A0A077ZQE8_TRITR Loading...

Kinesin heavy chain

AlphaFold DB , UniProt , Accession A0A077ZQE8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 278 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
1M46.2Very low61.9Low201 Ų20196.6 Ų96.699%0.9950%0.499SS*.  0-46.60-87-179.7-161.500113.5T3 I4 V5M1-T3 PolarHBondContact O-N 3.3Å; M1-I4 PolarHBondContact O-N 3.04Å; M1-V5 WeakPolarHBondContact O-CG2 3.45Å; M1-V5 PolarHBondContact O-N 3.37Å
2R38.6Very low64.1Low219 Ų21994.5 Ų94.583%0.82649%0.488SS*.Hα-helixtrans-55.1-46.1-177.4-76.6-176.9179.5171.70.2114.2I4 V5 L6R2-I4 VanDerWaalsContact C-N 3.32Å; R2-I4 PolarHBondContact O-N 2.87Å; R2-V5 PolarHBondContact O-N 2.95Å; R2-L6 HydrophobicContact CB-CD1 4.48Å; R2-L6 WeakPolarHBondContact O-CB 3.41Å; R2-L6 WeakPolarHBondContact O-CD1 3.13Å; R2-L6 WeakPolarHBondContact O-CG 3.47Å; R2-L6 PolarHBondContact O-N 3.46Å
3T40.6Very low66.2Low114 Ų11487.2 Ų87.270%0.69945%0.451SS*.Hα-helixtrans-64-31.1-179.2-23.40000113.9M1 N7M1-T3 PolarHBondContact O-N 3.3Å; T3-N7 PolarHBondContact O-N 3.1Å
4I49.9Very low68Low139 Ų13984.8 Ų84.871%0.71344%0.439SS*.Hα-helixtrans-76.3-39.8177.4-64.6167.5000110.8M1 R2 L6 G8M1-I4 PolarHBondContact O-N 3.04Å; R2-I4 VanDerWaalsContact C-N 3.32Å; R2-I4 PolarHBondContact O-N 2.87Å; I4-L6 VanDerWaalsContact C-N 3.31Å; I4-L6 PolarHBondContact O-N 2.64Å; I4-G8 PolarHBondContact O-N 3.29Å
5V53.6Low69.6Low108 Ų10888 Ų8866%0.65545%0.448SS*.Hα-helixtrans-68.7-32.1176.7177.30000111.6M1 R2 G8M1-V5 WeakPolarHBondContact O-CG2 3.45Å; M1-V5 PolarHBondContact O-N 3.37Å; R2-V5 PolarHBondContact O-N 2.95Å; V5-G8 PolarHBondContact O-N 3.42Å
6L54.8Low71.1Confident35 Ų3582.8 Ų82.818%0.18342%0.422CS..Hα-helixtrans-67.1-47.2-178.6-81.6165.8000113.1R2 I4 G8 S9 Q68R2-L6 HydrophobicContact CB-CD1 4.48Å; R2-L6 WeakPolarHBondContact O-CB 3.41Å; R2-L6 WeakPolarHBondContact O-CD1 3.13Å; R2-L6 WeakPolarHBondContact O-CG 3.47Å; R2-L6 PolarHBondContact O-N 3.46Å; I4-L6 VanDerWaalsContact C-N 3.31Å; I4-L6 PolarHBondContact O-N 2.64Å; L6-G8 PolarHBondContact O-N 3.4Å; L6-S9 PolarHBondContact O-N 2.97Å; L6-S9 PolarHBondContact O-OG 2.75Å; L6-Q68 WeakPolarHBondContact CD2-O 3.29Å
7N67.6Low72.2Confident81 Ų8179.1 Ų79.143%0.43340%0.403SS..Hα-helixtrans-61.8-31.1174.4-157.8-17.6000111.7T3 S9 I10 Q11T3-N7 PolarHBondContact O-N 3.1Å; N7-S9 VanDerWaalsContact C-N 3.31Å; N7-S9 PolarHBondContact O-N 3.32Å; N7-I10 PolarHBondContact O-N 3.21Å; N7-Q11 WeakPolarHBondContact O-CB 3.2Å; N7-Q11 VanDerWaalsContact O-CG 3.24Å; N7-Q11 WeakPolarHBondContact O-CG 3.26Å; N7-Q11 PolarHBondContact O-N 3.3Å; N7-Q11 VanDerWaalsContact O-N 3.16Å; N7-Q11 PolarHBondContact OD1-NE2 2.64Å
8G78.5Confident73.2Confident31 Ų3178.7 Ų78.732%0.3240%0.399SS..Hα-helixtrans-63.5-29.9177.700000114.7I4 V5 L6 L12I4-G8 PolarHBondContact O-N 3.29Å; V5-G8 PolarHBondContact O-N 3.42Å; L6-G8 PolarHBondContact O-N 3.4Å; G8-L12 VanDerWaalsContact O-CB 3.26Å; G8-L12 WeakPolarHBondContact O-CB 3.37Å; G8-L12 PolarHBondContact O-N 3.09Å
9S79.6Confident74.2Confident13 Ų1375.4 Ų75.49%0.09139%0.385CS..Hα-helixtrans-72.8-39.5-178.663.70000113.5L6 N7 G13L6-S9 PolarHBondContact O-N 2.97Å; L6-S9 PolarHBondContact O-OG 2.75Å; N7-S9 VanDerWaalsContact C-N 3.31Å; N7-S9 PolarHBondContact O-N 3.32Å; S9-G13 PolarHBondContact O-N 3Å; S9-G13 VanDerWaalsContact O-N 3.09Å
10I84.4Confident75Confident16 Ų1673.8 Ų73.88%0.08238%0.376CS..Hα-helixtrans-71.8-46.1176.5-58.1-55000110N7 L12 G13 D14 Q51 A52 V55 F67N7-I10 PolarHBondContact O-N 3.21Å; I10-L12 VanDerWaalsContact C-N 3.27Å; I10-L12 PolarHBondContact O-N 2.8Å; I10-G13 CarbonylContact O-C 3.49Å; I10-G13 VanDerWaalsContact O-CA 3.28Å; I10-G13 WeakPolarHBondContact O-CA 3.47Å; I10-G13 PolarHBondContact O-N 3.12Å; I10-D14 PolarHBondContact O-N 3.47Å; I10-Q51 HydrophobicContact CD1-CB 4.07Å; I10-A52 HydrophobicContact CG2-CB 4.43Å; I10-V55 HydrophobicContact CD1-CG2 3.79Å; I10-V55 HydrophobicContact CG1-CG2 4.39Å; I10-F67 HydrophobicContact CD1-CE1 4.22Å
11Q86.8Confident75.5Confident106 Ų10676.6 Ų76.650%0.49539%0.388SS..Hα-helixtrans-57.2-39.9175.3-70.7175.78.700112.7N7 G13 D14 K15N7-Q11 WeakPolarHBondContact O-CB 3.2Å; N7-Q11 VanDerWaalsContact O-CG 3.24Å; N7-Q11 WeakPolarHBondContact O-CG 3.26Å; N7-Q11 PolarHBondContact O-N 3.3Å; N7-Q11 VanDerWaalsContact O-N 3.16Å; N7-Q11 PolarHBondContact OD1-NE2 2.64Å; Q11-G13 VanDerWaalsContact C-N 3.34Å; Q11-D14 PolarHBondContact O-N 3.09Å; Q11-K15 WeakPolarHBondContact O-CG 3.22Å; Q11-K15 PolarHBondContact O-N 3.01Å; Q11-K15 VanDerWaalsContact O-N 3.09Å
12L89.1Confident77.4Confident71 Ų7173.2 Ų73.237%0.37237%0.367SS..Hα-helixtrans-64.2-42173.4-179.562.4000111.1G8 I10 K15 L16 Y48G8-L12 VanDerWaalsContact O-CB 3.26Å; G8-L12 WeakPolarHBondContact O-CB 3.37Å; G8-L12 PolarHBondContact O-N 3.09Å; I10-L12 VanDerWaalsContact C-N 3.27Å; I10-L12 PolarHBondContact O-N 2.8Å; L12-K15 PolarHBondContact O-N 3.4Å; L12-L16 HydrophobicContact CG-CD1 4.11Å; L12-L16 WeakPolarHBondContact O-CB 3.09Å; L12-L16 VanDerWaalsContact O-CG 3.26Å; L12-L16 WeakPolarHBondContact O-CG 3.26Å; L12-L16 PolarHBondContact O-N 3.3Å; L12-Y48 HydrophobicContact CD2-CD1 4.42Å; L12-Y48 HydrophobicContact CD2-CD2 3.78Å; L12-Y48 HydrophobicContact CD2-CE1 4.34Å; L12-Y48 HydrophobicContact CD2-CE2 3.65Å; L12-Y48 HydrophobicContact CD2-CG 4.18Å; L12-Y48 HydrophobicContact CG-CD2 4.43Å
13G91.1Very high79.7Confident0 Ų064.7 Ų64.70%034%0.338CS..Hα-helixtrans-56.7-45.2172.700000112.6S9 I10 Q11 K15 L16 I17S9-G13 PolarHBondContact O-N 3Å; S9-G13 VanDerWaalsContact O-N 3.09Å; I10-G13 CarbonylContact O-C 3.49Å; I10-G13 VanDerWaalsContact O-CA 3.28Å; I10-G13 WeakPolarHBondContact O-CA 3.47Å; I10-G13 PolarHBondContact O-N 3.12Å; Q11-G13 VanDerWaalsContact C-N 3.34Å; G13-K15 PolarHBondContact O-N 2.68Å; G13-L16 CarbonylContact O-C 3.57Å; G13-L16 WeakPolarHBondContact O-CB 3.3Å; G13-L16 PolarHBondContact O-N 3.05Å; G13-L16 VanDerWaalsContact O-N 3.13Å; G13-I17 VanDerWaalsContact O-CG1 3.31Å; G13-I17 WeakPolarHBondContact O-CG1 3.43Å; G13-I17 PolarHBondContact O-N 2.85Å
14D90.9Very high81.2Confident53 Ų5361.7 Ų61.728%0.28333%0.325SS..Hα-helixtrans-61.3-43.5177.1-63.4-30.5000112.2I10 Q11 L16 I17 E18 H56I10-D14 PolarHBondContact O-N 3.47Å; Q11-D14 PolarHBondContact O-N 3.09Å; D14-L16 VanDerWaalsContact C-N 3.31Å; D14-L16 PolarHBondContact O-N 2.99Å; D14-I17 PolarHBondContact O-N 3.5Å; D14-E18 PolarHBondContact O-N 2.75Å; D14-H56 IonicContact OD1-CE1 3.49Å; D14-H56 PolarHBondContact OD1-CE1 3.44Å; D14-H56 IonicContact OD1-NE2 2.79Å; D14-H56 PolarHBondContact OD1-NE2 3.45Å
15K92.1Very high81.8Confident133 Ų13363.8 Ų63.858%0.57833%0.329SS*.Hα-helixtrans-65.2-35.2174.8-67.3-54.4-179.7-165.30112.7Q11 L12 G13 E18 A19Q11-K15 WeakPolarHBondContact O-CG 3.22Å; Q11-K15 PolarHBondContact O-N 3.01Å; Q11-K15 VanDerWaalsContact O-N 3.09Å; L12-K15 PolarHBondContact O-N 3.4Å; G13-K15 PolarHBondContact O-N 2.68Å; K15-E18 IonicContact NZ-OE2 2.63Å; K15-E18 PolarHBondContact NZ-OE2 3.35Å; K15-A19 VanDerWaalsContact O-CB 3.32Å; K15-A19 WeakPolarHBondContact O-CB 3.4Å; K15-A19 PolarHBondContact O-N 2.95Å
16L93.1Very high82.2Confident5 Ų566.3 Ų66.33%0.02633%0.328CS..Hα-helixtrans-70.2-36174.3-71.3169000111.9L12 G13 D14 Q20 W34 L40 V45 Y48 I49L12-L16 HydrophobicContact CG-CD1 4.11Å; L12-L16 WeakPolarHBondContact O-CB 3.09Å; L12-L16 VanDerWaalsContact O-CG 3.26Å; L12-L16 WeakPolarHBondContact O-CG 3.26Å; L12-L16 PolarHBondContact O-N 3.3Å; G13-L16 CarbonylContact O-C 3.57Å; G13-L16 WeakPolarHBondContact O-CB 3.3Å; G13-L16 PolarHBondContact O-N 3.05Å; G13-L16 VanDerWaalsContact O-N 3.13Å; D14-L16 VanDerWaalsContact C-N 3.31Å; D14-L16 PolarHBondContact O-N 2.99Å; L16-Q20 WeakPolarHBondContact O-CB 3.27Å; L16-Q20 PolarHBondContact O-N 3.19Å; L16-W34 HydrophobicContact CD2-CZ3 4.14Å; L16-L40 HydrophobicContact CD2-CD1 4.32Å; L16-V45 HydrophobicContact CD1-CG1 4.27Å; L16-V45 HydrophobicContact CD2-CG1 4.12Å; L16-V45 HydrophobicContact CD2-CG2 4.48Å; L16-Y48 HydrophobicContact CD1-CD2 4.26Å; L16-Y48 HydrophobicContact CD1-CG 4.41Å; L16-I49 HydrophobicContact CB-CD1 4.13Å; L16-I49 HydrophobicContact CB-CG1 3.67Å
17I91Very high82.5Confident20 Ų2072.8 Ų72.810%0.10336%0.362CS..Hα-helixtrans-63.2-48.8172.3-68.6164000110G13 D14 A19 Q20 E21 I49 A52 K53G13-I17 VanDerWaalsContact O-CG1 3.31Å; G13-I17 WeakPolarHBondContact O-CG1 3.43Å; G13-I17 PolarHBondContact O-N 2.85Å; D14-I17 PolarHBondContact O-N 3.5Å; I17-A19 VanDerWaalsContact C-N 3.35Å; I17-A19 PolarHBondContact O-N 3.46Å; I17-Q20 WeakPolarHBondContact O-CA 3.41Å; I17-Q20 WeakPolarHBondContact O-CB 3.49Å; I17-Q20 PolarHBondContact O-N 3.46Å; I17-Q20 VanDerWaalsContact O-N 3.1Å; I17-E21 WeakPolarHBondContact O-CG 3.38Å; I17-E21 PolarHBondContact O-N 3.09Å; I17-I49 HydrophobicContact CG1-CB 4.42Å; I17-I49 HydrophobicContact CG1-CG1 4.29Å; I17-I49 HydrophobicContact CG1-CG2 3.95Å; I17-A52 HydrophobicContact CD1-CB 3.71Å; I17-K53 HydrophobicContact CD1-CG 3.78Å; I17-K53 HydrophobicContact CG1-CG 4.47Å
18E90.5Very high82.7Confident72 Ų7271.6 Ų71.634%0.33636%0.36SS..Hα-helixtrans-59.2-44.5177.6-170.3-168.2158.100111.7D14 K15 E21 K22D14-E18 PolarHBondContact O-N 2.75Å; K15-E18 IonicContact NZ-OE2 2.63Å; K15-E18 PolarHBondContact NZ-OE2 3.35Å; E18-E21 PolarHBondContact O-N 2.82Å; E18-K22 HydrophobicContact CG-CD 4.43Å; E18-K22 WeakPolarHBondContact O-CG 3.28Å; E18-K22 PolarHBondContact O-N 3.22Å; E18-K22 VanDerWaalsContact O-N 3.09Å; E18-K22 IonicContact OE1-NZ 3.09Å; E18-K22 PolarHBondContact OE1-NZ 3.32Å
19A90.7Very high82.8Confident16 Ų1672 Ų7213%0.13236%0.364CS..Hα-helixtrans-65.6-38.8175.200000111.8K15 I17 K22 L23 F31 W34K15-A19 VanDerWaalsContact O-CB 3.32Å; K15-A19 WeakPolarHBondContact O-CB 3.4Å; K15-A19 PolarHBondContact O-N 2.95Å; I17-A19 VanDerWaalsContact C-N 3.35Å; I17-A19 PolarHBondContact O-N 3.46Å; A19-K22 PolarHBondContact O-N 3.04Å; A19-L23 VanDerWaalsContact O-CB 3.27Å; A19-L23 WeakPolarHBondContact O-CB 3.32Å; A19-L23 VanDerWaalsContact O-CG 3.26Å; A19-L23 WeakPolarHBondContact O-CG 3.34Å; A19-L23 PolarHBondContact O-N 2.82Å; A19-F31 HydrophobicContact CB-CE2 4.09Å; A19-W34 HydrophobicContact CB-CE3 4.37Å; A19-W34 HydrophobicContact CB-CH2 3.8Å; A19-W34 HydrophobicContact CB-CZ3 3.7Å
20Q90.3Very high83.1Confident43 Ų4373.4 Ų73.420%0.20137%0.372CS..Hα-helixtrans-60.4-49.2175.6-173.7-179.826.100110.4L16 I17 K22 L23 A24 F31L16-Q20 WeakPolarHBondContact O-CB 3.27Å; L16-Q20 PolarHBondContact O-N 3.19Å; I17-Q20 WeakPolarHBondContact O-CA 3.41Å; I17-Q20 WeakPolarHBondContact O-CB 3.49Å; I17-Q20 PolarHBondContact O-N 3.46Å; I17-Q20 VanDerWaalsContact O-N 3.1Å; Q20-K22 PolarHBondContact O-N 3.22Å; Q20-L23 PolarHBondContact O-N 3.1Å; Q20-A24 WeakPolarHBondContact O-CA 3.12Å; Q20-A24 WeakPolarHBondContact O-CB 3.26Å; Q20-A24 PolarHBondContact O-N 3.4Å; Q20-F31 VanDerWaalsContact CA-CD2 3.47Å; Q20-F31 HydrophobicContact CB-CD1 4.32Å; Q20-F31 HydrophobicContact CB-CD2 4.01Å; Q20-F31 HydrophobicContact CB-CE1 4.1Å; Q20-F31 HydrophobicContact CB-CE2 3.79Å; Q20-F31 HydrophobicContact CB-CG 4.28Å; Q20-F31 HydrophobicContact CB-CZ 3.85Å; Q20-F31 HydrophobicContact CG-CD1 4.04Å; Q20-F31 HydrophobicContact CG-CD2 4.48Å; Q20-F31 HydrophobicContact CG-CE1 4.1Å; Q20-F31 HydrophobicContact CG-CG 4.24Å; Q20-F31 HydrophobicContact CG-CZ 4.36Å
21E87Confident83.4Confident133 Ų13373.3 Ų73.362%0.62137%0.371SS*.Hα-helixtrans-61.1-43.4178.9-71.1175.4174.200112.6I17 E18I17-E21 WeakPolarHBondContact O-CG 3.38Å; I17-E21 PolarHBondContact O-N 3.09Å; E18-E21 PolarHBondContact O-N 2.82Å
22K86.3Confident83.5Confident130 Ų13071.7 Ų71.757%0.56536%0.364SS*.Hα-helixtrans-66.5-38.3178.5-74174.4176.1173.40112.8E18 A19 Q20E18-K22 HydrophobicContact CG-CD 4.43Å; E18-K22 WeakPolarHBondContact O-CG 3.28Å; E18-K22 PolarHBondContact O-N 3.22Å; E18-K22 VanDerWaalsContact O-N 3.09Å; E18-K22 IonicContact OE1-NZ 3.09Å; E18-K22 PolarHBondContact OE1-NZ 3.32Å; A19-K22 PolarHBondContact O-N 3.04Å; Q20-K22 PolarHBondContact O-N 3.22Å
23L86.2Confident83.5Confident40 Ų4075.2 Ų75.221%0.20938%0.376CS..Hα-helixtrans-92.9-15.8-176.6-61.5176.5000113.5A19 Q20 K25 T30 F31 W34A19-L23 VanDerWaalsContact O-CB 3.27Å; A19-L23 WeakPolarHBondContact O-CB 3.32Å; A19-L23 VanDerWaalsContact O-CG 3.26Å; A19-L23 WeakPolarHBondContact O-CG 3.34Å; A19-L23 PolarHBondContact O-N 2.82Å; Q20-L23 PolarHBondContact O-N 3.1Å; L23-K25 VanDerWaalsContact C-N 3.31Å; L23-K25 PolarHBondContact O-N 2.95Å; L23-T30 HydrophobicContact CB-CG2 4.38Å; L23-T30 HydrophobicContact CD2-CG2 3.95Å; L23-F31 HydrophobicContact CB-CB 4Å; L23-F31 HydrophobicContact CB-CD2 4.41Å; L23-F31 HydrophobicContact CD1-CD2 4.13Å; L23-W34 HydrophobicContact CD1-CB 3.61Å; L23-W34 HydrophobicContact CD1-CD2 3.7Å; L23-W34 HydrophobicContact CD1-CE3 3.9Å; L23-W34 HydrophobicContact CD1-CG 3.57Å
24A71.8Confident83.5Confident51 Ų5179.7 Ų79.742%0.42139%0.393SS..Hα-helixtrans-71.7-22.9177.700000113.1Q20 Y26 N27Q20-A24 WeakPolarHBondContact O-CA 3.12Å; Q20-A24 WeakPolarHBondContact O-CB 3.26Å; Q20-A24 PolarHBondContact O-N 3.4Å; A24-Y26 PolarHBondContact O-N 2.64Å; A24-N27 PolarHBondContact O-N 3.41Å
25K63.4Low83.5Confident183 Ų18377.2 Ų77.280%0.79638%0.38SS*.THydrogen-bonded Turntrans-54.3-13179.5-89.8-172.6175.2-179.10115.5L23L23-K25 VanDerWaalsContact C-N 3.31Å; L23-K25 PolarHBondContact O-N 2.95Å
26Y60.4Low83.5Confident161 Ų16173.9 Ų73.963%0.63137%0.374SS*.THydrogen-bonded Turntrans-107.7-1.7-174.1-59.3-73.9000114.9A24 S28A24-Y26 PolarHBondContact O-N 2.64Å; Y26-S28 WeakPolarHBondContact CB-OG 3.48Å; Y26-S28 VanDerWaalsContact O-CB 3.26Å; Y26-S28 WeakPolarHBondContact O-CB 3.47Å; Y26-S28 PolarHBondContact O-N 2.91Å; Y26-S28 PolarHBondContact O-OG 3.14Å
27N62.5Low83.4Confident171 Ų17178.1 Ų78.191%0.91440%0.403SS*.SBendtrans44.819.8-178.4-107.57.7000115.4A24A24-N27 PolarHBondContact O-N 3.41Å
28S70.5Confident83.4Confident55 Ų5581.7 Ų81.739%0.38542%0.422SS..SBendtrans-109.613.7-165.750.10000112.8Y26 T30Y26-S28 WeakPolarHBondContact CB-OG 3.48Å; Y26-S28 VanDerWaalsContact O-CB 3.26Å; Y26-S28 WeakPolarHBondContact O-CB 3.47Å; Y26-S28 PolarHBondContact O-N 2.91Å; Y26-S28 PolarHBondContact O-OG 3.14Å; S28-T30 PolarHBondContact O-N 3Å; S28-T30 PolarHBondContact OG-OG1 3.23Å
29G80.4Confident83.4Confident39 Ų3981.3 Ų81.340%0.40244%0.437SS..SBendtrans65.219.5-172.100000113.4F31 E32 K33G29-F31 VanDerWaalsContact C-N 3.28Å; G29-F31 PolarHBondContact O-N 3.43Å; G29-E32 PolarHBondContact O-N 3.32Å; G29-E32 VanDerWaalsContact O-N 3.09Å; G29-K33 PolarHBondContact O-N 3.3Å
30T87.3Confident83.5Confident43 Ų4383.4 Ų83.426%0.26445%0.446SS..Hα-helixtrans-58.7-38.8-175.4-57.30000112.3L23 S28 E32 K33 W34L23-T30 HydrophobicContact CB-CG2 4.38Å; L23-T30 HydrophobicContact CD2-CG2 3.95Å; S28-T30 PolarHBondContact O-N 3Å; S28-T30 PolarHBondContact OG-OG1 3.23Å; T30-E32 VanDerWaalsContact C-N 3.35Å; T30-E32 PolarHBondContact O-N 3.46Å; T30-K33 PolarHBondContact O-N 3.44Å; T30-W34 VanDerWaalsContact O-CB 3.3Å; T30-W34 WeakPolarHBondContact O-CB 3.45Å; T30-W34 PolarHBondContact O-N 3.44Å
31F90.5Very high83.6Confident14 Ų1489 Ų896%0.06147%0.469CS..Hα-helixtrans-59.2-45.3175.3-179-115.2000112.1A19 Q20 L23 G29 W34 F35 V45 I49A19-F31 HydrophobicContact CB-CE2 4.09Å; Q20-F31 VanDerWaalsContact CA-CD2 3.47Å; Q20-F31 HydrophobicContact CB-CD1 4.32Å; Q20-F31 HydrophobicContact CB-CD2 4.01Å; Q20-F31 HydrophobicContact CB-CE1 4.1Å; Q20-F31 HydrophobicContact CB-CE2 3.79Å; Q20-F31 HydrophobicContact CB-CG 4.28Å; Q20-F31 HydrophobicContact CB-CZ 3.85Å; Q20-F31 HydrophobicContact CG-CD1 4.04Å; Q20-F31 HydrophobicContact CG-CD2 4.48Å; Q20-F31 HydrophobicContact CG-CE1 4.1Å; Q20-F31 HydrophobicContact CG-CG 4.24Å; Q20-F31 HydrophobicContact CG-CZ 4.36Å; L23-F31 HydrophobicContact CB-CB 4Å; L23-F31 HydrophobicContact CB-CD2 4.41Å; L23-F31 HydrophobicContact CD1-CD2 4.13Å; G29-F31 VanDerWaalsContact C-N 3.28Å; G29-F31 PolarHBondContact O-N 3.43Å; F31-W34 HydrophobicContact CD2-CE3 4.12Å; F31-W34 HydrophobicContact CD2-CZ3 4.48Å; F31-W34 HydrophobicContact CE2-CE3 4.04Å; F31-W34 AromaticContact CE2-CZ3 3.97Å; F31-W34 HydrophobicContact CE2-CZ3 3.97Å; F31-W34 PolarHBondContact O-N 2.91Å; F31-F35 AromaticContact CD1-CD1 3.87Å; F31-F35 HydrophobicContact CD1-CD1 3.87Å; F31-F35 AromaticContact CD1-CE1 3.89Å; F31-F35 HydrophobicContact CD1-CE1 3.89Å; F31-F35 AromaticContact CE1-CD1 3.71Å; F31-F35 HydrophobicContact CE1-CD1 3.71Å; F31-F35 AromaticContact CE1-CE1 3.84Å; F31-F35 HydrophobicContact CE1-CE1 3.84Å; F31-F35 HydrophobicContact CE2-CD1 4.45Å; F31-F35 HydrophobicContact CG-CD1 4.32Å; F31-F35 HydrophobicContact CZ-CD1 4.01Å; F31-F35 WeakPolarHBondContact O-CD1 3.26Å; F31-F35 PolarHBondContact O-N 3.1Å; F31-V45 HydrophobicContact CE1-CG1 3.76Å; F31-V45 HydrophobicContact CZ-CG1 3.63Å; F31-I49 HydrophobicContact CE1-CD1 3.93Å; F31-I49 HydrophobicContact CZ-CD1 3.81Å
32E88.9Confident83.8Confident72 Ų7287.4 Ų87.434%0.33646%0.461SS..Hα-helixtrans-66.4-41.7179179.2160.6-159.900112.7G29 T30 F35 S36 K42G29-E32 PolarHBondContact O-N 3.32Å; G29-E32 VanDerWaalsContact O-N 3.09Å; T30-E32 VanDerWaalsContact C-N 3.35Å; T30-E32 PolarHBondContact O-N 3.46Å; E32-F35 HydrophobicContact CB-CE1 3.93Å; E32-F35 HydrophobicContact CB-CZ 3.89Å; E32-F35 HydrophobicContact CG-CE1 4.22Å; E32-F35 HydrophobicContact CG-CE2 4.25Å; E32-F35 HydrophobicContact CG-CZ 3.65Å; E32-S36 WeakPolarHBondContact O-CB 3.46Å; E32-S36 PolarHBondContact O-N 3.13Å; E32-S36 VanDerWaalsContact O-N 3.12Å; E32-S36 PolarHBondContact O-OG 2.93Å; E32-K42 VanDerWaalsContact CD-NZ 3.32Å; E32-K42 WeakPolarHBondContact OE1-CD 3.43Å; E32-K42 WeakPolarHBondContact OE1-CE 2.96Å; E32-K42 IonicContact OE1-NZ 3.67Å; E32-K42 PolarHBondContact OE1-NZ 3.47Å; E32-K42 IonicContact OE2-NZ 3.5Å; E32-K42 PolarHBondContact OE2-NZ 2.89Å; E32-K42 VanDerWaalsContact OE2-NZ 3.09Å
33K88.2Confident84Confident146 Ų14687 Ų8764%0.63546%0.461SS*.Hα-helixtrans-61.4-44.1172.4-68.9174.2-179.91690111.7G29 T30 S36 S37G29-K33 PolarHBondContact O-N 3.3Å; T30-K33 PolarHBondContact O-N 3.44Å; K33-S36 PolarHBondContact O-N 2.86Å; K33-S37 WeakPolarHBondContact O-CB 3.21Å; K33-S37 PolarHBondContact O-N 3.43Å
34W91.4Very high84.1Confident94 Ų9487.5 Ų87.536%0.35647%0.466SS..Hα-helixtrans-63.4-54.5-178.5171.476.1000112.1L16 A19 L23 T30 F31 S36 S37 I38L16-W34 HydrophobicContact CD2-CZ3 4.14Å; A19-W34 HydrophobicContact CB-CE3 4.37Å; A19-W34 HydrophobicContact CB-CH2 3.8Å; A19-W34 HydrophobicContact CB-CZ3 3.7Å; L23-W34 HydrophobicContact CD1-CB 3.61Å; L23-W34 HydrophobicContact CD1-CD2 3.7Å; L23-W34 HydrophobicContact CD1-CE3 3.9Å; L23-W34 HydrophobicContact CD1-CG 3.57Å; T30-W34 VanDerWaalsContact O-CB 3.3Å; T30-W34 WeakPolarHBondContact O-CB 3.45Å; T30-W34 PolarHBondContact O-N 3.44Å; F31-W34 HydrophobicContact CD2-CE3 4.12Å; F31-W34 HydrophobicContact CD2-CZ3 4.48Å; F31-W34 HydrophobicContact CE2-CE3 4.04Å; F31-W34 AromaticContact CE2-CZ3 3.97Å; F31-W34 HydrophobicContact CE2-CZ3 3.97Å; F31-W34 PolarHBondContact O-N 2.91Å; W34-S36 PolarHBondContact O-N 3.34Å; W34-S37 WeakPolarHBondContact O-CB 3.17Å; W34-S37 PolarHBondContact O-N 2.99Å; W34-S37 VanDerWaalsContact O-N 3.1Å; W34-S37 PolarHBondContact O-OG 3.32Å; W34-I38 HydrophobicContact CH2-CD1 4.07Å; W34-I38 HydrophobicContact CZ2-CD1 4.04Å; W34-I38 HydrophobicContact CZ3-CD1 4.43Å; W34-I38 PolarHBondContact O-N 3.26Å
35F91.9Very high85.1Confident0 Ų085.1 Ų85.10%045%0.446CS..Hα-helixtrans-65.9-31.3-178.571.2-122.1000111.6F31 E32 S37 I38 G39 L40 K42 V45F31-F35 AromaticContact CD1-CD1 3.87Å; F31-F35 HydrophobicContact CD1-CD1 3.87Å; F31-F35 AromaticContact CD1-CE1 3.89Å; F31-F35 HydrophobicContact CD1-CE1 3.89Å; F31-F35 AromaticContact CE1-CD1 3.71Å; F31-F35 HydrophobicContact CE1-CD1 3.71Å; F31-F35 AromaticContact CE1-CE1 3.84Å; F31-F35 HydrophobicContact CE1-CE1 3.84Å; F31-F35 HydrophobicContact CE2-CD1 4.45Å; F31-F35 HydrophobicContact CG-CD1 4.32Å; F31-F35 HydrophobicContact CZ-CD1 4.01Å; F31-F35 WeakPolarHBondContact O-CD1 3.26Å; F31-F35 PolarHBondContact O-N 3.1Å; E32-F35 HydrophobicContact CB-CE1 3.93Å; E32-F35 HydrophobicContact CB-CZ 3.89Å; E32-F35 HydrophobicContact CG-CE1 4.22Å; E32-F35 HydrophobicContact CG-CE2 4.25Å; E32-F35 HydrophobicContact CG-CZ 3.65Å; F35-S37 VanDerWaalsContact C-N 3.33Å; F35-I38 WeakPolarHBondContact O-CG1 3.36Å; F35-I38 PolarHBondContact O-N 2.84Å; F35-G39 PolarHBondContact O-N 2.79Å; F35-L40 HydrophobicContact CB-CB 4.25Å; F35-L40 HydrophobicContact CB-CD1 4.42Å; F35-L40 HydrophobicContact CD2-CB 4.4Å; F35-L40 WeakPolarHBondContact CD2-O 3.38Å; F35-L40 WeakPolarHBondContact O-CB 3.47Å; F35-L40 PolarHBondContact O-N 3.49Å; F35-K42 HydrophobicContact CE2-CB 4.05Å; F35-K42 HydrophobicContact CZ-CB 3.95Å; F35-K42 HydrophobicContact CZ-CG 4.06Å; F35-V45 HydrophobicContact CB-CG2 3.95Å; F35-V45 HydrophobicContact CD1-CB 4.32Å; F35-V45 HydrophobicContact CD1-CG1 3.88Å; F35-V45 HydrophobicContact CD1-CG2 4.08Å; F35-V45 HydrophobicContact CD2-CG2 3.88Å; F35-V45 HydrophobicContact CE1-CB 4.42Å; F35-V45 HydrophobicContact CE1-CG1 4.11Å; F35-V45 HydrophobicContact CE2-CG2 4.45Å; F35-V45 HydrophobicContact CG-CB 4.45Å; F35-V45 HydrophobicContact CG-CG1 4.38Å; F35-V45 HydrophobicContact CG-CG2 3.74Å
36S90.5Very high86.5Confident64 Ų6480 Ų8045%0.44842%0.422SS..Hα-helixtrans-68.2-36.4176.3-59.50000111.2E32 K33 W34 I38 G39E32-S36 WeakPolarHBondContact O-CB 3.46Å; E32-S36 PolarHBondContact O-N 3.13Å; E32-S36 VanDerWaalsContact O-N 3.12Å; E32-S36 PolarHBondContact O-OG 2.93Å; K33-S36 PolarHBondContact O-N 2.86Å; W34-S36 PolarHBondContact O-N 3.34Å; S36-I38 VanDerWaalsContact C-N 3.27Å; S36-I38 PolarHBondContact O-N 2.64Å; S36-G39 PolarHBondContact O-N 3.43Å
37S91.3Very high88Confident93 Ų9373.5 Ų73.565%0.6540%0.398SS*.Hα-helixtrans-65.2-28.4177.777.10000113.5K33 W34 F35 G39K33-S37 WeakPolarHBondContact O-CB 3.21Å; K33-S37 PolarHBondContact O-N 3.43Å; W34-S37 WeakPolarHBondContact O-CB 3.17Å; W34-S37 PolarHBondContact O-N 2.99Å; W34-S37 VanDerWaalsContact O-N 3.1Å; W34-S37 PolarHBondContact O-OG 3.32Å; F35-S37 VanDerWaalsContact C-N 3.33Å; S37-G39 VanDerWaalsContact C-N 3.31Å
38I91.4Very high89.4Confident95 Ų9567.9 Ų67.949%0.48736%0.364SS..THydrogen-bonded Turntrans-91.48.8174.263171.4000112.7W34 F35 S36 L40W34-I38 HydrophobicContact CH2-CD1 4.07Å; W34-I38 HydrophobicContact CZ2-CD1 4.04Å; W34-I38 HydrophobicContact CZ3-CD1 4.43Å; W34-I38 PolarHBondContact O-N 3.26Å; F35-I38 WeakPolarHBondContact O-CG1 3.36Å; F35-I38 PolarHBondContact O-N 2.84Å; S36-I38 VanDerWaalsContact C-N 3.27Å; S36-I38 PolarHBondContact O-N 2.64Å; I38-L40 HydrophobicContact CD1-CD1 3.67Å; I38-L40 HydrophobicContact CD1-CG 4.07Å; I38-L40 HydrophobicContact CG1-CD1 4.18Å; I38-L40 HydrophobicContact CG1-CG 4.05Å
39G90.5Very high90.4Very high65 Ų6565.3 Ų65.367%0.6735%0.346SS*.THydrogen-bonded Turntrans82.811.5174.100000115.6F35 S36 S37F35-G39 PolarHBondContact O-N 2.79Å; S36-G39 PolarHBondContact O-N 3.43Å; S37-G39 VanDerWaalsContact C-N 3.31Å
40L91.8Very high91Very high59 Ų5965 Ų6531%0.30934%0.336SS..  trans-82.6139176.5-62.6178.9000111.3L16 F35 I38 V45L16-L40 HydrophobicContact CD2-CD1 4.32Å; F35-L40 HydrophobicContact CB-CB 4.25Å; F35-L40 HydrophobicContact CB-CD1 4.42Å; F35-L40 HydrophobicContact CD2-CB 4.4Å; F35-L40 WeakPolarHBondContact CD2-O 3.38Å; F35-L40 WeakPolarHBondContact O-CB 3.47Å; F35-L40 PolarHBondContact O-N 3.49Å; I38-L40 HydrophobicContact CD1-CD1 3.67Å; I38-L40 HydrophobicContact CD1-CG 4.07Å; I38-L40 HydrophobicContact CG1-CD1 4.18Å; I38-L40 HydrophobicContact CG1-CG 4.05Å; L40-V45 HydrophobicContact CB-CG2 3.68Å; L40-V45 HydrophobicContact CD1-CG2 3.98Å; L40-V45 HydrophobicContact CG-CG2 4.47Å
41K92.6Very high91.2Very high160 Ų16063 Ų6370%0.69632%0.323SS*.  trans-81.2138.7174.2-65-178.6-179.7179.60110Q43 T44 V45K41-Q43 VanDerWaalsContact C-N 3.29Å; K41-Q43 PolarHBondContact O-N 3.45Å; K41-T44 WeakPolarHBondContact O-CB 3.31Å; K41-T44 PolarHBondContact O-N 3.1Å; K41-V45 PolarHBondContact O-N 2.96Å
42K91.2Very high91.2Very high101 Ų10162.3 Ų62.344%0.43932%0.32SS..Hα-helixtrans-44.9-52.4175.4-175.4176.4-164.7146.80112.5E32 F35 T44 V45 Y46E32-K42 VanDerWaalsContact CD-NZ 3.32Å; E32-K42 WeakPolarHBondContact OE1-CD 3.43Å; E32-K42 WeakPolarHBondContact OE1-CE 2.96Å; E32-K42 IonicContact OE1-NZ 3.67Å; E32-K42 PolarHBondContact OE1-NZ 3.47Å; E32-K42 IonicContact OE2-NZ 3.5Å; E32-K42 PolarHBondContact OE2-NZ 2.89Å; E32-K42 VanDerWaalsContact OE2-NZ 3.09Å; F35-K42 HydrophobicContact CE2-CB 4.05Å; F35-K42 HydrophobicContact CZ-CB 3.95Å; F35-K42 HydrophobicContact CZ-CG 4.06Å; K42-T44 VanDerWaalsContact C-N 3.31Å; K42-T44 PolarHBondContact O-N 2.85Å; K42-V45 PolarHBondContact O-N 3.38Å; K42-Y46 HydrophobicContact CD-CE2 4.46Å; K42-Y46 HydrophobicContact CG-CD2 3.71Å; K42-Y46 HydrophobicContact CG-CE2 3.72Å; K42-Y46 VanDerWaalsContact O-CD2 3.28Å; K42-Y46 WeakPolarHBondContact O-CD2 3.28Å; K42-Y46 PolarHBondContact O-N 3.16Å
43Q90.2Very high91.3Very high122 Ų12263.1 Ų63.157%0.5732%0.323SS*.Hα-helixtrans-56.4-45.2-179.8-17263.244.900112.3K41 N47K41-Q43 VanDerWaalsContact C-N 3.29Å; K41-Q43 PolarHBondContact O-N 3.45Å; Q43-N47 PolarHBondContact NE2-OD1 3.09Å; Q43-N47 WeakPolarHBondContact O-CB 3.35Å; Q43-N47 PolarHBondContact O-N 2.91Å; Q43-N47 PolarHBondContact O-ND2 3.09Å; Q43-N47 PolarHBondContact O-OD1 3.34Å
44T90.2Very high91.5Very high50 Ų5057.5 Ų57.531%0.30730%0.298SS..Hα-helixtrans-64.1-44.2-179.5-57.30000111.4K41 K42 N47 Y48K41-T44 WeakPolarHBondContact O-CB 3.31Å; K41-T44 PolarHBondContact O-N 3.1Å; K42-T44 VanDerWaalsContact C-N 3.31Å; K42-T44 PolarHBondContact O-N 2.85Å; T44-N47 PolarHBondContact O-N 3.05Å; T44-Y48 HydrophobicContact CG2-CD2 3.82Å; T44-Y48 HydrophobicContact CG2-CE2 3.36Å; T44-Y48 WeakPolarHBondContact O-CD2 3.49Å; T44-Y48 PolarHBondContact O-N 2.8Å; T44-Y48 VanDerWaalsContact O-N 3.1Å
45V92.3Very high91.4Very high1 Ų153.8 Ų53.81%0.00629%0.286CS..Hα-helixtrans-59.5-51.7178.1170.80000111L16 F31 F35 L40 K41 K42 N47 Y48 I49L16-V45 HydrophobicContact CD1-CG1 4.27Å; L16-V45 HydrophobicContact CD2-CG1 4.12Å; L16-V45 HydrophobicContact CD2-CG2 4.48Å; F31-V45 HydrophobicContact CE1-CG1 3.76Å; F31-V45 HydrophobicContact CZ-CG1 3.63Å; F35-V45 HydrophobicContact CB-CG2 3.95Å; F35-V45 HydrophobicContact CD1-CB 4.32Å; F35-V45 HydrophobicContact CD1-CG1 3.88Å; F35-V45 HydrophobicContact CD1-CG2 4.08Å; F35-V45 HydrophobicContact CD2-CG2 3.88Å; F35-V45 HydrophobicContact CE1-CB 4.42Å; F35-V45 HydrophobicContact CE1-CG1 4.11Å; F35-V45 HydrophobicContact CE2-CG2 4.45Å; F35-V45 HydrophobicContact CG-CB 4.45Å; F35-V45 HydrophobicContact CG-CG1 4.38Å; F35-V45 HydrophobicContact CG-CG2 3.74Å; L40-V45 HydrophobicContact CB-CG2 3.68Å; L40-V45 HydrophobicContact CD1-CG2 3.98Å; L40-V45 HydrophobicContact CG-CG2 4.47Å; K41-V45 PolarHBondContact O-N 2.96Å; K42-V45 PolarHBondContact O-N 3.38Å; V45-N47 VanDerWaalsContact C-N 3.33Å; V45-N47 PolarHBondContact O-N 3.09Å; V45-Y48 PolarHBondContact O-N 3.27Å; V45-I49 HydrophobicContact CG1-CD1 3.77Å; V45-I49 WeakPolarHBondContact O-CG1 3.49Å; V45-I49 PolarHBondContact O-N 3.01Å
46Y92.5Very high91.2Very high75 Ų7559.6 Ų59.629%0.29431%0.313SS..Hα-helixtrans-67.3-32.8179.7-76.7-74.8000112.6K42 Y48 I49 N50K42-Y46 HydrophobicContact CD-CE2 4.46Å; K42-Y46 HydrophobicContact CG-CD2 3.71Å; K42-Y46 HydrophobicContact CG-CE2 3.72Å; K42-Y46 VanDerWaalsContact O-CD2 3.28Å; K42-Y46 WeakPolarHBondContact O-CD2 3.28Å; K42-Y46 PolarHBondContact O-N 3.16Å; Y46-Y48 VanDerWaalsContact C-N 3.33Å; Y46-Y48 PolarHBondContact O-N 3.5Å; Y46-I49 HydrophobicContact CD1-CD1 4.46Å; Y46-I49 PolarHBondContact O-N 3.08Å; Y46-N50 WeakPolarHBondContact O-CB 3.23Å; Y46-N50 PolarHBondContact O-N 2.83Å; Y46-N50 PolarHBondContact O-ND2 3.5Å; Y46-N50 PolarHBondContact O-OD1 3.31Å
47N91.8Very high91Very high25 Ų2563.5 Ų63.513%0.13432%0.324CS..Hα-helixtrans-61.4-40.4173.2-71.2-6.2000112.2Q43 T44 V45 Q51 T76Q43-N47 PolarHBondContact NE2-OD1 3.09Å; Q43-N47 WeakPolarHBondContact O-CB 3.35Å; Q43-N47 PolarHBondContact O-N 2.91Å; Q43-N47 PolarHBondContact O-ND2 3.09Å; Q43-N47 PolarHBondContact O-OD1 3.34Å; T44-N47 PolarHBondContact O-N 3.05Å; V45-N47 VanDerWaalsContact C-N 3.33Å; V45-N47 PolarHBondContact O-N 3.09Å; N47-Q51 WeakPolarHBondContact O-CB 3.43Å; N47-Q51 VanDerWaalsContact O-CG 3.23Å; N47-Q51 WeakPolarHBondContact O-CG 3.47Å; N47-Q51 PolarHBondContact O-N 3.23Å; N47-Q51 VanDerWaalsContact O-N 3.1Å; N47-Q51 PolarHBondContact O-NE2 3.34Å; N47-T76 HydrophobicContact CB-CG2 4.22Å; N47-T76 WeakPolarHBondContact ND2-CG2 3.46Å
48Y91.7Very high90.7Very high52 Ų5260 Ų6020%0.20430%0.297CS..Hα-helixtrans-71.8-43177.1-73.3-58.5000112.2L12 L16 T44 V45 Y46 N50 Q51 A52L12-Y48 HydrophobicContact CD2-CD1 4.42Å; L12-Y48 HydrophobicContact CD2-CD2 3.78Å; L12-Y48 HydrophobicContact CD2-CE1 4.34Å; L12-Y48 HydrophobicContact CD2-CE2 3.65Å; L12-Y48 HydrophobicContact CD2-CG 4.18Å; L12-Y48 HydrophobicContact CG-CD2 4.43Å; L16-Y48 HydrophobicContact CD1-CD2 4.26Å; L16-Y48 HydrophobicContact CD1-CG 4.41Å; T44-Y48 HydrophobicContact CG2-CD2 3.82Å; T44-Y48 HydrophobicContact CG2-CE2 3.36Å; T44-Y48 WeakPolarHBondContact O-CD2 3.49Å; T44-Y48 PolarHBondContact O-N 2.8Å; T44-Y48 VanDerWaalsContact O-N 3.1Å; V45-Y48 PolarHBondContact O-N 3.27Å; Y46-Y48 VanDerWaalsContact C-N 3.33Å; Y46-Y48 PolarHBondContact O-N 3.5Å; Y48-N50 VanDerWaalsContact C-N 3.31Å; Y48-N50 PolarHBondContact O-N 2.99Å; Y48-Q51 PolarHBondContact O-N 3.3Å; Y48-A52 PolarHBondContact O-N 3.49Å
49I92.8Very high90Very high1 Ų163.4 Ų63.41%0.00532%0.317CS..Hα-helixtrans-57.8-46.7175-70.9170.3000110.6L16 I17 F31 V45 Y46 A52 K53L16-I49 HydrophobicContact CB-CD1 4.13Å; L16-I49 HydrophobicContact CB-CG1 3.67Å; I17-I49 HydrophobicContact CG1-CB 4.42Å; I17-I49 HydrophobicContact CG1-CG1 4.29Å; I17-I49 HydrophobicContact CG1-CG2 3.95Å; F31-I49 HydrophobicContact CE1-CD1 3.93Å; F31-I49 HydrophobicContact CZ-CD1 3.81Å; V45-I49 HydrophobicContact CG1-CD1 3.77Å; V45-I49 WeakPolarHBondContact O-CG1 3.49Å; V45-I49 PolarHBondContact O-N 3.01Å; Y46-I49 HydrophobicContact CD1-CD1 4.46Å; Y46-I49 PolarHBondContact O-N 3.08Å; I49-A52 PolarHBondContact O-N 3.36Å; I49-K53 HydrophobicContact CG2-CD 4.01Å; I49-K53 HydrophobicContact CG2-CG 4.44Å; I49-K53 WeakPolarHBondContact O-CB 3.16Å; I49-K53 WeakPolarHBondContact O-CG 3.36Å; I49-K53 PolarHBondContact O-N 2.92Å
50N92.4Very high89.4Confident33 Ų3365.4 Ų65.418%0.17631%0.309CS..Hα-helixtrans-63.4-43.7179.9-74.1-8.4000111.6Y46 Y48 K53 F54 S79Y46-N50 WeakPolarHBondContact O-CB 3.23Å; Y46-N50 PolarHBondContact O-N 2.83Å; Y46-N50 PolarHBondContact O-ND2 3.5Å; Y46-N50 PolarHBondContact O-OD1 3.31Å; Y48-N50 VanDerWaalsContact C-N 3.31Å; Y48-N50 PolarHBondContact O-N 2.99Å; N50-K53 PolarHBondContact O-N 3.26Å; N50-F54 WeakPolarHBondContact O-CB 3.24Å; N50-F54 PolarHBondContact O-N 3.32Å; N50-S79 WeakPolarHBondContact CB-O 3.47Å
51Q91.3Very high88.8Confident1 Ų166.9 Ų66.91%0.00532%0.324CS..Hα-helixtrans-61.4-44176-75170.975.700112.2I10 N47 Y48 F54 V55 F67I10-Q51 HydrophobicContact CD1-CB 4.07Å; N47-Q51 WeakPolarHBondContact O-CB 3.43Å; N47-Q51 VanDerWaalsContact O-CG 3.23Å; N47-Q51 WeakPolarHBondContact O-CG 3.47Å; N47-Q51 PolarHBondContact O-N 3.23Å; N47-Q51 VanDerWaalsContact O-N 3.1Å; N47-Q51 PolarHBondContact O-NE2 3.34Å; Y48-Q51 PolarHBondContact O-N 3.3Å; Q51-F54 PolarHBondContact O-N 3.19Å; Q51-V55 WeakPolarHBondContact O-CG2 3.34Å; Q51-V55 PolarHBondContact O-N 3.24Å; Q51-F67 HydrophobicContact CB-CZ 4.29Å; Q51-F67 HydrophobicContact CG-CZ 4.07Å
52A90.5Very high88.4Confident0 Ų065.8 Ų65.80%032%0.321CS..Hα-helixtrans-65.4-45.9177.600000112.2I10 I17 Y48 I49 F54 V55 H56I10-A52 HydrophobicContact CG2-CB 4.43Å; I17-A52 HydrophobicContact CD1-CB 3.71Å; Y48-A52 PolarHBondContact O-N 3.49Å; I49-A52 PolarHBondContact O-N 3.36Å; A52-F54 VanDerWaalsContact C-N 3.28Å; A52-F54 PolarHBondContact O-N 3.06Å; A52-V55 PolarHBondContact O-N 2.97Å; A52-H56 VanDerWaalsContact O-CG 3.28Å; A52-H56 PolarHBondContact O-N 3.22Å
53K91.5Very high88.1Confident88 Ų8862.4 Ų62.438%0.38331%0.307SS..Hα-helixtrans-59.8-39.5174.5-73.6-177.6179.9-178.50112.5I17 I49 N50 H56 Q57I17-K53 HydrophobicContact CD1-CG 3.78Å; I17-K53 HydrophobicContact CG1-CG 4.47Å; I49-K53 HydrophobicContact CG2-CD 4.01Å; I49-K53 HydrophobicContact CG2-CG 4.44Å; I49-K53 WeakPolarHBondContact O-CB 3.16Å; I49-K53 WeakPolarHBondContact O-CG 3.36Å; I49-K53 PolarHBondContact O-N 2.92Å; N50-K53 PolarHBondContact O-N 3.26Å; K53-H56 PolarHBondContact O-N 3.16Å; K53-Q57 WeakPolarHBondContact O-CG 3.37Å; K53-Q57 PolarHBondContact O-N 2.99Å
54F91.5Very high87.9Confident28 Ų2858.5 Ų58.512%0.12329%0.29CS..Hα-helixtrans-64.5-42.6178.6-174-113.4000111.5N50 Q51 A52 Q57 M58 F67 V78 S79 V88 L92N50-F54 WeakPolarHBondContact O-CB 3.24Å; N50-F54 PolarHBondContact O-N 3.32Å; Q51-F54 PolarHBondContact O-N 3.19Å; A52-F54 VanDerWaalsContact C-N 3.28Å; A52-F54 PolarHBondContact O-N 3.06Å; F54-Q57 PolarHBondContact O-N 3.37Å; F54-M58 HydrophobicContact CD1-CE 3.36Å; F54-M58 HydrophobicContact CE1-CE 3.02Å; F54-M58 HydrophobicContact CE2-CE 4.45Å; F54-M58 HydrophobicContact CG-CE 4.22Å; F54-M58 HydrophobicContact CZ-CE 3.61Å; F54-F67 AromaticContact CD1-CD2 3.88Å; F54-F67 HydrophobicContact CD1-CD2 3.88Å; F54-F67 HydrophobicContact CD1-CE1 4.32Å; F54-F67 AromaticContact CD1-CE2 3.53Å; F54-F67 HydrophobicContact CD1-CE2 3.53Å; F54-F67 HydrophobicContact CD1-CG 4.41Å; F54-F67 AromaticContact CD1-CZ 3.76Å; F54-F67 HydrophobicContact CD1-CZ 3.76Å; F54-F67 AromaticContact CE1-CD2 3.63Å; F54-F67 HydrophobicContact CE1-CD2 3.63Å; F54-F67 AromaticContact CE1-CE2 3.64Å; F54-F67 HydrophobicContact CE1-CE2 3.64Å; F54-F67 HydrophobicContact CE1-CG 4.33Å; F54-F67 HydrophobicContact CE1-CZ 4.33Å; F54-V78 HydrophobicContact CE1-CG2 4Å; F54-S79 VanDerWaalsContact CD1-OG 3.29Å; F54-S79 WeakPolarHBondContact CD1-OG 3.45Å; F54-V88 HydrophobicContact CE1-CG1 4.5Å; F54-V88 HydrophobicContact CE2-CG1 3.82Å; F54-V88 HydrophobicContact CZ-CG1 3.37Å; F54-L92 HydrophobicContact CE1-CD2 4.38Å; F54-L92 HydrophobicContact CZ-CD1 4.18Å
55V89Confident87.6Confident17 Ų1760.6 Ų60.610%0.10330%0.299CS..Hα-helixtrans-64.7-38.1173.1172.30000112I10 Q51 A52 Q57 M58 I64 F67I10-V55 HydrophobicContact CD1-CG2 3.79Å; I10-V55 HydrophobicContact CG1-CG2 4.39Å; Q51-V55 WeakPolarHBondContact O-CG2 3.34Å; Q51-V55 PolarHBondContact O-N 3.24Å; A52-V55 PolarHBondContact O-N 2.97Å; V55-Q57 PolarHBondContact O-N 3.13Å; V55-M58 PolarHBondContact O-N 3.03Å; V55-M58 VanDerWaalsContact O-N 3.11Å; V55-I64 HydrophobicContact CG1-CD1 4.49Å; V55-I64 HydrophobicContact CG1-CG1 4.35Å; V55-I64 HydrophobicContact CG1-CG2 4.31Å; V55-F67 HydrophobicContact CG2-CD1 3.5Å; V55-F67 HydrophobicContact CG2-CE1 3.45Å; V55-F67 VanDerWaalsContact CG2-CE1 3.45Å
56H87.2Confident87.3Confident121 Ų12162.5 Ų62.556%0.5631%0.309SS*.Hα-helixtrans-64.4-16.6175.9-67.4162.6000114.4D14 A52 K53D14-H56 IonicContact OD1-CE1 3.49Å; D14-H56 PolarHBondContact OD1-CE1 3.44Å; D14-H56 IonicContact OD1-NE2 2.79Å; D14-H56 PolarHBondContact OD1-NE2 3.45Å; A52-H56 VanDerWaalsContact O-CG 3.28Å; A52-H56 PolarHBondContact O-N 3.22Å; K53-H56 PolarHBondContact O-N 3.16Å
57Q86.5Confident87.2Confident146 Ų14658.9 Ų58.968%0.68230%0.295SS*.THydrogen-bonded Turntrans-91.7-7.1176.8-69.6170.7-12.100112.9K53 F54 V55K53-Q57 WeakPolarHBondContact O-CG 3.37Å; K53-Q57 PolarHBondContact O-N 2.99Å; F54-Q57 PolarHBondContact O-N 3.37Å; V55-Q57 PolarHBondContact O-N 3.13Å
58M85.3Confident86.8Confident19 Ų1960 Ų609%0.09430%0.299CS..  trans-88.3128-179.9-64.9172.3-18000110.8F54 V55 Q63 I64 F67 L92F54-M58 HydrophobicContact CD1-CE 3.36Å; F54-M58 HydrophobicContact CE1-CE 3.02Å; F54-M58 HydrophobicContact CE2-CE 4.45Å; F54-M58 HydrophobicContact CG-CE 4.22Å; F54-M58 HydrophobicContact CZ-CE 3.61Å; V55-M58 PolarHBondContact O-N 3.03Å; V55-M58 VanDerWaalsContact O-N 3.11Å; M58-Q63 HydrophobicContact SD-CB 4.42Å; M58-I64 HydrophobicContact CB-CD1 4.21Å; M58-I64 HydrophobicContact CB-CG1 3.72Å; M58-I64 HydrophobicContact CG-CG1 4.38Å; M58-I64 HydrophobicContact SD-CB 4.47Å; M58-I64 HydrophobicContact SD-CG1 3.76Å; M58-F67 HydrophobicContact CE-CB 3.97Å; M58-F67 HydrophobicContact CE-CD1 4.43Å; M58-F67 HydrophobicContact CE-CD2 4.23Å; M58-F67 HydrophobicContact CE-CG 3.94Å; M58-F67 HydrophobicContact SD-CB 4.34Å; M58-L92 HydrophobicContact CE-CD1 4.04Å; M58-L92 HydrophobicContact CE-CD2 3.66Å
59D77.1Confident86.6Confident167 Ų16765.2 Ų65.289%0.89333%0.325SS*.  trans-89.2-24.6174.6-65.6-46.7000112.3
60E77.6Confident86.3Confident107 Ų10765.8 Ų65.850%0.533%0.328SS..  trans-95.8123.2-172.5-67.8-178.1-177.500112.6E62 Q63 I64E60-E62 PolarHBondContact O-N 3.38Å; E60-Q63 HydrophobicContact CB-CB 4.17Å; E60-Q63 HydrophobicContact CB-CG 3.8Å; E60-Q63 PolarHBondContact O-N 3.04Å; E60-Q63 WeakPolarHBondContact OE2-CG 3.39Å; E60-Q63 PolarHBondContact OE2-NE2 3.44Å; E60-I64 WeakPolarHBondContact O-CG1 3.36Å; E60-I64 PolarHBondContact O-N 3.38Å
61S80.6Confident86.1Confident91 Ų9167.2 Ų67.264%0.63634%0.34SS*.Hα-helixtrans-61.6-29.9177.2610000113N65S61-N65 VanDerWaalsContact O-CG 3.27Å; S61-N65 PolarHBondContact O-N 2.97Å; S61-N65 VanDerWaalsContact O-N 3.13Å; S61-N65 PolarHBondContact O-ND2 2.86Å; S61-N65 VanDerWaalsContact O-ND2 3.16Å
62E82.4Confident85.9Confident136 Ų13672.6 Ų72.664%0.63637%0.366SS*.Hα-helixtrans-67.5-46.6176.5-172.9166.6-164.900111.9E60 I64 N65 I66E60-E62 PolarHBondContact O-N 3.38Å; E62-I64 VanDerWaalsContact C-N 3.31Å; E62-I64 PolarHBondContact O-N 2.93Å; E62-N65 WeakPolarHBondContact O-CB 3.45Å; E62-N65 PolarHBondContact O-N 3.26Å; E62-N65 VanDerWaalsContact O-N 3.12Å; E62-I66 HydrophobicContact CG-CD1 4.06Å; E62-I66 WeakPolarHBondContact O-CG1 3.33Å; E62-I66 PolarHBondContact O-N 3.25Å
63Q85.2Confident85.8Confident31 Ų3176.5 Ų76.515%0.14539%0.39CS..Hα-helixtrans-61.7-39.6176.1-64.4-177.52.600112.1M58 E60 N65 I66 F67 L92M58-Q63 HydrophobicContact SD-CB 4.42Å; E60-Q63 HydrophobicContact CB-CB 4.17Å; E60-Q63 HydrophobicContact CB-CG 3.8Å; E60-Q63 PolarHBondContact O-N 3.04Å; E60-Q63 WeakPolarHBondContact OE2-CG 3.39Å; E60-Q63 PolarHBondContact OE2-NE2 3.44Å; Q63-N65 VanDerWaalsContact C-N 3.31Å; Q63-N65 PolarHBondContact O-N 3.36Å; Q63-I66 PolarHBondContact O-N 3.07Å; Q63-F67 VanDerWaalsContact O-CB 3.24Å; Q63-F67 WeakPolarHBondContact O-CB 3.37Å; Q63-F67 PolarHBondContact O-N 3.32Å; Q63-L92 HydrophobicContact CG-CB 4.35Å
64I85.7Confident85.8Confident40 Ų4072.3 Ų72.321%0.20537%0.372CS..Hα-helixtrans-60.6-43175-67.2171.9000110.6V55 M58 E60 E62 Q68V55-I64 HydrophobicContact CG1-CD1 4.49Å; V55-I64 HydrophobicContact CG1-CG1 4.35Å; V55-I64 HydrophobicContact CG1-CG2 4.31Å; M58-I64 HydrophobicContact CB-CD1 4.21Å; M58-I64 HydrophobicContact CB-CG1 3.72Å; M58-I64 HydrophobicContact CG-CG1 4.38Å; M58-I64 HydrophobicContact SD-CB 4.47Å; M58-I64 HydrophobicContact SD-CG1 3.76Å; E60-I64 WeakPolarHBondContact O-CG1 3.36Å; E60-I64 PolarHBondContact O-N 3.38Å; E62-I64 VanDerWaalsContact C-N 3.31Å; E62-I64 PolarHBondContact O-N 2.93Å; I64-Q68 WeakPolarHBondContact O-CB 3.32Å; I64-Q68 VanDerWaalsContact O-CG 3.25Å; I64-Q68 WeakPolarHBondContact O-CG 3.15Å; I64-Q68 PolarHBondContact O-N 2.91Å
65N85.4Confident85.7Confident94 Ų9472.1 Ų72.150%0.50337%0.37SS..Hα-helixtrans-64.9-47.8177.1-71.2-31.2000111.2S61 E62 Q63 F67 Q68 E69S61-N65 VanDerWaalsContact O-CG 3.27Å; S61-N65 PolarHBondContact O-N 2.97Å; S61-N65 VanDerWaalsContact O-N 3.13Å; S61-N65 PolarHBondContact O-ND2 2.86Å; S61-N65 VanDerWaalsContact O-ND2 3.16Å; E62-N65 WeakPolarHBondContact O-CB 3.45Å; E62-N65 PolarHBondContact O-N 3.26Å; E62-N65 VanDerWaalsContact O-N 3.12Å; Q63-N65 VanDerWaalsContact C-N 3.31Å; Q63-N65 PolarHBondContact O-N 3.36Å; N65-F67 PolarHBondContact O-N 3.2Å; N65-Q68 PolarHBondContact O-N 3.39Å; N65-E69 WeakPolarHBondContact O-CG 3.46Å; N65-E69 PolarHBondContact O-N 3Å
66I86.3Confident85.8Confident40 Ų4072.3 Ų72.321%0.20537%0.372CS..Hα-helixtrans-57.9-50178-68.6168.1000110.1E62 Q63 Q68 E69 L70 L92E62-I66 HydrophobicContact CG-CD1 4.06Å; E62-I66 WeakPolarHBondContact O-CG1 3.33Å; E62-I66 PolarHBondContact O-N 3.25Å; Q63-I66 PolarHBondContact O-N 3.07Å; I66-Q68 VanDerWaalsContact C-N 3.31Å; I66-Q68 PolarHBondContact O-N 3.25Å; I66-E69 PolarHBondContact O-N 2.78Å; I66-L70 HydrophobicContact CG2-CD2 4.48Å; I66-L70 WeakPolarHBondContact O-CG 3.42Å; I66-L70 PolarHBondContact O-N 3.33Å; I66-L92 WeakPolarHBondContact CD1-O 3.45Å
67F89Confident86Confident0 Ų067.6 Ų67.60%035%0.35CS..Hα-helixtrans-57.2-42.8178.4176-104.3000112.5I10 Q51 F54 V55 M58 Q63 N65 E69 L70 R75 V78 S79 L92I10-F67 HydrophobicContact CD1-CE1 4.22Å; Q51-F67 HydrophobicContact CB-CZ 4.29Å; Q51-F67 HydrophobicContact CG-CZ 4.07Å; F54-F67 AromaticContact CD1-CD2 3.88Å; F54-F67 HydrophobicContact CD1-CD2 3.88Å; F54-F67 HydrophobicContact CD1-CE1 4.32Å; F54-F67 AromaticContact CD1-CE2 3.53Å; F54-F67 HydrophobicContact CD1-CE2 3.53Å; F54-F67 HydrophobicContact CD1-CG 4.41Å; F54-F67 AromaticContact CD1-CZ 3.76Å; F54-F67 HydrophobicContact CD1-CZ 3.76Å; F54-F67 AromaticContact CE1-CD2 3.63Å; F54-F67 HydrophobicContact CE1-CD2 3.63Å; F54-F67 AromaticContact CE1-CE2 3.64Å; F54-F67 HydrophobicContact CE1-CE2 3.64Å; F54-F67 HydrophobicContact CE1-CG 4.33Å; F54-F67 HydrophobicContact CE1-CZ 4.33Å; V55-F67 HydrophobicContact CG2-CD1 3.5Å; V55-F67 HydrophobicContact CG2-CE1 3.45Å; V55-F67 VanDerWaalsContact CG2-CE1 3.45Å; M58-F67 HydrophobicContact CE-CB 3.97Å; M58-F67 HydrophobicContact CE-CD1 4.43Å; M58-F67 HydrophobicContact CE-CD2 4.23Å; M58-F67 HydrophobicContact CE-CG 3.94Å; M58-F67 HydrophobicContact SD-CB 4.34Å; Q63-F67 VanDerWaalsContact O-CB 3.24Å; Q63-F67 WeakPolarHBondContact O-CB 3.37Å; Q63-F67 PolarHBondContact O-N 3.32Å; N65-F67 PolarHBondContact O-N 3.2Å; F67-E69 VanDerWaalsContact C-N 3.33Å; F67-E69 PolarHBondContact O-N 3.26Å; F67-L70 HydrophobicContact CD2-CD1 3.88Å; F67-L70 WeakPolarHBondContact O-CB 3.35Å; F67-L70 WeakPolarHBondContact O-CG 3.15Å; F67-L70 PolarHBondContact O-N 3.38Å; F67-R75 HydrophobicContact CD2-CG 4.37Å; F67-R75 HydrophobicContact CE2-CB 3.93Å; F67-R75 HydrophobicContact CE2-CG 3.94Å; F67-R75 HydrophobicContact CZ-CB 3.97Å; F67-R75 HydrophobicContact CZ-CG 4.08Å; F67-R75 WeakPolarHBondContact O-CD 2.95Å; F67-R75 WeakPolarHBondContact O-CG 3.17Å; F67-V78 HydrophobicContact CD2-CG2 3.89Å; F67-V78 HydrophobicContact CE2-CG2 3.51Å; F67-S79 VanDerWaalsContact CE2-OG 3.32Å; F67-S79 WeakPolarHBondContact CE2-OG 3.38Å; F67-S79 WeakPolarHBondContact CZ-OG 3.46Å; F67-L92 HydrophobicContact CB-CD2 3.98Å; F67-L92 HydrophobicContact CD2-CD2 4.48Å
68Q84.6Confident86.2Confident47 Ų4760.7 Ų60.722%0.2232%0.317CS..Hα-helixtrans-65.1-35.8176.7-74.7-178.354.100112.1L6 I64 N65 I66 L70 R75L6-Q68 WeakPolarHBondContact CD2-O 3.29Å; I64-Q68 WeakPolarHBondContact O-CB 3.32Å; I64-Q68 VanDerWaalsContact O-CG 3.25Å; I64-Q68 WeakPolarHBondContact O-CG 3.15Å; I64-Q68 PolarHBondContact O-N 2.91Å; N65-Q68 PolarHBondContact O-N 3.39Å; I66-Q68 VanDerWaalsContact C-N 3.31Å; I66-Q68 PolarHBondContact O-N 3.25Å; Q68-L70 VanDerWaalsContact C-N 3.27Å; Q68-L70 PolarHBondContact O-N 3Å; Q68-R75 PolarHBondContact O-NH1 3.03Å
69E85.8Confident86.5Confident162 Ų16260.1 Ų60.176%0.75732%0.315SS*.Hα-helixtrans-73-15.5178.5-69.7-171.4160.600114.2N65 I66 F67N65-E69 WeakPolarHBondContact O-CG 3.46Å; N65-E69 PolarHBondContact O-N 3Å; I66-E69 PolarHBondContact O-N 2.78Å; F67-E69 VanDerWaalsContact C-N 3.33Å; F67-E69 PolarHBondContact O-N 3.26Å
70L88.2Confident87.2Confident14 Ų1455.2 Ų55.27%0.07329%0.286CS..SBendtrans-62.6149.1-179.4-58.3175.2000112.6I66 F67 Q68 L74 R75 V78 V91I66-L70 HydrophobicContact CG2-CD2 4.48Å; I66-L70 WeakPolarHBondContact O-CG 3.42Å; I66-L70 PolarHBondContact O-N 3.33Å; F67-L70 HydrophobicContact CD2-CD1 3.88Å; F67-L70 WeakPolarHBondContact O-CB 3.35Å; F67-L70 WeakPolarHBondContact O-CG 3.15Å; F67-L70 PolarHBondContact O-N 3.38Å; Q68-L70 VanDerWaalsContact C-N 3.27Å; Q68-L70 PolarHBondContact O-N 3Å; L70-L74 HydrophobicContact CB-CB 4.48Å; L70-L74 HydrophobicContact CB-CD2 4.5Å; L70-L74 HydrophobicContact CD1-CD2 4.42Å; L70-L74 HydrophobicContact CD1-CG 4.28Å; L70-L74 HydrophobicContact CD2-CD2 3.95Å; L70-L74 HydrophobicContact CG-CD2 4.5Å; L70-R75 HydrophobicContact CB-CG 3.68Å; L70-R75 HydrophobicContact CD1-CG 4.38Å; L70-R75 PolarHBondContact O-NH1 3.05Å; L70-V78 HydrophobicContact CD1-CG2 4.42Å; L70-V91 HydrophobicContact CD1-CG1 3.41Å; L70-V91 VanDerWaalsContact CD1-CG1 3.41Å; L70-V91 HydrophobicContact CD2-CG1 3.85Å; L70-V91 HydrophobicContact CG-CG1 4.27Å
71P87.9Confident87.7Confident63 Ų6355.8 Ų55.841%0.40930%0.299SS..  trans-53.3142.8167.6-23.833.3000111.7T73 L74 R75P71-T73 PolarHBondContact O-N 3.1Å; P71-T73 VanDerWaalsContact O-N 3.08Å; P71-L74 PolarHBondContact O-N 2.67Å; P71-R75 PolarHBondContact O-N 3.16Å
72M86.4Confident88Confident113 Ų11355.2 Ų55.256%0.55730%0.295SS*.Hα-helixtrans-52-37.8-178.4179.5-179.7178.400113.2T76M72-T76 WeakPolarHBondContact O-CB 3.31Å; M72-T76 PolarHBondContact O-N 3.47Å; M72-T76 VanDerWaalsContact O-N 3.09Å; M72-T76 PolarHBondContact O-OG1 3.35Å
73T89.3Confident88.3Confident82 Ų8249.7 Ų49.750%0.50327%0.272SS..Hα-helixtrans-64.2-43.8177.449.50000111.5P71 T76 E77 T99P71-T73 PolarHBondContact O-N 3.1Å; P71-T73 VanDerWaalsContact O-N 3.08Å; T73-T76 PolarHBondContact O-N 3.04Å; T73-E77 WeakPolarHBondContact O-CG 3.44Å; T73-E77 PolarHBondContact O-N 3.14Å; T73-E77 VanDerWaalsContact O-N 3.16Å; T73-T99 WeakPolarHBondContact CB-OG1 3.36Å; T73-T99 PolarHBondContact OG1-OG1 3.31Å
74L90.7Very high88.4Confident0 Ų050.2 Ų50.20%028%0.275CS..Hα-helixtrans-70-43.1179.7-17555.8000111.4L70 P71 T76 E77 V78 V91 T99 Y102L70-L74 HydrophobicContact CB-CB 4.48Å; L70-L74 HydrophobicContact CB-CD2 4.5Å; L70-L74 HydrophobicContact CD1-CD2 4.42Å; L70-L74 HydrophobicContact CD1-CG 4.28Å; L70-L74 HydrophobicContact CD2-CD2 3.95Å; L70-L74 HydrophobicContact CG-CD2 4.5Å; P71-L74 PolarHBondContact O-N 2.67Å; L74-T76 PolarHBondContact O-N 2.99Å; L74-E77 PolarHBondContact O-N 3.27Å; L74-V78 HydrophobicContact CD1-CG1 3.93Å; L74-V78 HydrophobicContact CG-CG1 4.34Å; L74-V78 PolarHBondContact O-N 2.94Å; L74-V91 HydrophobicContact CD1-CG2 4.21Å; L74-V91 HydrophobicContact CD2-CG1 4.01Å; L74-V91 HydrophobicContact CG-CG1 4.19Å; L74-T99 PolarHBondContact N-OG1 3.04Å; L74-Y102 HydrophobicContact CD1-CD1 4.25Å; L74-Y102 HydrophobicContact CD1-CD2 4.25Å; L74-Y102 HydrophobicContact CD1-CG 3.75Å
75R89.8Confident88.5Confident24 Ų2453 Ų539%0.09130%0.296CS..Hα-helixtrans-53.9-43.4172.5-67.9-162.2-53.2-108.75.4112.5F67 Q68 L70 P71 E77 S79F67-R75 HydrophobicContact CD2-CG 4.37Å; F67-R75 HydrophobicContact CE2-CB 3.93Å; F67-R75 HydrophobicContact CE2-CG 3.94Å; F67-R75 HydrophobicContact CZ-CB 3.97Å; F67-R75 HydrophobicContact CZ-CG 4.08Å; F67-R75 WeakPolarHBondContact O-CD 2.95Å; F67-R75 WeakPolarHBondContact O-CG 3.17Å; Q68-R75 PolarHBondContact O-NH1 3.03Å; L70-R75 HydrophobicContact CB-CG 3.68Å; L70-R75 HydrophobicContact CD1-CG 4.38Å; L70-R75 PolarHBondContact O-NH1 3.05Å; P71-R75 PolarHBondContact O-N 3.16Å; R75-E77 VanDerWaalsContact C-N 3.3Å; R75-E77 PolarHBondContact O-N 3.01Å; R75-S79 WeakPolarHBondContact O-CB 3.39Å; R75-S79 PolarHBondContact O-N 3.22Å; R75-S79 VanDerWaalsContact O-N 3.13Å; R75-S79 PolarHBondContact O-OG 3.18Å
76T90.5Very high88.6Confident22 Ų2254.4 Ų54.414%0.13530%0.299CS..Hα-helixtrans-66-34179.6-570000112.1N47 M72 T73 L74 K80N47-T76 HydrophobicContact CB-CG2 4.22Å; N47-T76 WeakPolarHBondContact ND2-CG2 3.46Å; M72-T76 WeakPolarHBondContact O-CB 3.31Å; M72-T76 PolarHBondContact O-N 3.47Å; M72-T76 VanDerWaalsContact O-N 3.09Å; M72-T76 PolarHBondContact O-OG1 3.35Å; T73-T76 PolarHBondContact O-N 3.04Å; L74-T76 PolarHBondContact O-N 2.99Å; T76-K80 WeakPolarHBondContact O-CG 3.38Å
77E91.5Very high88.8Confident21 Ų2152.5 Ų52.510%0.09829%0.289CS..Hα-helixtrans-73.7-49.9177.9-67.2-64.9162.400111.5T73 L74 R75 S79 K80 T99 Y102 R103T73-E77 WeakPolarHBondContact O-CG 3.44Å; T73-E77 PolarHBondContact O-N 3.14Å; T73-E77 VanDerWaalsContact O-N 3.16Å; L74-E77 PolarHBondContact O-N 3.27Å; R75-E77 VanDerWaalsContact C-N 3.3Å; R75-E77 PolarHBondContact O-N 3.01Å; E77-S79 VanDerWaalsContact C-N 3.32Å; E77-S79 PolarHBondContact O-N 3.31Å; E77-K80 VanDerWaalsContact CD-NZ 3.25Å; E77-K80 WeakPolarHBondContact O-CB 3.18Å; E77-K80 PolarHBondContact O-N 3.28Å; E77-K80 IonicContact OE1-NZ 3.24Å; E77-K80 PolarHBondContact OE1-NZ 3.18Å; E77-K80 WeakPolarHBondContact OE2-CE 3.36Å; E77-K80 IonicContact OE2-NZ 3.58Å; E77-K80 PolarHBondContact OE2-NZ 3.29Å; E77-T99 HydrophobicContact CG-CG2 3.98Å; E77-Y102 HydrophobicContact CB-CD1 3.79Å; E77-Y102 HydrophobicContact CB-CE1 3.63Å; E77-Y102 HydrophobicContact CG-CD1 4.47Å; E77-R103 IonicContact OE1-CZ 2.8Å; E77-R103 IonicContact OE1-NE 2.8Å; E77-R103 PolarHBondContact OE1-NE 3.42Å; E77-R103 IonicContact OE1-NH2 2.64Å; E77-R103 PolarHBondContact OE1-NH2 3.28Å
78V91.8Very high88.9Confident1 Ų153.1 Ų53.11%0.00629%0.293CS..Hα-helixtrans-69.4-27.5-175.7-55.50000113.6F54 F67 L70 L74 K80 A83 V88 V91 Y102F54-V78 HydrophobicContact CE1-CG2 4Å; F67-V78 HydrophobicContact CD2-CG2 3.89Å; F67-V78 HydrophobicContact CE2-CG2 3.51Å; L70-V78 HydrophobicContact CD1-CG2 4.42Å; L74-V78 HydrophobicContact CD1-CG1 3.93Å; L74-V78 HydrophobicContact CG-CG1 4.34Å; L74-V78 PolarHBondContact O-N 2.94Å; V78-K80 VanDerWaalsContact C-N 3.29Å; V78-K80 PolarHBondContact O-N 3.27Å; V78-A83 WeakPolarHBondContact O-CB 3.36Å; V78-V88 HydrophobicContact CB-CG2 4.31Å; V78-V91 HydrophobicContact CG1-CB 4.05Å; V78-V91 HydrophobicContact CG1-CG1 3.93Å; V78-V91 HydrophobicContact CG1-CG2 3.87Å; V78-Y102 HydrophobicContact CG1-CD2 4.02Å; V78-Y102 HydrophobicContact CG1-CE1 4.47Å; V78-Y102 HydrophobicContact CG1-CE2 3.67Å
79S91.5Very high89.1Confident7 Ų756.1 Ų56.15%0.04931%0.307CS..THydrogen-bonded Turntrans-82.90.4177.7-56.40000113.9N50 F54 F67 R75 E77N50-S79 WeakPolarHBondContact CB-O 3.47Å; F54-S79 VanDerWaalsContact CD1-OG 3.29Å; F54-S79 WeakPolarHBondContact CD1-OG 3.45Å; F67-S79 VanDerWaalsContact CE2-OG 3.32Å; F67-S79 WeakPolarHBondContact CE2-OG 3.38Å; F67-S79 WeakPolarHBondContact CZ-OG 3.46Å; R75-S79 WeakPolarHBondContact O-CB 3.39Å; R75-S79 PolarHBondContact O-N 3.22Å; R75-S79 VanDerWaalsContact O-N 3.13Å; R75-S79 PolarHBondContact O-OG 3.18Å; E77-S79 VanDerWaalsContact C-N 3.32Å; E77-S79 PolarHBondContact O-N 3.31Å
80K91.5Very high89.3Confident65 Ų6551 Ų5128%0.28329%0.285SS..SBendtrans-66.2141.5177.2-73.8172.8-176.2173.80110.1T76 E77 V78 S82 A83T76-K80 WeakPolarHBondContact O-CG 3.38Å; E77-K80 VanDerWaalsContact CD-NZ 3.25Å; E77-K80 WeakPolarHBondContact O-CB 3.18Å; E77-K80 PolarHBondContact O-N 3.28Å; E77-K80 IonicContact OE1-NZ 3.24Å; E77-K80 PolarHBondContact OE1-NZ 3.18Å; E77-K80 WeakPolarHBondContact OE2-CE 3.36Å; E77-K80 IonicContact OE2-NZ 3.58Å; E77-K80 PolarHBondContact OE2-NZ 3.29Å; V78-K80 VanDerWaalsContact C-N 3.29Å; V78-K80 PolarHBondContact O-N 3.27Å; K80-S82 PolarHBondContact O-N 3.11Å; K80-A83 WeakPolarHBondContact O-CB 3.43Å; K80-A83 PolarHBondContact O-N 3.42Å
81P87.8Confident89.4Confident118 Ų11850.3 Ų50.377%0.76628%0.281SS*.THydrogen-bonded Turntrans-58.7-20.6171.4-25.134000114.2
82S87Confident89.5Confident80 Ų8047.9 Ų47.956%0.55927%0.265SS*.THydrogen-bonded Turntrans-94.27.4178.366.60000113.8K80K80-S82 PolarHBondContact O-N 3.11Å
83A88.8Confident89.5Confident19 Ų1945.6 Ų45.616%0.15726%0.26CS..  trans-69138.4-179.900000110.4V78 K80 P85 V88 Y102V78-A83 WeakPolarHBondContact O-CB 3.36Å; K80-A83 WeakPolarHBondContact O-CB 3.43Å; K80-A83 PolarHBondContact O-N 3.42Å; A83-P85 WeakPolarHBondContact O-CD 3.24Å; A83-V88 HydrophobicContact CB-CG2 3.69Å; A83-Y102 WeakPolarHBondContact CB-OH 3.45Å
84Q87.4Confident89.3Confident42 Ų4242.8 Ų42.820%0.19625%0.247CC..  trans-73.1121.4177.4-73.9-73.125.400109.9E86 A87 V88 E106 L109 D113Q84-E86 VanDerWaalsContact C-N 3.3Å; Q84-E86 PolarHBondContact O-N 3.26Å; Q84-A87 HydrophobicContact CB-CB 4.21Å; Q84-A87 PolarHBondContact O-N 3.47Å; Q84-V88 WeakPolarHBondContact O-CG2 3.38Å; Q84-V88 PolarHBondContact O-N 2.66Å; Q84-V88 VanDerWaalsContact O-N 3.08Å; Q84-E106 HydrophobicContact CB-CG 4.42Å; Q84-E106 HydrophobicContact CG-CG 3.95Å; Q84-L109 HydrophobicContact CB-CD1 4.14Å; Q84-L109 HydrophobicContact CG-CB 4.48Å; Q84-D113 PolarHBondContact NE2-OD2 3.12Å; Q84-D113 VanDerWaalsContact NE2-OD2 3.09Å
85P87.9Confident89.2Confident99 Ų9948.5 Ų48.564%0.64328%0.278SS*.Hα-helixtrans-53.9-42.5-174.9-27.934.7000113.8A83 A87 V88 E89A83-P85 WeakPolarHBondContact O-CD 3.24Å; P85-A87 VanDerWaalsContact C-N 3.34Å; P85-A87 PolarHBondContact O-N 3.22Å; P85-V88 WeakPolarHBondContact O-CB 3.24Å; P85-V88 PolarHBondContact O-N 3.2Å; P85-V88 VanDerWaalsContact O-N 3.16Å; P85-E89 PolarHBondContact O-N 3.23Å
86E86.9Confident89.1Confident123 Ų12348.2 Ų48.258%0.57528%0.278SS*.Hα-helixtrans-61.4-39.4178.5-174.5-178173.700112.5Q84 L90 L109Q84-E86 VanDerWaalsContact C-N 3.3Å; Q84-E86 PolarHBondContact O-N 3.26Å; E86-L90 PolarHBondContact O-N 3.41Å; E86-L109 HydrophobicContact CB-CD1 4Å; E86-L109 HydrophobicContact CG-CD1 4.32Å; E86-L109 VanDerWaalsContact OE2-CD2 3.22Å; E86-L109 WeakPolarHBondContact OE2-CD2 3.45Å
87A90.4Very high88.7Confident0 Ų054.2 Ų54.20%030%0.302CS..Hα-helixtrans-72.9-30.9177.200000112.4Q84 P85 V91 Y102 L105 L109Q84-A87 HydrophobicContact CB-CB 4.21Å; Q84-A87 PolarHBondContact O-N 3.47Å; P85-A87 VanDerWaalsContact C-N 3.34Å; P85-A87 PolarHBondContact O-N 3.22Å; A87-V91 WeakPolarHBondContact O-CG2 3.25Å; A87-V91 PolarHBondContact O-N 3.22Å; A87-Y102 HydrophobicContact CB-CD2 4.22Å; A87-Y102 HydrophobicContact CB-CE2 3.7Å; A87-L105 HydrophobicContact CB-CD2 3.73Å; A87-L105 HydrophobicContact CB-CG 4.18Å; A87-L109 HydrophobicContact CB-CD1 4.06Å
88V91.5Very high88.6Confident13 Ų1356.1 Ų56.18%0.07932%0.315CS..Hα-helixtrans-68.2-44.3176.41740000110.6F54 V78 A83 Q84 P85 L90 V91 L92F54-V88 HydrophobicContact CE1-CG1 4.5Å; F54-V88 HydrophobicContact CE2-CG1 3.82Å; F54-V88 HydrophobicContact CZ-CG1 3.37Å; V78-V88 HydrophobicContact CB-CG2 4.31Å; A83-V88 HydrophobicContact CB-CG2 3.69Å; Q84-V88 WeakPolarHBondContact O-CG2 3.38Å; Q84-V88 PolarHBondContact O-N 2.66Å; Q84-V88 VanDerWaalsContact O-N 3.08Å; P85-V88 WeakPolarHBondContact O-CB 3.24Å; P85-V88 PolarHBondContact O-N 3.2Å; P85-V88 VanDerWaalsContact O-N 3.16Å; V88-L90 VanDerWaalsContact C-N 3.29Å; V88-L90 PolarHBondContact O-N 3.48Å; V88-V91 WeakPolarHBondContact O-CB 3.42Å; V88-V91 PolarHBondContact O-N 3.03Å; V88-L92 HydrophobicContact CG1-CD1 3.98Å; V88-L92 HydrophobicContact CG1-CG 4.26Å; V88-L92 WeakPolarHBondContact O-CG 3.43Å; V88-L92 PolarHBondContact O-N 3.32Å
89E89.3Confident88.5Confident110 Ų11057.1 Ų57.151%0.51432%0.321SS..Hα-helixtrans-57-42.2177.3-16468.6-159.300111.9P85 V91 L92 S93P85-E89 PolarHBondContact O-N 3.23Å; E89-V91 VanDerWaalsContact C-N 3.27Å; E89-V91 PolarHBondContact O-N 3.45Å; E89-L92 PolarHBondContact O-N 2.83Å; E89-S93 WeakPolarHBondContact O-CB 3.48Å; E89-S93 PolarHBondContact O-N 2.76Å; E89-S93 PolarHBondContact O-OG 2.96Å
90L89.3Confident88.4Confident55 Ų5565.2 Ų65.229%0.28836%0.355SS..Hα-helixtrans-67.5-24.8176.7-72.2169.6000113.6E86 V88 S93 D95 I96 L105E86-L90 PolarHBondContact O-N 3.41Å; V88-L90 VanDerWaalsContact C-N 3.29Å; V88-L90 PolarHBondContact O-N 3.48Å; L90-S93 VanDerWaalsContact CA-OG 3.28Å; L90-S93 WeakPolarHBondContact CA-OG 3.47Å; L90-S93 PolarHBondContact O-OG 3.06Å; L90-D95 HydrophobicContact CD2-CB 4.37Å; L90-D95 WeakPolarHBondContact O-CB 3.35Å; L90-D95 PolarHBondContact O-N 3.34Å; L90-D95 VanDerWaalsContact O-N 3.11Å; L90-I96 HydrophobicContact CB-CD1 3.66Å; L90-I96 HydrophobicContact CB-CG1 4.12Å; L90-I96 HydrophobicContact CD1-CD1 4.38Å; L90-I96 PolarHBondContact O-N 3.02Å; L90-I96 VanDerWaalsContact O-N 3.08Å; L90-L105 HydrophobicContact CD1-CD2 3.5Å; L90-L105 VanDerWaalsContact CD1-CD2 3.5Å
91V91.1Very high88.4Confident0 Ų066.8 Ų66.80%036%0.364CS..Hα-helixtrans-78.6-41.1171.2175.10000110.6L70 L74 V78 A87 V88 E89 S93 G94 I96 Y102L70-V91 HydrophobicContact CD1-CG1 3.41Å; L70-V91 VanDerWaalsContact CD1-CG1 3.41Å; L70-V91 HydrophobicContact CD2-CG1 3.85Å; L70-V91 HydrophobicContact CG-CG1 4.27Å; L74-V91 HydrophobicContact CD1-CG2 4.21Å; L74-V91 HydrophobicContact CD2-CG1 4.01Å; L74-V91 HydrophobicContact CG-CG1 4.19Å; V78-V91 HydrophobicContact CG1-CB 4.05Å; V78-V91 HydrophobicContact CG1-CG1 3.93Å; V78-V91 HydrophobicContact CG1-CG2 3.87Å; A87-V91 WeakPolarHBondContact O-CG2 3.25Å; A87-V91 PolarHBondContact O-N 3.22Å; V88-V91 WeakPolarHBondContact O-CB 3.42Å; V88-V91 PolarHBondContact O-N 3.03Å; E89-V91 VanDerWaalsContact C-N 3.27Å; E89-V91 PolarHBondContact O-N 3.45Å; V91-S93 VanDerWaalsContact C-N 3.34Å; V91-G94 PolarHBondContact O-N 2.83Å; V91-G94 VanDerWaalsContact O-N 3.12Å; V91-I96 HydrophobicContact CG2-CB 3.75Å; V91-I96 HydrophobicContact CG2-CG2 3.8Å; V91-Y102 HydrophobicContact CG2-CD2 3.5Å; V91-Y102 HydrophobicContact CG2-CE2 4.08Å; V91-Y102 HydrophobicContact CG2-CG 4.39Å
92L89.1Confident88.6Confident11 Ų1161.2 Ų61.26%0.05833%0.327CS..Hα-helixtrans-72.2-25-179-65.3-180000113.5F54 M58 Q63 I66 F67 V88 E89 G94F54-L92 HydrophobicContact CE1-CD2 4.38Å; F54-L92 HydrophobicContact CZ-CD1 4.18Å; M58-L92 HydrophobicContact CE-CD1 4.04Å; M58-L92 HydrophobicContact CE-CD2 3.66Å; Q63-L92 HydrophobicContact CG-CB 4.35Å; I66-L92 WeakPolarHBondContact CD1-O 3.45Å; F67-L92 HydrophobicContact CB-CD2 3.98Å; F67-L92 HydrophobicContact CD2-CD2 4.48Å; V88-L92 HydrophobicContact CG1-CD1 3.98Å; V88-L92 HydrophobicContact CG1-CG 4.26Å; V88-L92 WeakPolarHBondContact O-CG 3.43Å; V88-L92 PolarHBondContact O-N 3.32Å; E89-L92 PolarHBondContact O-N 2.83Å; L92-G94 VanDerWaalsContact C-N 3.29Å
93S87.5Confident88.8Confident66 Ų6664 Ų6446%0.46233%0.326SS..THydrogen-bonded Turntrans-79-10169.350.70000113.6E89 L90 V91E89-S93 WeakPolarHBondContact O-CB 3.48Å; E89-S93 PolarHBondContact O-N 2.76Å; E89-S93 PolarHBondContact O-OG 2.96Å; L90-S93 VanDerWaalsContact CA-OG 3.28Å; L90-S93 WeakPolarHBondContact CA-OG 3.47Å; L90-S93 PolarHBondContact O-OG 3.06Å; V91-S93 VanDerWaalsContact C-N 3.34Å
94G84.6Confident88.9Confident22 Ų2267.6 Ų67.623%0.22734%0.339CS..THydrogen-bonded Turntrans865.9178.200000115.3V91 L92 K97V91-G94 PolarHBondContact O-N 2.83Å; V91-G94 VanDerWaalsContact O-N 3.12Å; L92-G94 VanDerWaalsContact C-N 3.29Å; G94-K97 WeakPolarHBondContact O-CE 3.43Å
95D88.4Confident89.1Confident121 Ų12167.3 Ų67.365%0.64734%0.339SS*.SBendtrans-70.9-32.4177.3-73.3-27.9000112.3L90L90-D95 HydrophobicContact CD2-CB 4.37Å; L90-D95 WeakPolarHBondContact O-CB 3.35Å; L90-D95 PolarHBondContact O-N 3.34Å; L90-D95 VanDerWaalsContact O-N 3.11Å
96I87.5Confident89.2Confident17 Ų1763.8 Ų63.89%0.08731%0.314CS..  trans-111111.2178.7-61.5176.4000110L90 V91 E101 L105L90-I96 HydrophobicContact CB-CD1 3.66Å; L90-I96 HydrophobicContact CB-CG1 4.12Å; L90-I96 HydrophobicContact CD1-CD1 4.38Å; L90-I96 PolarHBondContact O-N 3.02Å; L90-I96 VanDerWaalsContact O-N 3.08Å; V91-I96 HydrophobicContact CG2-CB 3.75Å; V91-I96 HydrophobicContact CG2-CG2 3.8Å; I96-E101 HydrophobicContact CG2-CB 3.83Å; I96-L105 HydrophobicContact CD1-CB 4.5Å; I96-L105 HydrophobicContact CD1-CD2 3.45Å; I96-L105 VanDerWaalsContact CD1-CD2 3.45Å
97K82.3Confident89.3Confident149 Ų14964.8 Ų64.865%0.64832%0.316SS*.  trans-107-10.6-176.5-64.1-177.8-177.5177.30113.5G94G94-K97 WeakPolarHBondContact O-CE 3.43Å
98T89.3Confident89.3Confident60 Ų6069.5 Ų69.537%0.36834%0.338SS..SBendtrans-120.2147.3-176.677.10000112.9K100 E101 Y102T98-K100 PolarHBondContact O-N 3.15Å; T98-E101 WeakPolarHBondContact CB-OE2 3.23Å; T98-E101 WeakPolarHBondContact CG2-OE2 3.46Å; T98-E101 PolarHBondContact N-OE2 3.09Å; T98-E101 PolarHBondContact O-N 3.4Å; T98-E101 WeakPolarHBondContact OG1-CB 3.29Å; T98-E101 VanDerWaalsContact OG1-CG 3.24Å; T98-E101 WeakPolarHBondContact OG1-CG 3.48Å; T98-E101 PolarHBondContact OG1-N 2.9Å; T98-E101 PolarHBondContact OG1-OE2 3.02Å; T98-Y102 PolarHBondContact O-N 3.03Å
99T89.8Confident89.2Confident22 Ų2269.5 Ų69.514%0.13534%0.338CS..Hα-helixtrans-63.2-25174.7-49.90000112.7T73 L74 E77 R103T73-T99 WeakPolarHBondContact CB-OG1 3.36Å; T73-T99 PolarHBondContact OG1-OG1 3.31Å; L74-T99 PolarHBondContact N-OG1 3.04Å; E77-T99 HydrophobicContact CG-CG2 3.98Å; T99-R103 WeakPolarHBondContact O-CG 3.46Å; T99-R103 PolarHBondContact O-N 3.12Å
100K90.1Very high89.2Confident177 Ų17768.2 Ų68.277%0.7733%0.331SS*.Hα-helixtrans-72.1-47.1179.5-173.2-178176.2-172.70111.2T98 R103 E104T98-K100 PolarHBondContact O-N 3.15Å; K100-R103 PolarHBondContact O-N 2.94Å; K100-E104 PolarHBondContact O-N 3.35Å
101E90.1Very high89.2Confident99 Ų9971.8 Ų71.846%0.46334%0.344SS..Hα-helixtrans-61.5-45.6176.7-71.9158.7159.300111.1I96 T98 R103 E104 L105I96-E101 HydrophobicContact CG2-CB 3.83Å; T98-E101 WeakPolarHBondContact CB-OE2 3.23Å; T98-E101 WeakPolarHBondContact CG2-OE2 3.46Å; T98-E101 PolarHBondContact N-OE2 3.09Å; T98-E101 PolarHBondContact O-N 3.4Å; T98-E101 WeakPolarHBondContact OG1-CB 3.29Å; T98-E101 VanDerWaalsContact OG1-CG 3.24Å; T98-E101 WeakPolarHBondContact OG1-CG 3.48Å; T98-E101 PolarHBondContact OG1-N 2.9Å; T98-E101 PolarHBondContact OG1-OE2 3.02Å; E101-R103 PolarHBondContact O-N 3.46Å; E101-E104 PolarHBondContact O-N 2.92Å; E101-L105 PolarHBondContact O-N 3.16Å
102Y93.3Very high89Confident0 Ų077.8 Ų77.80%037%0.37CS..Hα-helixtrans-57.2-48.2177.6-179.5-99.8000113L74 E77 V78 A83 A87 V91 T98 E104 L105 E106L74-Y102 HydrophobicContact CD1-CD1 4.25Å; L74-Y102 HydrophobicContact CD1-CD2 4.25Å; L74-Y102 HydrophobicContact CD1-CG 3.75Å; E77-Y102 HydrophobicContact CB-CD1 3.79Å; E77-Y102 HydrophobicContact CB-CE1 3.63Å; E77-Y102 HydrophobicContact CG-CD1 4.47Å; V78-Y102 HydrophobicContact CG1-CD2 4.02Å; V78-Y102 HydrophobicContact CG1-CE1 4.47Å; V78-Y102 HydrophobicContact CG1-CE2 3.67Å; A83-Y102 WeakPolarHBondContact CB-OH 3.45Å; A87-Y102 HydrophobicContact CB-CD2 4.22Å; A87-Y102 HydrophobicContact CB-CE2 3.7Å; V91-Y102 HydrophobicContact CG2-CD2 3.5Å; V91-Y102 HydrophobicContact CG2-CE2 4.08Å; V91-Y102 HydrophobicContact CG2-CG 4.39Å; T98-Y102 PolarHBondContact O-N 3.03Å; Y102-E104 VanDerWaalsContact C-N 3.33Å; Y102-E104 PolarHBondContact O-N 3.23Å; Y102-L105 PolarHBondContact O-N 3.08Å; Y102-E106 PolarHBondContact O-N 3.39Å
103R90.3Very high88.9Confident139 Ų13980.6 Ų80.653%0.52539%0.385SS..Hα-helixtrans-65.2-35.6-179.6-76.7179.2176.8176.70.6113.1E77 T99 K100 E101 K107E77-R103 IonicContact OE1-CZ 2.8Å; E77-R103 IonicContact OE1-NE 2.8Å; E77-R103 PolarHBondContact OE1-NE 3.42Å; E77-R103 IonicContact OE1-NH2 2.64Å; E77-R103 PolarHBondContact OE1-NH2 3.28Å; T99-R103 WeakPolarHBondContact O-CG 3.46Å; T99-R103 PolarHBondContact O-N 3.12Å; K100-R103 PolarHBondContact O-N 2.94Å; E101-R103 PolarHBondContact O-N 3.46Å; R103-K107 WeakPolarHBondContact O-CB 3.48Å; R103-K107 PolarHBondContact O-N 3.39Å; R103-K107 VanDerWaalsContact O-N 3.14Å
104E91.2Very high88.9Confident95 Ų9583.2 Ų83.244%0.44439%0.39SS..Hα-helixtrans-68.9-42.4177.2-175.356.5-147.900110.7K100 E101 Y102 K107 Q108K100-E104 PolarHBondContact O-N 3.35Å; E101-E104 PolarHBondContact O-N 2.92Å; Y102-E104 VanDerWaalsContact C-N 3.33Å; Y102-E104 PolarHBondContact O-N 3.23Å; E104-K107 PolarHBondContact O-N 3.01Å; E104-Q108 WeakPolarHBondContact O-CG 3.47Å; E104-Q108 PolarHBondContact O-N 3.2Å; E104-Q108 PolarHBondContact OE1-NE2 3Å; E104-Q108 VanDerWaalsContact OE1-NE2 3.16Å
105L91.4Very high89Confident35 Ų3587 Ų8718%0.18340%0.402CS..Hα-helixtrans-62.8-47.5175.6-178.166.5000111.9A87 L90 I96 E101 Y102 K107 Q108 L109A87-L105 HydrophobicContact CB-CD2 3.73Å; A87-L105 HydrophobicContact CB-CG 4.18Å; L90-L105 HydrophobicContact CD1-CD2 3.5Å; L90-L105 VanDerWaalsContact CD1-CD2 3.5Å; I96-L105 HydrophobicContact CD1-CB 4.5Å; I96-L105 HydrophobicContact CD1-CD2 3.45Å; I96-L105 VanDerWaalsContact CD1-CD2 3.45Å; E101-L105 PolarHBondContact O-N 3.16Å; Y102-L105 PolarHBondContact O-N 3.08Å; L105-K107 PolarHBondContact O-N 3.36Å; L105-Q108 PolarHBondContact O-N 3.08Å; L105-L109 HydrophobicContact CD1-CG 4.4Å; L105-L109 HydrophobicContact CG-CD1 4.22Å; L105-L109 HydrophobicContact CG-CG 4.45Å; L105-L109 WeakPolarHBondContact O-CG 3.28Å; L105-L109 PolarHBondContact O-N 3.11Å
106E89.9Confident88.9Confident25 Ų2585.8 Ų85.812%0.11739%0.394CS..Hα-helixtrans-58.2-38.8178.6-164.2-161.4152.400111.5Q84 Y102 K110Q84-E106 HydrophobicContact CB-CG 4.42Å; Q84-E106 HydrophobicContact CG-CG 3.95Å; Y102-E106 PolarHBondContact O-N 3.39Å; E106-K110 WeakPolarHBondContact O-CB 3.46Å; E106-K110 WeakPolarHBondContact O-CG 3.47Å; E106-K110 PolarHBondContact O-N 3.04Å; E106-K110 WeakPolarHBondContact OE1-CE 3.03Å; E106-K110 IonicContact OE1-NZ 3.34Å; E106-K110 PolarHBondContact OE1-NZ 2.95Å
107K90.1Very high88.8Confident145 Ų14590 Ų9063%0.6342%0.417SS*.Hα-helixtrans-66.6-39.1175.9-173.7-177.4178.3-171.80112.2R103 E104 L105 K111R103-K107 WeakPolarHBondContact O-CB 3.48Å; R103-K107 PolarHBondContact O-N 3.39Å; R103-K107 VanDerWaalsContact O-N 3.14Å; E104-K107 PolarHBondContact O-N 3.01Å; L105-K107 PolarHBondContact O-N 3.36Å; K107-K111 WeakPolarHBondContact O-CB 3.45Å; K107-K111 PolarHBondContact O-N 3.35Å; K107-K111 VanDerWaalsContact O-N 3.1Å
108Q89.7Confident89Confident98 Ų9887.4 Ų87.446%0.45841%0.41SS..Hα-helixtrans-68.7-42.3177.6-72.7177.82100112E104 L105 K111 K112E104-Q108 WeakPolarHBondContact O-CG 3.47Å; E104-Q108 PolarHBondContact O-N 3.2Å; E104-Q108 PolarHBondContact OE1-NE2 3Å; E104-Q108 VanDerWaalsContact OE1-NE2 3.16Å; L105-Q108 PolarHBondContact O-N 3.08Å; Q108-K111 PolarHBondContact O-N 2.88Å; Q108-K112 PolarHBondContact O-N 3.25Å
109L90Very high88.6Confident13 Ų1389.7 Ų89.77%0.06842%0.419CS..Hα-helixtrans-62.2-48.8176.2-68.6177.1000111.1Q84 E86 A87 L105 K111 K112 D113Q84-L109 HydrophobicContact CB-CD1 4.14Å; Q84-L109 HydrophobicContact CG-CB 4.48Å; E86-L109 HydrophobicContact CB-CD1 4Å; E86-L109 HydrophobicContact CG-CD1 4.32Å; E86-L109 VanDerWaalsContact OE2-CD2 3.22Å; E86-L109 WeakPolarHBondContact OE2-CD2 3.45Å; A87-L109 HydrophobicContact CB-CD1 4.06Å; L105-L109 HydrophobicContact CD1-CG 4.4Å; L105-L109 HydrophobicContact CG-CD1 4.22Å; L105-L109 HydrophobicContact CG-CG 4.45Å; L105-L109 WeakPolarHBondContact O-CG 3.28Å; L105-L109 PolarHBondContact O-N 3.11Å; L109-K111 VanDerWaalsContact C-N 3.29Å; L109-K111 PolarHBondContact O-N 3.19Å; L109-K112 WeakPolarHBondContact O-CB 3.49Å; L109-K112 PolarHBondContact O-N 3.19Å; L109-D113 PolarHBondContact O-N 3.26Å
110K89.2Confident88.2Confident84 Ų8491.1 Ų91.137%0.36543%0.43SS..Hα-helixtrans-56.4-41.9175.1-78.2175.7171.1167.20113.1E106 K112 D113 E114E106-K110 WeakPolarHBondContact O-CB 3.46Å; E106-K110 WeakPolarHBondContact O-CG 3.47Å; E106-K110 PolarHBondContact O-N 3.04Å; E106-K110 WeakPolarHBondContact OE1-CE 3.03Å; E106-K110 IonicContact OE1-NZ 3.34Å; E106-K110 PolarHBondContact OE1-NZ 2.95Å; K110-K112 VanDerWaalsContact C-N 3.32Å; K110-K112 PolarHBondContact O-N 3.35Å; K110-D113 PolarHBondContact O-N 3.12Å; K110-E114 WeakPolarHBondContact O-CB 3.38Å; K110-E114 VanDerWaalsContact O-CG 3.31Å; K110-E114 WeakPolarHBondContact O-CG 3.44Å; K110-E114 PolarHBondContact O-N 3.13Å
111K89.5Confident87.8Confident130 Ų13088.5 Ų88.557%0.56542%0.421SS*.Hα-helixtrans-65.2-36.1177-171.9-179.7179-174.90112.2K107 Q108 L109 Q115K107-K111 WeakPolarHBondContact O-CB 3.45Å; K107-K111 PolarHBondContact O-N 3.35Å; K107-K111 VanDerWaalsContact O-N 3.1Å; Q108-K111 PolarHBondContact O-N 2.88Å; L109-K111 VanDerWaalsContact C-N 3.29Å; L109-K111 PolarHBondContact O-N 3.19Å; K111-Q115 WeakPolarHBondContact O-CB 3.08Å; K111-Q115 VanDerWaalsContact O-CG 3.23Å; K111-Q115 WeakPolarHBondContact O-CG 3.2Å; K111-Q115 PolarHBondContact O-N 3.4Å
112K85.4Confident87.3Confident125 Ų12587.5 Ų87.554%0.54342%0.421SS..Hα-helixtrans-69.7-43.2175.7-76.2-175.4179177.80111.5Q108 L109 K110 Q115 I116Q108-K112 PolarHBondContact O-N 3.25Å; L109-K112 WeakPolarHBondContact O-CB 3.49Å; L109-K112 PolarHBondContact O-N 3.19Å; K110-K112 VanDerWaalsContact C-N 3.32Å; K110-K112 PolarHBondContact O-N 3.35Å; K112-Q115 WeakPolarHBondContact O-CB 3.39Å; K112-Q115 PolarHBondContact O-N 3.16Å; K112-Q115 VanDerWaalsContact O-N 3.15Å; K112-I116 WeakPolarHBondContact O-CG1 3.26Å; K112-I116 PolarHBondContact O-N 3.49Å
113D87.2Confident86.5Confident70 Ų7092.6 Ų92.637%0.37445%0.447SS..Hα-helixtrans-59.9-47.5175.7-66.8-24000110.5Q84 L109 K110 Q115 I116 D117Q84-D113 PolarHBondContact NE2-OD2 3.12Å; Q84-D113 VanDerWaalsContact NE2-OD2 3.09Å; L109-D113 PolarHBondContact O-N 3.26Å; K110-D113 PolarHBondContact O-N 3.12Å; D113-Q115 VanDerWaalsContact C-N 3.29Å; D113-Q115 PolarHBondContact O-N 3.35Å; D113-I116 PolarHBondContact O-N 2.91Å; D113-I116 VanDerWaalsContact O-N 3.12Å; D113-D117 WeakPolarHBondContact O-CB 3.33Å; D113-D117 PolarHBondContact O-N 3.45Å
114E88.1Confident85.9Confident121 Ų12190.9 Ų90.957%0.56545%0.449SS*.Hα-helixtrans-58.7-39174.1-74.3171.5-17300112.2K110 N118K110-E114 WeakPolarHBondContact O-CB 3.38Å; K110-E114 VanDerWaalsContact O-CG 3.31Å; K110-E114 WeakPolarHBondContact O-CG 3.44Å; K110-E114 PolarHBondContact O-N 3.13Å; E114-N118 VanDerWaalsContact O-CB 3.29Å; E114-N118 WeakPolarHBondContact O-CB 3.26Å; E114-N118 PolarHBondContact O-N 2.84Å; E114-N118 PolarHBondContact O-ND2 3.24Å
115Q85.5Confident85Confident103 Ų10391.1 Ų91.148%0.48145%0.453SS..Hα-helixtrans-67.5-40.3176.1-78177.1-22.100112.1K111 K112 D113 L119K111-Q115 WeakPolarHBondContact O-CB 3.08Å; K111-Q115 VanDerWaalsContact O-CG 3.23Å; K111-Q115 WeakPolarHBondContact O-CG 3.2Å; K111-Q115 PolarHBondContact O-N 3.4Å; K112-Q115 WeakPolarHBondContact O-CB 3.39Å; K112-Q115 PolarHBondContact O-N 3.16Å; K112-Q115 VanDerWaalsContact O-N 3.15Å; D113-Q115 VanDerWaalsContact C-N 3.29Å; D113-Q115 PolarHBondContact O-N 3.35Å; Q115-L119 VanDerWaalsContact O-CB 3.32Å; Q115-L119 WeakPolarHBondContact O-CB 3.48Å; Q115-L119 WeakPolarHBondContact O-CG 3.29Å; Q115-L119 PolarHBondContact O-N 3.41Å
116I86.3Confident83.6Confident95 Ų9595.9 Ų95.949%0.48748%0.476SS..Hα-helixtrans-67-43.1177.4-71.4161.5000110.3K112 D113 L119 S120K112-I116 WeakPolarHBondContact O-CG1 3.26Å; K112-I116 PolarHBondContact O-N 3.49Å; D113-I116 PolarHBondContact O-N 2.91Å; D113-I116 VanDerWaalsContact O-N 3.12Å; I116-L119 PolarHBondContact O-N 3.24Å; I116-S120 VanDerWaalsContact O-CB 3.29Å; I116-S120 WeakPolarHBondContact O-CB 3.21Å; I116-S120 PolarHBondContact O-N 2.92Å; I116-S120 PolarHBondContact O-OG 2.81Å
117D86.7Confident82.2Confident106 Ų10699.3 Ų99.357%0.56750%0.503SS*.Hα-helixtrans-63.7-46.8177-74.8-15000111.1D113 L119 S120 E121D113-D117 WeakPolarHBondContact O-CB 3.33Å; D113-D117 PolarHBondContact O-N 3.45Å; D117-L119 PolarHBondContact O-N 2.81Å; D117-S120 PolarHBondContact O-N 3.42Å; D117-E121 WeakPolarHBondContact O-CB 3.32Å; D117-E121 PolarHBondContact O-N 3.18Å
118N85.5Confident80.8Confident94 Ų9498.2 Ų98.250%0.50351%0.508SS..Hα-helixtrans-60.9-42.4175.1-76.2-49.8000112E114 S120 E121 V122E114-N118 VanDerWaalsContact O-CB 3.29Å; E114-N118 WeakPolarHBondContact O-CB 3.26Å; E114-N118 PolarHBondContact O-N 2.84Å; E114-N118 PolarHBondContact O-ND2 3.24Å; N118-S120 VanDerWaalsContact C-N 3.33Å; N118-E121 PolarHBondContact O-N 2.84Å; N118-V122 VanDerWaalsContact O-CG2 3.26Å; N118-V122 WeakPolarHBondContact O-CG2 3.22Å; N118-V122 PolarHBondContact O-N 2.92Å
119L81.9Confident79.2Confident108 Ų108100.2 Ų100.257%0.56552%0.517SS*.Hα-helixtrans-66.4-37.4176.3-76.4169.6000111.5Q115 I116 D117 V122 I123Q115-L119 VanDerWaalsContact O-CB 3.32Å; Q115-L119 WeakPolarHBondContact O-CB 3.48Å; Q115-L119 WeakPolarHBondContact O-CG 3.29Å; Q115-L119 PolarHBondContact O-N 3.41Å; I116-L119 PolarHBondContact O-N 3.24Å; D117-L119 PolarHBondContact O-N 2.81Å; L119-V122 PolarHBondContact O-N 3.35Å; L119-I123 WeakPolarHBondContact O-CB 3.2Å; L119-I123 WeakPolarHBondContact O-CG1 3.4Å; L119-I123 PolarHBondContact O-N 3.39Å
120S81.1Confident77.2Confident52 Ų52108 Ų10836%0.36455%0.553SS.*Hα-helixtrans-67.4-38.4176.9-600000111.3I116 D117 N118 I123 N124I116-S120 VanDerWaalsContact O-CB 3.29Å; I116-S120 WeakPolarHBondContact O-CB 3.21Å; I116-S120 PolarHBondContact O-N 2.92Å; I116-S120 PolarHBondContact O-OG 2.81Å; D117-S120 PolarHBondContact O-N 3.42Å; N118-S120 VanDerWaalsContact C-N 3.33Å; S120-I123 PolarHBondContact O-N 2.83Å; S120-N124 WeakPolarHBondContact O-CB 3.47Å; S120-N124 VanDerWaalsContact O-CG 3.31Å; S120-N124 PolarHBondContact O-N 2.87Å; S120-N124 PolarHBondContact O-ND2 2.86Å
121E81.6Confident75.3Confident121 Ų121109.4 Ų109.457%0.56557%0.571SS**Hα-helixtrans-64.5-46.4172.2-169.5173.4-164.700111D117 N118 I123 N124 D125D117-E121 WeakPolarHBondContact O-CB 3.32Å; D117-E121 PolarHBondContact O-N 3.18Å; N118-E121 PolarHBondContact O-N 2.84Å; E121-I123 VanDerWaalsContact C-N 3.35Å; E121-I123 PolarHBondContact O-N 3.47Å; E121-N124 PolarHBondContact O-N 3.43Å; E121-D125 WeakPolarHBondContact O-CB 3.41Å; E121-D125 PolarHBondContact O-N 2.85Å
122V78.6Confident73.4Confident79 Ų79113.7 Ų113.748%0.47958%0.584SS.*Hα-helixtrans-60.5-42.5175.3170.70000111.7N118 L119 D125 M126N118-V122 VanDerWaalsContact O-CG2 3.26Å; N118-V122 WeakPolarHBondContact O-CG2 3.22Å; N118-V122 PolarHBondContact O-N 2.92Å; L119-V122 PolarHBondContact O-N 3.35Å; V122-D125 PolarHBondContact O-N 3.06Å; V122-M126 HydrophobicContact CG1-CG 4.35Å; V122-M126 HydrophobicContact CG1-SD 3.91Å; V122-M126 VanDerWaalsContact O-CB 3.26Å; V122-M126 WeakPolarHBondContact O-CB 3.46Å; V122-M126 WeakPolarHBondContact O-CG 3.35Å; V122-M126 PolarHBondContact O-N 2.74Å
123I76.5Confident71.7Confident106 Ų106113.6 Ų113.654%0.54459%0.594SS.*Hα-helixtrans-66.4-41.9177.5-71.4165.9000110.7L119 S120 E121 M126 S127L119-I123 WeakPolarHBondContact O-CB 3.2Å; L119-I123 WeakPolarHBondContact O-CG1 3.4Å; L119-I123 PolarHBondContact O-N 3.39Å; S120-I123 PolarHBondContact O-N 2.83Å; E121-I123 VanDerWaalsContact C-N 3.35Å; E121-I123 PolarHBondContact O-N 3.47Å; I123-M126 PolarHBondContact O-N 3.43Å; I123-S127 VanDerWaalsContact O-CB 3.25Å; I123-S127 WeakPolarHBondContact O-CB 3.49Å; I123-S127 PolarHBondContact O-N 3.47Å
124N77.6Confident69.9Low104 Ų104117.3 Ų117.356%0.55661%0.612SS**Hα-helixtrans-64.8-44.9176.2-79.1-30.6000111.4S120 E121 M126 S127 V128S120-N124 WeakPolarHBondContact O-CB 3.47Å; S120-N124 VanDerWaalsContact O-CG 3.31Å; S120-N124 PolarHBondContact O-N 2.87Å; S120-N124 PolarHBondContact O-ND2 2.86Å; E121-N124 PolarHBondContact O-N 3.43Å; N124-M126 VanDerWaalsContact C-N 3.35Å; N124-M126 PolarHBondContact O-N 2.94Å; N124-S127 WeakPolarHBondContact O-CB 3.32Å; N124-S127 PolarHBondContact O-N 3.12Å; N124-S127 VanDerWaalsContact O-N 3.12Å; N124-V128 VanDerWaalsContact O-CG2 3.32Å; N124-V128 WeakPolarHBondContact O-CG2 3.49Å; N124-V128 PolarHBondContact O-N 2.86Å
125D72.5Confident67.9Low100 Ų100119.8 Ų119.854%0.53562%0.623SS.*Hα-helixtrans-62.4-40.4175-87.91.9000111.9E121 V122 S127 V128 Q129E121-D125 WeakPolarHBondContact O-CB 3.41Å; E121-D125 PolarHBondContact O-N 2.85Å; V122-D125 PolarHBondContact O-N 3.06Å; D125-S127 VanDerWaalsContact C-N 3.31Å; D125-S127 PolarHBondContact O-N 3.15Å; D125-V128 PolarHBondContact O-N 3.46Å; D125-Q129 WeakPolarHBondContact O-CG 3.25Å; D125-Q129 PolarHBondContact O-N 3.4Å; D125-Q129 VanDerWaalsContact O-N 3.15Å
126M62.2Low66.2Low134 Ų134123.4 Ų123.466%0.6664%0.637SS**Hα-helixtrans-66.6-30.9173.8-76.8179.96500112.8V122 I123 N124V122-M126 HydrophobicContact CG1-CG 4.35Å; V122-M126 HydrophobicContact CG1-SD 3.91Å; V122-M126 VanDerWaalsContact O-CB 3.26Å; V122-M126 WeakPolarHBondContact O-CB 3.46Å; V122-M126 WeakPolarHBondContact O-CG 3.35Å; V122-M126 PolarHBondContact O-N 2.74Å; I123-M126 PolarHBondContact O-N 3.43Å; N124-M126 VanDerWaalsContact C-N 3.35Å; N124-M126 PolarHBondContact O-N 2.94Å
127S60.6Low64.5Low98 Ų98126.9 Ų126.969%0.68565%0.652SS**Hα-helixtrans-77.9-29.9178-170.20000112.5I123 N124 D125I123-S127 VanDerWaalsContact O-CB 3.25Å; I123-S127 WeakPolarHBondContact O-CB 3.49Å; I123-S127 PolarHBondContact O-N 3.47Å; N124-S127 WeakPolarHBondContact O-CB 3.32Å; N124-S127 PolarHBondContact O-N 3.12Å; N124-S127 VanDerWaalsContact O-N 3.12Å; D125-S127 VanDerWaalsContact C-N 3.31Å; D125-S127 PolarHBondContact O-N 3.15Å
128V62.1Low62.9Low122 Ų122127.5 Ų127.574%0.73966%0.659SS**Hα-helixtrans-76.7-26.3174.2176.30000111.7N124 D125 Q130N124-V128 VanDerWaalsContact O-CG2 3.32Å; N124-V128 WeakPolarHBondContact O-CG2 3.49Å; N124-V128 PolarHBondContact O-N 2.86Å; D125-V128 PolarHBondContact O-N 3.46Å; V128-Q130 PolarHBondContact O-N 2.89Å
129Q54.3Low61.4Low139 Ų139128.6 Ų128.665%0.6567%0.669SS**SBendtrans-71.4101.8166.9-67.6-158.134.800109.7D125 P131D125-Q129 WeakPolarHBondContact O-CG 3.25Å; D125-Q129 PolarHBondContact O-N 3.4Å; D125-Q129 VanDerWaalsContact O-N 3.15Å; Q129-P131 VanDerWaalsContact O-N 3.16Å
130Q48.9Very low60.3Low176 Ų176128.2 Ų128.282%0.82267%0.671SS**PPolyproline II helixtrans-48.3127.5162.2-72.9-172.228.600107.7V128 R132V128-Q130 PolarHBondContact O-N 2.89Å; Q130-R132 PolarHBondContact O-N 3.31Å
131P48.9Very low59.5Low114 Ų114134.6 Ų134.674%0.7470%0.695SS**PPolyproline II helixtrans-54.1118.5-178.420-30.3000107.7Q129 V133Q129-P131 VanDerWaalsContact O-N 3.16Å; P131-V133 PolarHBondContact O-N 3.01Å
132R49.9Very low59Low220 Ų220137.3 Ų137.383%0.8371%0.705SS**PPolyproline II helixtrans-56.9116.1158.9-74.2-176.2-179.2-173.30.8104.4Q130 I134Q130-R132 PolarHBondContact O-N 3.31Å; R132-I134 PolarHBondContact O-N 2.72Å
133V49.8Very low58.9Low124 Ų124138.2 Ų138.275%0.75271%0.71SS**  trans-59.991.9169.3-179.20000105.8P131 E135P131-V133 PolarHBondContact O-N 3.01Å; V133-E135 VanDerWaalsContact C-N 3.34Å; V133-E135 HydrophobicContact CG1-CG 3.95Å; V133-E135 PolarHBondContact O-N 2.96Å
134I50Low59.3Low147 Ų147136.9 Ų136.975%0.75471%0.708SS**  trans-77.5102.2157.2-58.4173000101.8R132 K136R132-I134 PolarHBondContact O-N 2.72Å; I134-K136 PolarHBondContact O-N 2.72Å
135E46.2Very low59.7Low173 Ų173140 Ų14081%0.80873%0.725SS**  trans-59.285.9161.9-67-178.5-179.400106.5V133 E137V133-E135 VanDerWaalsContact C-N 3.34Å; V133-E135 HydrophobicContact CG1-CG 3.95Å; V133-E135 PolarHBondContact O-N 2.96Å; E135-E137 VanDerWaalsContact C-N 3.33Å; E135-E137 PolarHBondContact O-N 3.14Å; E135-E137 VanDerWaalsContact O-N 3.14Å
136K49.8Very low60.5Low179 Ų179139.7 Ų139.778%0.77872%0.723SS**  trans-71.3104.4160.7-161.4174.5-173-179.80103I134 V138I134-K136 PolarHBondContact O-N 2.72Å; K136-V138 PolarHBondContact O-N 2.9Å
137E49.5Very low61.8Low169 Ų169138.8 Ų138.879%0.7971%0.713SS**  trans-50.6100.9161.3-91.6-175.3149.800106.2E135 V139E135-E137 VanDerWaalsContact C-N 3.33Å; E135-E137 PolarHBondContact O-N 3.14Å; E135-E137 VanDerWaalsContact O-N 3.14Å; E137-V139 PolarHBondContact O-N 2.76Å
138V52.8Low63.2Low118 Ų118139 Ų13972%0.71570%0.704SS**  trans-65.894157.4178.60000102.5K136 V140K136-V138 PolarHBondContact O-N 2.9Å; V138-V140 HydrophobicContact CG1-CG2 4.25Å; V138-V140 PolarHBondContact O-N 2.74Å
139V53.9Low64.7Low117 Ų117137.9 Ų137.971%0.70969%0.694SS**  trans-62.189163.5-177.90000104.3E137 E141E137-V139 PolarHBondContact O-N 2.76Å; V139-E141 PolarHBondContact O-N 2.72Å
140V59.4Low66.6Low100 Ų100136.7 Ų136.761%0.60669%0.691SS**  trans-55.1114.8161.1179.20000103.4V138 K142V138-V140 HydrophobicContact CG1-CG2 4.25Å; V138-V140 PolarHBondContact O-N 2.74Å; V140-K142 PolarHBondContact O-N 3.06Å
141E63.9Low68.8Low187 Ų187133.7 Ų133.787%0.87468%0.675SS**  trans-56.396168.4-84.6-175.7159.100106.5V139 V143V139-E141 PolarHBondContact O-N 2.72Å; E141-V143 PolarHBondContact O-N 3.35Å
142K72Confident70.9Confident178 Ų178133.5 Ų133.577%0.77467%0.665SS**PPolyproline II helixtrans-71.9121169.4-69.9-174.7-179.8179.50104.8V140 P144V140-K142 PolarHBondContact O-N 3.06Å; K142-P144 VanDerWaalsContact O-CD 3.32Å; K142-P144 WeakPolarHBondContact O-CD 3.32Å; K142-P144 VanDerWaalsContact O-N 3.1Å
143V76.6Confident73.1Confident98 Ų98126.2 Ų126.259%0.59465%0.647SS**PPolyproline II helixtrans-49.6120.9162.1176.90000105.9E141 D145 Y147E141-V143 PolarHBondContact O-N 3.35Å; V143-D145 PolarHBondContact O-N 2.99Å; V143-Y147 VanDerWaalsContact CG1-CB 3.43Å; V143-Y147 HydrophobicContact CG1-CD1 3.65Å; V143-Y147 HydrophobicContact CG1-CG 3.62Å
144P84.9Confident75.2Confident78 Ų78127.6 Ų127.651%0.50664%0.64SS.*PPolyproline II helixtrans-51.6139.1179.6-29.837.2000110.4K142 D146 Y147K142-P144 VanDerWaalsContact O-CD 3.32Å; K142-P144 WeakPolarHBondContact O-CD 3.32Å; K142-P144 VanDerWaalsContact O-N 3.1Å; P144-D146 WeakPolarHBondContact CB-OD1 3.23Å; P144-D146 PolarHBondContact O-N 3.42Å; P144-Y147 VanDerWaalsContact O-CB 3.23Å; P144-Y147 WeakPolarHBondContact O-CB 3.37Å; P144-Y147 PolarHBondContact O-N 3.32Å
145D84.6Confident77.4Confident168 Ų168123.6 Ų123.690%0.89863%0.625SS**THydrogen-bonded Turntrans-57.7-22.8-175.3-65.5-27.5000112.5V143V143-D145 PolarHBondContact O-N 2.99Å
146D90.5Very high79.8Confident94 Ų94119.8 Ų119.850%0.50361%0.607SS.*THydrogen-bonded Turntrans-93-0.8179.166.8-21.2000114.4P144 E148 N149 L150P144-D146 WeakPolarHBondContact CB-OD1 3.23Å; P144-D146 PolarHBondContact O-N 3.42Å; D146-E148 PolarHBondContact O-N 2.9Å; D146-N149 WeakPolarHBondContact O-CB 3.49Å; D146-N149 PolarHBondContact O-N 2.82Å; D146-N149 VanDerWaalsContact O-N 3.08Å; D146-L150 WeakPolarHBondContact O-CB 3.09Å; D146-L150 PolarHBondContact O-N 2.85Å
147Y89.4Confident82.1Confident115 Ų115116.6 Ų116.645%0.45160%0.598SS.*Hα-helixtrans-56.3-46.7-176.6176.4-103.9000112.8V143 P144 N149 L150 K151V143-Y147 VanDerWaalsContact CG1-CB 3.43Å; V143-Y147 HydrophobicContact CG1-CD1 3.65Å; V143-Y147 HydrophobicContact CG1-CG 3.62Å; P144-Y147 VanDerWaalsContact O-CB 3.23Å; P144-Y147 WeakPolarHBondContact O-CB 3.37Å; P144-Y147 PolarHBondContact O-N 3.32Å; Y147-N149 VanDerWaalsContact C-N 3.34Å; Y147-N149 PolarHBondContact O-N 3.08Å; Y147-L150 PolarHBondContact O-N 3.25Å; Y147-K151 WeakPolarHBondContact O-CB 3.45Å; Y147-K151 PolarHBondContact O-N 2.92Å
148E90.8Very high84.3Confident103 Ų103113.9 Ų113.948%0.48159%0.585SS.*Hα-helixtrans-66.6-36.9178.4-68.3-58.8146.100111.8D146 K151 Q152D146-E148 PolarHBondContact O-N 2.9Å; E148-K151 PolarHBondContact O-N 3.48Å; E148-Q152 WeakPolarHBondContact O-CB 3.5Å; E148-Q152 VanDerWaalsContact O-CG 3.32Å; E148-Q152 WeakPolarHBondContact O-CG 3.4Å; E148-Q152 PolarHBondContact O-N 2.77Å
149N93.6Very high86.4Confident99 Ų99115 Ų11553%0.52958%0.583SS.*Hα-helixtrans-66.3-40.7175.5-67.8-34.2000111.5D146 Y147 Q152 S153D146-N149 WeakPolarHBondContact O-CB 3.49Å; D146-N149 PolarHBondContact O-N 2.82Å; D146-N149 VanDerWaalsContact O-N 3.08Å; Y147-N149 VanDerWaalsContact C-N 3.34Å; Y147-N149 PolarHBondContact O-N 3.08Å; N149-Q152 PolarHBondContact O-N 3.33Å; N149-S153 WeakPolarHBondContact O-CB 3.39Å; N149-S153 PolarHBondContact O-N 3.48Å; N149-S153 PolarHBondContact O-OG 2.91Å
150L93.8Very high88.5Confident114 Ų114117.4 Ų117.460%0.59758%0.579SS**Hα-helixtrans-66.6-42.3177.2-175.862.1000111.1D146 Y147 S153 Y154D146-L150 WeakPolarHBondContact O-CB 3.09Å; D146-L150 PolarHBondContact O-N 2.85Å; Y147-L150 PolarHBondContact O-N 3.25Å; L150-S153 PolarHBondContact O-N 2.97Å; L150-Y154 WeakPolarHBondContact O-CB 3.46Å; L150-Y154 PolarHBondContact O-N 3.45Å
151K93.6Very high90.3Very high112 Ų112115.4 Ų115.449%0.48757%0.57SS.*Hα-helixtrans-60.6-46.2175.1-175.8-179.4176.9-172.80111.8Y147 E148 S153 Y154 S155Y147-K151 WeakPolarHBondContact O-CB 3.45Å; Y147-K151 PolarHBondContact O-N 2.92Å; E148-K151 PolarHBondContact O-N 3.48Å; K151-S153 VanDerWaalsContact C-N 3.34Å; K151-S153 PolarHBondContact O-N 3.13Å; K151-Y154 PolarHBondContact O-N 3.45Å; K151-S155 PolarHBondContact O-N 3.42Å; K151-S155 PolarHBondContact O-OG 2.97Å
152Q94.6Very high91.8Very high111 Ų111109.9 Ų109.952%0.51955%0.552SS.*Hα-helixtrans-61.6-42.4174.6-73.8178.91.100112E148 N149 Y154 S155 Q156E148-Q152 WeakPolarHBondContact O-CB 3.5Å; E148-Q152 VanDerWaalsContact O-CG 3.32Å; E148-Q152 WeakPolarHBondContact O-CG 3.4Å; E148-Q152 PolarHBondContact O-N 2.77Å; N149-Q152 PolarHBondContact O-N 3.33Å; Q152-Y154 VanDerWaalsContact C-N 3.33Å; Q152-Y154 PolarHBondContact O-N 3Å; Q152-S155 PolarHBondContact O-N 3.35Å; Q152-Q156 WeakPolarHBondContact O-CG 3.32Å; Q152-Q156 PolarHBondContact O-N 3.03Å
153S95.2Very high93.1Very high66 Ų66106.6 Ų106.646%0.46254%0.539SS..Hα-helixtrans-63.2-39.8177.5-59.70000111.9N149 L150 K151 Q156 L157N149-S153 WeakPolarHBondContact O-CB 3.39Å; N149-S153 PolarHBondContact O-N 3.48Å; N149-S153 PolarHBondContact O-OG 2.91Å; L150-S153 PolarHBondContact O-N 2.97Å; K151-S153 VanDerWaalsContact C-N 3.34Å; K151-S153 PolarHBondContact O-N 3.13Å; S153-Q156 PolarHBondContact O-N 3.47Å; S153-L157 WeakPolarHBondContact O-CB 3.4Å; S153-L157 PolarHBondContact O-N 3.49Å
154Y95.2Very high94.1Very high154 Ų154107.8 Ų107.860%0.60454%0.541SS*.Hα-helixtrans-63.2-47.3175.2-177.1-91.2000111.6L150 K151 Q152 Q156 L157 E158L150-Y154 WeakPolarHBondContact O-CB 3.46Å; L150-Y154 PolarHBondContact O-N 3.45Å; K151-Y154 PolarHBondContact O-N 3.45Å; Q152-Y154 VanDerWaalsContact C-N 3.33Å; Q152-Y154 PolarHBondContact O-N 3Å; Y154-Q156 PolarHBondContact O-N 3.48Å; Y154-L157 WeakPolarHBondContact O-CB 3.47Å; Y154-L157 PolarHBondContact O-N 3.34Å; Y154-L157 VanDerWaalsContact O-N 3.13Å; Y154-E158 PolarHBondContact O-N 2.85Å
155S95Very high94.7Very high63 Ų63109.2 Ų109.244%0.44154%0.541SS..Hα-helixtrans-61.2-40.7176.6-64.30000112.8K151 Q152 L157 E158 E159K151-S155 PolarHBondContact O-N 3.42Å; K151-S155 PolarHBondContact O-OG 2.97Å; Q152-S155 PolarHBondContact O-N 3.35Å; S155-L157 VanDerWaalsContact C-N 3.32Å; S155-L157 PolarHBondContact O-N 2.93Å; S155-E158 PolarHBondContact O-N 3.06Å; S155-E159 PolarHBondContact O-N 3.35Å
156Q96.7Very high95.3Very high93 Ų93103.8 Ų103.844%0.43552%0.517SS..Hα-helixtrans-66-34.2174.6-71.2178.822.500112.8Q152 S153 Y154 R160Q152-Q156 WeakPolarHBondContact O-CG 3.32Å; Q152-Q156 PolarHBondContact O-N 3.03Å; S153-Q156 PolarHBondContact O-N 3.47Å; Y154-Q156 PolarHBondContact O-N 3.48Å; Q156-R160 WeakPolarHBondContact O-CB 3.39Å; Q156-R160 WeakPolarHBondContact O-CG 3.42Å; Q156-R160 PolarHBondContact O-N 3.32Å
157L97.4Very high95.6Very high112 Ų112103 Ų10359%0.58651%0.512SS*.Hα-helixtrans-69.1-41.2176.6-176.262.6000111.2S153 Y154 S155 R160 S161S153-L157 WeakPolarHBondContact O-CB 3.4Å; S153-L157 PolarHBondContact O-N 3.49Å; Y154-L157 WeakPolarHBondContact O-CB 3.47Å; Y154-L157 PolarHBondContact O-N 3.34Å; Y154-L157 VanDerWaalsContact O-N 3.13Å; S155-L157 VanDerWaalsContact C-N 3.32Å; S155-L157 PolarHBondContact O-N 2.93Å; L157-R160 PolarHBondContact O-N 3.4Å; L157-S161 WeakPolarHBondContact O-CB 3.37Å; L157-S161 PolarHBondContact O-N 3.37Å
158E96.6Very high96Very high111 Ų111104.4 Ų104.452%0.51952%0.518SS..Hα-helixtrans-62.7-43.1175.9-173.9174-144.700111.9Y154 S155 S161 S162Y154-E158 PolarHBondContact O-N 2.85Å; S155-E158 PolarHBondContact O-N 3.06Å; E158-S161 PolarHBondContact O-N 3.31Å; E158-S162 PolarHBondContact O-N 2.9Å; E158-S162 PolarHBondContact O-OG 3.43Å
159E96.8Very high96.3Very high143 Ų143107.8 Ų107.867%0.66853%0.526SS*.Hα-helixtrans-62.1-46.8174.3-173.6179.1-171.300111.6S155 S161 S162 Q163S155-E159 PolarHBondContact O-N 3.35Å; E159-S161 VanDerWaalsContact C-N 3.34Å; E159-S161 PolarHBondContact O-N 3.05Å; E159-S162 PolarHBondContact O-N 3.44Å; E159-Q163 PolarHBondContact O-N 2.95Å
160R97.4Very high96.5Very high166 Ų166107.8 Ų107.863%0.62653%0.526SS*.Hα-helixtrans-62-39.9175.8-77.6-173.2179.5104.1-0.2112.6Q156 L157 Q163 L164Q156-R160 WeakPolarHBondContact O-CB 3.39Å; Q156-R160 WeakPolarHBondContact O-CG 3.42Å; Q156-R160 PolarHBondContact O-N 3.32Å; L157-R160 PolarHBondContact O-N 3.4Å; R160-Q163 PolarHBondContact O-N 3.4Å; R160-L164 WeakPolarHBondContact O-CB 3.47Å; R160-L164 PolarHBondContact O-N 2.97Å
161S97Very high96.7Very high59 Ų59107.5 Ų107.541%0.41353%0.525SS..Hα-helixtrans-62.4-45.9177.1-167.30000110.8L157 E158 E159 Q163 L164 E165L157-S161 WeakPolarHBondContact O-CB 3.37Å; L157-S161 PolarHBondContact O-N 3.37Å; E158-S161 PolarHBondContact O-N 3.31Å; E159-S161 VanDerWaalsContact C-N 3.34Å; E159-S161 PolarHBondContact O-N 3.05Å; S161-Q163 PolarHBondContact O-N 2.97Å; S161-L164 PolarHBondContact O-N 3.46Å; S161-E165 WeakPolarHBondContact O-CG 3.31Å; S161-E165 PolarHBondContact O-N 2.93Å
162S97.1Very high96.9Very high71 Ų71106.1 Ų106.150%0.49752%0.522SS..Hα-helixtrans-61.9-42177.2-57.80000112.1E158 E159 E165 S166E158-S162 PolarHBondContact O-N 2.9Å; E158-S162 PolarHBondContact O-OG 3.43Å; E159-S162 PolarHBondContact O-N 3.44Å; S162-E165 PolarHBondContact O-N 3.08Å; S162-S166 PolarHBondContact O-N 3.45Å
163Q97.8Very high97Very high108 Ų108103.9 Ų103.951%0.50552%0.522SS..Hα-helixtrans-64.3-40.7175.6-173.463.648.100112E159 R160 S161 S166 N167E159-Q163 PolarHBondContact O-N 2.95Å; R160-Q163 PolarHBondContact O-N 3.4Å; S161-Q163 PolarHBondContact O-N 2.97Å; Q163-S166 PolarHBondContact O-N 3.23Å; Q163-N167 PolarHBondContact NE2-OD1 2.94Å; Q163-N167 WeakPolarHBondContact O-CB 3.37Å; Q163-N167 PolarHBondContact O-N 3.43Å; Q163-N167 PolarHBondContact O-OD1 3.42Å
164L97.8Very high97.1Very high123 Ų123106.3 Ų106.364%0.64453%0.527SS*.Hα-helixtrans-66.2-39.6179-172.264000111.5R160 S161 N167 Y168R160-L164 WeakPolarHBondContact O-CB 3.47Å; R160-L164 PolarHBondContact O-N 2.97Å; S161-L164 PolarHBondContact O-N 3.46Å; L164-N167 PolarHBondContact O-N 3.04Å; L164-Y168 VanDerWaalsContact O-CB 3.31Å; L164-Y168 WeakPolarHBondContact O-CB 3.5Å; L164-Y168 PolarHBondContact O-N 2.97Å
165E97.4Very high97.2Very high108 Ų108106.5 Ų106.551%0.50553%0.526SS..Hα-helixtrans-62.4-41.8172.9-74.9-177.2-165.700112.3S161 S162 Y168 R169S161-E165 WeakPolarHBondContact O-CG 3.31Å; S161-E165 PolarHBondContact O-N 2.93Å; S162-E165 PolarHBondContact O-N 3.08Å; E165-Y168 PolarHBondContact O-N 2.91Å; E165-R169 WeakPolarHBondContact O-CG 3.4Å; E165-R169 PolarHBondContact O-N 3.26Å; E165-R169 VanDerWaalsContact O-N 3.08Å
166S97.3Very high97.3Very high54 Ų54110 Ų11038%0.37853%0.533SS..Hα-helixtrans-61.6-52174.8-1670000111.1S162 Q163 Y168 R169 D170S162-S166 PolarHBondContact O-N 3.45Å; Q163-S166 PolarHBondContact O-N 3.23Å; S166-Y168 PolarHBondContact O-N 3.3Å; S166-R169 WeakPolarHBondContact O-CB 3.46Å; S166-R169 PolarHBondContact O-N 3.4Å; S166-D170 PolarHBondContact O-N 3.03Å
167N97.7Very high97.2Very high77 Ų77110.3 Ų110.341%0.41254%0.535SS..Hα-helixtrans-59-37.6179.3-67.8-6.3000111.8Q163 L164 D170 L171Q163-N167 PolarHBondContact NE2-OD1 2.94Å; Q163-N167 WeakPolarHBondContact O-CB 3.37Å; Q163-N167 PolarHBondContact O-N 3.43Å; Q163-N167 PolarHBondContact O-OD1 3.42Å; L164-N167 PolarHBondContact O-N 3.04Å; N167-D170 PolarHBondContact O-N 2.87Å; N167-L171 WeakPolarHBondContact O-CB 3.48Å; N167-L171 PolarHBondContact O-N 3.34Å
168Y97.3Very high97.2Very high146 Ų146108.7 Ų108.757%0.57353%0.53SS*.Hα-helixtrans-65.7-39.8176.8-178-108.3000112.1L164 E165 S166 L171 L172L164-Y168 VanDerWaalsContact O-CB 3.31Å; L164-Y168 WeakPolarHBondContact O-CB 3.5Å; L164-Y168 PolarHBondContact O-N 2.97Å; E165-Y168 PolarHBondContact O-N 2.91Å; S166-Y168 PolarHBondContact O-N 3.3Å; Y168-L171 PolarHBondContact O-N 3.49Å; Y168-L172 HydrophobicContact CD1-CD1 4.01Å; Y168-L172 HydrophobicContact CE1-CD1 3.53Å; Y168-L172 HydrophobicContact CE1-CG 4.23Å; Y168-L172 WeakPolarHBondContact O-CG 3.28Å; Y168-L172 PolarHBondContact O-N 3.06Å
169R97.5Very high97.2Very high174 Ų174107.2 Ų107.266%0.65753%0.525SS*.Hα-helixtrans-64.9-42.4174.4-71.6177.4-175.3-177.35.5111.9E165 S166 L172 A173E165-R169 WeakPolarHBondContact O-CG 3.4Å; E165-R169 PolarHBondContact O-N 3.26Å; E165-R169 VanDerWaalsContact O-N 3.08Å; S166-R169 WeakPolarHBondContact O-CB 3.46Å; S166-R169 PolarHBondContact O-N 3.4Å; R169-L172 PolarHBondContact O-N 3.05Å; R169-A173 PolarHBondContact O-N 3.3Å
170D97.7Very high97.1Very high99 Ų99105.1 Ų105.153%0.52952%0.515SS..Hα-helixtrans-63.6-43.5177.7-65.8-24.9000111S166 N167 L172 A173 E174S166-D170 PolarHBondContact O-N 3.03Å; N167-D170 PolarHBondContact O-N 2.87Å; D170-L172 VanDerWaalsContact C-N 3.33Å; D170-L172 PolarHBondContact O-N 3.11Å; D170-A173 WeakPolarHBondContact O-CB 3.38Å; D170-A173 PolarHBondContact O-N 2.88Å; D170-A173 VanDerWaalsContact O-N 3.13Å; D170-E174 PolarHBondContact O-N 2.9Å
171L97.8Very high97Very high107 Ų107102.9 Ų102.956%0.5651%0.51SS*.Hα-helixtrans-63.2-37.1176.3-171.967.6000112.4N167 Y168 A173 R175N167-L171 WeakPolarHBondContact O-CB 3.48Å; N167-L171 PolarHBondContact O-N 3.34Å; Y168-L171 PolarHBondContact O-N 3.49Å; L171-A173 VanDerWaalsContact C-N 3.35Å; L171-R175 VanDerWaalsContact O-CB 3.28Å; L171-R175 WeakPolarHBondContact O-CB 3.37Å; L171-R175 PolarHBondContact O-N 2.98Å
172L97.5Very high97Very high84 Ų84103.5 Ų103.544%0.4452%0.515SS..Hα-helixtrans-65.6-37.6173.8-76.3176.2000112.2Y168 R169 D170 K176Y168-L172 HydrophobicContact CD1-CD1 4.01Å; Y168-L172 HydrophobicContact CE1-CD1 3.53Å; Y168-L172 HydrophobicContact CE1-CG 4.23Å; Y168-L172 WeakPolarHBondContact O-CG 3.28Å; Y168-L172 PolarHBondContact O-N 3.06Å; R169-L172 PolarHBondContact O-N 3.05Å; D170-L172 VanDerWaalsContact C-N 3.33Å; D170-L172 PolarHBondContact O-N 3.11Å; L172-K176 PolarHBondContact O-N 3.49Å; L172-K176 VanDerWaalsContact O-N 3.11Å
173A97Very high96.8Very high63 Ų63102.9 Ų102.952%0.52151%0.51SS..Hα-helixtrans-67.2-45.7175.600000111.4R169 D170 L171 R175 K176 E177R169-A173 PolarHBondContact O-N 3.3Å; D170-A173 WeakPolarHBondContact O-CB 3.38Å; D170-A173 PolarHBondContact O-N 2.88Å; D170-A173 VanDerWaalsContact O-N 3.13Å; L171-A173 VanDerWaalsContact C-N 3.35Å; A173-R175 PolarHBondContact O-N 3.13Å; A173-K176 PolarHBondContact O-N 3.38Å; A173-E177 PolarHBondContact O-N 2.82Å
174E97Very high96.7Very high117 Ų117104 Ų10455%0.54751%0.513SS..Hα-helixtrans-61.3-43.5175.7-173.2178.1-172.800111.4D170 K176 E177 V178D170-E174 PolarHBondContact O-N 2.9Å; E174-K176 VanDerWaalsContact C-N 3.32Å; E174-K176 PolarHBondContact O-N 2.89Å; E174-E177 WeakPolarHBondContact O-CB 3.45Å; E174-E177 PolarHBondContact O-N 3.25Å; E174-E177 VanDerWaalsContact O-N 3.14Å; E174-V178 WeakPolarHBondContact O-CG2 3.5Å; E174-V178 PolarHBondContact O-N 2.88Å
175R97.3Very high96.6Very high159 Ų159106.4 Ų106.460%0.652%0.515SS*.Hα-helixtrans-58.4-43.6175.8-174.9177.2-172.9-87.6-1.7111.9L171 A173 E177 V178 D179L171-R175 VanDerWaalsContact O-CB 3.28Å; L171-R175 WeakPolarHBondContact O-CB 3.37Å; L171-R175 PolarHBondContact O-N 2.98Å; A173-R175 PolarHBondContact O-N 3.13Å; R175-E177 VanDerWaalsContact C-N 3.35Å; R175-V178 PolarHBondContact O-N 3.14Å; R175-D179 IonicContact NH1-OD2 3.34Å; R175-D179 WeakPolarHBondContact O-CB 3.37Å; R175-D179 VanDerWaalsContact O-CG 3.27Å; R175-D179 PolarHBondContact O-N 2.7Å
176K96.7Very high96.5Very high136 Ų136106.2 Ų106.259%0.59151%0.514SS*.Hα-helixtrans-62.8-42176.4-175.2-178.7174.4-171.80111.5L172 A173 E174 V178 D179 E180L172-K176 PolarHBondContact O-N 3.49Å; L172-K176 VanDerWaalsContact O-N 3.11Å; A173-K176 PolarHBondContact O-N 3.38Å; E174-K176 VanDerWaalsContact C-N 3.32Å; E174-K176 PolarHBondContact O-N 2.89Å; K176-V178 VanDerWaalsContact C-N 3.34Å; K176-D179 PolarHBondContact O-N 2.99Å; K176-E180 VanDerWaalsContact CE-OE1 3.29Å; K176-E180 WeakPolarHBondContact CE-OE1 3.36Å; K176-E180 WeakPolarHBondContact O-CG 3.47Å; K176-E180 PolarHBondContact O-N 3Å
177E95.9Very high96.5Very high99 Ų99109.6 Ų109.646%0.46352%0.524SS..Hα-helixtrans-62.7-41.5175.9-170.5-174.6162.700111.8A173 E174 R175 E180 K181A173-E177 PolarHBondContact O-N 2.82Å; E174-E177 WeakPolarHBondContact O-CB 3.45Å; E174-E177 PolarHBondContact O-N 3.25Å; E174-E177 VanDerWaalsContact O-N 3.14Å; R175-E177 VanDerWaalsContact C-N 3.35Å; E177-E180 PolarHBondContact O-N 3.45Å; E177-K181 HydrophobicContact CG-CD 4.46Å; E177-K181 WeakPolarHBondContact O-CB 3.29Å; E177-K181 WeakPolarHBondContact O-CG 3.39Å; E177-K181 PolarHBondContact O-N 3.3Å; E177-K181 WeakPolarHBondContact OE1-CE 3.49Å; E177-K181 IonicContact OE1-NZ 2.64Å; E177-K181 PolarHBondContact OE1-NZ 2.9Å
178V97Very high96.4Very high79 Ų79111.2 Ų111.248%0.47953%0.532SS..Hα-helixtrans-64.1-44.4175.8171.40000111.3E174 R175 K176 E180 K181 S182E174-V178 WeakPolarHBondContact O-CG2 3.5Å; E174-V178 PolarHBondContact O-N 2.88Å; R175-V178 PolarHBondContact O-N 3.14Å; K176-V178 VanDerWaalsContact C-N 3.34Å; V178-E180 VanDerWaalsContact C-N 3.34Å; V178-E180 PolarHBondContact O-N 3.03Å; V178-K181 PolarHBondContact O-N 3.38Å; V178-S182 WeakPolarHBondContact O-CB 3.5Å; V178-S182 PolarHBondContact O-N 3.25Å
179D95.8Very high96.2Very high80 Ų80106.5 Ų106.543%0.42852%0.521SS..Hα-helixtrans-61-42.6177.4-72.2-21.6000111.2R175 K176 S182 S183R175-D179 IonicContact NH1-OD2 3.34Å; R175-D179 WeakPolarHBondContact O-CB 3.37Å; R175-D179 VanDerWaalsContact O-CG 3.27Å; R175-D179 PolarHBondContact O-N 2.7Å; K176-D179 PolarHBondContact O-N 2.99Å; D179-S182 PolarHBondContact O-N 2.63Å; D179-S183 PolarHBondContact O-N 2.96Å
180E95.7Very high96.1Very high98 Ų98103.6 Ų103.646%0.45851%0.513SS..Hα-helixtrans-64.2-42.5175.3-74.1178.5-168.700112.4K176 E177 V178 K184K176-E180 VanDerWaalsContact CE-OE1 3.29Å; K176-E180 WeakPolarHBondContact CE-OE1 3.36Å; K176-E180 WeakPolarHBondContact O-CG 3.47Å; K176-E180 PolarHBondContact O-N 3Å; E177-E180 PolarHBondContact O-N 3.45Å; V178-E180 VanDerWaalsContact C-N 3.34Å; V178-E180 PolarHBondContact O-N 3.03Å; E180-K184 WeakPolarHBondContact O-CG 3.37Å; E180-K184 PolarHBondContact O-N 3.03Å; E180-K184 VanDerWaalsContact O-N 3.13Å
181K95.8Very high96Very high120 Ų120101.2 Ų101.252%0.52251%0.507SS..Hα-helixtrans-65-40.8175.1-75.8176.4-175.3167.10111.8E177 V178 K184 Y185E177-K181 HydrophobicContact CG-CD 4.46Å; E177-K181 WeakPolarHBondContact O-CB 3.29Å; E177-K181 WeakPolarHBondContact O-CG 3.39Å; E177-K181 PolarHBondContact O-N 3.3Å; E177-K181 WeakPolarHBondContact OE1-CE 3.49Å; E177-K181 IonicContact OE1-NZ 2.64Å; E177-K181 PolarHBondContact OE1-NZ 2.9Å; V178-K181 PolarHBondContact O-N 3.38Å; K181-K184 PolarHBondContact O-N 3.39Å; K181-Y185 PolarHBondContact O-N 3.29Å
182S95.4Very high95.9Very high72 Ų72100.5 Ų100.550%0.50350%0.503SS..Hα-helixtrans-63.2-43.5178-170.90000111.4V178 D179 K184 Y185 E186V178-S182 WeakPolarHBondContact O-CB 3.5Å; V178-S182 PolarHBondContact O-N 3.25Å; D179-S182 PolarHBondContact O-N 2.63Å; S182-K184 VanDerWaalsContact C-N 3.34Å; S182-K184 PolarHBondContact O-N 3.44Å; S182-Y185 WeakPolarHBondContact O-CB 3.44Å; S182-Y185 PolarHBondContact O-N 3.49Å; S182-E186 PolarHBondContact O-N 3.47Å
183S94.5Very high95.7Very high58 Ų58100.4 Ų100.441%0.40650%0.502SS..Hα-helixtrans-61.3-41.9175.2-177.50000112.1D179 E186 Q187D179-S183 PolarHBondContact O-N 2.96Å; S183-E186 PolarHBondContact O-N 3.09Å; S183-Q187 WeakPolarHBondContact O-CG 3.13Å; S183-Q187 PolarHBondContact O-N 2.97Å; S183-Q187 VanDerWaalsContact O-N 3.09Å
184K95.4Very high95.6Very high130 Ų130103.2 Ų103.257%0.56551%0.505SS*.Hα-helixtrans-63.5-40.1174-72.5174.2-177.1171.90112.2E180 K181 S182 Q187 L188E180-K184 WeakPolarHBondContact O-CG 3.37Å; E180-K184 PolarHBondContact O-N 3.03Å; E180-K184 VanDerWaalsContact O-N 3.13Å; K181-K184 PolarHBondContact O-N 3.39Å; S182-K184 VanDerWaalsContact C-N 3.34Å; S182-K184 PolarHBondContact O-N 3.44Å; K184-Q187 PolarHBondContact O-N 3.31Å; K184-L188 WeakPolarHBondContact O-CB 3.41Å; K184-L188 WeakPolarHBondContact O-CG 3.32Å; K184-L188 PolarHBondContact O-N 3.2Å
185Y96Very high95.4Very high175 Ų175100.4 Ų100.469%0.68650%0.501SS*.Hα-helixtrans-63.1-43.2177-176.7-95000111.8K181 S182 Q187 L188 S189K181-Y185 PolarHBondContact O-N 3.29Å; S182-Y185 WeakPolarHBondContact O-CB 3.44Å; S182-Y185 PolarHBondContact O-N 3.49Å; Y185-Q187 PolarHBondContact O-N 2.88Å; Y185-L188 PolarHBondContact O-N 3.39Å; Y185-S189 WeakPolarHBondContact O-CB 3.39Å; Y185-S189 PolarHBondContact O-N 3.42Å
186E95.3Very high95.2Very high104 Ų10498.2 Ų98.249%0.48650%0.498SS..Hα-helixtrans-63.2-41.4176.8-165.9-17215700112S182 S183 S189 K190S182-E186 PolarHBondContact O-N 3.47Å; S183-E186 PolarHBondContact O-N 3.09Å; E186-S189 PolarHBondContact O-N 3.4Å; E186-K190 WeakPolarHBondContact O-CG 3.44Å; E186-K190 PolarHBondContact O-N 3.47Å; E186-K190 WeakPolarHBondContact OE1-CE 3.37Å; E186-K190 IonicContact OE1-NZ 2.74Å; E186-K190 PolarHBondContact OE1-NZ 3.4Å
187Q95.6Very high94.9Very high125 Ų12596.8 Ų96.858%0.58450%0.497SS*.Hα-helixtrans-63.6-43.8175.2-70.5175.428.300112.2S183 K184 Y185 K190 A191S183-Q187 WeakPolarHBondContact O-CG 3.13Å; S183-Q187 PolarHBondContact O-N 2.97Å; S183-Q187 VanDerWaalsContact O-N 3.09Å; K184-Q187 PolarHBondContact O-N 3.31Å; Y185-Q187 PolarHBondContact O-N 2.88Å; Q187-K190 PolarHBondContact O-N 3.04Å; Q187-A191 WeakPolarHBondContact O-CB 3.34Å; Q187-A191 PolarHBondContact O-N 3.33Å
188L95.8Very high94.8Very high110 Ų11098.5 Ų98.558%0.57650%0.503SS*.Hα-helixtrans-63.7-41.7176.4-77.1168.6000111.7K184 Y185 K190 A191 I192K184-L188 WeakPolarHBondContact O-CB 3.41Å; K184-L188 WeakPolarHBondContact O-CG 3.32Å; K184-L188 PolarHBondContact O-N 3.2Å; Y185-L188 PolarHBondContact O-N 3.39Å; L188-K190 PolarHBondContact O-N 3.5Å; L188-A191 PolarHBondContact O-N 3.46Å; L188-I192 VanDerWaalsContact O-CG1 3.32Å; L188-I192 WeakPolarHBondContact O-CG1 3.37Å; L188-I192 PolarHBondContact O-N 3.13Å
189S94.6Very high94.6Very high48 Ų4899.4 Ų99.434%0.33650%0.504SS..Hα-helixtrans-61.3-43.9176.3177.10000111.8Y185 E186 A191 I192 N193Y185-S189 WeakPolarHBondContact O-CB 3.39Å; Y185-S189 PolarHBondContact O-N 3.42Å; E186-S189 PolarHBondContact O-N 3.4Å; S189-A191 VanDerWaalsContact C-N 3.35Å; S189-A191 PolarHBondContact O-N 3.1Å; S189-I192 PolarHBondContact O-N 3.11Å; S189-N193 PolarHBondContact O-N 2.88Å; S189-N193 PolarHBondContact O-OD1 3.34Å
190K95.5Very high94.4Very high113 Ų11398.8 Ų98.849%0.49151%0.507SS..Hα-helixtrans-61.7-41.6174.1-72.8174.4-174.8166.20112.2E186 Q187 L188 N193 Q194E186-K190 WeakPolarHBondContact O-CG 3.44Å; E186-K190 PolarHBondContact O-N 3.47Å; E186-K190 WeakPolarHBondContact OE1-CE 3.37Å; E186-K190 IonicContact OE1-NZ 2.74Å; E186-K190 PolarHBondContact OE1-NZ 3.4Å; Q187-K190 PolarHBondContact O-N 3.04Å; L188-K190 PolarHBondContact O-N 3.5Å; K190-N193 PolarHBondContact O-N 3.23Å; K190-Q194 WeakPolarHBondContact O-CG 3.47Å; K190-Q194 PolarHBondContact O-N 3.23Å; K190-Q194 VanDerWaalsContact O-N 3.08Å
191A95.3Very high94.2Very high48 Ų4899.6 Ų99.640%0.39751%0.51SS..Hα-helixtrans-67.1-36.8178.200000112.6Q187 L188 S189 A195Q187-A191 WeakPolarHBondContact O-CB 3.34Å; Q187-A191 PolarHBondContact O-N 3.33Å; L188-A191 PolarHBondContact O-N 3.46Å; S189-A191 VanDerWaalsContact C-N 3.35Å; S189-A191 PolarHBondContact O-N 3.1Å; A191-A195 WeakPolarHBondContact O-CB 3.34Å; A191-A195 PolarHBondContact O-N 3.46Å
192I94.5Very high94.1Very high93 Ų9397.2 Ų97.248%0.47751%0.506SS..Hα-helixtrans-64-50.1174.8-72.4167000110.2L188 S189 Q194 A195 E196L188-I192 VanDerWaalsContact O-CG1 3.32Å; L188-I192 WeakPolarHBondContact O-CG1 3.37Å; L188-I192 PolarHBondContact O-N 3.13Å; S189-I192 PolarHBondContact O-N 3.11Å; I192-Q194 VanDerWaalsContact C-N 3.31Å; I192-Q194 PolarHBondContact O-N 3.34Å; I192-A195 CarbonylContact O-C 3.58Å; I192-A195 WeakPolarHBondContact O-CA 3.39Å; I192-A195 WeakPolarHBondContact O-CB 3.48Å; I192-A195 PolarHBondContact O-N 2.94Å; I192-E196 HydrophobicContact CG2-CG 4.33Å; I192-E196 WeakPolarHBondContact O-CG 3.24Å; I192-E196 PolarHBondContact O-N 2.97Å
193N93.7Very high94Very high81 Ų8199.2 Ų99.243%0.43351%0.507SS..Hα-helixtrans-58.2-45.1178.9-66.5-6.9000111.3S189 K190 A195 E196 D197S189-N193 PolarHBondContact O-N 2.88Å; S189-N193 PolarHBondContact O-OD1 3.34Å; K190-N193 PolarHBondContact O-N 3.23Å; N193-A195 VanDerWaalsContact C-N 3.28Å; N193-A195 PolarHBondContact O-N 2.95Å; N193-E196 PolarHBondContact O-N 3.1Å; N193-D197 PolarHBondContact O-N 3.08Å
194Q94.3Very high93.9Very high122 Ų122101.6 Ų101.657%0.5751%0.507SS*.Hα-helixtrans-62.6-33.7175.4-73178.3-13.300113.3K190 I192 K198K190-Q194 WeakPolarHBondContact O-CG 3.47Å; K190-Q194 PolarHBondContact O-N 3.23Å; K190-Q194 VanDerWaalsContact O-N 3.08Å; I192-Q194 VanDerWaalsContact C-N 3.31Å; I192-Q194 PolarHBondContact O-N 3.34Å; Q194-K198 WeakPolarHBondContact O-CB 3.49Å; Q194-K198 VanDerWaalsContact O-CG 3.32Å; Q194-K198 WeakPolarHBondContact O-CG 3.46Å; Q194-K198 PolarHBondContact O-N 2.99Å
195A94Very high93.8Very high58 Ų5899.8 Ų99.848%0.47950%0.503SS..Hα-helixtrans-73-37.9176.500000111.6A191 I192 N193 K198 L199A191-A195 WeakPolarHBondContact O-CB 3.34Å; A191-A195 PolarHBondContact O-N 3.46Å; I192-A195 CarbonylContact O-C 3.58Å; I192-A195 WeakPolarHBondContact O-CA 3.39Å; I192-A195 WeakPolarHBondContact O-CB 3.48Å; I192-A195 PolarHBondContact O-N 2.94Å; N193-A195 VanDerWaalsContact C-N 3.28Å; N193-A195 PolarHBondContact O-N 2.95Å; A195-K198 PolarHBondContact O-N 3.3Å; A195-L199 VanDerWaalsContact O-CB 3.24Å; A195-L199 WeakPolarHBondContact O-CB 3.48Å; A195-L199 PolarHBondContact O-N 3.08Å
196E91.6Very high93.7Very high114 Ų11496.7 Ų96.753%0.53350%0.498SS..Hα-helixtrans-64.3-44.3174.3-72.2-179.5155.300111.5I192 N193 K198 L199 S200I192-E196 HydrophobicContact CG2-CG 4.33Å; I192-E196 WeakPolarHBondContact O-CG 3.24Å; I192-E196 PolarHBondContact O-N 2.97Å; N193-E196 PolarHBondContact O-N 3.1Å; E196-K198 PolarHBondContact O-N 3.11Å; E196-L199 PolarHBondContact O-N 2.97Å; E196-S200 WeakPolarHBondContact O-CB 3.47Å; E196-S200 PolarHBondContact O-N 2.89Å
197D91.6Very high93.6Very high106 Ų10694.6 Ų94.657%0.56749%0.494SS*.Hα-helixtrans-58.9-49.6175.2-69.9-24.6000111N193 L199 S200 E201N193-D197 PolarHBondContact O-N 3.08Å; D197-L199 VanDerWaalsContact C-N 3.32Å; D197-L199 PolarHBondContact O-N 2.95Å; D197-S200 WeakPolarHBondContact O-CB 3.32Å; D197-S200 PolarHBondContact O-N 3.39Å; D197-E201 WeakPolarHBondContact O-CG 3.43Å; D197-E201 PolarHBondContact O-N 2.86Å
198K93Very high93.4Very high134 Ų13492.1 Ų92.158%0.58349%0.485SS*.Hα-helixtrans-63.3-36.2176.8-75.7178.6-179.7179.40113Q194 A195 E196 T202Q194-K198 WeakPolarHBondContact O-CB 3.49Å; Q194-K198 VanDerWaalsContact O-CG 3.32Å; Q194-K198 WeakPolarHBondContact O-CG 3.46Å; Q194-K198 PolarHBondContact O-N 2.99Å; A195-K198 PolarHBondContact O-N 3.3Å; E196-K198 PolarHBondContact O-N 3.11Å; K198-T202 WeakPolarHBondContact O-CB 3.49Å; K198-T202 PolarHBondContact O-N 3.49Å; K198-T202 PolarHBondContact O-OG1 3.18Å
199L93.1Very high93.3Very high98 Ų9894 Ų9451%0.51349%0.486SS..Hα-helixtrans-65.2-43.9176.1-17964.4000110.4A195 E196 D197 T202 Q203A195-L199 VanDerWaalsContact O-CB 3.24Å; A195-L199 WeakPolarHBondContact O-CB 3.48Å; A195-L199 PolarHBondContact O-N 3.08Å; E196-L199 PolarHBondContact O-N 2.97Å; D197-L199 VanDerWaalsContact C-N 3.32Å; D197-L199 PolarHBondContact O-N 2.95Å; L199-T202 PolarHBondContact O-N 3.22Å; L199-Q203 HydrophobicContact CD1-CG 4.48Å; L199-Q203 WeakPolarHBondContact O-CB 3.4Å; L199-Q203 VanDerWaalsContact O-CG 3.28Å; L199-Q203 WeakPolarHBondContact O-CG 3.47Å; L199-Q203 PolarHBondContact O-N 2.84Å
200S91.4Very high93.3Very high68 Ų6898 Ų9848%0.47650%0.497SS..Hα-helixtrans-59.5-47.4175-175.70000111.8E196 D197 T202 Q203 R204E196-S200 WeakPolarHBondContact O-CB 3.47Å; E196-S200 PolarHBondContact O-N 2.89Å; D197-S200 WeakPolarHBondContact O-CB 3.32Å; D197-S200 PolarHBondContact O-N 3.39Å; S200-T202 VanDerWaalsContact C-N 3.34Å; S200-T202 PolarHBondContact O-N 3.23Å; S200-Q203 PolarHBondContact O-N 2.99Å; S200-R204 PolarHBondContact O-N 3.43Å
201E91.8Very high93.2Very high114 Ų11496.8 Ų96.853%0.53350%0.496SS..Hα-helixtrans-58.4-44.5174.1-72.5179.5170.100112.1D197 R204 L205D197-E201 WeakPolarHBondContact O-CG 3.43Å; D197-E201 PolarHBondContact O-N 2.86Å; E201-R204 PolarHBondContact O-N 3.25Å; E201-L205 WeakPolarHBondContact O-CB 3.28Å; E201-L205 PolarHBondContact O-N 3.37Å
202T93.5Very high93Very high70 Ų7099 Ų9943%0.42950%0.501SS..Hα-helixtrans-66.7-40179.4-57.10000111.6K198 L199 S200 L205 I206K198-T202 WeakPolarHBondContact O-CB 3.49Å; K198-T202 PolarHBondContact O-N 3.49Å; K198-T202 PolarHBondContact O-OG1 3.18Å; L199-T202 PolarHBondContact O-N 3.22Å; S200-T202 VanDerWaalsContact C-N 3.34Å; S200-T202 PolarHBondContact O-N 3.23Å; T202-L205 PolarHBondContact O-N 3.49Å; T202-I206 HydrophobicContact CG2-CD1 3.98Å; T202-I206 HydrophobicContact CG2-CG1 4.47Å; T202-I206 VanDerWaalsContact O-CG1 3.28Å; T202-I206 WeakPolarHBondContact O-CG1 3.5Å; T202-I206 PolarHBondContact O-N 3.5Å
203Q93Very high93Very high115 Ų11597.8 Ų97.854%0.53750%0.5SS..Hα-helixtrans-63.6-42.6175.3-75.9174.5-12.800111.4L199 S200 L205 I206 S207L199-Q203 HydrophobicContact CD1-CG 4.48Å; L199-Q203 WeakPolarHBondContact O-CB 3.4Å; L199-Q203 VanDerWaalsContact O-CG 3.28Å; L199-Q203 WeakPolarHBondContact O-CG 3.47Å; L199-Q203 PolarHBondContact O-N 2.84Å; S200-Q203 PolarHBondContact O-N 2.99Å; Q203-L205 VanDerWaalsContact C-N 3.33Å; Q203-L205 PolarHBondContact O-N 2.8Å; Q203-I206 PolarHBondContact O-N 2.63Å; Q203-S207 WeakPolarHBondContact O-CB 3.26Å; Q203-S207 PolarHBondContact O-N 3.34Å
204R93.2Very high93.1Very high107 Ų10796.9 Ų96.940%0.40450%0.495SS..Hα-helixtrans-59.6-45.6173.1-172.3171.777.1-140.2-4.3111S200 E201 S207 N208 E272S200-R204 PolarHBondContact O-N 3.43Å; E201-R204 PolarHBondContact O-N 3.25Å; R204-S207 PolarHBondContact O-N 2.88Å; R204-N208 WeakPolarHBondContact O-CB 3.45Å; R204-N208 VanDerWaalsContact O-CG 3.23Å; R204-N208 PolarHBondContact O-N 2.83Å; R204-E272 WeakPolarHBondContact CD-OE1 3.13Å; R204-E272 IonicContact CZ-OE1 3.61Å; R204-E272 IonicContact CZ-OE2 3.05Å; R204-E272 VanDerWaalsContact CZ-OE2 3.24Å; R204-E272 VanDerWaalsContact NE-CD 3.34Å; R204-E272 IonicContact NE-OE1 2.89Å; R204-E272 PolarHBondContact NE-OE1 3.15Å; R204-E272 IonicContact NE-OE2 3.07Å; R204-E272 PolarHBondContact NE-OE2 2.95Å; R204-E272 IonicContact NH2-OE1 3.04Å; R204-E272 IonicContact NH2-OE2 3.25Å; R204-E272 PolarHBondContact NH2-OE2 3.35Å
205L93.9Very high93Very high92 Ų9294.3 Ų94.348%0.48249%0.488SS..Hα-helixtrans-61.1-46.5177.6-173.164.4000112.1E201 T202 Q203 S207 N208 Y209E201-L205 WeakPolarHBondContact O-CB 3.28Å; E201-L205 PolarHBondContact O-N 3.37Å; T202-L205 PolarHBondContact O-N 3.49Å; Q203-L205 VanDerWaalsContact C-N 3.33Å; Q203-L205 PolarHBondContact O-N 2.8Å; L205-S207 VanDerWaalsContact C-N 3.34Å; L205-S207 PolarHBondContact O-N 3.3Å; L205-N208 PolarHBondContact O-N 3.26Å; L205-Y209 HydrophobicContact CD1-CD2 4Å; L205-Y209 HydrophobicContact CD1-CE2 3.61Å; L205-Y209 HydrophobicContact CD2-CE2 4.13Å; L205-Y209 HydrophobicContact CG-CD2 3.82Å; L205-Y209 HydrophobicContact CG-CE2 3.65Å; L205-Y209 VanDerWaalsContact O-CD2 3.25Å; L205-Y209 WeakPolarHBondContact O-CD2 3.46Å; L205-Y209 PolarHBondContact O-N 2.92Å
206I92.6Very high92.9Very high110 Ų11096 Ų9656%0.56449%0.489SS*.Hα-helixtrans-60.2-44.2176.2-70.8166.9000110.7T202 Q203 N208 Y209 K210T202-I206 HydrophobicContact CG2-CD1 3.98Å; T202-I206 HydrophobicContact CG2-CG1 4.47Å; T202-I206 VanDerWaalsContact O-CG1 3.28Å; T202-I206 WeakPolarHBondContact O-CG1 3.5Å; T202-I206 PolarHBondContact O-N 3.5Å; Q203-I206 PolarHBondContact O-N 2.63Å; I206-N208 VanDerWaalsContact C-N 3.34Å; I206-N208 PolarHBondContact O-N 2.88Å; I206-Y209 PolarHBondContact O-N 2.86Å; I206-K210 WeakPolarHBondContact O-CB 3.43Å; I206-K210 PolarHBondContact O-N 2.92Å
207S93.8Very high93.1Very high60 Ų6096 Ų9642%0.4249%0.489SS..Hα-helixtrans-62.2-42.4176.9-170.50000111.7Q203 R204 L205 K210 N211Q203-S207 WeakPolarHBondContact O-CB 3.26Å; Q203-S207 PolarHBondContact O-N 3.34Å; R204-S207 PolarHBondContact O-N 2.88Å; L205-S207 VanDerWaalsContact C-N 3.34Å; L205-S207 PolarHBondContact O-N 3.3Å; S207-K210 PolarHBondContact O-N 2.84Å; S207-N211 WeakPolarHBondContact O-CB 3.34Å; S207-N211 PolarHBondContact O-N 3.42Å; S207-N211 PolarHBondContact O-ND2 2.74Å
208N91.1Very high93.2Very high73 Ų7397.8 Ų97.839%0.3949%0.491SS..Hα-helixtrans-64.4-42.8177.1-71.7-12.8000111.6R204 L205 I206 N211 L212R204-N208 WeakPolarHBondContact O-CB 3.45Å; R204-N208 VanDerWaalsContact O-CG 3.23Å; R204-N208 PolarHBondContact O-N 2.83Å; L205-N208 PolarHBondContact O-N 3.26Å; I206-N208 VanDerWaalsContact C-N 3.34Å; I206-N208 PolarHBondContact O-N 2.88Å; N208-N211 PolarHBondContact O-N 3.28Å; N208-L212 WeakPolarHBondContact O-CB 3.44Å; N208-L212 PolarHBondContact O-N 3.3Å
209Y93.8Very high93.1Very high151 Ų15193.1 Ų93.159%0.59248%0.476SS*.Hα-helixtrans-62.6-41.8174.5-88.4-66.1000112.5L205 I206 L212 S213L205-Y209 HydrophobicContact CD1-CD2 4Å; L205-Y209 HydrophobicContact CD1-CE2 3.61Å; L205-Y209 HydrophobicContact CD2-CE2 4.13Å; L205-Y209 HydrophobicContact CG-CD2 3.82Å; L205-Y209 HydrophobicContact CG-CE2 3.65Å; L205-Y209 VanDerWaalsContact O-CD2 3.25Å; L205-Y209 WeakPolarHBondContact O-CD2 3.46Å; L205-Y209 PolarHBondContact O-N 2.92Å; I206-Y209 PolarHBondContact O-N 2.86Å; Y209-L212 PolarHBondContact O-N 3.07Å; Y209-S213 WeakPolarHBondContact O-CB 3.5Å; Y209-S213 PolarHBondContact O-N 3.38Å
210K95.6Very high93.1Very high131 Ų13193.2 Ų93.257%0.5748%0.477SS*.Hα-helixtrans-60.9-49.8175.2-179.7174.3177.7170.60110.9I206 S207 L212 S213 D214I206-K210 WeakPolarHBondContact O-CB 3.43Å; I206-K210 PolarHBondContact O-N 2.92Å; S207-K210 PolarHBondContact O-N 2.84Å; K210-L212 VanDerWaalsContact C-N 3.29Å; K210-L212 PolarHBondContact O-N 2.93Å; K210-S213 WeakPolarHBondContact O-CB 3.28Å; K210-S213 PolarHBondContact O-N 2.74Å; K210-S213 VanDerWaalsContact O-N 3.13Å; K210-D214 VanDerWaalsContact O-CG 3.29Å; K210-D214 PolarHBondContact O-N 3.17Å
211N92.6Very high93.2Very high87 Ų8795.1 Ų95.147%0.46548%0.478SS..Hα-helixtrans-58.3-42.2177.7-70.1-21.3000111.8S207 N208 V215S207-N211 WeakPolarHBondContact O-CB 3.34Å; S207-N211 PolarHBondContact O-N 3.42Å; S207-N211 PolarHBondContact O-ND2 2.74Å; N208-N211 PolarHBondContact O-N 3.28Å; N211-V215 VanDerWaalsContact O-CG2 3.29Å; N211-V215 WeakPolarHBondContact O-CG2 3.49Å; N211-V215 PolarHBondContact O-N 2.87Å
212L91.6Very high93.2Very high95 Ų9593.8 Ų93.850%0.49747%0.474SS..Hα-helixtrans-62.9-45.6175.4177.561.2000111.6N208 Y209 K210 V215 L216N208-L212 WeakPolarHBondContact O-CB 3.44Å; N208-L212 PolarHBondContact O-N 3.3Å; Y209-L212 PolarHBondContact O-N 3.07Å; K210-L212 VanDerWaalsContact C-N 3.29Å; K210-L212 PolarHBondContact O-N 2.93Å; L212-V215 PolarHBondContact O-N 3.18Å; L212-L216 HydrophobicContact CD1-CD1 4.21Å; L212-L216 HydrophobicContact CD1-CG 4.23Å; L212-L216 HydrophobicContact CG-CD1 4.05Å; L212-L216 HydrophobicContact CG-CG 4.49Å; L212-L216 VanDerWaalsContact O-CG 3.3Å; L212-L216 WeakPolarHBondContact O-CG 3.5Å; L212-L216 PolarHBondContact O-N 3.42Å
213S94.5Very high93Very high67 Ų6795.9 Ų95.947%0.46948%0.482SS..Hα-helixtrans-59.9-47.2177.6-1700000111.5Y209 K210 V215 L216 E217Y209-S213 WeakPolarHBondContact O-CB 3.5Å; Y209-S213 PolarHBondContact O-N 3.38Å; K210-S213 WeakPolarHBondContact O-CB 3.28Å; K210-S213 PolarHBondContact O-N 2.74Å; K210-S213 VanDerWaalsContact O-N 3.13Å; S213-V215 VanDerWaalsContact C-N 3.3Å; S213-V215 PolarHBondContact O-N 3.28Å; S213-L216 PolarHBondContact O-N 3.23Å; S213-E217 WeakPolarHBondContact O-CB 3.42Å; S213-E217 PolarHBondContact O-N 3.11Å
214D95.6Very high92.8Very high62 Ų6294.3 Ų94.333%0.33248%0.484SS..Hα-helixtrans-61.1-39178.8-68-6.3000111.3K210 K218K210-D214 VanDerWaalsContact O-CG 3.29Å; K210-D214 PolarHBondContact O-N 3.17Å; D214-K218 WeakPolarHBondContact O-CG 3.25Å; D214-K218 PolarHBondContact O-N 3.29Å; D214-K218 VanDerWaalsContact O-N 3.16Å
215V91.4Very high92.6Very high68 Ų6896.4 Ų96.441%0.41250%0.498SS..Hα-helixtrans-68.7-41.3175.9169.90000111.4N211 L212 S213 S219N211-V215 VanDerWaalsContact O-CG2 3.29Å; N211-V215 WeakPolarHBondContact O-CG2 3.49Å; N211-V215 PolarHBondContact O-N 2.87Å; L212-V215 PolarHBondContact O-N 3.18Å; S213-V215 VanDerWaalsContact C-N 3.3Å; S213-V215 PolarHBondContact O-N 3.28Å; V215-S219 VanDerWaalsContact O-CB 3.25Å; V215-S219 WeakPolarHBondContact O-CB 3.28Å; V215-S219 PolarHBondContact O-N 3.15Å; V215-S219 PolarHBondContact O-OG 3.36Å
216L92.3Very high92.2Very high94 Ų9493.7 Ų93.749%0.49249%0.489SS..Hα-helixtrans-65.1-42.9178-73.6171.9000111.7L212 S213 S219 N220L212-L216 HydrophobicContact CD1-CD1 4.21Å; L212-L216 HydrophobicContact CD1-CG 4.23Å; L212-L216 HydrophobicContact CG-CD1 4.05Å; L212-L216 HydrophobicContact CG-CG 4.49Å; L212-L216 VanDerWaalsContact O-CG 3.3Å; L212-L216 WeakPolarHBondContact O-CG 3.5Å; L212-L216 PolarHBondContact O-N 3.42Å; S213-L216 PolarHBondContact O-N 3.23Å; L216-S219 PolarHBondContact O-N 3.33Å; L216-N220 PolarHBondContact O-N 2.9Å; L216-N220 PolarHBondContact O-ND2 3.38Å
217E95.1Very high91.9Very high115 Ų11591.1 Ų91.154%0.53748%0.481SS..Hα-helixtrans-59.3-53.9176.5-174.1172.3-165.700110.9S213 S219 N220 E221S213-E217 WeakPolarHBondContact O-CB 3.42Å; S213-E217 PolarHBondContact O-N 3.11Å; E217-S219 VanDerWaalsContact C-N 3.29Å; E217-S219 PolarHBondContact O-N 3.38Å; E217-N220 WeakPolarHBondContact O-CB 3.48Å; E217-N220 PolarHBondContact O-N 3.49Å; E217-N220 VanDerWaalsContact O-N 3.11Å; E217-E221 PolarHBondContact O-N 3.43Å
218K95.1Very high91.4Very high143 Ų14390.8 Ų90.862%0.62248%0.482SS*.Hα-helixtrans-62.1-34.5177.7-70.2176.5-177.2177.60113.3D214 L222D214-K218 WeakPolarHBondContact O-CG 3.25Å; D214-K218 PolarHBondContact O-N 3.29Å; D214-K218 VanDerWaalsContact O-N 3.16Å; K218-L222 WeakPolarHBondContact O-CB 3.47Å; K218-L222 PolarHBondContact O-N 3.21Å
219S91.2Very high91.1Very high36 Ų3691.6 Ų91.625%0.25249%0.485SS..Hα-helixtrans-67.9-38.4176.5-60.60000111.3V215 L216 E217 L222 L223V215-S219 VanDerWaalsContact O-CB 3.25Å; V215-S219 WeakPolarHBondContact O-CB 3.28Å; V215-S219 PolarHBondContact O-N 3.15Å; V215-S219 PolarHBondContact O-OG 3.36Å; L216-S219 PolarHBondContact O-N 3.33Å; E217-S219 VanDerWaalsContact C-N 3.29Å; E217-S219 PolarHBondContact O-N 3.38Å; S219-L222 PolarHBondContact O-N 3.46Å; S219-L223 WeakPolarHBondContact O-CB 3.27Å; S219-L223 VanDerWaalsContact O-CG 3.25Å; S219-L223 WeakPolarHBondContact O-CG 3.39Å; S219-L223 PolarHBondContact O-N 2.91Å
220N91.9Very high90.5Very high100 Ų10090.8 Ų90.854%0.53549%0.49SS..Hα-helixtrans-68.2-39.3176-74.7-27.4000112.1L216 E217 L223 S224L216-N220 PolarHBondContact O-N 2.9Å; L216-N220 PolarHBondContact O-ND2 3.38Å; E217-N220 WeakPolarHBondContact O-CB 3.48Å; E217-N220 PolarHBondContact O-N 3.49Å; E217-N220 VanDerWaalsContact O-N 3.11Å; N220-L223 PolarHBondContact O-N 3.33Å; N220-S224 WeakPolarHBondContact O-CB 3.32Å; N220-S224 PolarHBondContact O-N 3.35Å; N220-S224 PolarHBondContact O-OG 2.91Å
221E94.1Very high90Very high107 Ų10794.4 Ų94.450%0.550%0.501SS..Hα-helixtrans-59-52.2172.1-70177.8162.500110.8E217 L223 S224 E225E217-E221 PolarHBondContact O-N 3.43Å; E221-L223 VanDerWaalsContact C-N 3.35Å; E221-L223 PolarHBondContact O-N 3.24Å; E221-S224 WeakPolarHBondContact O-CB 3.45Å; E221-S224 PolarHBondContact O-N 3.36Å; E221-S224 VanDerWaalsContact O-N 3.1Å; E221-E225 PolarHBondContact O-N 2.94Å
222L90.8Very high89.8Confident87 Ų8795.3 Ų95.346%0.45550%0.503SS..Hα-helixtrans-56.6-46.2177.8177.768.1000112.2K218 S219 S224 E225 A226 L255K218-L222 WeakPolarHBondContact O-CB 3.47Å; K218-L222 PolarHBondContact O-N 3.21Å; S219-L222 PolarHBondContact O-N 3.46Å; L222-S224 VanDerWaalsContact C-N 3.29Å; L222-S224 PolarHBondContact O-N 2.91Å; L222-E225 PolarHBondContact O-N 3.07Å; L222-A226 VanDerWaalsContact O-CB 3.22Å; L222-A226 WeakPolarHBondContact O-CB 3.25Å; L222-A226 PolarHBondContact O-N 3.37Å; L222-L255 HydrophobicContact CD2-CD2 4.36Å
223L90Very high89.7Confident114 Ų11497 Ų9760%0.59751%0.513SS*.Hα-helixtrans-64.2-37.1178.8-74.4172000111.7S219 N220 E221 S227S219-L223 WeakPolarHBondContact O-CB 3.27Å; S219-L223 VanDerWaalsContact O-CG 3.25Å; S219-L223 WeakPolarHBondContact O-CG 3.39Å; S219-L223 PolarHBondContact O-N 2.91Å; N220-L223 PolarHBondContact O-N 3.33Å; E221-L223 VanDerWaalsContact C-N 3.35Å; E221-L223 PolarHBondContact O-N 3.24Å; L223-S227 VanDerWaalsContact O-CB 3.29Å; L223-S227 WeakPolarHBondContact O-CB 3.42Å; L223-S227 PolarHBondContact O-N 3.1Å
224S89.7Confident89.4Confident82 Ų8296.3 Ų96.357%0.57350%0.503SS*.Hα-helixtrans-65.3-45.8177-60.30000111N220 E221 L222 S227N220-S224 WeakPolarHBondContact O-CB 3.32Å; N220-S224 PolarHBondContact O-N 3.35Å; N220-S224 PolarHBondContact O-OG 2.91Å; E221-S224 WeakPolarHBondContact O-CB 3.45Å; E221-S224 PolarHBondContact O-N 3.36Å; E221-S224 VanDerWaalsContact O-N 3.1Å; L222-S224 VanDerWaalsContact C-N 3.29Å; L222-S224 PolarHBondContact O-N 2.91Å; S224-S227 PolarHBondContact O-N 2.99Å; S224-S227 PolarHBondContact O-OG 3.43Å
225E87Confident89.1Confident150 Ų15096.7 Ų96.770%0.70151%0.511SS*.Hα-helixtrans-63.5-45.3175.3-69.6-179-176.200112.1E221 L222 S227E221-E225 PolarHBondContact O-N 2.94Å; L222-E225 PolarHBondContact O-N 3.07Å; E225-S227 VanDerWaalsContact C-N 3.32Å; E225-S227 PolarHBondContact O-N 3.4Å
226A87Confident89.1Confident35 Ų3598.9 Ų98.929%0.28952%0.517SS..Hα-helixtrans-71.6-24.6-178.300000113.3L222 A228 L229L222-A226 VanDerWaalsContact O-CB 3.22Å; L222-A226 WeakPolarHBondContact O-CB 3.25Å; L222-A226 PolarHBondContact O-N 3.37Å; A226-A228 PolarHBondContact O-N 2.99Å; A226-A228 VanDerWaalsContact O-N 3.16Å; A226-L229 WeakPolarHBondContact O-CB 3.38Å; A226-L229 PolarHBondContact O-N 3.46Å
227S85.6Confident89Confident57 Ų5798 Ų9840%0.39952%0.515SS..Hα-helixtrans-57.1-33-177.670.10000113.1L223 S224 E225 Y231L223-S227 VanDerWaalsContact O-CB 3.29Å; L223-S227 WeakPolarHBondContact O-CB 3.42Å; L223-S227 PolarHBondContact O-N 3.1Å; S224-S227 PolarHBondContact O-N 2.99Å; S224-S227 PolarHBondContact O-OG 3.43Å; E225-S227 VanDerWaalsContact C-N 3.32Å; E225-S227 PolarHBondContact O-N 3.4Å; S227-Y231 WeakPolarHBondContact O-CD2 3.43Å
228A83.1Confident88.8Confident53 Ų5395.2 Ų95.244%0.43850%0.503SS..THydrogen-bonded Turntrans-69.1-34.9177.100000112.4A226 I230 Y231 Q232A226-A228 PolarHBondContact O-N 2.99Å; A226-A228 VanDerWaalsContact O-N 3.16Å; A228-I230 VanDerWaalsContact C-N 3.3Å; A228-I230 PolarHBondContact O-N 2.87Å; A228-Y231 PolarHBondContact O-N 3.32Å; A228-Q232 WeakPolarHBondContact O-CG 3.26Å
229L84.3Confident88.5Confident89 Ų8993.2 Ų93.247%0.46651%0.508SS..G310 helixtrans-65.6-33.4-178.6-66171.8000112.1A226 Y231 Q232A226-L229 WeakPolarHBondContact O-CB 3.38Å; A226-L229 PolarHBondContact O-N 3.46Å; L229-Y231 PolarHBondContact O-N 2.77Å; L229-Q232 PolarHBondContact O-N 2.88Å; L229-Q232 VanDerWaalsContact O-N 3.09Å
230I81.9Confident88.7Confident134 Ų134101 Ų10169%0.68753%0.531SS*.G310 helixtrans-60.5-29.3-177.5-61.6174.2000111.9A228A228-I230 VanDerWaalsContact C-N 3.3Å; A228-I230 PolarHBondContact O-N 2.87Å
231Y84.9Confident88.7Confident207 Ų20799.7 Ų99.781%0.81252%0.524SS*.G310 helixtrans-98.2-1.6-179-58.9-72.8000113.6S227 A228 L229S227-Y231 WeakPolarHBondContact O-CD2 3.43Å; A228-Y231 PolarHBondContact O-N 3.32Å; L229-Y231 PolarHBondContact O-N 2.77Å
232Q88.1Confident88.5Confident106 Ų10696.8 Ų96.850%0.49552%0.523SS..SBendtrans-86.4135.2177.9-72.9178.81.400111A228 L229 L234A228-Q232 WeakPolarHBondContact O-CG 3.26Å; L229-Q232 PolarHBondContact O-N 2.88Å; L229-Q232 VanDerWaalsContact O-N 3.09Å; Q232-L234 HydrophobicContact CB-CD2 4.26Å; Q232-L234 HydrophobicContact CB-CG 4.33Å; Q232-L234 PolarHBondContact O-N 2.89Å; Q232-L234 VanDerWaalsContact O-N 3.15Å
233D89.8Confident88.6Confident132 Ų13298 Ų9871%0.70653%0.53SS*.  trans-77.398.8168.5-175.54.5000109.8S235D233-S235 VanDerWaalsContact C-N 3.34Å; D233-S235 WeakPolarHBondContact OD1-CB 3.29Å; D233-S235 PolarHBondContact OD1-N 3.31Å; D233-S235 PolarHBondContact OD1-OG 3.06Å
234L88.8Confident88.7Confident51 Ų5194 Ų9427%0.26751%0.513SS..  trans-91.48.2178.4-62.2177.2000113.1Q232 E236 V237 I238Q232-L234 HydrophobicContact CB-CD2 4.26Å; Q232-L234 HydrophobicContact CB-CG 4.33Å; Q232-L234 PolarHBondContact O-N 2.89Å; Q232-L234 VanDerWaalsContact O-N 3.15Å; L234-E236 VanDerWaalsContact C-N 3.3Å; L234-E236 PolarHBondContact O-N 3.38Å; L234-V237 PolarHBondContact O-N 2.87Å; L234-V237 VanDerWaalsContact O-N 3.14Å; L234-I238 HydrophobicContact CB-CD1 3.93Å; L234-I238 HydrophobicContact CB-CG1 4.29Å; L234-I238 WeakPolarHBondContact O-CB 3.45Å; L234-I238 VanDerWaalsContact O-CG1 3.32Å; L234-I238 WeakPolarHBondContact O-CG1 3.32Å; L234-I238 PolarHBondContact O-N 3.13Å
235S89Confident88.8Confident71 Ų7194.7 Ų94.750%0.49751%0.506SS..Hα-helixtrans-59.3-38.8-173.6-55.40000112.7D233 S239D233-S235 VanDerWaalsContact C-N 3.34Å; D233-S235 WeakPolarHBondContact OD1-CB 3.29Å; D233-S235 PolarHBondContact OD1-N 3.31Å; D233-S235 PolarHBondContact OD1-OG 3.06Å; S235-S239 VanDerWaalsContact O-CB 3.22Å; S235-S239 WeakPolarHBondContact O-CB 3.18Å; S235-S239 PolarHBondContact O-N 3.34Å; S235-S239 PolarHBondContact O-OG 2.92Å
236E91.7Very high89.2Confident113 Ų11396.8 Ų96.853%0.52851%0.507SS..Hα-helixtrans-67.8-42.7177.5-174174.4-171.700112L234 S239 R240L234-E236 VanDerWaalsContact C-N 3.3Å; L234-E236 PolarHBondContact O-N 3.38Å; E236-S239 PolarHBondContact O-N 2.92Å; E236-R240 WeakPolarHBondContact O-CB 3.41Å; E236-R240 WeakPolarHBondContact O-CG 3.25Å; E236-R240 PolarHBondContact O-N 3.34Å; E236-R240 IonicContact OE1-CZ 2.7Å; E236-R240 IonicContact OE1-NE 2.67Å; E236-R240 IonicContact OE1-NH1 3.56Å; E236-R240 PolarHBondContact OE1-NH1 2.68Å; E236-R240 IonicContact OE1-NH2 2.63Å; E236-R240 PolarHBondContact OE1-NH2 3.19Å
237V90.8Very high89.4Confident76 Ų76100.5 Ų100.546%0.46152%0.518SS..Hα-helixtrans-63.1-51178178.10000109.9L234 S239 R240 D241 A244L234-V237 PolarHBondContact O-N 2.87Å; L234-V237 VanDerWaalsContact O-N 3.14Å; V237-S239 VanDerWaalsContact C-N 3.26Å; V237-S239 PolarHBondContact O-N 3.21Å; V237-R240 PolarHBondContact O-N 3.47Å; V237-D241 PolarHBondContact O-N 2.92Å; V237-A244 HydrophobicContact CG1-CB 4.03Å
238I90.2Very high89.6Confident56 Ų56101 Ų10129%0.28752%0.516SS..Hα-helixtrans-62.3-34.5-179.3-67.9170.2000111.5L234 K245 L248L234-I238 HydrophobicContact CB-CD1 3.93Å; L234-I238 HydrophobicContact CB-CG1 4.29Å; L234-I238 WeakPolarHBondContact O-CB 3.45Å; L234-I238 VanDerWaalsContact O-CG1 3.32Å; L234-I238 WeakPolarHBondContact O-CG1 3.32Å; L234-I238 PolarHBondContact O-N 3.13Å; I238-K245 HydrophobicContact CG2-CB 4.06Å; I238-K245 HydrophobicContact CG2-CD 3.8Å; I238-K245 HydrophobicContact CG2-CG 3.89Å; I238-L248 HydrophobicContact CD1-CD2 3.97Å
239S89.8Confident90Very high102 Ų102102.1 Ų102.171%0.71352%0.515SS*.Hα-helixtrans-76.7-30.1179.9-60.70000113.3S235 E236 V237S235-S239 VanDerWaalsContact O-CB 3.22Å; S235-S239 WeakPolarHBondContact O-CB 3.18Å; S235-S239 PolarHBondContact O-N 3.34Å; S235-S239 PolarHBondContact O-OG 2.92Å; E236-S239 PolarHBondContact O-N 2.92Å; V237-S239 VanDerWaalsContact C-N 3.26Å; V237-S239 PolarHBondContact O-N 3.21Å
240R93.4Very high90.5Very high198 Ų198102.1 Ų102.175%0.74751%0.511SS*.Hα-helixtrans-94.2-30.8-177.2-71.3-174.2176.8174.213.5113.6E236 V237E236-R240 WeakPolarHBondContact O-CB 3.41Å; E236-R240 WeakPolarHBondContact O-CG 3.25Å; E236-R240 PolarHBondContact O-N 3.34Å; E236-R240 IonicContact OE1-CZ 2.7Å; E236-R240 IonicContact OE1-NE 2.67Å; E236-R240 IonicContact OE1-NH1 3.56Å; E236-R240 PolarHBondContact OE1-NH1 2.68Å; E236-R240 IonicContact OE1-NH2 2.63Å; E236-R240 PolarHBondContact OE1-NH2 3.19Å; V237-R240 PolarHBondContact O-N 3.47Å
241D92.4Very high91Very high73 Ų73100 Ų10039%0.3950%0.501SS..  trans-119.896.1-174.8-171.1-13.4000111V237 L243 A244 K245V237-D241 PolarHBondContact O-N 2.92Å; D241-L243 PolarHBondContact O-N 3.28Å; D241-L243 WeakPolarHBondContact OD1-CA 3.39Å; D241-L243 VanDerWaalsContact OD1-CB 3.32Å; D241-L243 WeakPolarHBondContact OD1-CB 3.3Å; D241-L243 PolarHBondContact OD1-N 3.14Å; D241-A244 HydrophobicContact CB-CB 3.79Å; D241-A244 PolarHBondContact O-N 2.91Å; D241-A244 PolarHBondContact OD1-N 2.87Å; D241-K245 PolarHBondContact O-N 2.95Å; D241-K245 VanDerWaalsContact O-N 3.11Å
242G91.1Very high91.3Very high46 Ų4693 Ų9347%0.47448%0.48SS..Hα-helixtrans-65.3-21176.700000113.8R246G242-R246 WeakPolarHBondContact O-CG 3.41Å; G242-R246 PolarHBondContact O-N 2.95Å
243L92.9Very high91.6Very high114 Ų11494 Ų9460%0.59748%0.484SS*.Hα-helixtrans-75.9-46.1173.4-179.8136.3000110.1D241 K245 R246 E247D241-L243 PolarHBondContact O-N 3.28Å; D241-L243 WeakPolarHBondContact OD1-CA 3.39Å; D241-L243 VanDerWaalsContact OD1-CB 3.32Å; D241-L243 WeakPolarHBondContact OD1-CB 3.3Å; D241-L243 PolarHBondContact OD1-N 3.14Å; L243-K245 VanDerWaalsContact C-N 3.27Å; L243-K245 PolarHBondContact O-N 3.16Å; L243-R246 PolarHBondContact O-N 3.29Å; L243-R246 VanDerWaalsContact O-N 3.08Å; L243-E247 HydrophobicContact CD2-CG 4.25Å; L243-E247 WeakPolarHBondContact O-CG 3.32Å; L243-E247 PolarHBondContact O-N 2.94Å
244A91.2Very high91.8Very high29 Ų2995 Ų9524%0.2448%0.478CS..Hα-helixtrans-56.4-42174.700000112.1V237 D241 L248V237-A244 HydrophobicContact CG1-CB 4.03Å; D241-A244 HydrophobicContact CB-CB 3.79Å; D241-A244 PolarHBondContact O-N 2.91Å; D241-A244 PolarHBondContact OD1-N 2.87Å; A244-L248 WeakPolarHBondContact O-CB 3.5Å; A244-L248 PolarHBondContact O-N 2.96Å
245K92.4Very high92Very high97 Ų9795.8 Ų95.842%0.42248%0.482SS..Hα-helixtrans-59.4-48.1173.5-177.7178.1179.5177.20112.5I238 D241 L243 L248 D249I238-K245 HydrophobicContact CG2-CB 4.06Å; I238-K245 HydrophobicContact CG2-CD 3.8Å; I238-K245 HydrophobicContact CG2-CG 3.89Å; D241-K245 PolarHBondContact O-N 2.95Å; D241-K245 VanDerWaalsContact O-N 3.11Å; L243-K245 VanDerWaalsContact C-N 3.27Å; L243-K245 PolarHBondContact O-N 3.16Å; K245-L248 PolarHBondContact O-N 3.08Å; K245-D249 VanDerWaalsContact O-CG 3.32Å; K245-D249 PolarHBondContact O-N 2.89Å
246R94.3Very high92.2Very high193 Ų19398.1 Ų98.173%0.72849%0.485SS*.Hα-helixtrans-64.1-40.9-179.4-76.5175-175.6175.22.8112.6G242 L243 L248 D249 F250G242-R246 WeakPolarHBondContact O-CG 3.41Å; G242-R246 PolarHBondContact O-N 2.95Å; L243-R246 PolarHBondContact O-N 3.29Å; L243-R246 VanDerWaalsContact O-N 3.08Å; R246-L248 VanDerWaalsContact C-N 3.32Å; R246-D249 PolarHBondContact O-N 3.26Å; R246-F250 WeakPolarHBondContact O-CB 3.47Å; R246-F250 PolarHBondContact O-N 3.28Å
247E92Very high92.3Very high114 Ų11499 Ų9953%0.53349%0.488SS..Hα-helixtrans-63.6-39.6176.2-69.8-65.6163.500111.3L243 L251L243-E247 HydrophobicContact CD2-CG 4.25Å; L243-E247 WeakPolarHBondContact O-CG 3.32Å; L243-E247 PolarHBondContact O-N 2.94Å; E247-L251 WeakPolarHBondContact O-CB 3.35Å; E247-L251 PolarHBondContact O-N 3.11Å
248L89.6Confident92.2Very high67 Ų6799.3 Ų99.335%0.35148%0.483SS..Hα-helixtrans-64.2-51.4174.3-178.763000111.7I238 A244 K245 R246 F250 L251 T252I238-L248 HydrophobicContact CD1-CD2 3.97Å; A244-L248 WeakPolarHBondContact O-CB 3.5Å; A244-L248 PolarHBondContact O-N 2.96Å; K245-L248 PolarHBondContact O-N 3.08Å; R246-L248 VanDerWaalsContact C-N 3.32Å; L248-F250 VanDerWaalsContact C-N 3.27Å; L248-F250 PolarHBondContact O-N 2.99Å; L248-L251 WeakPolarHBondContact O-CB 3.34Å; L248-L251 PolarHBondContact O-N 2.98Å; L248-T252 PolarHBondContact O-N 3.31Å; L248-T252 PolarHBondContact O-OG1 3.32Å
249D92.6Very high92.2Very high77 Ų77101.2 Ų101.241%0.41249%0.493SS..Hα-helixtrans-57.1-43.7178.4-69.4-22.8000110.5K245 R246 T252 E253K245-D249 VanDerWaalsContact O-CG 3.32Å; K245-D249 PolarHBondContact O-N 2.89Å; R246-D249 PolarHBondContact O-N 3.26Å; D249-T252 WeakPolarHBondContact O-CB 3.42Å; D249-T252 PolarHBondContact O-N 3.11Å; D249-E253 WeakPolarHBondContact O-CG 3.41Å; D249-E253 PolarHBondContact O-N 3.06Å
250F94.7Very high92.2Very high88 Ų8899.4 Ų99.439%0.38648%0.48SS..Hα-helixtrans-67.2-38.4178.6-175.1-121.7000113.6R246 L248 R254R246-F250 WeakPolarHBondContact O-CB 3.47Å; R246-F250 PolarHBondContact O-N 3.28Å; L248-F250 VanDerWaalsContact C-N 3.27Å; L248-F250 PolarHBondContact O-N 2.99Å; F250-R254 WeakPolarHBondContact O-CB 3.49Å; F250-R254 VanDerWaalsContact O-CG 3.27Å; F250-R254 WeakPolarHBondContact O-CG 3.49Å; F250-R254 PolarHBondContact O-N 2.9Å; F250-R254 VanDerWaalsContact O-N 3.07Å
251L91.2Very high91.9Very high90 Ų9093.1 Ų93.147%0.47146%0.461SS..Hα-helixtrans-61.8-45.2172.1176.664.8000110.7E247 L248 R254 L255E247-L251 WeakPolarHBondContact O-CB 3.35Å; E247-L251 PolarHBondContact O-N 3.11Å; L248-L251 WeakPolarHBondContact O-CB 3.34Å; L248-L251 PolarHBondContact O-N 2.98Å; L251-R254 PolarHBondContact O-N 3.33Å; L251-L255 HydrophobicContact CD1-CD1 4.16Å; L251-L255 HydrophobicContact CD1-CG 4.33Å; L251-L255 HydrophobicContact CG-CD1 4.05Å; L251-L255 WeakPolarHBondContact O-CG 3.47Å; L251-L255 PolarHBondContact O-N 2.95Å
252T90.6Very high91.7Very high61 Ų6193 Ų9337%0.37446%0.46SS..Hα-helixtrans-60.2-50.6177.5-620000111.5L248 D249 R254 L255 E256L248-T252 PolarHBondContact O-N 3.31Å; L248-T252 PolarHBondContact O-OG1 3.32Å; D249-T252 WeakPolarHBondContact O-CB 3.42Å; D249-T252 PolarHBondContact O-N 3.11Å; T252-R254 VanDerWaalsContact C-N 3.3Å; T252-R254 PolarHBondContact O-N 2.91Å; T252-L255 PolarHBondContact O-N 3.04Å; T252-L255 VanDerWaalsContact O-N 3.14Å; T252-E256 HydrophobicContact CG2-CG 4.44Å; T252-E256 WeakPolarHBondContact O-CG 3.33Å; T252-E256 PolarHBondContact O-N 3.27Å
253E95.8Very high91.5Very high126 Ų12696.8 Ų96.859%0.58946%0.464SS*.Hα-helixtrans-58.1-41.5177.7-73.8178.6179.300112.2D249 E256 K257D249-E253 WeakPolarHBondContact O-CG 3.41Å; D249-E253 PolarHBondContact O-N 3.06Å; E253-E256 PolarHBondContact O-N 3.36Å; E253-K257 WeakPolarHBondContact O-CB 3.5Å; E253-K257 PolarHBondContact O-N 3.01Å
254R93.3Very high91.2Very high154 Ų15495.9 Ų95.958%0.58146%0.459SS*.Hα-helixtrans-63.9-42.1176.6-77.9174.4163.8-167.3-4112.3F250 L251 T252 F258F250-R254 WeakPolarHBondContact O-CB 3.49Å; F250-R254 VanDerWaalsContact O-CG 3.27Å; F250-R254 WeakPolarHBondContact O-CG 3.49Å; F250-R254 PolarHBondContact O-N 2.9Å; F250-R254 VanDerWaalsContact O-N 3.07Å; L251-R254 PolarHBondContact O-N 3.33Å; T252-R254 VanDerWaalsContact C-N 3.3Å; T252-R254 PolarHBondContact O-N 2.91Å; R254-F258 WeakPolarHBondContact O-CB 3.32Å; R254-F258 PolarHBondContact O-N 3.16Å
255L92.3Very high90.7Very high66 Ų6699.4 Ų99.435%0.34647%0.473SS..Hα-helixtrans-68.2-40.6177.7-73.6171.8000111.6L222 L251 T252 F258 L259L222-L255 HydrophobicContact CD2-CD2 4.36Å; L251-L255 HydrophobicContact CD1-CD1 4.16Å; L251-L255 HydrophobicContact CD1-CG 4.33Å; L251-L255 HydrophobicContact CG-CD1 4.05Å; L251-L255 WeakPolarHBondContact O-CG 3.47Å; L251-L255 PolarHBondContact O-N 2.95Å; T252-L255 PolarHBondContact O-N 3.04Å; T252-L255 VanDerWaalsContact O-N 3.14Å; L255-F258 PolarHBondContact O-N 3.49Å; L255-L259 WeakPolarHBondContact O-CB 3.25Å; L255-L259 VanDerWaalsContact O-CG 3.25Å; L255-L259 WeakPolarHBondContact O-CG 3.42Å; L255-L259 PolarHBondContact O-N 2.96Å
256E94.4Very high89.7Confident120 Ų12099.5 Ų99.556%0.56149%0.486SS*.Hα-helixtrans-61.5-44.3174.8-73.5-178.1161.400111.9T252 E253 S260T252-E256 HydrophobicContact CG2-CG 4.44Å; T252-E256 WeakPolarHBondContact O-CG 3.33Å; T252-E256 PolarHBondContact O-N 3.27Å; E253-E256 PolarHBondContact O-N 3.36Å; E256-S260 WeakPolarHBondContact O-CB 3.41Å; E256-S260 PolarHBondContact O-N 3.36Å; E256-S260 PolarHBondContact O-OG 2.86Å
257K92.4Very high88.7Confident133 Ų13398.1 Ų98.158%0.57849%0.485SS*.Hα-helixtrans-61.8-48.5173.7-175.4-179.5179.4-63.70111.3E253 L259 S260 D261E253-K257 WeakPolarHBondContact O-CB 3.5Å; E253-K257 PolarHBondContact O-N 3.01Å; K257-L259 PolarHBondContact O-N 3.1Å; K257-S260 WeakPolarHBondContact O-CB 3.22Å; K257-S260 PolarHBondContact O-N 3.07Å; K257-S260 VanDerWaalsContact O-N 3.1Å; K257-D261 IonicContact NZ-OD2 2.71Å; K257-D261 PolarHBondContact NZ-OD2 3.16Å; K257-D261 PolarHBondContact O-N 3.31Å
258F89.5Confident87.2Confident82 Ų8296.9 Ų96.936%0.3648%0.482SS..Hα-helixtrans-58.3-45.9179176.6-113000112.3R254 L255 S260 D261 L262R254-F258 WeakPolarHBondContact O-CB 3.32Å; R254-F258 PolarHBondContact O-N 3.16Å; L255-F258 PolarHBondContact O-N 3.49Å; F258-S260 VanDerWaalsContact C-N 3.28Å; F258-S260 PolarHBondContact O-N 3.23Å; F258-D261 PolarHBondContact O-N 2.92Å; F258-L262 HydrophobicContact CD1-CD1 4.01Å; F258-L262 HydrophobicContact CD2-CG 4.45Å; F258-L262 HydrophobicContact CE1-CD1 3.43Å; F258-L262 VanDerWaalsContact CE1-CD1 3.43Å; F258-L262 HydrophobicContact CE1-CG 4.18Å; F258-L262 HydrophobicContact CE2-CD1 4.18Å; F258-L262 HydrophobicContact CE2-CD2 4.25Å; F258-L262 HydrophobicContact CE2-CG 4.07Å; F258-L262 HydrophobicContact CZ-CD1 3.54Å; F258-L262 HydrophobicContact CZ-CD2 4.18Å; F258-L262 HydrophobicContact CZ-CG 3.94Å; F258-L262 WeakPolarHBondContact O-CG 3.36Å; F258-L262 PolarHBondContact O-N 2.97Å
259L90Very high85.4Confident95 Ų95101.6 Ų101.650%0.49751%0.507SS..Hα-helixtrans-64.4-33.6176.3-71.4173.7000112.3L255 K257 K263L255-L259 WeakPolarHBondContact O-CB 3.25Å; L255-L259 VanDerWaalsContact O-CG 3.25Å; L255-L259 WeakPolarHBondContact O-CG 3.42Å; L255-L259 PolarHBondContact O-N 2.96Å; K257-L259 PolarHBondContact O-N 3.1Å; L259-K263 WeakPolarHBondContact O-CB 3.22Å; L259-K263 VanDerWaalsContact O-CG 3.26Å; L259-K263 WeakPolarHBondContact O-CG 3.29Å; L259-K263 PolarHBondContact O-N 3.38Å; L259-K263 VanDerWaalsContact O-N 3.11Å
260S90.2Very high83.7Confident64 Ų64103.3 Ų103.345%0.44852%0.515SS..Hα-helixtrans-69-44175.2-58.90000111.2E256 K257 F258 K263 L264E256-S260 WeakPolarHBondContact O-CB 3.41Å; E256-S260 PolarHBondContact O-N 3.36Å; E256-S260 PolarHBondContact O-OG 2.86Å; K257-S260 WeakPolarHBondContact O-CB 3.22Å; K257-S260 PolarHBondContact O-N 3.07Å; K257-S260 VanDerWaalsContact O-N 3.1Å; F258-S260 VanDerWaalsContact C-N 3.28Å; F258-S260 PolarHBondContact O-N 3.23Å; S260-K263 WeakPolarHBondContact O-CB 3.45Å; S260-K263 PolarHBondContact O-N 3.41Å; S260-L264 PolarHBondContact O-N 3.01Å
261D87.9Confident81.4Confident66 Ų66106.7 Ų106.735%0.35354%0.537SS..Hα-helixtrans-62.6-44.8176-67.8-19.8000110.9K257 F258 K263 L264 I265K257-D261 IonicContact NZ-OD2 2.71Å; K257-D261 PolarHBondContact NZ-OD2 3.16Å; K257-D261 PolarHBondContact O-N 3.31Å; F258-D261 PolarHBondContact O-N 2.92Å; D261-K263 VanDerWaalsContact C-N 3.33Å; D261-K263 PolarHBondContact O-N 3.43Å; D261-L264 WeakPolarHBondContact O-CB 3.39Å; D261-L264 PolarHBondContact O-N 3.48Å; D261-I265 PolarHBondContact O-N 2.89Å; D261-I265 VanDerWaalsContact O-N 3.17Å
262L86.6Confident79.3Confident70 Ų70107.5 Ų107.537%0.36654%0.538SS..Hα-helixtrans-60.6-39175-75.3-177.4000113.1F258 L264 I265 S266F258-L262 HydrophobicContact CD1-CD1 4.01Å; F258-L262 HydrophobicContact CD2-CG 4.45Å; F258-L262 HydrophobicContact CE1-CD1 3.43Å; F258-L262 VanDerWaalsContact CE1-CD1 3.43Å; F258-L262 HydrophobicContact CE1-CG 4.18Å; F258-L262 HydrophobicContact CE2-CD1 4.18Å; F258-L262 HydrophobicContact CE2-CD2 4.25Å; F258-L262 HydrophobicContact CE2-CG 4.07Å; F258-L262 HydrophobicContact CZ-CD1 3.54Å; F258-L262 HydrophobicContact CZ-CD2 4.18Å; F258-L262 HydrophobicContact CZ-CG 3.94Å; F258-L262 WeakPolarHBondContact O-CG 3.36Å; F258-L262 PolarHBondContact O-N 2.97Å; L262-L264 PolarHBondContact O-N 2.86Å; L262-I265 HydrophobicContact CD2-CD1 4.27Å; L262-I265 PolarHBondContact O-N 3.49Å; L262-S266 PolarHBondContact O-N 3.41Å; L262-S266 VanDerWaalsContact O-N 3.15Å
263K87Confident77.1Confident126 Ų126107.8 Ų107.855%0.54855%0.553SS.*Hα-helixtrans-65-28175.4-78.1171.4-176.8173.10112.5L259 S260 D261 S266 K267L259-K263 WeakPolarHBondContact O-CB 3.22Å; L259-K263 VanDerWaalsContact O-CG 3.26Å; L259-K263 WeakPolarHBondContact O-CG 3.29Å; L259-K263 PolarHBondContact O-N 3.38Å; L259-K263 VanDerWaalsContact O-N 3.11Å; S260-K263 WeakPolarHBondContact O-CB 3.45Å; S260-K263 PolarHBondContact O-N 3.41Å; D261-K263 VanDerWaalsContact C-N 3.33Å; D261-K263 PolarHBondContact O-N 3.43Å; K263-S266 PolarHBondContact O-OG 3.14Å; K263-K267 WeakPolarHBondContact O-CB 3.42Å; K263-K267 VanDerWaalsContact O-CG 3.28Å; K263-K267 WeakPolarHBondContact O-CG 3.39Å; K263-K267 PolarHBondContact O-N 3.26Å
264L86.7Confident74.2Confident95 Ų95110.3 Ų110.350%0.49757%0.565SS.*Hα-helixtrans-73.3-39.7174.1-68171.8000110.9S260 D261 L262 S266 K267 N268S260-L264 PolarHBondContact O-N 3.01Å; D261-L264 WeakPolarHBondContact O-CB 3.39Å; D261-L264 PolarHBondContact O-N 3.48Å; L262-L264 PolarHBondContact O-N 2.86Å; L264-S266 VanDerWaalsContact C-N 3.33Å; L264-S266 PolarHBondContact O-N 3.45Å; L264-K267 PolarHBondContact O-N 2.78Å; L264-N268 VanDerWaalsContact O-CB 3.26Å; L264-N268 WeakPolarHBondContact O-CB 3.49Å; L264-N268 PolarHBondContact O-N 2.98Å
265I82.2Confident71.8Confident104 Ų104108.1 Ų108.153%0.53357%0.568SS.*Hα-helixtrans-61.3-41.5176.9-60.3172.9000111.1D261 L262 K267D261-I265 PolarHBondContact O-N 2.89Å; D261-I265 VanDerWaalsContact O-N 3.17Å; L262-I265 HydrophobicContact CD2-CD1 4.27Å; L262-I265 PolarHBondContact O-N 3.49Å; I265-K267 VanDerWaalsContact C-N 3.3Å; I265-K267 PolarHBondContact O-N 2.68Å
266S71.3Confident69.1Low98 Ų98111.7 Ų111.769%0.68559%0.586SS**Hα-helixtrans-74.6-17.9-179.666.20000114.5L262 K263 L264L262-S266 PolarHBondContact O-N 3.41Å; L262-S266 VanDerWaalsContact O-N 3.15Å; K263-S266 PolarHBondContact O-OG 3.14Å; L264-S266 VanDerWaalsContact C-N 3.33Å; L264-S266 PolarHBondContact O-N 3.45Å
267K71.8Confident66.7Low164 Ų164112.8 Ų112.871%0.71360%0.596SS**Hα-helixtrans-100.6-26180-72.1-178.8-179.6-174.60113.6K263 L264 I265K263-K267 WeakPolarHBondContact O-CB 3.42Å; K263-K267 VanDerWaalsContact O-CG 3.28Å; K263-K267 WeakPolarHBondContact O-CG 3.39Å; K263-K267 PolarHBondContact O-N 3.26Å; L264-K267 PolarHBondContact O-N 2.78Å; I265-K267 VanDerWaalsContact C-N 3.3Å; I265-K267 PolarHBondContact O-N 2.68Å
268N61Low64.1Low89 Ų89118.8 Ų118.848%0.47663%0.626SS.*  trans-92.6125.3-179-71.4-17.4000109.8L264 I270L264-N268 VanDerWaalsContact O-CB 3.26Å; L264-N268 WeakPolarHBondContact O-CB 3.49Å; L264-N268 PolarHBondContact O-N 2.98Å; N268-I270 HydrophobicContact CB-CG1 3.83Å; N268-I270 PolarHBondContact O-N 2.7Å
269N53Low62.9Low165 Ų165120.6 Ų120.688%0.88264%0.639SS**  trans-64.980.3151.8-70.8-16.5000107L271N269-L271 VanDerWaalsContact C-N 3.33Å; N269-L271 PolarHBondContact O-N 2.62Å
270I56Low61.4Low113 Ų113121.9 Ų121.958%0.57965%0.647SS**  trans-67.4103.4167.8-59180000105.3N268 E272N268-I270 HydrophobicContact CB-CG1 3.83Å; N268-I270 PolarHBondContact O-N 2.7Å; I270-E272 PolarHBondContact O-N 3Å; I270-E272 VanDerWaalsContact O-N 3.08Å
271L45.7Very low59.8Low160 Ų160125.2 Ų125.284%0.83866%0.658SS**  trans-55.4109.2159.9-76.7152.5000105.7N269 G273N269-L271 VanDerWaalsContact C-N 3.33Å; N269-L271 PolarHBondContact O-N 2.62Å; L271-G273 PolarHBondContact O-N 3.09Å; L271-G273 VanDerWaalsContact O-N 3.11Å
272E48.5Very low58.2Low107 Ų107128.6 Ų128.650%0.568%0.676SS.*  trans-47.3122.9165.7-84.8175.9138.400107.4R204 I270 E274R204-E272 WeakPolarHBondContact CD-OE1 3.13Å; R204-E272 IonicContact CZ-OE1 3.61Å; R204-E272 IonicContact CZ-OE2 3.05Å; R204-E272 VanDerWaalsContact CZ-OE2 3.24Å; R204-E272 VanDerWaalsContact NE-CD 3.34Å; R204-E272 IonicContact NE-OE1 2.89Å; R204-E272 PolarHBondContact NE-OE1 3.15Å; R204-E272 IonicContact NE-OE2 3.07Å; R204-E272 PolarHBondContact NE-OE2 2.95Å; R204-E272 IonicContact NH2-OE1 3.04Å; R204-E272 IonicContact NH2-OE2 3.25Å; R204-E272 PolarHBondContact NH2-OE2 3.35Å; I270-E272 PolarHBondContact O-N 3Å; I270-E272 VanDerWaalsContact O-N 3.08Å; E272-E274 PolarHBondContact O-N 3.17Å
273G44.6Very low56.4Low66 Ų66132.3 Ų132.368%0.6870%0.695SS**  trans-53.4130.4179.700000110L271 V275L271-G273 PolarHBondContact O-N 3.09Å; L271-G273 VanDerWaalsContact O-N 3.11Å; G273-V275 PolarHBondContact O-N 3.41Å; G273-V275 VanDerWaalsContact O-N 3.1Å
274E34.7Very low54.4Low180 Ų180132.7 Ų132.784%0.84171%0.705SS**  trans-43.9115.8167.4-115.9172.3169.500109.2E272 I276E272-E274 PolarHBondContact O-N 3.17Å; E274-I276 VanDerWaalsContact C-N 3.34Å; E274-I276 PolarHBondContact O-N 3.04Å; E274-I276 VanDerWaalsContact O-N 3.1Å
275V41.7Very low52Low107 Ų107135.4 Ų135.465%0.64872%0.72SS**  trans-73.498.9161.5-178.90000105.4G273 N277G273-V275 PolarHBondContact O-N 3.41Å; G273-V275 VanDerWaalsContact O-N 3.1Å; V275-N277 WeakPolarHBondContact CG1-OD1 3.33Å; V275-N277 PolarHBondContact O-N 2.71Å; V275-N277 VanDerWaalsContact O-N 3.11Å
276I36.7Very low49.7Very low142 Ų142137.8 Ų137.873%0.72873%0.734SS**  trans-71.599.6165.1-55.6174.2000105.7E274E274-I276 VanDerWaalsContact C-N 3.34Å; E274-I276 PolarHBondContact O-N 3.04Å; E274-I276 VanDerWaalsContact O-N 3.1Å
277N42.6Very low47.9Very low143 Ų143141.2 Ų141.277%0.76574%0.738SS**  trans-79.3112.7162.9-76.7-23.5000107.3V275V275-N277 WeakPolarHBondContact CG1-OD1 3.33Å; V275-N277 PolarHBondContact O-N 2.71Å; V275-N277 VanDerWaalsContact O-N 3.11Å
278E39Very low45.8Very low258 Ų258139.1 Ų139.1100%1.20674%0.74SS**  trans-70.50158.2-77.5-174.8162.800111.1

Retrieved 278 of 278 residues in 74.4 ms (Link to these results)

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