondContact O-N 2.61Å; T129-Q131 VanDerWaalsContact C-N 3.32Å; T129-Q131 PolarHBondContact O-N 2.95Å; T129-M132 PolarHBondContact O-N 2.97Å; T129-E133 VanDerWaalsContact O-CB 3.29Å; T129-E133 WeakPolarHBondContact O-CB 3.4Å; T129-E133 PolarHBondContact O-N 3.12Å
130A74.9Confident73.5Confident55 Ų5599.5 Ų99.546%0.45553%0.534SS..Hα-helixtrans-59.4-43.5173.700000111.4D126 V127 E133 D134D126-A130 VanDerWaalsContact O-CB 3.3Å; D126-A130 WeakPolarHBondContact O-CB 3.09Å; D126-A130 PolarHBondContact O-N 3.42Å; V127-A130 PolarHBondContact O-N 3.28Å; A130-E133 PolarHBondContact O-N 2.85Å; A130-D134 WeakPolarHBondContact O-CB 3.45Å; A130-D134 PolarHBondContact O-N 3.12Å
131Q77.4Confident72.5Confident128 Ų12897.3 Ų97.360%0.59853%0.529SS*.Hα-helixtrans-72.3-31.6179-166.2157.2-0.200112.9V127 T129 T135V127-Q131 VanDerWaalsContact O-CB 3.27Å; V127-Q131 WeakPolarHBondContact O-CB 3.39Å; V127-Q131 PolarHBondContact O-N 2.89Å; T129-Q131 VanDerWaalsContact C-N 3.32Å; T129-Q131 PolarHBondContact O-N 2.95Å; Q131-T135 WeakPolarHBondContact O-CB 3.43Å; Q131-T135 WeakPolarHBondContact O-CG2 3.47Å; Q131-T135 PolarHBondContact O-N 3.14Å; Q131-T135 PolarHBondContact O-OG1 2.93Å
132M75.2Confident72.1Confident110 Ų11098.3 Ų98.354%0.54254%0.538SS..Hα-helixtrans-70.6-40.9171.5-174.2171.6154.400111.3Q128 T129 T135 M136Q128-M132 WeakPolarHBondContact O-CB 3.47Å; Q128-M132 PolarHBondContact O-N 3.24Å; T129-M132 PolarHBondContact O-N 2.97Å; M132-T135 WeakPolarHBondContact CA-OG1 3.11Å; M132-T135 PolarHBondContact O-N 3.21Å; M132-T135 PolarHBondContact O-OG1 3.32Å; M132-T135 VanDerWaalsContact O-OG1 3.08Å; M132-M136 HydrophobicContact CE-SD 3.45Å; M132-M136 WeakPolarHBondContact CE-SD 3.37Å; M132-M136 HydrophobicContact CG-CG 4.28Å; M132-M136 HydrophobicContact CG-SD 3.87Å; M132-M136 WeakPolarHBondContact O-CB 3.46Å; M132-M136 WeakPolarHBondContact O-CG 3.33Å; M132-M136 PolarHBondContact O-N 2.93Å
133E76.6Confident71.6Confident135 Ų13597.9 Ų97.963%0.63154%0.544SS*.Hα-helixtrans-63.2-43.6174.2-170.8115.7-157.500110.6T129 A130 M136 S137T129-E133 VanDerWaalsContact O-CB 3.29Å; T129-E133 WeakPolarHBondContact O-CB 3.4Å; T129-E133 PolarHBondContact O-N 3.12Å; A130-E133 PolarHBondContact O-N 2.85Å; E133-M136 PolarHBondContact O-N 3.44Å; E133-S137 WeakPolarHBondContact O-CA 3.47Å; E133-S137 WeakPolarHBondContact O-CB 3.5Å; E133-S137 PolarHBondContact O-N 3.23Å
134D78.1Confident70.7Confident111 Ų11195.2 Ų95.259%0.59454%0.537SS*.Hα-helixtrans-64.8-41.4176-83.9-14.3000112.8A130 S138A130-D134 WeakPolarHBondContact O-CB 3.45Å; A130-D134 PolarHBondContact O-N 3.12Å; D134-S138 VanDerWaalsContact O-CB 3.31Å; D134-S138 WeakPolarHBondContact O-CB 3.5Å; D134-S138 PolarHBondContact O-N 3.41Å; D134-S138 PolarHBondContact O-OG 3.24Å
135T71.7Confident70.4Confident79 Ų7993.9 Ų93.949%0.48553%0.53SS..Hα-helixtrans-73.2-37.6177.9460000112.6Q131 M132 T139Q131-T135 WeakPolarHBondContact O-CB 3.43Å; Q131-T135 WeakPolarHBondContact O-CG2 3.47Å; Q131-T135 PolarHBondContact O-N 3.14Å; Q131-T135 PolarHBondContact O-OG1 2.93Å; M132-T135 WeakPolarHBondContact CA-OG1 3.11Å; M132-T135 PolarHBondContact O-N 3.21Å; M132-T135 PolarHBondContact O-OG1 3.32Å; M132-T135 VanDerWaalsContact O-OG1 3.08Å; T135-T139 PolarHBondContact O-N 3.28Å; T135-T139 VanDerWaalsContact O-N 3.11Å; T135-T139 PolarHBondContact O-OG1 2.96Å
136M69.5Low69.7Low108 Ų10895.8 Ų95.853%0.53254%0.536SS..Hα-helixtrans-66.6-48.9172.4-72.2-178.482.800110.2M132 E133 S138 T139 T140M132-M136 HydrophobicContact CE-SD 3.45Å; M132-M136 WeakPolarHBondContact CE-SD 3.37Å; M132-M136 HydrophobicContact CG-CG 4.28Å; M132-M136 HydrophobicContact CG-SD 3.87Å; M132-M136 WeakPolarHBondContact O-CB 3.46Å; M132-M136 WeakPolarHBondContact O-CG 3.33Å; M132-M136 PolarHBondContact O-N 2.93Å; E133-M136 PolarHBondContact O-N 3.44Å; M136-S138 VanDerWaalsContact C-N 3.32Å; M136-S138 PolarHBondContact O-N 2.93Å; M136-T139 CarbonylContact O-C 3.58Å; M136-T139 WeakPolarHBondContact O-CA 3.41Å; M136-T139 WeakPolarHBondContact O-CB 3.5Å; M136-T139 PolarHBondContact O-N 3.34Å; M136-T140 PolarHBondContact O-N 3.34Å; M136-T140 PolarHBondContact O-OG1 3.28Å
137S68.5Low69.6Low63 Ų6394.8 Ų94.844%0.44153%0.531SS..Hα-helixtrans-52.5-48.8175.1-176.90000111.2E133 T139 T140 T141E133-S137 WeakPolarHBondContact O-CA 3.47Å; E133-S137 WeakPolarHBondContact O-CB 3.5Å; E133-S137 PolarHBondContact O-N 3.23Å; S137-T139 VanDerWaalsContact C-N 3.28Å; S137-T139 PolarHBondContact O-N 2.89Å; S137-T140 WeakPolarHBondContact CA-OG1 3.45Å; S137-T140 PolarHBondContact O-N 3.14Å; S137-T140 PolarHBondContact O-OG1 2.92Å; S137-T141 PolarHBondContact O-N 3.41Å; S137-T141 PolarHBondContact O-OG1 2.88Å
138S69.1Low68.8Low84 Ų8496.9 Ų96.959%0.58754%0.535SS*.Hα-helixtrans-59.1-35.5175-61.30000113.3D134 M136D134-S138 VanDerWaalsContact O-CB 3.31Å; D134-S138 WeakPolarHBondContact O-CB 3.5Å; D134-S138 PolarHBondContact O-N 3.41Å; D134-S138 PolarHBondContact O-OG 3.24Å; M136-S138 VanDerWaalsContact C-N 3.32Å; M136-S138 PolarHBondContact O-N 2.93Å
139T62.3Low68.8Low100 Ų10093.8 Ų93.861%0.61352%0.524SS*.Hα-helixtrans-76.1-40.9177.2-55.40000111.9T135 M136 S137 T141 L142T135-T139 PolarHBondContact O-N 3.28Å; T135-T139 VanDerWaalsContact O-N 3.11Å; T135-T139 PolarHBondContact O-OG1 2.96Å; M136-T139 CarbonylContact O-C 3.58Å; M136-T139 WeakPolarHBondContact O-CA 3.41Å; M136-T139 WeakPolarHBondContact O-CB 3.5Å; M136-T139 PolarHBondContact O-N 3.34Å; S137-T139 VanDerWaalsContact C-N 3.28Å; S137-T139 PolarHBondContact O-N 2.89Å; T139-T141 VanDerWaalsContact C-N 3.34Å; T139-L142 PolarHBondContact O-N 3.36Å
140T59.1Low68.7Low71 Ų7194.7 Ų94.744%0.43653%0.527SS..Hα-helixtrans-70.6-25.7175.317.60000113.4M136 S137 L142 T143 T144M136-T140 PolarHBondContact O-N 3.34Å; M136-T140 PolarHBondContact O-OG1 3.28Å; S137-T140 WeakPolarHBondContact CA-OG1 3.45Å; S137-T140 PolarHBondContact O-N 3.14Å; S137-T140 PolarHBondContact O-OG1 2.92Å; T140-L142 PolarHBondContact O-N 2.98Å; T140-T143 PolarHBondContact O-N 3.49Å; T140-T143 VanDerWaalsContact O-N 3.14Å; T140-T143 PolarHBondContact O-OG1 3.29Å; T140-T144 WeakPolarHBondContact O-CA 3.25Å; T140-T144 PolarHBondContact O-N 3.5Å
141T58.3Low68.7Low77 Ų7795.8 Ų95.847%0.47253%0.531SS..Hα-helixtrans-59.9-29.1176.2-51.20000111.6S137 T139S137-T141 PolarHBondContact O-N 3.41Å; S137-T141 PolarHBondContact O-OG1 2.88Å; T139-T141 VanDerWaalsContact C-N 3.34Å
142L60.7Low68.5Low154 Ų15494.3 Ų94.381%0.80653%0.527SS*.Hα-helixtrans-80.4-30178.2-164.269.9000113.3T139 T140T139-L142 PolarHBondContact O-N 3.36Å; T140-L142 PolarHBondContact O-N 2.98Å
143T61.1Low68.3Low102 Ų10295.3 Ų95.363%0.62653%0.532SS*.Hα-helixtrans-100.7-16.1-177.356.60000113.5T140T140-T143 PolarHBondContact O-N 3.49Å; T140-T143 VanDerWaalsContact O-N 3.14Å; T140-T143 PolarHBondContact O-OG1 3.29Å
144T60.6Low68.2Low71 Ų7194.6 Ų94.644%0.43653%0.528SS..SBendtrans-139.680178.7-53.90000108.6T140 Q146 V149T140-T144 WeakPolarHBondContact O-CA 3.25Å; T140-T144 PolarHBondContact O-N 3.5Å; T144-Q146 PolarHBondContact O-N 3.39Å; T144-V149 HydrophobicContact CG2-CG2 3.49Å; T144-V149 VanDerWaalsContact CG2-CG2 3.49Å
145P71.3Confident68Low46 Ų4695.4 Ų95.430%0.29953%0.528SS..  trans-61.8134.2-179.8-20.432000111.2N147 Q148 V149P145-N147 PolarHBondContact O-N 3.12Å; P145-N147 VanDerWaalsContact O-N 3.13Å; P145-Q148 HydrophobicContact CB-CG 4.31Å; P145-Q148 HydrophobicContact CG-CG 4.35Å; P145-Q148 WeakPolarHBondContact O-CB 3.45Å; P145-Q148 PolarHBondContact O-N 2.93Å; P145-V149 PolarHBondContact O-N 3.44Å
146Q63.6Low68.2Low136 Ų13696 Ų9664%0.63653%0.528SS*.Hα-helixtrans-49.6-42.8-179.5-153.796.1-3.600112.2T144 Q148 V149 D150T144-Q146 PolarHBondContact O-N 3.39Å; Q146-Q148 VanDerWaalsContact C-N 3.28Å; Q146-Q148 PolarHBondContact O-N 3.44Å; Q146-V149 PolarHBondContact O-N 3.14Å; Q146-V149 VanDerWaalsContact O-N 3.08Å; Q146-D150 PolarHBondContact O-N 3.34Å
147N72.8Confident68Low81 Ų8193.7 Ų93.743%0.43353%0.526SS..Hα-helixtrans-60.8-31.1178.7-78.2-17000114.1P145 S151 Q185P145-N147 PolarHBondContact O-N 3.12Å; P145-N147 VanDerWaalsContact O-N 3.13Å; N147-S151 VanDerWaalsContact O-CB 3.27Å; N147-S151 WeakPolarHBondContact O-CB 3.5Å; N147-S151 PolarHBondContact O-N 3.48Å; N147-S151 PolarHBondContact O-OG 2.8Å; N147-Q185 PolarHBondContact ND2-OE1 2.67Å; N147-Q185 PolarHBondContact OD1-NE2 2.68Å; N147-Q185 PolarHBondContact OD1-OE1 3.22Å
148Q67.9Low68.3Low131 Ų13194.4 Ų94.461%0.61253%0.525SS*.Hα-helixtrans-75.3-35176.7-68.4-176.6-3.400111.4P145 Q146 L152P145-Q148 HydrophobicContact CB-CG 4.31Å; P145-Q148 HydrophobicContact CG-CG 4.35Å; P145-Q148 WeakPolarHBondContact O-CB 3.45Å; P145-Q148 PolarHBondContact O-N 2.93Å; Q146-Q148 VanDerWaalsContact C-N 3.28Å; Q146-Q148 PolarHBondContact O-N 3.44Å; Q148-L152 WeakPolarHBondContact O-CB 3.39Å; Q148-L152 PolarHBondContact O-N 3.3Å; Q148-L152 VanDerWaalsContact O-N 3.09Å
149V71.3Confident68.2Low64 Ų6496.5 Ų96.539%0.38853%0.526SS..Hα-helixtrans-70.3-44.1175.3-178.80000110.5T144 P145 Q146 L152 M153T144-V149 HydrophobicContact CG2-CG2 3.49Å; T144-V149 VanDerWaalsContact CG2-CG2 3.49Å; P145-V149 PolarHBondContact O-N 3.44Å; Q146-V149 PolarHBondContact O-N 3.14Å; Q146-V149 VanDerWaalsContact O-N 3.08Å; V149-L152 PolarHBondContact O-N 3.25Å; V149-M153 WeakPolarHBondContact O-CB 3.46Å; V149-M153 PolarHBondContact O-N 3.45Å
150D71.8Confident68.3Low83 Ų8394.9 Ų94.944%0.44452%0.522SS..Hα-helixtrans-66-39.5178.6-68.5-22.7000111.5Q146 M153 H154Q146-D150 PolarHBondContact O-N 3.34Å; D150-M153 PolarHBondContact O-N 3.44Å; D150-H154 WeakPolarHBondContact O-CB 3.47Å; D150-H154 PolarHBondContact O-N 3.24Å
151S76.4Confident68.1Low78 Ų7893.4 Ų93.455%0.54552%0.521SS..Hα-helixtrans-64.2-42174.2-63.50000112N147 H154 E155N147-S151 VanDerWaalsContact O-CB 3.27Å; N147-S151 WeakPolarHBondContact O-CB 3.5Å; N147-S151 PolarHBondContact O-N 3.48Å; N147-S151 PolarHBondContact O-OG 2.8Å; S151-H154 PolarHBondContact O-N 3.14Å; S151-E155 WeakPolarHBondContact O-CB 3.44Å; S151-E155 PolarHBondContact O-N 3.23Å
152L73Confident67.8Low96 Ų9695.1 Ų95.150%0.50353%0.527SS..Hα-helixtrans-67.2-39176.4-176.668.8000111.7Q148 V149 H154 E155 L156Q148-L152 WeakPolarHBondContact O-CB 3.39Å; Q148-L152 PolarHBondContact O-N 3.3Å; Q148-L152 VanDerWaalsContact O-N 3.09Å; V149-L152 PolarHBondContact O-N 3.25Å; L152-H154 VanDerWaalsContact C-N 3.35Å; L152-E155 PolarHBondContact O-N 2.94Å; L152-L156 HydrophobicContact CD1-CD1 4.4Å; L152-L156 HydrophobicContact CG-CD1 4.11Å; L152-L156 WeakPolarHBondContact O-CB 3.48Å; L152-L156 VanDerWaalsContact O-CG 3.25Å; L152-L156 WeakPolarHBondContact O-CG 3.46Å; L152-L156 PolarHBondContact O-N 3.42Å
153M70.9Confident67.2Low132 Ų13293.8 Ų93.865%0.6552%0.521SS*.Hα-helixtrans-63.8-40.3173.9-93.3-93.8-8900111.6V149 D150 A157V149-M153 WeakPolarHBondContact O-CB 3.46Å; V149-M153 PolarHBondContact O-N 3.45Å; D150-M153 PolarHBondContact O-N 3.44Å; M153-A157 WeakPolarHBondContact O-CB 3.12Å; M153-A157 PolarHBondContact O-N 3.1Å
154H73.8Confident66.4Low119 Ų11996 Ų9655%0.55153%0.528SS*.Hα-helixtrans-68.3-42.7176-158.2-53.1000111.7D150 S151 L152 L156 A157 D158D150-H154 WeakPolarHBondContact O-CB 3.47Å; D150-H154 PolarHBondContact O-N 3.24Å; S151-H154 PolarHBondContact O-N 3.14Å; L152-H154 VanDerWaalsContact C-N 3.35Å; H154-L156 PolarHBondContact O-N 3.1Å; H154-A157 PolarHBondContact O-N 2.86Å; H154-D158 IonicContact CE1-OD1 2.58Å; H154-D158 PolarHBondContact CE1-OD1 3.4Å; H154-D158 IonicContact CE1-OD2 2.92Å; H154-D158 PolarHBondContact CE1-OD2 3.43Å; H154-D158 VanDerWaalsContact ND1-CG 3.33Å; H154-D158 IonicContact ND1-OD1 2.7Å; H154-D158 PolarHBondContact ND1-OD1 3.5Å; H154-D158 IonicContact ND1-OD2 2.68Å; H154-D158 PolarHBondContact ND1-OD2 2.9Å; H154-D158 WeakPolarHBondContact O-CB 3.34Å; H154-D158 PolarHBondContact O-N 2.95Å
155E74.8Confident65.7Low128 Ų12898 Ų9860%0.59854%0.536SS*.Hα-helixtrans-61.4-43.6176-173.2177.2-174.300111.5S151 L152 D158 E159S151-E155 WeakPolarHBondContact O-CB 3.44Å; S151-E155 PolarHBondContact O-N 3.23Å; L152-E155 PolarHBondContact O-N 2.94Å; E155-D158 PolarHBondContact O-N 3.01Å; E155-E159 WeakPolarHBondContact O-CB 3.3Å; E155-E159 PolarHBondContact O-N 2.95Å
156L74.8Confident64.6Low92 Ų92103.8 Ų103.848%0.48256%0.561SS.*Hα-helixtrans-72.1-33176.9-69.7173.3000112.9L152 H154 A160L152-L156 HydrophobicContact CD1-CD1 4.4Å; L152-L156 HydrophobicContact CG-CD1 4.11Å; L152-L156 WeakPolarHBondContact O-CB 3.48Å; L152-L156 VanDerWaalsContact O-CG 3.25Å; L152-L156 WeakPolarHBondContact O-CG 3.46Å; L152-L156 PolarHBondContact O-N 3.42Å; H154-L156 PolarHBondContact O-N 3.1Å; L156-A160 VanDerWaalsContact O-CB 3.26Å; L156-A160 WeakPolarHBondContact O-CB 3.43Å; L156-A160 PolarHBondContact O-N 3.46Å
157A66.9Low63.9Low60 Ų60106.2 Ų106.250%0.49657%0.572SS.*Hα-helixtrans-70.5-38.3174.500000111.4M153 H154 A160 G161M153-A157 WeakPolarHBondContact O-CB 3.12Å; M153-A157 PolarHBondContact O-N 3.1Å; H154-A157 PolarHBondContact O-N 2.86Å; A157-A160 PolarHBondContact O-N 3.24Å; A157-G161 WeakPolarHBondContact O-CA 3.41Å; A157-G161 PolarHBondContact O-N 3.21Å
158D74.1Confident62.6Low77 Ų77108.4 Ų108.441%0.41258%0.584SS.*Hα-helixtrans-67.1-42.7171.8-71.6-25.3000110.4H154 E155 A160 G161 L162H154-D158 IonicContact CE1-OD1 2.58Å; H154-D158 PolarHBondContact CE1-OD1 3.4Å; H154-D158 IonicContact CE1-OD2 2.92Å; H154-D158 PolarHBondContact CE1-OD2 3.43Å; H154-D158 VanDerWaalsContact ND1-CG 3.33Å; H154-D158 IonicContact ND1-OD1 2.7Å; H154-D158 PolarHBondContact ND1-OD1 3.5Å; H154-D158 IonicContact ND1-OD2 2.68Å; H154-D158 PolarHBondContact ND1-OD2 2.9Å; H154-D158 WeakPolarHBondContact O-CB 3.34Å; H154-D158 PolarHBondContact O-N 2.95Å; E155-D158 PolarHBondContact O-N 3.01Å; D158-A160 VanDerWaalsContact C-N 3.33Å; D158-A160 PolarHBondContact O-N 3.48Å; D158-G161 CarbonylContact O-C 3.43Å; D158-G161 PolarHBondContact O-N 2.97Å; D158-L162 HydrophobicContact CB-CD1 4.32Å; D158-L162 WeakPolarHBondContact O-CA 3.44Å; D158-L162 WeakPolarHBondContact O-CB 3.48Å; D158-L162 WeakPolarHBondContact O-CD1 3.45Å; D158-L162 WeakPolarHBondContact O-CG 3.34Å; D158-L162 PolarHBondContact O-N 3.04Å
159E67.7Low61.5Low129 Ų129108 Ų10860%0.60359%0.592SS**Hα-helixtrans-62.2-41.1176-164.3174-16500111.3E155 D163E155-E159 WeakPolarHBondContact O-CB 3.3Å; E155-E159 PolarHBondContact O-N 2.95Å; E159-D163 PolarHBondContact O-N 3.4Å
160A63.9Low60.4Low65 Ų65114.8 Ų114.854%0.53762%0.62SS.*Hα-helixtrans-72.2-30.8174.700000113.6L156 A157 D158L156-A160 VanDerWaalsContact O-CB 3.26Å; L156-A160 WeakPolarHBondContact O-CB 3.43Å; L156-A160 PolarHBondContact O-N 3.46Å; A157-A160 PolarHBondContact O-N 3.24Å; D158-A160 VanDerWaalsContact C-N 3.33Å; D158-A160 PolarHBondContact O-N 3.48Å
161G55.5Low58.8Low41 Ų41114.1 Ų114.142%0.42363%0.632SS.*Hα-helixtrans-81.9-27176.800000113.8A157 D158A157-G161 WeakPolarHBondContact O-CA 3.41Å; A157-G161 PolarHBondContact O-N 3.21Å; D158-G161 CarbonylContact O-C 3.43Å; D158-G161 PolarHBondContact O-N 2.97Å
162L51.3Low57.4Low112 Ų112119.6 Ų119.659%0.58665%0.649SS**Hα-helixtrans-77.9-28.6174.4-76.4163.1000111.7D158 L164 N165 M166D158-L162 HydrophobicContact CB-CD1 4.32Å; D158-L162 WeakPolarHBondContact O-CA 3.44Å; D158-L162 WeakPolarHBondContact O-CB 3.48Å; D158-L162 WeakPolarHBondContact O-CD1 3.45Å; D158-L162 WeakPolarHBondContact O-CG 3.34Å; D158-L162 PolarHBondContact O-N 3.04Å; L162-L164 PolarHBondContact O-N 3.11Å; L162-N165 PolarHBondContact O-N 3.45Å; L162-N165 VanDerWaalsContact O-N 3.08Å; L162-M166 PolarHBondContact O-N 3.12Å; L162-M166 VanDerWaalsContact O-N 3.16Å
163D48.7Very low55.8Low127 Ų127121.8 Ų121.868%0.67967%0.667SS**THydrogen-bonded Turntrans-66.8-25.6174.4-137.710.4000111.9E159E159-D163 PolarHBondContact O-N 3.4Å
164L43.7Very low54.2Low147 Ų147118.7 Ų118.777%0.7767%0.668SS**THydrogen-bonded Turntrans-80-20.1171.4-88.3148.7000113.7L162L162-L164 PolarHBondContact O-N 3.11Å
165N46.3Very low53Low115 Ų115119.2 Ų119.262%0.61569%0.685SS**THydrogen-bonded Turntrans-98.4-4.4-177.9-133.418.8000112.9L162 E167L162-N165 PolarHBondContact O-N 3.45Å; L162-N165 VanDerWaalsContact O-N 3.08Å; N165-E167 VanDerWaalsContact C-N 3.29Å; N165-E167 PolarHBondContact O-N 2.93Å
166M48.5Very low51.7Low167 Ų167119.9 Ų119.982%0.82370%0.698SS**THydrogen-bonded Turntrans-830.7-179.5-133.8-172.115300114.1L162L162-M166 PolarHBondContact O-N 3.12Å; L162-M166 VanDerWaalsContact O-N 3.16Å
167E48.7Very low50.5Low186 Ų186118.3 Ų118.387%0.86970%0.704SS**THydrogen-bonded Turntrans-108.67.3179.8-124.5174.4145.300114.7N165N165-E167 VanDerWaalsContact C-N 3.29Å; N165-E167 PolarHBondContact O-N 2.93Å
168L45.3Very low49.3Very low128 Ų128121.8 Ų121.867%0.6772%0.719SS**SBendtrans-119.5135.8176.3-82.1153.1000111.6
169P45.4Very low48.3Very low121 Ų121122.8 Ų122.879%0.78673%0.732SS**  trans-68.8138.2-17128.2-32.9000111.7G171P169-G171 PolarHBondContact O-N 3.32Å; P169-G171 VanDerWaalsContact O-N 3.1Å
170Q47.6Very low47.5Very low208 Ų208121 Ų12197%0.97273%0.73SS**  trans-46.1110-177.3-80.8179.9-19.800113.5
171G38Very low46.8Very low68 Ų68121.2 Ų121.270%0.70173%0.732SS**  trans-115.8129.3158.500000109.3P169 T173P169-G171 PolarHBondContact O-N 3.32Å; P169-G171 VanDerWaalsContact O-N 3.1Å; G171-T173 PolarHBondContact O-N 2.86Å
172Q47.6Very low46.8Very low194 Ų194123 Ų12391%0.90774%0.737SS**  trans-40.6130178.3-71.2172.5-0.700114.2
173T38.1Very low47Very low142 Ų142120.3 Ų120.387%0.87173%0.731SS**  trans-17212313545.80000105.5G171G171-T173 PolarHBondContact O-N 2.86Å
174G38.4Very low47.4Very low66 Ų66120.5 Ų120.568%0.6873%0.728SS**  102.79068.300000108.2V176G174-V176 PolarHBondContact O-N 3.21Å
175S47.8Very low48Very low130 Ų130118.1 Ų118.191%0.90971%0.713SS**  trans-56.2101.3174.2138.20000110.3
176V48Very low49.1Very low143 Ų143118.2 Ų118.287%0.86771%0.714SS**  trans-146.6121.8170.6-175.40000108.9G174G174-V176 PolarHBondContact O-N 3.21Å
177G49.1Very low50.5Low59 Ų59115.1 Ų115.161%0.60870%0.697SS**  trans124.857154.500000118
178T42.6Very low51.6Low133 Ų133111.5 Ų111.582%0.81668%0.683SS**SBendtrans-127.9-3162-470000112.8
179S51.3Low53.1Low98 Ų98108.5 Ų108.569%0.68567%0.673SS**SBendtrans-94.6-6-173.454.40000115.6
180V51.9Low54.6Low91 Ų91105.5 Ų105.555%0.55266%0.655SS**Hα-helixtrans-91.1-41.3-170.4-160.80000112.4S182 A183 E184V180-S182 PolarHBondContact O-N 2.87Å; V180-A183 PolarHBondContact O-N 3.29Å; V180-E184 PolarHBondContact O-N 2.97Å
181A50.1Low56Low70 Ų70103.1 Ų103.158%0.57964%0.637SS**Hα-helixtrans-69.9-36.2-174.800000113.8
182S54Low58Low77 Ų77105.1 Ų105.154%0.53863%0.631SS.*Hα-helixtrans-71.7-32.3177.4-52.40000112.5V180 D186V180-S182 PolarHBondContact O-N 2.87Å; S182-D186 PolarHBondContact O-N 3.01Å
183A56.6Low59.6Low56 Ų5698.9 Ų98.946%0.46361%0.612SS.*Hα-helixtrans-69.6-36.2179.600000112.1V180 E187V180-A183 PolarHBondContact O-N 3.29Å; A183-E187 WeakPolarHBondContact O-CB 3.39Å; A183-E187 PolarHBondContact O-N 3.15Å
184E56Low61.7Low131 Ų13199 Ų9961%0.61260%0.601SS**Hα-helixtrans-71.4-35.6-179.9-69.1-176.9146.500112.7V180 L188V180-E184 PolarHBondContact O-N 2.97Å; E184-L188 WeakPolarHBondContact O-CB 3.45Å; E184-L188 PolarHBondContact O-N 2.99Å
185Q56.5Low63.5Low98 Ų98101.4 Ų101.446%0.45860%0.598SS.*Hα-helixtrans-68.7-40.8176-74.8-169.6-1600112.5N147 S189N147-Q185 PolarHBondContact ND2-OE1 2.67Å; N147-Q185 PolarHBondContact OD1-NE2 2.68Å; N147-Q185 PolarHBondContact OD1-OE1 3.22Å; Q185-S189 PolarHBondContact O-N 3.49Å; Q185-S189 VanDerWaalsContact O-N 3.13Å; Q185-S189 PolarHBondContact O-OG 3.31Å
186D70.1Confident64.7Low116 Ų116105.8 Ų105.862%0.6259%0.594SS**Hα-helixtrans-68.8-35.8176.8-78.6-17.8000111.7S182 S189 S190S182-D186 PolarHBondContact O-N 3.01Å; D186-S189 WeakPolarHBondContact CA-OG 3.42Å; D186-S189 PolarHBondContact O-OG 3.09Å; D186-S189 VanDerWaalsContact O-OG 3.04Å; D186-S190 WeakPolarHBondContact O-CB 3.22Å; D186-S190 PolarHBondContact O-N 2.71Å
187E77.5Confident65.9Low102 Ų102106.1 Ų106.148%0.47759%0.591SS.*Hα-helixtrans-70-40.1176.8-165.7177.3171.900112.1A183 S190 R191A183-E187 WeakPolarHBondContact O-CB 3.39Å; A183-E187 PolarHBondContact O-N 3.15Å; E187-S190 PolarHBondContact O-N 3.42Å; E187-R191 WeakPolarHBondContact O-CG 3.46Å; E187-R191 PolarHBondContact O-N 3.21Å; E187-R191 IonicContact OE1-CZ 3.35Å; E187-R191 IonicContact OE1-NE 3.4Å; E187-R191 PolarHBondContact OE1-NE 3.47Å; E187-R191 IonicContact OE1-NH2 2.69Å; E187-R191 PolarHBondContact OE1-NH2 3.26Å
188L72.1Confident66.8Low111 Ų111111.2 Ų111.258%0.58160%0.599SS**Hα-helixtrans-65.8-42.3178.2-158.181.9000111.8E184 R191 L192E184-L188 WeakPolarHBondContact O-CB 3.45Å; E184-L188 PolarHBondContact O-N 2.99Å; L188-R191 PolarHBondContact O-N 3.2Å; L188-L192 HydrophobicContact CG-CD1 4.37Å; L188-L192 WeakPolarHBondContact O-CB 3.46Å; L188-L192 WeakPolarHBondContact O-CG 3.48Å; L188-L192 PolarHBondContact O-N 3.26Å
189S76Confident66.9Low65 Ų65115.8 Ų115.846%0.45561%0.614SS.*Hα-helixtrans-67.5-36.5177.2480000112.1Q185 D186 A193Q185-S189 PolarHBondContact O-N 3.49Å; Q185-S189 VanDerWaalsContact O-N 3.13Å; Q185-S189 PolarHBondContact O-OG 3.31Å; D186-S189 WeakPolarHBondContact CA-OG 3.42Å; D186-S189 PolarHBondContact O-OG 3.09Å; D186-S189 VanDerWaalsContact O-OG 3.04Å; S189-A193 WeakPolarHBondContact O-CB 3.49Å; S189-A193 PolarHBondContact O-N 3.15Å
190S78.1Confident67.7Low57 Ų57116.7 Ų116.740%0.39961%0.61SS.*Hα-helixtrans-65.1-40.8171.6-168.80000113D186 E187 A193 K194D186-S190 WeakPolarHBondContact O-CB 3.22Å; D186-S190 PolarHBondContact O-N 2.71Å; E187-S190 PolarHBondContact O-N 3.42Å; S190-A193 PolarHBondContact O-N 2.97Å; S190-K194 WeakPolarHBondContact O-CG 3.36Å; S190-K194 PolarHBondContact O-N 3.3Å; S190-K194 VanDerWaalsContact O-N 3.12Å
191R76.9Confident68.5Low159 Ų159118 Ų11860%0.661%0.613SS**Hα-helixtrans-67.2-41.3176.5-75.6-179.1-175.8-1763.8112.1E187 L188 A193 K194 L195E187-R191 WeakPolarHBondContact O-CG 3.46Å; E187-R191 PolarHBondContact O-N 3.21Å; E187-R191 IonicContact OE1-CZ 3.35Å; E187-R191 IonicContact OE1-NE 3.4Å; E187-R191 PolarHBondContact OE1-NE 3.47Å; E187-R191 IonicContact OE1-NH2 2.69Å; E187-R191 PolarHBondContact OE1-NH2 3.26Å; L188-R191 PolarHBondContact O-N 3.2Å; R191-A193 VanDerWaalsContact C-N 3.34Å; R191-K194 PolarHBondContact O-N 3.12Å; R191-L195 PolarHBondContact O-N 3.12Å
192L79.1Confident69.5Low109 Ų109120.7 Ų120.757%0.57162%0.615SS**Hα-helixtrans-64.9-37.7175.7-80161.8000112.1L188 L195 R196L188-L192 HydrophobicContact CG-CD1 4.37Å; L188-L192 WeakPolarHBondContact O-CB 3.46Å; L188-L192 WeakPolarHBondContact O-CG 3.48Å; L188-L192 PolarHBondContact O-N 3.26Å; L192-L195 PolarHBondContact O-N 3.43Å; L192-R196 PolarHBondContact O-N 3.08Å; L192-R196 VanDerWaalsContact O-N 3.11Å
193A81.4Confident70.4Confident63 Ų63123.2 Ų123.252%0.52162%0.62SS.*Hα-helixtrans-63.3-44.5174.800000112S189 S190 R191 L195 R196 D197S189-A193 WeakPolarHBondContact O-CB 3.49Å; S189-A193 PolarHBondContact O-N 3.15Å; S190-A193 PolarHBondContact O-N 2.97Å; R191-A193 VanDerWaalsContact C-N 3.34Å; A193-L195 VanDerWaalsContact C-N 3.34Å; A193-L195 PolarHBondContact O-N 3.38Å; A193-R196 PolarHBondContact O-N 3.43Å; A193-D197 PolarHBondContact O-N 3.39Å
194K81.6Confident71.3Confident144 Ų144127.4 Ų127.463%0.62663%0.63SS**Hα-helixtrans-65.3-34.7177.1-74.6175.1178.81700113.3S190 R191 R196 D197 Q198S190-K194 WeakPolarHBondContact O-CG 3.36Å; S190-K194 PolarHBondContact O-N 3.3Å; S190-K194 VanDerWaalsContact O-N 3.12Å; R191-K194 PolarHBondContact O-N 3.12Å; K194-R196 VanDerWaalsContact C-N 3.32Å; K194-D197 PolarHBondContact O-N 3.05Å; K194-Q198 PolarHBondContact O-N 2.93Å
195L76.4Confident72.3Confident118 Ų118127.2 Ų127.262%0.61863%0.631SS**Hα-helixtrans-70.1-32.7176.5-156.385.4000111.8R191 L192 A193 D197 Q198R191-L195 PolarHBondContact O-N 3.12Å; L192-L195 PolarHBondContact O-N 3.43Å; A193-L195 VanDerWaalsContact C-N 3.34Å; A193-L195 PolarHBondContact O-N 3.38Å; L195-D197 VanDerWaalsContact C-N 3.33Å; L195-Q198 PolarHBondContact O-N 3.47Å
196R73.1Confident73.5Confident221 Ų221129.3 Ų129.383%0.83464%0.643SS**Hα-helixtrans-72.3-26.3177.5-128.1178.4171158.2-1.6113.4L192 A193 K194 Q198L192-R196 PolarHBondContact O-N 3.08Å; L192-R196 VanDerWaalsContact O-N 3.11Å; A193-R196 PolarHBondContact O-N 3.43Å; K194-R196 VanDerWaalsContact C-N 3.32Å; R196-Q198 VanDerWaalsContact C-N 3.34Å
197D73.3Confident73.7Confident150 Ų150130.3 Ų130.380%0.80265%0.645SS**THydrogen-bonded Turntrans-85.4-8.7177.7-146.237.7000112.6A193 K194 L195A193-D197 PolarHBondContact O-N 3.39Å; K194-D197 PolarHBondContact O-N 3.05Å; L195-D197 VanDerWaalsContact C-N 3.33Å
198Q67.9Low73.4Confident167 Ų167132.7 Ų132.778%0.7866%0.659SS**  trans-98.1-1.3177.9-86.7-175.1-23.300114.3K194 L195 R196K194-Q198 PolarHBondContact O-N 2.93Å; L195-Q198 PolarHBondContact O-N 3.47Å; R196-Q198 VanDerWaalsContact C-N 3.34Å
199M44.8Very low73.5Confident228 Ų228134.6 Ų134.6100%1.12367%0.666SS**  trans-103.30169.7-80.9-105.7-71.300109.9

Retrieved 199 of 199 residues in 1370 ms (Link to these results)