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Antitoxin MazE

Antitoxin component of a type II toxin-antitoxin (TA) system. Labile antitoxin that binds to cognate MazF toxin and counteracts its endoribonuclease activity.

AlphaFold DB (Q2FWI7), UniProt , Accession Q99SI6, Species STAAM (Staphylococcus aureus (strain Mu50 / ATCC 700699)), Gene mazE, Length 56 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
1M67.3Low86.8Confident218 Ų218116.1 Ų116.1100%1.07460%0.598SS**  0-40.10-65.1-174-156.900113.1S3 F4 S5M1-S3 PolarHBondContact O-N 3.24Å; M1-F4 PolarHBondContact O-N 3.32Å; M1-S5 PolarHBondContact O-N 2.94Å
2L81.2Confident87.6Confident136 Ų136115.4 Ų115.471%0.71260%0.595SS**Hα-helixtrans-57.5-42.3179.4-70.1166.2000115.1F4 S5 Q6L2-F4 VanDerWaalsContact C-N 3.3Å; L2-F4 PolarHBondContact O-N 3.38Å; L2-S5 PolarHBondContact O-N 3.37Å; L2-S5 PolarHBondContact O-OG 3.41Å; L2-Q6 WeakPolarHBondContact O-CG 3.45Å; L2-Q6 PolarHBondContact O-N 2.84Å
3S82.4Confident88.4Confident73 Ų73114 Ų11451%0.5158%0.584SS.*Hα-helixtrans-62.1-37.6178.3170.50000112.3M1 Q6 N7M1-S3 PolarHBondContact O-N 3.24Å; S3-Q6 PolarHBondContact O-N 3.03Å; S3-N7 WeakPolarHBondContact O-CB 3.46Å; S3-N7 VanDerWaalsContact O-CG 3.28Å; S3-N7 PolarHBondContact O-N 3.25Å; S3-N7 PolarHBondContact O-ND2 2.96Å
4F85.1Confident89Confident150 Ų150111.5 Ų111.566%0.65857%0.569SS**Hα-helixtrans-65.2-42.7176.5179.4-100.4000111.7M1 L2 R8M1-F4 PolarHBondContact O-N 3.32Å; L2-F4 VanDerWaalsContact C-N 3.3Å; L2-F4 PolarHBondContact O-N 3.38Å; F4-R8 WeakPolarHBondContact O-CB 3.39Å; F4-R8 PolarHBondContact O-N 3.23Å
5S86.7Confident89.6Confident45 Ų45108.5 Ų108.532%0.31556%0.562SS.*Hα-helixtrans-66.3-38.5176.561.20000112.2M1 L2 R8 S9M1-S5 PolarHBondContact O-N 2.94Å; L2-S5 PolarHBondContact O-N 3.37Å; L2-S5 PolarHBondContact O-OG 3.41Å; S5-R8 PolarHBondContact O-N 3.44Å; S5-S9 PolarHBondContact O-N 3.43Å; S5-S9 PolarHBondContact O-OG 3.38Å
6Q88Confident90.1Very high127 Ų127107.5 Ų107.559%0.59356%0.557SS**Hα-helixtrans-63.3-47.7176.4-74.7173.2-28.500111.8L2 S3 R8 S9 H10L2-Q6 WeakPolarHBondContact O-CG 3.45Å; L2-Q6 PolarHBondContact O-N 2.84Å; S3-Q6 PolarHBondContact O-N 3.03Å; Q6-R8 VanDerWaalsContact C-N 3.3Å; Q6-R8 PolarHBondContact O-N 3.31Å; Q6-S9 PolarHBondContact O-N 2.91Å; Q6-H10 WeakPolarHBondContact O-CB 3.44Å; Q6-H10 PolarHBondContact O-N 3.47Å
7N90Very high90.6Very high103 Ų103107.8 Ų107.855%0.55155%0.553SS**Hα-helixtrans-61-39.6177-71.9-27.1000111.8S3 H10 S11S3-N7 WeakPolarHBondContact O-CB 3.46Å; S3-N7 VanDerWaalsContact O-CG 3.28Å; S3-N7 PolarHBondContact O-N 3.25Å; S3-N7 PolarHBondContact O-ND2 2.96Å; N7-H10 PolarHBondContact O-N 3.14Å; N7-S11 WeakPolarHBondContact O-CB 3.36Å; N7-S11 PolarHBondContact O-N 2.92Å
8R91.7Very high91Very high160 Ų160106.6 Ų106.660%0.60455%0.545SS*.Hα-helixtrans-63.7-45.8175.5-167.9-174.276.9-151.64.6111.9F4 S5 Q6 S11 L12F4-R8 WeakPolarHBondContact O-CB 3.39Å; F4-R8 PolarHBondContact O-N 3.23Å; S5-R8 PolarHBondContact O-N 3.44Å; Q6-R8 VanDerWaalsContact C-N 3.3Å; Q6-R8 PolarHBondContact O-N 3.31Å; R8-S11 PolarHBondContact O-N 3.17Å; R8-L12 WeakPolarHBondContact O-CB 3.19Å; R8-L12 PolarHBondContact O-N 2.97Å
9S92.7Very high91.4Very high71 Ų71102.5 Ų102.550%0.49753%0.532SS..Hα-helixtrans-62.3-43.4177.5-65.30000111.7S5 Q6 L12 E13S5-S9 PolarHBondContact O-N 3.43Å; S5-S9 PolarHBondContact O-OG 3.38Å; Q6-S9 PolarHBondContact O-N 2.91Å; S9-L12 PolarHBondContact O-N 3.39Å; S9-E13 WeakPolarHBondContact O-CB 3.45Å; S9-E13 PolarHBondContact O-N 2.97Å
10H94.3Very high91.7Very high123 Ų123105.7 Ų105.757%0.56954%0.538SS*.Hα-helixtrans-62.8-44.6176.5-178.1-82.8000111.9Q6 N7 L12 E13 Q14Q6-H10 WeakPolarHBondContact O-CB 3.44Å; Q6-H10 PolarHBondContact O-N 3.47Å; N7-H10 PolarHBondContact O-N 3.14Å; H10-L12 VanDerWaalsContact C-N 3.32Å; H10-L12 PolarHBondContact O-N 3.4Å; H10-E13 PolarHBondContact O-N 2.8Å; H10-Q14 WeakPolarHBondContact O-CB 3.44Å; H10-Q14 PolarHBondContact O-N 3.27Å
11S95.3Very high92Very high71 Ų71105.1 Ų105.150%0.49754%0.544SS..Hα-helixtrans-60.2-42.8175.9-176.10000111.8N7 R8 Q14 S15N7-S11 WeakPolarHBondContact O-CB 3.36Å; N7-S11 PolarHBondContact O-N 2.92Å; R8-S11 PolarHBondContact O-N 3.17Å; S11-Q14 PolarHBondContact O-N 3.23Å; S11-S15 PolarHBondContact O-N 3.37Å; S11-S15 PolarHBondContact O-OG 2.92Å
12L96.7Very high93.5Very high108 Ų108101.9 Ų101.957%0.56553%0.526SS*.Hα-helixtrans-65.5-44.7178.3-178.764.5000111.4R8 S9 H10 Q14 S15 L16R8-L12 WeakPolarHBondContact O-CB 3.19Å; R8-L12 PolarHBondContact O-N 2.97Å; S9-L12 PolarHBondContact O-N 3.39Å; H10-L12 VanDerWaalsContact C-N 3.32Å; H10-L12 PolarHBondContact O-N 3.4Å; L12-Q14 VanDerWaalsContact C-N 3.3Å; L12-Q14 PolarHBondContact O-N 3.31Å; L12-S15 PolarHBondContact O-N 3.34Å; L12-L16 HydrophobicContact CG-CD1 4.24Å; L12-L16 VanDerWaalsContact O-CG 3.32Å; L12-L16 WeakPolarHBondContact O-CG 3.32Å; L12-L16 PolarHBondContact O-N 3.43Å
13E97.5Very high94.3Very high97 Ų9799.3 Ų99.345%0.45351%0.511SS..Hα-helixtrans-59.5-42.4176.4-172-172153.800111.5S9 H10 L16 K17S9-E13 WeakPolarHBondContact O-CB 3.45Å; S9-E13 PolarHBondContact O-N 2.97Å; H10-E13 PolarHBondContact O-N 2.8Å; E13-L16 PolarHBondContact O-N 2.94Å; E13-K17 WeakPolarHBondContact O-CG 3.43Å; E13-K17 PolarHBondContact O-N 2.93Å; E13-K17 WeakPolarHBondContact OE1-CE 3.39Å; E13-K17 IonicContact OE1-NZ 2.68Å; E13-K17 PolarHBondContact OE1-NZ 2.97Å
14Q97.5Very high95.1Very high79 Ų7998.1 Ų98.137%0.36951%0.506SS..Hα-helixtrans-63.3-47176.9-175.758.929.300111.7H10 S11 L12 L16 K17 E18H10-Q14 WeakPolarHBondContact O-CB 3.44Å; H10-Q14 PolarHBondContact O-N 3.27Å; S11-Q14 PolarHBondContact O-N 3.23Å; L12-Q14 VanDerWaalsContact C-N 3.3Å; L12-Q14 PolarHBondContact O-N 3.31Å; Q14-L16 VanDerWaalsContact C-N 3.29Å; Q14-L16 PolarHBondContact O-N 3.01Å; Q14-K17 PolarHBondContact O-N 3.22Å; Q14-E18 WeakPolarHBondContact CG-OE1 3.5Å; Q14-E18 PolarHBondContact NE2-OE1 3.36Å; Q14-E18 WeakPolarHBondContact O-CG 3.44Å; Q14-E18 PolarHBondContact O-N 2.99Å
15S97.5Very high95.7Very high67 Ų6797.7 Ų97.747%0.46951%0.511SS..Hα-helixtrans-62-36.3176.2-61.80000112.6S11 L12 G19S11-S15 PolarHBondContact O-N 3.37Å; S11-S15 PolarHBondContact O-OG 2.92Å; L12-S15 PolarHBondContact O-N 3.34Å; S15-G19 PolarHBondContact O-N 2.87Å
16L97.7Very high96.3Very high92 Ų9299.8 Ų99.848%0.48252%0.518SS..Hα-helixtrans-65.1-45.4174.5-74.1170.4000111.6L12 E13 Q14 E18 G19 Y20L12-L16 HydrophobicContact CG-CD1 4.24Å; L12-L16 VanDerWaalsContact O-CG 3.32Å; L12-L16 WeakPolarHBondContact O-CG 3.32Å; L12-L16 PolarHBondContact O-N 3.43Å; E13-L16 PolarHBondContact O-N 2.94Å; Q14-L16 VanDerWaalsContact C-N 3.29Å; Q14-L16 PolarHBondContact O-N 3.01Å; L16-E18 VanDerWaalsContact C-N 3.34Å; L16-E18 PolarHBondContact O-N 2.91Å; L16-G19 PolarHBondContact O-N 3.36Å; L16-Y20 WeakPolarHBondContact O-CD2 3.4Å; L16-Y20 PolarHBondContact O-N 3.41Å
17K97.9Very high96.7Very high112 Ų11297.4 Ų97.449%0.48751%0.509SS..Hα-helixtrans-59.2-45.9176.9-74.7174.3-176.7167.20111.6E13 Q14 Y20 S21E13-K17 WeakPolarHBondContact O-CG 3.43Å; E13-K17 PolarHBondContact O-N 2.93Å; E13-K17 WeakPolarHBondContact OE1-CE 3.39Å; E13-K17 IonicContact OE1-NZ 2.68Å; E13-K17 PolarHBondContact OE1-NZ 2.97Å; Q14-K17 PolarHBondContact O-N 3.22Å; K17-Y20 PolarHBondContact O-N 2.93Å; K17-S21 WeakPolarHBondContact O-CB 3.45Å; K17-S21 PolarHBondContact O-N 3.06Å
18E98.4Very high97.1Very high87 Ų8797.4 Ų97.441%0.40751%0.508SS..Hα-helixtrans-62.4-44.4176.8-72.2169.5-168.800111.4Q14 L16 S21 Q22Q14-E18 WeakPolarHBondContact CG-OE1 3.5Å; Q14-E18 PolarHBondContact NE2-OE1 3.36Å; Q14-E18 WeakPolarHBondContact O-CG 3.44Å; Q14-E18 PolarHBondContact O-N 2.99Å; L16-E18 VanDerWaalsContact C-N 3.34Å; L16-E18 PolarHBondContact O-N 2.91Å; E18-S21 PolarHBondContact O-N 3.07Å; E18-Q22 WeakPolarHBondContact O-CB 3.3Å; E18-Q22 WeakPolarHBondContact O-CG 3.34Å; E18-Q22 PolarHBondContact O-N 3.29Å
19G98.4Very high97.4Very high29 Ų2992.4 Ų92.430%0.29950%0.498SS..Hα-helixtrans-61.9-44.6177.200000113.3S15 L16 S21 Q22 M23S15-G19 PolarHBondContact O-N 2.87Å; L16-G19 PolarHBondContact O-N 3.36Å; G19-S21 PolarHBondContact O-N 3.4Å; G19-Q22 PolarHBondContact O-N 2.99Å; G19-M23 WeakPolarHBondContact O-CB 3.44Å; G19-M23 VanDerWaalsContact O-CG 3.3Å; G19-M23 WeakPolarHBondContact O-CG 3.2Å; G19-M23 PolarHBondContact O-N 3.47Å
20Y98.4Very high97.6Very high165 Ų16593.2 Ų93.265%0.64750%0.496SS*.Hα-helixtrans-62.5-42.7174.8-80.5-61.9000111.9L16 K17 M23 A24L16-Y20 WeakPolarHBondContact O-CD2 3.4Å; L16-Y20 PolarHBondContact O-N 3.41Å; K17-Y20 PolarHBondContact O-N 2.93Å; Y20-M23 PolarHBondContact O-N 2.91Å; Y20-A24 PolarHBondContact O-N 3.27Å
21S98.4Very high97.7Very high94 Ų9489.9 Ų89.966%0.65749%0.49SS*.Hα-helixtrans-63.6-41.6177.1-1750000112.1K17 E18 G19 M23K17-S21 WeakPolarHBondContact O-CB 3.45Å; K17-S21 PolarHBondContact O-N 3.06Å; E18-S21 PolarHBondContact O-N 3.07Å; G19-S21 PolarHBondContact O-N 3.4Å; S21-M23 PolarHBondContact O-N 3.5Å
22Q98.5Very high97.6Very high150 Ų15091.4 Ų91.470%0.70149%0.493SS*.Hα-helixtrans-67.7-25.5178.6-72.516827.900112.4E18 G19E18-Q22 WeakPolarHBondContact O-CB 3.3Å; E18-Q22 WeakPolarHBondContact O-CG 3.34Å; E18-Q22 PolarHBondContact O-N 3.29Å; G19-Q22 PolarHBondContact O-N 2.99Å
23M98.3Very high97.5Very high82 Ų8292.1 Ų92.140%0.40449%0.493SS..THydrogen-bonded Turntrans-103.64.2-177.2-60.9-85.351.100114.6G19 Y20 S21 D25 L26 N27G19-M23 WeakPolarHBondContact O-CB 3.44Å; G19-M23 VanDerWaalsContact O-CG 3.3Å; G19-M23 WeakPolarHBondContact O-CG 3.2Å; G19-M23 PolarHBondContact O-N 3.47Å; Y20-M23 PolarHBondContact O-N 2.91Å; S21-M23 PolarHBondContact O-N 3.5Å; M23-D25 PolarHBondContact O-N 2.68Å; M23-L26 HydrophobicContact CE-CB 3.85Å; M23-L26 HydrophobicContact CE-CD2 3.57Å; M23-L26 HydrophobicContact CE-CG 4.36Å; M23-L26 PolarHBondContact O-N 2.97Å; M23-L26 HydrophobicContact SD-CD2 4.23Å; M23-N27 WeakPolarHBondContact O-CB 3.16Å; M23-N27 VanDerWaalsContact O-CG 3.28Å; M23-N27 PolarHBondContact O-N 3.47Å; M23-N27 PolarHBondContact O-ND2 3Å
24A98.2Very high97.2Very high49 Ų4989 Ų8941%0.40548%0.484SS..Hα-helixtrans-55-50.2-174.900000112.5Y20 N27 L28Y20-A24 PolarHBondContact O-N 3.27Å; A24-N27 PolarHBondContact O-N 3.47Å; A24-L28 VanDerWaalsContact O-CB 3.25Å; A24-L28 WeakPolarHBondContact O-CB 3.48Å; A24-L28 PolarHBondContact O-N 3.18Å
25D98.2Very high96.8Very high141 Ų14190.8 Ų90.875%0.75449%0.491SS*.Hα-helixtrans-64.9-43.8-176.8-65.8-18.9000112.3M23 L28 S29M23-D25 PolarHBondContact O-N 2.68Å; D25-L28 PolarHBondContact O-N 2.83Å; D25-S29 PolarHBondContact O-N 3.35Å
26L98.3Very high96.3Very high88 Ų8891.3 Ų91.346%0.46149%0.493SS..Hα-helixtrans-64.3-49.8178.317763000111.2M23 L28 S29 L30M23-L26 HydrophobicContact CE-CB 3.85Å; M23-L26 HydrophobicContact CE-CD2 3.57Å; M23-L26 HydrophobicContact CE-CG 4.36Å; M23-L26 PolarHBondContact O-N 2.97Å; M23-L26 HydrophobicContact SD-CD2 4.23Å; L26-L28 VanDerWaalsContact C-N 3.25Å; L26-L28 PolarHBondContact O-N 3.36Å; L26-S29 WeakPolarHBondContact O-CB 3.36Å; L26-S29 PolarHBondContact O-N 3.02Å; L26-L30 HydrophobicContact CD1-CD1 4.22Å; L26-L30 HydrophobicContact CD1-CG 4.32Å; L26-L30 HydrophobicContact CG-CD1 4.13Å; L26-L30 WeakPolarHBondContact O-CG 3.46Å; L26-L30 PolarHBondContact O-N 2.89Å
27N97.6Very high95.7Very high77 Ų7794.2 Ų94.241%0.41251%0.507SS..Hα-helixtrans-63.1-36.4-178.7-71.7-17.9000111.2M23 A24 A31M23-N27 WeakPolarHBondContact O-CB 3.16Å; M23-N27 VanDerWaalsContact O-CG 3.28Å; M23-N27 PolarHBondContact O-N 3.47Å; M23-N27 PolarHBondContact O-ND2 3Å; A24-N27 PolarHBondContact O-N 3.47Å; N27-A31 WeakPolarHBondContact O-CB 3.4Å; N27-A31 PolarHBondContact O-N 3.36Å
28L97.6Very high95.2Very high103 Ų10395.8 Ų95.854%0.53952%0.516SS..Hα-helixtrans-67.4-41.6174.8-176.560.2000112.1A24 D25 L26 A31 N32A24-L28 VanDerWaalsContact O-CB 3.25Å; A24-L28 WeakPolarHBondContact O-CB 3.48Å; A24-L28 PolarHBondContact O-N 3.18Å; D25-L28 PolarHBondContact O-N 2.83Å; L26-L28 VanDerWaalsContact C-N 3.25Å; L26-L28 PolarHBondContact O-N 3.36Å; L28-A31 PolarHBondContact O-N 2.94Å; L28-N32 PolarHBondContact O-N 3.45Å; L28-N32 PolarHBondContact O-ND2 3.41Å; L28-N32 VanDerWaalsContact O-ND2 3.14Å
29S97.9Very high94.5Very high55 Ų5592.8 Ų92.839%0.38551%0.505SS..Hα-helixtrans-58.3-50.6174.7-1650000111.1D25 L26 A31 N32 E33D25-S29 PolarHBondContact O-N 3.35Å; L26-S29 WeakPolarHBondContact O-CB 3.36Å; L26-S29 PolarHBondContact O-N 3.02Å; S29-A31 VanDerWaalsContact C-N 3.35Å; S29-A31 PolarHBondContact O-N 3.47Å; S29-N32 PolarHBondContact O-N 3.18Å; S29-E33 WeakPolarHBondContact O-CG 3.48Å; S29-E33 PolarHBondContact O-N 3.14Å; S29-E33 PolarHBondContact OG-OE1 2.99Å
30L97.1Very high93.3Very high88 Ų8899.7 Ų99.746%0.46153%0.529SS..Hα-helixtrans-61.8-41.5-179.5-67.6173.2000112.2L26 N32 E33 A34L26-L30 HydrophobicContact CD1-CD1 4.22Å; L26-L30 HydrophobicContact CD1-CG 4.32Å; L26-L30 HydrophobicContact CG-CD1 4.13Å; L26-L30 WeakPolarHBondContact O-CG 3.46Å; L26-L30 PolarHBondContact O-N 2.89Å; L30-N32 VanDerWaalsContact C-N 3.35Å; L30-N32 PolarHBondContact O-N 3.49Å; L30-E33 PolarHBondContact O-N 3.43Å; L30-A34 WeakPolarHBondContact O-CB 3.25Å; L30-A34 PolarHBondContact O-N 3.32Å
31A95.9Very high92.1Very high54 Ų5494.7 Ų94.745%0.44652%0.522SS..Hα-helixtrans-62.2-41.9176.100000111.9N27 L28 S29 A34 F35N27-A31 WeakPolarHBondContact O-CB 3.4Å; N27-A31 PolarHBondContact O-N 3.36Å; L28-A31 PolarHBondContact O-N 2.94Å; S29-A31 VanDerWaalsContact C-N 3.35Å; S29-A31 PolarHBondContact O-N 3.47Å; A31-A34 PolarHBondContact O-N 2.94Å; A31-F35 PolarHBondContact O-N 3.06Å
32N93.9Very high90.5Very high102 Ų10292.9 Ų92.955%0.54551%0.509SS..Hα-helixtrans-68.6-36.2176.4-72-35.1000112.6L28 S29 L30 F35L28-N32 PolarHBondContact O-N 3.45Å; L28-N32 PolarHBondContact O-ND2 3.41Å; L28-N32 VanDerWaalsContact O-ND2 3.14Å; S29-N32 PolarHBondContact O-N 3.18Å; L30-N32 VanDerWaalsContact C-N 3.35Å; L30-N32 PolarHBondContact O-N 3.49Å; N32-F35 WeakPolarHBondContact O-CB 3.33Å; N32-F35 PolarHBondContact O-N 3.03Å
33E94.7Very high88.7Confident124 Ų12491.9 Ų91.958%0.57951%0.508SS*.Hα-helixtrans-66.5-38.2176.5-74.3166.6-143.500112.2S29 L30 P36S29-E33 WeakPolarHBondContact O-CG 3.48Å; S29-E33 PolarHBondContact O-N 3.14Å; S29-E33 PolarHBondContact OG-OE1 2.99Å; L30-E33 PolarHBondContact O-N 3.43Å; E33-P36 WeakPolarHBondContact O-CD 3.47Å
34A91.8Very high86.9Confident31 Ų3191.8 Ų91.826%0.25652%0.515SS..Hα-helixtrans-77.9-23.117800000113.2L30 A31 P36 I37 E38L30-A34 WeakPolarHBondContact O-CB 3.25Å; L30-A34 PolarHBondContact O-N 3.32Å; A31-A34 PolarHBondContact O-N 2.94Å; A34-P36 VanDerWaalsContact C-CD 3.48Å; A34-I37 WeakPolarHBondContact O-CB 3.44Å; A34-I37 PolarHBondContact O-N 3.09Å; A34-E38 HydrophobicContact CB-CG 4.43Å; A34-E38 PolarHBondContact O-N 3.5Å; A34-E38 VanDerWaalsContact O-N 3.09Å
35F89.2Confident84.9Confident116 Ų11694.2 Ų94.251%0.50952%0.521SS..Hα-helixtrans-48.7-47.4-173.8175.3-97.4000114.5A31 N32 I37 E38 C39A31-F35 PolarHBondContact O-N 3.06Å; N32-F35 WeakPolarHBondContact O-CB 3.33Å; N32-F35 PolarHBondContact O-N 3.03Å; F35-I37 PolarHBondContact O-N 3.29Å; F35-E38 PolarHBondContact O-N 3.2Å; F35-C39 HydrophobicContact CE1-CB 4.26Å; F35-C39 HydrophobicContact CE2-CB 4.22Å; F35-C39 HydrophobicContact CZ-CB 4.07Å; F35-C39 WeakPolarHBondContact O-CB 3.06Å; F35-C39 PolarHBondContact O-N 2.89Å
36P85.9Confident82.9Confident79 Ų7993.8 Ų93.851%0.51351%0.514SS..Hα-helixtrans-63.3-26.3-179.3-22.134.8000113.8E33 A34E33-P36 WeakPolarHBondContact O-CD 3.47Å; A34-P36 VanDerWaalsContact C-CD 3.48Å
37I85.9Confident81.1Confident153 Ų15394.2 Ų94.279%0.78552%0.52SS*.Hα-helixtrans-84.8-36-179.1-58.3169.2000110.6A34 F35A34-I37 WeakPolarHBondContact O-CB 3.44Å; A34-I37 PolarHBondContact O-N 3.09Å; F35-I37 PolarHBondContact O-N 3.29Å
38E86.2Confident79.3Confident145 Ų14598.2 Ų98.268%0.67853%0.531SS*.Hα-helixtrans-81-25.8179.8-65.2-179.1169.500112.7A34 F35 E40A34-E38 HydrophobicContact CB-CG 4.43Å; A34-E38 PolarHBondContact O-N 3.5Å; A34-E38 VanDerWaalsContact O-N 3.09Å; F35-E38 PolarHBondContact O-N 3.2Å; E38-E40 PolarHBondContact O-N 3.02Å
39C84.6Confident77.5Confident24 Ų2497.9 Ų97.916%0.16253%0.529CS..  trans-74.591.2-177.2177.80000111.5F35 A41 C42F35-C39 HydrophobicContact CE1-CB 4.26Å; F35-C39 HydrophobicContact CE2-CB 4.22Å; F35-C39 HydrophobicContact CZ-CB 4.07Å; F35-C39 WeakPolarHBondContact O-CB 3.06Å; F35-C39 PolarHBondContact O-N 2.89Å; C39-A41 PolarHBondContact O-N 3.11Å; C39-A41 VanDerWaalsContact O-N 3.11Å; C39-C42 HydrophobicContact CB-CB 3.74Å; C39-C42 WeakPolarHBondContact CB-SG 3.13Å; C39-C42 WeakPolarHBondContact O-CB 3.43Å; C39-C42 PolarHBondContact O-N 3Å; C39-C42 WeakPolarHBondContact SG-CB 2.99Å; C39-C42 PolarHBondContact SG-N 3.41Å; C39-C42 CovalentContact SG-SG 2.06Å; C39-C42 PolarHBondContact SG-SG 3.16Å
40E73.2Confident75.7Confident174 Ų17498.5 Ų98.581%0.81353%0.533SS*.Hα-helixtrans-55.2-29.6173-64.3179.6-169.800112.6E38 C42 C44E38-E40 PolarHBondContact O-N 3.02Å; E40-C42 VanDerWaalsContact C-N 3.35Å; E40-C44 WeakPolarHBondContact O-CB 3.45Å; E40-C44 PolarHBondContact O-SG 3.46Å
41A72Confident74Confident60 Ų6097.3 Ų97.350%0.49653%0.532SS..Hα-helixtrans-75.4-21.3179.600000114C39 D43 C44 N45C39-A41 PolarHBondContact O-N 3.11Å; C39-A41 VanDerWaalsContact O-N 3.11Å; A41-D43 VanDerWaalsContact C-N 3.33Å; A41-D43 PolarHBondContact O-N 3.49Å; A41-C44 PolarHBondContact O-N 3.15Å; A41-N45 PolarHBondContact O-N 2.06Å; A41-N45 VanDerWaalsContact O-N 3.15Å
42C65.6Low72.1Confident56 Ų5699.7 Ų99.738%0.37854%0.538SS..Hα-helixtrans-72.7-28.8-173.6-67.80000111.7C39 E40C39-C42 HydrophobicContact CB-CB 3.74Å; C39-C42 WeakPolarHBondContact CB-SG 3.13Å; C39-C42 WeakPolarHBondContact O-CB 3.43Å; C39-C42 PolarHBondContact O-N 3Å; C39-C42 WeakPolarHBondContact SG-CB 2.99Å; C39-C42 PolarHBondContact SG-N 3.41Å; C39-C42 CovalentContact SG-SG 2.06Å; C39-C42 PolarHBondContact SG-SG 3.16Å; E40-C42 VanDerWaalsContact C-N 3.35Å
43D61.6Low70.5Confident129 Ų12998.9 Ų98.969%0.6954%0.54SS*.Hα-helixtrans-94.5-22.4171.7-73.9-24000113.5A41 T47A41-D43 VanDerWaalsContact C-N 3.33Å; A41-D43 PolarHBondContact O-N 3.49Å; D43-T47 PolarHBondContact O-OG1 3.19Å
44C59.2Low68.8Low80 Ų8098.2 Ų98.254%0.54154%0.544SS..Hα-helixtrans-85.2-32.4-174.4-69.40000114.1E40 A41 Y48E40-C44 WeakPolarHBondContact O-CB 3.45Å; E40-C44 PolarHBondContact O-SG 3.46Å; A41-C44 PolarHBondContact O-N 3.15Å; C44-Y48 PolarHBondContact O-N 3.12Å; C44-Y48 VanDerWaalsContact O-N 3.16Å
45N57.4Low67.2Low99 Ų99103.1 Ų103.153%0.52957%0.566SS.*Hα-helixtrans-71.3-38.4-176-113.518.7000112.5A41 T47 Y48 L49A41-N45 PolarHBondContact O-N 2.06Å; A41-N45 VanDerWaalsContact O-N 3.15Å; N45-T47 VanDerWaalsContact C-N 3.33Å; N45-T47 PolarHBondContact O-N 2.88Å; N45-Y48 PolarHBondContact O-N 3.16Å; N45-L49 VanDerWaalsContact O-CB 3.31Å; N45-L49 WeakPolarHBondContact O-CB 3.31Å; N45-L49 WeakPolarHBondContact O-CG 3.26Å; N45-L49 PolarHBondContact O-N 3.41Å
46E56.3Low65.1Low132 Ų132109.3 Ų109.362%0.61760%0.597SS**Hα-helixtrans-66-37.7178.4-69.4-61.2150.200111.6L49 S50E46-L49 PolarHBondContact O-N 2.57Å; E46-S50 VanDerWaalsContact O-CB 3.26Å; E46-S50 WeakPolarHBondContact O-CB 3.16Å; E46-S50 PolarHBondContact O-N 3.34Å; E46-S50 PolarHBondContact O-OG 3.22Å
47T59.9Low64.1Low97 Ų97110.9 Ų110.960%0.59560%0.601SS**Hα-helixtrans-66.8-39.7176.6-49.20000111.8D43 N45 S50 S51D43-T47 PolarHBondContact O-OG1 3.19Å; N45-T47 VanDerWaalsContact C-N 3.33Å; N45-T47 PolarHBondContact O-N 2.88Å; T47-S50 PolarHBondContact O-OG 2.85Å; T47-S51 WeakPolarHBondContact O-CB 3.39Å; T47-S51 PolarHBondContact O-N 3.28Å; T47-S51 PolarHBondContact O-OG 3.39Å
48Y59.2Low62.9Low162 Ų162108.6 Ų108.664%0.63559%0.592SS**Hα-helixtrans-69.3-43175.9-171.7-97.3000111.9C44 N45 S51 N52C44-Y48 PolarHBondContact O-N 3.12Å; C44-Y48 VanDerWaalsContact O-N 3.16Å; N45-Y48 PolarHBondContact O-N 3.16Å; Y48-S51 PolarHBondContact O-N 3.36Å; Y48-S51 PolarHBondContact O-OG 3.39Å; Y48-N52 PolarHBondContact O-N 3.47Å
49L59.7Low61.6Low96 Ų96106.6 Ų106.650%0.50359%0.587SS.*Hα-helixtrans-70.9-36.1-179.6-68.1170.9000113N45 E46 N52 S53N45-L49 VanDerWaalsContact O-CB 3.31Å; N45-L49 WeakPolarHBondContact O-CB 3.31Å; N45-L49 WeakPolarHBondContact O-CG 3.26Å; N45-L49 PolarHBondContact O-N 3.41Å; E46-L49 PolarHBondContact O-N 2.57Å; L49-N52 PolarHBondContact O-N 2.88Å; L49-S53 PolarHBondContact O-N 3.4Å; L49-S53 PolarHBondContact O-OG 3.44Å
50S61Low60.3Low67 Ų67111.5 Ų111.547%0.46961%0.612SS.*Hα-helixtrans-75-25.8176.5530000113.6E46 T47 N52 S53 T54E46-S50 VanDerWaalsContact O-CB 3.26Å; E46-S50 WeakPolarHBondContact O-CB 3.16Å; E46-S50 PolarHBondContact O-N 3.34Å; E46-S50 PolarHBondContact O-OG 3.22Å; T47-S50 PolarHBondContact O-OG 2.85Å; S50-N52 VanDerWaalsContact C-N 3.34Å; S50-S53 PolarHBondContact O-OG 3.19Å; S50-T54 PolarHBondContact O-OG1 3.48Å
51S60.2Low59.5Low63 Ų63107.6 Ų107.644%0.44160%0.599SS.*Hα-helixtrans-75.9-20.8172.772.30000113.9T47 Y48 N55T47-S51 WeakPolarHBondContact O-CB 3.39Å; T47-S51 PolarHBondContact O-N 3.28Å; T47-S51 PolarHBondContact O-OG 3.39Å; Y48-S51 PolarHBondContact O-N 3.36Å; Y48-S51 PolarHBondContact O-OG 3.39Å; S51-N55 PolarHBondContact O-ND2 3.25Å
52N57.8Low58.6Low105 Ų105110.7 Ų110.756%0.56161%0.606SS**Hα-helixtrans-95.1-15.1-178.7-150.746.3000113.4Y48 L49 S50Y48-N52 PolarHBondContact O-N 3.47Å; L49-N52 PolarHBondContact O-N 2.88Å; S50-N52 VanDerWaalsContact C-N 3.34Å
53S59.7Low58.1Low85 Ų85114.6 Ų114.659%0.59462%0.622SS**THydrogen-bonded Turntrans-89.1-4.5178.155.70000114.6L49 S50L49-S53 PolarHBondContact O-N 3.4Å; L49-S53 PolarHBondContact O-OG 3.44Å; S50-S53 PolarHBondContact O-OG 3.19Å
54T59.3Low57.9Low109 Ų109113.5 Ų113.567%0.66962%0.617SS**THydrogen-bonded Turntrans-100.25.6174.130.30000113.5S50S50-T54 PolarHBondContact O-OG1 3.48Å
55N57.3Low57.8Low134 Ų134116.3 Ų116.372%0.71762%0.624SS**  trans-118.612.8-178.9-69.9-48000114.5S51S51-N55 PolarHBondContact O-ND2 3.25Å
56E45.4Very low57.8Low247 Ų247117.9 Ų117.9100%1.15463%0.632SS**  trans-114.20163.6-74.3-169.1132.200110.2

Retrieved 56 of 56 residues in 256.5 ms (Link to these results)