A0A3Q0KLZ7_SCHMA Loading...

Cytochrome c oxidase assembly factor 6 homolog

AlphaFold DB , UniProt , Accession A0A3Q0KLZ7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 91 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
1M41Very low65.4Low222 Ų222103.3 Ų103.3100%1.09458%0.582SS**  0131.90-63.4-139.5-95.900107.5T3M1-T3 PolarHBondContact O-N 3.4Å
2P51.7Low67.3Low125 Ų125102.5 Ų102.581%0.81257%0.571SS**  trans-60.5111.6166.5-8.723.5000105.9T4P2-T4 PolarHBondContact O-N 3.19Å
3T53.3Low69Low86 Ų86102.3 Ų102.353%0.52856%0.556SS.*  trans-70.1129.6177.744.60000106.4M1 S5 D6M1-T3 PolarHBondContact O-N 3.4Å; T3-S5 PolarHBondContact O-N 3.28Å; T3-D6 PolarHBondContact O-N 3.15Å
4T55.4Low70.6Confident123 Ų123102.9 Ų102.976%0.75555%0.553SS**G310 helixtrans-54-16.2-178.641.30000113.9P2 D6 L7P2-T4 PolarHBondContact O-N 3.19Å; T4-D6 PolarHBondContact O-N 2.6Å; T4-D6 VanDerWaalsContact O-N 3.16Å; T4-L7 PolarHBondContact O-N 2.83Å; T4-L7 VanDerWaalsContact O-N 3.14Å
5S56.8Low72.1Confident86 Ų86104.6 Ų104.660%0.60155%0.553SS**G310 helixtrans-56.8-20.8171.6-151.30000114.2T3 L7T3-S5 PolarHBondContact O-N 3.28Å; S5-L7 VanDerWaalsContact C-N 3.35Å
6D59.5Low73.4Confident48 Ų4898.1 Ų98.126%0.25752%0.519SS..G310 helixtrans-82.5-13.6179.8-64.1-30.8000113.4T3 T4 L8 V60 W61T3-D6 PolarHBondContact O-N 3.15Å; T4-D6 PolarHBondContact O-N 2.6Å; T4-D6 VanDerWaalsContact O-N 3.16Å; D6-L8 PolarHBondContact O-N 3.1Å; D6-V60 VanDerWaalsContact OD1-CB 3.24Å; D6-V60 WeakPolarHBondContact OD1-CB 3.46Å; D6-V60 WeakPolarHBondContact OD1-CG2 3.25Å; D6-W61 PolarHBondContact O-NE1 2.93Å; D6-W61 VanDerWaalsContact O-NE1 3.09Å
7L71.8Confident74.6Confident136 Ų13698.8 Ų98.871%0.71251%0.513SS*.  trans-93.987.8-177.5-61.4-177.9000111.3T4 S5T4-L7 PolarHBondContact O-N 2.83Å; T4-L7 VanDerWaalsContact O-N 3.14Å; S5-L7 VanDerWaalsContact C-N 3.35Å
8L75.6Confident75.8Confident14 Ų14101.6 Ų101.67%0.07352%0.52CS..  trans-71.7137.3167.7-70.9159.1000111D6 E12 R13 C16 P58 W61D6-L8 PolarHBondContact O-N 3.1Å; L8-E12 HydrophobicContact CB-CB 4.27Å; L8-E12 HydrophobicContact CD2-CB 3.52Å; L8-R13 HydrophobicContact CB-CG 3.4Å; L8-R13 HydrophobicContact CD1-CG 4.06Å; L8-R13 HydrophobicContact CG-CG 4.37Å; L8-R13 VanDerWaalsContact O-CZ 3.29Å; L8-R13 PolarHBondContact O-NE 3.31Å; L8-R13 PolarHBondContact O-NH2 2.87Å; L8-C16 HydrophobicContact CD1-CB 4.4Å; L8-P58 HydrophobicContact CD1-CG 3.92Å; L8-P58 HydrophobicContact CD2-CG 3.7Å; L8-P58 HydrophobicContact CG-CG 3.74Å; L8-W61 HydrophobicContact CD1-CD2 3.76Å; L8-W61 HydrophobicContact CD1-CE3 4.31Å; L8-W61 HydrophobicContact CD1-CG 4.02Å; L8-W61 HydrophobicContact CD1-CZ2 4.07Å
9S83.3Confident76.9Confident50 Ų5096.5 Ų96.535%0.3550%0.495SS..  trans-67.5162.9163.870.20000111.1P11 E12 R13S9-P11 WeakPolarHBondContact OG-CD 3.27Å; S9-E12 WeakPolarHBondContact CB-OE2 3.38Å; S9-E12 PolarHBondContact N-OE2 3.45Å; S9-E12 PolarHBondContact O-N 3.14Å; S9-E12 VanDerWaalsContact OG-CG 3.25Å; S9-E12 WeakPolarHBondContact OG-CG 3.42Å; S9-E12 PolarHBondContact OG-OE2 2.88Å; S9-R13 WeakPolarHBondContact O-CG 3.19Å; S9-R13 PolarHBondContact O-N 3.4Å
10K83.9Confident77.8Confident173 Ų17394.4 Ų94.475%0.75248%0.48SS*.Hα-helixtrans-50-52.2177.8-69.3-176.1178.8-177.40113.5E12 R13 E14K10-E12 VanDerWaalsContact C-N 3.33Å; K10-E12 PolarHBondContact O-N 3.09Å; K10-R13 PolarHBondContact O-N 3.02Å; K10-E14 PolarHBondContact O-N 2.91Å; K10-E14 VanDerWaalsContact O-N 3.15Å
11P87Confident78.7Confident73 Ų7393.7 Ų93.747%0.47448%0.478SS..Hα-helixtrans-67.1-31.5-179.326-35.4000113.3S9 E14 K15S9-P11 WeakPolarHBondContact OG-CD 3.27Å; P11-E14 PolarHBondContact O-N 2.83Å; P11-K15 WeakPolarHBondContact O-CG 3.47Å; P11-K15 PolarHBondContact O-N 3.36Å; P11-K15 VanDerWaalsContact O-N 3.1Å
12E87.9Confident81.4Confident94 Ų9484.9 Ų84.944%0.43944%0.44SS..Hα-helixtrans-70.6-37.9176.2-65167133.500111.4L8 S9 K10 E14 K15 C16L8-E12 HydrophobicContact CB-CB 4.27Å; L8-E12 HydrophobicContact CD2-CB 3.52Å; S9-E12 WeakPolarHBondContact CB-OE2 3.38Å; S9-E12 PolarHBondContact N-OE2 3.45Å; S9-E12 PolarHBondContact O-N 3.14Å; S9-E12 VanDerWaalsContact OG-CG 3.25Å; S9-E12 WeakPolarHBondContact OG-CG 3.42Å; S9-E12 PolarHBondContact OG-OE2 2.88Å; K10-E12 VanDerWaalsContact C-N 3.33Å; K10-E12 PolarHBondContact O-N 3.09Å; E12-E14 VanDerWaalsContact C-N 3.32Å; E12-E14 PolarHBondContact O-N 3.33Å; E12-K15 PolarHBondContact O-N 3.45Å; E12-C16 VanDerWaalsContact O-CB 3.29Å; E12-C16 WeakPolarHBondContact O-CB 3.5Å; E12-C16 PolarHBondContact O-N 3.06Å
13R89.6Confident83.5Confident100 Ų10079.7 Ų79.738%0.37741%0.405SS..Hα-helixtrans-59.1-44.5172.3-68.3178.7-155-178.83.2111.4L8 S9 K10 C16 W17L8-R13 HydrophobicContact CB-CG 3.4Å; L8-R13 HydrophobicContact CD1-CG 4.06Å; L8-R13 HydrophobicContact CG-CG 4.37Å; L8-R13 VanDerWaalsContact O-CZ 3.29Å; L8-R13 PolarHBondContact O-NE 3.31Å; L8-R13 PolarHBondContact O-NH2 2.87Å; S9-R13 WeakPolarHBondContact O-CG 3.19Å; S9-R13 PolarHBondContact O-N 3.4Å; K10-R13 PolarHBondContact O-N 3.02Å; R13-C16 WeakPolarHBondContact O-CB 3.49Å; R13-C16 PolarHBondContact O-N 2.02Å; R13-W17 WeakPolarHBondContact O-CB 3.29Å; R13-W17 VanDerWaalsContact O-CG 3.26Å; R13-W17 PolarHBondContact O-N 3.16Å
14E91.7Very high85.5Confident110 Ų11077.5 Ų77.551%0.51439%0.387SS..Hα-helixtrans-62.7-43.7178.6-71.4176.3-17300112.1K10 P11 E12 W17 K18K10-E14 PolarHBondContact O-N 2.91Å; K10-E14 VanDerWaalsContact O-N 3.15Å; P11-E14 PolarHBondContact O-N 2.83Å; E12-E14 VanDerWaalsContact C-N 3.32Å; E12-E14 PolarHBondContact O-N 3.33Å; E14-W17 PolarHBondContact O-N 2.97Å; E14-K18 WeakPolarHBondContact O-CB 3.24Å; E14-K18 VanDerWaalsContact O-CG 3.27Å; E14-K18 WeakPolarHBondContact O-CG 3.2Å; E14-K18 PolarHBondContact O-N 3.44Å
15K92.4Very high87.5Confident129 Ų12978.3 Ų78.356%0.56138%0.382SS*.Hα-helixtrans-61.8-45.7174.7-71.4177.9-176.8-179.60111.4P11 E12 K18 S19P11-K15 WeakPolarHBondContact O-CG 3.47Å; P11-K15 PolarHBondContact O-N 3.36Å; P11-K15 VanDerWaalsContact O-N 3.1Å; E12-K15 PolarHBondContact O-N 3.45Å; K15-K18 PolarHBondContact O-N 3.34Å; K15-S19 PolarHBondContact O-N 2.84Å; K15-S19 PolarHBondContact O-OG 3Å
16C94.4Very high89.4Confident0 Ų075 Ų750%036%0.359CS..Hα-helixtrans-57.8-50.7176.71710000111.1L8 E12 R13 K18 S19 R20 C57L8-C16 HydrophobicContact CD1-CB 4.4Å; E12-C16 VanDerWaalsContact O-CB 3.29Å; E12-C16 WeakPolarHBondContact O-CB 3.5Å; E12-C16 PolarHBondContact O-N 3.06Å; R13-C16 WeakPolarHBondContact O-CB 3.49Å; R13-C16 PolarHBondContact O-N 2.02Å; C16-K18 PolarHBondContact O-N 2.89Å; C16-S19 PolarHBondContact O-N 3.06Å; C16-S19 PolarHBondContact O-OG 3.05Å; C16-R20 WeakPolarHBondContact O-CB 3.47Å; C16-R20 PolarHBondContact O-N 2.88Å; C16-C57 WeakPolarHBondContact CA-SG 3.05Å; C16-C57 HydrophobicContact CB-CB 4.04Å; C16-C57 WeakPolarHBondContact CB-SG 3.4Å; C16-C57 PolarHBondContact O-SG 3.31Å; C16-C57 WeakPolarHBondContact SG-CB 3.42Å; C16-C57 CovalentContact SG-SG 2.02Å; C16-C57 PolarHBondContact SG-SG 3.47Å
17W93.8Very high91.1Very high110 Ų11073.1 Ų73.142%0.41735%0.349SS..Hα-helixtrans-63.4-39.1179.5-65.6-4.6000112.8R13 E14 S19 R20 D21 W61 F65R13-W17 WeakPolarHBondContact O-CB 3.29Å; R13-W17 VanDerWaalsContact O-CG 3.26Å; R13-W17 PolarHBondContact O-N 3.16Å; E14-W17 PolarHBondContact O-N 2.97Å; W17-S19 PolarHBondContact O-N 2.71Å; W17-R20 WeakPolarHBondContact O-CB 3.38Å; W17-R20 PolarHBondContact O-N 3.43Å; W17-D21 WeakPolarHBondContact O-CB 3.45Å; W17-D21 PolarHBondContact O-N 3.4Å; W17-W61 AromaticContact NE1-CZ3 3.55Å; W17-F65 AromaticContact CD1-CZ 3.87Å; W17-F65 AromaticContact NE1-CZ 3.71Å
18K95.7Very high92.1Very high149 Ų14971.6 Ų71.665%0.64834%0.341SS*.Hα-helixtrans-60.6-44.7174-74.1173-178.4177.80112E14 K15 C16 D21 A22E14-K18 WeakPolarHBondContact O-CB 3.24Å; E14-K18 VanDerWaalsContact O-CG 3.27Å; E14-K18 WeakPolarHBondContact O-CG 3.2Å; E14-K18 PolarHBondContact O-N 3.44Å; K15-K18 PolarHBondContact O-N 3.34Å; C16-K18 PolarHBondContact O-N 2.89Å; K18-D21 PolarHBondContact O-N 3.2Å; K18-A22 WeakPolarHBondContact O-CB 3.42Å; K18-A22 PolarHBondContact O-N 3.3Å
19S95.9Very high93Very high6 Ų673.9 Ų73.94%0.04235%0.353CS..Hα-helixtrans-66.8-37.2177.969.40000112.7K15 C16 W17 F23 M56K15-S19 PolarHBondContact O-N 2.84Å; K15-S19 PolarHBondContact O-OG 3Å; C16-S19 PolarHBondContact O-N 3.06Å; C16-S19 PolarHBondContact O-OG 3.05Å; W17-S19 PolarHBondContact O-N 2.71Å; S19-F23 PolarHBondContact O-N 3.42Å; S19-M56 WeakPolarHBondContact OG-CB 2.98Å
20R95.7Very high93.5Very high54 Ų5471.6 Ų71.620%0.20434%0.337CS..Hα-helixtrans-60-51.3173.3-179.5-160.970.1-168.8-3110.7C16 W17 A22 F23 W24 Y53 F65C16-R20 WeakPolarHBondContact O-CB 3.47Å; C16-R20 PolarHBondContact O-N 2.88Å; W17-R20 WeakPolarHBondContact O-CB 3.38Å; W17-R20 PolarHBondContact O-N 3.43Å; R20-A22 VanDerWaalsContact C-N 3.34Å; R20-A22 PolarHBondContact O-N 3.34Å; R20-F23 PolarHBondContact O-N 2.9Å; R20-W24 PolarHBondContact O-N 3.48Å; R20-Y53 HydrophobicContact CB-CD2 3.87Å; R20-Y53 HydrophobicContact CB-CE2 3.45Å; R20-Y53 VanDerWaalsContact CB-CE2 3.45Å; R20-Y53 HydrophobicContact CG-CE2 3.79Å; R20-F65 HydrophobicContact CG-CD2 4.3Å; R20-F65 HydrophobicContact CG-CG 4.5Å; R20-F65 VanDerWaalsContact NH1-CE1 3.31Å
21D96.7Very high93.8Very high79 Ų7967 Ų6742%0.42232%0.32SS..Hα-helixtrans-65.6-40.8-175.5-65.7-12.2000110.5W17 K18 F23 W24 E25W17-D21 WeakPolarHBondContact O-CB 3.45Å; W17-D21 PolarHBondContact O-N 3.4Å; K18-D21 PolarHBondContact O-N 3.2Å; D21-F23 VanDerWaalsContact C-N 3.34Å; D21-F23 PolarHBondContact O-N 2.92Å; D21-W24 PolarHBondContact O-N 3.46Å; D21-E25 VanDerWaalsContact O-CB 3.3Å; D21-E25 WeakPolarHBondContact O-CB 3.2Å; D21-E25 PolarHBondContact O-N 2.93Å
22A97Very high94Very high37 Ų3767.6 Ų67.631%0.30633%0.325SS..Hα-helixtrans-61.4-38.6173.600000113.2K18 R20 C26K18-A22 WeakPolarHBondContact O-CB 3.42Å; K18-A22 PolarHBondContact O-N 3.3Å; R20-A22 VanDerWaalsContact C-N 3.34Å; R20-A22 PolarHBondContact O-N 3.34Å; A22-C26 PolarHBondContact O-N 3.03Å
23F96.9Very high94.2Very high16 Ų1669.9 Ų69.97%0.0733%0.334CS..Hα-helixtrans-63.3-49.5173.4171.5-118.2000111S19 R20 D21 E25 C26 V27 C46 Q49 R50 Y53S19-F23 PolarHBondContact O-N 3.42Å; R20-F23 PolarHBondContact O-N 2.9Å; D21-F23 VanDerWaalsContact C-N 3.34Å; D21-F23 PolarHBondContact O-N 2.92Å; F23-E25 PolarHBondContact O-N 2.99Å; F23-C26 WeakPolarHBondContact O-CB 3.47Å; F23-C26 PolarHBondContact O-N 2.94Å; F23-V27 HydrophobicContact CD2-CG2 4.25Å; F23-V27 HydrophobicContact CE1-CG2 4.25Å; F23-V27 HydrophobicContact CE2-CG2 3.8Å; F23-V27 HydrophobicContact CZ-CG2 3.8Å; F23-V27 WeakPolarHBondContact O-CG2 3.18Å; F23-V27 PolarHBondContact O-N 3.07Å; F23-C46 HydrophobicContact CD2-CB 4.13Å; F23-C46 HydrophobicContact CE2-CB 4.01Å; F23-Q49 HydrophobicContact CB-CB 4.11Å; F23-Q49 HydrophobicContact CD2-CB 4.28Å; F23-R50 HydrophobicContact CD2-CB 3.93Å; F23-R50 HydrophobicContact CE2-CB 3.77Å; F23-R50 HydrophobicContact CE2-CG 4.31Å; F23-Y53 HydrophobicContact CB-CD1 4.25Å; F23-Y53 HydrophobicContact CB-CG 4.45Å; F23-Y53 AromaticContact CD1-CD1 3.75Å; F23-Y53 HydrophobicContact CD1-CD1 3.75Å; F23-Y53 HydrophobicContact CD1-CE1 4.03Å; F23-Y53 HydrophobicContact CE1-CD1 4.42Å; F23-Y53 HydrophobicContact CG-CD1 4.15Å
24W95Very high94.1Very high40 Ų4067.7 Ų67.715%0.15233%0.33CS..Hα-helixtrans-70.1-32.6-177.5-63.9131.5000114.2R20 D21 C26 V27 I28 D66 R69R20-W24 PolarHBondContact O-N 3.48Å; D21-W24 PolarHBondContact O-N 3.46Å; W24-C26 VanDerWaalsContact C-N 3.33Å; W24-V27 HydrophobicContact CE3-CB 4.26Å; W24-V27 HydrophobicContact CE3-CG2 3.87Å; W24-V27 HydrophobicContact CZ3-CG2 4.27Å; W24-V27 PolarHBondContact O-N 2.93Å; W24-I28 VanDerWaalsContact O-CG1 3.32Å; W24-I28 WeakPolarHBondContact O-CG1 2.87Å; W24-I28 PolarHBondContact O-N 3.47Å; W24-D66 VanDerWaalsContact CZ2-OD1 3.27Å; W24-D66 WeakPolarHBondContact CZ2-OD1 3.45Å; W24-R69 VanDerWaalsContact CD2-NH1 3.34Å; W24-R69 VanDerWaalsContact CE3-CD 3.4Å; W24-R69 HydrophobicContact CH2-CB 4.3Å; W24-R69 HydrophobicContact CH2-CG 4.38Å; W24-R69 HydrophobicContact CZ2-CB 4.16Å
25E96.4Very high93.6Very high140 Ų14068.7 Ų68.765%0.65435%0.349SS*.Hα-helixtrans-59.7-45.8170.8-176.9175.9-154.400110.5D21 F23 V27 I28 D29D21-E25 VanDerWaalsContact O-CB 3.3Å; D21-E25 WeakPolarHBondContact O-CB 3.2Å; D21-E25 PolarHBondContact O-N 2.93Å; F23-E25 PolarHBondContact O-N 2.99Å; E25-V27 PolarHBondContact O-N 3.47Å; E25-I28 PolarHBondContact O-N 2.82Å; E25-D29 WeakPolarHBondContact O-CB 3.33Å; E25-D29 PolarHBondContact O-N 2.97Å
26C97.1Very high93Very high18 Ų1870.9 Ų70.912%0.12236%0.361CS..Hα-helixtrans-59.2-45.2173.1-179.60000111.9A22 F23 W24 I28 D29 V30 C46 Q49A22-C26 PolarHBondContact O-N 3.03Å; F23-C26 WeakPolarHBondContact O-CB 3.47Å; F23-C26 PolarHBondContact O-N 2.94Å; W24-C26 VanDerWaalsContact C-N 3.33Å; C26-I28 VanDerWaalsContact C-N 3.32Å; C26-I28 PolarHBondContact O-N 3.24Å; C26-D29 PolarHBondContact O-N 3.22Å; C26-V30 WeakPolarHBondContact O-CG2 3.38Å; C26-V30 PolarHBondContact O-N 3.48Å; C26-C46 HydrophobicContact CB-CB 3.88Å; C26-C46 WeakPolarHBondContact CB-SG 3.49Å; C26-C46 PolarHBondContact O-SG 3.01Å; C26-C46 WeakPolarHBondContact SG-CA 3.28Å; C26-C46 WeakPolarHBondContact SG-CB 3.29Å; C26-C46 CovalentContact SG-SG 2.04Å; C26-C46 PolarHBondContact SG-SG 3.24Å; C26-Q49 HydrophobicContact CB-CG 4.27Å
27V94.7Very high92.1Very high7 Ų773.5 Ų73.54%0.04238%0.378CS..Hα-helixtrans-60.6-43.3178.6178.50000111.3F23 W24 E25 V30 I31 V42 C46F23-V27 HydrophobicContact CD2-CG2 4.25Å; F23-V27 HydrophobicContact CE1-CG2 4.25Å; F23-V27 HydrophobicContact CE2-CG2 3.8Å; F23-V27 HydrophobicContact CZ-CG2 3.8Å; F23-V27 WeakPolarHBondContact O-CG2 3.18Å; F23-V27 PolarHBondContact O-N 3.07Å; W24-V27 HydrophobicContact CE3-CB 4.26Å; W24-V27 HydrophobicContact CE3-CG2 3.87Å; W24-V27 HydrophobicContact CZ3-CG2 4.27Å; W24-V27 PolarHBondContact O-N 2.93Å; E25-V27 PolarHBondContact O-N 3.47Å; V27-V30 PolarHBondContact O-N 3.21Å; V27-I31 HydrophobicContact CG1-CD1 3.72Å; V27-I31 HydrophobicContact CG1-CG1 4.44Å; V27-I31 WeakPolarHBondContact O-CB 3.43Å; V27-I31 VanDerWaalsContact O-CG1 3.29Å; V27-I31 WeakPolarHBondContact O-CG1 3.38Å; V27-I31 PolarHBondContact O-N 3.34Å; V27-V42 HydrophobicContact CB-CG1 4.12Å; V27-V42 HydrophobicContact CG1-CG1 3.75Å; V27-V42 HydrophobicContact CG2-CG1 3.66Å; V27-C46 PolarHBondContact N-SG 2.9Å
28I93.2Very high91.6Very high104 Ų10472.2 Ų72.253%0.53338%0.38SS..Hα-helixtrans-63.2-45.2177.5-71.2161.3000110.5W24 E25 C26 V30 I31 S32W24-I28 VanDerWaalsContact O-CG1 3.32Å; W24-I28 WeakPolarHBondContact O-CG1 2.87Å; W24-I28 PolarHBondContact O-N 3.47Å; E25-I28 PolarHBondContact O-N 2.82Å; C26-I28 VanDerWaalsContact C-N 3.32Å; C26-I28 PolarHBondContact O-N 3.24Å; I28-V30 PolarHBondContact O-N 3.06Å; I28-I31 PolarHBondContact O-N 3.36Å; I28-S32 WeakPolarHBondContact O-CB 3.48Å; I28-S32 PolarHBondContact O-N 3.45Å; I28-S32 PolarHBondContact O-OG 3.2Å
29D95.4Very high91.2Very high63 Ų6372.9 Ų72.934%0.33739%0.385SS..Hα-helixtrans-59.3-47178.7-17770.3000111.5E25 C26 I31 S32 K33E25-D29 WeakPolarHBondContact O-CB 3.33Å; E25-D29 PolarHBondContact O-N 2.97Å; C26-D29 PolarHBondContact O-N 3.22Å; D29-I31 PolarHBondContact O-N 3.01Å; D29-S32 PolarHBondContact O-N 2.94Å; D29-S32 PolarHBondContact O-OG 3.28Å; D29-K33 WeakPolarHBondContact O-CB 3.48Å; D29-K33 WeakPolarHBondContact O-CG 3.33Å; D29-K33 PolarHBondContact O-N 3.42Å; D29-K33 VanDerWaalsContact O-N 3.1Å; D29-K33 WeakPolarHBondContact OD1-CE 3.07Å; D29-K33 IonicContact OD1-NZ 2.8Å; D29-K33 PolarHBondContact OD1-NZ 3.31Å; D29-K33 WeakPolarHBondContact OD2-CE 3.22Å; D29-K33 IonicContact OD2-NZ 2.86Å; D29-K33 PolarHBondContact OD2-NZ 2.76Å
30V93.9Very high91Very high1 Ų177 Ų771%0.00640%0.403CS..Hα-helixtrans-61.3-46.5176.7175.80000111C26 V27 I28 S32 K33 N34 L41 V42 Q45C26-V30 WeakPolarHBondContact O-CG2 3.38Å; C26-V30 PolarHBondContact O-N 3.48Å; V27-V30 PolarHBondContact O-N 3.21Å; I28-V30 PolarHBondContact O-N 3.06Å; V30-S32 VanDerWaalsContact C-N 3.33Å; V30-S32 PolarHBondContact O-N 3.37Å; V30-K33 PolarHBondContact O-N 3Å; V30-N34 PolarHBondContact O-N 3.28Å; V30-N34 PolarHBondContact O-ND2 2.87Å; V30-L41 HydrophobicContact CG1-CD2 4.25Å; V30-L41 HydrophobicContact CG1-CG 4.21Å; V30-V42 HydrophobicContact CB-CG2 4.27Å; V30-V42 HydrophobicContact CG1-CG2 3.74Å; V30-Q45 HydrophobicContact CG2-CB 3.8Å; V30-Q45 HydrophobicContact CG2-CG 4.43Å
31I90.5Very high90.8Very high77 Ų7776.5 Ų76.540%0.39541%0.405SS..Hα-helixtrans-63-40.5178.6-72170.8000111.3V27 I28 D29 K33 P37 V42V27-I31 HydrophobicContact CG1-CD1 3.72Å; V27-I31 HydrophobicContact CG1-CG1 4.44Å; V27-I31 WeakPolarHBondContact O-CB 3.43Å; V27-I31 VanDerWaalsContact O-CG1 3.29Å; V27-I31 WeakPolarHBondContact O-CG1 3.38Å; V27-I31 PolarHBondContact O-N 3.34Å; I28-I31 PolarHBondContact O-N 3.36Å; D29-I31 PolarHBondContact O-N 3.01Å; I31-K33 VanDerWaalsContact C-N 3.3Å; I31-K33 PolarHBondContact O-N 2.83Å; I31-P37 HydrophobicContact CB-CB 4.34Å; I31-P37 HydrophobicContact CB-CG 4.29Å; I31-P37 HydrophobicContact CG1-CB 3.83Å; I31-P37 HydrophobicContact CG1-CG 3.98Å; I31-P37 HydrophobicContact CG2-CG 4.1Å; I31-V42 HydrophobicContact CG1-CG2 4.33Å
32S90.9Very high90.6Very high85 Ų8573.7 Ų73.759%0.59439%0.39SS*.Hα-helixtrans-68.6-27.8-179.570.80000113.8I28 D29 V30I28-S32 WeakPolarHBondContact O-CB 3.48Å; I28-S32 PolarHBondContact O-N 3.45Å; I28-S32 PolarHBondContact O-OG 3.2Å; D29-S32 PolarHBondContact O-N 2.94Å; D29-S32 PolarHBondContact O-OG 3.28Å; V30-S32 VanDerWaalsContact C-N 3.33Å; V30-S32 PolarHBondContact O-N 3.37Å
33K91.8Very high90.3Very high143 Ų14379 Ų7962%0.62240%0.403SS*.Hα-helixtrans-90.8-13.2-177.1-73172.6178.7165.40113.6D29 V30 I31D29-K33 WeakPolarHBondContact O-CB 3.48Å; D29-K33 WeakPolarHBondContact O-CG 3.33Å; D29-K33 PolarHBondContact O-N 3.42Å; D29-K33 VanDerWaalsContact O-N 3.1Å; D29-K33 WeakPolarHBondContact OD1-CE 3.07Å; D29-K33 IonicContact OD1-NZ 2.8Å; D29-K33 PolarHBondContact OD1-NZ 3.31Å; D29-K33 WeakPolarHBondContact OD2-CE 3.22Å; D29-K33 IonicContact OD2-NZ 2.86Å; D29-K33 PolarHBondContact OD2-NZ 2.76Å; V30-K33 PolarHBondContact O-N 3Å; I31-K33 VanDerWaalsContact C-N 3.3Å; I31-K33 PolarHBondContact O-N 2.83Å
34N87.3Confident90.2Very high54 Ų5484.3 Ų84.329%0.28943%0.426SS..  trans-123.5121-175.4-63.7-84.1000109.4V30 E36 P37 L41V30-N34 PolarHBondContact O-N 3.28Å; V30-N34 PolarHBondContact O-ND2 2.87Å; N34-E36 PolarHBondContact O-N 2.89Å; N34-P37 HydrophobicContact CB-CB 4.44Å; N34-P37 WeakPolarHBondContact O-CD 3.06Å; N34-L41 HydrophobicContact CB-CD2 4.27Å
35S80.2Confident90.1Very high130 Ų13087 Ų8791%0.90944%0.439SS*.SBendtrans-63.3-29.1-178.6-50.20000113.2
36E79.7Confident90.1Very high176 Ų17680.3 Ų80.382%0.82241%0.408SS*.SBendtrans-127.278.1176.3-66.8-179.4179.900108.5N34 D38N34-E36 PolarHBondContact O-N 2.89Å; E36-D38 PolarHBondContact O-N 3.37Å; E36-D38 VanDerWaalsContact O-N 3.14Å
37P75.5Confident90.1Very high55 Ų5582.4 Ų82.436%0.35742%0.423SS..  trans-73.5112.6-178.228.8-29.7000109.1I31 N34I31-P37 HydrophobicContact CB-CB 4.34Å; I31-P37 HydrophobicContact CB-CG 4.29Å; I31-P37 HydrophobicContact CG1-CB 3.83Å; I31-P37 HydrophobicContact CG1-CG 3.98Å; I31-P37 HydrophobicContact CG2-CG 4.1Å; N34-P37 HydrophobicContact CB-CB 4.44Å; N34-P37 WeakPolarHBondContact O-CD 3.06Å
38D85.3Confident90.1Very high83 Ų8390.1 Ų90.144%0.44446%0.456SS..  trans-82.8149.9170.480.755.7000110.7E36 E40 L41 V42E36-D38 PolarHBondContact O-N 3.37Å; E36-D38 VanDerWaalsContact O-N 3.14Å; D38-E40 PolarHBondContact O-N 3.08Å; D38-E40 VanDerWaalsContact OD1-CA 3.26Å; D38-E40 WeakPolarHBondContact OD1-CA 3.25Å; D38-E40 VanDerWaalsContact OD1-CB 3.28Å; D38-E40 WeakPolarHBondContact OD1-CB 3.46Å; D38-E40 PolarHBondContact OD1-N 3.14Å; D38-L41 PolarHBondContact O-N 2.95Å; D38-L41 VanDerWaalsContact OD1-CB 3.29Å; D38-L41 WeakPolarHBondContact OD1-CB 3.48Å; D38-L41 PolarHBondContact OD1-N 3.31Å; D38-V42 PolarHBondContact O-N 3.33Å
39E86.8Confident90.3Very high163 Ų16388.2 Ų88.276%0.76245%0.445SS*.Hα-helixtrans-63.2-30.5-179.6-170-173.4151.100112R43E39-R43 VanDerWaalsContact O-CB 3.29Å; E39-R43 WeakPolarHBondContact O-CB 3.33Å; E39-R43 PolarHBondContact O-N 3.26Å
40E90.5Very high90.3Very high92 Ų9288.2 Ų88.243%0.4344%0.44SS..Hα-helixtrans-69.9-36-179.6176.6172.6-179.600112.2D38 R43 K44D38-E40 PolarHBondContact O-N 3.08Å; D38-E40 VanDerWaalsContact OD1-CA 3.26Å; D38-E40 WeakPolarHBondContact OD1-CA 3.25Å; D38-E40 VanDerWaalsContact OD1-CB 3.28Å; D38-E40 WeakPolarHBondContact OD1-CB 3.46Å; D38-E40 PolarHBondContact OD1-N 3.14Å; E40-R43 PolarHBondContact O-N 2.89Å; E40-K44 HydrophobicContact CG-CD 4.1Å; E40-K44 WeakPolarHBondContact O-CB 3.27Å; E40-K44 VanDerWaalsContact O-CG 3.24Å; E40-K44 WeakPolarHBondContact O-CG 3.31Å; E40-K44 PolarHBondContact O-N 2.86Å; E40-K44 WeakPolarHBondContact OE1-CE 3.28Å; E40-K44 IonicContact OE1-NZ 3.29Å; E40-K44 PolarHBondContact OE1-NZ 2.77Å
41L91.5Very high90.5Very high44 Ų4494.3 Ų94.323%0.2347%0.467CS..Hα-helixtrans-68.5-48.1177.9-177.467000109.2V30 N34 D38 R43 K44 Q45V30-L41 HydrophobicContact CG1-CD2 4.25Å; V30-L41 HydrophobicContact CG1-CG 4.21Å; N34-L41 HydrophobicContact CB-CD2 4.27Å; D38-L41 PolarHBondContact O-N 2.95Å; D38-L41 VanDerWaalsContact OD1-CB 3.29Å; D38-L41 WeakPolarHBondContact OD1-CB 3.48Å; D38-L41 PolarHBondContact OD1-N 3.31Å; L41-R43 VanDerWaalsContact C-N 3.32Å; L41-R43 PolarHBondContact O-N 3.23Å; L41-K44 PolarHBondContact O-N 2.8Å; L41-Q45 HydrophobicContact CD1-CG 4.26Å; L41-Q45 WeakPolarHBondContact O-CB 3.3Å; L41-Q45 WeakPolarHBondContact O-CG 3.45Å; L41-Q45 PolarHBondContact O-N 3.49Å
42V92.2Very high90.7Very high20 Ų2094.1 Ų94.112%0.12147%0.466CS..Hα-helixtrans-56.9-48.5172.4173.70000110V27 V30 I31 D38 K44 Q45 C46V27-V42 HydrophobicContact CB-CG1 4.12Å; V27-V42 HydrophobicContact CG1-CG1 3.75Å; V27-V42 HydrophobicContact CG2-CG1 3.66Å; V30-V42 HydrophobicContact CB-CG2 4.27Å; V30-V42 HydrophobicContact CG1-CG2 3.74Å; I31-V42 HydrophobicContact CG1-CG2 4.33Å; D38-V42 PolarHBondContact O-N 3.33Å; V42-K44 VanDerWaalsContact C-N 3.35Å; V42-K44 PolarHBondContact O-N 3.15Å; V42-Q45 PolarHBondContact O-N 2.91Å; V42-C46 VanDerWaalsContact O-CB 3.27Å; V42-C46 WeakPolarHBondContact O-CB 3.32Å; V42-C46 PolarHBondContact O-N 3.24Å
43R92Very high90.9Very high149 Ų14990.1 Ų90.156%0.56244%0.438SS*.Hα-helixtrans-61-41.6178.7-175.3178.665.6-147.9-1.2112.2E39 E40 L41 S47E39-R43 VanDerWaalsContact O-CB 3.29Å; E39-R43 WeakPolarHBondContact O-CB 3.33Å; E39-R43 PolarHBondContact O-N 3.26Å; E40-R43 PolarHBondContact O-N 2.89Å; L41-R43 VanDerWaalsContact C-N 3.32Å; L41-R43 PolarHBondContact O-N 3.23Å; R43-S47 VanDerWaalsContact O-CA 3.32Å; R43-S47 WeakPolarHBondContact O-CA 3.46Å; R43-S47 VanDerWaalsContact O-CB 3.25Å; R43-S47 WeakPolarHBondContact O-CB 3.27Å; R43-S47 PolarHBondContact O-N 3.44Å; R43-S47 VanDerWaalsContact O-N 3.11Å
44K93.4Very high91Very high127 Ų12788.2 Ų88.255%0.55243%0.432SS*.Hα-helixtrans-66.4-52.3178.4-78.9172-177.51680111.2E40 L41 V42 S47E40-K44 HydrophobicContact CG-CD 4.1Å; E40-K44 WeakPolarHBondContact O-CB 3.27Å; E40-K44 VanDerWaalsContact O-CG 3.24Å; E40-K44 WeakPolarHBondContact O-CG 3.31Å; E40-K44 PolarHBondContact O-N 2.86Å; E40-K44 WeakPolarHBondContact OE1-CE 3.28Å; E40-K44 IonicContact OE1-NZ 3.29Å; E40-K44 PolarHBondContact OE1-NZ 2.77Å; L41-K44 PolarHBondContact O-N 2.8Å; V42-K44 VanDerWaalsContact C-N 3.35Å; V42-K44 PolarHBondContact O-N 3.15Å; K44-S47 WeakPolarHBondContact O-CB 3.4Å; K44-S47 PolarHBondContact O-N 3.49Å; K44-S47 PolarHBondContact O-OG 3.01Å
45Q94.3Very high91.3Very high95 Ų9591.6 Ų91.644%0.44445%0.445SS..Hα-helixtrans-70.1-39.2-175-68.2-1654800112.5V30 L41 V42V30-Q45 HydrophobicContact CG2-CB 3.8Å; V30-Q45 HydrophobicContact CG2-CG 4.43Å; L41-Q45 HydrophobicContact CD1-CG 4.26Å; L41-Q45 WeakPolarHBondContact O-CB 3.3Å; L41-Q45 WeakPolarHBondContact O-CG 3.45Å; L41-Q45 PolarHBondContact O-N 3.49Å; V42-Q45 PolarHBondContact O-N 2.91Å
46C96.4Very high91.8Very high0 Ų089.5 Ų89.50%042%0.422CS..THydrogen-bonded Turntrans-96.514.7-179.6-550000113.5F23 C26 V27 V42 K48 Q49 R50F23-C46 HydrophobicContact CD2-CB 4.13Å; F23-C46 HydrophobicContact CE2-CB 4.01Å; C26-C46 HydrophobicContact CB-CB 3.88Å; C26-C46 WeakPolarHBondContact CB-SG 3.49Å; C26-C46 PolarHBondContact O-SG 3.01Å; C26-C46 WeakPolarHBondContact SG-CA 3.28Å; C26-C46 WeakPolarHBondContact SG-CB 3.29Å; C26-C46 CovalentContact SG-SG 2.04Å; C26-C46 PolarHBondContact SG-SG 3.24Å; V27-C46 PolarHBondContact N-SG 2.9Å; V42-C46 VanDerWaalsContact O-CB 3.27Å; V42-C46 WeakPolarHBondContact O-CB 3.32Å; V42-C46 PolarHBondContact O-N 3.24Å; C46-K48 VanDerWaalsContact C-N 3.3Å; C46-K48 PolarHBondContact O-N 2.04Å; C46-Q49 PolarHBondContact O-N 3.44Å; C46-R50 WeakPolarHBondContact O-CB 3.32Å; C46-R50 PolarHBondContact O-N 2.95Å
47S96.1Very high92.5Very high62 Ų6281.4 Ų81.443%0.43439%0.385SS..Hα-helixtrans-57.3-39.5-178.754.10000113.1R43 K44 R50 K51R43-S47 VanDerWaalsContact O-CA 3.32Å; R43-S47 WeakPolarHBondContact O-CA 3.46Å; R43-S47 VanDerWaalsContact O-CB 3.25Å; R43-S47 WeakPolarHBondContact O-CB 3.27Å; R43-S47 PolarHBondContact O-N 3.44Å; R43-S47 VanDerWaalsContact O-N 3.11Å; K44-S47 WeakPolarHBondContact O-CB 3.4Å; K44-S47 PolarHBondContact O-N 3.49Å; K44-S47 PolarHBondContact O-OG 3.01Å; S47-R50 PolarHBondContact O-N 3.26Å; S47-K51 WeakPolarHBondContact O-CB 3.4Å; S47-K51 PolarHBondContact O-N 2.87Å
48K96.2Very high93.3Very high170 Ų17079.9 Ų79.974%0.73938%0.375SS*.Hα-helixtrans-65.4-47.5179.1-67-179.4-178.71760111.4C46 R50 K51 L52C46-K48 VanDerWaalsContact C-N 3.3Å; C46-K48 PolarHBondContact O-N 2.04Å; K48-R50 VanDerWaalsContact C-N 3.33Å; K48-K51 PolarHBondContact O-N 2.85Å; K48-L52 PolarHBondContact O-N 2.72Å
49Q96.4Very high93.5Very high64 Ų6486.1 Ų86.130%0.29939%0.393SS..Hα-helixtrans-67.5-37.7178.5-65.680-11.500110.5F23 C26 C46 L52 Y53F23-Q49 HydrophobicContact CB-CB 4.11Å; F23-Q49 HydrophobicContact CD2-CB 4.28Å; C26-Q49 HydrophobicContact CB-CG 4.27Å; C46-Q49 PolarHBondContact O-N 3.44Å; Q49-L52 PolarHBondContact O-N 2.76Å; Q49-Y53 VanDerWaalsContact O-CB 3.25Å; Q49-Y53 WeakPolarHBondContact O-CB 3.39Å; Q49-Y53 PolarHBondContact O-N 2.77Å
50R96.5Very high93.7Very high62 Ų6282.1 Ų82.123%0.23438%0.379CS..Hα-helixtrans-60.4-46.5174.3-178.359.4-175.9-165.35.1111.6F23 C46 S47 K48 Y53 E54 D66F23-R50 HydrophobicContact CD2-CB 3.93Å; F23-R50 HydrophobicContact CE2-CB 3.77Å; F23-R50 HydrophobicContact CE2-CG 4.31Å; C46-R50 WeakPolarHBondContact O-CB 3.32Å; C46-R50 PolarHBondContact O-N 2.95Å; S47-R50 PolarHBondContact O-N 3.26Å; K48-R50 VanDerWaalsContact C-N 3.33Å; R50-Y53 WeakPolarHBondContact O-CB 3.36Å; R50-Y53 PolarHBondContact O-N 3.34Å; R50-E54 IonicContact CZ-OE1 3.89Å; R50-E54 VanDerWaalsContact CZ-OE1 3.29Å; R50-E54 IonicContact NE-OE1 3.28Å; R50-E54 PolarHBondContact NE-OE1 3.49Å; R50-E54 IonicContact NH2-OE1 2.76Å; R50-E54 PolarHBondContact NH2-OE1 3.11Å; R50-E54 WeakPolarHBondContact O-CG 3.42Å; R50-E54 PolarHBondContact O-N 3.39Å; R50-D66 IonicContact CZ-OD2 2.76Å; R50-D66 VanDerWaalsContact CZ-OD2 3.28Å; R50-D66 VanDerWaalsContact NH1-CG 3.34Å; R50-D66 IonicContact NH1-OD1 2.75Å; R50-D66 PolarHBondContact NH1-OD1 3.5Å; R50-D66 VanDerWaalsContact NH1-OD1 3.15Å; R50-D66 IonicContact NH1-OD2 2.65Å; R50-D66 PolarHBondContact NH1-OD2 3.1Å; R50-D66 IonicContact NH2-OD2 2.77Å; R50-D66 PolarHBondContact NH2-OD2 3.48Å
51K96.2Very high93.7Very high129 Ų12980.5 Ų80.556%0.56137%0.369SS*.Hα-helixtrans-61-47.5176.6-178.7175.1172.8177.90111.5S47 K48 Y53 E54 E55S47-K51 WeakPolarHBondContact O-CB 3.4Å; S47-K51 PolarHBondContact O-N 2.87Å; K48-K51 PolarHBondContact O-N 2.85Å; K51-Y53 VanDerWaalsContact C-N 3.26Å; K51-Y53 PolarHBondContact O-N 2.94Å; K51-E54 PolarHBondContact O-N 2.91Å; K51-E55 WeakPolarHBondContact CE-OE1 3.38Å; K51-E55 HydrophobicContact CG-CG 4.46Å; K51-E55 IonicContact NZ-OE1 2.77Å; K51-E55 WeakPolarHBondContact O-CB 3.06Å; K51-E55 WeakPolarHBondContact O-CG 3.03Å; K51-E55 PolarHBondContact O-N 3.39Å
52L95Very high93.8Very high74 Ų7478.7 Ų78.739%0.38736%0.36SS..Hα-helixtrans-60-39.5177.5-17664.6000111.8K48 Q49 E55 M56K48-L52 PolarHBondContact O-N 2.72Å; Q49-L52 PolarHBondContact O-N 2.76Å; L52-E55 PolarHBondContact O-N 2.89Å; L52-M56 HydrophobicContact CD1-CE 3.58Å; L52-M56 HydrophobicContact CD1-CG 3.84Å; L52-M56 HydrophobicContact CG-CG 4.16Å; L52-M56 VanDerWaalsContact O-CB 3.29Å; L52-M56 WeakPolarHBondContact O-CB 3.33Å; L52-M56 WeakPolarHBondContact O-CG 3.27Å; L52-M56 PolarHBondContact O-N 3.45Å
53Y95.2Very high93.9Very high0 Ų081.3 Ų81.30%037%0.373CS..Hα-helixtrans-64.2-43.9177.1176.7-143.8000112.2R20 F23 Q49 R50 K51 E55 M56 C57 V62 F65R20-Y53 HydrophobicContact CB-CD2 3.87Å; R20-Y53 HydrophobicContact CB-CE2 3.45Å; R20-Y53 VanDerWaalsContact CB-CE2 3.45Å; R20-Y53 HydrophobicContact CG-CE2 3.79Å; F23-Y53 HydrophobicContact CB-CD1 4.25Å; F23-Y53 HydrophobicContact CB-CG 4.45Å; F23-Y53 AromaticContact CD1-CD1 3.75Å; F23-Y53 HydrophobicContact CD1-CD1 3.75Å; F23-Y53 HydrophobicContact CD1-CE1 4.03Å; F23-Y53 HydrophobicContact CE1-CD1 4.42Å; F23-Y53 HydrophobicContact CG-CD1 4.15Å; Q49-Y53 VanDerWaalsContact O-CB 3.25Å; Q49-Y53 WeakPolarHBondContact O-CB 3.39Å; Q49-Y53 PolarHBondContact O-N 2.77Å; R50-Y53 WeakPolarHBondContact O-CB 3.36Å; R50-Y53 PolarHBondContact O-N 3.34Å; K51-Y53 VanDerWaalsContact C-N 3.26Å; K51-Y53 PolarHBondContact O-N 2.94Å; Y53-E55 VanDerWaalsContact C-N 3.31Å; Y53-E55 PolarHBondContact O-N 2.97Å; Y53-M56 PolarHBondContact O-N 3.2Å; Y53-C57 HydrophobicContact CD2-CB 4.15Å; Y53-C57 WeakPolarHBondContact CD2-SG 3.25Å; Y53-C57 HydrophobicContact CE2-CB 4.06Å; Y53-C57 WeakPolarHBondContact CE2-SG 3.32Å; Y53-C57 VanDerWaalsContact O-CB 3.28Å; Y53-C57 WeakPolarHBondContact O-CB 3.44Å; Y53-C57 PolarHBondContact O-N 2.93Å; Y53-V62 HydrophobicContact CD1-CG1 4.29Å; Y53-V62 HydrophobicContact CD2-CG2 4.34Å; Y53-V62 HydrophobicContact CE1-CB 4.44Å; Y53-V62 HydrophobicContact CE1-CG1 3.79Å; Y53-V62 HydrophobicContact CE1-CG2 4.39Å; Y53-V62 HydrophobicContact CE2-CG2 4.04Å; Y53-F65 HydrophobicContact CE2-CD2 4.36Å; Y53-F65 WeakPolarHBondContact OH-CB 3.38Å; Y53-F65 VanDerWaalsContact OH-CD2 3.22Å; Y53-F65 WeakPolarHBondContact OH-CD2 3.39Å
54E94.5Very high93.9Very high104 Ų10480 Ų8049%0.48637%0.372SS..Hα-helixtrans-69.5-25175.3-70.3-180174.800113.6R50 K51 V62R50-E54 IonicContact CZ-OE1 3.89Å; R50-E54 VanDerWaalsContact CZ-OE1 3.29Å; R50-E54 IonicContact NE-OE1 3.28Å; R50-E54 PolarHBondContact NE-OE1 3.49Å; R50-E54 IonicContact NH2-OE1 2.76Å; R50-E54 PolarHBondContact NH2-OE1 3.11Å; R50-E54 WeakPolarHBondContact O-CG 3.42Å; R50-E54 PolarHBondContact O-N 3.39Å; K51-E54 PolarHBondContact O-N 2.91Å; E54-V62 HydrophobicContact CG-CG1 4.33Å
55E93.5Very high94Very high124 Ų12474.9 Ų74.958%0.57935%0.35SS*.Hα-helixtrans-80.3-37.4174.8-74.7174.1172.300112.7K51 L52 Y53K51-E55 WeakPolarHBondContact CE-OE1 3.38Å; K51-E55 HydrophobicContact CG-CG 4.46Å; K51-E55 IonicContact NZ-OE1 2.77Å; K51-E55 WeakPolarHBondContact O-CB 3.06Å; K51-E55 WeakPolarHBondContact O-CG 3.03Å; K51-E55 PolarHBondContact O-N 3.39Å; L52-E55 PolarHBondContact O-N 2.89Å; Y53-E55 VanDerWaalsContact C-N 3.31Å; Y53-E55 PolarHBondContact O-N 2.97Å
56M91.8Very high94Very high86 Ų8671.7 Ų71.742%0.42434%0.335SS..Hα-helixtrans-89.7-18.2-174.3-66.8-68.6172.800113.6S19 L52 Y53S19-M56 WeakPolarHBondContact OG-CB 2.98Å; L52-M56 HydrophobicContact CD1-CE 3.58Å; L52-M56 HydrophobicContact CD1-CG 3.84Å; L52-M56 HydrophobicContact CG-CG 4.16Å; L52-M56 VanDerWaalsContact O-CB 3.29Å; L52-M56 WeakPolarHBondContact O-CB 3.33Å; L52-M56 WeakPolarHBondContact O-CG 3.27Å; L52-M56 PolarHBondContact O-N 3.45Å; Y53-M56 PolarHBondContact O-N 3.2Å
57C93.2Very high93.9Very high6 Ų677.7 Ų77.74%0.04136%0.362CS..SBendtrans-116.6141179.9-66.40000111.6C16 Y53 V62C16-C57 WeakPolarHBondContact CA-SG 3.05Å; C16-C57 HydrophobicContact CB-CB 4.04Å; C16-C57 WeakPolarHBondContact CB-SG 3.4Å; C16-C57 PolarHBondContact O-SG 3.31Å; C16-C57 WeakPolarHBondContact SG-CB 3.42Å; C16-C57 CovalentContact SG-SG 2.02Å; C16-C57 PolarHBondContact SG-SG 3.47Å; Y53-C57 HydrophobicContact CD2-CB 4.15Å; Y53-C57 WeakPolarHBondContact CD2-SG 3.25Å; Y53-C57 HydrophobicContact CE2-CB 4.06Å; Y53-C57 WeakPolarHBondContact CE2-SG 3.32Å; Y53-C57 VanDerWaalsContact O-CB 3.28Å; Y53-C57 WeakPolarHBondContact O-CB 3.44Å; Y53-C57 PolarHBondContact O-N 2.93Å; C57-V62 HydrophobicContact CB-CG2 3.55Å
58P91.6Very high93.8Very high23 Ų2379.9 Ų79.915%0.14936%0.363CS..  trans-58.2143.1167.9-19.631.5000110.3L8 V60 W61 V62L8-P58 HydrophobicContact CD1-CG 3.92Å; L8-P58 HydrophobicContact CD2-CG 3.7Å; L8-P58 HydrophobicContact CG-CG 3.74Å; P58-V60 PolarHBondContact O-N 3.33Å; P58-W61 WeakPolarHBondContact O-CA 3.48Å; P58-W61 WeakPolarHBondContact O-CB 3.01Å; P58-W61 PolarHBondContact O-N 3.27Å; P58-V62 PolarHBondContact O-N 3.34Å
59R90.6Very high93.6Very high215 Ų21574.3 Ų74.381%0.81134%0.338SS*.Hα-helixtrans-53.8-34.5-177.6-166175.9-145.5-82.7-4.7113.6V62 N63R59-V62 PolarHBondContact O-N 3.35Å; R59-N63 WeakPolarHBondContact O-CB 3.1Å; R59-N63 PolarHBondContact O-N 3.29Å
60V89.9Confident93.5Very high79 Ų7976.1 Ų76.148%0.47935%0.349SS..Hα-helixtrans-63.8-42.7176.9173.90000111.2D6 P58 F64D6-V60 VanDerWaalsContact OD1-CB 3.24Å; D6-V60 WeakPolarHBondContact OD1-CB 3.46Å; D6-V60 WeakPolarHBondContact OD1-CG2 3.25Å; P58-V60 PolarHBondContact O-N 3.33Å; V60-F64 WeakPolarHBondContact O-CB 3.35Å; V60-F64 PolarHBondContact O-N 3.03Å
61W91.6Very high93.4Very high58 Ų5878.5 Ų78.522%0.2236%0.361CS..Hα-helixtrans-66.9-44.7176.5-78.271.9000111.5D6 L8 W17 P58 N63 F64 F65D6-W61 PolarHBondContact O-NE1 2.93Å; D6-W61 VanDerWaalsContact O-NE1 3.09Å; L8-W61 HydrophobicContact CD1-CD2 3.76Å; L8-W61 HydrophobicContact CD1-CE3 4.31Å; L8-W61 HydrophobicContact CD1-CG 4.02Å; L8-W61 HydrophobicContact CD1-CZ2 4.07Å; W17-W61 AromaticContact NE1-CZ3 3.55Å; P58-W61 WeakPolarHBondContact O-CA 3.48Å; P58-W61 WeakPolarHBondContact O-CB 3.01Å; P58-W61 PolarHBondContact O-N 3.27Å; W61-N63 PolarHBondContact O-N 3.4Å; W61-F64 PolarHBondContact O-N 3.45Å; W61-F65 HydrophobicContact CB-CD2 4.44Å; W61-F65 HydrophobicContact CB-CE2 4.26Å; W61-F65 HydrophobicContact CD2-CE2 4.49Å; W61-F65 HydrophobicContact CE3-CE1 4.48Å; W61-F65 AromaticContact CE3-CE2 3.53Å; W61-F65 HydrophobicContact CE3-CE2 3.53Å; W61-F65 AromaticContact CE3-CZ 3.46Å; W61-F65 HydrophobicContact CE3-CZ 3.46Å; W61-F65 VanDerWaalsContact CE3-CZ 3.46Å; W61-F65 HydrophobicContact CZ3-CE2 4.27Å; W61-F65 AromaticContact CZ3-CZ 3.76Å; W61-F65 HydrophobicContact CZ3-CZ 3.76Å; W61-F65 WeakPolarHBondContact O-CB 3.41Å; W61-F65 WeakPolarHBondContact O-CD2 3.38Å; W61-F65 WeakPolarHBondContact O-CG 3.29Å; W61-F65 PolarHBondContact O-N 2.78Å
62V94.1Very high93.3Very high6 Ų676.4 Ų76.44%0.03635%0.354CS..Hα-helixtrans-55.4-53.6175.8176.20000110.5Y53 E54 C57 P58 R59 F64 F65 D66Y53-V62 HydrophobicContact CD1-CG1 4.29Å; Y53-V62 HydrophobicContact CD2-CG2 4.34Å; Y53-V62 HydrophobicContact CE1-CB 4.44Å; Y53-V62 HydrophobicContact CE1-CG1 3.79Å; Y53-V62 HydrophobicContact CE1-CG2 4.39Å; Y53-V62 HydrophobicContact CE2-CG2 4.04Å; E54-V62 HydrophobicContact CG-CG1 4.33Å; C57-V62 HydrophobicContact CB-CG2 3.55Å; P58-V62 PolarHBondContact O-N 3.34Å; R59-V62 PolarHBondContact O-N 3.35Å; V62-F64 VanDerWaalsContact C-N 3.33Å; V62-F64 PolarHBondContact O-N 3.48Å; V62-F65 PolarHBondContact O-N 3.01Å; V62-D66 WeakPolarHBondContact O-CB 3.49Å; V62-D66 PolarHBondContact O-N 3.47Å
63N93.2Very high93.2Very high75 Ų7576.7 Ų76.740%0.40136%0.355SS..Hα-helixtrans-61-39.8179.6-179.754.1000112.7R59 W61 K67R59-N63 WeakPolarHBondContact O-CB 3.1Å; R59-N63 PolarHBondContact O-N 3.29Å; W61-N63 PolarHBondContact O-N 3.4Å; N63-K67 WeakPolarHBondContact O-CB 3.38Å; N63-K67 VanDerWaalsContact O-CG 3.28Å; N63-K67 WeakPolarHBondContact O-CG 3.46Å; N63-K67 PolarHBondContact O-N 2.83Å; N63-K67 VanDerWaalsContact O-N 3.08Å; N63-K67 VanDerWaalsContact OD1-CE 3.31Å; N63-K67 WeakPolarHBondContact OD1-CE 3.39Å
64F92.5Very high93.1Very high121 Ų12182.3 Ų82.353%0.53138%0.38SS..Hα-helixtrans-62.8-46.5176.3173.5-101.2000111.7V60 W61 V62 K68V60-F64 WeakPolarHBondContact O-CB 3.35Å; V60-F64 PolarHBondContact O-N 3.03Å; W61-F64 PolarHBondContact O-N 3.45Å; V62-F64 VanDerWaalsContact C-N 3.33Å; V62-F64 PolarHBondContact O-N 3.48Å; F64-K68 HydrophobicContact CE1-CD 4.34Å; F64-K68 HydrophobicContact CZ-CD 4.5Å; F64-K68 VanDerWaalsContact O-CB 3.27Å; F64-K68 WeakPolarHBondContact O-CB 3.39Å; F64-K68 PolarHBondContact O-N 3.29Å
65F94.9Very high93.2Very high20 Ų2081.3 Ų81.39%0.08837%0.374CS..Hα-helixtrans-68-41.1179.9-73.1-46.6000112.9W17 R20 Y53 W61 V62 K68 R69W17-F65 AromaticContact CD1-CZ 3.87Å; W17-F65 AromaticContact NE1-CZ 3.71Å; R20-F65 HydrophobicContact CG-CD2 4.3Å; R20-F65 HydrophobicContact CG-CG 4.5Å; R20-F65 VanDerWaalsContact NH1-CE1 3.31Å; Y53-F65 HydrophobicContact CE2-CD2 4.36Å; Y53-F65 WeakPolarHBondContact OH-CB 3.38Å; Y53-F65 VanDerWaalsContact OH-CD2 3.22Å; Y53-F65 WeakPolarHBondContact OH-CD2 3.39Å; W61-F65 HydrophobicContact CB-CD2 4.44Å; W61-F65 HydrophobicContact CB-CE2 4.26Å; W61-F65 HydrophobicContact CD2-CE2 4.49Å; W61-F65 HydrophobicContact CE3-CE1 4.48Å; W61-F65 AromaticContact CE3-CE2 3.53Å; W61-F65 HydrophobicContact CE3-CE2 3.53Å; W61-F65 AromaticContact CE3-CZ 3.46Å; W61-F65 HydrophobicContact CE3-CZ 3.46Å; W61-F65 VanDerWaalsContact CE3-CZ 3.46Å; W61-F65 HydrophobicContact CZ3-CE2 4.27Å; W61-F65 AromaticContact CZ3-CZ 3.76Å; W61-F65 HydrophobicContact CZ3-CZ 3.76Å; W61-F65 WeakPolarHBondContact O-CB 3.41Å; W61-F65 WeakPolarHBondContact O-CD2 3.38Å; W61-F65 WeakPolarHBondContact O-CG 3.29Å; W61-F65 PolarHBondContact O-N 2.78Å; V62-F65 PolarHBondContact O-N 3.01Å; F65-K68 PolarHBondContact O-N 3.26Å; F65-R69 PolarHBondContact O-N 3.46Å
66D94.5Very high93.3Very high27 Ų2778 Ų7814%0.14437%0.368CS..Hα-helixtrans-58.5-53176.1-69.2-6.2000109.6W24 R50 V62 K68 R69 D70W24-D66 VanDerWaalsContact CZ2-OD1 3.27Å; W24-D66 WeakPolarHBondContact CZ2-OD1 3.45Å; R50-D66 IonicContact CZ-OD2 2.76Å; R50-D66 VanDerWaalsContact CZ-OD2 3.28Å; R50-D66 VanDerWaalsContact NH1-CG 3.34Å; R50-D66 IonicContact NH1-OD1 2.75Å; R50-D66 PolarHBondContact NH1-OD1 3.5Å; R50-D66 VanDerWaalsContact NH1-OD1 3.15Å; R50-D66 IonicContact NH1-OD2 2.65Å; R50-D66 PolarHBondContact NH1-OD2 3.1Å; R50-D66 IonicContact NH2-OD2 2.77Å; R50-D66 PolarHBondContact NH2-OD2 3.48Å; V62-D66 WeakPolarHBondContact O-CB 3.49Å; V62-D66 PolarHBondContact O-N 3.47Å; D66-K68 VanDerWaalsContact C-N 3.32Å; D66-K68 PolarHBondContact O-N 2.82Å; D66-R69 WeakPolarHBondContact O-CB 3.24Å; D66-R69 PolarHBondContact O-N 3.4Å; D66-R69 VanDerWaalsContact O-N 3.14Å; D66-D70 PolarHBondContact O-N 3.26Å
67K94.9Very high93.4Very high127 Ų12780.7 Ų80.755%0.55238%0.377SS*.Hα-helixtrans-60-40.2176.6-72.8179.6177.2-171.30113.3N63 R69 D70 F71N63-K67 WeakPolarHBondContact O-CB 3.38Å; N63-K67 VanDerWaalsContact O-CG 3.28Å; N63-K67 WeakPolarHBondContact O-CG 3.46Å; N63-K67 PolarHBondContact O-N 2.83Å; N63-K67 VanDerWaalsContact O-N 3.08Å; N63-K67 VanDerWaalsContact OD1-CE 3.31Å; N63-K67 WeakPolarHBondContact OD1-CE 3.39Å; K67-R69 VanDerWaalsContact C-N 3.32Å; K67-D70 PolarHBondContact O-N 2.86Å; K67-F71 WeakPolarHBondContact O-CB 3.4Å; K67-F71 PolarHBondContact O-N 3.42Å
68K94.6Very high93.5Very high108 Ų10884.5 Ų84.547%0.4739%0.393SS..Hα-helixtrans-60.6-45.6177.5-178.8176.5179.3179.10110.1F64 F65 D66 F71 E72F64-K68 HydrophobicContact CE1-CD 4.34Å; F64-K68 HydrophobicContact CZ-CD 4.5Å; F64-K68 VanDerWaalsContact O-CB 3.27Å; F64-K68 WeakPolarHBondContact O-CB 3.39Å; F64-K68 PolarHBondContact O-N 3.29Å; F65-K68 PolarHBondContact O-N 3.26Å; D66-K68 VanDerWaalsContact C-N 3.32Å; D66-K68 PolarHBondContact O-N 2.82Å; K68-F71 PolarHBondContact O-N 2.96Å; K68-E72 HydrophobicContact CG-CG 4.47Å; K68-E72 WeakPolarHBondContact O-CG 3.36Å; K68-E72 PolarHBondContact O-N 3.4Å
69R92.2Very high93.7Very high53 Ų5389.6 Ų89.620%0.241%0.413CS..Hα-helixtrans-61.6-47177.6179.9-173.4162.3125.2-2.3111.3W24 F65 D66 K67 F71 E72 L73W24-R69 VanDerWaalsContact CD2-NH1 3.34Å; W24-R69 VanDerWaalsContact CE3-CD 3.4Å; W24-R69 HydrophobicContact CH2-CB 4.3Å; W24-R69 HydrophobicContact CH2-CG 4.38Å; W24-R69 HydrophobicContact CZ2-CB 4.16Å; F65-R69 PolarHBondContact O-N 3.46Å; D66-R69 WeakPolarHBondContact O-CB 3.24Å; D66-R69 PolarHBondContact O-N 3.4Å; D66-R69 VanDerWaalsContact O-N 3.14Å; K67-R69 VanDerWaalsContact C-N 3.32Å; R69-F71 PolarHBondContact O-N 3.34Å; R69-E72 PolarHBondContact O-N 2.99Å; R69-L73 HydrophobicContact CG-CD1 4.04Å; R69-L73 HydrophobicContact CG-CG 4.4Å; R69-L73 WeakPolarHBondContact O-CG 3.35Å; R69-L73 PolarHBondContact O-N 2.9Å
70D92.3Very high93.8Very high101 Ų10185 Ų8554%0.5440%0.401SS..Hα-helixtrans-58.5-41.4178.8-66.3-20000111.4D66 K67 L73 F74D66-D70 PolarHBondContact O-N 3.26Å; K67-D70 PolarHBondContact O-N 2.86Å; D70-L73 PolarHBondContact O-N 2.97Å; D70-F74 WeakPolarHBondContact O-CB 3.29Å; D70-F74 PolarHBondContact O-N 2.88Å
71F95.7Very high94Very high112 Ų11285.7 Ų85.749%0.49140%0.399SS..Hα-helixtrans-66.2-43.2176.4-177.2-109.1000112.9K67 K68 R69 F74 K75K67-F71 WeakPolarHBondContact O-CB 3.4Å; K67-F71 PolarHBondContact O-N 3.42Å; K68-F71 PolarHBondContact O-N 2.96Å; R69-F71 PolarHBondContact O-N 3.34Å; F71-F74 PolarHBondContact O-N 3.46Å; F71-K75 HydrophobicContact CD1-CD 4.14Å; F71-K75 HydrophobicContact CE1-CD 3.5Å; F71-K75 HydrophobicContact CE1-CG 4.12Å; F71-K75 HydrophobicContact CE2-CG 4.34Å; F71-K75 HydrophobicContact CZ-CD 3.72Å; F71-K75 HydrophobicContact CZ-CG 4.02Å; F71-K75 WeakPolarHBondContact O-CG 3.49Å; F71-K75 PolarHBondContact O-N 3.49Å
72E94.6Very high94.1Very high86 Ų8689 Ų8940%0.40242%0.417SS..Hα-helixtrans-63.4-41.3175.4-67.5-52137.900111.7K68 R69 K75 A76K68-E72 HydrophobicContact CG-CG 4.47Å; K68-E72 WeakPolarHBondContact O-CG 3.36Å; K68-E72 PolarHBondContact O-N 3.4Å; R69-E72 PolarHBondContact O-N 2.99Å; E72-K75 VanDerWaalsContact CD-CE 3.41Å; E72-K75 PolarHBondContact O-N 3.49Å; E72-K75 WeakPolarHBondContact OE1-CE 3.29Å; E72-K75 IonicContact OE1-NZ 2.72Å; E72-K75 PolarHBondContact OE1-NZ 3.27Å; E72-K75 WeakPolarHBondContact OE2-CE 3.26Å; E72-K75 IonicContact OE2-NZ 3.15Å; E72-K75 PolarHBondContact OE2-NZ 3.29Å; E72-A76 WeakPolarHBondContact O-CB 3.33Å; E72-A76 PolarHBondContact O-N 3.4Å
73L91.3Very high94.1Very high80 Ų8093 Ų9342%0.41944%0.437SS..Hα-helixtrans-63.8-41.8174.7-72.8173.3000111.9R69 D70 A76 K77R69-L73 HydrophobicContact CG-CD1 4.04Å; R69-L73 HydrophobicContact CG-CG 4.4Å; R69-L73 WeakPolarHBondContact O-CG 3.35Å; R69-L73 PolarHBondContact O-N 2.9Å; D70-L73 PolarHBondContact O-N 2.97Å; L73-A76 PolarHBondContact O-N 3.39Å; L73-K77 WeakPolarHBondContact O-CG 3.37Å; L73-K77 PolarHBondContact O-N 2.61Å
74F94.1Very high94.1Very high117 Ų11794.2 Ų94.251%0.51344%0.443SS..Hα-helixtrans-60.2-48175.3173-98.7000111.6D70 F71 A76 K77 K78D70-F74 WeakPolarHBondContact O-CB 3.29Å; D70-F74 PolarHBondContact O-N 2.88Å; F71-F74 PolarHBondContact O-N 3.46Å; F74-A76 PolarHBondContact O-N 3.24Å; F74-K77 PolarHBondContact O-N 3.34Å; F74-K78 HydrophobicContact CD1-CG 4.45Å; F74-K78 HydrophobicContact CD2-CG 4.46Å; F74-K78 HydrophobicContact CE1-CG 3.98Å; F74-K78 HydrophobicContact CE2-CG 4.01Å; F74-K78 HydrophobicContact CZ-CD 4.26Å; F74-K78 HydrophobicContact CZ-CG 3.75Å; F74-K78 WeakPolarHBondContact O-CG 3.37Å; F74-K78 PolarHBondContact O-N 2.87Å
75K96Very high94Very high84 Ų8493.3 Ų93.337%0.36544%0.444SS..Hα-helixtrans-61-44.3176.6-75.6-172-63.5170.20112.2F71 E72 K77 K78 F79F71-K75 HydrophobicContact CD1-CD 4.14Å; F71-K75 HydrophobicContact CE1-CD 3.5Å; F71-K75 HydrophobicContact CE1-CG 4.12Å; F71-K75 HydrophobicContact CE2-CG 4.34Å; F71-K75 HydrophobicContact CZ-CD 3.72Å; F71-K75 HydrophobicContact CZ-CG 4.02Å; F71-K75 WeakPolarHBondContact O-CG 3.49Å; F71-K75 PolarHBondContact O-N 3.49Å; E72-K75 VanDerWaalsContact CD-CE 3.41Å; E72-K75 PolarHBondContact O-N 3.49Å; E72-K75 WeakPolarHBondContact OE1-CE 3.29Å; E72-K75 IonicContact OE1-NZ 2.72Å; E72-K75 PolarHBondContact OE1-NZ 3.27Å; E72-K75 WeakPolarHBondContact OE2-CE 3.26Å; E72-K75 IonicContact OE2-NZ 3.15Å; E72-K75 PolarHBondContact OE2-NZ 3.29Å; K75-K77 PolarHBondContact O-N 2.65Å; K75-K78 PolarHBondContact O-N 3.32Å; K75-F79 WeakPolarHBondContact O-CB 3.42Å; K75-F79 PolarHBondContact O-N 2.91Å
76A95.1Very high93.7Very high55 Ų5595 Ų9546%0.45546%0.458SS..Hα-helixtrans-60.2-46.7179.100000111.3E72 L73 F74 K78 F79 E80E72-A76 WeakPolarHBondContact O-CB 3.33Å; E72-A76 PolarHBondContact O-N 3.4Å; L73-A76 PolarHBondContact O-N 3.39Å; F74-A76 PolarHBondContact O-N 3.24Å; A76-K78 PolarHBondContact O-N 3.33Å; A76-F79 PolarHBondContact O-N 2.76Å; A76-E80 WeakPolarHBondContact O-CB 3.28Å; A76-E80 PolarHBondContact O-N 3.14Å
77K94.1Very high93.3Very high142 Ų14296.5 Ų96.562%0.61748%0.475SS*.Hα-helixtrans-60.2-44.3175.4-73176.9179.1-175.60112L73 F74 K75 E80 E81L73-K77 WeakPolarHBondContact O-CG 3.37Å; L73-K77 PolarHBondContact O-N 2.61Å; F74-K77 PolarHBondContact O-N 3.34Å; K75-K77 PolarHBondContact O-N 2.65Å; K77-E80 PolarHBondContact O-N 3.01Å; K77-E81 WeakPolarHBondContact O-CB 3.05Å; K77-E81 PolarHBondContact O-N 3.4Å
78K94.7Very high92.7Very high86 Ų8694.2 Ų94.237%0.37447%0.474SS..Hα-helixtrans-63.1-42.9178.6-77-72.6161.6-152.10112.4F74 K75 A76 E81 E82F74-K78 HydrophobicContact CD1-CG 4.45Å; F74-K78 HydrophobicContact CD2-CG 4.46Å; F74-K78 HydrophobicContact CE1-CG 3.98Å; F74-K78 HydrophobicContact CE2-CG 4.01Å; F74-K78 HydrophobicContact CZ-CD 4.26Å; F74-K78 HydrophobicContact CZ-CG 3.75Å; F74-K78 WeakPolarHBondContact O-CG 3.37Å; F74-K78 PolarHBondContact O-N 2.87Å; K75-K78 PolarHBondContact O-N 3.32Å; A76-K78 PolarHBondContact O-N 3.33Å; K78-E81 IonicContact NZ-OE2 3.01Å; K78-E81 PolarHBondContact NZ-OE2 3.24Å; K78-E81 PolarHBondContact O-N 2.98Å; K78-E82 WeakPolarHBondContact O-CG 3.49Å; K78-E82 PolarHBondContact O-N 3.34Å
79F96.1Very high91.5Very high130 Ų13093.4 Ų93.457%0.5748%0.483SS*.Hα-helixtrans-62.8-43.2176.1179.3-106.5000112.2K75 A76 E82 L83K75-F79 WeakPolarHBondContact O-CB 3.42Å; K75-F79 PolarHBondContact O-N 2.91Å; A76-F79 PolarHBondContact O-N 2.76Å; F79-E82 PolarHBondContact O-N 2.94Å; F79-L83 HydrophobicContact CD1-CD1 3.85Å; F79-L83 HydrophobicContact CE1-CD1 3.36Å; F79-L83 HydrophobicContact CE1-CG 4.18Å; F79-L83 HydrophobicContact CE2-CD1 4.46Å; F79-L83 HydrophobicContact CE2-CG 4.46Å; F79-L83 HydrophobicContact CZ-CD1 3.71Å; F79-L83 HydrophobicContact CZ-CD2 4.32Å; F79-L83 HydrophobicContact CZ-CG 4.14Å; F79-L83 WeakPolarHBondContact O-CG 3.38Å; F79-L83 PolarHBondContact O-N 3.36Å
80E94.3Very high90.1Very high118 Ų11899 Ų9955%0.55151%0.511SS*.Hα-helixtrans-61.5-44.4174.9-176.2177.4-170.100111.9A76 K77 E82 L83 L84A76-E80 WeakPolarHBondContact O-CB 3.28Å; A76-E80 PolarHBondContact O-N 3.14Å; K77-E80 PolarHBondContact O-N 3.01Å; E80-E82 PolarHBondContact O-N 2.92Å; E80-L83 WeakPolarHBondContact O-CB 3.3Å; E80-L83 PolarHBondContact O-N 2.75Å; E80-L84 HydrophobicContact CG-CD1 4.16Å; E80-L84 VanDerWaalsContact O-CG 3.3Å; E80-L84 WeakPolarHBondContact O-CG 3.37Å; E80-L84 PolarHBondContact O-N 3.46Å
81E93.7Very high88.2Confident93 Ų93101.8 Ų101.844%0.43554%0.539SS..Hα-helixtrans-60.8-43.3177.5-152.5174.7-157.300111.7K77 K78 L84 N85K77-E81 WeakPolarHBondContact O-CB 3.05Å; K77-E81 PolarHBondContact O-N 3.4Å; K78-E81 IonicContact NZ-OE2 3.01Å; K78-E81 PolarHBondContact NZ-OE2 3.24Å; K78-E81 PolarHBondContact O-N 2.98Å; E81-L84 PolarHBondContact O-N 3.41Å; E81-N85 WeakPolarHBondContact O-CB 3.48Å; E81-N85 PolarHBondContact O-N 3.48Å; E81-N85 PolarHBondContact O-ND2 3.45Å; E81-N85 VanDerWaalsContact O-ND2 3.07Å
82E93.9Very high87.9Confident128 Ų128101.3 Ų101.360%0.59854%0.541SS*.Hα-helixtrans-62.3-43.2174.6-74.7172.2-173.400112.2K78 F79 E80 N85 S86K78-E82 WeakPolarHBondContact O-CG 3.49Å; K78-E82 PolarHBondContact O-N 3.34Å; F79-E82 PolarHBondContact O-N 2.94Å; E80-E82 PolarHBondContact O-N 2.92Å; E82-N85 PolarHBondContact O-N 3.25Å; E82-S86 WeakPolarHBondContact O-CB 3.4Å; E82-S86 PolarHBondContact O-N 3.44Å; E82-S86 PolarHBondContact O-OG 2.81Å
83L94.3Very high87.5Confident89 Ų89102.1 Ų102.147%0.46655%0.548SS..Hα-helixtrans-61.2-47.2175.1-73.9174000111.5F79 E80 N85 S86 A87F79-L83 HydrophobicContact CD1-CD1 3.85Å; F79-L83 HydrophobicContact CE1-CD1 3.36Å; F79-L83 HydrophobicContact CE1-CG 4.18Å; F79-L83 HydrophobicContact CE2-CD1 4.46Å; F79-L83 HydrophobicContact CE2-CG 4.46Å; F79-L83 HydrophobicContact CZ-CD1 3.71Å; F79-L83 HydrophobicContact CZ-CD2 4.32Å; F79-L83 HydrophobicContact CZ-CG 4.14Å; F79-L83 WeakPolarHBondContact O-CG 3.38Å; F79-L83 PolarHBondContact O-N 3.36Å; E80-L83 WeakPolarHBondContact O-CB 3.3Å; E80-L83 PolarHBondContact O-N 2.75Å; L83-N85 PolarHBondContact O-N 2.94Å; L83-S86 PolarHBondContact O-N 2.97Å; L83-S86 PolarHBondContact O-OG 2.96Å; L83-A87 PolarHBondContact O-N 3.39Å
84L92.7Very high87.3Confident101 Ų101103.3 Ų103.353%0.52956%0.555SS.*Hα-helixtrans-62.6-40.4179.2-69.7172000112.3E80 E81 A87 S88E80-L84 HydrophobicContact CG-CD1 4.16Å; E80-L84 VanDerWaalsContact O-CG 3.3Å; E80-L84 WeakPolarHBondContact O-CG 3.37Å; E80-L84 PolarHBondContact O-N 3.46Å; E81-L84 PolarHBondContact O-N 3.41Å; L84-A87 PolarHBondContact O-N 3.07Å; L84-S88 WeakPolarHBondContact O-CB 3.41Å; L84-S88 PolarHBondContact O-N 2.96Å; L84-S88 PolarHBondContact O-OG 2.76Å
85N89.8Confident86.9Confident103 Ų103102.5 Ų102.555%0.55156%0.558SS**Hα-helixtrans-67.5-38.9176.1-70.8-30.1000112.1E81 E82 L83 A87 S88 S89E81-N85 WeakPolarHBondContact O-CB 3.48Å; E81-N85 PolarHBondContact O-N 3.48Å; E81-N85 PolarHBondContact O-ND2 3.45Å; E81-N85 VanDerWaalsContact O-ND2 3.07Å; E82-N85 PolarHBondContact O-N 3.25Å; L83-N85 PolarHBondContact O-N 2.94Å; N85-A87 VanDerWaalsContact C-N 3.34Å; N85-S88 PolarHBondContact O-N 2.82Å; N85-S89 WeakPolarHBondContact O-CB 3.42Å; N85-S89 PolarHBondContact O-N 3.23Å; N85-S89 PolarHBondContact O-OG 3.32Å
86S88Confident86.3Confident55 Ų55103.7 Ų103.739%0.38557%0.57SS.*Hα-helixtrans-67-34.5175.777.20000112.7E82 L83 S89 Q90E82-S86 WeakPolarHBondContact O-CB 3.4Å; E82-S86 PolarHBondContact O-N 3.44Å; E82-S86 PolarHBondContact O-OG 2.81Å; L83-S86 PolarHBondContact O-N 2.97Å; L83-S86 PolarHBondContact O-OG 2.96Å; S86-S89 PolarHBondContact O-OG 3.39Å; S86-Q90 WeakPolarHBondContact O-CG 3.41Å
87A87Confident85.7Confident59 Ų59106.9 Ų106.949%0.48858%0.578SS.*Hα-helixtrans-72.5-38.4175.100000111.9L83 L84 N85L83-A87 PolarHBondContact O-N 3.39Å; L84-A87 PolarHBondContact O-N 3.07Å; N85-A87 VanDerWaalsContact C-N 3.34Å
88S81.5Confident85.1Confident78 Ų78104.4 Ų104.455%0.54558%0.575SS.*Hα-helixtrans-74.3-30-179.1-560000113.1L84 N85 Q90 S91L84-S88 WeakPolarHBondContact O-CB 3.41Å; L84-S88 PolarHBondContact O-N 2.96Å; L84-S88 PolarHBondContact O-OG 2.76Å; N85-S88 PolarHBondContact O-N 2.82Å; S88-Q90 PolarHBondContact O-N 3.01Å; S88-S91 PolarHBondContact O-N 3.42Å
89S70.4Confident84.4Confident92 Ų92105.8 Ų105.864%0.64359%0.59SS**THydrogen-bonded Turntrans-77.2-6.4177.850.80000114.4N85 S86N85-S89 WeakPolarHBondContact O-CB 3.42Å; N85-S89 PolarHBondContact O-N 3.23Å; N85-S89 PolarHBondContact O-OG 3.32Å; S86-S89 PolarHBondContact O-OG 3.39Å
90Q62.1Low83.4Confident170 Ų170103.8 Ų103.879%0.79459%0.592SS**THydrogen-bonded Turntrans-94.6-0.1171.8-65.8179.711.700113S86 S88S86-Q90 WeakPolarHBondContact O-CG 3.41Å; S88-Q90 PolarHBondContact O-N 3.01Å
91S53.6Low82.4Confident160 Ų160102.5 Ų102.5100%1.11960%0.596SS**  trans-100.60175.9-49.90000110.7S88S88-S91 PolarHBondContact O-N 3.42Å

Retrieved 91 of 91 residues in 249.2 ms (Link to these results)

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