G4LZ15_SCHMA Loading...

Mitochondrial carrier protein, putative

AlphaFold DB , UniProt , Accession G4LZ15, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 301 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
1M42.2Very low41.5Very low16 Ų1633.5 Ų33.58%0.07917%0.167CC..  0-750-152.6-171.6-121.800112.4Q3 E4 I5 Y33 R83 G87M1-Q3 VanDerWaalsContact C-N 3.34Å; M1-Q3 PolarHBondContact O-N 3.25Å; M1-E4 WeakPolarHBondContact CA-OE2 3.44Å; M1-E4 PolarHBondContact N-OE2 3.23Å; M1-E4 CarbonylContact O-C 3.46Å; M1-E4 PolarHBondContact O-N 3.03Å; M1-E4 VanDerWaalsContact O-N 3.11Å; M1-I5 HydrophobicContact CG-CD1 3.49Å; M1-I5 VanDerWaalsContact CG-CD1 3.49Å; M1-I5 HydrophobicContact CG-CG1 4.03Å; M1-I5 WeakPolarHBondContact O-CA 3.31Å; M1-I5 WeakPolarHBondContact O-CB 3.27Å; M1-I5 VanDerWaalsContact O-CG1 3.23Å; M1-I5 WeakPolarHBondContact O-CG1 3.42Å; M1-I5 PolarHBondContact O-N 2.9Å; M1-I5 HydrophobicContact SD-CD1 4Å; M1-Y33 HydrophobicContact CE-CD2 3.59Å; M1-Y33 HydrophobicContact CE-CE2 4.41Å; M1-Y33 HydrophobicContact CE-CG 3.8Å; M1-Y33 HydrophobicContact CG-CD2 3.88Å; M1-Y33 HydrophobicContact CG-CE1 4.29Å; M1-Y33 HydrophobicContact CG-CE2 3.79Å; M1-Y33 HydrophobicContact CG-CG 4.34Å; M1-Y33 PolarHBondContact O-OH 3.44Å; M1-Y33 HydrophobicContact SD-CD2 4.48Å; M1-R83 VanDerWaalsContact CE-C 3.5Å; M1-R83 HydrophobicContact CE-CB 4.07Å; M1-R83 WeakPolarHBondContact CE-O 3.49Å; M1-G87 WeakPolarHBondContact SD-CA 3Å; M1-G87 PolarHBondContact SD-N 2.72Å; M1-G87 VanDerWaalsContact SD-N 3.37Å
2R40.9Very low41.3Very low53 Ų5332.2 Ų32.220%0.216%0.163CC..Hα-helixtrans-57.9-41.6-178.3-155.8-161.8-174.9-134.7-5.1113.3E4 I5 E6 Q94R2-E4 PolarHBondContact O-N 3.03Å; R2-I5 CarbonylContact O-C 3.49Å; R2-I5 PolarHBondContact O-N 3.12Å; R2-E6 HydrophobicContact CG-CG 4.08Å; R2-E6 IonicContact CZ-OE1 2.82Å; R2-E6 IonicContact NE-OE1 3.04Å; R2-E6 PolarHBondContact NE-OE1 3.44Å; R2-E6 IonicContact NH1-OE1 3.63Å; R2-E6 PolarHBondContact NH1-OE1 3.09Å; R2-E6 IonicContact NH1-OE2 3.31Å; R2-E6 IonicContact NH2-OE1 3.08Å; R2-E6 PolarHBondContact NH2-OE1 2.98Å; R2-E6 VanDerWaalsContact NH2-OE1 3.08Å; R2-E6 WeakPolarHBondContact O-CA 3.5Å; R2-E6 WeakPolarHBondContact O-CB 3.27Å; R2-E6 WeakPolarHBondContact O-CG 3.2Å; R2-E6 PolarHBondContact O-N 3.24Å; R2-Q94 VanDerWaalsContact CD-OE1 3.31Å; R2-Q94 VanDerWaalsContact NH1-CD 3.31Å
3Q49.9Very low41.2Very low36 Ų3639.9 Ų39.917%0.16820%0.198CC..Hα-helixtrans-61.4-44.1175.1-77174.8-7.200113.1M1 I7 N183 Y186M1-Q3 VanDerWaalsContact C-N 3.34Å; M1-Q3 PolarHBondContact O-N 3.25Å; Q3-I7 WeakPolarHBondContact O-CG1 3.33Å; Q3-I7 PolarHBondContact O-N 3.06Å; Q3-I7 VanDerWaalsContact O-N 3.14Å; Q3-N183 PolarHBondContact NE2-OD1 3.38Å; Q3-Y186 HydrophobicContact CB-CD1 4.44Å; Q3-Y186 HydrophobicContact CB-CD2 3.58Å; Q3-Y186 HydrophobicContact CB-CE1 4.28Å; Q3-Y186 HydrophobicContact CB-CE2 3.34Å; Q3-Y186 HydrophobicContact CB-CG 4.11Å; Q3-Y186 HydrophobicContact CG-CD1 3.66Å; Q3-Y186 HydrophobicContact CG-CD2 3.64Å; Q3-Y186 HydrophobicContact CG-CE1 3.73Å; Q3-Y186 HydrophobicContact CG-CE2 3.67Å; Q3-Y186 HydrophobicContact CG-CG 3.61Å; Q3-Y186 WeakPolarHBondContact O-CE2 3.03Å; Q3-Y186 PolarHBondContact O-OH 2.78Å
4E43.5Very low40.9Very low54 Ų5446.1 Ų46.125%0.25223%0.226SC..Hα-helixtrans-71.5-35.4178.1-65.6160145.800110.7M1 R2 A8 Y33 R83 W283M1-E4 WeakPolarHBondContact CA-OE2 3.44Å; M1-E4 PolarHBondContact N-OE2 3.23Å; M1-E4 CarbonylContact O-C 3.46Å; M1-E4 PolarHBondContact O-N 3.03Å; M1-E4 VanDerWaalsContact O-N 3.11Å; R2-E4 PolarHBondContact O-N 3.03Å; E4-A8 WeakPolarHBondContact O-CB 3.45Å; E4-A8 PolarHBondContact O-N 2.98Å; E4-Y33 HydrophobicContact CB-CE1 4.04Å; E4-Y33 WeakPolarHBondContact CB-OH 3.48Å; E4-Y33 WeakPolarHBondContact OE2-CE1 3.39Å; E4-R83 IonicContact OE2-NH1 2.78Å; E4-W283 HydrophobicContact CB-CZ3 3.98Å; E4-W283 HydrophobicContact CG-CZ3 4.47Å; E4-W283 VanDerWaalsContact O-CH2 3.29Å; E4-W283 WeakPolarHBondContact O-CH2 3.4Å; E4-W283 WeakPolarHBondContact O-CZ3 3.37Å
5I41Very low41Very low20 Ų2053.7 Ų53.710%0.10327%0.268CS..Hα-helixtrans-71.1-46.2176.5-78.6-175.7000110.9M1 R2 I7 A8 F9 Y33M1-I5 HydrophobicContact CG-CD1 3.49Å; M1-I5 VanDerWaalsContact CG-CD1 3.49Å; M1-I5 HydrophobicContact CG-CG1 4.03Å; M1-I5 WeakPolarHBondContact O-CA 3.31Å; M1-I5 WeakPolarHBondContact O-CB 3.27Å; M1-I5 VanDerWaalsContact O-CG1 3.23Å; M1-I5 WeakPolarHBondContact O-CG1 3.42Å; M1-I5 PolarHBondContact O-N 2.9Å; M1-I5 HydrophobicContact SD-CD1 4Å; R2-I5 CarbonylContact O-C 3.49Å; R2-I5 PolarHBondContact O-N 3.12Å; I5-I7 VanDerWaalsContact C-N 3.31Å; I5-I7 PolarHBondContact O-N 3.36Å; I5-A8 CarbonylContact O-C 3.41Å; I5-A8 PolarHBondContact O-N 2.8Å; I5-A8 VanDerWaalsContact O-N 3.12Å; I5-F9 HydrophobicContact CB-CD2 4.42Å; I5-F9 HydrophobicContact CB-CE2 4.48Å; I5-F9 HydrophobicContact CG2-CD2 3.18Å; I5-F9 HydrophobicContact CG2-CE2 3.03Å; I5-F9 HydrophobicContact CG2-CG 4.41Å; I5-F9 HydrophobicContact CG2-CZ 4.19Å; I5-F9 VanDerWaalsContact O-CB 3.3Å; I5-F9 WeakPolarHBondContact O-CB 3.3Å; I5-F9 WeakPolarHBondContact O-CD2 3.18Å; I5-F9 WeakPolarHBondContact O-CG 3.27Å; I5-F9 PolarHBondContact O-N 2.82Å; I5-Y33 HydrophobicContact CD1-CD2 4.26Å; I5-Y33 HydrophobicContact CD1-CE2 3.63Å; I5-Y33 HydrophobicContact CG1-CD2 4.28Å; I5-Y33 HydrophobicContact CG1-CE2 3.21Å; I5-Y33 WeakPolarHBondContact CG1-OH 3.47Å; I5-Y33 PolarHBondContact N-OH 3.38Å
6E43.7Very low40.9Very low55 Ų5554.9 Ų54.926%0.25730%0.298SS..Hα-helixtrans-63.6-38.9178.5-86.6-177.7145.200110.4R2 F9 S10R2-E6 HydrophobicContact CG-CG 4.08Å; R2-E6 IonicContact CZ-OE1 2.82Å; R2-E6 IonicContact NE-OE1 3.04Å; R2-E6 PolarHBondContact NE-OE1 3.44Å; R2-E6 IonicContact NH1-OE1 3.63Å; R2-E6 PolarHBondContact NH1-OE1 3.09Å; R2-E6 IonicContact NH1-OE2 3.31Å; R2-E6 IonicContact NH2-OE1 3.08Å; R2-E6 PolarHBondContact NH2-OE1 2.98Å; R2-E6 VanDerWaalsContact NH2-OE1 3.08Å; R2-E6 WeakPolarHBondContact O-CA 3.5Å; R2-E6 WeakPolarHBondContact O-CB 3.27Å; R2-E6 WeakPolarHBondContact O-CG 3.2Å; R2-E6 PolarHBondContact O-N 3.24Å; E6-F9 CarbonylContact O-C 3.57Å; E6-F9 PolarHBondContact O-N 3.35Å; E6-S10 WeakPolarHBondContact O-CB 3.22Å; E6-S10 PolarHBondContact O-N 3.21Å; E6-S10 PolarHBondContact O-OG 2.77Å
7I42.6Very low41.3Very low7 Ų759.2 Ų59.24%0.03632%0.316CS..Hα-helixtrans-72.1-37.4172.3-61179.1000110.5Q3 I5 F9 S10 A11 Y186 L219 W283Q3-I7 WeakPolarHBondContact O-CG1 3.33Å; Q3-I7 PolarHBondContact O-N 3.06Å; Q3-I7 VanDerWaalsContact O-N 3.14Å; I5-I7 VanDerWaalsContact C-N 3.31Å; I5-I7 PolarHBondContact O-N 3.36Å; I7-F9 VanDerWaalsContact C-N 3.27Å; I7-F9 PolarHBondContact O-N 3.12Å; I7-S10 CarbonylContact O-C 3.54Å; I7-S10 WeakPolarHBondContact O-CA 3.48Å; I7-S10 WeakPolarHBondContact O-CB 3.4Å; I7-S10 PolarHBondContact O-N 3.26Å; I7-S10 VanDerWaalsContact O-N 3.09Å; I7-A11 PolarHBondContact O-N 3.43Å; I7-Y186 HydrophobicContact CD1-CD2 4.23Å; I7-Y186 HydrophobicContact CD1-CE2 3.3Å; I7-Y186 HydrophobicContact CG1-CE2 3.81Å; I7-Y186 VanDerWaalsContact CG1-OH 3.31Å; I7-Y186 WeakPolarHBondContact CG1-OH 3.32Å; I7-L219 HydrophobicContact CD1-CD2 3.96Å; I7-W283 HydrophobicContact CB-CH2 3.36Å; I7-W283 HydrophobicContact CB-CZ2 3.95Å; I7-W283 HydrophobicContact CB-CZ3 4.21Å; I7-W283 HydrophobicContact CG2-CH2 3.27Å; I7-W283 HydrophobicContact CG2-CZ2 3.28Å; I7-W283 HydrophobicContact CG2-CZ3 4.37Å
8A38.3Very low41.7Very low5 Ų566.2 Ų66.24%0.04134%0.343CS..Hα-helixtrans-66.1-31.517500000111.6E4 I5 A11 W283E4-A8 WeakPolarHBondContact O-CB 3.45Å; E4-A8 PolarHBondContact O-N 2.98Å; I5-A8 CarbonylContact O-C 3.41Å; I5-A8 PolarHBondContact O-N 2.8Å; I5-A8 VanDerWaalsContact O-N 3.12Å; A8-A11 WeakPolarHBondContact O-CB 3.48Å; A8-A11 PolarHBondContact O-N 3.1Å; A8-W283 HydrophobicContact CB-CH2 4.32Å
9F39.9Very low42.6Very low60 Ų6067.9 Ų67.926%0.26337%0.368SS..Hα-helixtrans-74.6-29.8169.5-82.1-58.4000112.7I5 E6 I7 A11 E25 F290I5-F9 HydrophobicContact CB-CD2 4.42Å; I5-F9 HydrophobicContact CB-CE2 4.48Å; I5-F9 HydrophobicContact CG2-CD2 3.18Å; I5-F9 HydrophobicContact CG2-CE2 3.03Å; I5-F9 HydrophobicContact CG2-CG 4.41Å; I5-F9 HydrophobicContact CG2-CZ 4.19Å; I5-F9 VanDerWaalsContact O-CB 3.3Å; I5-F9 WeakPolarHBondContact O-CB 3.3Å; I5-F9 WeakPolarHBondContact O-CD2 3.18Å; I5-F9 WeakPolarHBondContact O-CG 3.27Å; I5-F9 PolarHBondContact O-N 2.82Å; E6-F9 CarbonylContact O-C 3.57Å; E6-F9 PolarHBondContact O-N 3.35Å; I7-F9 VanDerWaalsContact C-N 3.27Å; I7-F9 PolarHBondContact O-N 3.12Å; F9-A11 PolarHBondContact O-N 3.11Å; F9-A11 VanDerWaalsContact O-O 3.07Å; F9-E25 HydrophobicContact CE1-CB 3.65Å; F9-E25 HydrophobicContact CE1-CG 4.11Å; F9-E25 WeakPolarHBondContact CE1-OE2 3.02Å; F9-E25 HydrophobicContact CZ-CB 3.65Å; F9-F290 HydrophobicContact CD1-CE1 4.39Å; F9-F290 AromaticContact CD1-CZ 3.92Å; F9-F290 HydrophobicContact CD1-CZ 3.92Å; F9-F290 HydrophobicContact CE1-CE1 4.47Å; F9-F290 HydrophobicContact CE1-CE2 4.24Å; F9-F290 AromaticContact CE1-CZ 3.59Å; F9-F290 HydrophobicContact CE1-CZ 3.59Å; F9-F290 HydrophobicContact CZ-CZ 4.28Å
10S37.8Very low43.7Very low55 Ų5566.6 Ų66.639%0.38536%0.36SS..SBendtrans-75.2-10170-52.20000111.6E6 I7E6-S10 WeakPolarHBondContact O-CB 3.22Å; E6-S10 PolarHBondContact O-N 3.21Å; E6-S10 PolarHBondContact O-OG 2.77Å; I7-S10 CarbonylContact O-C 3.54Å; I7-S10 WeakPolarHBondContact O-CA 3.48Å; I7-S10 WeakPolarHBondContact O-CB 3.4Å; I7-S10 PolarHBondContact O-N 3.26Å; I7-S10 VanDerWaalsContact O-N 3.09Å
11A36.4Very low45Very low7 Ų765.9 Ų65.96%0.05836%0.359CS..SBendtrans-67.7149.2164.200000108I7 A8 F9 Q13I7-A11 PolarHBondContact O-N 3.43Å; A8-A11 WeakPolarHBondContact O-CB 3.48Å; A8-A11 PolarHBondContact O-N 3.1Å; F9-A11 PolarHBondContact O-N 3.11Å; F9-A11 VanDerWaalsContact O-O 3.07Å; A11-Q13 PolarHBondContact O-N 3.33Å
12P39.3Very low46.3Very low18 Ų1870 Ų7012%0.11739%0.388CS..PPolyproline II helixtrans-55.8116.9-159.622.3-31.8000111.5H14P12-H14 PolarHBondContact O-N 3.07Å
13Q39.4Very low48.1Very low133 Ų13373.1 Ų73.162%0.62140%0.404SS*.PPolyproline II helixtrans-63.8119.9152.8-69.2-175-19.200105.3A11 D15A11-Q13 PolarHBondContact O-N 3.33Å; Q13-D15 PolarHBondContact O-N 3.19Å; Q13-D15 VanDerWaalsContact O-N 3.09Å
14H38Very low49.5Very low126 Ų12672.4 Ų72.458%0.58340%0.403SS*.  trans-60.3115.2168.3-109.6-88.7000107.2P12 G16P12-H14 PolarHBondContact O-N 3.07Å; H14-G16 PolarHBondContact O-N 3.19Å
15D41.7Very low51Low160 Ų16071.9 Ų71.986%0.85640%0.401SS*.THydrogen-bonded Turntrans-65.435.1-172.2-75.9-45.3000115.1Q13Q13-D15 PolarHBondContact O-N 3.19Å; Q13-D15 VanDerWaalsContact O-N 3.09Å
16G40.2Very low52.9Low73 Ų7375.3 Ų75.375%0.75342%0.415SS*.THydrogen-bonded Turntrans-154-1.9-17800000116.8H14H14-G16 PolarHBondContact O-N 3.19Å
17H47.5Very low54.8Low128 Ų12877.7 Ų77.759%0.59343%0.429SS*.SBendtrans-97.1142.3-178.1-76.3-74.1000112.1A19H17-A19 PolarHBondContact O-N 2.96Å
18K48.7Very low56.9Low185 Ų18578.9 Ų78.980%0.80443%0.434SS*.  trans-44.4125.4169.7-73.6175.9-178.7168.30108.5N20K18-N20 PolarHBondContact O-N 3.3Å
19A59Low59Low100 Ų10078.8 Ų78.883%0.82643%0.434SS*.PPolyproline II helixtrans-54.7118.6178.200000108.9H17H17-A19 PolarHBondContact O-N 2.96Å
20N64.5Low61.2Low40 Ų4077 Ų7721%0.21443%0.43CS..PPolyproline II helixtrans-61.9144.6175.2-77.3-39.1000108.5K18 E25 L294 N297K18-N20 PolarHBondContact O-N 3.3Å; N20-E25 HydrophobicContact CB-CG 4.09Å; N20-L294 WeakPolarHBondContact ND2-CD2 3.29Å; N20-N297 PolarHBondContact OD1-ND2 3.23Å
21P70.7Confident63.6Low52 Ų5276.1 Ų76.134%0.33843%0.426SS..PPolyproline II helixtrans-64.7144.7176.630.3-35.9000109.2H23 C24P21-H23 WeakPolarHBondContact CB-CE1 3.38Å; P21-H23 WeakPolarHBondContact CG-CE1 3.06Å; P21-H23 PolarHBondContact O-N 2.85Å; P21-C24 HydrophobicContact CG-CB 4.16Å; P21-C24 WeakPolarHBondContact O-CB 3.14Å; P21-C24 PolarHBondContact O-N 2.93Å
22P70.2Confident66.1Low104 Ų10475.8 Ų75.868%0.67542%0.423SS*.Hα-helixtrans-61.4-23.7-168.622.3-34.4000113.8F26P22-F26 PolarHBondContact O-N 3.45Å; P22-F26 VanDerWaalsContact O-N 3.15Å
23H77Confident68.4Low117 Ų11775.1 Ų75.154%0.54242%0.418SS..Hα-helixtrans-70.7-35.9175.662.7-95.3000112.5P21 E25 F26 L27P21-H23 WeakPolarHBondContact CB-CE1 3.38Å; P21-H23 WeakPolarHBondContact CG-CE1 3.06Å; P21-H23 PolarHBondContact O-N 2.85Å; H23-E25 VanDerWaalsContact C-N 3.34Å; H23-F26 PolarHBondContact O-N 3.4Å; H23-L27 VanDerWaalsContact O-CG 3.27Å; H23-L27 WeakPolarHBondContact O-CG 3.36Å; H23-L27 PolarHBondContact O-N 3.34Å
24C79.4Confident70.9Confident22 Ų2271.1 Ų71.115%0.14941%0.405CS..Hα-helixtrans-64.2-44.5176.2-72.80000110.3P21 F26 L27 F28P21-C24 HydrophobicContact CG-CB 4.16Å; P21-C24 WeakPolarHBondContact O-CB 3.14Å; P21-C24 PolarHBondContact O-N 2.93Å; C24-F26 VanDerWaalsContact C-N 3.34Å; C24-F26 PolarHBondContact O-N 2.74Å; C24-L27 PolarHBondContact O-N 3.06Å; C24-F28 HydrophobicContact CB-CE2 3.97Å; C24-F28 HydrophobicContact CB-CZ 4.04Å; C24-F28 WeakPolarHBondContact O-CD1 3.32Å; C24-F28 WeakPolarHBondContact O-CD2 3.42Å; C24-F28 WeakPolarHBondContact O-CG 3.41Å; C24-F28 PolarHBondContact O-N 2.97Å
25E76.4Confident73.5Confident43 Ų4368 Ų6820%0.20140%0.395CS..Hα-helixtrans-62.7-40.8178.2-60.8-171.8161.500112.6F9 N20 H23 F28 G29F9-E25 HydrophobicContact CE1-CB 3.65Å; F9-E25 HydrophobicContact CE1-CG 4.11Å; F9-E25 WeakPolarHBondContact CE1-OE2 3.02Å; F9-E25 HydrophobicContact CZ-CB 3.65Å; N20-E25 HydrophobicContact CB-CG 4.09Å; H23-E25 VanDerWaalsContact C-N 3.34Å; E25-F28 PolarHBondContact O-N 2.9Å; E25-G29 PolarHBondContact O-N 2.79Å
26F79.7Confident75.9Confident91 Ų9160.5 Ų60.540%0.39936%0.355SS..Hα-helixtrans-61.5-43.7173.6-178.9-95.3000111.9P22 H23 C24 G29 A30 A88P22-F26 PolarHBondContact O-N 3.45Å; P22-F26 VanDerWaalsContact O-N 3.15Å; H23-F26 PolarHBondContact O-N 3.4Å; C24-F26 VanDerWaalsContact C-N 3.34Å; C24-F26 PolarHBondContact O-N 2.74Å; F26-G29 PolarHBondContact O-N 2.84Å; F26-A30 WeakPolarHBondContact O-CB 3.07Å; F26-A30 PolarHBondContact O-N 2.78Å; F26-A88 HydrophobicContact CE2-CB 4.46Å; F26-A88 HydrophobicContact CZ-CB 4.11Å
27L84.1Confident78.3Confident105 Ų10558.3 Ų58.355%0.5533%0.327SS..Hα-helixtrans-64.2-43.6177-71.9172000111.9H23 C24 G29 A30 A31H23-L27 VanDerWaalsContact O-CG 3.27Å; H23-L27 WeakPolarHBondContact O-CG 3.36Å; H23-L27 PolarHBondContact O-N 3.34Å; C24-L27 PolarHBondContact O-N 3.06Å; L27-G29 VanDerWaalsContact C-N 3.34Å; L27-A30 PolarHBondContact O-N 3.19Å; L27-A31 WeakPolarHBondContact O-CB 3.24Å; L27-A31 PolarHBondContact O-N 3.3Å
28F86.4Confident80.6Confident32 Ų3255.1 Ų55.114%0.1432%0.316CS..Hα-helixtrans-65.2-40177.1-59.8-22.3000111.6C24 E25 A31 A32 F290 L293 L294 N297C24-F28 HydrophobicContact CB-CE2 3.97Å; C24-F28 HydrophobicContact CB-CZ 4.04Å; C24-F28 WeakPolarHBondContact O-CD1 3.32Å; C24-F28 WeakPolarHBondContact O-CD2 3.42Å; C24-F28 WeakPolarHBondContact O-CG 3.41Å; C24-F28 PolarHBondContact O-N 2.97Å; E25-F28 PolarHBondContact O-N 2.9Å; F28-A31 PolarHBondContact O-N 2.71Å; F28-A32 VanDerWaalsContact O-CB 3.31Å; F28-A32 WeakPolarHBondContact O-CB 3.47Å; F28-A32 PolarHBondContact O-N 2.63Å; F28-F290 HydrophobicContact CB-CD2 3.84Å; F28-F290 HydrophobicContact CB-CE2 3.88Å; F28-L293 HydrophobicContact CB-CB 4.08Å; F28-L293 HydrophobicContact CB-CD1 4.05Å; F28-L293 HydrophobicContact CD1-CB 3.94Å; F28-L293 HydrophobicContact CD1-CD1 4.23Å; F28-L293 HydrophobicContact CD2-CB 4.39Å; F28-L293 HydrophobicContact CG-CB 3.88Å; F28-L293 HydrophobicContact CG-CD1 4.42Å; F28-L294 HydrophobicContact CD2-CD2 3.78Å; F28-L294 HydrophobicContact CD2-CG 4.31Å; F28-L294 HydrophobicContact CE2-CD2 4.07Å; F28-N297 HydrophobicContact CE2-CB 3.83Å; F28-N297 HydrophobicContact CZ-CB 3.62Å
29G83Confident82.7Confident4 Ų450 Ų504%0.04130%0.3CS..Hα-helixtrans-55.6-56.817000000110.7E25 F26 L27 A31 A32 Y33E25-G29 PolarHBondContact O-N 2.79Å; F26-G29 PolarHBondContact O-N 2.84Å; L27-G29 VanDerWaalsContact C-N 3.34Å; G29-A31 VanDerWaalsContact C-N 3.31Å; G29-A31 PolarHBondContact O-N 3.35Å; G29-A32 WeakPolarHBondContact O-CB 3.29Å; G29-A32 PolarHBondContact O-N 3.3Å; G29-A32 VanDerWaalsContact O-N 3.12Å; G29-Y33 WeakPolarHBondContact O-CD2 3.41Å; G29-Y33 PolarHBondContact O-N 2.88Å
30A85.6Confident84.3Confident22 Ų2246.2 Ų46.218%0.18227%0.266CS..Hα-helixtrans-57.3-40.6-179.600000113.2F26 L27 S34F26-A30 WeakPolarHBondContact O-CB 3.07Å; F26-A30 PolarHBondContact O-N 2.78Å; L27-A30 PolarHBondContact O-N 3.19Å; A30-S34 WeakPolarHBondContact O-CB 3.47Å; A30-S34 PolarHBondContact O-N 3.3Å; A30-S34 PolarHBondContact O-OG 3.28Å
31A88.9Confident85.6Confident37 Ų3744.5 Ų44.531%0.30626%0.257SS..Hα-helixtrans-63.7-46.7174.900000111.7L27 F28 G29 Y33 S34 V35 L293L27-A31 WeakPolarHBondContact O-CB 3.24Å; L27-A31 PolarHBondContact O-N 3.3Å; F28-A31 PolarHBondContact O-N 2.71Å; G29-A31 VanDerWaalsContact C-N 3.31Å; G29-A31 PolarHBondContact O-N 3.35Å; A31-Y33 VanDerWaalsContact C-N 3.34Å; A31-Y33 PolarHBondContact O-N 3.22Å; A31-S34 WeakPolarHBondContact O-CB 3.31Å; A31-S34 PolarHBondContact O-N 2.95Å; A31-S34 VanDerWaalsContact O-N 3.07Å; A31-V35 WeakPolarHBondContact O-CG2 3.37Å; A31-V35 PolarHBondContact O-N 3.07Å; A31-L293 HydrophobicContact CB-CD1 3.7Å
32A88.6Confident86.6Confident0 Ų043.3 Ų43.30%025%0.249CC..Hα-helixtrans-60-40.4177.600000112.9F28 G29 S36 I286 T289 F290F28-A32 VanDerWaalsContact O-CB 3.31Å; F28-A32 WeakPolarHBondContact O-CB 3.47Å; F28-A32 PolarHBondContact O-N 2.63Å; G29-A32 WeakPolarHBondContact O-CB 3.29Å; G29-A32 PolarHBondContact O-N 3.3Å; G29-A32 VanDerWaalsContact O-N 3.12Å; A32-S36 WeakPolarHBondContact O-CB 3.35Å; A32-S36 PolarHBondContact O-N 3.08Å; A32-I286 HydrophobicContact CB-CG2 4.34Å; A32-T289 HydrophobicContact CB-CG2 3.93Å; A32-F290 HydrophobicContact CB-CB 4.17Å
33Y88.4Confident87.6Confident4 Ų440.1 Ų40.12%0.01623%0.226CC..Hα-helixtrans-64.6-43.2171.6-77.3-77.3000112.3M1 E4 I5 G29 A31 V35 S36 V37 I286M1-Y33 HydrophobicContact CE-CD2 3.59Å; M1-Y33 HydrophobicContact CE-CE2 4.41Å; M1-Y33 HydrophobicContact CE-CG 3.8Å; M1-Y33 HydrophobicContact CG-CD2 3.88Å; M1-Y33 HydrophobicContact CG-CE1 4.29Å; M1-Y33 HydrophobicContact CG-CE2 3.79Å; M1-Y33 HydrophobicContact CG-CG 4.34Å; M1-Y33 PolarHBondContact O-OH 3.44Å; M1-Y33 HydrophobicContact SD-CD2 4.48Å; E4-Y33 HydrophobicContact CB-CE1 4.04Å; E4-Y33 WeakPolarHBondContact CB-OH 3.48Å; E4-Y33 WeakPolarHBondContact OE2-CE1 3.39Å; I5-Y33 HydrophobicContact CD1-CD2 4.26Å; I5-Y33 HydrophobicContact CD1-CE2 3.63Å; I5-Y33 HydrophobicContact CG1-CD2 4.28Å; I5-Y33 HydrophobicContact CG1-CE2 3.21Å; I5-Y33 WeakPolarHBondContact CG1-OH 3.47Å; I5-Y33 PolarHBondContact N-OH 3.38Å; G29-Y33 WeakPolarHBondContact O-CD2 3.41Å; G29-Y33 PolarHBondContact O-N 2.88Å; A31-Y33 VanDerWaalsContact C-N 3.34Å; A31-Y33 PolarHBondContact O-N 3.22Å; Y33-V35 VanDerWaalsContact C-N 3.29Å; Y33-V35 PolarHBondContact O-N 3.47Å; Y33-S36 PolarHBondContact O-N 2.88Å; Y33-V37 WeakPolarHBondContact O-CB 3.36Å; Y33-V37 VanDerWaalsContact O-CG2 3.27Å; Y33-V37 WeakPolarHBondContact O-CG2 3.35Å; Y33-V37 PolarHBondContact O-N 3Å; Y33-I286 HydrophobicContact CD1-CD1 3.66Å; Y33-I286 HydrophobicContact CD1-CG1 4.07Å; Y33-I286 HydrophobicContact CE1-CD1 3.26Å; Y33-I286 HydrophobicContact CE1-CG1 3.98Å; Y33-I286 HydrophobicContact CE1-CG2 4.41Å; Y33-I286 HydrophobicContact CE2-CG2 4.13Å
34S91.1Very high88.2Confident48 Ų4837 Ų3734%0.33621%0.21SC..Hα-helixtrans-60.3-44-178.5-60.20000110.5A30 A31 V37 V38A30-S34 WeakPolarHBondContact O-CB 3.47Å; A30-S34 PolarHBondContact O-N 3.3Å; A30-S34 PolarHBondContact O-OG 3.28Å; A31-S34 WeakPolarHBondContact O-CB 3.31Å; A31-S34 PolarHBondContact O-N 2.95Å; A31-S34 VanDerWaalsContact O-N 3.07Å; S34-V37 PolarHBondContact O-N 2.89Å; S34-V38 VanDerWaalsContact O-CG2 3.3Å; S34-V38 WeakPolarHBondContact O-CG2 2.98Å; S34-V38 PolarHBondContact O-N 3.32Å
35V92.7Very high88.7Confident62 Ų6236 Ų3638%0.37620%0.203SC..Hα-helixtrans-60.5-50.8173.2174.40000111A31 Y33 V37 V38 V39 T289A31-V35 WeakPolarHBondContact O-CG2 3.37Å; A31-V35 PolarHBondContact O-N 3.07Å; Y33-V35 VanDerWaalsContact C-N 3.29Å; Y33-V35 PolarHBondContact O-N 3.47Å; V35-V37 VanDerWaalsContact C-N 3.33Å; V35-V37 PolarHBondContact O-N 3.17Å; V35-V38 PolarHBondContact O-N 3.35Å; V35-V39 HydrophobicContact CG1-CG2 4.2Å; V35-V39 WeakPolarHBondContact O-CB 3.38Å; V35-V39 VanDerWaalsContact O-CG2 3.3Å; V35-V39 WeakPolarHBondContact O-CG2 3.43Å; V35-V39 PolarHBondContact O-N 3.32Å; V35-T289 HydrophobicContact CB-CG2 4.27Å; V35-T289 HydrophobicContact CG2-CG2 4.14Å
36S91.3Very high89.3Confident2 Ų234 Ų341%0.01419%0.193CC..Hα-helixtrans-58.1-43.2179.2-170.90000112.6A32 Y33 L40 S282A32-S36 WeakPolarHBondContact O-CB 3.35Å; A32-S36 PolarHBondContact O-N 3.08Å; Y33-S36 PolarHBondContact O-N 2.88Å; S36-L40 VanDerWaalsContact O-CB 3.3Å; S36-L40 WeakPolarHBondContact O-CB 3.4Å; S36-L40 WeakPolarHBondContact O-CG 3.21Å; S36-L40 PolarHBondContact O-N 3.04Å; S36-S282 WeakPolarHBondContact OG-CA 3.25Å; S36-S282 PolarHBondContact OG-O 3.01Å; S36-S282 PolarHBondContact OG-OG 2.99Å
37V91.9Very high89.7Confident26 Ų2629.7 Ų29.716%0.15818%0.175CC..Hα-helixtrans-62.7-49.9177.1167.60000110.3Y33 S34 V35 F41 V76 P79 L80 R83Y33-V37 WeakPolarHBondContact O-CB 3.36Å; Y33-V37 VanDerWaalsContact O-CG2 3.27Å; Y33-V37 WeakPolarHBondContact O-CG2 3.35Å; Y33-V37 PolarHBondContact O-N 3Å; S34-V37 PolarHBondContact O-N 2.89Å; V35-V37 VanDerWaalsContact C-N 3.33Å; V35-V37 PolarHBondContact O-N 3.17Å; V37-F41 WeakPolarHBondContact O-CA 3.23Å; V37-F41 WeakPolarHBondContact O-CB 3.47Å; V37-F41 PolarHBondContact O-N 3.12Å; V37-V76 HydrophobicContact CG1-CG2 4.35Å; V37-P79 HydrophobicContact CG1-CB 3.96Å; V37-L80 HydrophobicContact CB-CD2 3.94Å; V37-L80 HydrophobicContact CG1-CD2 3.74Å; V37-L80 HydrophobicContact CG1-CG 4.08Å; V37-R83 HydrophobicContact CG2-CG 4.42Å
38V94.6Very high90Very high61 Ų6124.8 Ų24.837%0.3715%0.149SC..Hα-helixtrans-60.9-51.7-179.9171.10000110.3S34 V35 L40 F41 Y73 L80S34-V38 VanDerWaalsContact O-CG2 3.3Å; S34-V38 WeakPolarHBondContact O-CG2 2.98Å; S34-V38 PolarHBondContact O-N 3.32Å; V35-V38 PolarHBondContact O-N 3.35Å; V38-L40 VanDerWaalsContact C-N 3.33Å; V38-L40 PolarHBondContact O-N 2.98Å; V38-F41 PolarHBondContact O-N 3.39Å; V38-Y73 HydrophobicContact CG1-CE1 4.22Å; V38-Y73 WeakPolarHBondContact O-CE1 3.32Å; V38-L80 HydrophobicContact CG2-CD1 4.34Å; V38-L80 HydrophobicContact CG2-CD2 4.32Å
39V93.7Very high90.1Very high79 Ų7923.3 Ų23.348%0.47914%0.143SC..Hα-helixtrans-60.9-41.6-177.2172.80000111.9V35 L285V35-V39 HydrophobicContact CG1-CG2 4.2Å; V35-V39 WeakPolarHBondContact O-CB 3.38Å; V35-V39 VanDerWaalsContact O-CG2 3.3Å; V35-V39 WeakPolarHBondContact O-CG2 3.43Å; V35-V39 PolarHBondContact O-N 3.32Å; V39-L285 HydrophobicContact CB-CD1 3.97Å; V39-L285 HydrophobicContact CG1-CD1 3.64Å
40L92Very high90.2Very high20 Ų2024 Ų2411%0.10515%0.145CC..Hα-helixtrans-93.50.2-176.1-60.4178.1000114S36 V38 L43 Y44 R278 F281 S282 L285S36-L40 VanDerWaalsContact O-CB 3.3Å; S36-L40 WeakPolarHBondContact O-CB 3.4Å; S36-L40 WeakPolarHBondContact O-CG 3.21Å; S36-L40 PolarHBondContact O-N 3.04Å; V38-L40 VanDerWaalsContact C-N 3.33Å; V38-L40 PolarHBondContact O-N 2.98Å; L40-L43 HydrophobicContact CD2-CD2 4.34Å; L40-L43 WeakPolarHBondContact O-CB 3.01Å; L40-L43 PolarHBondContact O-N 2.7Å; L40-Y44 PolarHBondContact O-N 2.7Å; L40-R278 HydrophobicContact CD1-CG 4.46Å; L40-F281 HydrophobicContact CD1-CB 4.19Å; L40-F281 HydrophobicContact CD2-CB 4.02Å; L40-S282 VanDerWaalsContact CD1-CB 3.5Å; L40-L285 HydrophobicContact CD1-CD1 3.96Å; L40-L285 HydrophobicContact CD2-CD1 3.98Å; L40-L285 HydrophobicContact CG-CD1 3.74Å
41F93.1Very high90.2Very high4 Ų423.4 Ų23.42%0.01814%0.138CC..Hα-helixtrans-60-44.3-177.1-169.5-99.4000113V37 V38 L43 Y44 K45 A72 Y73 R74 G75 V76 P79 Q141V37-F41 WeakPolarHBondContact O-CA 3.23Å; V37-F41 WeakPolarHBondContact O-CB 3.47Å; V37-F41 PolarHBondContact O-N 3.12Å; V38-F41 PolarHBondContact O-N 3.39Å; F41-L43 VanDerWaalsContact C-N 3.32Å; F41-L43 PolarHBondContact O-N 3.1Å; F41-Y44 WeakPolarHBondContact O-CB 3.41Å; F41-Y44 PolarHBondContact O-N 2.8Å; F41-K45 PolarHBondContact O-N 2.98Å; F41-A72 WeakPolarHBondContact CD1-O 3.42Å; F41-A72 WeakPolarHBondContact CE1-O 3.49Å; F41-Y73 HydrophobicContact CB-CD1 4.33Å; F41-Y73 HydrophobicContact CB-CE1 4.38Å; F41-Y73 HydrophobicContact CD1-CD1 4.2Å; F41-R74 WeakPolarHBondContact CE1-O 3.49Å; F41-R74 WeakPolarHBondContact CZ-O 3.41Å; F41-G75 WeakPolarHBondContact CE2-O 3.45Å; F41-G75 WeakPolarHBondContact CZ-O 3.4Å; F41-V76 HydrophobicContact CB-CG2 4.04Å; F41-V76 HydrophobicContact CD1-CB 3.99Å; F41-V76 HydrophobicContact CD1-CG2 4.24Å; F41-V76 HydrophobicContact CD2-CB 4Å; F41-V76 HydrophobicContact CD2-CG2 3.81Å; F41-V76 HydrophobicContact CE1-CB 4.02Å; F41-V76 HydrophobicContact CE2-CB 4.06Å; F41-V76 HydrophobicContact CE2-CG2 4.33Å; F41-V76 HydrophobicContact CG-CB 3.96Å; F41-V76 HydrophobicContact CG-CG2 3.75Å; F41-V76 HydrophobicContact CZ-CB 4.05Å; F41-V76 VanDerWaalsContact CZ-N 3.33Å; F41-P79 HydrophobicContact CE2-CG 4.07Å; F41-Q141 HydrophobicContact CZ-CG 4.3Å
42P91.4Very high90Very high26 Ų2622.2 Ų22.217%0.16913%0.126CC..Hα-helixtrans-61-40.3175.7-24.135.9000112.4K45 T46 Y64 A72 Y73P42-K45 PolarHBondContact O-N 3.11Å; P42-T46 PolarHBondContact O-N 2.84Å; P42-T46 VanDerWaalsContact O-N 3.14Å; P42-Y64 HydrophobicContact CB-CE2 4.26Å; P42-Y64 WeakPolarHBondContact O-CE2 3.03Å; P42-Y64 PolarHBondContact O-OH 3.37Å; P42-A72 HydrophobicContact CB-CB 4.47Å; P42-Y73 HydrophobicContact CG-CE1 4.05Å; P42-Y73 HydrophobicContact CG-CE2 3.96Å
43L90.1Very high89.7Confident37 Ų3724.8 Ų24.819%0.19414%0.14CC..Hα-helixtrans-62.7-45.8174.9179.162.4000110.7L40 F41 K45 T46 I47 W57 R278L40-L43 HydrophobicContact CD2-CD2 4.34Å; L40-L43 WeakPolarHBondContact O-CB 3.01Å; L40-L43 PolarHBondContact O-N 2.7Å; F41-L43 VanDerWaalsContact C-N 3.32Å; F41-L43 PolarHBondContact O-N 3.1Å; L43-K45 VanDerWaalsContact C-N 3.33Å; L43-K45 PolarHBondContact O-N 3.27Å; L43-T46 PolarHBondContact O-N 3.28Å; L43-T46 VanDerWaalsContact O-N 3.15Å; L43-T46 PolarHBondContact O-OG1 3.31Å; L43-I47 PolarHBondContact O-N 3.04Å; L43-W57 HydrophobicContact CD1-CZ2 4.19Å; L43-R278 HydrophobicContact CD2-CB 3.84Å; L43-R278 HydrophobicContact CD2-CG 4.21Å; L43-R278 HydrophobicContact CG-CB 4.37Å
44Y89.3Confident89.3Confident52 Ų5224.9 Ų24.920%0.20414%0.143CC..Hα-helixtrans-58.2-43.8176.3179-89.2000112.4L40 F41 T46 I47 F48L40-Y44 PolarHBondContact O-N 2.7Å; F41-Y44 WeakPolarHBondContact O-CB 3.41Å; F41-Y44 PolarHBondContact O-N 2.8Å; Y44-T46 VanDerWaalsContact C-N 3.27Å; Y44-T46 PolarHBondContact O-N 2.87Å; Y44-I47 WeakPolarHBondContact O-CB 3.26Å; Y44-I47 PolarHBondContact O-N 3.21Å; Y44-I47 VanDerWaalsContact O-N 3.12Å; Y44-F48 PolarHBondContact O-N 3.3Å
45K90.3Very high88.9Confident0 Ų024.6 Ų24.60%014%0.137CC..Hα-helixtrans-67.5-25.9179.5178-178.3-166.5-148.40112.3F41 P42 L43 F48 F49 Y64 E67 M71 A72F41-K45 PolarHBondContact O-N 2.98Å; P42-K45 PolarHBondContact O-N 3.11Å; L43-K45 VanDerWaalsContact C-N 3.33Å; L43-K45 PolarHBondContact O-N 3.27Å; K45-F48 WeakPolarHBondContact O-CB 3.47Å; K45-F48 PolarHBondContact O-N 3.21Å; K45-F49 HydrophobicContact CD-CZ 4.11Å; K45-F49 VanDerWaalsContact CE-CZ 3.45Å; K45-F49 HydrophobicContact CG-CE1 4.3Å; K45-F49 HydrophobicContact CG-CE2 4.05Å; K45-F49 HydrophobicContact CG-CZ 3.84Å; K45-F49 VanDerWaalsContact O-CD2 3.3Å; K45-F49 WeakPolarHBondContact O-CD2 3.19Å; K45-F49 WeakPolarHBondContact O-CG 2.91Å; K45-F49 PolarHBondContact O-N 2.95Å; K45-F49 VanDerWaalsContact O-N 3.17Å; K45-Y64 WeakPolarHBondContact CB-OH 3.26Å; K45-Y64 HydrophobicContact CD-CE1 4.05Å; K45-Y64 HydrophobicContact CG-CE1 4.37Å; K45-Y64 WeakPolarHBondContact CG-OH 3.44Å; K45-E67 IonicContact NZ-OE2 2.63Å; K45-E67 PolarHBondContact NZ-OE2 2.71Å; K45-M71 PolarHBondContact NZ-O 3.45Å; K45-A72 WeakPolarHBondContact CD-O 3.45Å
46T89.1Confident88.5Confident1 Ų125 Ų251%0.00614%0.14CC..Hα-helixtrans-65.8-44.9168.165.90000112.3P42 L43 Y44 F48 F49 Q50 W57 A60 L61 Y64P42-T46 PolarHBondContact O-N 2.84Å; P42-T46 VanDerWaalsContact O-N 3.14Å; L43-T46 PolarHBondContact O-N 3.28Å; L43-T46 VanDerWaalsContact O-N 3.15Å; L43-T46 PolarHBondContact O-OG1 3.31Å; Y44-T46 VanDerWaalsContact C-N 3.27Å; Y44-T46 PolarHBondContact O-N 2.87Å; T46-F48 PolarHBondContact O-N 3.19Å; T46-F49 WeakPolarHBondContact O-CB 3.4Å; T46-F49 PolarHBondContact O-N 3.48Å; T46-F49 VanDerWaalsContact O-N 3.11Å; T46-Q50 WeakPolarHBondContact O-CG 3.39Å; T46-Q50 PolarHBondContact O-N 2.98Å; T46-Q50 VanDerWaalsContact O-N 3.17Å; T46-W57 PolarHBondContact OG1-NE1 3.09Å; T46-W57 VanDerWaalsContact OG1-NE1 3.08Å; T46-A60 HydrophobicContact CG2-CB 4.12Å; T46-L61 HydrophobicContact CG2-CD2 4.19Å; T46-Y64 HydrophobicContact CG2-CD2 4.23Å; T46-Y64 HydrophobicContact CG2-CE2 3.37Å; T46-Y64 PolarHBondContact N-OH 3.5Å
47I89Confident88Confident1 Ų130.4 Ų30.41%0.00516%0.161CC..Hα-helixtrans-59.4-41.1176.7-62.8160.8000110L43 Y44 F49 Q50 Q51 F228 A274 N275 R278L43-I47 PolarHBondContact O-N 3.04Å; Y44-I47 WeakPolarHBondContact O-CB 3.26Å; Y44-I47 PolarHBondContact O-N 3.21Å; Y44-I47 VanDerWaalsContact O-N 3.12Å; I47-F49 VanDerWaalsContact C-N 3.33Å; I47-F49 PolarHBondContact O-N 3.36Å; I47-Q50 WeakPolarHBondContact O-CB 3.26Å; I47-Q50 PolarHBondContact O-N 2.91Å; I47-Q50 VanDerWaalsContact O-N 3.09Å; I47-Q51 HydrophobicContact CG2-CG 4.3Å; I47-Q51 WeakPolarHBondContact O-CG 3.19Å; I47-Q51 PolarHBondContact O-N 3.05Å; I47-F228 HydrophobicContact CG2-CE2 3.79Å; I47-F228 HydrophobicContact CG2-CZ 4.14Å; I47-A274 HydrophobicContact CD1-CB 4.13Å; I47-A274 HydrophobicContact CG1-CB 3.64Å; I47-N275 HydrophobicContact CD1-CB 4.23Å; I47-N275 HydrophobicContact CG2-CB 4.48Å; I47-R278 HydrophobicContact CD1-CB 3.97Å; I47-R278 HydrophobicContact CD1-CG 4.39Å
48F90Very high87.8Confident2 Ų234.6 Ų34.61%0.00918%0.181CC..Hα-helixtrans-57.1-43.5175.8176.3-91.6000112.5Y44 K45 T46 Q50 Q51 L52 T138 Q141 N142 T235Y44-F48 PolarHBondContact O-N 3.3Å; K45-F48 WeakPolarHBondContact O-CB 3.47Å; K45-F48 PolarHBondContact O-N 3.21Å; T46-F48 PolarHBondContact O-N 3.19Å; F48-Q50 VanDerWaalsContact C-N 3.3Å; F48-Q50 PolarHBondContact O-N 3.42Å; F48-Q51 PolarHBondContact O-N 2.96Å; F48-L52 HydrophobicContact CD1-CD1 4.31Å; F48-L52 HydrophobicContact CE1-CD1 3.42Å; F48-L52 VanDerWaalsContact CE1-CD1 3.42Å; F48-L52 HydrophobicContact CE1-CG 4.24Å; F48-L52 HydrophobicContact CE2-CD1 3.83Å; F48-L52 HydrophobicContact CE2-CG 4.28Å; F48-L52 HydrophobicContact CZ-CD1 3.13Å; F48-L52 HydrophobicContact CZ-CG 4.01Å; F48-L52 PolarHBondContact O-N 2.85Å; F48-T138 HydrophobicContact CE2-CG2 3.82Å; F48-T138 HydrophobicContact CZ-CG2 4.05Å; F48-T138 VanDerWaalsContact CZ-O 3.3Å; F48-T138 WeakPolarHBondContact CZ-O 3.46Å; F48-Q141 HydrophobicContact CD1-CB 3.78Å; F48-Q141 HydrophobicContact CD2-CB 4.42Å; F48-Q141 HydrophobicContact CE1-CB 3.41Å; F48-Q141 VanDerWaalsContact CE1-CB 3.41Å; F48-Q141 WeakPolarHBondContact CE1-O 3.36Å; F48-Q141 HydrophobicContact CE2-CB 4.09Å; F48-Q141 HydrophobicContact CG-CB 4.26Å; F48-Q141 HydrophobicContact CZ-CB 3.57Å; F48-N142 HydrophobicContact CZ-CB 4.37Å; F48-T235 HydrophobicContact CD2-CG2 3.68Å; F48-T235 HydrophobicContact CE2-CG2 3.38Å; F48-T235 HydrophobicContact CZ-CG2 4.27Å
49F87.8Confident87.4Confident2 Ų235.9 Ų35.91%0.00918%0.183CC..Hα-helixtrans-63.5-36.6174.9-59.5-41.6000112.4K45 T46 I47 Q51 D53 G54 I55 A60 Y64K45-F49 HydrophobicContact CD-CZ 4.11Å; K45-F49 VanDerWaalsContact CE-CZ 3.45Å; K45-F49 HydrophobicContact CG-CE1 4.3Å; K45-F49 HydrophobicContact CG-CE2 4.05Å; K45-F49 HydrophobicContact CG-CZ 3.84Å; K45-F49 VanDerWaalsContact O-CD2 3.3Å; K45-F49 WeakPolarHBondContact O-CD2 3.19Å; K45-F49 WeakPolarHBondContact O-CG 2.91Å; K45-F49 PolarHBondContact O-N 2.95Å; K45-F49 VanDerWaalsContact O-N 3.17Å; T46-F49 WeakPolarHBondContact O-CB 3.4Å; T46-F49 PolarHBondContact O-N 3.48Å; T46-F49 VanDerWaalsContact O-N 3.11Å; I47-F49 VanDerWaalsContact C-N 3.33Å; I47-F49 PolarHBondContact O-N 3.36Å; F49-Q51 VanDerWaalsContact C-N 3.34Å; F49-D53 WeakPolarHBondContact O-CA 3.42Å; F49-D53 WeakPolarHBondContact O-CB 3.33Å; F49-D53 PolarHBondContact O-N 3.34Å; F49-G54 PolarHBondContact O-N 3.36Å; F49-I55 HydrophobicContact CB-CD1 3.63Å; F49-I55 HydrophobicContact CB-CG1 3.91Å; F49-I55 HydrophobicContact CG-CD1 4.37Å; F49-A60 HydrophobicContact CB-CB 4.46Å; F49-A60 HydrophobicContact CD2-CB 4.08Å; F49-Y64 HydrophobicContact CE2-CE1 4.06Å
50Q85.4Confident87Confident19 Ų1932.1 Ų32.19%0.08916%0.16CC..Hα-helixtrans-67.2-36.7174.6-51-168.2-82.200111.9T46 I47 F48 G54 I55 G271T46-Q50 WeakPolarHBondContact O-CG 3.39Å; T46-Q50 PolarHBondContact O-N 2.98Å; T46-Q50 VanDerWaalsContact O-N 3.17Å; I47-Q50 WeakPolarHBondContact O-CB 3.26Å; I47-Q50 PolarHBondContact O-N 2.91Å; I47-Q50 VanDerWaalsContact O-N 3.09Å; F48-Q50 VanDerWaalsContact C-N 3.3Å; F48-Q50 PolarHBondContact O-N 3.42Å; Q50-G54 WeakPolarHBondContact O-CA 3.48Å; Q50-G54 PolarHBondContact O-N 3.04Å; Q50-I55 WeakPolarHBondContact CG-O 3.35Å; Q50-G271 VanDerWaalsContact OE1-CA 3.25Å
51Q86.6Confident86.7Confident9 Ų934.7 Ų34.74%0.04217%0.174CC..Hα-helixtrans-69.5-41.1178.6-70.3179.2-900112.8I47 F48 F49 F228 V232 T235I47-Q51 HydrophobicContact CG2-CG 4.3Å; I47-Q51 WeakPolarHBondContact O-CG 3.19Å; I47-Q51 PolarHBondContact O-N 3.05Å; F48-Q51 PolarHBondContact O-N 2.96Å; F49-Q51 VanDerWaalsContact C-N 3.34Å; Q51-F228 HydrophobicContact CG-CE1 4.4Å; Q51-F228 HydrophobicContact CG-CE2 4.36Å; Q51-F228 HydrophobicContact CG-CZ 3.8Å; Q51-F228 VanDerWaalsContact NE2-CE2 3.28Å; Q51-V232 HydrophobicContact CB-CG2 4.38Å; Q51-V232 HydrophobicContact CG-CG2 3.99Å; Q51-T235 PolarHBondContact OE1-OG1 3.02Å
52L84.6Confident86.5Confident11 Ų1138.6 Ų38.66%0.05819%0.194CC..Hα-helixtrans-85.6-62.3179.9-77.5-170.2000112.8F48 N142 T235F48-L52 HydrophobicContact CD1-CD1 4.31Å; F48-L52 HydrophobicContact CE1-CD1 3.42Å; F48-L52 VanDerWaalsContact CE1-CD1 3.42Å; F48-L52 HydrophobicContact CE1-CG 4.24Å; F48-L52 HydrophobicContact CE2-CD1 3.83Å; F48-L52 HydrophobicContact CE2-CG 4.28Å; F48-L52 HydrophobicContact CZ-CD1 3.13Å; F48-L52 HydrophobicContact CZ-CG 4.01Å; F48-L52 PolarHBondContact O-N 2.85Å; L52-N142 HydrophobicContact CD1-CB 4.3Å; L52-T235 HydrophobicContact CD1-CG2 4.19Å; L52-T235 HydrophobicContact CD2-CG2 3.61Å; L52-T235 HydrophobicContact CG-CG2 3.64Å
53D82.1Confident86.1Confident55 Ų5539.3 Ų39.329%0.29419%0.193SC..Hα-helixtrans-85-11.4-170.6-63.5-32000111.9F49 I55 R63F49-D53 WeakPolarHBondContact O-CA 3.42Å; F49-D53 WeakPolarHBondContact O-CB 3.33Å; F49-D53 PolarHBondContact O-N 3.34Å; D53-I55 HydrophobicContact CB-CG1 4.43Å; D53-I55 HydrophobicContact CB-CG2 3.82Å; D53-I55 PolarHBondContact O-N 2.98Å; D53-R63 IonicContact OD2-NH1 2.71Å; D53-R63 PolarHBondContact OD2-NH1 3.28Å
54G78.6Confident85.9Confident6 Ų639.3 Ų39.36%0.06219%0.191CC..  trans69.59.5-178.600000114.5F49 Q50 R270F49-G54 PolarHBondContact O-N 3.36Å; Q50-G54 WeakPolarHBondContact O-CA 3.48Å; Q50-G54 PolarHBondContact O-N 3.04Å; G54-R270 PolarHBondContact O-NH1 3.39Å
55I83.9Confident85.7Confident41 Ų4147.6 Ų47.621%0.2122%0.222CC..  trans-70152-174.562.7171.3000112.2F49 Q50 D53 E59 A60F49-I55 HydrophobicContact CB-CD1 3.63Å; F49-I55 HydrophobicContact CB-CG1 3.91Å; F49-I55 HydrophobicContact CG-CD1 4.37Å; Q50-I55 WeakPolarHBondContact CG-O 3.35Å; D53-I55 HydrophobicContact CB-CG1 4.43Å; D53-I55 HydrophobicContact CB-CG2 3.82Å; D53-I55 PolarHBondContact O-N 2.98Å; I55-E59 HydrophobicContact CB-CB 4.48Å; I55-E59 HydrophobicContact CD1-CB 4.5Å; I55-A60 HydrophobicContact CD1-CB 3.95Å; I55-A60 HydrophobicContact CG1-CB 4.49Å
56P83.8Confident85.5Confident70 Ų7054.2 Ų54.246%0.45526%0.256SS..  trans-71161.9172.70.515.7000110.8I58 E59 A60P56-I58 VanDerWaalsContact C-N 3.27Å; P56-I58 PolarHBondContact O-N 3Å; P56-E59 WeakPolarHBondContact CB-OE2 3.33Å; P56-E59 VanDerWaalsContact CD-OE2 3.23Å; P56-E59 WeakPolarHBondContact CD-OE2 3.18Å; P56-E59 VanDerWaalsContact CG-CD 3.47Å; P56-E59 HydrophobicContact CG-CG 4.42Å; P56-E59 WeakPolarHBondContact CG-OE2 3.13Å; P56-E59 PolarHBondContact O-N 3.12Å; P56-A60 PolarHBondContact O-N 3.06Å
57W80.5Confident85.3Confident117 Ų11756.4 Ų56.444%0.44327%0.266SS..Hα-helixtrans-67.9-29.1-172.8-171.650000112.5L43 T46 A60 L61L43-W57 HydrophobicContact CD1-CZ2 4.19Å; T46-W57 PolarHBondContact OG1-NE1 3.09Å; T46-W57 VanDerWaalsContact OG1-NE1 3.08Å; W57-A60 WeakPolarHBondContact O-CB 3.46Å; W57-A60 PolarHBondContact O-N 3.17Å; W57-L61 HydrophobicContact CD2-CD1 4.37Å; W57-L61 HydrophobicContact CZ2-CD1 4.38Å; W57-L61 WeakPolarHBondContact O-CG 3.4Å; W57-L61 PolarHBondContact O-N 3.16Å; W57-L61 VanDerWaalsContact O-N 3.1Å
58I87.2Confident85.1Confident113 Ų11357.8 Ų57.858%0.57928%0.28SS*.Hα-helixtrans-64.9-45.2178.4-61.7175.4000110.2P56 A60 L61 I62P56-I58 VanDerWaalsContact C-N 3.27Å; P56-I58 PolarHBondContact O-N 3Å; I58-A60 VanDerWaalsContact C-N 3.31Å; I58-A60 PolarHBondContact O-N 2.9Å; I58-L61 WeakPolarHBondContact O-CB 3.43Å; I58-L61 PolarHBondContact O-N 2.95Å; I58-L61 VanDerWaalsContact O-N 3.09Å; I58-I62 HydrophobicContact CG2-CD1 4.08Å; I58-I62 WeakPolarHBondContact O-CG1 3.34Å; I58-I62 PolarHBondContact O-N 3.44Å
59E86.8Confident84.8Confident88 Ų8864 Ų6441%0.41131%0.312SS..Hα-helixtrans-65.4-36.7177.7-70.374.1-17500110.9I55 P56 L61 I62 R63I55-E59 HydrophobicContact CB-CB 4.48Å; I55-E59 HydrophobicContact CD1-CB 4.5Å; P56-E59 WeakPolarHBondContact CB-OE2 3.33Å; P56-E59 VanDerWaalsContact CD-OE2 3.23Å; P56-E59 WeakPolarHBondContact CD-OE2 3.18Å; P56-E59 VanDerWaalsContact CG-CD 3.47Å; P56-E59 HydrophobicContact CG-CG 4.42Å; P56-E59 WeakPolarHBondContact CG-OE2 3.13Å; P56-E59 PolarHBondContact O-N 3.12Å; E59-L61 VanDerWaalsContact C-N 3.29Å; E59-L61 PolarHBondContact O-N 3.02Å; E59-I62 PolarHBondContact O-N 3.48Å; E59-R63 WeakPolarHBondContact O-CB 3.46Å; E59-R63 PolarHBondContact O-N 3.46Å
60A85.3Confident84.7Confident0 Ų074.2 Ų74.20%035%0.351CS..Hα-helixtrans-61.2-36.4172.200000112.4T46 F49 I55 P56 W57 I58 R63T46-A60 HydrophobicContact CG2-CB 4.12Å; F49-A60 HydrophobicContact CB-CB 4.46Å; F49-A60 HydrophobicContact CD2-CB 4.08Å; I55-A60 HydrophobicContact CD1-CB 3.95Å; I55-A60 HydrophobicContact CG1-CB 4.49Å; P56-A60 PolarHBondContact O-N 3.06Å; W57-A60 WeakPolarHBondContact O-CB 3.46Å; W57-A60 PolarHBondContact O-N 3.17Å; I58-A60 VanDerWaalsContact C-N 3.31Å; I58-A60 PolarHBondContact O-N 2.9Å; A60-R63 WeakPolarHBondContact O-CB 3.21Å
61L86.3Confident84.7Confident75 Ų7576 Ų7639%0.39336%0.36SS..Hα-helixtrans-74-40.3175.2-66.6173.5000112.3T46 W57 I58 E59 R63 Y64T46-L61 HydrophobicContact CG2-CD2 4.19Å; W57-L61 HydrophobicContact CD2-CD1 4.37Å; W57-L61 HydrophobicContact CZ2-CD1 4.38Å; W57-L61 WeakPolarHBondContact O-CG 3.4Å; W57-L61 PolarHBondContact O-N 3.16Å; W57-L61 VanDerWaalsContact O-N 3.1Å; I58-L61 WeakPolarHBondContact O-CB 3.43Å; I58-L61 PolarHBondContact O-N 2.95Å; I58-L61 VanDerWaalsContact O-N 3.09Å; E59-L61 VanDerWaalsContact C-N 3.29Å; E59-L61 PolarHBondContact O-N 3.02Å; L61-R63 PolarHBondContact O-N 2.9Å; L61-Y64 PolarHBondContact O-N 3.44Å; L61-Y64 VanDerWaalsContact O-N 3.15Å
62I87.8Confident84.8Confident86 Ų8675.7 Ų75.744%0.44136%0.358SS..Hα-helixtrans-58.1-40.5174-68.7167.5000109.9I58 E59 Y64 R65 I66I58-I62 HydrophobicContact CG2-CD1 4.08Å; I58-I62 WeakPolarHBondContact O-CG1 3.34Å; I58-I62 PolarHBondContact O-N 3.44Å; E59-I62 PolarHBondContact O-N 3.48Å; I62-Y64 VanDerWaalsContact C-N 3.27Å; I62-Y64 PolarHBondContact O-N 3.37Å; I62-R65 WeakPolarHBondContact O-CA 3.38Å; I62-R65 VanDerWaalsContact O-CB 3.32Å; I62-R65 WeakPolarHBondContact O-CB 3.3Å; I62-R65 PolarHBondContact O-N 2.96Å; I62-I66 HydrophobicContact CG2-CD1 4.07Å; I62-I66 PolarHBondContact O-N 3.42Å
63R84.2Confident85.1Confident41 Ų4179.3 Ų79.316%0.15537%0.372CS..Hα-helixtrans-58.8-35.2177.5-169.8170-178.5168.63.6113.6D53 E59 A60 L61 R65 I66 E67 K143D53-R63 IonicContact OD2-NH1 2.71Å; D53-R63 PolarHBondContact OD2-NH1 3.28Å; E59-R63 WeakPolarHBondContact O-CB 3.46Å; E59-R63 PolarHBondContact O-N 3.46Å; A60-R63 WeakPolarHBondContact O-CB 3.21Å; L61-R63 PolarHBondContact O-N 2.9Å; R63-R65 VanDerWaalsContact C-N 3.3Å; R63-R65 PolarHBondContact O-N 3.29Å; R63-I66 PolarHBondContact O-N 3.1Å; R63-E67 HydrophobicContact CG-CG 4.08Å; R63-E67 IonicContact CZ-OE1 3.49Å; R63-E67 IonicContact NE-OE1 3.87Å; R63-E67 PolarHBondContact NE-OE1 3.27Å; R63-E67 IonicContact NH2-OE1 2.74Å; R63-E67 PolarHBondContact NH2-OE1 2.92Å; R63-E67 WeakPolarHBondContact O-CB 3.36Å; R63-E67 PolarHBondContact O-N 2.99Å; R63-K143 VanDerWaalsContact NH2-CD 3.3Å
64Y85.2Confident85.4Confident36 Ų3678.9 Ų78.914%0.14137%0.366CS..Hα-helixtrans-66.4-31.1173.1-73.1-34.1000113.9P42 K45 T46 F49 L61 I62 I66 G68 A72P42-Y64 HydrophobicContact CB-CE2 4.26Å; P42-Y64 WeakPolarHBondContact O-CE2 3.03Å; P42-Y64 PolarHBondContact O-OH 3.37Å; K45-Y64 WeakPolarHBondContact CB-OH 3.26Å; K45-Y64 HydrophobicContact CD-CE1 4.05Å; K45-Y64 HydrophobicContact CG-CE1 4.37Å; K45-Y64 WeakPolarHBondContact CG-OH 3.44Å; T46-Y64 HydrophobicContact CG2-CD2 4.23Å; T46-Y64 HydrophobicContact CG2-CE2 3.37Å; T46-Y64 PolarHBondContact N-OH 3.5Å; F49-Y64 HydrophobicContact CE2-CE1 4.06Å; L61-Y64 PolarHBondContact O-N 3.44Å; L61-Y64 VanDerWaalsContact O-N 3.15Å; I62-Y64 VanDerWaalsContact C-N 3.27Å; I62-Y64 PolarHBondContact O-N 3.37Å; Y64-I66 VanDerWaalsContact C-N 3.26Å; Y64-I66 PolarHBondContact O-N 3.15Å; Y64-G68 WeakPolarHBondContact O-CA 3.46Å; Y64-G68 PolarHBondContact O-N 3.41Å; Y64-A72 HydrophobicContact CD1-CB 3.87Å; Y64-A72 HydrophobicContact CE1-CB 3.77Å; Y64-A72 HydrophobicContact CG-CB 4.49Å
65R84.4Confident86Confident226 Ų22679 Ų7985%0.85337%0.367SS*.Hα-helixtrans-66.8-33.1174-60.5-173.3176-172.3-1.1111.4I62 R63I62-R65 WeakPolarHBondContact O-CA 3.38Å; I62-R65 VanDerWaalsContact O-CB 3.32Å; I62-R65 WeakPolarHBondContact O-CB 3.3Å; I62-R65 PolarHBondContact O-N 2.96Å; R63-R65 VanDerWaalsContact C-N 3.3Å; R63-R65 PolarHBondContact O-N 3.29Å
66I86.7Confident86.5Confident139 Ų13978.4 Ų78.471%0.71337%0.365SS*.Hα-helixtrans-82.4-47.5-179.5-57.7170000111.6I62 R63 Y64I62-I66 HydrophobicContact CG2-CD1 4.07Å; I62-I66 PolarHBondContact O-N 3.42Å; R63-I66 PolarHBondContact O-N 3.1Å; Y64-I66 VanDerWaalsContact C-N 3.26Å; Y64-I66 PolarHBondContact O-N 3.15Å
67E84.2Confident87Confident48 Ų4878.5 Ų78.522%0.22436%0.361CS..Hα-helixtrans-77.9-21.3-177.2-66.1-175175.800113.5K45 R63 M71K45-E67 IonicContact NZ-OE2 2.63Å; K45-E67 PolarHBondContact NZ-OE2 2.71Å; R63-E67 HydrophobicContact CG-CG 4.08Å; R63-E67 IonicContact CZ-OE1 3.49Å; R63-E67 IonicContact NE-OE1 3.87Å; R63-E67 PolarHBondContact NE-OE1 3.27Å; R63-E67 IonicContact NH2-OE1 2.74Å; R63-E67 PolarHBondContact NH2-OE1 2.92Å; R63-E67 WeakPolarHBondContact O-CB 3.36Å; R63-E67 PolarHBondContact O-N 2.99Å; E67-M71 HydrophobicContact CB-CB 3.78Å; E67-M71 HydrophobicContact CB-CG 4.18Å; E67-M71 WeakPolarHBondContact O-CG 3.34Å
68G86.2Confident87.7Confident29 Ų2972.9 Ų72.930%0.29934%0.34SS..  trans82.1163.5-178.300000115Y64 R70 M71 A72Y64-G68 WeakPolarHBondContact O-CA 3.46Å; Y64-G68 PolarHBondContact O-N 3.41Å; G68-R70 VanDerWaalsContact C-N 3.3Å; G68-R70 PolarHBondContact O-N 3.01Å; G68-M71 PolarHBondContact O-N 3.1Å; G68-M71 VanDerWaalsContact O-N 3.15Å; G68-A72 PolarHBondContact O-N 2.91Å
69I82.7Confident87.9Confident132 Ų13268 Ų6868%0.67732%0.316SS*.Hα-helixtrans-62.3-33-172.9-167.163.6000113.5M71 A72 Y73I69-M71 VanDerWaalsContact C-N 3.29Å; I69-M71 PolarHBondContact O-N 3.36Å; I69-A72 HydrophobicContact CD1-CB 4.35Å; I69-A72 VanDerWaalsContact O-CB 3.27Å; I69-A72 WeakPolarHBondContact O-CB 3.49Å; I69-A72 PolarHBondContact O-N 3.34Å; I69-A72 VanDerWaalsContact O-N 3.12Å; I69-Y73 HydrophobicContact CD1-CE2 4.16Å; I69-Y73 HydrophobicContact CG1-CE2 4.39Å
70R85.6Confident88.2Confident218 Ų21865.8 Ų65.882%0.82331%0.307SS*.Hα-helixtrans-62.3-38.7178.3-174.7179179.1-179.81.3111.6G68 A72 Y73G68-R70 VanDerWaalsContact C-N 3.3Å; G68-R70 PolarHBondContact O-N 3.01Å; R70-A72 VanDerWaalsContact C-N 3.31Å; R70-Y73 PolarHBondContact O-N 2.69Å
71M86.5Confident88.5Confident57 Ų5768.5 Ų68.528%0.28132%0.321SS..Hα-helixtrans-72.6-27.1177.6-69.6-60.3163.400111.7K45 E67 G68 I69 Y73 R74K45-M71 PolarHBondContact NZ-O 3.45Å; E67-M71 HydrophobicContact CB-CB 3.78Å; E67-M71 HydrophobicContact CB-CG 4.18Å; E67-M71 WeakPolarHBondContact O-CG 3.34Å; G68-M71 PolarHBondContact O-N 3.1Å; G68-M71 VanDerWaalsContact O-N 3.15Å; I69-M71 VanDerWaalsContact C-N 3.29Å; I69-M71 PolarHBondContact O-N 3.36Å; M71-Y73 PolarHBondContact O-N 3.11Å; M71-R74 WeakPolarHBondContact O-CB 3.35Å; M71-R74 PolarHBondContact O-N 3.35Å; M71-R74 VanDerWaalsContact O-N 3.09Å; M71-R74 HydrophobicContact SD-CB 4.42Å
72A87.3Confident88.8Confident1 Ų165.2 Ų65.21%0.00830%0.303CS..Hα-helixtrans-58.2-32.3174.700000112.6F41 P42 K45 Y64 G68 I69 R70F41-A72 WeakPolarHBondContact CD1-O 3.42Å; F41-A72 WeakPolarHBondContact CE1-O 3.49Å; P42-A72 HydrophobicContact CB-CB 4.47Å; K45-A72 WeakPolarHBondContact CD-O 3.45Å; Y64-A72 HydrophobicContact CD1-CB 3.87Å; Y64-A72 HydrophobicContact CE1-CB 3.77Å; Y64-A72 HydrophobicContact CG-CB 4.49Å; G68-A72 PolarHBondContact O-N 2.91Å; I69-A72 HydrophobicContact CD1-CB 4.35Å; I69-A72 VanDerWaalsContact O-CB 3.27Å; I69-A72 WeakPolarHBondContact O-CB 3.49Å; I69-A72 PolarHBondContact O-N 3.34Å; I69-A72 VanDerWaalsContact O-N 3.12Å; R70-A72 VanDerWaalsContact C-N 3.31Å
73Y91.4Very high88.6Confident88 Ų8865 Ų6535%0.34530%0.297SS..THydrogen-bonded Turntrans-96.33178-70.8-85.5000114.8V38 F41 P42 I69 R70 M71 G75 V76V38-Y73 HydrophobicContact CG1-CE1 4.22Å; V38-Y73 WeakPolarHBondContact O-CE1 3.32Å; F41-Y73 HydrophobicContact CB-CD1 4.33Å; F41-Y73 HydrophobicContact CB-CE1 4.38Å; F41-Y73 HydrophobicContact CD1-CD1 4.2Å; P42-Y73 HydrophobicContact CG-CE1 4.05Å; P42-Y73 HydrophobicContact CG-CE2 3.96Å; I69-Y73 HydrophobicContact CD1-CE2 4.16Å; I69-Y73 HydrophobicContact CG1-CE2 4.39Å; R70-Y73 PolarHBondContact O-N 2.69Å; M71-Y73 PolarHBondContact O-N 3.11Å; Y73-G75 PolarHBondContact O-N 3.35Å; Y73-V76 WeakPolarHBondContact O-CB 3.4Å; Y73-V76 VanDerWaalsContact O-CG1 3.26Å; Y73-V76 WeakPolarHBondContact O-CG1 3.46Å; Y73-V76 PolarHBondContact O-N 3.17Å; Y73-V76 VanDerWaalsContact O-N 3.14Å
74R89.4Confident88.7Confident46 Ų4665.6 Ų65.617%0.17431%0.311CS..THydrogen-bonded Turntrans-65.2123.1177.2-172.4176-173.9154.10110.1F41 M71 H146 Y149F41-R74 WeakPolarHBondContact CE1-O 3.49Å; F41-R74 WeakPolarHBondContact CZ-O 3.41Å; M71-R74 WeakPolarHBondContact O-CB 3.35Å; M71-R74 PolarHBondContact O-N 3.35Å; M71-R74 VanDerWaalsContact O-N 3.09Å; M71-R74 HydrophobicContact SD-CB 4.42Å; R74-H146 PolarHBondContact NH1-O 3.48Å; R74-H146 PolarHBondContact NH2-O 3.31Å; R74-Y149 PolarHBondContact NH2-O 3.01Å
75G90.2Very high88.9Confident8 Ų866.3 Ų66.38%0.08232%0.321CS..THydrogen-bonded Turntrans88.516.4-176.200000114.7F41 Y73 P78 P79F41-G75 WeakPolarHBondContact CE2-O 3.45Å; F41-G75 WeakPolarHBondContact CZ-O 3.4Å; Y73-G75 PolarHBondContact O-N 3.35Å; G75-P78 WeakPolarHBondContact O-CD 3.15Å; G75-P79 WeakPolarHBondContact O-CD 3.3Å
76V93.9Very high89Confident29 Ų2955.5 Ų55.518%0.17628%0.28CS..  trans-74-28.1175.570.60000113.6V37 F41 Y73 P79 L80V37-V76 HydrophobicContact CG1-CG2 4.35Å; F41-V76 HydrophobicContact CB-CG2 4.04Å; F41-V76 HydrophobicContact CD1-CB 3.99Å; F41-V76 HydrophobicContact CD1-CG2 4.24Å; F41-V76 HydrophobicContact CD2-CB 4Å; F41-V76 HydrophobicContact CD2-CG2 3.81Å; F41-V76 HydrophobicContact CE1-CB 4.02Å; F41-V76 HydrophobicContact CE2-CB 4.06Å; F41-V76 HydrophobicContact CE2-CG2 4.33Å; F41-V76 HydrophobicContact CG-CB 3.96Å; F41-V76 HydrophobicContact CG-CG2 3.75Å; F41-V76 HydrophobicContact CZ-CB 4.05Å; F41-V76 VanDerWaalsContact CZ-N 3.33Å; Y73-V76 WeakPolarHBondContact O-CB 3.4Å; Y73-V76 VanDerWaalsContact O-CG1 3.26Å; Y73-V76 WeakPolarHBondContact O-CG1 3.46Å; Y73-V76 PolarHBondContact O-N 3.17Å; Y73-V76 VanDerWaalsContact O-N 3.14Å; V76-P79 VanDerWaalsContact O-CD 3.25Å; V76-P79 WeakPolarHBondContact O-CD 3.21Å; V76-L80 HydrophobicContact CG2-CD1 4.27Å; V76-L80 WeakPolarHBondContact O-CG 3.39Å; V76-L80 PolarHBondContact O-N 3.39Å
77L94.9Very high88.6Confident71 Ų7149.1 Ų49.137%0.37225%0.249SC..Hα-helixtrans-64.9-47.2-176.6179.264.3000114L80 L81 F153L77-L80 WeakPolarHBondContact O-CB 3.41Å; L77-L80 PolarHBondContact O-N 3.41Å; L77-L80 VanDerWaalsContact O-N 3.09Å; L77-L81 HydrophobicContact CD1-CD1 4.23Å; L77-L81 HydrophobicContact CD1-CD2 4.49Å; L77-L81 HydrophobicContact CD1-CG 4.07Å; L77-L81 HydrophobicContact CG-CD1 4.04Å; L77-L81 HydrophobicContact CG-CG 4.31Å; L77-L81 PolarHBondContact O-N 3.39Å; L77-F153 HydrophobicContact CD2-CE2 4.31Å
78P94.6Very high88.6Confident0 Ų049.4 Ų49.40%026%0.259CS..Hα-helixtrans-57.8-43.7178.6-13.321.8000113.8G75 L80 L81 Q82 F133 V136 Q137 L140 T152G75-P78 WeakPolarHBondContact O-CD 3.15Å; P78-L80 VanDerWaalsContact C-N 3.33Å; P78-L80 PolarHBondContact O-N 2.93Å; P78-L81 PolarHBondContact O-N 3.12Å; P78-Q82 VanDerWaalsContact O-CB 3.31Å; P78-Q82 WeakPolarHBondContact O-CB 3.26Å; P78-Q82 PolarHBondContact O-N 3.41Å; P78-F133 HydrophobicContact CB-CB 4.23Å; P78-F133 HydrophobicContact CB-CD1 4.47Å; P78-F133 VanDerWaalsContact CB-O 3.27Å; P78-F133 WeakPolarHBondContact CB-O 3.48Å; P78-V136 HydrophobicContact CG-CB 4.42Å; P78-V136 HydrophobicContact CG-CG1 4.01Å; P78-Q137 HydrophobicContact CB-CB 4.09Å; P78-Q137 HydrophobicContact CG-CB 4.31Å; P78-L140 HydrophobicContact CG-CD1 4.19Å; P78-T152 HydrophobicContact CB-CG2 4.42Å; P78-T152 WeakPolarHBondContact CD-OG1 3.42Å; P78-T152 HydrophobicContact CG-CG2 3.82Å
79P91.6Very high88.7Confident11 Ų1150.6 Ų50.67%0.07126%0.259CS..Hα-helixtrans-53.5-44.5169.7-29.933.5000114.2V37 F41 G75 V76 Q82 R83 Q137V37-P79 HydrophobicContact CG1-CB 3.96Å; F41-P79 HydrophobicContact CE2-CG 4.07Å; G75-P79 WeakPolarHBondContact O-CD 3.3Å; V76-P79 VanDerWaalsContact O-CD 3.25Å; V76-P79 WeakPolarHBondContact O-CD 3.21Å; P79-Q82 PolarHBondContact O-N 3.04Å; P79-R83 VanDerWaalsContact O-CB 3.27Å; P79-R83 WeakPolarHBondContact O-CB 3.42Å; P79-R83 WeakPolarHBondContact O-CG 3.32Å; P79-R83 PolarHBondContact O-N 3.21Å; P79-Q137 HydrophobicContact CG-CB 4.5Å; P79-Q137 HydrophobicContact CG-CG 3.83Å
80L92.9Very high88.8Confident40 Ų4045 Ų4521%0.20923%0.229CC..Hα-helixtrans-62.8-46.7179.9-69.3170000111V37 V38 V76 L77 P78 R83 A84V37-L80 HydrophobicContact CB-CD2 3.94Å; V37-L80 HydrophobicContact CG1-CD2 3.74Å; V37-L80 HydrophobicContact CG1-CG 4.08Å; V38-L80 HydrophobicContact CG2-CD1 4.34Å; V38-L80 HydrophobicContact CG2-CD2 4.32Å; V76-L80 HydrophobicContact CG2-CD1 4.27Å; V76-L80 WeakPolarHBondContact O-CG 3.39Å; V76-L80 PolarHBondContact O-N 3.39Å; L77-L80 WeakPolarHBondContact O-CB 3.41Å; L77-L80 PolarHBondContact O-N 3.41Å; L77-L80 VanDerWaalsContact O-N 3.09Å; P78-L80 VanDerWaalsContact C-N 3.33Å; P78-L80 PolarHBondContact O-N 2.93Å; L80-R83 PolarHBondContact O-N 3.38Å; L80-A84 WeakPolarHBondContact O-CB 3.41Å; L80-A84 PolarHBondContact O-N 3.28Å
81L92.3Very high88.7Confident57 Ų5739.6 Ų39.630%0.29821%0.212SC..Hα-helixtrans-63.4-48.2177.1-66.5176.2000111.8L77 P78 R83 A84 S85 F133L77-L81 HydrophobicContact CD1-CD1 4.23Å; L77-L81 HydrophobicContact CD1-CD2 4.49Å; L77-L81 HydrophobicContact CD1-CG 4.07Å; L77-L81 HydrophobicContact CG-CD1 4.04Å; L77-L81 HydrophobicContact CG-CG 4.31Å; L77-L81 PolarHBondContact O-N 3.39Å; P78-L81 PolarHBondContact O-N 3.12Å; L81-R83 VanDerWaalsContact C-N 3.27Å; L81-R83 PolarHBondContact O-N 3.24Å; L81-A84 PolarHBondContact O-N 3.5Å; L81-S85 PolarHBondContact O-N 3Å; L81-S85 PolarHBondContact O-OG 2.83Å; L81-F133 HydrophobicContact CB-CD1 4.02Å; L81-F133 HydrophobicContact CB-CE1 3.74Å; L81-F133 HydrophobicContact CB-CZ 4.04Å; L81-F133 HydrophobicContact CD1-CD1 4.36Å; L81-F133 HydrophobicContact CD1-CE1 3.8Å; L81-F133 HydrophobicContact CG-CE1 4.43Å
82Q91.9Very high88.7Confident6 Ų638.7 Ų38.73%0.02822%0.218CC..Hα-helixtrans-56-45.9177.4-177.4176.7-14.800111.1P78 P79 S85 S86 L130 F133 E134P78-Q82 VanDerWaalsContact O-CB 3.31Å; P78-Q82 WeakPolarHBondContact O-CB 3.26Å; P78-Q82 PolarHBondContact O-N 3.41Å; P79-Q82 PolarHBondContact O-N 3.04Å; Q82-S85 PolarHBondContact O-N 2.98Å; Q82-S86 WeakPolarHBondContact O-CA 3.39Å; Q82-S86 WeakPolarHBondContact O-CB 3.45Å; Q82-S86 PolarHBondContact O-N 3.38Å; Q82-L130 HydrophobicContact CG-CB 4.14Å; Q82-F133 HydrophobicContact CB-CB 3.69Å; Q82-F133 HydrophobicContact CB-CD2 4.08Å; Q82-F133 HydrophobicContact CB-CG 4.13Å; Q82-F133 HydrophobicContact CG-CB 4.29Å; Q82-E134 VanDerWaalsContact CD-CG 3.49Å; Q82-E134 VanDerWaalsContact NE2-CG 3.31Å; Q82-E134 PolarHBondContact NE2-OE1 3.15Å
83R85.3Confident88.8Confident82 Ų8240.5 Ų40.531%0.30923%0.228SC..Hα-helixtrans-68.1-46.6-177.5-68.1-70.1168144.5-5.5110.7M1 E4 V37 P79 L80 L81 S85 S86M1-R83 VanDerWaalsContact CE-C 3.5Å; M1-R83 HydrophobicContact CE-CB 4.07Å; M1-R83 WeakPolarHBondContact CE-O 3.49Å; E4-R83 IonicContact OE2-NH1 2.78Å; V37-R83 HydrophobicContact CG2-CG 4.42Å; P79-R83 VanDerWaalsContact O-CB 3.27Å; P79-R83 WeakPolarHBondContact O-CB 3.42Å; P79-R83 WeakPolarHBondContact O-CG 3.32Å; P79-R83 PolarHBondContact O-N 3.21Å; L80-R83 PolarHBondContact O-N 3.38Å; L81-R83 VanDerWaalsContact C-N 3.27Å; L81-R83 PolarHBondContact O-N 3.24Å; R83-S85 PolarHBondContact O-N 2.91Å; R83-S86 PolarHBondContact O-N 2.84Å
84A86.1Confident88.6Confident53 Ų5337 Ų3744%0.43822%0.215SC..Hα-helixtrans-54.6-38.6175.800000112.5L80 L81L80-A84 WeakPolarHBondContact O-CB 3.41Å; L80-A84 PolarHBondContact O-N 3.28Å; L81-A84 PolarHBondContact O-N 3.5Å
85S88.1Confident88.5Confident51 Ų5136.4 Ų36.436%0.35722%0.218SC..Hα-helixtrans-82.5-35.4178.3-55.50000114.2L81 Q82 R83 G87 A88 L89L81-S85 PolarHBondContact O-N 3Å; L81-S85 PolarHBondContact O-OG 2.83Å; Q82-S85 PolarHBondContact O-N 2.98Å; R83-S85 PolarHBondContact O-N 2.91Å; S85-G87 PolarHBondContact O-N 3.41Å; S85-A88 PolarHBondContact O-N 2.82Å; S85-L89 WeakPolarHBondContact O-CB 3.13Å; S85-L89 PolarHBondContact O-N 2.73Å
86S87.5Confident88.6Confident0 Ų039.8 Ų39.80%024%0.241CC..Hα-helixtrans-61.7-42.7-173.11660000112.4Q82 R83 A88 L89 M90 E127Q82-S86 WeakPolarHBondContact O-CA 3.39Å; Q82-S86 WeakPolarHBondContact O-CB 3.45Å; Q82-S86 PolarHBondContact O-N 3.38Å; R83-S86 PolarHBondContact O-N 2.84Å; S86-A88 PolarHBondContact O-N 3.17Å; S86-L89 PolarHBondContact O-N 3.17Å; S86-M90 WeakPolarHBondContact O-CB 3.44Å; S86-M90 VanDerWaalsContact O-CG 3.29Å; S86-M90 WeakPolarHBondContact O-CG 3.5Å; S86-M90 PolarHBondContact O-N 3Å; S86-E127 WeakPolarHBondContact CB-OE1 3.19Å; S86-E127 PolarHBondContact OG-OE1 3.15Å
87G78.7Confident88.3Confident5 Ų539.2 Ų39.25%0.05224%0.238CC..Hα-helixtrans-58.6-50.4179.600000113.2M1 S85 F91M1-G87 WeakPolarHBondContact SD-CA 3Å; M1-G87 PolarHBondContact SD-N 2.72Å; M1-G87 VanDerWaalsContact SD-N 3.37Å; S85-G87 PolarHBondContact O-N 3.41Å; G87-F91 VanDerWaalsContact O-CB 3.28Å; G87-F91 WeakPolarHBondContact O-CB 3.45Å; G87-F91 PolarHBondContact O-N 3.01Å
88A84.2Confident88Confident54 Ų5438.8 Ų38.845%0.44623%0.234SC..Hα-helixtrans-63.6-44.7178.900000111.6F26 S85 S86 G92F26-A88 HydrophobicContact CE2-CB 4.46Å; F26-A88 HydrophobicContact CZ-CB 4.11Å; S85-A88 PolarHBondContact O-N 2.82Å; S86-A88 PolarHBondContact O-N 3.17Å; A88-G92 PolarHBondContact O-N 3.07Å
89L87.8Confident87.7Confident54 Ų5447 Ų4728%0.28327%0.265SS..Hα-helixtrans-62.8-52-179.5-178.164.2000111.8S85 S86 F91 G92 V93 S126 V129 L130S85-L89 WeakPolarHBondContact O-CB 3.13Å; S85-L89 PolarHBondContact O-N 2.73Å; S86-L89 PolarHBondContact O-N 3.17Å; L89-F91 VanDerWaalsContact C-N 3.34Å; L89-F91 PolarHBondContact O-N 3.27Å; L89-G92 PolarHBondContact O-N 3.23Å; L89-V93 HydrophobicContact CD1-CG2 4.12Å; L89-V93 WeakPolarHBondContact O-CB 3.27Å; L89-V93 WeakPolarHBondContact O-CG2 3.43Å; L89-V93 PolarHBondContact O-N 3.48Å; L89-S126 WeakPolarHBondContact CD2-O 3.33Å; L89-V129 HydrophobicContact CD2-CB 4.47Å; L89-L130 HydrophobicContact CD2-CD1 3.92Å; L89-L130 HydrophobicContact CD2-CD2 4.46Å; L89-L130 HydrophobicContact CD2-CG 3.88Å
90M85.6Confident87.7Confident13 Ų1351.5 Ų51.56%0.06428%0.284CS..Hα-helixtrans-62.9-42-178.9-69.8-17875.100111.6S86 Q94 A123 E127S86-M90 WeakPolarHBondContact O-CB 3.44Å; S86-M90 VanDerWaalsContact O-CG 3.29Å; S86-M90 WeakPolarHBondContact O-CG 3.5Å; S86-M90 PolarHBondContact O-N 3Å; M90-Q94 WeakPolarHBondContact O-CB 3.48Å; M90-Q94 PolarHBondContact O-N 2.91Å; M90-A123 HydrophobicContact CB-CB 4.41Å; M90-E127 HydrophobicContact CG-CB 4.27Å; M90-E127 HydrophobicContact CG-CG 4.48Å; M90-E127 HydrophobicContact SD-CG 4.44Å
91F82.7Confident87.5Confident106 Ų10650 Ų5047%0.46528%0.276SS..Hα-helixtrans-61.6-49.9177-177.4-87.1000111.5G87 L89 V93 Q94 S95G87-F91 VanDerWaalsContact O-CB 3.28Å; G87-F91 WeakPolarHBondContact O-CB 3.45Å; G87-F91 PolarHBondContact O-N 3.01Å; L89-F91 VanDerWaalsContact C-N 3.34Å; L89-F91 PolarHBondContact O-N 3.27Å; F91-V93 PolarHBondContact O-N 3.19Å; F91-Q94 PolarHBondContact O-N 3.43Å; F91-S95 VanDerWaalsContact O-CB 3.32Å; F91-S95 WeakPolarHBondContact O-CB 3.34Å; F91-S95 PolarHBondContact O-N 3.09Å
92G86Confident87.3Confident38 Ų3850.9 Ų50.939%0.39228%0.283SS..Hα-helixtrans-60.5-47.5-179.400000112.1A88 L89 S96A88-G92 PolarHBondContact O-N 3.07Å; L89-G92 PolarHBondContact O-N 3.23Å; G92-S96 WeakPolarHBondContact O-CB 3.03Å; G92-S96 PolarHBondContact O-N 3.17Å
93V89.7Confident87.1Confident38 Ų3856.4 Ų56.423%0.2331%0.313CS..Hα-helixtrans-68.2-42.5-179.7174.10000111.5L89 F91 S97 A123 S126L89-V93 HydrophobicContact CD1-CG2 4.12Å; L89-V93 WeakPolarHBondContact O-CB 3.27Å; L89-V93 WeakPolarHBondContact O-CG2 3.43Å; L89-V93 PolarHBondContact O-N 3.48Å; F91-V93 PolarHBondContact O-N 3.19Å; V93-S97 VanDerWaalsContact O-CB 3.22Å; V93-S97 WeakPolarHBondContact O-CB 3.4Å; V93-S97 PolarHBondContact O-N 3.17Å; V93-S97 PolarHBondContact O-OG 3.43Å; V93-A123 HydrophobicContact CB-CB 4.5Å; V93-A123 HydrophobicContact CG1-CB 4.39Å; V93-S126 WeakPolarHBondContact CG2-OG 3.43Å
94Q87.2Confident87.3Confident15 Ų1556.4 Ų56.47%0.0732%0.316CS..Hα-helixtrans-62.3-49.6178-172.3178.2-3.300111.2R2 M90 F91 S96 S97 E98 S120 A123R2-Q94 VanDerWaalsContact CD-OE1 3.31Å; R2-Q94 VanDerWaalsContact NH1-CD 3.31Å; M90-Q94 WeakPolarHBondContact O-CB 3.48Å; M90-Q94 PolarHBondContact O-N 2.91Å; F91-Q94 PolarHBondContact O-N 3.43Å; Q94-S96 PolarHBondContact O-N 3.41Å; Q94-S97 PolarHBondContact O-N 3.34Å; Q94-E98 WeakPolarHBondContact O-CB 3.12Å; Q94-E98 PolarHBondContact O-N 2.96Å; Q94-S120 PolarHBondContact NE2-OG 3.3Å; Q94-S120 VanDerWaalsContact NE2-OG 3.16Å; Q94-A123 HydrophobicContact CB-CB 3.84Å
95S87.6Confident87.1Confident34 Ų3457.8 Ų57.824%0.23832%0.321CS..Hα-helixtrans-63.2-42.9-179.5-172.30000111.8F91 R99F91-S95 VanDerWaalsContact O-CB 3.32Å; F91-S95 WeakPolarHBondContact O-CB 3.34Å; F91-S95 PolarHBondContact O-N 3.09Å; S95-R99 WeakPolarHBondContact O-CB 3.47Å; S95-R99 VanDerWaalsContact O-CG 3.27Å; S95-R99 WeakPolarHBondContact O-CG 3.37Å; S95-R99 PolarHBondContact O-N 3.15Å
96S91.4Very high86.8Confident79 Ų7960.4 Ų60.455%0.55235%0.346SS*.Hα-helixtrans-61.5-45.6175.1-173.90000111.7G92 Q94 R99 F100G92-S96 WeakPolarHBondContact O-CB 3.03Å; G92-S96 PolarHBondContact O-N 3.17Å; Q94-S96 PolarHBondContact O-N 3.41Å; S96-R99 PolarHBondContact O-N 3.11Å; S96-F100 WeakPolarHBondContact O-CB 3.31Å; S96-F100 PolarHBondContact O-N 2.84Å
97S89.2Confident86.7Confident17 Ų1765.3 Ų65.312%0.11938%0.375CS..Hα-helixtrans-66.1-41.8-180-57.90000112.3V93 Q94 F100 L101V93-S97 VanDerWaalsContact O-CB 3.22Å; V93-S97 WeakPolarHBondContact O-CB 3.4Å; V93-S97 PolarHBondContact O-N 3.17Å; V93-S97 PolarHBondContact O-OG 3.43Å; Q94-S97 PolarHBondContact O-N 3.34Å; S97-F100 PolarHBondContact O-N 3.19Å; S97-L101 VanDerWaalsContact O-CG 3.23Å; S97-L101 WeakPolarHBondContact O-CG 2.92Å; S97-L101 PolarHBondContact O-N 3.26Å
98E87.1Confident86.8Confident62 Ų6267.4 Ų67.429%0.2938%0.383SS..Hα-helixtrans-64.1-45.8177.3-175.7171.4-170.600111.3Q94 F100 L101 V102Q94-E98 WeakPolarHBondContact O-CB 3.12Å; Q94-E98 PolarHBondContact O-N 2.96Å; E98-F100 VanDerWaalsContact C-N 3.32Å; E98-F100 PolarHBondContact O-N 3.49Å; E98-L101 PolarHBondContact O-N 3.04Å; E98-V102 WeakPolarHBondContact O-CB 3.45Å; E98-V102 VanDerWaalsContact O-CG2 3.29Å; E98-V102 WeakPolarHBondContact O-CG2 3.36Å; E98-V102 PolarHBondContact O-N 3.13Å
99R89.3Confident86.8Confident173 Ų17372 Ų7265%0.65340%0.4SS*.Hα-helixtrans-59.8-43.1174.7-72.1175-177.4-171.51.5111.7S95 S96 V102 N103S95-R99 WeakPolarHBondContact O-CB 3.47Å; S95-R99 VanDerWaalsContact O-CG 3.27Å; S95-R99 WeakPolarHBondContact O-CG 3.37Å; S95-R99 PolarHBondContact O-N 3.15Å; S96-R99 PolarHBondContact O-N 3.11Å; R99-V102 PolarHBondContact O-N 3.28Å; R99-N103 VanDerWaalsContact O-CB 3.27Å; R99-N103 WeakPolarHBondContact O-CB 3.45Å; R99-N103 PolarHBondContact O-N 3.33Å; R99-N103 PolarHBondContact O-ND2 3.45Å
100F90.7Very high86.6Confident105 Ų10574.6 Ų74.646%0.46141%0.407SS..Hα-helixtrans-62.3-46.2178.9-179.9-96.9000112.2S96 S97 E98 N103 H104 F108S96-F100 WeakPolarHBondContact O-CB 3.31Å; S96-F100 PolarHBondContact O-N 2.84Å; S97-F100 PolarHBondContact O-N 3.19Å; E98-F100 VanDerWaalsContact C-N 3.32Å; E98-F100 PolarHBondContact O-N 3.49Å; F100-N103 PolarHBondContact O-N 3.1Å; F100-H104 AromaticContact CD2-CE1 3.74Å; F100-H104 AromaticContact CD2-ND1 3.85Å; F100-H104 AromaticContact CE2-CE1 3.48Å; F100-H104 VanDerWaalsContact CE2-CE1 3.48Å; F100-H104 WeakPolarHBondContact CE2-CE1 3.26Å; F100-H104 AromaticContact CE2-ND1 3.77Å; F100-H104 PolarHBondContact O-N 3.41Å; F100-H104 PolarHBondContact O-ND1 3.4Å; F100-F108 HydrophobicContact CD1-CE2 4.4Å; F100-F108 AromaticContact CE1-CE2 3.76Å; F100-F108 HydrophobicContact CE1-CE2 3.76Å; F100-F108 HydrophobicContact CE1-CZ 4.42Å
101L88.9Confident86.7Confident8 Ų876.6 Ų76.64%0.04242%0.423CS..Hα-helixtrans-64.1-44.4178.6-68.9169.3000111.7S97 E98 N103 H104 F108 V118S97-L101 VanDerWaalsContact O-CG 3.23Å; S97-L101 WeakPolarHBondContact O-CG 2.92Å; S97-L101 PolarHBondContact O-N 3.26Å; E98-L101 PolarHBondContact O-N 3.04Å; L101-N103 PolarHBondContact O-N 3.09Å; L101-H104 PolarHBondContact O-N 3.21Å; L101-F108 HydrophobicContact CD2-CB 4.08Å; L101-F108 HydrophobicContact CD2-CD1 3.87Å; L101-F108 HydrophobicContact CD2-CD2 3.68Å; L101-F108 HydrophobicContact CD2-CE1 4.18Å; L101-F108 HydrophobicContact CD2-CE2 4.03Å; L101-F108 HydrophobicContact CD2-CG 3.59Å; L101-F108 HydrophobicContact CD2-CZ 4.25Å; L101-V118 HydrophobicContact CD1-CB 4Å; L101-V118 HydrophobicContact CD1-CG1 3.82Å
102V87.5Confident86.7Confident76 Ų7676.2 Ų76.246%0.46143%0.43SS..Hα-helixtrans-66.8-36.2179.7171.10000112.2E98 R99 H104E98-V102 WeakPolarHBondContact O-CB 3.45Å; E98-V102 VanDerWaalsContact O-CG2 3.29Å; E98-V102 WeakPolarHBondContact O-CG2 3.36Å; E98-V102 PolarHBondContact O-N 3.13Å; R99-V102 PolarHBondContact O-N 3.28Å; V102-H104 VanDerWaalsContact C-N 3.27Å; V102-H104 PolarHBondContact O-N 3.33Å
103N89.3Confident86.6Confident122 Ų12278.8 Ų78.865%0.65244%0.439SS*.Hα-helixtrans-76.3-11.3-179.4-71.7-12.2000113.9R99 F100 L101 P105R99-N103 VanDerWaalsContact O-CB 3.27Å; R99-N103 WeakPolarHBondContact O-CB 3.45Å; R99-N103 PolarHBondContact O-N 3.33Å; R99-N103 PolarHBondContact O-ND2 3.45Å; F100-N103 PolarHBondContact O-N 3.1Å; L101-N103 PolarHBondContact O-N 3.09Å; N103-P105 VanDerWaalsContact O-CD 3.28Å; N103-P105 WeakPolarHBondContact O-CD 3.47Å
104H88.6Confident86.3Confident82 Ų8280.7 Ų80.738%0.3845%0.447SS..  trans-11959.5178.1-63.186.2000111.9F100 L101 V102 A106 T107 F108F100-H104 AromaticContact CD2-CE1 3.74Å; F100-H104 AromaticContact CD2-ND1 3.85Å; F100-H104 AromaticContact CE2-CE1 3.48Å; F100-H104 VanDerWaalsContact CE2-CE1 3.48Å; F100-H104 WeakPolarHBondContact CE2-CE1 3.26Å; F100-H104 AromaticContact CE2-ND1 3.77Å; F100-H104 PolarHBondContact O-N 3.41Å; F100-H104 PolarHBondContact O-ND1 3.4Å; L101-H104 PolarHBondContact O-N 3.21Å; V102-H104 VanDerWaalsContact C-N 3.27Å; V102-H104 PolarHBondContact O-N 3.33Å; H104-A106 PolarHBondContact O-N 3.36Å; H104-T107 PolarHBondContact O-N 2.93Å; H104-T107 VanDerWaalsContact O-N 3.08Å; H104-F108 HydrophobicContact CB-CD2 4.1Å; H104-F108 PolarHBondContact O-N 3.45Å
105P81.3Confident86.3Confident82 Ų8280.9 Ų80.953%0.53245%0.448SS..THydrogen-bonded Turntrans-65.3-26.3-174.328.1-35.5000113.1N103 T107 F108 N109N103-P105 VanDerWaalsContact O-CD 3.28Å; N103-P105 WeakPolarHBondContact O-CD 3.47Å; P105-T107 PolarHBondContact O-N 3.35Å; P105-F108 CarbonylContact O-C 3.6Å; P105-N109 PolarHBondContact O-N 2.92Å
106A83.3Confident86.2Confident106 Ų10684.2 Ų84.288%0.87646%0.458SS*.THydrogen-bonded Turntrans-65.2-28.1176.300000112.8H104H104-A106 PolarHBondContact O-N 3.36Å
107T83.6Confident85.9Confident102 Ų10283.8 Ų83.863%0.62645%0.449SS*.THydrogen-bonded Turntrans-97.9-39.3178.3-48.80000111.5H104 P105H104-T107 PolarHBondContact O-N 2.93Å; H104-T107 VanDerWaalsContact O-N 3.08Å; P105-T107 PolarHBondContact O-N 3.35Å
108F82.5Confident85.8Confident50 Ų5085.5 Ų85.522%0.21946%0.459CS..  trans-118.571.9-175.9-56.6-65.9000110.6F100 L101 H104 P105 Y110 H115F100-F108 HydrophobicContact CD1-CE2 4.4Å; F100-F108 AromaticContact CE1-CE2 3.76Å; F100-F108 HydrophobicContact CE1-CE2 3.76Å; F100-F108 HydrophobicContact CE1-CZ 4.42Å; L101-F108 HydrophobicContact CD2-CB 4.08Å; L101-F108 HydrophobicContact CD2-CD1 3.87Å; L101-F108 HydrophobicContact CD2-CD2 3.68Å; L101-F108 HydrophobicContact CD2-CE1 4.18Å; L101-F108 HydrophobicContact CD2-CE2 4.03Å; L101-F108 HydrophobicContact CD2-CG 3.59Å; L101-F108 HydrophobicContact CD2-CZ 4.25Å; H104-F108 HydrophobicContact CB-CD2 4.1Å; H104-F108 PolarHBondContact O-N 3.45Å; P105-F108 CarbonylContact O-C 3.6Å; F108-Y110 HydrophobicContact CB-CD2 3.96Å; F108-Y110 HydrophobicContact CB-CE2 4.05Å; F108-Y110 HydrophobicContact CD1-CD2 4.34Å; F108-Y110 AromaticContact CD1-CE2 3.59Å; F108-Y110 HydrophobicContact CD1-CE2 3.59Å; F108-Y110 HydrophobicContact CG-CE2 4.25Å; F108-Y110 PolarHBondContact O-N 2.96Å; F108-H115 PolarHBondContact O-NE2 3.33Å
109N83.3Confident85.9Confident150 Ų15082.5 Ų82.580%0.80245%0.445SS*.  trans-80.862.5173.8-168.616.6000110.7P105P105-N109 PolarHBondContact O-N 2.92Å
110Y84Confident85.8Confident108 Ų10874.5 Ų74.542%0.42442%0.415SS..  trans-100.9157.3178.2-55.7-49.8000111.8F108 L114 H115F108-Y110 HydrophobicContact CB-CD2 3.96Å; F108-Y110 HydrophobicContact CB-CE2 4.05Å; F108-Y110 HydrophobicContact CD1-CD2 4.34Å; F108-Y110 AromaticContact CD1-CE2 3.59Å; F108-Y110 HydrophobicContact CD1-CE2 3.59Å; F108-Y110 HydrophobicContact CG-CE2 4.25Å; F108-Y110 PolarHBondContact O-N 2.96Å; Y110-L114 HydrophobicContact CD1-CD1 4.34Å; Y110-L114 HydrophobicContact CG-CB 4.41Å; Y110-H115 AromaticContact CD2-CD2 4Å; Y110-H115 PolarHBondContact O-CE1 2.88Å; Y110-H115 VanDerWaalsContact O-CE1 3.26Å
111S86.7Confident85.7Confident56 Ų5670.9 Ų70.939%0.39241%0.405SS..  trans-63.7154170.971.60000110.8T113 L114 H115S111-T113 PolarHBondContact O-N 3.5Å; S111-T113 VanDerWaalsContact O-N 3.09Å; S111-L114 WeakPolarHBondContact O-CB 3.18Å; S111-L114 PolarHBondContact O-N 2.78Å; S111-L114 WeakPolarHBondContact OG-CG 3.16Å; S111-L114 PolarHBondContact OG-N 3.09Å; S111-H115 PolarHBondContact O-N 3.18Å
112P83.8Confident85.8Confident97 Ų9773.8 Ų73.863%0.6342%0.42SS*.Hα-helixtrans-54.4-32.5177-27.434.8000113.6K116P112-K116 WeakPolarHBondContact O-CG 3.36Å; P112-K116 PolarHBondContact O-N 3.05Å
113T82.6Confident85.8Confident92 Ų9270.1 Ų70.156%0.56440%0.398SS*.Hα-helixtrans-66.3-42.5175-52.50000111.9S111 K116 I117S111-T113 PolarHBondContact O-N 3.5Å; S111-T113 VanDerWaalsContact O-N 3.09Å; T113-K116 PolarHBondContact O-N 3.16Å; T113-I117 HydrophobicContact CG2-CD1 4.11Å; T113-I117 WeakPolarHBondContact O-CG1 3.11Å; T113-I117 PolarHBondContact O-N 3.42Å
114L85.2Confident85.7Confident78 Ų7864.3 Ų64.341%0.40837%0.367SS..Hα-helixtrans-66.8-38.6177.3-74.1176.8000111.5Y110 S111 K116 I117 V118Y110-L114 HydrophobicContact CD1-CD1 4.34Å; Y110-L114 HydrophobicContact CG-CB 4.41Å; S111-L114 WeakPolarHBondContact O-CB 3.18Å; S111-L114 PolarHBondContact O-N 2.78Å; S111-L114 WeakPolarHBondContact OG-CG 3.16Å; S111-L114 PolarHBondContact OG-N 3.09Å; L114-K116 VanDerWaalsContact C-N 3.29Å; L114-K116 PolarHBondContact O-N 3Å; L114-I117 PolarHBondContact O-N 3.28Å; L114-V118 WeakPolarHBondContact O-CG2 3.27Å; L114-V118 PolarHBondContact O-N 3.46Å
115H86.5Confident86Confident19 Ų1966.8 Ų66.89%0.08837%0.373CS..Hα-helixtrans-55-45.6171.6-68.5153.7000111.9F108 Y110 S111 V118 S119F108-H115 PolarHBondContact O-NE2 3.33Å; Y110-H115 AromaticContact CD2-CD2 4Å; Y110-H115 PolarHBondContact O-CE1 2.88Å; Y110-H115 VanDerWaalsContact O-CE1 3.26Å; S111-H115 PolarHBondContact O-N 3.18Å; H115-V118 PolarHBondContact O-N 2.94Å; H115-S119 VanDerWaalsContact O-CB 3.3Å; H115-S119 WeakPolarHBondContact O-CB 3.38Å; H115-S119 PolarHBondContact O-N 3.27Å; H115-S119 PolarHBondContact O-OG 3.07Å; H115-S119 VanDerWaalsContact O-OG 3.09Å
116K84.3Confident86.5Confident104 Ų10464 Ų6445%0.45236%0.356SS..Hα-helixtrans-64.5-40177.1-70.1-180-178.3-174.30113P112 T113 L114 S119 S120 F187P112-K116 WeakPolarHBondContact O-CG 3.36Å; P112-K116 PolarHBondContact O-N 3.05Å; T113-K116 PolarHBondContact O-N 3.16Å; L114-K116 VanDerWaalsContact C-N 3.29Å; L114-K116 PolarHBondContact O-N 3Å; K116-S119 PolarHBondContact O-OG 3.05Å; K116-S119 VanDerWaalsContact O-OG 3.12Å; K116-S120 WeakPolarHBondContact O-CB 3.41Å; K116-S120 PolarHBondContact O-N 2.9Å; K116-S120 PolarHBondContact O-OG 3.48Å; K116-F187 HydrophobicContact CB-CE1 4.49Å
117I85.7Confident86.9Confident70 Ų7059.9 Ų59.936%0.35932%0.318SS..Hα-helixtrans-66-47.2178.4-69.3167.2000110.3T113 L114 S120 A121 F187T113-I117 HydrophobicContact CG2-CD1 4.11Å; T113-I117 WeakPolarHBondContact O-CG1 3.11Å; T113-I117 PolarHBondContact O-N 3.42Å; L114-I117 PolarHBondContact O-N 3.28Å; I117-S120 PolarHBondContact O-N 3Å; I117-A121 WeakPolarHBondContact O-CB 3.42Å; I117-A121 PolarHBondContact O-N 2.89Å; I117-F187 HydrophobicContact CG1-CD2 4.27Å
118V88.5Confident87.3Confident53 Ų5355.4 Ų55.432%0.32129%0.291SS..Hα-helixtrans-65.5-47.7179.9175.60000110.8L101 L114 H115 S120 A121 L122L101-V118 HydrophobicContact CD1-CB 4Å; L101-V118 HydrophobicContact CD1-CG1 3.82Å; L114-V118 WeakPolarHBondContact O-CG2 3.27Å; L114-V118 PolarHBondContact O-N 3.46Å; H115-V118 PolarHBondContact O-N 2.94Å; V118-S120 PolarHBondContact O-N 3.48Å; V118-A121 PolarHBondContact O-N 3.33Å; V118-A121 VanDerWaalsContact O-N 3.16Å; V118-L122 HydrophobicContact CG1-CD1 4.18Å; V118-L122 WeakPolarHBondContact O-CG 3.42Å; V118-L122 PolarHBondContact O-N 2.67Å
119S87.9Confident87.9Confident0 Ų057.3 Ų57.30%031%0.307CS..Hα-helixtrans-60.8-36.2178.368.90000112H115 K116 A123H115-S119 VanDerWaalsContact O-CB 3.3Å; H115-S119 WeakPolarHBondContact O-CB 3.38Å; H115-S119 PolarHBondContact O-N 3.27Å; H115-S119 PolarHBondContact O-OG 3.07Å; H115-S119 VanDerWaalsContact O-OG 3.09Å; K116-S119 PolarHBondContact O-OG 3.05Å; K116-S119 VanDerWaalsContact O-OG 3.12Å; S119-A123 WeakPolarHBondContact O-CB 3.28Å; S119-A123 PolarHBondContact O-N 2.87Å
120S86.6Confident88.4Confident5 Ų550.9 Ų50.94%0.03527%0.272CS..Hα-helixtrans-72.7-37.7175.8-58.30000112.9Q94 K116 I117 V118 A123 G124 N183 F187Q94-S120 PolarHBondContact NE2-OG 3.3Å; Q94-S120 VanDerWaalsContact NE2-OG 3.16Å; K116-S120 WeakPolarHBondContact O-CB 3.41Å; K116-S120 PolarHBondContact O-N 2.9Å; K116-S120 PolarHBondContact O-OG 3.48Å; I117-S120 PolarHBondContact O-N 3Å; V118-S120 PolarHBondContact O-N 3.48Å; S120-A123 PolarHBondContact O-N 3.37Å; S120-G124 PolarHBondContact O-N 3.42Å; S120-N183 PolarHBondContact O-ND2 3.16Å; S120-F187 VanDerWaalsContact CB-CE2 3.47Å; S120-F187 VanDerWaalsContact OG-CE2 3.31Å; S120-F187 WeakPolarHBondContact OG-CE2 3.41Å; S120-F187 WeakPolarHBondContact OG-CZ 3.49Å
121A88.7Confident88.9Confident29 Ų2945.8 Ų45.824%0.2425%0.253CS..Hα-helixtrans-61.4-45.3173.500000111I117 V118 A123 G124 W125I117-A121 WeakPolarHBondContact O-CB 3.42Å; I117-A121 PolarHBondContact O-N 2.89Å; V118-A121 PolarHBondContact O-N 3.33Å; V118-A121 VanDerWaalsContact O-N 3.16Å; A121-A123 PolarHBondContact O-N 3.23Å; A121-G124 PolarHBondContact O-N 3.44Å; A121-W125 PolarHBondContact O-N 3.49Å
122L91Very high89.4Confident68 Ų6844 Ų4436%0.35624%0.24SC..Hα-helixtrans-60.8-42.8175.1-69173.3000112V118 W125 S126V118-L122 HydrophobicContact CG1-CD1 4.18Å; V118-L122 WeakPolarHBondContact O-CG 3.42Å; V118-L122 PolarHBondContact O-N 2.67Å; L122-W125 PolarHBondContact O-N 2.96Å; L122-S126 WeakPolarHBondContact O-CB 3.45Å; L122-S126 PolarHBondContact O-N 3.41Å
123A88.6Confident90Very high0 Ų041.4 Ų41.40%022%0.219CC..Hα-helixtrans-61.5-44.3173.800000112.1M90 V93 Q94 S119 S120 A121 W125 S126 E127M90-A123 HydrophobicContact CB-CB 4.41Å; V93-A123 HydrophobicContact CB-CB 4.5Å; V93-A123 HydrophobicContact CG1-CB 4.39Å; Q94-A123 HydrophobicContact CB-CB 3.84Å; S119-A123 WeakPolarHBondContact O-CB 3.28Å; S119-A123 PolarHBondContact O-N 2.87Å; S120-A123 PolarHBondContact O-N 3.37Å; A121-A123 PolarHBondContact O-N 3.23Å; A123-W125 VanDerWaalsContact C-N 3.31Å; A123-W125 PolarHBondContact O-N 3.09Å; A123-S126 WeakPolarHBondContact CA-OG 3.31Å; A123-S126 PolarHBondContact O-N 3.12Å; A123-S126 PolarHBondContact O-OG 3.38Å; A123-E127 PolarHBondContact O-N 2.91Å
124G87.8Confident90.5Very high0 Ų037.4 Ų37.40%019%0.193CC..Hα-helixtrans-61.2-37.4174.900000113S120 A121 N179S120-G124 PolarHBondContact O-N 3.42Å; A121-G124 PolarHBondContact O-N 3.44Å; G124-N179 PolarHBondContact O-ND2 3.41Å
125W93.4Very high91Very high134 Ų13433.7 Ų33.751%0.50817%0.174SC..Hα-helixtrans-71.4-39.1174.5-70.11.1000112.3A121 L122 A123 E127 A128 L176 S180A121-W125 PolarHBondContact O-N 3.49Å; L122-W125 PolarHBondContact O-N 2.96Å; A123-W125 VanDerWaalsContact C-N 3.31Å; A123-W125 PolarHBondContact O-N 3.09Å; W125-E127 PolarHBondContact O-N 2.87Å; W125-A128 WeakPolarHBondContact O-CB 3.48Å; W125-A128 PolarHBondContact O-N 3.22Å; W125-L176 HydrophobicContact CB-CD2 4.05Å; W125-L176 HydrophobicContact CG-CD2 3.97Å; W125-S180 PolarHBondContact NE1-OG 2.94Å
126S91.7Very high91.4Very high24 Ų2432.8 Ų32.817%0.16817%0.17CC..Hα-helixtrans-63-30.7176.175.60000112.7L89 V93 L122 A123 A128 V129L89-S126 WeakPolarHBondContact CD2-O 3.33Å; V93-S126 WeakPolarHBondContact CG2-OG 3.43Å; L122-S126 WeakPolarHBondContact O-CB 3.45Å; L122-S126 PolarHBondContact O-N 3.41Å; A123-S126 WeakPolarHBondContact CA-OG 3.31Å; A123-S126 PolarHBondContact O-N 3.12Å; A123-S126 PolarHBondContact O-OG 3.38Å; S126-A128 PolarHBondContact O-N 3.26Å; S126-A128 VanDerWaalsContact O-N 3.1Å; S126-V129 WeakPolarHBondContact O-CB 3.43Å; S126-V129 VanDerWaalsContact O-CG2 3.31Å; S126-V129 WeakPolarHBondContact O-CG2 3.31Å; S126-V129 PolarHBondContact O-N 3.07Å
127E91.7Very high91.9Very high19 Ų1928.5 Ų28.59%0.08915%0.151CC..G310 helixtrans-58.9-23.4173.9-166.7-174-15600112.1S86 M90 A123 W125 V129 L130 N179S86-E127 WeakPolarHBondContact CB-OE1 3.19Å; S86-E127 PolarHBondContact OG-OE1 3.15Å; M90-E127 HydrophobicContact CG-CB 4.27Å; M90-E127 HydrophobicContact CG-CG 4.48Å; M90-E127 HydrophobicContact SD-CG 4.44Å; A123-E127 PolarHBondContact O-N 2.91Å; W125-E127 PolarHBondContact O-N 2.87Å; E127-V129 PolarHBondContact O-N 2.73Å; E127-V129 VanDerWaalsContact O-N 3.09Å; E127-L130 HydrophobicContact CG-CD1 4.42Å; E127-L130 WeakPolarHBondContact O-CB 3.33Å; E127-L130 PolarHBondContact O-N 3.38Å; E127-N179 PolarHBondContact OE2-ND2 3.03Å
128A92.6Very high92.3Very high8 Ų825.2 Ų25.27%0.06613%0.134CC..G310 helixtrans-62.1-16.9175.300000113.4W125 S126 L130 M131 Y169 L172 V175 L176W125-A128 WeakPolarHBondContact O-CB 3.48Å; W125-A128 PolarHBondContact O-N 3.22Å; S126-A128 PolarHBondContact O-N 3.26Å; S126-A128 VanDerWaalsContact O-N 3.1Å; A128-L130 PolarHBondContact O-N 3.49Å; A128-M131 WeakPolarHBondContact O-CB 3.42Å; A128-M131 PolarHBondContact O-N 3.23Å; A128-M131 VanDerWaalsContact O-N 3.07Å; A128-Y169 WeakPolarHBondContact O-CE1 3.47Å; A128-L172 HydrophobicContact CB-CD1 3.63Å; A128-V175 HydrophobicContact CB-CG1 4.45Å; A128-L176 HydrophobicContact CB-CD2 3.87Å
129V94.6Very high92.6Very high89 Ų8922.7 Ų22.754%0.53912%0.119SC..G310 helixtrans-60.1-28.4168.8174.80000111.5L89 S126 E127 M131 P132L89-V129 HydrophobicContact CD2-CB 4.47Å; S126-V129 WeakPolarHBondContact O-CB 3.43Å; S126-V129 VanDerWaalsContact O-CG2 3.31Å; S126-V129 WeakPolarHBondContact O-CG2 3.31Å; S126-V129 PolarHBondContact O-N 3.07Å; E127-V129 PolarHBondContact O-N 2.73Å; E127-V129 VanDerWaalsContact O-N 3.09Å; V129-M131 VanDerWaalsContact C-N 3.29Å; V129-M131 PolarHBondContact O-N 3.49Å; V129-P132 WeakPolarHBondContact O-CD 3.49Å
130L94.6Very high92.8Very high16 Ų1622.9 Ų22.98%0.08412%0.12CC..G310 helixtrans-87.23.3178.1-56.8175.6000113.3Q82 L89 E127 A128 P132 F133Q82-L130 HydrophobicContact CG-CB 4.14Å; L89-L130 HydrophobicContact CD2-CD1 3.92Å; L89-L130 HydrophobicContact CD2-CD2 4.46Å; L89-L130 HydrophobicContact CD2-CG 3.88Å; E127-L130 HydrophobicContact CG-CD1 4.42Å; E127-L130 WeakPolarHBondContact O-CB 3.33Å; E127-L130 PolarHBondContact O-N 3.38Å; A128-L130 PolarHBondContact O-N 3.49Å; L130-P132 VanDerWaalsContact C-N 3.29Å; L130-F133 HydrophobicContact CB-CD2 4.22Å; L130-F133 HydrophobicContact CD2-CD2 4.24Å; L130-F133 HydrophobicContact CD2-CE2 4.01Å; L130-F133 WeakPolarHBondContact O-CB 3.33Å; L130-F133 PolarHBondContact O-N 3.38Å
131M94.7Very high93Very high1 Ų122.6 Ų22.61%0.00512%0.118CC..Hα-helixtrans-55-30.8176.9-175.1178.2172.400115.2A128 V129 F133 E134 R135 Y169 R170 L172 V175 Q238A128-M131 WeakPolarHBondContact O-CB 3.42Å; A128-M131 PolarHBondContact O-N 3.23Å; A128-M131 VanDerWaalsContact O-N 3.07Å; V129-M131 VanDerWaalsContact C-N 3.29Å; V129-M131 PolarHBondContact O-N 3.49Å; M131-F133 PolarHBondContact O-N 2.95Å; M131-F133 VanDerWaalsContact O-N 3.16Å; M131-E134 WeakPolarHBondContact O-CB 3.39Å; M131-E134 PolarHBondContact O-N 3.47Å; M131-R135 PolarHBondContact O-N 3.12Å; M131-Y169 HydrophobicContact CB-CD1 4.16Å; M131-Y169 HydrophobicContact CB-CE1 4.33Å; M131-Y169 WeakPolarHBondContact CE-O 3.43Å; M131-Y169 HydrophobicContact SD-CD1 4.04Å; M131-R170 WeakPolarHBondContact CE-O 3.41Å; M131-L172 HydrophobicContact CE-CB 4.38Å; M131-L172 VanDerWaalsContact CE-N 3.28Å; M131-L172 HydrophobicContact SD-CB 3.98Å; M131-L172 HydrophobicContact SD-CD1 3.89Å; M131-V175 HydrophobicContact CE-CG2 4.32Å; M131-V175 HydrophobicContact SD-CG2 4.31Å; M131-Q238 HydrophobicContact CE-CG 4.41Å; M131-Q238 VanDerWaalsContact CE-NE2 3.33Å
132P96.5Very high93.1Very high19 Ų1921.6 Ų21.612%0.12311%0.109CC..Hα-helixtrans-53.4-33.7172.4-30.137.7000113.8V129 L130 R135 V136 L156 L168 Y169V129-P132 WeakPolarHBondContact O-CD 3.49Å; L130-P132 VanDerWaalsContact C-N 3.29Å; P132-R135 PolarHBondContact O-N 3.32Å; P132-V136 WeakPolarHBondContact O-CG2 3.47Å; P132-V136 PolarHBondContact O-N 2.6Å; P132-L156 HydrophobicContact CB-CD2 4.3Å; P132-L168 HydrophobicContact CB-CB 4.18Å; P132-L168 HydrophobicContact CB-CD1 4.11Å; P132-L168 HydrophobicContact CB-CD2 4.41Å; P132-L168 HydrophobicContact CB-CG 4.48Å; P132-L168 HydrophobicContact CG-CB 4.06Å; P132-L168 HydrophobicContact CG-CD1 4.22Å; P132-Y169 HydrophobicContact CG-CE1 4.45Å; P132-Y169 HydrophobicContact CG-CE2 4.39Å
133F96.1Very high92.8Very high42 Ų4222.6 Ų22.618%0.18411%0.111CC..Hα-helixtrans-70-42.9175.6-64.1-60.3000112.1P78 L81 Q82 L130 M131 R135 V136 Q137P78-F133 HydrophobicContact CB-CB 4.23Å; P78-F133 HydrophobicContact CB-CD1 4.47Å; P78-F133 VanDerWaalsContact CB-O 3.27Å; P78-F133 WeakPolarHBondContact CB-O 3.48Å; L81-F133 HydrophobicContact CB-CD1 4.02Å; L81-F133 HydrophobicContact CB-CE1 3.74Å; L81-F133 HydrophobicContact CB-CZ 4.04Å; L81-F133 HydrophobicContact CD1-CD1 4.36Å; L81-F133 HydrophobicContact CD1-CE1 3.8Å; L81-F133 HydrophobicContact CG-CE1 4.43Å; Q82-F133 HydrophobicContact CB-CB 3.69Å; Q82-F133 HydrophobicContact CB-CD2 4.08Å; Q82-F133 HydrophobicContact CB-CG 4.13Å; Q82-F133 HydrophobicContact CG-CB 4.29Å; L130-F133 HydrophobicContact CB-CD2 4.22Å; L130-F133 HydrophobicContact CD2-CD2 4.24Å; L130-F133 HydrophobicContact CD2-CE2 4.01Å; L130-F133 WeakPolarHBondContact O-CB 3.33Å; L130-F133 PolarHBondContact O-N 3.38Å; M131-F133 PolarHBondContact O-N 2.95Å; M131-F133 VanDerWaalsContact O-N 3.16Å; F133-R135 VanDerWaalsContact C-N 3.28Å; F133-R135 PolarHBondContact O-N 3.14Å; F133-V136 PolarHBondContact O-N 3.01Å; F133-Q137 WeakPolarHBondContact O-CB 3.36Å; F133-Q137 PolarHBondContact O-N 3.29Å
134E93.9Very high92.7Very high8 Ų827.9 Ų27.94%0.03714%0.139CC..Hα-helixtrans-58.6-43.9173-62.9-169.1178.500110.8Q82 M131 Q137 T138 R178 K234Q82-E134 VanDerWaalsContact CD-CG 3.49Å; Q82-E134 VanDerWaalsContact NE2-CG 3.31Å; Q82-E134 PolarHBondContact NE2-OE1 3.15Å; M131-E134 WeakPolarHBondContact O-CB 3.39Å; M131-E134 PolarHBondContact O-N 3.47Å; E134-Q137 WeakPolarHBondContact O-CB 3.46Å; E134-Q137 PolarHBondContact O-N 3.36Å; E134-T138 PolarHBondContact O-N 2.84Å; E134-T138 PolarHBondContact O-OG1 2.83Å; E134-R178 IonicContact OE1-NH2 3.51Å; E134-R178 PolarHBondContact OE1-NH2 3.44Å; E134-R178 IonicContact OE2-NH2 2.84Å; E134-K234 VanDerWaalsContact CD-NZ 3.31Å; E134-K234 IonicContact OE1-NZ 2.79Å; E134-K234 WeakPolarHBondContact OE2-CE 3.3Å; E134-K234 IonicContact OE2-NZ 3.13Å; E134-K234 PolarHBondContact OE2-NZ 3.47Å
135R94.9Very high92.7Very high0 Ų029.1 Ų29.10%014%0.144CC..Hα-helixtrans-60.8-49.3-179.6-17869-135.8-121.58.5111.9M131 P132 F133 Q137 T138 L139 E167 L168 Q238 N240M131-R135 PolarHBondContact O-N 3.12Å; P132-R135 PolarHBondContact O-N 3.32Å; F133-R135 VanDerWaalsContact C-N 3.28Å; F133-R135 PolarHBondContact O-N 3.14Å; R135-Q137 VanDerWaalsContact C-N 3.33Å; R135-T138 PolarHBondContact O-N 3.4Å; R135-L139 HydrophobicContact CG-CD1 4.39Å; R135-L139 WeakPolarHBondContact O-CG 3.26Å; R135-L139 PolarHBondContact O-N 2.85Å; R135-L139 VanDerWaalsContact O-N 3.1Å; R135-E167 IonicContact NH1-OE1 2.62Å; R135-E167 PolarHBondContact NH1-OE1 2.73Å; R135-L168 WeakPolarHBondContact CB-O 3.22Å; R135-Q238 PolarHBondContact NE-O 3.35Å; R135-Q238 VanDerWaalsContact NH2-C 3.33Å; R135-Q238 PolarHBondContact NH2-O 2.66Å; R135-N240 PolarHBondContact NH1-O 2.81Å; R135-N240 VanDerWaalsContact NH1-O 3.1Å; R135-N240 PolarHBondContact NH2-O 2.98Å
136V95.9Very high92.3Very high0 Ų024.2 Ų24.20%013%0.126CC..Hα-helixtrans-68.8-36.4-178.8174.20000111.1P78 P132 F133 L139 L140 T152 A155 L156P78-V136 HydrophobicContact CG-CB 4.42Å; P78-V136 HydrophobicContact CG-CG1 4.01Å; P132-V136 WeakPolarHBondContact O-CG2 3.47Å; P132-V136 PolarHBondContact O-N 2.6Å; F133-V136 PolarHBondContact O-N 3.01Å; V136-L139 PolarHBondContact O-N 3.01Å; V136-L140 HydrophobicContact CG1-CD1 3.82Å; V136-L140 HydrophobicContact CG1-CG 4.14Å; V136-L140 WeakPolarHBondContact O-CB 3.31Å; V136-L140 WeakPolarHBondContact O-CG 3.39Å; V136-L140 PolarHBondContact O-N 3.12Å; V136-T152 HydrophobicContact CG1-CG2 3.84Å; V136-A155 HydrophobicContact CG1-CB 3.77Å; V136-A155 HydrophobicContact CG2-CB 4.49Å; V136-L156 HydrophobicContact CG2-CD2 3.44Å; V136-L156 VanDerWaalsContact CG2-CD2 3.44Å; V136-L156 HydrophobicContact CG2-CG 3.63Å
137Q95.1Very high92.1Very high13 Ų1331 Ų316%0.06116%0.161CC..Hα-helixtrans-55.6-54.6171.5-177.8-169.5-7.500110.9P78 P79 F133 E134 R135 L139 L140 Q141P78-Q137 HydrophobicContact CB-CB 4.09Å; P78-Q137 HydrophobicContact CG-CB 4.31Å; P79-Q137 HydrophobicContact CG-CB 4.5Å; P79-Q137 HydrophobicContact CG-CG 3.83Å; F133-Q137 WeakPolarHBondContact O-CB 3.36Å; F133-Q137 PolarHBondContact O-N 3.29Å; E134-Q137 WeakPolarHBondContact O-CB 3.46Å; E134-Q137 PolarHBondContact O-N 3.36Å; R135-Q137 VanDerWaalsContact C-N 3.33Å; Q137-L139 PolarHBondContact O-N 3.42Å; Q137-L140 PolarHBondContact O-N 3.08Å; Q137-Q141 HydrophobicContact CG-CG 4.45Å; Q137-Q141 WeakPolarHBondContact O-CB 3.46Å; Q137-Q141 WeakPolarHBondContact O-CG 3.25Å; Q137-Q141 PolarHBondContact O-N 3.18Å
138T93.7Very high92Very high1 Ų136.8 Ų36.81%0.00618%0.182CC..Hα-helixtrans-57-40.6-179.6-65.20000111.6F48 E134 R135 Q141 N142 T235 Q238F48-T138 HydrophobicContact CE2-CG2 3.82Å; F48-T138 HydrophobicContact CZ-CG2 4.05Å; F48-T138 VanDerWaalsContact CZ-O 3.3Å; F48-T138 WeakPolarHBondContact CZ-O 3.46Å; E134-T138 PolarHBondContact O-N 2.84Å; E134-T138 PolarHBondContact O-OG1 2.83Å; R135-T138 PolarHBondContact O-N 3.4Å; T138-Q141 PolarHBondContact O-N 3.43Å; T138-N142 WeakPolarHBondContact O-CB 3.36Å; T138-N142 PolarHBondContact O-N 3.34Å; T138-T235 HydrophobicContact CG2-CG2 4.04Å; T138-Q238 VanDerWaalsContact CG2-C 3.44Å; T138-Q238 HydrophobicContact CG2-CB 3.81Å; T138-Q238 VanDerWaalsContact CG2-O 3.29Å; T138-Q238 WeakPolarHBondContact CG2-O 3.43Å; T138-Q238 PolarHBondContact OG1-OE1 3.17Å
139L94.5Very high92Very high0 Ų036.4 Ų36.40%018%0.179CC..Hα-helixtrans-71.3-38.2179.4-71.1176.4000113.8R135 V136 Q137 Q141 N142 Y145 Y149 I159 V241R135-L139 HydrophobicContact CG-CD1 4.39Å; R135-L139 WeakPolarHBondContact O-CG 3.26Å; R135-L139 PolarHBondContact O-N 2.85Å; R135-L139 VanDerWaalsContact O-N 3.1Å; V136-L139 PolarHBondContact O-N 3.01Å; Q137-L139 PolarHBondContact O-N 3.42Å; L139-Q141 VanDerWaalsContact C-N 3.3Å; L139-N142 PolarHBondContact O-N 3.08Å; L139-Y145 HydrophobicContact CD2-CD2 3.85Å; L139-Y145 HydrophobicContact CD2-CE1 4.45Å; L139-Y145 HydrophobicContact CD2-CE2 3.81Å; L139-Y145 HydrophobicContact CD2-CG 4.2Å; L139-Y149 HydrophobicContact CB-CD2 4.1Å; L139-Y149 HydrophobicContact CB-CE2 4.09Å; L139-Y149 HydrophobicContact CD1-CE2 3.97Å; L139-Y149 HydrophobicContact CD2-CE2 4.43Å; L139-Y149 HydrophobicContact CG-CE2 4.4Å; L139-I159 HydrophobicContact CD1-CD1 3.28Å; L139-I159 HydrophobicContact CD1-CG1 4.27Å; L139-V241 HydrophobicContact CD1-CG2 3.74Å; L139-V241 HydrophobicContact CD2-CG2 3.44Å; L139-V241 VanDerWaalsContact CD2-CG2 3.44Å; L139-V241 HydrophobicContact CG-CG2 4.24Å
140L92.9Very high91.8Very high4 Ų440 Ų402%0.02119%0.187CC..Hα-helixtrans-72.3-25.4176.9-72.3176.5000113.2P78 V136 Q137 A155P78-L140 HydrophobicContact CG-CD1 4.19Å; V136-L140 HydrophobicContact CG1-CD1 3.82Å; V136-L140 HydrophobicContact CG1-CG 4.14Å; V136-L140 WeakPolarHBondContact O-CB 3.31Å; V136-L140 WeakPolarHBondContact O-CG 3.39Å; V136-L140 PolarHBondContact O-N 3.12Å; Q137-L140 PolarHBondContact O-N 3.08Å; L140-A155 HydrophobicContact CD2-CB 4.48Å
141Q90.3Very high91.6Very high0 Ų043.3 Ų43.30%021%0.205CC..Hα-helixtrans-84.4-21.5175.3-69.7-178.2-44.200112.6F41 F48 Q137 T138 L139F41-Q141 HydrophobicContact CZ-CG 4.3Å; F48-Q141 HydrophobicContact CD1-CB 3.78Å; F48-Q141 HydrophobicContact CD2-CB 4.42Å; F48-Q141 HydrophobicContact CE1-CB 3.41Å; F48-Q141 VanDerWaalsContact CE1-CB 3.41Å; F48-Q141 WeakPolarHBondContact CE1-O 3.36Å; F48-Q141 HydrophobicContact CE2-CB 4.09Å; F48-Q141 HydrophobicContact CG-CB 4.26Å; F48-Q141 HydrophobicContact CZ-CB 3.57Å; Q137-Q141 HydrophobicContact CG-CG 4.45Å; Q137-Q141 WeakPolarHBondContact O-CB 3.46Å; Q137-Q141 WeakPolarHBondContact O-CG 3.25Å; Q137-Q141 PolarHBondContact O-N 3.18Å; T138-Q141 PolarHBondContact O-N 3.43Å; L139-Q141 VanDerWaalsContact C-N 3.3Å
142N89.9Confident91.6Very high8 Ų843.6 Ų43.64%0.04321%0.206CC..  trans-78.6126.7177.5-173-1.1000111.1F48 L52 T138 L139 D144 Y145 H146F48-N142 HydrophobicContact CZ-CB 4.37Å; L52-N142 HydrophobicContact CD1-CB 4.3Å; T138-N142 WeakPolarHBondContact O-CB 3.36Å; T138-N142 PolarHBondContact O-N 3.34Å; L139-N142 PolarHBondContact O-N 3.08Å; N142-D144 VanDerWaalsContact C-N 3.27Å; N142-D144 PolarHBondContact ND2-OD2 3.23Å; N142-D144 PolarHBondContact O-N 2.86Å; N142-D144 PolarHBondContact OD1-N 3.02Å; N142-D144 PolarHBondContact OD1-OD2 3.33Å; N142-Y145 HydrophobicContact CB-CD2 3.98Å; N142-Y145 WeakPolarHBondContact ND2-CE2 3.32Å; N142-Y145 PolarHBondContact O-N 3.41Å; N142-H146 PolarHBondContact O-CD2 2.69Å
143K84.9Confident91.6Very high89 Ų8948.4 Ų48.439%0.38723%0.226SC..G310 helixtrans-58.4-36.1-179.175.4-172.9-178.7-177.10113.6R63 Y145 H146R63-K143 VanDerWaalsContact NH2-CD 3.3Å; K143-Y145 PolarHBondContact O-N 3.04Å; K143-H146 WeakPolarHBondContact O-CB 3.4Å; K143-H146 PolarHBondContact O-N 2.82Å; K143-H146 VanDerWaalsContact O-N 3.09Å
144D86.5Confident91.6Very high111 Ų11149.6 Ų49.659%0.59423%0.231SC*.G310 helixtrans-65.7-15.8-175.4-53.4-32.3000112N142N142-D144 VanDerWaalsContact C-N 3.27Å; N142-D144 PolarHBondContact ND2-OD2 3.23Å; N142-D144 PolarHBondContact O-N 2.86Å; N142-D144 PolarHBondContact OD1-N 3.02Å; N142-D144 PolarHBondContact OD1-OD2 3.33Å
145Y88.5Confident91.6Very high26 Ų2649.2 Ų49.210%0.10223%0.23CC..G310 helixtrans-115.27-179.4-57.8-85.2000113.5L139 N142 K143 D147 R148 Y149 S239 V241L139-Y145 HydrophobicContact CD2-CD2 3.85Å; L139-Y145 HydrophobicContact CD2-CE1 4.45Å; L139-Y145 HydrophobicContact CD2-CE2 3.81Å; L139-Y145 HydrophobicContact CD2-CG 4.2Å; N142-Y145 HydrophobicContact CB-CD2 3.98Å; N142-Y145 WeakPolarHBondContact ND2-CE2 3.32Å; N142-Y145 PolarHBondContact O-N 3.41Å; K143-Y145 PolarHBondContact O-N 3.04Å; Y145-D147 PolarHBondContact O-N 3.27Å; Y145-R148 PolarHBondContact O-N 3.1Å; Y145-R148 VanDerWaalsContact O-N 3.11Å; Y145-Y149 HydrophobicContact CD1-CD2 4.19Å; Y145-Y149 AromaticContact CD1-CE2 3.59Å; Y145-Y149 HydrophobicContact CD1-CE2 3.59Å; Y145-Y149 HydrophobicContact CE1-CE2 4.39Å; Y145-Y149 HydrophobicContact CG-CD2 4.2Å; Y145-Y149 AromaticContact CG-CE2 3.96Å; Y145-Y149 HydrophobicContact CG-CE2 3.96Å; Y145-Y149 PolarHBondContact O-N 3.39Å; Y145-S239 WeakPolarHBondContact CE2-O 3.49Å; Y145-S239 PolarHBondContact OH-O 2.87Å; Y145-S239 VanDerWaalsContact OH-O 3.07Å; Y145-V241 HydrophobicContact CD1-CG2 4.21Å; Y145-V241 HydrophobicContact CE1-CB 3.86Å; Y145-V241 HydrophobicContact CE1-CG2 3.46Å; Y145-V241 VanDerWaalsContact CE1-CG2 3.46Å; Y145-V241 PolarHBondContact OH-N 2.97Å; Y145-V241 VanDerWaalsContact OH-N 3.11Å
146H85.5Confident91.7Very high31 Ų3150.9 Ų50.914%0.14424%0.239CC..THydrogen-bonded Turntrans-58.3-35.6178.9-78.5-178.5000112.5R74 N142 K143R74-H146 PolarHBondContact NH1-O 3.48Å; R74-H146 PolarHBondContact NH2-O 3.31Å; N142-H146 PolarHBondContact O-CD2 2.69Å; K143-H146 WeakPolarHBondContact O-CB 3.4Å; K143-H146 PolarHBondContact O-N 2.82Å; K143-H146 VanDerWaalsContact O-N 3.09Å
147D86.4Confident91.7Very high167 Ų16756 Ų5689%0.89327%0.265SS*.THydrogen-bonded Turntrans-86.8-20.6178.6-59.2-38.7000112.7Y145Y145-D147 PolarHBondContact O-N 3.27Å
148R89.6Confident91.8Very high139 Ų13957.3 Ų57.353%0.52527%0.272SS..THydrogen-bonded Turntrans-84.7-38.6-177.9-168.1174.7-68.4-175.4-2.4112.9Y145 H154Y145-R148 PolarHBondContact O-N 3.1Å; Y145-R148 VanDerWaalsContact O-N 3.11Å; R148-H154 PolarHBondContact O-CE1 2.89Å
149Y92.6Very high91.8Very high1 Ų157.3 Ų57.30%0.00427%0.272CS..  trans-118.9104.7-174-59.9-46.2000112.8R74 L139 Y145 A155 N158 I159 V241R74-Y149 PolarHBondContact NH2-O 3.01Å; L139-Y149 HydrophobicContact CB-CD2 4.1Å; L139-Y149 HydrophobicContact CB-CE2 4.09Å; L139-Y149 HydrophobicContact CD1-CE2 3.97Å; L139-Y149 HydrophobicContact CD2-CE2 4.43Å; L139-Y149 HydrophobicContact CG-CE2 4.4Å; Y145-Y149 HydrophobicContact CD1-CD2 4.19Å; Y145-Y149 AromaticContact CD1-CE2 3.59Å; Y145-Y149 HydrophobicContact CD1-CE2 3.59Å; Y145-Y149 HydrophobicContact CE1-CE2 4.39Å; Y145-Y149 HydrophobicContact CG-CD2 4.2Å; Y145-Y149 AromaticContact CG-CE2 3.96Å; Y145-Y149 HydrophobicContact CG-CE2 3.96Å; Y145-Y149 PolarHBondContact O-N 3.39Å; Y149-A155 HydrophobicContact CD1-CB 4.02Å; Y149-A155 HydrophobicContact CD2-CB 4.35Å; Y149-A155 HydrophobicContact CG-CB 3.86Å; Y149-N158 HydrophobicContact CD1-CB 4.34Å; Y149-N158 HydrophobicContact CE1-CB 3.95Å; Y149-I159 HydrophobicContact CE1-CG1 4.29Å; Y149-V241 HydrophobicContact CE2-CG2 4.4Å
150K90Very high91.8Very high165 Ų16559.6 Ų59.672%0.71729%0.286SS*.  trans-67-41.2-177.4-62-178.2-179.7179.60113.8
151N92.1Very high91.9Very high84 Ų8463.6 Ų63.645%0.44932%0.315SS..SBendtrans-155.1176.2-177.262.846.6000111.1F153 H154 A155N151-F153 PolarHBondContact O-N 3.09Å; N151-F153 PolarHBondContact OD1-N 2.84Å; N151-H154 PolarHBondContact O-N 2.95Å; N151-H154 VanDerWaalsContact OD1-CB 3.26Å; N151-H154 WeakPolarHBondContact OD1-CB 3.48Å; N151-H154 PolarHBondContact OD1-N 3.37Å; N151-A155 WeakPolarHBondContact O-CB 3.21Å; N151-A155 PolarHBondContact O-N 3.2Å
152T94.2Very high92.1Very high7 Ų768.6 Ų68.64%0.04334%0.341CS..Hα-helixtrans-54-48.9-179.2-56.60000113.2P78 V136 A155 L156P78-T152 HydrophobicContact CB-CG2 4.42Å; P78-T152 WeakPolarHBondContact CD-OG1 3.42Å; P78-T152 HydrophobicContact CG-CG2 3.82Å; V136-T152 HydrophobicContact CG1-CG2 3.84Å; T152-A155 PolarHBondContact O-N 2.87Å; T152-L156 HydrophobicContact CG2-CD1 4.36Å; T152-L156 WeakPolarHBondContact O-CG 3.24Å; T152-L156 PolarHBondContact O-N 2.77Å
153F95.8Very high92.3Very high121 Ų12172.1 Ų72.153%0.53136%0.357SS..Hα-helixtrans-70.6-40-177.1-61.9-70.5000111.9L77 N151 A155 L156 I157L77-F153 HydrophobicContact CD2-CE2 4.31Å; N151-F153 PolarHBondContact O-N 3.09Å; N151-F153 PolarHBondContact OD1-N 2.84Å; F153-A155 VanDerWaalsContact C-N 3.31Å; F153-A155 PolarHBondContact O-N 3.24Å; F153-L156 PolarHBondContact O-N 2.62Å; F153-I157 WeakPolarHBondContact O-CB 3.42Å; F153-I157 VanDerWaalsContact O-CG1 3.26Å; F153-I157 WeakPolarHBondContact O-CG1 3.3Å; F153-I157 PolarHBondContact O-N 3.36Å
154H95.9Very high92.7Very high66 Ų6669.3 Ų69.331%0.30635%0.354SS..Hα-helixtrans-61.9-39.9174.4-174.3-97.3000111.4R148 N151 N158R148-H154 PolarHBondContact O-CE1 2.89Å; N151-H154 PolarHBondContact O-N 2.95Å; N151-H154 VanDerWaalsContact OD1-CB 3.26Å; N151-H154 WeakPolarHBondContact OD1-CB 3.48Å; N151-H154 PolarHBondContact OD1-N 3.37Å; H154-N158 WeakPolarHBondContact O-CB 3.45Å; H154-N158 PolarHBondContact O-N 2.99Å
155A95.4Very high93Very high0 Ų068.4 Ų68.40%035%0.352CS..Hα-helixtrans-63.2-48.9173.900000111.6V136 L140 Y149 N151 T152 F153 N158 I159V136-A155 HydrophobicContact CG1-CB 3.77Å; V136-A155 HydrophobicContact CG2-CB 4.49Å; L140-A155 HydrophobicContact CD2-CB 4.48Å; Y149-A155 HydrophobicContact CD1-CB 4.02Å; Y149-A155 HydrophobicContact CD2-CB 4.35Å; Y149-A155 HydrophobicContact CG-CB 3.86Å; N151-A155 WeakPolarHBondContact O-CB 3.21Å; N151-A155 PolarHBondContact O-N 3.2Å; T152-A155 PolarHBondContact O-N 2.87Å; F153-A155 VanDerWaalsContact C-N 3.31Å; F153-A155 PolarHBondContact O-N 3.24Å; A155-N158 PolarHBondContact O-N 3.37Å; A155-I159 WeakPolarHBondContact O-CB 3.49Å; A155-I159 VanDerWaalsContact O-CD1 3.26Å; A155-I159 WeakPolarHBondContact O-CD1 3.27Å; A155-I159 WeakPolarHBondContact O-CG1 3.44Å; A155-I159 PolarHBondContact O-N 3.01Å
156L96Very high93.2Very high36 Ų3674.6 Ų74.619%0.18838%0.379CS..Hα-helixtrans-55.6-56.4177.3-78.7169.3000111.4P132 V136 T152 F153 N158 I159 T160 L168P132-L156 HydrophobicContact CB-CD2 4.3Å; V136-L156 HydrophobicContact CG2-CD2 3.44Å; V136-L156 VanDerWaalsContact CG2-CD2 3.44Å; V136-L156 HydrophobicContact CG2-CG 3.63Å; T152-L156 HydrophobicContact CG2-CD1 4.36Å; T152-L156 WeakPolarHBondContact O-CG 3.24Å; T152-L156 PolarHBondContact O-N 2.77Å; F153-L156 PolarHBondContact O-N 2.62Å; L156-N158 PolarHBondContact O-N 3.37Å; L156-I159 PolarHBondContact O-N 3.43Å; L156-T160 WeakPolarHBondContact O-CG2 3.49Å; L156-T160 PolarHBondContact O-N 2.98Å; L156-T160 PolarHBondContact O-OG1 3.38Å; L156-L168 HydrophobicContact CD2-CD1 4.43Å; L156-L168 HydrophobicContact CD2-CD2 3.93Å
157I96.7Very high93.6Very high108 Ų10873.3 Ų73.355%0.55437%0.374SS*.Hα-helixtrans-60.1-47.4-177.2-66.2165.6000110.4F153 I159 T160 S161F153-I157 WeakPolarHBondContact O-CB 3.42Å; F153-I157 VanDerWaalsContact O-CG1 3.26Å; F153-I157 WeakPolarHBondContact O-CG1 3.3Å; F153-I157 PolarHBondContact O-N 3.36Å; I157-I159 PolarHBondContact O-N 3.14Å; I157-T160 WeakPolarHBondContact CA-OG1 3.49Å; I157-T160 PolarHBondContact O-N 2.91Å; I157-T160 PolarHBondContact O-OG1 3.4Å; I157-S161 VanDerWaalsContact O-CB 3.29Å; I157-S161 WeakPolarHBondContact O-CB 3.44Å; I157-S161 PolarHBondContact O-N 2.89Å; I157-S161 PolarHBondContact O-OG 3.22Å
158N95.6Very high94Very high40 Ų4065.9 Ų65.921%0.21433%0.334CS..Hα-helixtrans-63.3-43.4-178-173.1-63.6000111.8Y149 H154 A155 L156 N162Y149-N158 HydrophobicContact CD1-CB 4.34Å; Y149-N158 HydrophobicContact CE1-CB 3.95Å; H154-N158 WeakPolarHBondContact O-CB 3.45Å; H154-N158 PolarHBondContact O-N 2.99Å; A155-N158 PolarHBondContact O-N 3.37Å; L156-N158 PolarHBondContact O-N 3.37Å; N158-N162 VanDerWaalsContact CG-ND2 3.33Å; N158-N162 VanDerWaalsContact O-CB 3.27Å; N158-N162 WeakPolarHBondContact O-CB 3.3Å; N158-N162 PolarHBondContact O-N 2.85Å; N158-N162 PolarHBondContact O-ND2 3.18Å; N158-N162 VanDerWaalsContact O-ND2 3.08Å; N158-N162 PolarHBondContact OD1-ND2 3.18Å
159I94.9Very high94.3Very high1 Ų163 Ų631%0.00532%0.324CS..Hα-helixtrans-64-48.6177.6-66.9161.9000110.3L139 Y149 A155 L156 I157 S161 H163 G164 E167 L168L139-I159 HydrophobicContact CD1-CD1 3.28Å; L139-I159 HydrophobicContact CD1-CG1 4.27Å; Y149-I159 HydrophobicContact CE1-CG1 4.29Å; A155-I159 WeakPolarHBondContact O-CB 3.49Å; A155-I159 VanDerWaalsContact O-CD1 3.26Å; A155-I159 WeakPolarHBondContact O-CD1 3.27Å; A155-I159 WeakPolarHBondContact O-CG1 3.44Å; A155-I159 PolarHBondContact O-N 3.01Å; L156-I159 PolarHBondContact O-N 3.43Å; I157-I159 PolarHBondContact O-N 3.14Å; I159-S161 PolarHBondContact O-N 3.47Å; I159-H163 WeakPolarHBondContact O-CB 3.34Å; I159-H163 PolarHBondContact O-N 3.4Å; I159-G164 PolarHBondContact O-N 3.41Å; I159-E167 HydrophobicContact CG2-CB 3.86Å; I159-E167 HydrophobicContact CG2-CG 3.67Å; I159-L168 HydrophobicContact CB-CD2 4.35Å; I159-L168 HydrophobicContact CD1-CD2 4.47Å; I159-L168 HydrophobicContact CG2-CD2 3.88Å; I159-L168 HydrophobicContact CG2-CG 4.36Å
160T95.1Very high94.3Very high47 Ų4763.3 Ų63.329%0.28833%0.325SS..Hα-helixtrans-66-38.5-177.551.10000112.6L156 I157 G164 V165 L168L156-T160 WeakPolarHBondContact O-CG2 3.49Å; L156-T160 PolarHBondContact O-N 2.98Å; L156-T160 PolarHBondContact O-OG1 3.38Å; I157-T160 WeakPolarHBondContact CA-OG1 3.49Å; I157-T160 PolarHBondContact O-N 2.91Å; I157-T160 PolarHBondContact O-OG1 3.4Å; T160-G164 WeakPolarHBondContact O-CA 3.48Å; T160-G164 PolarHBondContact O-N 3.32Å; T160-G164 VanDerWaalsContact O-N 3.07Å; T160-V165 HydrophobicContact CG2-CG2 4.43Å; T160-L168 HydrophobicContact CG2-CD1 3.57Å; T160-L168 HydrophobicContact CG2-CG 4.17Å
161S95.1Very high94.4Very high89 Ų8955.6 Ų55.662%0.62229%0.292SS*.Hα-helixtrans-74.2-36.4-179.4-61.60000112.7I157 I159I157-S161 VanDerWaalsContact O-CB 3.29Å; I157-S161 WeakPolarHBondContact O-CB 3.44Å; I157-S161 PolarHBondContact O-N 2.89Å; I157-S161 PolarHBondContact O-OG 3.22Å; I159-S161 PolarHBondContact O-N 3.47Å
162N94.1Very high94.5Very high105 Ų10554.7 Ų54.756%0.56129%0.287SS*.Hα-helixtrans-92.2-29.1-175.1-66-39.6000114.1N158N158-N162 VanDerWaalsContact CG-ND2 3.33Å; N158-N162 VanDerWaalsContact O-CB 3.27Å; N158-N162 WeakPolarHBondContact O-CB 3.3Å; N158-N162 PolarHBondContact O-N 2.85Å; N158-N162 PolarHBondContact O-ND2 3.18Å; N158-N162 VanDerWaalsContact O-ND2 3.08Å; N158-N162 PolarHBondContact OD1-ND2 3.18Å
163H92.7Very high94.5Very high81 Ų8156.8 Ų56.838%0.37530%0.301SS..Hα-helixtrans-125.5-7.3-173.8-57.582.6000113.6I159 E167I159-H163 WeakPolarHBondContact O-CB 3.34Å; I159-H163 PolarHBondContact O-N 3.4Å; H163-E167 HydrophobicContact CB-CB 3.72Å; H163-E167 HydrophobicContact CB-CG 3.73Å
164G93.3Very high94.4Very high30 Ų3051 Ų5131%0.30928%0.276SS..  trans81.8167.5-176.700000114.2I159 T160 K166 E167I159-G164 PolarHBondContact O-N 3.41Å; T160-G164 WeakPolarHBondContact O-CA 3.48Å; T160-G164 PolarHBondContact O-N 3.32Å; T160-G164 VanDerWaalsContact O-N 3.07Å; G164-K166 VanDerWaalsContact C-N 3.27Å; G164-K166 PolarHBondContact O-N 2.93Å; G164-E167 WeakPolarHBondContact O-CB 3.35Å; G164-E167 PolarHBondContact O-N 2.9Å
165V93.4Very high94.3Very high92 Ų9247.9 Ų47.956%0.55826%0.262SS*.G310 helixtrans-64-30.4-174.8179.90000112.7T160 E167 L168 Y169T160-V165 HydrophobicContact CG2-CG2 4.43Å; V165-E167 PolarHBondContact O-N 2.87Å; V165-E167 VanDerWaalsContact O-N 3.17Å; V165-L168 HydrophobicContact CG1-CD1 4.47Å; V165-L168 WeakPolarHBondContact O-CB 3.23Å; V165-L168 PolarHBondContact O-N 2.85Å; V165-L168 VanDerWaalsContact O-N 3.1Å; V165-Y169 HydrophobicContact CG1-CE2 4.27Å
166K93.2Very high94.2Very high157 Ų15750.3 Ų50.368%0.68327%0.274SS*.G310 helixtrans-58.3-29.7178.4-172.9178.2178.2-179.20112.5G164 L168 Y169 F245G164-K166 VanDerWaalsContact C-N 3.27Å; G164-K166 PolarHBondContact O-N 2.93Å; K166-L168 PolarHBondContact O-N 3.19Å; K166-Y169 PolarHBondContact O-N 3.22Å; K166-Y169 VanDerWaalsContact O-N 3.12Å; K166-F245 HydrophobicContact CG-CE1 4.44Å; K166-F245 HydrophobicContact CG-CZ 4.26Å
167E94Very high94.1Very high4 Ų452 Ų522%0.01929%0.286CS..G310 helixtrans-65.6-26.8-179.9-173.359.8-158.200112.8R135 I159 H163 G164 V165 Y169 R170 G242 F245R135-E167 IonicContact NH1-OE1 2.62Å; R135-E167 PolarHBondContact NH1-OE1 2.73Å; I159-E167 HydrophobicContact CG2-CB 3.86Å; I159-E167 HydrophobicContact CG2-CG 3.67Å; H163-E167 HydrophobicContact CB-CB 3.72Å; H163-E167 HydrophobicContact CB-CG 3.73Å; G164-E167 WeakPolarHBondContact O-CB 3.35Å; G164-E167 PolarHBondContact O-N 2.9Å; V165-E167 PolarHBondContact O-N 2.87Å; V165-E167 VanDerWaalsContact O-N 3.17Å; E167-Y169 PolarHBondContact O-N 3.02Å; E167-R170 WeakPolarHBondContact O-CB 3.36Å; E167-R170 PolarHBondContact O-N 2.97Å; E167-R170 IonicContact OE1-CZ 3.99Å; E167-R170 IonicContact OE1-NE 3.5Å; E167-R170 PolarHBondContact OE1-NE 2.96Å; E167-R170 IonicContact OE1-NH2 2.98Å; E167-R170 PolarHBondContact OE1-NH2 3.08Å; E167-R170 IonicContact OE2-CZ 2.73Å; E167-R170 IonicContact OE2-NE 2.67Å; E167-R170 PolarHBondContact OE2-NE 2.86Å; E167-R170 IonicContact OE2-NH2 3.36Å; E167-R170 PolarHBondContact OE2-NH2 3.4Å; E167-G242 PolarHBondContact OE1-N 3.49Å; E167-G242 VanDerWaalsContact OE1-N 3.12Å; E167-F245 WeakPolarHBondContact OE2-CZ 3.39Å
168L94.8Very high93.9Very high11 Ų1148.6 Ų48.66%0.05827%0.266CS..G310 helixtrans-65.6-24.5175.6-64.3173.2000112.7P132 R135 L156 I159 T160 V165 K166P132-L168 HydrophobicContact CB-CB 4.18Å; P132-L168 HydrophobicContact CB-CD1 4.11Å; P132-L168 HydrophobicContact CB-CD2 4.41Å; P132-L168 HydrophobicContact CB-CG 4.48Å; P132-L168 HydrophobicContact CG-CB 4.06Å; P132-L168 HydrophobicContact CG-CD1 4.22Å; R135-L168 WeakPolarHBondContact CB-O 3.22Å; L156-L168 HydrophobicContact CD2-CD1 4.43Å; L156-L168 HydrophobicContact CD2-CD2 3.93Å; I159-L168 HydrophobicContact CB-CD2 4.35Å; I159-L168 HydrophobicContact CD1-CD2 4.47Å; I159-L168 HydrophobicContact CG2-CD2 3.88Å; I159-L168 HydrophobicContact CG2-CG 4.36Å; T160-L168 HydrophobicContact CG2-CD1 3.57Å; T160-L168 HydrophobicContact CG2-CG 4.17Å; V165-L168 HydrophobicContact CG1-CD1 4.47Å; V165-L168 WeakPolarHBondContact O-CB 3.23Å; V165-L168 PolarHBondContact O-N 2.85Å; V165-L168 VanDerWaalsContact O-N 3.1Å; K166-L168 PolarHBondContact O-N 3.19Å
169Y95.1Very high93.7Very high79 Ų7946.9 Ų46.931%0.3126%0.257SS..G310 helixtrans-100.517.5-178.1-63.5-86.7000113.1A128 M131 P132 V165 K166 E167 G171 L172A128-Y169 WeakPolarHBondContact O-CE1 3.47Å; M131-Y169 HydrophobicContact CB-CD1 4.16Å; M131-Y169 HydrophobicContact CB-CE1 4.33Å; M131-Y169 WeakPolarHBondContact CE-O 3.43Å; M131-Y169 HydrophobicContact SD-CD1 4.04Å; P132-Y169 HydrophobicContact CG-CE1 4.45Å; P132-Y169 HydrophobicContact CG-CE2 4.39Å; V165-Y169 HydrophobicContact CG1-CE2 4.27Å; K166-Y169 PolarHBondContact O-N 3.22Å; K166-Y169 VanDerWaalsContact O-N 3.12Å; E167-Y169 PolarHBondContact O-N 3.02Å; Y169-G171 PolarHBondContact O-N 3.04Å; Y169-L172 WeakPolarHBondContact O-CB 3.38Å; Y169-L172 PolarHBondContact O-N 3.26Å; Y169-L172 VanDerWaalsContact O-N 3.15Å
170R93.5Very high93.4Very high7 Ų748.9 Ų48.93%0.02627%0.271CS..THydrogen-bonded Turntrans-64.5121.5171.5-176.3-179.5-66.4-97.6-5.4110.5M131 E167 M237 Q238 N240 G242 G243 S244 F245M131-R170 WeakPolarHBondContact CE-O 3.41Å; E167-R170 WeakPolarHBondContact O-CB 3.36Å; E167-R170 PolarHBondContact O-N 2.97Å; E167-R170 IonicContact OE1-CZ 3.99Å; E167-R170 IonicContact OE1-NE 3.5Å; E167-R170 PolarHBondContact OE1-NE 2.96Å; E167-R170 IonicContact OE1-NH2 2.98Å; E167-R170 PolarHBondContact OE1-NH2 3.08Å; E167-R170 IonicContact OE2-CZ 2.73Å; E167-R170 IonicContact OE2-NE 2.67Å; E167-R170 PolarHBondContact OE2-NE 2.86Å; E167-R170 IonicContact OE2-NH2 3.36Å; E167-R170 PolarHBondContact OE2-NH2 3.4Å; R170-M237 WeakPolarHBondContact CD-O 3.08Å; R170-M237 WeakPolarHBondContact CG-O 3.48Å; R170-Q238 WeakPolarHBondContact O-CG 3.29Å; R170-N240 VanDerWaalsContact CD-O 3.24Å; R170-N240 WeakPolarHBondContact CD-O 3.49Å; R170-N240 PolarHBondContact NE-O 3.37Å; R170-G242 PolarHBondContact NH2-O 3.18Å; R170-G243 PolarHBondContact NH2-O 3.42Å; R170-S244 PolarHBondContact NH1-O 3.34Å; R170-F245 HydrophobicContact CB-CD1 4.42Å; R170-F245 HydrophobicContact CB-CE1 4.12Å; R170-F245 HydrophobicContact CG-CD1 4.3Å; R170-F245 HydrophobicContact CG-CE1 4.43Å
171G92.5Very high93.2Very high3 Ų348.3 Ų48.33%0.03127%0.271CS..THydrogen-bonded Turntrans93.518.6-172.300000114.3Y169 S173 P174 V175Y169-G171 PolarHBondContact O-N 3.04Å; G171-S173 VanDerWaalsContact C-N 3.3Å; G171-S173 PolarHBondContact O-N 2.69Å; G171-P174 WeakPolarHBondContact O-CD 3.3Å; G171-P174 WeakPolarHBondContact O-CG 3.21Å; G171-V175 WeakPolarHBondContact O-CG2 3.3Å; G171-V175 PolarHBondContact O-N 3.35Å
172L94.2Very high92.9Very high65 Ų6544.7 Ų44.734%0.3425%0.246SC..Hα-helixtrans-60.4-39.7179.1178.861.8000112.1A128 M131 Y169 V175 L176A128-L172 HydrophobicContact CB-CD1 3.63Å; M131-L172 HydrophobicContact CE-CB 4.38Å; M131-L172 VanDerWaalsContact CE-N 3.28Å; M131-L172 HydrophobicContact SD-CB 3.98Å; M131-L172 HydrophobicContact SD-CD1 3.89Å; Y169-L172 WeakPolarHBondContact O-CB 3.38Å; Y169-L172 PolarHBondContact O-N 3.26Å; Y169-L172 VanDerWaalsContact O-N 3.15Å; L172-V175 WeakPolarHBondContact O-CB 2.99Å; L172-V175 PolarHBondContact O-N 3.44Å; L172-V175 VanDerWaalsContact O-N 3.17Å; L172-L176 HydrophobicContact CD1-CD1 4.15Å; L172-L176 HydrophobicContact CD1-CD2 4.33Å; L172-L176 HydrophobicContact CD1-CG 3.97Å; L172-L176 HydrophobicContact CD2-CD1 4.45Å; L172-L176 HydrophobicContact CG-CD1 3.91Å; L172-L176 HydrophobicContact CG-CG 4.19Å; L172-L176 WeakPolarHBondContact O-CG 3.35Å; L172-L176 PolarHBondContact O-N 3.35Å
173S93.4Very high92.5Very high50 Ų5040.2 Ų40.235%0.3522%0.223SC..Hα-helixtrans-59.5-52.8-178.1520000114G171 V175 L176 V177G171-S173 VanDerWaalsContact C-N 3.3Å; G171-S173 PolarHBondContact O-N 2.69Å; S173-V175 VanDerWaalsContact C-N 3.26Å; S173-V175 PolarHBondContact O-N 3.36Å; S173-L176 PolarHBondContact O-N 3.48Å; S173-V177 WeakPolarHBondContact O-CG2 3.12Å; S173-V177 PolarHBondContact O-N 2.98Å; S173-V177 VanDerWaalsContact O-N 3.11Å
174P93.5Very high92.2Very high0 Ų037.9 Ų37.90%022%0.221CC..Hα-helixtrans-64.7-28.8175.227.5-36.9000112.7G171 R178 I233 K234 M237 F248G171-P174 WeakPolarHBondContact O-CD 3.3Å; G171-P174 WeakPolarHBondContact O-CG 3.21Å; P174-R178 WeakPolarHBondContact O-CB 3.31Å; P174-R178 PolarHBondContact O-N 2.87Å; P174-I233 HydrophobicContact CB-CG2 4.3Å; P174-I233 HydrophobicContact CG-CG2 4.4Å; P174-K234 HydrophobicContact CB-CB 4.09Å; P174-K234 HydrophobicContact CG-CB 3.94Å; P174-M237 HydrophobicContact CG-SD 3.62Å; P174-F248 HydrophobicContact CB-CD2 3.99Å; P174-F248 HydrophobicContact CB-CE2 4.09Å
175V93.9Very high91.9Very high1 Ų139.1 Ų39.11%0.00622%0.22CC..Hα-helixtrans-64.8-47.3175.5172.40000111.1A128 M131 G171 L172 S173 R178 N179 K234A128-V175 HydrophobicContact CB-CG1 4.45Å; M131-V175 HydrophobicContact CE-CG2 4.32Å; M131-V175 HydrophobicContact SD-CG2 4.31Å; G171-V175 WeakPolarHBondContact O-CG2 3.3Å; G171-V175 PolarHBondContact O-N 3.35Å; L172-V175 WeakPolarHBondContact O-CB 2.99Å; L172-V175 PolarHBondContact O-N 3.44Å; L172-V175 VanDerWaalsContact O-N 3.17Å; S173-V175 VanDerWaalsContact C-N 3.26Å; S173-V175 PolarHBondContact O-N 3.36Å; V175-R178 WeakPolarHBondContact O-CB 3.06Å; V175-R178 PolarHBondContact O-N 2.94Å; V175-N179 WeakPolarHBondContact O-CB 3.27Å; V175-N179 PolarHBondContact O-N 3.36Å; V175-N179 PolarHBondContact O-OD1 3.07Å; V175-K234 HydrophobicContact CG2-CD 3.96Å; V175-K234 HydrophobicContact CG2-CG 3.86Å
176L93.8Very high91.5Very high50 Ų5035.2 Ų35.226%0.26220%0.195SC..Hα-helixtrans-62.5-46.4178.3-68.3174.6000111.5W125 A128 L172 S173 R178 N179 S180W125-L176 HydrophobicContact CB-CD2 4.05Å; W125-L176 HydrophobicContact CG-CD2 3.97Å; A128-L176 HydrophobicContact CB-CD2 3.87Å; L172-L176 HydrophobicContact CD1-CD1 4.15Å; L172-L176 HydrophobicContact CD1-CD2 4.33Å; L172-L176 HydrophobicContact CD1-CG 3.97Å; L172-L176 HydrophobicContact CD2-CD1 4.45Å; L172-L176 HydrophobicContact CG-CD1 3.91Å; L172-L176 HydrophobicContact CG-CG 4.19Å; L172-L176 WeakPolarHBondContact O-CG 3.35Å; L172-L176 PolarHBondContact O-N 3.35Å; S173-L176 PolarHBondContact O-N 3.48Å; L176-R178 VanDerWaalsContact C-N 3.34Å; L176-R178 PolarHBondContact O-N 3.47Å; L176-N179 PolarHBondContact O-N 3.42Å; L176-S180 PolarHBondContact O-N 3.37Å; L176-S180 PolarHBondContact O-OG 3.32Å
177V93.1Very high90.9Very high73 Ų7330.3 Ų30.344%0.44217%0.174SC..Hα-helixtrans-63.1-42.4177.41780000110.9S173 N179 S180 A181 L230S173-V177 WeakPolarHBondContact O-CG2 3.12Å; S173-V177 PolarHBondContact O-N 2.98Å; S173-V177 VanDerWaalsContact O-N 3.11Å; V177-N179 PolarHBondContact O-N 3.23Å; V177-S180 PolarHBondContact O-N 3.33Å; V177-A181 VanDerWaalsContact O-CB 3.31Å; V177-A181 WeakPolarHBondContact O-CB 3.43Å; V177-A181 PolarHBondContact O-N 3.39Å; V177-L230 HydrophobicContact CB-CD2 4.47Å; V177-L230 HydrophobicContact CG1-CD1 3.93Å; V177-L230 HydrophobicContact CG1-CD2 3.95Å
178R92.5Very high90.5Very high36 Ų3634.5 Ų34.514%0.13620%0.203CC..Hα-helixtrans-58.3-47.4175.5176.3-173.368.975.3-7.6111.2E134 P174 V175 L176 A181 A182 L230 N231E134-R178 IonicContact OE1-NH2 3.51Å; E134-R178 PolarHBondContact OE1-NH2 3.44Å; E134-R178 IonicContact OE2-NH2 2.84Å; P174-R178 WeakPolarHBondContact O-CB 3.31Å; P174-R178 PolarHBondContact O-N 2.87Å; V175-R178 WeakPolarHBondContact O-CB 3.06Å; V175-R178 PolarHBondContact O-N 2.94Å; L176-R178 VanDerWaalsContact C-N 3.34Å; L176-R178 PolarHBondContact O-N 3.47Å; R178-A181 PolarHBondContact O-N 2.91Å; R178-A182 VanDerWaalsContact O-CB 3.26Å; R178-A182 WeakPolarHBondContact O-CB 3.37Å; R178-A182 PolarHBondContact O-N 2.79Å; R178-L230 HydrophobicContact CB-CB 4.17Å; R178-L230 HydrophobicContact CB-CD1 4.2Å; R178-N231 WeakPolarHBondContact CD-OD1 3.15Å
179N91.2Very high90Very high4 Ų434.5 Ų34.52%0.02121%0.205CC..Hα-helixtrans-65.9-43.1-178-75.33000111.3G124 E127 V175 L176 V177 N183G124-N179 PolarHBondContact O-ND2 3.41Å; E127-N179 PolarHBondContact OE2-ND2 3.03Å; V175-N179 WeakPolarHBondContact O-CB 3.27Å; V175-N179 PolarHBondContact O-N 3.36Å; V175-N179 PolarHBondContact O-OD1 3.07Å; L176-N179 PolarHBondContact O-N 3.42Å; V177-N179 PolarHBondContact O-N 3.23Å; N179-N183 WeakPolarHBondContact O-CB 3.27Å; N179-N183 PolarHBondContact O-N 3.37Å; N179-N183 PolarHBondContact O-ND2 3.3Å; N179-N183 PolarHBondContact O-OD1 3.23Å
180S89.4Confident89.2Confident43 Ų4332.8 Ų32.830%0.30120%0.2SC..Hα-helixtrans-61.9-46.5174.1-65.50000112.6W125 L176 V177 N183 G184W125-S180 PolarHBondContact NE1-OG 2.94Å; L176-S180 PolarHBondContact O-N 3.37Å; L176-S180 PolarHBondContact O-OG 3.32Å; V177-S180 PolarHBondContact O-N 3.33Å; S180-N183 PolarHBondContact O-N 3.19Å; S180-G184 PolarHBondContact O-N 3.02Å
181A90.1Very high88.6Confident34 Ų3439.3 Ų39.328%0.28123%0.229SC..Hα-helixtrans-63.6-44.8178.900000111.8V177 R178 N183 G184 L185 T227 L230V177-A181 VanDerWaalsContact O-CB 3.31Å; V177-A181 WeakPolarHBondContact O-CB 3.43Å; V177-A181 PolarHBondContact O-N 3.39Å; R178-A181 PolarHBondContact O-N 2.91Å; A181-N183 VanDerWaalsContact C-N 3.33Å; A181-N183 PolarHBondContact O-N 3.16Å; A181-G184 PolarHBondContact O-N 2.89Å; A181-L185 WeakPolarHBondContact O-CB 3.38Å; A181-L185 WeakPolarHBondContact O-CD1 3.3Å; A181-L185 VanDerWaalsContact O-CG 3.24Å; A181-L185 WeakPolarHBondContact O-CG 3.41Å; A181-L185 PolarHBondContact O-N 3.02Å; A181-T227 HydrophobicContact CB-CG2 4.34Å; A181-L230 HydrophobicContact CB-CD1 4.37Å
182A89.4Confident88.1Confident13 Ų1345.8 Ų45.811%0.10725%0.252CS..Hα-helixtrans-59.3-44.4176.700000111.6R178 Y186 I223 T227R178-A182 VanDerWaalsContact O-CB 3.26Å; R178-A182 WeakPolarHBondContact O-CB 3.37Å; R178-A182 PolarHBondContact O-N 2.79Å; A182-Y186 VanDerWaalsContact O-CB 3.3Å; A182-Y186 WeakPolarHBondContact O-CB 3.33Å; A182-Y186 PolarHBondContact O-N 3.48Å; A182-I223 HydrophobicContact CB-CG2 4.03Å; A182-T227 HydrophobicContact CB-CG2 4.26Å
183N86Confident87.3Confident11 Ų1142.7 Ų42.76%0.05924%0.236CC..Hα-helixtrans-64.6-45.3178.7-68.7-11.9000112.4Q3 S120 N179 S180 A181 Y186 F187Q3-N183 PolarHBondContact NE2-OD1 3.38Å; S120-N183 PolarHBondContact O-ND2 3.16Å; N179-N183 WeakPolarHBondContact O-CB 3.27Å; N179-N183 PolarHBondContact O-N 3.37Å; N179-N183 PolarHBondContact O-ND2 3.3Å; N179-N183 PolarHBondContact O-OD1 3.23Å; S180-N183 PolarHBondContact O-N 3.19Å; A181-N183 VanDerWaalsContact C-N 3.33Å; A181-N183 PolarHBondContact O-N 3.16Å; N183-Y186 PolarHBondContact O-N 2.89Å; N183-F187 WeakPolarHBondContact O-CD2 3.43Å; N183-F187 PolarHBondContact O-N 2.66Å; N183-F187 VanDerWaalsContact O-N 3.12Å
184G85.4Confident86.4Confident33 Ų3343 Ų4334%0.3423%0.233SC..Hα-helixtrans-60.5-48.717700000112.2S180 A181 Y186 F187 C188S180-G184 PolarHBondContact O-N 3.02Å; A181-G184 PolarHBondContact O-N 2.89Å; G184-Y186 VanDerWaalsContact C-N 3.29Å; G184-Y186 PolarHBondContact O-N 3.12Å; G184-F187 PolarHBondContact O-N 2.91Å; G184-C188 PolarHBondContact O-N 2.9Å; G184-C188 VanDerWaalsContact O-N 3.08Å; G184-C188 PolarHBondContact O-SG 3.45Å; G184-C188 VanDerWaalsContact O-SG 3.4Å
185L88.1Confident85.7Confident55 Ų5547 Ų4729%0.28826%0.255SS..Hα-helixtrans-63-36.5178.6-69.1167.3000112.3A181 G189 I223 V226A181-L185 WeakPolarHBondContact O-CB 3.38Å; A181-L185 WeakPolarHBondContact O-CD1 3.3Å; A181-L185 VanDerWaalsContact O-CG 3.24Å; A181-L185 WeakPolarHBondContact O-CG 3.41Å; A181-L185 PolarHBondContact O-N 3.02Å; L185-G189 PolarHBondContact O-N 2.78Å; L185-I223 HydrophobicContact CB-CG1 3.86Å; L185-V226 HydrophobicContact CD1-CB 3.67Å; L185-V226 HydrophobicContact CD1-CG1 3.58Å; L185-V226 HydrophobicContact CD1-CG2 4.24Å
186Y83.8Confident84.8Confident11 Ų1149.1 Ų49.14%0.04327%0.266CS..Hα-helixtrans-60.8-47.8174.4174.9-91.9000111.7Q3 I7 A182 N183 G184 G189 H190 L219 I223Q3-Y186 HydrophobicContact CB-CD1 4.44Å; Q3-Y186 HydrophobicContact CB-CD2 3.58Å; Q3-Y186 HydrophobicContact CB-CE1 4.28Å; Q3-Y186 HydrophobicContact CB-CE2 3.34Å; Q3-Y186 HydrophobicContact CB-CG 4.11Å; Q3-Y186 HydrophobicContact CG-CD1 3.66Å; Q3-Y186 HydrophobicContact CG-CD2 3.64Å; Q3-Y186 HydrophobicContact CG-CE1 3.73Å; Q3-Y186 HydrophobicContact CG-CE2 3.67Å; Q3-Y186 HydrophobicContact CG-CG 3.61Å; Q3-Y186 WeakPolarHBondContact O-CE2 3.03Å; Q3-Y186 PolarHBondContact O-OH 2.78Å; I7-Y186 HydrophobicContact CD1-CD2 4.23Å; I7-Y186 HydrophobicContact CD1-CE2 3.3Å; I7-Y186 HydrophobicContact CG1-CE2 3.81Å; I7-Y186 VanDerWaalsContact CG1-OH 3.31Å; I7-Y186 WeakPolarHBondContact CG1-OH 3.32Å; A182-Y186 VanDerWaalsContact O-CB 3.3Å; A182-Y186 WeakPolarHBondContact O-CB 3.33Å; A182-Y186 PolarHBondContact O-N 3.48Å; N183-Y186 PolarHBondContact O-N 2.89Å; G184-Y186 VanDerWaalsContact C-N 3.29Å; G184-Y186 PolarHBondContact O-N 3.12Å; Y186-G189 PolarHBondContact O-N 3.12Å; Y186-H190 HydrophobicContact CE1-CB 4.39Å; Y186-H190 WeakPolarHBondContact O-CB 3.17Å; Y186-H190 PolarHBondContact O-N 3.35Å; Y186-L219 HydrophobicContact CD2-CD2 4.46Å; Y186-I223 HydrophobicContact CD2-CD1 4.46Å
187F82.3Confident83.8Confident54 Ų5448.7 Ų48.724%0.23726%0.261CS..Hα-helixtrans-63.6-44.7179-79.9-66.3000112.6K116 I117 S120 N183 G184 G189 H190 K191K116-F187 HydrophobicContact CB-CE1 4.49Å; I117-F187 HydrophobicContact CG1-CD2 4.27Å; S120-F187 VanDerWaalsContact CB-CE2 3.47Å; S120-F187 VanDerWaalsContact OG-CE2 3.31Å; S120-F187 WeakPolarHBondContact OG-CE2 3.41Å; S120-F187 WeakPolarHBondContact OG-CZ 3.49Å; N183-F187 WeakPolarHBondContact O-CD2 3.43Å; N183-F187 PolarHBondContact O-N 2.66Å; N183-F187 VanDerWaalsContact O-N 3.12Å; G184-F187 PolarHBondContact O-N 2.91Å; F187-G189 VanDerWaalsContact C-N 3.34Å; F187-H190 PolarHBondContact O-N 3.24Å; F187-K191 WeakPolarHBondContact O-CB 3.16Å; F187-K191 PolarHBondContact O-N 2.98Å
188C84Confident82.6Confident91 Ų9151.4 Ų51.462%0.61528%0.277SS*.Hα-helixtrans-60.2-47.1176.5-67.40000111.1G184 W192G184-C188 PolarHBondContact O-N 2.9Å; G184-C188 VanDerWaalsContact O-N 3.08Å; G184-C188 PolarHBondContact O-SG 3.45Å; G184-C188 VanDerWaalsContact O-SG 3.4Å; C188-W192 WeakPolarHBondContact O-CB 3.47Å; C188-W192 PolarHBondContact O-N 3.36Å; C188-W192 VanDerWaalsContact O-N 3.08Å
189G84.3Confident81.4Confident11 Ų1159.9 Ų59.911%0.11331%0.309CS..Hα-helixtrans-66.8-43.9179.500000112.8L185 Y186 F187 K191 W192 L193L185-G189 PolarHBondContact O-N 2.78Å; Y186-G189 PolarHBondContact O-N 3.12Å; F187-G189 VanDerWaalsContact C-N 3.34Å; G189-K191 VanDerWaalsContact C-N 3.33Å; G189-K191 PolarHBondContact O-N 2.98Å; G189-W192 WeakPolarHBondContact O-CB 3.37Å; G189-W192 PolarHBondContact O-N 3.4Å; G189-L193 WeakPolarHBondContact O-CB 3.29Å; G189-L193 VanDerWaalsContact O-CG 3.24Å; G189-L193 WeakPolarHBondContact O-CG 3.21Å; G189-L193 PolarHBondContact O-N 3.22Å
190H78.1Confident80.2Confident44 Ų4467.8 Ų67.820%0.20434%0.339CS..Hα-helixtrans-61.6-41.1178.1-173.885.3000111.8Y186 F187 L193 N194Y186-H190 HydrophobicContact CE1-CB 4.39Å; Y186-H190 WeakPolarHBondContact O-CB 3.17Å; Y186-H190 PolarHBondContact O-N 3.35Å; F187-H190 PolarHBondContact O-N 3.24Å; H190-L193 PolarHBondContact O-N 3.38Å; H190-N194 PolarHBondContact CD2-ND2 3.49Å; H190-N194 PolarHBondContact NE2-ND2 3.41Å; H190-N194 PolarHBondContact O-N 2.79Å; H190-N194 PolarHBondContact O-ND2 3.01Å; H190-N194 VanDerWaalsContact O-ND2 3.13Å
191K81.1Confident78.8Confident144 Ų14472.5 Ų72.563%0.62637%0.366SS*.Hα-helixtrans-60.7-50.7173.2-175.1178.1178.3-179.50111.3F187 G189 L193 N194 D195F187-K191 WeakPolarHBondContact O-CB 3.16Å; F187-K191 PolarHBondContact O-N 2.98Å; G189-K191 VanDerWaalsContact C-N 3.33Å; G189-K191 PolarHBondContact O-N 2.98Å; K191-L193 VanDerWaalsContact C-N 3.28Å; K191-L193 PolarHBondContact O-N 2.9Å; K191-N194 PolarHBondContact O-N 3.3Å; K191-N194 VanDerWaalsContact O-N 3.17Å; K191-D195 PolarHBondContact O-N 3.35Å
192W81.9Confident77.6Confident139 Ų13973.3 Ų73.353%0.52737%0.369SS..Hα-helixtrans-57.3-40.5177.117779.9000112.5C188 G189 D195 I196C188-W192 WeakPolarHBondContact O-CB 3.47Å; C188-W192 PolarHBondContact O-N 3.36Å; C188-W192 VanDerWaalsContact O-N 3.08Å; G189-W192 WeakPolarHBondContact O-CB 3.37Å; G189-W192 PolarHBondContact O-N 3.4Å; W192-D195 PolarHBondContact O-N 2.83Å; W192-I196 HydrophobicContact CD2-CD1 3.69Å; W192-I196 HydrophobicContact CE3-CD1 3.97Å; W192-I196 HydrophobicContact CG-CD1 4.42Å; W192-I196 HydrophobicContact CH2-CD1 3.52Å; W192-I196 HydrophobicContact CZ2-CD1 3.23Å; W192-I196 HydrophobicContact CZ3-CD1 3.89Å; W192-I196 WeakPolarHBondContact O-CG1 3.43Å; W192-I196 PolarHBondContact O-N 3.08Å; W192-I196 VanDerWaalsContact O-N 3.16Å
193L78.2Confident76.5Confident0 Ų081.5 Ų81.50%041%0.405CS..Hα-helixtrans-64.6-43.5176.1-72.6-172.5000112.7G189 H190 K191 D195 I196 R197 L215 L219G189-L193 WeakPolarHBondContact O-CB 3.29Å; G189-L193 VanDerWaalsContact O-CG 3.24Å; G189-L193 WeakPolarHBondContact O-CG 3.21Å; G189-L193 PolarHBondContact O-N 3.22Å; H190-L193 PolarHBondContact O-N 3.38Å; K191-L193 VanDerWaalsContact C-N 3.28Å; K191-L193 PolarHBondContact O-N 2.9Å; L193-D195 VanDerWaalsContact C-N 3.34Å; L193-I196 PolarHBondContact O-N 3.08Å; L193-R197 WeakPolarHBondContact O-CB 3.43Å; L193-R197 VanDerWaalsContact O-CG 3.3Å; L193-R197 WeakPolarHBondContact O-CG 3.27Å; L193-R197 PolarHBondContact O-N 3.45Å; L193-L215 HydrophobicContact CD1-CB 4.26Å; L193-L215 HydrophobicContact CD2-CB 3.62Å; L193-L215 HydrophobicContact CD2-CD1 3.98Å; L193-L215 HydrophobicContact CD2-CD2 3.61Å; L193-L215 HydrophobicContact CD2-CG 3.9Å; L193-L219 HydrophobicContact CD1-CB 4.04Å; L193-L219 HydrophobicContact CD1-CD2 3.59Å; L193-L219 HydrophobicContact CD1-CG 4.42Å; L193-L219 HydrophobicContact CG-CD2 4.44Å
194N75.1Confident75.9Confident55 Ų5583.2 Ų83.229%0.29442%0.418SS..Hα-helixtrans-64.8-39.9177.4-72.8-38.3000111.6H190 K191 I196 R197 V198H190-N194 PolarHBondContact CD2-ND2 3.49Å; H190-N194 PolarHBondContact NE2-ND2 3.41Å; H190-N194 PolarHBondContact O-N 2.79Å; H190-N194 PolarHBondContact O-ND2 3.01Å; H190-N194 VanDerWaalsContact O-ND2 3.13Å; K191-N194 PolarHBondContact O-N 3.3Å; K191-N194 VanDerWaalsContact O-N 3.17Å; N194-I196 VanDerWaalsContact C-N 3.26Å; N194-I196 PolarHBondContact O-N 2.75Å; N194-R197 PolarHBondContact O-N 3.37Å; N194-V198 VanDerWaalsContact O-CG2 3.31Å; N194-V198 WeakPolarHBondContact O-CG2 3.48Å; N194-V198 PolarHBondContact O-N 2.84Å
195D78Confident75.4Confident86 Ų8685.5 Ų85.546%0.4643%0.425SS..Hα-helixtrans-62.4-34.6176.7-66.7-17000112K191 W192 L193 R199K191-D195 PolarHBondContact O-N 3.35Å; W192-D195 PolarHBondContact O-N 2.83Å; L193-D195 VanDerWaalsContact C-N 3.34Å; D195-R199 WeakPolarHBondContact O-CD 3.34Å; D195-R199 VanDerWaalsContact O-CG 3.32Å; D195-R199 WeakPolarHBondContact O-CG 3.28Å
196I76.4Confident74.7Confident44 Ų4489.5 Ų89.523%0.22644%0.444CS..Hα-helixtrans-73.1-42.4174.2-69.6170.4000111.5W192 L193 N194 R199 W211W192-I196 HydrophobicContact CD2-CD1 3.69Å; W192-I196 HydrophobicContact CE3-CD1 3.97Å; W192-I196 HydrophobicContact CG-CD1 4.42Å; W192-I196 HydrophobicContact CH2-CD1 3.52Å; W192-I196 HydrophobicContact CZ2-CD1 3.23Å; W192-I196 HydrophobicContact CZ3-CD1 3.89Å; W192-I196 WeakPolarHBondContact O-CG1 3.43Å; W192-I196 PolarHBondContact O-N 3.08Å; W192-I196 VanDerWaalsContact O-N 3.16Å; L193-I196 PolarHBondContact O-N 3.08Å; N194-I196 VanDerWaalsContact C-N 3.26Å; N194-I196 PolarHBondContact O-N 2.75Å; I196-R199 PolarHBondContact O-N 2.88Å; I196-W211 HydrophobicContact CG2-CZ2 4.28Å
197R71.9Confident74.4Confident42 Ų4293.9 Ų93.916%0.15847%0.465CS..Hα-helixtrans-62.1-46.2179.1-77.3170.1168.1171.7-3.1111.8L193 N194 R199 R200 N212 L215L193-R197 WeakPolarHBondContact O-CB 3.43Å; L193-R197 VanDerWaalsContact O-CG 3.3Å; L193-R197 WeakPolarHBondContact O-CG 3.27Å; L193-R197 PolarHBondContact O-N 3.45Å; N194-R197 PolarHBondContact O-N 3.37Å; R197-R199 PolarHBondContact O-N 3.43Å; R197-R200 PolarHBondContact O-N 3.43Å; R197-R200 VanDerWaalsContact O-O 3.09Å; R197-N212 VanDerWaalsContact CZ-OD1 3.24Å; R197-N212 PolarHBondContact NE-OD1 2.96Å; R197-N212 VanDerWaalsContact NE-OD1 3.08Å; R197-N212 PolarHBondContact NH2-OD1 3.42Å; R197-L215 HydrophobicContact CG-CD1 4.13Å
198V68.1Low74Confident129 Ų12996.9 Ų96.978%0.78248%0.475SS*.Hα-helixtrans-60.2-28.7179.7170.20000111.9N194 R200N194-V198 VanDerWaalsContact O-CG2 3.31Å; N194-V198 WeakPolarHBondContact O-CG2 3.48Å; N194-V198 PolarHBondContact O-N 2.84Å; V198-R200 VanDerWaalsContact C-N 3.27Å; V198-R200 PolarHBondContact O-N 2.73Å
199R67Low73.5Confident214 Ų21494.6 Ų94.681%0.80846%0.46SS*.THydrogen-bonded Turntrans-78.1-6.1177.6-69.3172.8-176.6-89.90.3114D195 I196 R197D195-R199 WeakPolarHBondContact O-CD 3.34Å; D195-R199 VanDerWaalsContact O-CG 3.32Å; D195-R199 WeakPolarHBondContact O-CG 3.28Å; I196-R199 PolarHBondContact O-N 2.88Å; R197-R199 PolarHBondContact O-N 3.43Å
200R66.3Low73.2Confident171 Ų17198.8 Ų98.865%0.64548%0.479SS*.  trans-124.1117.8-173.9-70.7-75.6-167.6177.51.3110.7R197 V198 C202R197-R200 PolarHBondContact O-N 3.43Å; R197-R200 VanDerWaalsContact O-O 3.09Å; V198-R200 VanDerWaalsContact C-N 3.27Å; V198-R200 PolarHBondContact O-N 2.73Å; R200-C202 PolarHBondContact O-N 2.84Å
201T60.6Low73.2Confident142 Ų142101.4 Ų101.487%0.87149%0.487SS*.  trans-82.996.2162.8-38.50000107.3
202C64.5Low73Confident51 Ų5195.1 Ų95.135%0.34546%0.461SS..  trans-78.9130.6169.3-68.90000108.6R200 R208R200-C202 PolarHBondContact O-N 2.84Å; C202-R208 HydrophobicContact CB-CB 4.21Å
203E64.7Low73Confident184 Ų18491.9 Ų91.986%0.8645%0.45SS*.  trans-87.8-38.4-171.8-65.8-173.7161.900112.5
204S74.9Confident73.1Confident47 Ų4793.6 Ų93.633%0.32947%0.465SS..SBendtrans-101.6147.3-179.972.90000113.5M206 E207 R208S204-M206 PolarHBondContact O-N 3.2Å; S204-E207 PolarHBondContact N-OE2 2.94Å; S204-E207 PolarHBondContact O-N 3.25Å; S204-E207 VanDerWaalsContact OG-CB 3.3Å; S204-E207 WeakPolarHBondContact OG-CB 3.29Å; S204-E207 WeakPolarHBondContact OG-CG 3.45Å; S204-E207 PolarHBondContact OG-N 2.92Å; S204-E207 VanDerWaalsContact OG-N 3.15Å; S204-E207 PolarHBondContact OG-OE2 3.22Å; S204-R208 PolarHBondContact O-N 2.88Å; S204-R208 VanDerWaalsContact O-N 3.07Å
205T73.5Confident73.5Confident82 Ų8291.3 Ų91.350%0.50345%0.453SS..Hα-helixtrans-56.5-37.3173.6-51.20000111.7S209T205-S209 WeakPolarHBondContact O-CB 3.42Å; T205-S209 PolarHBondContact O-N 3.4Å
206M74.3Confident73.6Confident138 Ų13887.4 Ų87.468%0.6843%0.432SS*.Hα-helixtrans-67.6-46.5179.1-171.5172.4109.900112S204 R208 S209 L210S204-M206 PolarHBondContact O-N 3.2Å; M206-R208 VanDerWaalsContact C-N 3.33Å; M206-R208 PolarHBondContact O-N 2.93Å; M206-S209 WeakPolarHBondContact O-CB 3.12Å; M206-S209 PolarHBondContact O-N 3.37Å; M206-L210 HydrophobicContact CE-CD1 4.22Å; M206-L210 HydrophobicContact CG-CD1 4.25Å; M206-L210 WeakPolarHBondContact O-CG 3.21Å; M206-L210 PolarHBondContact O-N 2.97Å
207E76.5Confident74Confident104 Ų10485.3 Ų85.349%0.48642%0.421SS..Hα-helixtrans-60.5-43.7176.1-77.1170.7165.600111.7S204 S209 L210 W211S204-E207 PolarHBondContact N-OE2 2.94Å; S204-E207 PolarHBondContact O-N 3.25Å; S204-E207 VanDerWaalsContact OG-CB 3.3Å; S204-E207 WeakPolarHBondContact OG-CB 3.29Å; S204-E207 WeakPolarHBondContact OG-CG 3.45Å; S204-E207 PolarHBondContact OG-N 2.92Å; S204-E207 VanDerWaalsContact OG-N 3.15Å; S204-E207 PolarHBondContact OG-OE2 3.22Å; E207-S209 VanDerWaalsContact C-N 3.3Å; E207-S209 PolarHBondContact O-N 3.38Å; E207-L210 PolarHBondContact O-N 3.43Å; E207-W211 VanDerWaalsContact O-CB 3.24Å; E207-W211 WeakPolarHBondContact O-CB 3.32Å; E207-W211 PolarHBondContact O-N 3.36Å
208R74.3Confident74.7Confident116 Ų11687 Ų8744%0.43843%0.433SS..Hα-helixtrans-60.1-41.7176-173.6177.9178.4-164.8-2111.4C202 S204 M206 N212C202-R208 HydrophobicContact CB-CB 4.21Å; S204-R208 PolarHBondContact O-N 2.88Å; S204-R208 VanDerWaalsContact O-N 3.07Å; M206-R208 VanDerWaalsContact C-N 3.33Å; M206-R208 PolarHBondContact O-N 2.93Å; R208-N212 WeakPolarHBondContact O-CB 3.28Å; R208-N212 PolarHBondContact O-N 2.91Å; R208-N212 PolarHBondContact O-ND2 3.35Å
209S73.8Confident75.6Confident44 Ų4481.7 Ų81.731%0.30840%0.4SS..Hα-helixtrans-64.8-49.6177.3-172.80000112.2T205 M206 E207 W211 N212 F213T205-S209 WeakPolarHBondContact O-CB 3.42Å; T205-S209 PolarHBondContact O-N 3.4Å; M206-S209 WeakPolarHBondContact O-CB 3.12Å; M206-S209 PolarHBondContact O-N 3.37Å; E207-S209 VanDerWaalsContact C-N 3.3Å; E207-S209 PolarHBondContact O-N 3.38Å; S209-W211 VanDerWaalsContact C-N 3.28Å; S209-W211 PolarHBondContact O-N 3.49Å; S209-N212 PolarHBondContact O-N 3.47Å; S209-F213 WeakPolarHBondContact O-CB 3.3Å; S209-F213 PolarHBondContact O-N 3.49Å
210L78Confident76.5Confident99 Ų9972.9 Ų72.952%0.51838%0.376SS..Hα-helixtrans-60.1-39.2176.7-71.2174.6000112M206 E207 F213 A214M206-L210 HydrophobicContact CE-CD1 4.22Å; M206-L210 HydrophobicContact CG-CD1 4.25Å; M206-L210 WeakPolarHBondContact O-CG 3.21Å; M206-L210 PolarHBondContact O-N 2.97Å; E207-L210 PolarHBondContact O-N 3.43Å; L210-F213 WeakPolarHBondContact O-CB 3.47Å; L210-F213 PolarHBondContact O-N 3.27Å; L210-A214 WeakPolarHBondContact O-CB 3.46Å; L210-A214 PolarHBondContact O-N 3.48Å
211W79.1Confident77.5Confident98 Ų9864.7 Ų64.737%0.37135%0.345SS..Hα-helixtrans-67.5-43.8177.4-165.7-117.4000112I196 E207 S209 F213 A214 L215I196-W211 HydrophobicContact CG2-CZ2 4.28Å; E207-W211 VanDerWaalsContact O-CB 3.24Å; E207-W211 WeakPolarHBondContact O-CB 3.32Å; E207-W211 PolarHBondContact O-N 3.36Å; S209-W211 VanDerWaalsContact C-N 3.28Å; S209-W211 PolarHBondContact O-N 3.49Å; W211-F213 VanDerWaalsContact C-N 3.28Å; W211-F213 PolarHBondContact O-N 2.87Å; W211-A214 PolarHBondContact O-N 2.96Å; W211-L215 HydrophobicContact CD2-CD1 4.48Å; W211-L215 HydrophobicContact CD2-CG 4.44Å; W211-L215 HydrophobicContact CG-CD1 4.3Å; W211-L215 HydrophobicContact CZ2-CD2 4.24Å; W211-L215 VanDerWaalsContact NE1-CD1 3.28Å; W211-L215 WeakPolarHBondContact O-CB 3.46Å; W211-L215 WeakPolarHBondContact O-CG 3.34Å; W211-L215 PolarHBondContact O-N 3.29Å
212N76.6Confident78.8Confident13 Ų1360.7 Ų60.77%0.0732%0.32CS..Hα-helixtrans-62.3-37.8174-74-23.9000112.2R197 R208 S209 G216 W283R197-N212 VanDerWaalsContact CZ-OD1 3.24Å; R197-N212 PolarHBondContact NE-OD1 2.96Å; R197-N212 VanDerWaalsContact NE-OD1 3.08Å; R197-N212 PolarHBondContact NH2-OD1 3.42Å; R208-N212 WeakPolarHBondContact O-CB 3.28Å; R208-N212 PolarHBondContact O-N 2.91Å; R208-N212 PolarHBondContact O-ND2 3.35Å; S209-N212 PolarHBondContact O-N 3.47Å; N212-G216 PolarHBondContact O-N 2.98Å; N212-W283 PolarHBondContact O-NE1 2.99Å
213F80.3Confident80.1Confident70 Ų7059.3 Ų59.331%0.30731%0.309SS..Hα-helixtrans-62.2-51.5172.8170.8-105000111.4S209 L210 W211 L215 G217 V280 W283 G284S209-F213 WeakPolarHBondContact O-CB 3.3Å; S209-F213 PolarHBondContact O-N 3.49Å; L210-F213 WeakPolarHBondContact O-CB 3.47Å; L210-F213 PolarHBondContact O-N 3.27Å; W211-F213 VanDerWaalsContact C-N 3.28Å; W211-F213 PolarHBondContact O-N 2.87Å; F213-L215 PolarHBondContact O-N 3.45Å; F213-G217 PolarHBondContact O-N 3.36Å; F213-V280 HydrophobicContact CZ-CG1 4.05Å; F213-W283 AromaticContact CD2-CD1 3.64Å; F213-W283 PolarHBondContact O-NE1 3.49Å; F213-G284 VanDerWaalsContact CD2-CA 3.47Å; F213-G284 VanDerWaalsContact CE2-N 3.35Å
214A82.2Confident81.2Confident37 Ų3750.9 Ų50.931%0.30627%0.272SS..Hα-helixtrans-60.2-48.918000000112L210 W211 G217 I218L210-A214 WeakPolarHBondContact O-CB 3.46Å; L210-A214 PolarHBondContact O-N 3.48Å; W211-A214 PolarHBondContact O-N 2.96Å; A214-G217 PolarHBondContact O-N 2.98Å; A214-I218 WeakPolarHBondContact O-CB 3.23Å; A214-I218 WeakPolarHBondContact O-CD1 3.06Å; A214-I218 WeakPolarHBondContact O-CG1 3.42Å; A214-I218 PolarHBondContact O-N 3.05Å
215L82.6Confident81.9Confident7 Ų752.6 Ų52.64%0.03728%0.276CS..Hα-helixtrans-65.2-44.5-179.2-74.2-176.6000112.9L193 R197 W211 F213 I218 L219L193-L215 HydrophobicContact CD1-CB 4.26Å; L193-L215 HydrophobicContact CD2-CB 3.62Å; L193-L215 HydrophobicContact CD2-CD1 3.98Å; L193-L215 HydrophobicContact CD2-CD2 3.61Å; L193-L215 HydrophobicContact CD2-CG 3.9Å; R197-L215 HydrophobicContact CG-CD1 4.13Å; W211-L215 HydrophobicContact CD2-CD1 4.48Å; W211-L215 HydrophobicContact CD2-CG 4.44Å; W211-L215 HydrophobicContact CG-CD1 4.3Å; W211-L215 HydrophobicContact CZ2-CD2 4.24Å; W211-L215 VanDerWaalsContact NE1-CD1 3.28Å; W211-L215 WeakPolarHBondContact O-CB 3.46Å; W211-L215 WeakPolarHBondContact O-CG 3.34Å; W211-L215 PolarHBondContact O-N 3.29Å; F213-L215 PolarHBondContact O-N 3.45Å; L215-I218 PolarHBondContact O-N 2.94Å; L215-L219 WeakPolarHBondContact O-CB 3.46Å; L215-L219 PolarHBondContact O-N 3.45Å
216G80.9Confident82.8Confident3 Ų352.3 Ų52.33%0.03127%0.274CS..Hα-helixtrans-66.6-39.517700000112.3N212 L219 G220N212-G216 PolarHBondContact O-N 2.98Å; G216-L219 PolarHBondContact O-N 2.9Å; G216-G220 PolarHBondContact O-N 2.97Å
217G83.7Confident83.6Confident0 Ų046.1 Ų46.10%024%0.244CC..Hα-helixtrans-62.7-45.6174.600000112.6F213 A214 G220 G221 W283F213-G217 PolarHBondContact O-N 3.36Å; A214-G217 PolarHBondContact O-N 2.98Å; G217-G220 PolarHBondContact O-N 3.06Å; G217-G221 PolarHBondContact O-N 3.26Å; G217-W283 VanDerWaalsContact N-CD1 3.28Å
218I86.7Confident84.3Confident79 Ų7941.2 Ų41.241%0.40522%0.221SC..Hα-helixtrans-63.1-44.6176.5-70.5164.8000110.8A214 L215 G221 T222A214-I218 WeakPolarHBondContact O-CB 3.23Å; A214-I218 WeakPolarHBondContact O-CD1 3.06Å; A214-I218 WeakPolarHBondContact O-CG1 3.42Å; A214-I218 PolarHBondContact O-N 3.05Å; L215-I218 PolarHBondContact O-N 2.94Å; I218-G221 PolarHBondContact O-N 2.86Å; I218-T222 WeakPolarHBondContact O-CB 3.45Å; I218-T222 PolarHBondContact O-N 2.92Å; I218-T222 PolarHBondContact O-OG1 2.93Å
219L86.9Confident85.1Confident16 Ų1636.9 Ų36.98%0.08421%0.208CC..Hα-helixtrans-61-50.8177.2176.157000111.1I7 Y186 L193 L215 G216 G221 T222 I223I7-L219 HydrophobicContact CD1-CD2 3.96Å; Y186-L219 HydrophobicContact CD2-CD2 4.46Å; L193-L219 HydrophobicContact CD1-CB 4.04Å; L193-L219 HydrophobicContact CD1-CD2 3.59Å; L193-L219 HydrophobicContact CD1-CG 4.42Å; L193-L219 HydrophobicContact CG-CD2 4.44Å; L215-L219 WeakPolarHBondContact O-CB 3.46Å; L215-L219 PolarHBondContact O-N 3.45Å; G216-L219 PolarHBondContact O-N 2.9Å; L219-G221 VanDerWaalsContact C-N 3.34Å; L219-G221 PolarHBondContact O-N 3.5Å; L219-T222 PolarHBondContact O-N 3.09Å; L219-I223 HydrophobicContact CD1-CD1 3.83Å; L219-I223 HydrophobicContact CD1-CG1 4.12Å; L219-I223 HydrophobicContact CG-CD1 3.93Å; L219-I223 WeakPolarHBondContact O-CG1 3.43Å; L219-I223 PolarHBondContact O-N 3.28Å
220G85.2Confident86.1Confident29 Ų2936.1 Ų36.130%0.29920%0.2SC..Hα-helixtrans-59.6-43.3177.900000112.5G216 G217 G224G216-G220 PolarHBondContact O-N 2.97Å; G217-G220 PolarHBondContact O-N 3.06Å; G220-G224 PolarHBondContact O-N 2.62Å
221G87.8Confident86.8Confident0 Ų032.7 Ų32.70%018%0.182CC..Hα-helixtrans-62.4-41.7175.200000113G217 I218 L219 G224 M225 F276G217-G221 PolarHBondContact O-N 3.26Å; I218-G221 PolarHBondContact O-N 2.86Å; L219-G221 VanDerWaalsContact C-N 3.34Å; L219-G221 PolarHBondContact O-N 3.5Å; G221-G224 PolarHBondContact O-N 3.49Å; G221-M225 WeakPolarHBondContact O-CB 3.31Å; G221-M225 PolarHBondContact O-N 3.07Å; G221-F276 VanDerWaalsContact C-CD2 3.44Å; G221-F276 VanDerWaalsContact CA-CD2 3.44Å
222T89Confident87.4Confident58 Ų5828.2 Ų28.236%0.35617%0.166SC..Hα-helixtrans-66.5-46.4178.4-56.60000111.4I218 L219 G224 M225 V226I218-T222 WeakPolarHBondContact O-CB 3.45Å; I218-T222 PolarHBondContact O-N 2.92Å; I218-T222 PolarHBondContact O-OG1 2.93Å; L219-T222 PolarHBondContact O-N 3.09Å; T222-G224 VanDerWaalsContact C-N 3.28Å; T222-G224 PolarHBondContact O-N 2.8Å; T222-M225 PolarHBondContact O-N 3.03Å; T222-V226 WeakPolarHBondContact O-CG2 3.33Å; T222-V226 PolarHBondContact O-N 2.94Å
223I90.1Very high88.1Confident22 Ų2227.8 Ų27.811%0.11316%0.163CC..Hα-helixtrans-58.2-45.7173.6-65.7166.4000109.9A182 L185 Y186 L219 M225 V226 T227A182-I223 HydrophobicContact CB-CG2 4.03Å; L185-I223 HydrophobicContact CB-CG1 3.86Å; Y186-I223 HydrophobicContact CD2-CD1 4.46Å; L219-I223 HydrophobicContact CD1-CD1 3.83Å; L219-I223 HydrophobicContact CD1-CG1 4.12Å; L219-I223 HydrophobicContact CG-CD1 3.93Å; L219-I223 WeakPolarHBondContact O-CG1 3.43Å; L219-I223 PolarHBondContact O-N 3.28Å; I223-M225 VanDerWaalsContact C-N 3.31Å; I223-M225 PolarHBondContact O-N 3.21Å; I223-V226 PolarHBondContact O-N 3.09Å; I223-T227 HydrophobicContact CG2-CG2 4.33Å; I223-T227 WeakPolarHBondContact O-CB 3.37Å; I223-T227 WeakPolarHBondContact O-CG2 3.19Å; I223-T227 PolarHBondContact O-N 3.39Å; I223-T227 PolarHBondContact O-OG1 3.49Å
224G89Confident88.8Confident7 Ų724.9 Ų24.97%0.07215%0.151CC..Hα-helixtrans-59.2-39.7177.600000112.9G220 G221 T222 T227 F228 N275G220-G224 PolarHBondContact O-N 2.62Å; G221-G224 PolarHBondContact O-N 3.49Å; T222-G224 VanDerWaalsContact C-N 3.28Å; T222-G224 PolarHBondContact O-N 2.8Å; G224-T227 PolarHBondContact O-OG1 3.11Å; G224-F228 VanDerWaalsContact O-CB 3.31Å; G224-F228 WeakPolarHBondContact O-CB 3.46Å; G224-F228 PolarHBondContact O-N 3.14Å; G224-N275 VanDerWaalsContact C-ND2 3.27Å; G224-N275 WeakPolarHBondContact CA-ND2 3.46Å; G224-N275 PolarHBondContact O-ND2 3Å; G224-N275 VanDerWaalsContact O-ND2 3.12Å
225M90.4Very high89.3Confident83 Ų8323.2 Ų23.241%0.40914%0.136SC..Hα-helixtrans-67.3-48177.5179.3171.976.900111.9G221 T222 I223 T227 F228 V272G221-M225 WeakPolarHBondContact O-CB 3.31Å; G221-M225 PolarHBondContact O-N 3.07Å; T222-M225 PolarHBondContact O-N 3.03Å; I223-M225 VanDerWaalsContact C-N 3.31Å; I223-M225 PolarHBondContact O-N 3.21Å; M225-T227 VanDerWaalsContact C-N 3.34Å; M225-T227 PolarHBondContact O-N 3.37Å; M225-F228 VanDerWaalsContact O-CB 3.28Å; M225-F228 WeakPolarHBondContact O-CB 3.49Å; M225-F228 PolarHBondContact O-N 3.28Å; M225-V272 HydrophobicContact CB-CG1 4.18Å; M225-V272 HydrophobicContact CG-CG1 3.63Å; M225-V272 HydrophobicContact SD-CG1 4.03Å
226V90.6Very high89.7Confident76 Ų7624.9 Ų24.946%0.46114%0.142SC..Hα-helixtrans-67-37.7-179.11780000111.5L185 T222 I223 F228L185-V226 HydrophobicContact CD1-CB 3.67Å; L185-V226 HydrophobicContact CD1-CG1 3.58Å; L185-V226 HydrophobicContact CD1-CG2 4.24Å; T222-V226 WeakPolarHBondContact O-CG2 3.33Å; T222-V226 PolarHBondContact O-N 2.94Å; I223-V226 PolarHBondContact O-N 3.09Å; V226-F228 VanDerWaalsContact C-N 3.29Å; V226-F228 PolarHBondContact O-N 2.64Å
227T91.5Very high90.3Very high8 Ų825.2 Ų25.25%0.04914%0.143CC..THydrogen-bonded Turntrans-83.2-4178.259.80000113.5A181 A182 I223 G224 M225 L230 N231A181-T227 HydrophobicContact CB-CG2 4.34Å; A182-T227 HydrophobicContact CB-CG2 4.26Å; I223-T227 HydrophobicContact CG2-CG2 4.33Å; I223-T227 WeakPolarHBondContact O-CB 3.37Å; I223-T227 WeakPolarHBondContact O-CG2 3.19Å; I223-T227 PolarHBondContact O-N 3.39Å; I223-T227 PolarHBondContact O-OG1 3.49Å; G224-T227 PolarHBondContact O-OG1 3.11Å; M225-T227 VanDerWaalsContact C-N 3.34Å; M225-T227 PolarHBondContact O-N 3.37Å; T227-L230 WeakPolarHBondContact O-CB 3.21Å; T227-L230 PolarHBondContact O-N 3.39Å; T227-N231 PolarHBondContact O-N 3.21Å; T227-N231 PolarHBondContact O-ND2 3.22Å
228F91.8Very high90.8Very high0 Ų025.2 Ų25.20%014%0.143CC..Hα-helixtrans-60.6-45.8-174.8-164.2-95.5000113.5I47 Q51 G224 M225 V226 L230 N231 V232 L268 R270 G271 V272 N275I47-F228 HydrophobicContact CG2-CE2 3.79Å; I47-F228 HydrophobicContact CG2-CZ 4.14Å; Q51-F228 HydrophobicContact CG-CE1 4.4Å; Q51-F228 HydrophobicContact CG-CE2 4.36Å; Q51-F228 HydrophobicContact CG-CZ 3.8Å; Q51-F228 VanDerWaalsContact NE2-CE2 3.28Å; G224-F228 VanDerWaalsContact O-CB 3.31Å; G224-F228 WeakPolarHBondContact O-CB 3.46Å; G224-F228 PolarHBondContact O-N 3.14Å; M225-F228 VanDerWaalsContact O-CB 3.28Å; M225-F228 WeakPolarHBondContact O-CB 3.49Å; M225-F228 PolarHBondContact O-N 3.28Å; V226-F228 VanDerWaalsContact C-N 3.29Å; V226-F228 PolarHBondContact O-N 2.64Å; F228-L230 VanDerWaalsContact C-N 3.26Å; F228-L230 PolarHBondContact O-N 2.68Å; F228-N231 WeakPolarHBondContact O-CA 3.14Å; F228-N231 WeakPolarHBondContact O-CB 2.87Å; F228-N231 PolarHBondContact O-N 2.99Å; F228-V232 HydrophobicContact CD1-CG2 3.98Å; F228-V232 HydrophobicContact CE1-CG2 3.73Å; F228-V232 HydrophobicContact CZ-CG2 4.45Å; F228-V232 WeakPolarHBondContact O-CG2 3.28Å; F228-V232 PolarHBondContact O-N 3.04Å; F228-L268 WeakPolarHBondContact CD1-O 3.46Å; F228-L268 WeakPolarHBondContact CE1-O 3.35Å; F228-R270 WeakPolarHBondContact CE1-O 3.21Å; F228-R270 VanDerWaalsContact CZ-O 3.26Å; F228-R270 WeakPolarHBondContact CZ-O 3.43Å; F228-G271 VanDerWaalsContact CZ-C 3.45Å; F228-V272 HydrophobicContact CB-CG2 3.85Å; F228-V272 HydrophobicContact CD1-CG2 3.45Å; F228-V272 VanDerWaalsContact CD1-CG2 3.45Å; F228-V272 HydrophobicContact CD2-CG2 4.26Å; F228-V272 HydrophobicContact CE1-CG2 4.02Å; F228-V272 HydrophobicContact CG-CG2 3.59Å; F228-N275 HydrophobicContact CD2-CB 3.77Å; F228-N275 HydrophobicContact CE2-CB 3.67Å
229P92.1Very high91Very high26 Ų2621.7 Ų21.717%0.16913%0.125CC..Hα-helixtrans-60.1-35.8176.5-24.736.2000112.8N231 V232 I233 L268 F269P229-N231 VanDerWaalsContact C-N 3.31Å; P229-N231 PolarHBondContact O-N 3.3Å; P229-V232 PolarHBondContact O-N 3.07Å; P229-I233 VanDerWaalsContact O-CG1 3.31Å; P229-I233 WeakPolarHBondContact O-CG1 3.19Å; P229-I233 PolarHBondContact O-N 2.99Å; P229-L268 HydrophobicContact CB-CB 4.39Å; P229-F269 HydrophobicContact CG-CD1 4.48Å; P229-F269 HydrophobicContact CG-CE1 3.86Å; P229-F269 HydrophobicContact CG-CZ 3.87Å
230L93.2Very high91.2Very high27 Ų2723.8 Ų23.814%0.14114%0.137CC..Hα-helixtrans-65.8-36.6175.3-62.3171.4000111.5V177 R178 A181 T227 F228 K234 F248V177-L230 HydrophobicContact CB-CD2 4.47Å; V177-L230 HydrophobicContact CG1-CD1 3.93Å; V177-L230 HydrophobicContact CG1-CD2 3.95Å; R178-L230 HydrophobicContact CB-CB 4.17Å; R178-L230 HydrophobicContact CB-CD1 4.2Å; A181-L230 HydrophobicContact CB-CD1 4.37Å; T227-L230 WeakPolarHBondContact O-CB 3.21Å; T227-L230 PolarHBondContact O-N 3.39Å; F228-L230 VanDerWaalsContact C-N 3.26Å; F228-L230 PolarHBondContact O-N 2.68Å; L230-K234 WeakPolarHBondContact O-CB 3.29Å; L230-K234 PolarHBondContact O-N 2.89Å; L230-F248 HydrophobicContact CD2-CE2 3.85Å; L230-F248 HydrophobicContact CD2-CZ 4.04Å
231N92.3Very high91.3Very high27 Ų2723.4 Ų23.414%0.14413%0.129CC..Hα-helixtrans-64.4-41.4172.7-70.2-40.8000111.6R178 T227 F228 P229 K234 T235R178-N231 WeakPolarHBondContact CD-OD1 3.15Å; T227-N231 PolarHBondContact O-N 3.21Å; T227-N231 PolarHBondContact O-ND2 3.22Å; F228-N231 WeakPolarHBondContact O-CA 3.14Å; F228-N231 WeakPolarHBondContact O-CB 2.87Å; F228-N231 PolarHBondContact O-N 2.99Å; P229-N231 VanDerWaalsContact C-N 3.31Å; P229-N231 PolarHBondContact O-N 3.3Å; N231-K234 PolarHBondContact O-N 2.94Å; N231-T235 WeakPolarHBondContact O-CB 3.48Å; N231-T235 PolarHBondContact O-N 3.42Å; N231-T235 PolarHBondContact O-OG1 3.42Å
232V92.1Very high91.1Very high4 Ų424 Ų242%0.02414%0.135CC..Hα-helixtrans-61.2-48.1177.3179.60000110.9Q51 F228 P229 T235 R236 L255 L268Q51-V232 HydrophobicContact CB-CG2 4.38Å; Q51-V232 HydrophobicContact CG-CG2 3.99Å; F228-V232 HydrophobicContact CD1-CG2 3.98Å; F228-V232 HydrophobicContact CE1-CG2 3.73Å; F228-V232 HydrophobicContact CZ-CG2 4.45Å; F228-V232 WeakPolarHBondContact O-CG2 3.28Å; F228-V232 PolarHBondContact O-N 3.04Å; P229-V232 PolarHBondContact O-N 3.07Å; V232-T235 PolarHBondContact O-N 3.5Å; V232-R236 WeakPolarHBondContact O-CB 3.46Å; V232-R236 PolarHBondContact O-N 3.34Å; V232-L255 HydrophobicContact CG1-CD1 4.05Å; V232-L255 HydrophobicContact CG1-CD2 4.36Å; V232-L268 HydrophobicContact CB-CD2 4.27Å; V232-L268 HydrophobicContact CG1-CD2 3.89Å
233I92.7Very high90.9Very high4 Ų424.6 Ų24.62%0.02115%0.152CC..Hα-helixtrans-61.2-47.9177.7-60.4162000110.5P174 P229 T235 R236 M237 F248 T251 L252 L255P174-I233 HydrophobicContact CB-CG2 4.3Å; P174-I233 HydrophobicContact CG-CG2 4.4Å; P229-I233 VanDerWaalsContact O-CG1 3.31Å; P229-I233 WeakPolarHBondContact O-CG1 3.19Å; P229-I233 PolarHBondContact O-N 2.99Å; I233-T235 PolarHBondContact O-N 3.4Å; I233-R236 PolarHBondContact O-N 3.4Å; I233-M237 HydrophobicContact CG2-CG 4.49Å; I233-M237 HydrophobicContact CG2-SD 3.97Å; I233-M237 WeakPolarHBondContact O-CG 3.47Å; I233-M237 PolarHBondContact O-N 3.29Å; I233-F248 HydrophobicContact CD1-CD2 4.44Å; I233-F248 HydrophobicContact CD1-CE2 3.62Å; I233-F248 HydrophobicContact CD1-CZ 3.66Å; I233-F248 HydrophobicContact CG2-CD2 3.93Å; I233-F248 HydrophobicContact CG2-CE2 4.1Å; I233-T251 HydrophobicContact CG2-CG2 4.2Å; I233-L252 HydrophobicContact CD1-CB 4.27Å; I233-L252 HydrophobicContact CD1-CD1 3.88Å; I233-L252 HydrophobicContact CD1-CG 4.49Å; I233-L252 HydrophobicContact CG1-CD1 4.28Å; I233-L255 HydrophobicContact CB-CD1 4.47Å; I233-L255 HydrophobicContact CG1-CD1 4.04Å
234K93.6Very high90.5Very high10 Ų1027.7 Ų27.74%0.04318%0.176CC..Hα-helixtrans-54.3-54175.8171.8-153.9144176.10110.7E134 P174 V175 L230 N231 R236 M237 Q238E134-K234 VanDerWaalsContact CD-NZ 3.31Å; E134-K234 IonicContact OE1-NZ 2.79Å; E134-K234 WeakPolarHBondContact OE2-CE 3.3Å; E134-K234 IonicContact OE2-NZ 3.13Å; E134-K234 PolarHBondContact OE2-NZ 3.47Å; P174-K234 HydrophobicContact CB-CB 4.09Å; P174-K234 HydrophobicContact CG-CB 3.94Å; V175-K234 HydrophobicContact CG2-CD 3.96Å; V175-K234 HydrophobicContact CG2-CG 3.86Å; L230-K234 WeakPolarHBondContact O-CB 3.29Å; L230-K234 PolarHBondContact O-N 2.89Å; N231-K234 PolarHBondContact O-N 2.94Å; K234-R236 VanDerWaalsContact C-N 3.3Å; K234-R236 PolarHBondContact O-N 3.02Å; K234-M237 PolarHBondContact O-N 3.16Å; K234-M237 VanDerWaalsContact O-N 3.12Å; K234-Q238 VanDerWaalsContact CE-CD 3.49Å; K234-Q238 HydrophobicContact CG-CG 4.36Å; K234-Q238 WeakPolarHBondContact O-CB 3.4Å; K234-Q238 WeakPolarHBondContact O-CG 3.24Å; K234-Q238 PolarHBondContact O-N 3.22Å
235T92.5Very high90.2Very high1 Ų132 Ų321%0.00619%0.193CC..Hα-helixtrans-62.3-40.2-175.5-55.30000110.5F48 Q51 L52 T138 N231 V232 I233 Q238 S239F48-T235 HydrophobicContact CD2-CG2 3.68Å; F48-T235 HydrophobicContact CE2-CG2 3.38Å; F48-T235 HydrophobicContact CZ-CG2 4.27Å; Q51-T235 PolarHBondContact OE1-OG1 3.02Å; L52-T235 HydrophobicContact CD1-CG2 4.19Å; L52-T235 HydrophobicContact CD2-CG2 3.61Å; L52-T235 HydrophobicContact CG-CG2 3.64Å; T138-T235 HydrophobicContact CG2-CG2 4.04Å; N231-T235 WeakPolarHBondContact O-CB 3.48Å; N231-T235 PolarHBondContact O-N 3.42Å; N231-T235 PolarHBondContact O-OG1 3.42Å; V232-T235 PolarHBondContact O-N 3.5Å; I233-T235 PolarHBondContact O-N 3.4Å; T235-Q238 CarbonylContact O-C 3.54Å; T235-Q238 PolarHBondContact O-N 3.02Å; T235-S239 WeakPolarHBondContact O-CB 3.43Å; T235-S239 PolarHBondContact O-N 3.33Å; T235-S239 PolarHBondContact O-OG 3.41Å
236R91.6Very high89.8Confident42 Ų4231.1 Ų31.116%0.15819%0.19CC..Hα-helixtrans-64-39173.8176.760.779.3124.210.2113.1V232 I233 K234 S239 T251 L255 E258V232-R236 WeakPolarHBondContact O-CB 3.46Å; V232-R236 PolarHBondContact O-N 3.34Å; I233-R236 PolarHBondContact O-N 3.4Å; K234-R236 VanDerWaalsContact C-N 3.3Å; K234-R236 PolarHBondContact O-N 3.02Å; R236-S239 PolarHBondContact O-OG 3.38Å; R236-T251 HydrophobicContact CB-CG2 4.01Å; R236-T251 HydrophobicContact CG-CG2 3.58Å; R236-L255 HydrophobicContact CB-CD1 4.08Å; R236-L255 HydrophobicContact CB-CD2 4.17Å; R236-L255 HydrophobicContact CB-CG 4.44Å; R236-L255 HydrophobicContact CG-CD1 4.32Å; R236-L255 HydrophobicContact CG-CD2 4.03Å; R236-L255 HydrophobicContact CG-CG 4.22Å; R236-E258 IonicContact CZ-OE1 3.35Å; R236-E258 VanDerWaalsContact CZ-OE1 3.24Å; R236-E258 IonicContact CZ-OE2 2.8Å; R236-E258 IonicContact NH1-OE1 3.36Å; R236-E258 PolarHBondContact NH1-OE1 3.41Å; R236-E258 IonicContact NH1-OE2 3.46Å; R236-E258 IonicContact NH2-OE1 3.62Å; R236-E258 PolarHBondContact NH2-OE1 3.5Å; R236-E258 IonicContact NH2-OE2 3.98Å; R236-E258 PolarHBondContact NH2-OE2 2.67Å
237M93.2Very high89.6Confident10 Ų1029 Ų295%0.04918%0.183CC..Hα-helixtrans-68.1-39.6174.8-67.4173.380.800111R170 P174 I233 K234 S239 N246 T251R170-M237 WeakPolarHBondContact CD-O 3.08Å; R170-M237 WeakPolarHBondContact CG-O 3.48Å; P174-M237 HydrophobicContact CG-SD 3.62Å; I233-M237 HydrophobicContact CG2-CG 4.49Å; I233-M237 HydrophobicContact CG2-SD 3.97Å; I233-M237 WeakPolarHBondContact O-CG 3.47Å; I233-M237 PolarHBondContact O-N 3.29Å; K234-M237 PolarHBondContact O-N 3.16Å; K234-M237 VanDerWaalsContact O-N 3.12Å; M237-S239 VanDerWaalsContact C-N 3.34Å; M237-N246 WeakPolarHBondContact CE-O 3.45Å; M237-T251 HydrophobicContact CG-CG2 3.85Å
238Q94.3Very high89.5Confident0 Ų031.5 Ų31.50%019%0.194CC..Hα-helixtrans-81-6.2-179.3-71.2-178.6-10.900114.1M131 R135 T138 R170 K234 T235M131-Q238 HydrophobicContact CE-CG 4.41Å; M131-Q238 VanDerWaalsContact CE-NE2 3.33Å; R135-Q238 PolarHBondContact NE-O 3.35Å; R135-Q238 VanDerWaalsContact NH2-C 3.33Å; R135-Q238 PolarHBondContact NH2-O 2.66Å; T138-Q238 VanDerWaalsContact CG2-C 3.44Å; T138-Q238 HydrophobicContact CG2-CB 3.81Å; T138-Q238 VanDerWaalsContact CG2-O 3.29Å; T138-Q238 WeakPolarHBondContact CG2-O 3.43Å; T138-Q238 PolarHBondContact OG1-OE1 3.17Å; R170-Q238 WeakPolarHBondContact O-CG 3.29Å; K234-Q238 VanDerWaalsContact CE-CD 3.49Å; K234-Q238 HydrophobicContact CG-CG 4.36Å; K234-Q238 WeakPolarHBondContact O-CB 3.4Å; K234-Q238 WeakPolarHBondContact O-CG 3.24Å; K234-Q238 PolarHBondContact O-N 3.22Å; T235-Q238 CarbonylContact O-C 3.54Å; T235-Q238 PolarHBondContact O-N 3.02Å
239S91.1Very high89.4Confident5 Ų541.2 Ų41.24%0.03523%0.23CC..THydrogen-bonded Turntrans-85.3-16.2173.560.80000113.2Y145 T235 R236 M237Y145-S239 WeakPolarHBondContact CE2-O 3.49Å; Y145-S239 PolarHBondContact OH-O 2.87Å; Y145-S239 VanDerWaalsContact OH-O 3.07Å; T235-S239 WeakPolarHBondContact O-CB 3.43Å; T235-S239 PolarHBondContact O-N 3.33Å; T235-S239 PolarHBondContact O-OG 3.41Å; R236-S239 PolarHBondContact O-OG 3.38Å; M237-S239 VanDerWaalsContact C-N 3.34Å
240N90.5Very high89.2Confident60 Ų6043.8 Ų43.832%0.32125%0.247SC..  trans-97.8125.3-175.7-65.2-11.6000111.2R135 R170R135-N240 PolarHBondContact NH1-O 2.81Å; R135-N240 VanDerWaalsContact NH1-O 3.1Å; R135-N240 PolarHBondContact NH2-O 2.98Å; R170-N240 VanDerWaalsContact CD-O 3.24Å; R170-N240 WeakPolarHBondContact CD-O 3.49Å; R170-N240 PolarHBondContact NE-O 3.37Å
241V88Confident89.1Confident22 Ų2242.6 Ų42.613%0.13324%0.241CC..  trans-106.1129.1176.6-1780000109.6L139 Y145 Y149L139-V241 HydrophobicContact CD1-CG2 3.74Å; L139-V241 HydrophobicContact CD2-CG2 3.44Å; L139-V241 VanDerWaalsContact CD2-CG2 3.44Å; L139-V241 HydrophobicContact CG-CG2 4.24Å; Y145-V241 HydrophobicContact CD1-CG2 4.21Å; Y145-V241 HydrophobicContact CE1-CB 3.86Å; Y145-V241 HydrophobicContact CE1-CG2 3.46Å; Y145-V241 VanDerWaalsContact CE1-CG2 3.46Å; Y145-V241 PolarHBondContact OH-N 2.97Å; Y145-V241 VanDerWaalsContact OH-N 3.11Å; Y149-V241 HydrophobicContact CE2-CG2 4.4Å
242G84.6Confident88.9Confident13 Ų1343.9 Ų43.913%0.13425%0.247CC..SBendtrans72.3-172.1-179.400000112.8E167 R170E167-G242 PolarHBondContact OE1-N 3.49Å; E167-G242 VanDerWaalsContact OE1-N 3.12Å; R170-G242 PolarHBondContact NH2-O 3.18Å
243G84.7Confident88.7Confident69 Ų6947.6 Ų47.671%0.71127%0.27SS*.SBendtrans64.6-165.7-174.800000114R170R170-G243 PolarHBondContact NH2-O 3.42Å
244S81.2Confident88.5Confident87 Ų8749.8 Ų49.861%0.60829%0.286SS*.  trans-62.5138.4-17755.50000112.1R170 N246R170-S244 PolarHBondContact NH1-O 3.34Å; S244-N246 VanDerWaalsContact C-N 3.34Å; S244-N246 PolarHBondContact O-N 2.89Å; S244-N246 PolarHBondContact OG-OD1 3.42Å; S244-N246 VanDerWaalsContact OG-OD1 3.12Å
245F83Confident88.2Confident99 Ų9949.6 Ų49.643%0.43429%0.285SS..  trans-73.490.8169.5-75.9-103.6000108.7K166 E167 R170 G247K166-F245 HydrophobicContact CG-CE1 4.44Å; K166-F245 HydrophobicContact CG-CZ 4.26Å; E167-F245 WeakPolarHBondContact OE2-CZ 3.39Å; R170-F245 HydrophobicContact CB-CD1 4.42Å; R170-F245 HydrophobicContact CB-CE1 4.12Å; R170-F245 HydrophobicContact CG-CD1 4.3Å; R170-F245 HydrophobicContact CG-CE1 4.43Å; F245-G247 PolarHBondContact O-N 3.48Å
246N81.8Confident87.9Confident63 Ų6350.5 Ų50.534%0.33729%0.29SS..  trans-61.9123.2173.6-64.3-14.5000108.3M237 S244 T251M237-N246 WeakPolarHBondContact CE-O 3.45Å; S244-N246 VanDerWaalsContact C-N 3.34Å; S244-N246 PolarHBondContact O-N 2.89Å; S244-N246 PolarHBondContact OG-OD1 3.42Å; S244-N246 VanDerWaalsContact OG-OD1 3.12Å; N246-T251 WeakPolarHBondContact CB-OG1 3.41Å
247G86Confident87.5Confident32 Ų3254.1 Ų54.133%0.3331%0.305SS..  trans-72.7170.7176.600000112.1F245 R249 P250 T251F245-G247 PolarHBondContact O-N 3.48Å; G247-R249 PolarHBondContact O-N 3.22Å; G247-P250 WeakPolarHBondContact O-CD 3.27Å; G247-T251 PolarHBondContact O-N 3.18Å; G247-T251 VanDerWaalsContact O-N 3.1Å; G247-T251 PolarHBondContact O-OG1 3.16Å
248F88.9Confident86.7Confident60 Ų6057.9 Ų57.926%0.26332%0.322SS..Hα-helixtrans-52.6-48.8178.7179.6-89.8000113.1P174 L230 I233 L252P174-F248 HydrophobicContact CB-CD2 3.99Å; P174-F248 HydrophobicContact CB-CE2 4.09Å; L230-F248 HydrophobicContact CD2-CE2 3.85Å; L230-F248 HydrophobicContact CD2-CZ 4.04Å; I233-F248 HydrophobicContact CD1-CD2 4.44Å; I233-F248 HydrophobicContact CD1-CE2 3.62Å; I233-F248 HydrophobicContact CD1-CZ 3.66Å; I233-F248 HydrophobicContact CG2-CD2 3.93Å; I233-F248 HydrophobicContact CG2-CE2 4.1Å; F248-L252 HydrophobicContact CE1-CD2 4.21Å; F248-L252 WeakPolarHBondContact O-CB 3.46Å; F248-L252 PolarHBondContact O-N 2.92Å
249R89.1Confident85.4Confident205 Ų20562.3 Ų62.377%0.77435%0.346SS*.Hα-helixtrans-66.6-52.1-177.6-68.9-176-177.7-177.80.5112.4G247 T251 L252 V253G247-R249 PolarHBondContact O-N 3.22Å; R249-T251 VanDerWaalsContact C-N 3.28Å; R249-T251 PolarHBondContact O-N 3.28Å; R249-L252 PolarHBondContact O-N 3Å; R249-V253 WeakPolarHBondContact O-CG2 3.5Å; R249-V253 PolarHBondContact O-N 2.91Å
250P89.5Confident84.3Confident79 Ų7965.1 Ų65.151%0.51337%0.365SS..Hα-helixtrans-54.6-41.6175.2-2833.4000113.5G247 V253 S254G247-P250 WeakPolarHBondContact O-CD 3.27Å; P250-V253 PolarHBondContact O-N 2.99Å; P250-S254 WeakPolarHBondContact O-CB 3.35Å; P250-S254 PolarHBondContact O-N 3.18Å; P250-S254 PolarHBondContact O-OG 3.08Å
251T89.5Confident83.4Confident2 Ų270.2 Ų70.21%0.01239%0.393CS..Hα-helixtrans-69.5-38.5178.8-58.30000112.8I233 R236 M237 N246 G247 R249 S254 L255I233-T251 HydrophobicContact CG2-CG2 4.2Å; R236-T251 HydrophobicContact CB-CG2 4.01Å; R236-T251 HydrophobicContact CG-CG2 3.58Å; M237-T251 HydrophobicContact CG-CG2 3.85Å; N246-T251 WeakPolarHBondContact CB-OG1 3.41Å; G247-T251 PolarHBondContact O-N 3.18Å; G247-T251 VanDerWaalsContact O-N 3.1Å; G247-T251 PolarHBondContact O-OG1 3.16Å; R249-T251 VanDerWaalsContact C-N 3.28Å; R249-T251 PolarHBondContact O-N 3.28Å; T251-S254 WeakPolarHBondContact CA-OG 3.31Å; T251-S254 PolarHBondContact O-N 3.43Å; T251-S254 PolarHBondContact O-OG 3.46Å; T251-L255 HydrophobicContact CG2-CD1 4.05Å; T251-L255 HydrophobicContact CG2-CG 4.45Å; T251-L255 WeakPolarHBondContact O-CB 3.3Å; T251-L255 VanDerWaalsContact O-CG 3.27Å; T251-L255 WeakPolarHBondContact O-CG 3.21Å; T251-L255 PolarHBondContact O-N 2.79Å
252L89.7Confident82.8Confident54 Ų5477.1 Ų77.128%0.28342%0.421SS..Hα-helixtrans-61.9-46.9173.917559.8000111I233 F248 R249 L255 V256 L268I233-L252 HydrophobicContact CD1-CB 4.27Å; I233-L252 HydrophobicContact CD1-CD1 3.88Å; I233-L252 HydrophobicContact CD1-CG 4.49Å; I233-L252 HydrophobicContact CG1-CD1 4.28Å; F248-L252 HydrophobicContact CE1-CD2 4.21Å; F248-L252 WeakPolarHBondContact O-CB 3.46Å; F248-L252 PolarHBondContact O-N 2.92Å; R249-L252 PolarHBondContact O-N 3Å; L252-L255 PolarHBondContact O-N 3.12Å; L252-V256 HydrophobicContact CD1-CG2 4.14Å; L252-V256 VanDerWaalsContact O-CG2 3.3Å; L252-V256 WeakPolarHBondContact O-CG2 3.39Å; L252-V256 PolarHBondContact O-N 3.31Å; L252-L268 HydrophobicContact CD1-CD1 3.9Å
253V88.2Confident82.4Confident82 Ų8280.2 Ų80.250%0.49744%0.439SS..Hα-helixtrans-61-48.3176.8174.30000109.9R249 P250 L255 V256 Y257R249-V253 WeakPolarHBondContact O-CG2 3.5Å; R249-V253 PolarHBondContact O-N 2.91Å; P250-V253 PolarHBondContact O-N 2.99Å; V253-L255 VanDerWaalsContact C-N 3.27Å; V253-L255 PolarHBondContact O-N 3.42Å; V253-V256 PolarHBondContact O-N 2.88Å; V253-V256 VanDerWaalsContact O-N 3.09Å; V253-Y257 HydrophobicContact CG1-CD2 3.75Å; V253-Y257 HydrophobicContact CG1-CE2 4.07Å; V253-Y257 VanDerWaalsContact O-CD2 3.31Å; V253-Y257 WeakPolarHBondContact O-CD2 3.08Å; V253-Y257 PolarHBondContact O-N 2.9Å
254S87.3Confident82.2Confident51 Ų5179.2 Ų79.236%0.35742%0.417SS..Hα-helixtrans-58.9-39.117969.80000112.2P250 T251 E258P250-S254 WeakPolarHBondContact O-CB 3.35Å; P250-S254 PolarHBondContact O-N 3.18Å; P250-S254 PolarHBondContact O-OG 3.08Å; T251-S254 WeakPolarHBondContact CA-OG 3.31Å; T251-S254 PolarHBondContact O-N 3.43Å; T251-S254 PolarHBondContact O-OG 3.46Å; S254-E258 VanDerWaalsContact O-CB 3.27Å; S254-E258 WeakPolarHBondContact O-CB 3.4Å; S254-E258 PolarHBondContact O-N 2.86Å
255L86.8Confident82.3Confident5 Ų579.8 Ų79.83%0.02641%0.412CS..Hα-helixtrans-68.6-33.3177.9-76.6167000113.4V232 I233 R236 T251 L252 V253 L268V232-L255 HydrophobicContact CG1-CD1 4.05Å; V232-L255 HydrophobicContact CG1-CD2 4.36Å; I233-L255 HydrophobicContact CB-CD1 4.47Å; I233-L255 HydrophobicContact CG1-CD1 4.04Å; R236-L255 HydrophobicContact CB-CD1 4.08Å; R236-L255 HydrophobicContact CB-CD2 4.17Å; R236-L255 HydrophobicContact CB-CG 4.44Å; R236-L255 HydrophobicContact CG-CD1 4.32Å; R236-L255 HydrophobicContact CG-CD2 4.03Å; R236-L255 HydrophobicContact CG-CG 4.22Å; T251-L255 HydrophobicContact CG2-CD1 4.05Å; T251-L255 HydrophobicContact CG2-CG 4.45Å; T251-L255 WeakPolarHBondContact O-CB 3.3Å; T251-L255 VanDerWaalsContact O-CG 3.27Å; T251-L255 WeakPolarHBondContact O-CG 3.21Å; T251-L255 PolarHBondContact O-N 2.79Å; L252-L255 PolarHBondContact O-N 3.12Å; V253-L255 VanDerWaalsContact C-N 3.27Å; V253-L255 PolarHBondContact O-N 3.42Å; L255-L268 HydrophobicContact CB-CD2 4.14Å; L255-L268 HydrophobicContact CD1-CD2 4.24Å
256V87.1Confident82.3Confident20 Ų2081 Ų8112%0.12142%0.423CS..Hα-helixtrans-76.4-30.1-179.6170.10000111.7L252 V253 P263 N264 I265 L268L252-V256 HydrophobicContact CD1-CG2 4.14Å; L252-V256 VanDerWaalsContact O-CG2 3.3Å; L252-V256 WeakPolarHBondContact O-CG2 3.39Å; L252-V256 PolarHBondContact O-N 3.31Å; V253-V256 PolarHBondContact O-N 2.88Å; V253-V256 VanDerWaalsContact O-N 3.09Å; V256-P263 HydrophobicContact CG1-CB 3.43Å; V256-P263 VanDerWaalsContact CG1-CB 3.43Å; V256-P263 WeakPolarHBondContact O-CA 3.18Å; V256-N264 PolarHBondContact O-N 2.65Å; V256-I265 HydrophobicContact CG1-CG2 4.33Å; V256-I265 HydrophobicContact CG2-CG2 4.5Å; V256-L268 HydrophobicContact CG2-CD1 4.04Å
257Y83.2Confident82.1Confident119 Ų11979 Ų7947%0.46741%0.41SS..Hα-helixtrans-1083.6-175.6-70.4-84.8000114.8V253 S260 P263V253-Y257 HydrophobicContact CG1-CD2 3.75Å; V253-Y257 HydrophobicContact CG1-CE2 4.07Å; V253-Y257 VanDerWaalsContact O-CD2 3.31Å; V253-Y257 WeakPolarHBondContact O-CD2 3.08Å; V253-Y257 PolarHBondContact O-N 2.9Å; Y257-S260 VanDerWaalsContact O-O 3.1Å; Y257-P263 HydrophobicContact CE1-CB 4.11Å; Y257-P263 HydrophobicContact CE1-CG 4.46Å
258E75.4Confident82.1Confident89 Ų8978 Ų7842%0.41640%0.398SS..SBendtrans-66.3-41.4-171.3-164.1174.2-139.800114.7R236 S254 R267R236-E258 IonicContact CZ-OE1 3.35Å; R236-E258 VanDerWaalsContact CZ-OE1 3.24Å; R236-E258 IonicContact CZ-OE2 2.8Å; R236-E258 IonicContact NH1-OE1 3.36Å; R236-E258 PolarHBondContact NH1-OE1 3.41Å; R236-E258 IonicContact NH1-OE2 3.46Å; R236-E258 IonicContact NH2-OE1 3.62Å; R236-E258 PolarHBondContact NH2-OE1 3.5Å; R236-E258 IonicContact NH2-OE2 3.98Å; R236-E258 PolarHBondContact NH2-OE2 2.67Å; S254-E258 VanDerWaalsContact O-CB 3.27Å; S254-E258 WeakPolarHBondContact O-CB 3.4Å; S254-E258 PolarHBondContact O-N 2.86Å; E258-R267 IonicContact OE2-CZ 3.78Å; E258-R267 IonicContact OE2-NH1 2.96Å; E258-R267 PolarHBondContact OE2-NH1 3.44Å; E258-R267 IonicContact OE2-NH2 2.82Å; E258-R267 PolarHBondContact OE2-NH2 2.84Å
259D68.7Low82Confident93 Ų9379.9 Ų79.950%0.49741%0.406SS..SBendtrans-90.5-14.8-172-69.1-31000113.6R267D259-R267 IonicContact OD1-CZ 2.98Å; D259-R267 IonicContact OD1-NH1 3.41Å; D259-R267 PolarHBondContact OD1-NH1 3.12Å; D259-R267 WeakPolarHBondContact OD2-CD 3.31Å; D259-R267 IonicContact OD2-CZ 3.7Å; D259-R267 IonicContact OD2-NE 3.95Å; D259-R267 IonicContact OD2-NH1 3.24Å; D259-R267 PolarHBondContact OD2-NH1 3.09Å
260S66.4Low81.7Confident63 Ų6375.2 Ų75.244%0.44139%0.388SS..  trans-159151-171-70.30000111.2Y257 K262Y257-S260 VanDerWaalsContact O-O 3.1Å; S260-K262 WeakPolarHBondContact CB-O 3.43Å; S260-K262 PolarHBondContact O-N 3.36Å
261D71.5Confident81.5Confident167 Ų16771.7 Ų71.789%0.89337%0.366SS*.SBendtrans-57.4-19.7166.2-66.7-40.7000112.6
262K75.9Confident81.4Confident168 Ų16872.4 Ų72.473%0.7337%0.371SS*.SBendtrans-95.3136.4177.4-64.1-178-177.4177.30111.3S260 N264S260-K262 WeakPolarHBondContact CB-O 3.43Å; S260-K262 PolarHBondContact O-N 3.36Å; K262-N264 PolarHBondContact O-N 2.89Å
263P76.6Confident81.3Confident78 Ų7874.1 Ų74.151%0.50639%0.385SS..  trans-63.3121.3179.226.5-34.2000111.1V256 Y257V256-P263 HydrophobicContact CG1-CB 3.43Å; V256-P263 VanDerWaalsContact CG1-CB 3.43Å; V256-P263 WeakPolarHBondContact O-CA 3.18Å; Y257-P263 HydrophobicContact CE1-CB 4.11Å; Y257-P263 HydrophobicContact CE1-CG 4.46Å
264N80.6Confident81.3Confident48 Ų4870.7 Ų70.726%0.25737%0.365SS..  trans-112.581.5178.5-172.3-0.2000111.8V256 K262 L266 R267V256-N264 PolarHBondContact O-N 2.65Å; K262-N264 PolarHBondContact O-N 2.89Å; N264-L266 PolarHBondContact O-N 3.49Å; N264-L266 WeakPolarHBondContact OD1-CB 3.45Å; N264-L266 PolarHBondContact OD1-N 2.94Å; N264-R267 PolarHBondContact O-N 2.68Å
265I83.4Confident81.4Confident98 Ų9868.5 Ų68.550%0.50335%0.35SS..G310 helixtrans-66.4-24.5178.867.2174.5000112.9V256 R267 L268 F269V256-I265 HydrophobicContact CG1-CG2 4.33Å; V256-I265 HydrophobicContact CG2-CG2 4.5Å; I265-R267 PolarHBondContact O-N 3.08Å; I265-R267 VanDerWaalsContact O-N 3.16Å; I265-L268 WeakPolarHBondContact O-CB 3.42Å; I265-L268 PolarHBondContact O-N 3.35Å; I265-F269 WeakPolarHBondContact O-CD2 3.2Å
266L81.9Confident81.5Confident126 Ų12671.7 Ų71.766%0.6636%0.363SS*.G310 helixtrans-61.6-26-179.4-84.668.3000111.5N264 L268 F269 R270N264-L266 PolarHBondContact O-N 3.49Å; N264-L266 WeakPolarHBondContact OD1-CB 3.45Å; N264-L266 PolarHBondContact OD1-N 2.94Å; L266-L268 VanDerWaalsContact C-N 3.28Å; L266-L268 PolarHBondContact O-N 3.44Å; L266-F269 PolarHBondContact O-N 2.96Å; L266-R270 PolarHBondContact O-N 3.49Å
267R79.2Confident81.5Confident19 Ų1974.5 Ų74.57%0.07238%0.377CS..G310 helixtrans-61.2-36.2174.3-176168.5172-163.4-12.8112.5E258 D259 N264 I265 F269 R270E258-R267 IonicContact OE2-CZ 3.78Å; E258-R267 IonicContact OE2-NH1 2.96Å; E258-R267 PolarHBondContact OE2-NH1 3.44Å; E258-R267 IonicContact OE2-NH2 2.82Å; E258-R267 PolarHBondContact OE2-NH2 2.84Å; D259-R267 IonicContact OD1-CZ 2.98Å; D259-R267 IonicContact OD1-NH1 3.41Å; D259-R267 PolarHBondContact OD1-NH1 3.12Å; D259-R267 WeakPolarHBondContact OD2-CD 3.31Å; D259-R267 IonicContact OD2-CZ 3.7Å; D259-R267 IonicContact OD2-NE 3.95Å; D259-R267 IonicContact OD2-NH1 3.24Å; D259-R267 PolarHBondContact OD2-NH1 3.09Å; N264-R267 PolarHBondContact O-N 2.68Å; I265-R267 PolarHBondContact O-N 3.08Å; I265-R267 VanDerWaalsContact O-N 3.16Å; R267-F269 PolarHBondContact O-N 3.13Å; R267-F269 VanDerWaalsContact O-N 3.12Å; R267-R270 WeakPolarHBondContact O-CB 3.29Å; R267-R270 PolarHBondContact O-N 2.93Å
268L84.9Confident81.8Confident12 Ų1271.2 Ų71.26%0.06336%0.364CS..G310 helixtrans-63.6-17.7176-63.5172.3000112.6F228 P229 V232 L252 L255 V256 I265 L266F228-L268 WeakPolarHBondContact CD1-O 3.46Å; F228-L268 WeakPolarHBondContact CE1-O 3.35Å; P229-L268 HydrophobicContact CB-CB 4.39Å; V232-L268 HydrophobicContact CB-CD2 4.27Å; V232-L268 HydrophobicContact CG1-CD2 3.89Å; L252-L268 HydrophobicContact CD1-CD1 3.9Å; L255-L268 HydrophobicContact CB-CD2 4.14Å; L255-L268 HydrophobicContact CD1-CD2 4.24Å; V256-L268 HydrophobicContact CG2-CD1 4.04Å; I265-L268 WeakPolarHBondContact O-CB 3.42Å; I265-L268 PolarHBondContact O-N 3.35Å; L266-L268 VanDerWaalsContact C-N 3.28Å; L266-L268 PolarHBondContact O-N 3.44Å
269F86.8Confident82.3Confident100 Ų10067.5 Ų67.544%0.43935%0.348SS..G310 helixtrans-104.32.2178.7-61.4-91.3000112.7P229 I265 L266 R267 G271 V272P229-F269 HydrophobicContact CG-CD1 4.48Å; P229-F269 HydrophobicContact CG-CE1 3.86Å; P229-F269 HydrophobicContact CG-CZ 3.87Å; I265-F269 WeakPolarHBondContact O-CD2 3.2Å; L266-F269 PolarHBondContact O-N 2.96Å; R267-F269 PolarHBondContact O-N 3.13Å; R267-F269 VanDerWaalsContact O-N 3.12Å; F269-G271 PolarHBondContact O-N 3.43Å; F269-G271 VanDerWaalsContact O-N 3.13Å; F269-V272 HydrophobicContact CB-CG2 4Å; F269-V272 HydrophobicContact CD1-CG2 4Å; F269-V272 HydrophobicContact CG-CG2 4.48Å; F269-V272 WeakPolarHBondContact O-CB 3.32Å; F269-V272 WeakPolarHBondContact O-CG2 3.48Å; F269-V272 PolarHBondContact O-N 2.91Å; F269-V272 VanDerWaalsContact O-N 3.08Å
270R83.3Confident83.2Confident107 Ų10764.8 Ų64.840%0.40433%0.334SS..THydrogen-bonded Turntrans-66.3113.4173-75.4-174.9-179.5175.34.9109.7G54 F228 L266 R267G54-R270 PolarHBondContact O-NH1 3.39Å; F228-R270 WeakPolarHBondContact CE1-O 3.21Å; F228-R270 VanDerWaalsContact CZ-O 3.26Å; F228-R270 WeakPolarHBondContact CZ-O 3.43Å; L266-R270 PolarHBondContact O-N 3.49Å; R267-R270 WeakPolarHBondContact O-CB 3.29Å; R267-R270 PolarHBondContact O-N 2.93Å
271G84.8Confident84.3Confident5 Ų567.6 Ų67.65%0.05234%0.339CS..THydrogen-bonded Turntrans105-1.4-176.800000114.5Q50 F228 F269 A274 N275Q50-G271 VanDerWaalsContact OE1-CA 3.25Å; F228-G271 VanDerWaalsContact CZ-C 3.45Å; F269-G271 PolarHBondContact O-N 3.43Å; F269-G271 VanDerWaalsContact O-N 3.13Å; G271-A274 PolarHBondContact O-N 3.34Å; G271-N275 WeakPolarHBondContact O-CB 3.34Å; G271-N275 PolarHBondContact O-N 3.08Å
272V88.2Confident85.1Confident17 Ų1760.3 Ų60.310%0.10330%0.301CS..Hα-helixtrans-55.3-47.8171.6166.70000112.6M225 F228 F269 A274 N275 F276M225-V272 HydrophobicContact CB-CG1 4.18Å; M225-V272 HydrophobicContact CG-CG1 3.63Å; M225-V272 HydrophobicContact SD-CG1 4.03Å; F228-V272 HydrophobicContact CB-CG2 3.85Å; F228-V272 HydrophobicContact CD1-CG2 3.45Å; F228-V272 VanDerWaalsContact CD1-CG2 3.45Å; F228-V272 HydrophobicContact CD2-CG2 4.26Å; F228-V272 HydrophobicContact CE1-CG2 4.02Å; F228-V272 HydrophobicContact CG-CG2 3.59Å; F269-V272 HydrophobicContact CB-CG2 4Å; F269-V272 HydrophobicContact CD1-CG2 4Å; F269-V272 HydrophobicContact CG-CG2 4.48Å; F269-V272 WeakPolarHBondContact O-CB 3.32Å; F269-V272 WeakPolarHBondContact O-CG2 3.48Å; F269-V272 PolarHBondContact O-N 2.91Å; F269-V272 VanDerWaalsContact O-N 3.08Å; V272-A274 PolarHBondContact O-N 3.2Å; V272-N275 PolarHBondContact O-N 2.85Å; V272-F276 WeakPolarHBondContact O-CB 3.3Å; V272-F276 PolarHBondContact O-N 2.79Å
273P88.1Confident85.5Confident90 Ų9053.1 Ų53.158%0.58427%0.269SS*.Hα-helixtrans-59.8-45.6178.8-2535.2000112.4N275 F276 I277P273-N275 VanDerWaalsContact C-N 3.33Å; P273-N275 PolarHBondContact O-N 3.43Å; P273-F276 PolarHBondContact O-N 3.31Å; P273-I277 VanDerWaalsContact O-CG1 3.3Å; P273-I277 WeakPolarHBondContact O-CG1 3.48Å; P273-I277 PolarHBondContact O-N 3.28Å
274A87.2Confident85.8Confident10 Ų1049.7 Ų49.78%0.08325%0.248CC..Hα-helixtrans-63.8-38.3177.200000111.9I47 G271 V272 R278I47-A274 HydrophobicContact CD1-CB 4.13Å; I47-A274 HydrophobicContact CG1-CB 3.64Å; G271-A274 PolarHBondContact O-N 3.34Å; V272-A274 PolarHBondContact O-N 3.2Å; A274-R278 VanDerWaalsContact O-CB 3.27Å; A274-R278 WeakPolarHBondContact O-CB 3.13Å; A274-R278 PolarHBondContact O-N 2.88Å
275N88.7Confident86.2Confident5 Ų549.5 Ų49.53%0.02725%0.247CC..Hα-helixtrans-69.1-35.8175.6-177.863000113.2I47 G224 F228 G271 V272 P273 R278 S279I47-N275 HydrophobicContact CD1-CB 4.23Å; I47-N275 HydrophobicContact CG2-CB 4.48Å; G224-N275 VanDerWaalsContact C-ND2 3.27Å; G224-N275 WeakPolarHBondContact CA-ND2 3.46Å; G224-N275 PolarHBondContact O-ND2 3Å; G224-N275 VanDerWaalsContact O-ND2 3.12Å; F228-N275 HydrophobicContact CD2-CB 3.77Å; F228-N275 HydrophobicContact CE2-CB 3.67Å; G271-N275 WeakPolarHBondContact O-CB 3.34Å; G271-N275 PolarHBondContact O-N 3.08Å; V272-N275 PolarHBondContact O-N 2.85Å; P273-N275 VanDerWaalsContact C-N 3.33Å; P273-N275 PolarHBondContact O-N 3.43Å; N275-R278 PolarHBondContact OD1-NE 2.87Å; N275-R278 PolarHBondContact OD1-NH2 3.01Å; N275-S279 WeakPolarHBondContact O-CB 3.34Å; N275-S279 PolarHBondContact O-N 3.37Å; N275-S279 PolarHBondContact O-OG 2.94Å
276F89.1Confident86.4Confident71 Ų7144.9 Ų44.931%0.31122%0.223SC..Hα-helixtrans-63-52.4173.3-172.8-85.6000110.1G221 V272 P273 R278 S279 V280G221-F276 VanDerWaalsContact C-CD2 3.44Å; G221-F276 VanDerWaalsContact CA-CD2 3.44Å; V272-F276 WeakPolarHBondContact O-CB 3.3Å; V272-F276 PolarHBondContact O-N 2.79Å; P273-F276 PolarHBondContact O-N 3.31Å; F276-R278 VanDerWaalsContact C-N 3.35Å; F276-R278 PolarHBondContact O-N 2.95Å; F276-S279 WeakPolarHBondContact O-CB 3.27Å; F276-S279 PolarHBondContact O-N 2.92Å; F276-V280 HydrophobicContact CD1-CG2 4.07Å; F276-V280 HydrophobicContact CE1-CG2 3.74Å; F276-V280 HydrophobicContact CZ-CG2 4.32Å; F276-V280 WeakPolarHBondContact O-CG2 3.18Å; F276-V280 PolarHBondContact O-N 3.31Å
277I88.7Confident86.4Confident80 Ų8039.5 Ų39.541%0.4120%0.195SC..Hα-helixtrans-53.6-51.7175.2-70.3169.4000110.4P273 S279 V280 F281P273-I277 VanDerWaalsContact O-CG1 3.3Å; P273-I277 WeakPolarHBondContact O-CG1 3.48Å; P273-I277 PolarHBondContact O-N 3.28Å; I277-S279 VanDerWaalsContact C-N 3.26Å; I277-S279 PolarHBondContact O-N 3.15Å; I277-V280 PolarHBondContact O-N 3.4Å; I277-F281 HydrophobicContact CG2-CD2 3.54Å; I277-F281 HydrophobicContact CG2-CE2 3.61Å; I277-F281 VanDerWaalsContact O-CD2 3.29Å; I277-F281 WeakPolarHBondContact O-CD2 3.34Å; I277-F281 PolarHBondContact O-N 3.42Å
278R88Confident86.7Confident49 Ų4945.1 Ų45.119%0.18522%0.224CC..Hα-helixtrans-54.1-42.6176.8-176.3-158.660.870.35.5111.9L40 L43 I47 A274 N275 F276 S282L40-R278 HydrophobicContact CD1-CG 4.46Å; L43-R278 HydrophobicContact CD2-CB 3.84Å; L43-R278 HydrophobicContact CD2-CG 4.21Å; L43-R278 HydrophobicContact CG-CB 4.37Å; I47-R278 HydrophobicContact CD1-CB 3.97Å; I47-R278 HydrophobicContact CD1-CG 4.39Å; A274-R278 VanDerWaalsContact O-CB 3.27Å; A274-R278 WeakPolarHBondContact O-CB 3.13Å; A274-R278 PolarHBondContact O-N 2.88Å; N275-R278 PolarHBondContact OD1-NE 2.87Å; N275-R278 PolarHBondContact OD1-NH2 3.01Å; F276-R278 VanDerWaalsContact C-N 3.35Å; F276-R278 PolarHBondContact O-N 2.95Å; R278-S282 WeakPolarHBondContact O-CB 3.5Å; R278-S282 PolarHBondContact O-N 3.42Å
279S86.8Confident86.8Confident12 Ų1245.8 Ų45.88%0.08423%0.229CC..Hα-helixtrans-67.8-42.1-178.1-55.90000111.6N275 F276 I277 S282 W283N275-S279 WeakPolarHBondContact O-CB 3.34Å; N275-S279 PolarHBondContact O-N 3.37Å; N275-S279 PolarHBondContact O-OG 2.94Å; F276-S279 WeakPolarHBondContact O-CB 3.27Å; F276-S279 PolarHBondContact O-N 2.92Å; I277-S279 VanDerWaalsContact C-N 3.26Å; I277-S279 PolarHBondContact O-N 3.15Å; S279-S282 PolarHBondContact O-N 2.83Å; S279-W283 WeakPolarHBondContact O-CB 3.44Å; S279-W283 PolarHBondContact O-N 3.37Å
280V86.8Confident86.8Confident36 Ų3641.5 Ų41.522%0.21821%0.21CC..Hα-helixtrans-62.2-47.9174.8175.60000111.2F213 F276 I277 S282 W283 G284F213-V280 HydrophobicContact CZ-CG1 4.05Å; F276-V280 HydrophobicContact CD1-CG2 4.07Å; F276-V280 HydrophobicContact CE1-CG2 3.74Å; F276-V280 HydrophobicContact CZ-CG2 4.32Å; F276-V280 WeakPolarHBondContact O-CG2 3.18Å; F276-V280 PolarHBondContact O-N 3.31Å; I277-V280 PolarHBondContact O-N 3.4Å; V280-S282 PolarHBondContact O-N 3.46Å; V280-W283 WeakPolarHBondContact O-CB 3.04Å; V280-W283 PolarHBondContact O-N 3.46Å; V280-G284 PolarHBondContact O-N 2.96Å
281F89.4Confident86.8Confident121 Ų12138.2 Ų38.253%0.53120%0.199SC..Hα-helixtrans-65.9-38.5177.6-83.9-75.4000112.7L40 I277 W283 G284 L285L40-F281 HydrophobicContact CD1-CB 4.19Å; L40-F281 HydrophobicContact CD2-CB 4.02Å; I277-F281 HydrophobicContact CG2-CD2 3.54Å; I277-F281 HydrophobicContact CG2-CE2 3.61Å; I277-F281 VanDerWaalsContact O-CD2 3.29Å; I277-F281 WeakPolarHBondContact O-CD2 3.34Å; I277-F281 PolarHBondContact O-N 3.42Å; F281-W283 VanDerWaalsContact C-N 3.31Å; F281-W283 PolarHBondContact O-N 3.27Å; F281-G284 PolarHBondContact O-N 3.22Å; F281-L285 WeakPolarHBondContact O-CG 3.49Å; F281-L285 PolarHBondContact O-N 3.23Å
282S88.1Confident86.9Confident14 Ų1443.8 Ų43.810%0.09822%0.222CC..Hα-helixtrans-61.6-45.4178.9-172.30000110.3S36 L40 R278 S279 V280 G284 L285 I286S36-S282 WeakPolarHBondContact OG-CA 3.25Å; S36-S282 PolarHBondContact OG-O 3.01Å; S36-S282 PolarHBondContact OG-OG 2.99Å; L40-S282 VanDerWaalsContact CD1-CB 3.5Å; R278-S282 WeakPolarHBondContact O-CB 3.5Å; R278-S282 PolarHBondContact O-N 3.42Å; S279-S282 PolarHBondContact O-N 2.83Å; V280-S282 PolarHBondContact O-N 3.46Å; S282-G284 VanDerWaalsContact C-N 3.33Å; S282-G284 PolarHBondContact O-N 3.29Å; S282-L285 PolarHBondContact O-N 3.35Å; S282-I286 VanDerWaalsContact O-CD1 3.28Å; S282-I286 WeakPolarHBondContact O-CD1 3.41Å; S282-I286 WeakPolarHBondContact O-CG1 3.24Å; S282-I286 PolarHBondContact O-N 3.19Å
283W84.1Confident86.9Confident17 Ų1744.9 Ų44.96%0.06423%0.227CC..Hα-helixtrans-52.6-50.5173.6-173.1-110.2000111.8E4 I7 A8 N212 F213 G217 S279 V280 F281 I286 T287E4-W283 HydrophobicContact CB-CZ3 3.98Å; E4-W283 HydrophobicContact CG-CZ3 4.47Å; E4-W283 VanDerWaalsContact O-CH2 3.29Å; E4-W283 WeakPolarHBondContact O-CH2 3.4Å; E4-W283 WeakPolarHBondContact O-CZ3 3.37Å; I7-W283 HydrophobicContact CB-CH2 3.36Å; I7-W283 HydrophobicContact CB-CZ2 3.95Å; I7-W283 HydrophobicContact CB-CZ3 4.21Å; I7-W283 HydrophobicContact CG2-CH2 3.27Å; I7-W283 HydrophobicContact CG2-CZ2 3.28Å; I7-W283 HydrophobicContact CG2-CZ3 4.37Å; A8-W283 HydrophobicContact CB-CH2 4.32Å; N212-W283 PolarHBondContact O-NE1 2.99Å; F213-W283 AromaticContact CD2-CD1 3.64Å; F213-W283 PolarHBondContact O-NE1 3.49Å; G217-W283 VanDerWaalsContact N-CD1 3.28Å; S279-W283 WeakPolarHBondContact O-CB 3.44Å; S279-W283 PolarHBondContact O-N 3.37Å; V280-W283 WeakPolarHBondContact O-CB 3.04Å; V280-W283 PolarHBondContact O-N 3.46Å; F281-W283 VanDerWaalsContact C-N 3.31Å; F281-W283 PolarHBondContact O-N 3.27Å; W283-I286 PolarHBondContact O-N 3.41Å; W283-T287 PolarHBondContact O-N 3.05Å; W283-T287 PolarHBondContact O-OG1 3.13Å
284G84.2Confident86.7Confident6 Ų642.3 Ų42.36%0.06221%0.208CC..Hα-helixtrans-64-47.1-178.200000113.3F213 V280 F281 S282 I286 T287 M288F213-G284 VanDerWaalsContact CD2-CA 3.47Å; F213-G284 VanDerWaalsContact CE2-N 3.35Å; V280-G284 PolarHBondContact O-N 2.96Å; F281-G284 PolarHBondContact O-N 3.22Å; S282-G284 VanDerWaalsContact C-N 3.33Å; S282-G284 PolarHBondContact O-N 3.29Å; G284-I286 VanDerWaalsContact C-N 3.31Å; G284-I286 PolarHBondContact O-N 3.35Å; G284-T287 PolarHBondContact O-N 3.39Å; G284-M288 VanDerWaalsContact O-CB 3.29Å; G284-M288 WeakPolarHBondContact O-CB 3.26Å; G284-M288 WeakPolarHBondContact O-CG 3.45Å; G284-M288 PolarHBondContact O-N 2.9Å
285L88.5Confident86.5Confident44 Ų4447.1 Ų47.123%0.2323%0.229CC..Hα-helixtrans-61.6-40.3178.1-72.5171000112V39 L40 F281 S282 T289V39-L285 HydrophobicContact CB-CD1 3.97Å; V39-L285 HydrophobicContact CG1-CD1 3.64Å; L40-L285 HydrophobicContact CD1-CD1 3.96Å; L40-L285 HydrophobicContact CD2-CD1 3.98Å; L40-L285 HydrophobicContact CG-CD1 3.74Å; F281-L285 WeakPolarHBondContact O-CG 3.49Å; F281-L285 PolarHBondContact O-N 3.23Å; S282-L285 PolarHBondContact O-N 3.35Å; L285-T289 WeakPolarHBondContact O-CB 3.4Å; L285-T289 PolarHBondContact O-N 3.41Å; L285-T289 PolarHBondContact O-OG1 3.45Å
286I86.9Confident86.4Confident2 Ų249.5 Ų49.51%0.0124%0.241CC..Hα-helixtrans-63.7-52.4177.8-68.2158.4000109.7A32 Y33 S282 W283 G284 T289 F290A32-I286 HydrophobicContact CB-CG2 4.34Å; Y33-I286 HydrophobicContact CD1-CD1 3.66Å; Y33-I286 HydrophobicContact CD1-CG1 4.07Å; Y33-I286 HydrophobicContact CE1-CD1 3.26Å; Y33-I286 HydrophobicContact CE1-CG1 3.98Å; Y33-I286 HydrophobicContact CE1-CG2 4.41Å; Y33-I286 HydrophobicContact CE2-CG2 4.13Å; S282-I286 VanDerWaalsContact O-CD1 3.28Å; S282-I286 WeakPolarHBondContact O-CD1 3.41Å; S282-I286 WeakPolarHBondContact O-CG1 3.24Å; S282-I286 PolarHBondContact O-N 3.19Å; W283-I286 PolarHBondContact O-N 3.41Å; G284-I286 VanDerWaalsContact C-N 3.31Å; G284-I286 PolarHBondContact O-N 3.35Å; I286-T289 PolarHBondContact O-N 3Å; I286-F290 WeakPolarHBondContact O-CB 3.33Å; I286-F290 PolarHBondContact O-N 3.07Å
287T82.4Confident86.2Confident12 Ų1247.5 Ų47.57%0.07423%0.234CC..Hα-helixtrans-61.7-48.4-178.5-60.40000111.7W283 G284 T289 F290 H291W283-T287 PolarHBondContact O-N 3.05Å; W283-T287 PolarHBondContact O-OG1 3.13Å; G284-T287 PolarHBondContact O-N 3.39Å; T287-T289 PolarHBondContact O-N 3.19Å; T287-F290 PolarHBondContact O-N 3.05Å; T287-H291 PolarHBondContact O-CD2 2.88Å; T287-H291 PolarHBondContact O-N 3.28Å
288M85.6Confident85.8Confident138 Ų13845.7 Ų45.768%0.6823%0.228SC*.Hα-helixtrans-61-46.7178.7-70.7177.472.900111.9G284 F290 H291 F292G284-M288 VanDerWaalsContact O-CB 3.29Å; G284-M288 WeakPolarHBondContact O-CB 3.26Å; G284-M288 WeakPolarHBondContact O-CG 3.45Å; G284-M288 PolarHBondContact O-N 2.9Å; M288-F290 VanDerWaalsContact C-N 3.34Å; M288-F290 PolarHBondContact O-N 2.97Å; M288-H291 PolarHBondContact O-N 3.47Å; M288-F292 VanDerWaalsContact O-CB 3.26Å; M288-F292 WeakPolarHBondContact O-CB 3.41Å; M288-F292 PolarHBondContact O-N 2.98Å
289T88Confident85.4Confident25 Ų2550.3 Ų50.315%0.15325%0.254CS..Hα-helixtrans-66.2-40.1-179.6-53.90000111A32 V35 L285 I286 T287 F292 L293A32-T289 HydrophobicContact CB-CG2 3.93Å; V35-T289 HydrophobicContact CB-CG2 4.27Å; V35-T289 HydrophobicContact CG2-CG2 4.14Å; L285-T289 WeakPolarHBondContact O-CB 3.4Å; L285-T289 PolarHBondContact O-N 3.41Å; L285-T289 PolarHBondContact O-OG1 3.45Å; I286-T289 PolarHBondContact O-N 3Å; T287-T289 PolarHBondContact O-N 3.19Å; T289-F292 PolarHBondContact O-N 3Å; T289-L293 HydrophobicContact CG2-CD1 4.11Å; T289-L293 HydrophobicContact CG2-CG 4.43Å; T289-L293 WeakPolarHBondContact O-CB 3.46Å; T289-L293 VanDerWaalsContact O-CG 3.25Å; T289-L293 WeakPolarHBondContact O-CG 3.42Å; T289-L293 PolarHBondContact O-N 3.43Å
290F85.5Confident84.9Confident10 Ų1056.1 Ų56.14%0.04428%0.283CS..Hα-helixtrans-63-48.3178.2-178.7-104.5000112F9 F28 A32 I286 T287 M288 L293 L294F9-F290 HydrophobicContact CD1-CE1 4.39Å; F9-F290 AromaticContact CD1-CZ 3.92Å; F9-F290 HydrophobicContact CD1-CZ 3.92Å; F9-F290 HydrophobicContact CE1-CE1 4.47Å; F9-F290 HydrophobicContact CE1-CE2 4.24Å; F9-F290 AromaticContact CE1-CZ 3.59Å; F9-F290 HydrophobicContact CE1-CZ 3.59Å; F9-F290 HydrophobicContact CZ-CZ 4.28Å; F28-F290 HydrophobicContact CB-CD2 3.84Å; F28-F290 HydrophobicContact CB-CE2 3.88Å; A32-F290 HydrophobicContact CB-CB 4.17Å; I286-F290 WeakPolarHBondContact O-CB 3.33Å; I286-F290 PolarHBondContact O-N 3.07Å; T287-F290 PolarHBondContact O-N 3.05Å; M288-F290 VanDerWaalsContact C-N 3.34Å; M288-F290 PolarHBondContact O-N 2.97Å; F290-L293 PolarHBondContact O-N 3.4Å; F290-L294 HydrophobicContact CD1-CD1 3.8Å; F290-L294 HydrophobicContact CD1-CG 4.49Å; F290-L294 HydrophobicContact CE1-CD1 3.35Å; F290-L294 HydrophobicContact CE1-CG 4.17Å; F290-L294 HydrophobicContact CZ-CD1 3.81Å; F290-L294 HydrophobicContact CZ-CD2 4.42Å; F290-L294 HydrophobicContact CZ-CG 4.25Å; F290-L294 WeakPolarHBondContact O-CG 3.45Å; F290-L294 PolarHBondContact O-N 2.98Å
291H83.2Confident83.8Confident38 Ų3860.7 Ų60.718%0.17631%0.314CS..Hα-helixtrans-63.5-41.9176.9-76.5-65.7000112.2T287 M288 L293 L294 E295T287-H291 PolarHBondContact O-CD2 2.88Å; T287-H291 PolarHBondContact O-N 3.28Å; M288-H291 PolarHBondContact O-N 3.47Å; H291-L293 VanDerWaalsContact C-N 3.31Å; H291-L293 PolarHBondContact O-N 3.09Å; H291-L294 WeakPolarHBondContact O-CB 3.47Å; H291-L294 PolarHBondContact O-N 3.32Å; H291-L294 VanDerWaalsContact O-N 3.16Å; H291-E295 WeakPolarHBondContact O-CG 3.2Å; H291-E295 PolarHBondContact O-N 3.16Å
292F87.6Confident83.6Confident122 Ų12257.7 Ų57.754%0.53530%0.304SS..Hα-helixtrans-59.3-41.1175.6179.2-109.5000112.5M288 T289 E295 I296M288-F292 VanDerWaalsContact O-CB 3.26Å; M288-F292 WeakPolarHBondContact O-CB 3.41Å; M288-F292 PolarHBondContact O-N 2.98Å; T289-F292 PolarHBondContact O-N 3Å; F292-E295 PolarHBondContact O-N 3.15Å; F292-I296 HydrophobicContact CD1-CD1 3.75Å; F292-I296 HydrophobicContact CD2-CD1 4.43Å; F292-I296 HydrophobicContact CE1-CD1 3.25Å; F292-I296 HydrophobicContact CE1-CG1 4.41Å; F292-I296 HydrophobicContact CE2-CD1 4.01Å; F292-I296 HydrophobicContact CE2-CG1 4.44Å; F292-I296 HydrophobicContact CG-CD1 4.33Å; F292-I296 HydrophobicContact CZ-CD1 3.42Å; F292-I296 VanDerWaalsContact CZ-CD1 3.42Å; F292-I296 HydrophobicContact CZ-CG1 4.29Å; F292-I296 WeakPolarHBondContact O-CG1 3.46Å; F292-I296 PolarHBondContact O-N 3.29Å
293L87.4Confident83.3Confident40 Ų4059.9 Ų59.921%0.20931%0.314CS..Hα-helixtrans-68.1-37.1176.1-70.5173000112.5F28 A31 T289 F290 H291 N297F28-L293 HydrophobicContact CB-CB 4.08Å; F28-L293 HydrophobicContact CB-CD1 4.05Å; F28-L293 HydrophobicContact CD1-CB 3.94Å; F28-L293 HydrophobicContact CD1-CD1 4.23Å; F28-L293 HydrophobicContact CD2-CB 4.39Å; F28-L293 HydrophobicContact CG-CB 3.88Å; F28-L293 HydrophobicContact CG-CD1 4.42Å; A31-L293 HydrophobicContact CB-CD1 3.7Å; T289-L293 HydrophobicContact CG2-CD1 4.11Å; T289-L293 HydrophobicContact CG2-CG 4.43Å; T289-L293 WeakPolarHBondContact O-CB 3.46Å; T289-L293 VanDerWaalsContact O-CG 3.25Å; T289-L293 WeakPolarHBondContact O-CG 3.42Å; T289-L293 PolarHBondContact O-N 3.43Å; F290-L293 PolarHBondContact O-N 3.4Å; H291-L293 VanDerWaalsContact C-N 3.31Å; H291-L293 PolarHBondContact O-N 3.09Å; L293-N297 WeakPolarHBondContact O-CB 3.34Å; L293-N297 PolarHBondContact O-N 3.28Å
294L84Confident83.3Confident37 Ų3762.3 Ų62.319%0.19433%0.328CS..Hα-helixtrans-63.5-44.5173.3-73.3174000111.8N20 F28 F290 H291 N297 S298N20-L294 WeakPolarHBondContact ND2-CD2 3.29Å; F28-L294 HydrophobicContact CD2-CD2 3.78Å; F28-L294 HydrophobicContact CD2-CG 4.31Å; F28-L294 HydrophobicContact CE2-CD2 4.07Å; F290-L294 HydrophobicContact CD1-CD1 3.8Å; F290-L294 HydrophobicContact CD1-CG 4.49Å; F290-L294 HydrophobicContact CE1-CD1 3.35Å; F290-L294 HydrophobicContact CE1-CG 4.17Å; F290-L294 HydrophobicContact CZ-CD1 3.81Å; F290-L294 HydrophobicContact CZ-CD2 4.42Å; F290-L294 HydrophobicContact CZ-CG 4.25Å; F290-L294 WeakPolarHBondContact O-CG 3.45Å; F290-L294 PolarHBondContact O-N 2.98Å; H291-L294 WeakPolarHBondContact O-CB 3.47Å; H291-L294 PolarHBondContact O-N 3.32Å; H291-L294 VanDerWaalsContact O-N 3.16Å; L294-N297 PolarHBondContact O-N 3.18Å; L294-S298 WeakPolarHBondContact O-CB 3.36Å; L294-S298 PolarHBondContact O-N 3.4Å; L294-S298 PolarHBondContact O-OG 3.29Å
295E83.8Confident83.2Confident111 Ų11165.6 Ų65.652%0.51934%0.344SS..Hα-helixtrans-60.9-47.8176.9-75.2172.3-168.200111H291 F292 N297 S298 M299H291-E295 WeakPolarHBondContact O-CG 3.2Å; H291-E295 PolarHBondContact O-N 3.16Å; F292-E295 PolarHBondContact O-N 3.15Å; E295-N297 VanDerWaalsContact C-N 3.33Å; E295-N297 PolarHBondContact O-N 3.07Å; E295-S298 WeakPolarHBondContact CA-OG 3.14Å; E295-S298 PolarHBondContact O-N 3.18Å; E295-S298 PolarHBondContact O-OG 3.43Å; E295-M299 WeakPolarHBondContact O-CG 3.45Å; E295-M299 PolarHBondContact O-N 3.2Å
296I87.1Confident82.9Confident55 Ų5567 Ų6728%0.28235%0.351SS..Hα-helixtrans-56.7-47.4174.6-72.5170.9000111.1F292 S298 M299 I300F292-I296 HydrophobicContact CD1-CD1 3.75Å; F292-I296 HydrophobicContact CD2-CD1 4.43Å; F292-I296 HydrophobicContact CE1-CD1 3.25Å; F292-I296 HydrophobicContact CE1-CG1 4.41Å; F292-I296 HydrophobicContact CE2-CD1 4.01Å; F292-I296 HydrophobicContact CE2-CG1 4.44Å; F292-I296 HydrophobicContact CG-CD1 4.33Å; F292-I296 HydrophobicContact CZ-CD1 3.42Å; F292-I296 VanDerWaalsContact CZ-CD1 3.42Å; F292-I296 HydrophobicContact CZ-CG1 4.29Å; F292-I296 WeakPolarHBondContact O-CG1 3.46Å; F292-I296 PolarHBondContact O-N 3.29Å; I296-S298 VanDerWaalsContact C-N 3.29Å; I296-S298 PolarHBondContact O-N 2.9Å; I296-M299 HydrophobicContact CG1-CE 4.17Å; I296-M299 PolarHBondContact O-N 3.48Å; I296-I300 HydrophobicContact CG2-CD1 3.7Å; I296-I300 WeakPolarHBondContact O-CG1 3.3Å; I296-I300 PolarHBondContact O-N 3.02Å
297N84.9Confident82.6Confident28 Ų2871.3 Ų71.315%0.1537%0.374CS..Hα-helixtrans-62.3-39.3179.7-16975000111.9N20 F28 L293 L294 E295 M299 I300 C301N20-N297 PolarHBondContact OD1-ND2 3.23Å; F28-N297 HydrophobicContact CE2-CB 3.83Å; F28-N297 HydrophobicContact CZ-CB 3.62Å; L293-N297 WeakPolarHBondContact O-CB 3.34Å; L293-N297 PolarHBondContact O-N 3.28Å; L294-N297 PolarHBondContact O-N 3.18Å; E295-N297 VanDerWaalsContact C-N 3.33Å; E295-N297 PolarHBondContact O-N 3.07Å; N297-M299 VanDerWaalsContact C-N 3.3Å; N297-M299 PolarHBondContact O-N 3.23Å; N297-I300 PolarHBondContact O-N 2.7Å; N297-C301 PolarHBondContact O-N 2.76Å; N297-C301 VanDerWaalsContact O-N 3.07Å
298S79.5Confident82.6Confident43 Ų4375.6 Ų75.630%0.30140%0.395SS..Hα-helixtrans-69.6-23.7177.873.40000114.2L294 E295 I296L294-S298 WeakPolarHBondContact O-CB 3.36Å; L294-S298 PolarHBondContact O-N 3.4Å; L294-S298 PolarHBondContact O-OG 3.29Å; E295-S298 WeakPolarHBondContact CA-OG 3.14Å; E295-S298 PolarHBondContact O-N 3.18Å; E295-S298 PolarHBondContact O-OG 3.43Å; I296-S298 VanDerWaalsContact C-N 3.29Å; I296-S298 PolarHBondContact O-N 2.9Å
299M79.1Confident82.4Confident146 Ų14670.8 Ų70.872%0.71937%0.373SS*.Hα-helixtrans-80.2-23.8173.5-71.5-174.5-71.900112.4E295 I296 N297E295-M299 WeakPolarHBondContact O-CG 3.45Å; E295-M299 PolarHBondContact O-N 3.2Å; I296-M299 HydrophobicContact CG1-CE 4.17Å; I296-M299 PolarHBondContact O-N 3.48Å; N297-M299 VanDerWaalsContact C-N 3.3Å; N297-M299 PolarHBondContact O-N 3.23Å
300I76.5Confident81.9Confident134 Ų13474.6 Ų74.669%0.68739%0.392SS*.Hα-helixtrans-89.7-30.8-178.2-65.1168.6000111.8I296 N297I296-I300 HydrophobicContact CG2-CD1 3.7Å; I296-I300 WeakPolarHBondContact O-CG1 3.3Å; I296-I300 PolarHBondContact O-N 3.02Å; N297-I300 PolarHBondContact O-N 2.7Å
301C64.9Low81.6Confident131 Ų13180.5 Ų80.589%0.88542%0.423SS*.  trans-104.50-176-70.10000113.7N297N297-C301 PolarHBondContact O-N 2.76Å; N297-C301 VanDerWaalsContact O-N 3.07Å

Retrieved 301 of 301 residues in 101.8 ms (Link to these results)

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