A0A5K4F733_SCHMA Loading...

Tektin

AlphaFold DB , UniProt , Accession A0A5K4F733, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 161 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
1M72.8Confident90.9Very high211 Ų21185.5 Ų85.5100%1.03941%0.407SS*.  0129.90-175170.1174.200107.4
2F81.5Confident91.3Very high91 Ų9185 Ų8540%0.39940%0.404SS..  trans-75.1125.6-177.7-169.6-95.3000109.8L6 K7 I10F2-L6 HydrophobicContact CD2-CD2 4.35Å; F2-L6 HydrophobicContact CE1-CB 3.93Å; F2-L6 HydrophobicContact CE1-CD2 3.85Å; F2-L6 HydrophobicContact CE1-CG 3.77Å; F2-L6 HydrophobicContact CE2-CD2 3.5Å; F2-L6 HydrophobicContact CE2-CG 4.29Å; F2-L6 HydrophobicContact CZ-CB 4.16Å; F2-L6 HydrophobicContact CZ-CD2 3.22Å; F2-L6 HydrophobicContact CZ-CG 3.49Å; F2-L6 VanDerWaalsContact CZ-CG 3.49Å; F2-K7 HydrophobicContact CD1-CD 4.23Å; F2-K7 HydrophobicContact CD1-CG 3.38Å; F2-K7 HydrophobicContact CE1-CG 3.66Å; F2-K7 WeakPolarHBondContact O-CE 3.4Å; F2-I10 HydrophobicContact CE1-CD1 3.91Å; F2-I10 HydrophobicContact CZ-CD1 3.58Å
3P89.8Confident91.8Very high28 Ų2882.2 Ų82.218%0.18239%0.387CS..  trans-63.2137.5-169.8-20.930.2000113.5H5 L6 K7 Y68P3-H5 VanDerWaalsContact C-N 3.29Å; P3-H5 WeakPolarHBondContact CB-CE1 3.49Å; P3-H5 WeakPolarHBondContact CB-ND1 3.11Å; P3-H5 PolarHBondContact O-N 3.15Å; P3-L6 HydrophobicContact CB-CB 4.33Å; P3-L6 PolarHBondContact O-N 3.49Å; P3-L6 VanDerWaalsContact O-N 3.12Å; P3-K7 PolarHBondContact O-N 2.76Å; P3-K7 VanDerWaalsContact O-N 3.13Å; P3-Y68 HydrophobicContact CG-CD2 3.6Å; P3-Y68 HydrophobicContact CG-CE2 3.32Å
4E92.6Very high92.2Very high104 Ų10484.3 Ų84.349%0.48639%0.394SS..Hα-helixtrans-60.6-37.7-179.4-67.4-54.6134.400112.6L6 K7 T8E4-L6 VanDerWaalsContact C-N 3.27Å; E4-L6 PolarHBondContact O-N 2.67Å; E4-K7 WeakPolarHBondContact O-CB 3.19Å; E4-K7 PolarHBondContact O-N 3.04Å; E4-K7 IonicContact OE1-NZ 3.77Å; E4-K7 PolarHBondContact OE1-NZ 3.28Å; E4-K7 IonicContact OE2-NZ 3.82Å; E4-T8 PolarHBondContact O-N 3.17Å; E4-T8 PolarHBondContact O-OG1 3.07Å; E4-T8 VanDerWaalsContact O-OG1 3.14Å
5H90.6Very high92.5Very high104 Ų10484.5 Ų84.548%0.48140%0.399SS..Hα-helixtrans-61.1-37.1177.466.1-98.8000112.2P3 T8 R9P3-H5 VanDerWaalsContact C-N 3.29Å; P3-H5 WeakPolarHBondContact CB-CE1 3.49Å; P3-H5 WeakPolarHBondContact CB-ND1 3.11Å; P3-H5 PolarHBondContact O-N 3.15Å; H5-T8 PolarHBondContact O-N 3.06Å; H5-R9 PolarHBondContact O-N 3.23Å
6L93.4Very high92.8Very high7 Ų779.9 Ų79.94%0.03738%0.38CS..Hα-helixtrans-72-38.3177.7-172.362.8000110.8F2 P3 E4 T8 R9 I10 L61 V64 Y68F2-L6 HydrophobicContact CD2-CD2 4.35Å; F2-L6 HydrophobicContact CE1-CB 3.93Å; F2-L6 HydrophobicContact CE1-CD2 3.85Å; F2-L6 HydrophobicContact CE1-CG 3.77Å; F2-L6 HydrophobicContact CE2-CD2 3.5Å; F2-L6 HydrophobicContact CE2-CG 4.29Å; F2-L6 HydrophobicContact CZ-CB 4.16Å; F2-L6 HydrophobicContact CZ-CD2 3.22Å; F2-L6 HydrophobicContact CZ-CG 3.49Å; F2-L6 VanDerWaalsContact CZ-CG 3.49Å; P3-L6 HydrophobicContact CB-CB 4.33Å; P3-L6 PolarHBondContact O-N 3.49Å; P3-L6 VanDerWaalsContact O-N 3.12Å; E4-L6 VanDerWaalsContact C-N 3.27Å; E4-L6 PolarHBondContact O-N 2.67Å; L6-T8 VanDerWaalsContact C-N 3.34Å; L6-T8 PolarHBondContact O-N 2.67Å; L6-R9 PolarHBondContact O-N 2.89Å; L6-I10 HydrophobicContact CG-CD1 4.11Å; L6-I10 WeakPolarHBondContact O-CB 3.45Å; L6-I10 VanDerWaalsContact O-CG1 3.23Å; L6-I10 WeakPolarHBondContact O-CG1 3.36Å; L6-I10 PolarHBondContact O-N 3.41Å; L6-L61 HydrophobicContact CD1-CD1 4.1Å; L6-V64 HydrophobicContact CD1-CG1 3.94Å; L6-Y68 HydrophobicContact CD2-CD1 4.06Å; L6-Y68 HydrophobicContact CD2-CE1 4.44Å; L6-Y68 HydrophobicContact CD2-CG 4.27Å
7K94.9Very high93.1Very high85 Ų8581.1 Ų81.137%0.3738%0.381SS..Hα-helixtrans-58.7-46.9172-62.5-177.9-173.3165.50111.4F2 P3 E4 I10 K11F2-K7 HydrophobicContact CD1-CD 4.23Å; F2-K7 HydrophobicContact CD1-CG 3.38Å; F2-K7 HydrophobicContact CE1-CG 3.66Å; F2-K7 WeakPolarHBondContact O-CE 3.4Å; P3-K7 PolarHBondContact O-N 2.76Å; P3-K7 VanDerWaalsContact O-N 3.13Å; E4-K7 WeakPolarHBondContact O-CB 3.19Å; E4-K7 PolarHBondContact O-N 3.04Å; E4-K7 IonicContact OE1-NZ 3.77Å; E4-K7 PolarHBondContact OE1-NZ 3.28Å; E4-K7 IonicContact OE2-NZ 3.82Å; K7-I10 PolarHBondContact O-N 2.98Å; K7-K11 PolarHBondContact O-N 3.41Å
8T95.7Very high93.3Very high71 Ų7184.4 Ų84.444%0.43639%0.391SS..Hα-helixtrans-61.5-46.4178.8-60.70000111.3E4 H5 L6 I10 K11 H12E4-T8 PolarHBondContact O-N 3.17Å; E4-T8 PolarHBondContact O-OG1 3.07Å; E4-T8 VanDerWaalsContact O-OG1 3.14Å; H5-T8 PolarHBondContact O-N 3.06Å; L6-T8 VanDerWaalsContact C-N 3.34Å; L6-T8 PolarHBondContact O-N 2.67Å; T8-I10 PolarHBondContact O-N 2.79Å; T8-K11 WeakPolarHBondContact O-CB 3.44Å; T8-K11 PolarHBondContact O-N 3.19Å; T8-K11 VanDerWaalsContact O-N 3.13Å; T8-H12 PolarHBondContact O-CD2 2.99Å; T8-H12 PolarHBondContact O-N 3.06Å
9R95.4Very high93.4Very high60 Ų6084.1 Ų84.123%0.22639%0.392CS..Hα-helixtrans-66-38.8179.5-172.959.873.4-175.44.6112.5H5 L6 K11 H12 Y13 E57 L61H5-R9 PolarHBondContact O-N 3.23Å; L6-R9 PolarHBondContact O-N 2.89Å; R9-K11 VanDerWaalsContact C-N 3.28Å; R9-K11 PolarHBondContact O-N 3.34Å; R9-H12 PolarHBondContact O-N 3.43Å; R9-Y13 PolarHBondContact O-N 2.95Å; R9-E57 IonicContact CZ-OE2 3.93Å; R9-E57 IonicContact NH1-OE1 2.73Å; R9-E57 IonicContact NH1-OE2 2.68Å; R9-E57 PolarHBondContact NH1-OE2 3.01Å; R9-L61 HydrophobicContact CB-CD1 4.14Å; R9-L61 HydrophobicContact CG-CB 3.84Å; R9-L61 HydrophobicContact CG-CD1 3.69Å; R9-L61 HydrophobicContact CG-CG 4.36Å
10I96.3Very high93.5Very high52 Ų5280.4 Ų80.427%0.26738%0.376SS..Hα-helixtrans-60.2-40172.5-71.9167.9000111F2 L6 K7 T8 K14 L61F2-I10 HydrophobicContact CE1-CD1 3.91Å; F2-I10 HydrophobicContact CZ-CD1 3.58Å; L6-I10 HydrophobicContact CG-CD1 4.11Å; L6-I10 WeakPolarHBondContact O-CB 3.45Å; L6-I10 VanDerWaalsContact O-CG1 3.23Å; L6-I10 WeakPolarHBondContact O-CG1 3.36Å; L6-I10 PolarHBondContact O-N 3.41Å; K7-I10 PolarHBondContact O-N 2.98Å; T8-I10 PolarHBondContact O-N 2.79Å; I10-K14 HydrophobicContact CG2-CD 4.24Å; I10-K14 WeakPolarHBondContact O-CB 3.29Å; I10-K14 WeakPolarHBondContact O-CG 3.49Å; I10-K14 PolarHBondContact O-N 3.22Å; I10-L61 HydrophobicContact CG1-CD1 3.77Å; I10-L61 HydrophobicContact CG1-CD2 4.45Å
11K96.6Very high93.6Very high128 Ų12878.9 Ų78.956%0.55737%0.374SS*.Hα-helixtrans-62.3-48.4175.8-175.8-173.7173.5-171.20111.2K7 T8 R9 Y13 K14 D15K7-K11 PolarHBondContact O-N 3.41Å; T8-K11 WeakPolarHBondContact O-CB 3.44Å; T8-K11 PolarHBondContact O-N 3.19Å; T8-K11 VanDerWaalsContact O-N 3.13Å; R9-K11 VanDerWaalsContact C-N 3.28Å; R9-K11 PolarHBondContact O-N 3.34Å; K11-Y13 PolarHBondContact O-N 2.98Å; K11-K14 WeakPolarHBondContact O-CB 3.34Å; K11-K14 PolarHBondContact O-N 3.42Å; K11-K14 VanDerWaalsContact O-N 3.13Å; K11-D15 PolarHBondContact O-N 3.27Å
12H96.6Very high94.6Very high79 Ų7973.2 Ų73.237%0.36635%0.347SS..Hα-helixtrans-58.5-45.8179.3-73.4-151.7000112.2T8 R9 K14 D15 A16 E57T8-H12 PolarHBondContact O-CD2 2.99Å; T8-H12 PolarHBondContact O-N 3.06Å; R9-H12 PolarHBondContact O-N 3.43Å; H12-K14 PolarHBondContact O-N 2.94Å; H12-D15 PolarHBondContact O-N 3.21Å; H12-A16 WeakPolarHBondContact O-CB 3.28Å; H12-A16 PolarHBondContact O-N 3.05Å; H12-E57 WeakPolarHBondContact CB-OE2 3.42Å; H12-E57 IonicContact ND1-OE1 3.96Å
13Y96.9Very high95.1Very high49 Ų4969.9 Ų69.919%0.19233%0.333CS..Hα-helixtrans-61.2-42.7175.3170.6-108.7000112.2R9 K11 A16 Y17 K54 R58 L61R9-Y13 PolarHBondContact O-N 2.95Å; K11-Y13 PolarHBondContact O-N 2.98Å; Y13-A16 PolarHBondContact O-N 3.16Å; Y13-Y17 VanDerWaalsContact O-CB 3.26Å; Y13-Y17 WeakPolarHBondContact O-CB 3.37Å; Y13-Y17 PolarHBondContact O-N 2.93Å; Y13-K54 HydrophobicContact CE2-CG 4.27Å; Y13-R58 HydrophobicContact CD2-CB 3.92Å; Y13-R58 HydrophobicContact CE2-CB 3.77Å; Y13-R58 HydrophobicContact CE2-CG 4.22Å; Y13-L61 HydrophobicContact CD1-CD2 3.94Å; Y13-L61 HydrophobicContact CG-CD2 3.97Å
14K97.4Very high95.2Very high111 Ų11174.5 Ų74.548%0.48335%0.35SS..Hα-helixtrans-59.9-46.6175.7-78.2178.9177.6-176.30111.4I10 K11 H12 A16 Y17 Y18I10-K14 HydrophobicContact CG2-CD 4.24Å; I10-K14 WeakPolarHBondContact O-CB 3.29Å; I10-K14 WeakPolarHBondContact O-CG 3.49Å; I10-K14 PolarHBondContact O-N 3.22Å; K11-K14 WeakPolarHBondContact O-CB 3.34Å; K11-K14 PolarHBondContact O-N 3.42Å; K11-K14 VanDerWaalsContact O-N 3.13Å; H12-K14 PolarHBondContact O-N 2.94Å; K14-A16 PolarHBondContact O-N 3.44Å; K14-Y17 WeakPolarHBondContact O-CB 3.35Å; K14-Y17 PolarHBondContact O-N 3.25Å; K14-Y18 HydrophobicContact CB-CD2 4.47Å; K14-Y18 HydrophobicContact CB-CE2 4.24Å; K14-Y18 WeakPolarHBondContact O-CD2 3.45Å; K14-Y18 PolarHBondContact O-N 3.48Å
15D97.8Very high95.2Very high87 Ų8776.7 Ų76.747%0.46536%0.355SS..Hα-helixtrans-61.8-44.9179.7-66.6-18.2000111K11 H12 Y17 Y18 N19K11-D15 PolarHBondContact O-N 3.27Å; H12-D15 PolarHBondContact O-N 3.21Å; D15-Y17 PolarHBondContact O-N 3.09Å; D15-Y18 PolarHBondContact O-N 3.01Å; D15-N19 WeakPolarHBondContact O-CB 3.49Å; D15-N19 PolarHBondContact O-N 3.47Å
16A97Very high95.1Very high12 Ų1274.4 Ų74.410%0.09935%0.345CS..Hα-helixtrans-65.1-38.5175.800000112.8H12 Y13 K14 N19 S20 K54 E57H12-A16 WeakPolarHBondContact O-CB 3.28Å; H12-A16 PolarHBondContact O-N 3.05Å; Y13-A16 PolarHBondContact O-N 3.16Å; K14-A16 PolarHBondContact O-N 3.44Å; A16-N19 PolarHBondContact O-N 3.05Å; A16-S20 WeakPolarHBondContact O-CB 3.28Å; A16-S20 PolarHBondContact O-N 3.43Å; A16-K54 HydrophobicContact CB-CB 4.48Å; A16-E57 HydrophobicContact CB-CB 4.19Å; A16-E57 HydrophobicContact CB-CG 4.06Å
17Y97.3Very high94.8Very high99 Ų9977.1 Ų77.139%0.38836%0.355SS..Hα-helixtrans-61.6-47.3175.1179.1-81.3000111.8Y13 K14 D15 S20 S21 K54Y13-Y17 VanDerWaalsContact O-CB 3.26Å; Y13-Y17 WeakPolarHBondContact O-CB 3.37Å; Y13-Y17 PolarHBondContact O-N 2.93Å; K14-Y17 WeakPolarHBondContact O-CB 3.35Å; K14-Y17 PolarHBondContact O-N 3.25Å; D15-Y17 PolarHBondContact O-N 3.09Å; Y17-S20 PolarHBondContact O-N 2.94Å; Y17-S21 PolarHBondContact O-N 2.92Å; Y17-S21 PolarHBondContact O-OG 2.9Å; Y17-K54 HydrophobicContact CD2-CD 4.14Å; Y17-K54 VanDerWaalsContact CD2-CE 3.49Å; Y17-K54 VanDerWaalsContact CD2-NZ 3.34Å; Y17-K54 VanDerWaalsContact CE2-NZ 3.3Å
18Y97Very high94.5Very high142 Ų14277.1 Ų77.156%0.55736%0.356SS*.Hα-helixtrans-64.7-44.8178-73.1-58.3000111.3K14 D15 S20 S21 I22K14-Y18 HydrophobicContact CB-CD2 4.47Å; K14-Y18 HydrophobicContact CB-CE2 4.24Å; K14-Y18 WeakPolarHBondContact O-CD2 3.45Å; K14-Y18 PolarHBondContact O-N 3.48Å; D15-Y18 PolarHBondContact O-N 3.01Å; Y18-S20 PolarHBondContact O-N 3.35Å; Y18-S21 WeakPolarHBondContact O-CB 3.36Å; Y18-S21 PolarHBondContact O-N 2.97Å; Y18-S21 VanDerWaalsContact O-N 3.1Å; Y18-I22 WeakPolarHBondContact O-CG1 3.48Å; Y18-I22 PolarHBondContact O-N 3.43Å
19N95.8Very high94.1Very high77 Ų7777 Ų7741%0.41235%0.351SS..Hα-helixtrans-59.6-44.4176.7-174.340000112.3D15 A16 S21 I22 Q23D15-N19 WeakPolarHBondContact O-CB 3.49Å; D15-N19 PolarHBondContact O-N 3.47Å; A16-N19 PolarHBondContact O-N 3.05Å; N19-S21 VanDerWaalsContact C-N 3.27Å; N19-S21 PolarHBondContact O-N 2.92Å; N19-I22 PolarHBondContact O-N 3.31Å; N19-Q23 WeakPolarHBondContact O-CG 3.36Å; N19-Q23 PolarHBondContact O-N 3.49Å
20S95.1Very high93.5Very high10 Ų1075.4 Ų75.47%0.0735%0.35CS..Hα-helixtrans-61.2-36.7175.1175.50000112.5A16 Y17 Y18 K24A16-S20 WeakPolarHBondContact O-CB 3.28Å; A16-S20 PolarHBondContact O-N 3.43Å; Y17-S20 PolarHBondContact O-N 2.94Å; Y18-S20 PolarHBondContact O-N 3.35Å; S20-K24 WeakPolarHBondContact O-CB 3.47Å; S20-K24 PolarHBondContact O-N 3.44Å
21S94.8Very high92.8Very high50 Ų5079 Ų7935%0.3536%0.364SS..Hα-helixtrans-67.8-40.1176.4-56.40000112Y17 Y18 N19 K24 Y25Y17-S21 PolarHBondContact O-N 2.92Å; Y17-S21 PolarHBondContact O-OG 2.9Å; Y18-S21 WeakPolarHBondContact O-CB 3.36Å; Y18-S21 PolarHBondContact O-N 2.97Å; Y18-S21 VanDerWaalsContact O-N 3.1Å; N19-S21 VanDerWaalsContact C-N 3.27Å; N19-S21 PolarHBondContact O-N 2.92Å; S21-K24 PolarHBondContact O-N 3.28Å; S21-Y25 PolarHBondContact O-N 3.3Å; S21-Y25 VanDerWaalsContact O-N 3.09Å
22I94Very high92.2Very high91 Ų9179.9 Ų79.947%0.46737%0.368SS..Hα-helixtrans-63.1-49.3174.4-67.4165.8000110.3Y18 N19 K24 Y25 E26Y18-I22 WeakPolarHBondContact O-CG1 3.48Å; Y18-I22 PolarHBondContact O-N 3.43Å; N19-I22 PolarHBondContact O-N 3.31Å; I22-K24 PolarHBondContact O-N 3.43Å; I22-Y25 WeakPolarHBondContact O-CB 3.4Å; I22-Y25 PolarHBondContact O-N 3.26Å; I22-E26 HydrophobicContact CG2-CG 4.36Å; I22-E26 PolarHBondContact O-N 3.46Å
23Q91.3Very high90.8Very high21 Ų2179 Ų7910%0.09838%0.38CS..Hα-helixtrans-62.2-33.2179.2-71.3-58.6-46.700112.6N19 E26 Y27 R46 L47 S50N19-Q23 WeakPolarHBondContact O-CG 3.36Å; N19-Q23 PolarHBondContact O-N 3.49Å; Q23-E26 PolarHBondContact NE2-OE2 3.29Å; Q23-E26 PolarHBondContact OE1-OE2 3.02Å; Q23-Y27 WeakPolarHBondContact O-CB 3.49Å; Q23-Y27 PolarHBondContact O-N 2.94Å; Q23-R46 VanDerWaalsContact OE1-CB 3.23Å; Q23-L47 HydrophobicContact CB-CD1 4.22Å; Q23-S50 WeakPolarHBondContact CB-OG 3.41Å
24K92.8Very high89Confident126 Ų12680.9 Ų80.955%0.54839%0.393SS..Hα-helixtrans-64.1-46.5172.8-175.7-179.6177.2-176.90110.8S20 S21 I22 Y27 E28 L47S20-K24 WeakPolarHBondContact O-CB 3.47Å; S20-K24 PolarHBondContact O-N 3.44Å; S21-K24 PolarHBondContact O-N 3.28Å; I22-K24 PolarHBondContact O-N 3.43Å; K24-Y27 PolarHBondContact O-N 3.46Å; K24-E28 WeakPolarHBondContact O-CG 3.47Å; K24-E28 PolarHBondContact O-N 3.46Å; K24-L47 HydrophobicContact CB-CD1 3.93Å
25Y91.7Very high87.1Confident150 Ų15085 Ų8559%0.58841%0.414SS*.Hα-helixtrans-60.1-48.6176.1178.1-100.4000111.6S21 I22 Y27 E28 E29S21-Y25 PolarHBondContact O-N 3.3Å; S21-Y25 VanDerWaalsContact O-N 3.09Å; I22-Y25 WeakPolarHBondContact O-CB 3.4Å; I22-Y25 PolarHBondContact O-N 3.26Å; Y25-Y27 VanDerWaalsContact C-N 3.32Å; Y25-Y27 PolarHBondContact O-N 3.02Å; Y25-E28 PolarHBondContact O-N 3.24Å; Y25-E29 HydrophobicContact CD1-CG 4.22Å; Y25-E29 HydrophobicContact CD2-CG 4.42Å; Y25-E29 HydrophobicContact CE1-CG 3.77Å; Y25-E29 HydrophobicContact CE2-CG 3.97Å; Y25-E29 WeakPolarHBondContact O-CG 3.49Å; Y25-E29 PolarHBondContact O-N 3.38Å
26E89.2Confident85.3Confident56 Ų5687.3 Ų87.326%0.26243%0.427SS..Hα-helixtrans-57.5-41.4177.3-71.4-173.6163.600112.8I22 Q23 E29 A30 R41 W43I22-E26 HydrophobicContact CG2-CG 4.36Å; I22-E26 PolarHBondContact O-N 3.46Å; Q23-E26 PolarHBondContact NE2-OE2 3.29Å; Q23-E26 PolarHBondContact OE1-OE2 3.02Å; E26-E29 PolarHBondContact O-N 3.4Å; E26-A30 WeakPolarHBondContact O-CB 3.24Å; E26-A30 PolarHBondContact O-N 3.08Å; E26-R41 IonicContact OE2-NH2 2.69Å; E26-W43 HydrophobicContact CB-CE3 4.04Å; E26-W43 HydrophobicContact CB-CZ3 3.73Å; E26-W43 HydrophobicContact CG-CZ3 4.24Å
27Y88.1Confident83.5Confident64 Ų6488 Ų8825%0.25143%0.432SS..Hα-helixtrans-65.8-42.3177.1174.8-100.4000112.9Q23 K24 Y25 A30 K31 W43 L47Q23-Y27 WeakPolarHBondContact O-CB 3.49Å; Q23-Y27 PolarHBondContact O-N 2.94Å; K24-Y27 PolarHBondContact O-N 3.46Å; Y25-Y27 VanDerWaalsContact C-N 3.32Å; Y25-Y27 PolarHBondContact O-N 3.02Å; Y27-A30 PolarHBondContact O-N 2.98Å; Y27-K31 HydrophobicContact CD1-CD 4.33Å; Y27-K31 HydrophobicContact CE1-CD 3.73Å; Y27-K31 HydrophobicContact CE1-CG 4.48Å; Y27-K31 VanDerWaalsContact CZ-CE 3.48Å; Y27-K31 PolarHBondContact O-N 3.36Å; Y27-K31 VanDerWaalsContact O-N 3.16Å; Y27-K31 WeakPolarHBondContact OH-CE 3.36Å; Y27-K31 PolarHBondContact OH-NZ 2.95Å; Y27-W43 HydrophobicContact CD2-CB 4.06Å; Y27-L47 HydrophobicContact CD1-CD2 3.6Å; Y27-L47 HydrophobicContact CD2-CD2 4.31Å; Y27-L47 HydrophobicContact CE1-CD2 4.19Å; Y27-L47 HydrophobicContact CG-CD2 3.65Å
28E88.5Confident82Confident84 Ų8487 Ų8739%0.39343%0.434SS..Hα-helixtrans-68.4-36177.4-67.6-60.8153.300111.9K24 Y25 K31 K32K24-E28 WeakPolarHBondContact O-CG 3.47Å; K24-E28 PolarHBondContact O-N 3.46Å; Y25-E28 PolarHBondContact O-N 3.24Å; E28-K31 PolarHBondContact O-N 3.15Å; E28-K32 WeakPolarHBondContact O-CG 3.35Å
29E86.6Confident80.4Confident70 Ų7086.5 Ų86.533%0.32745%0.448SS..Hα-helixtrans-66-45172.9-70.2-57.7123.300111.5Y25 E26 K31 K32Y25-E29 HydrophobicContact CD1-CG 4.22Å; Y25-E29 HydrophobicContact CD2-CG 4.42Å; Y25-E29 HydrophobicContact CE1-CG 3.77Å; Y25-E29 HydrophobicContact CE2-CG 3.97Å; Y25-E29 WeakPolarHBondContact O-CG 3.49Å; Y25-E29 PolarHBondContact O-N 3.38Å; E26-E29 PolarHBondContact O-N 3.4Å; E29-K31 PolarHBondContact O-N 2.95Å; E29-K32 PolarHBondContact O-N 3.29Å; E29-K32 IonicContact OE1-NZ 3.1Å; E29-K32 PolarHBondContact OE1-NZ 3.28Å; E29-K32 IonicContact OE2-NZ 2.91Å
30A83.3Confident79.1Confident26 Ų2694 Ų9422%0.21547%0.47CS..Hα-helixtrans-60.3-29.8177.100000113E26 Y27 K32 W43E26-A30 WeakPolarHBondContact O-CB 3.24Å; E26-A30 PolarHBondContact O-N 3.08Å; Y27-A30 PolarHBondContact O-N 2.98Å; A30-K32 VanDerWaalsContact C-N 3.33Å; A30-K32 PolarHBondContact O-N 2.96Å; A30-W43 HydrophobicContact CB-CD2 4.04Å; A30-W43 HydrophobicContact CB-CG 3.9Å
31K81.1Confident78.2Confident127 Ų12797.4 Ų97.455%0.55248%0.482SS*.Hα-helixtrans-70.8-22.4176.3-88.4-176.9152.4178.40114.6Y27 E28 E29 G33Y27-K31 HydrophobicContact CD1-CD 4.33Å; Y27-K31 HydrophobicContact CE1-CD 3.73Å; Y27-K31 HydrophobicContact CE1-CG 4.48Å; Y27-K31 VanDerWaalsContact CZ-CE 3.48Å; Y27-K31 PolarHBondContact O-N 3.36Å; Y27-K31 VanDerWaalsContact O-N 3.16Å; Y27-K31 WeakPolarHBondContact OH-CE 3.36Å; Y27-K31 PolarHBondContact OH-NZ 2.95Å; E28-K31 PolarHBondContact O-N 3.15Å; E29-K31 PolarHBondContact O-N 2.95Å; K31-G33 PolarHBondContact O-N 3.01Å
32K84.2Confident77.8Confident147 Ų14799.7 Ų99.764%0.63949%0.49SS*.THydrogen-bonded Turntrans-75.62.2-175.3-70.3172.1-174.8172.30114E28 E29 A30E28-K32 WeakPolarHBondContact O-CG 3.35Å; E29-K32 PolarHBondContact O-N 3.29Å; E29-K32 IonicContact OE1-NZ 3.1Å; E29-K32 PolarHBondContact OE1-NZ 3.28Å; E29-K32 IonicContact OE2-NZ 2.91Å; A30-K32 VanDerWaalsContact C-N 3.33Å; A30-K32 PolarHBondContact O-N 2.96Å
33G66.6Low77.5Confident61 Ų6197.8 Ų97.863%0.62948%0.477SS*.  trans91.634169.500000114.9K31 E35K31-G33 PolarHBondContact O-N 3.01Å; G33-E35 PolarHBondContact O-N 3.1Å
34D59.9Low77.3Confident87 Ų8797.3 Ų97.347%0.46548%0.478SS..  trans-64.3115.5169-174.21.1000109.5N36 A37D34-N36 PolarHBondContact O-N 3.04Å; D34-N36 VanDerWaalsContact OD1-CB 3.27Å; D34-N36 WeakPolarHBondContact OD1-CB 3.25Å; D34-N36 PolarHBondContact OD1-N 3Å; D34-N36 PolarHBondContact OD1-ND2 3.49Å; D34-A37 HydrophobicContact CB-CB 4.39Å; D34-A37 VanDerWaalsContact O-CB 3.29Å; D34-A37 WeakPolarHBondContact O-CB 3.48Å; D34-A37 PolarHBondContact O-N 3.2Å
35E57.3Low77.3Confident197 Ų19792.1 Ų92.192%0.92146%0.46SS*.THydrogen-bonded Turntrans-56.6-18.5172.9-66.7-179.4174.700112.1G33G33-E35 PolarHBondContact O-N 3.1Å
36N59.3Low77.2Confident136 Ų13690.4 Ų90.473%0.72745%0.453SS*.THydrogen-bonded Turntrans-92.9-0.2175.4-53.5-68.1000114.5D34 D38D34-N36 PolarHBondContact O-N 3.04Å; D34-N36 VanDerWaalsContact OD1-CB 3.27Å; D34-N36 WeakPolarHBondContact OD1-CB 3.25Å; D34-N36 PolarHBondContact OD1-N 3Å; D34-N36 PolarHBondContact OD1-ND2 3.49Å; N36-D38 PolarHBondContact O-N 3.18Å
37A59.9Low77.4Confident26 Ų2688.8 Ų88.822%0.21545%0.446CS..SBendtrans-62.3104.2175.400000108.6D34 P39D34-A37 HydrophobicContact CB-CB 4.39Å; D34-A37 VanDerWaalsContact O-CB 3.29Å; D34-A37 WeakPolarHBondContact O-CB 3.48Å; D34-A37 PolarHBondContact O-N 3.2Å; A37-P39 WeakPolarHBondContact O-CD 3.35Å
38D65.5Low77.8Confident79 Ų7993.3 Ų93.342%0.42246%0.462SS..  trans-49.1108.6-176.6179.50.9000109.7N36 R40 R41N36-D38 PolarHBondContact O-N 3.18Å; D38-R40 PolarHBondContact O-N 3.46Å; D38-R40 VanDerWaalsContact OD1-CB 3.24Å; D38-R40 WeakPolarHBondContact OD1-CB 3.49Å; D38-R40 PolarHBondContact OD1-N 2.96Å; D38-R41 HydrophobicContact CB-CB 3.98Å; D38-R41 WeakPolarHBondContact O-CB 3.38Å; D38-R41 PolarHBondContact O-N 3.2Å
39P64Low78.1Confident132 Ų13292.3 Ų92.386%0.85747%0.468SS*.THydrogen-bonded Turntrans-62.3-17.6-176.9-24.335.4000112.4A37 R41A37-P39 WeakPolarHBondContact O-CD 3.35Å; P39-R41 VanDerWaalsContact C-N 3.32Å
40R68.2Low78.5Confident233 Ų23389.2 Ų89.288%0.87946%0.455SS*.THydrogen-bonded Turntrans-80-13.6175.5-57.5179.2175.7170.40.2112.9D38 D42D38-R40 PolarHBondContact O-N 3.46Å; D38-R40 VanDerWaalsContact OD1-CB 3.24Å; D38-R40 WeakPolarHBondContact OD1-CB 3.49Å; D38-R40 PolarHBondContact OD1-N 2.96Å; R40-D42 PolarHBondContact O-N 3.32Å
41R76.8Confident79.1Confident83 Ų8391.2 Ų91.231%0.31346%0.461SS..  trans-89.9108.9-175.4-167.5165.5170.4174.8-5.2109.9E26 D38 P39 W43 R46E26-R41 IonicContact OE2-NH2 2.69Å; D38-R41 HydrophobicContact CB-CB 3.98Å; D38-R41 WeakPolarHBondContact O-CB 3.38Å; D38-R41 PolarHBondContact O-N 3.2Å; P39-R41 VanDerWaalsContact C-N 3.32Å; R41-W43 VanDerWaalsContact CD-CZ2 3.49Å; R41-W43 HydrophobicContact CG-CD2 4.14Å; R41-W43 HydrophobicContact CG-CZ2 4.19Å; R41-W43 VanDerWaalsContact CZ-CZ3 3.45Å; R41-W43 VanDerWaalsContact NE-CZ3 3.34Å; R41-W43 VanDerWaalsContact NH2-CZ3 3.35Å; R41-W43 PolarHBondContact O-N 2.92Å; R41-R46 VanDerWaalsContact CZ-NH1 3.3Å; R41-R46 VanDerWaalsContact NE-CZ 3.32Å; R41-R46 VanDerWaalsContact NE-NH1 3.18Å
42D86.4Confident79.8Confident97 Ų9787.8 Ų87.852%0.51945%0.453SS..  trans-72.976.6174.9-176.615.1000111.4R40 G44 G45 R46 R48R40-D42 PolarHBondContact O-N 3.32Å; D42-G44 PolarHBondContact O-N 3.13Å; D42-G44 PolarHBondContact OD1-N 3.36Å; D42-G45 VanDerWaalsContact CG-N 3.25Å; D42-G45 PolarHBondContact O-N 3.43Å; D42-G45 PolarHBondContact OD1-N 2.92Å; D42-G45 WeakPolarHBondContact OD2-CA 3.39Å; D42-G45 PolarHBondContact OD2-N 2.95Å; D42-R46 PolarHBondContact O-N 3.45Å; D42-R48 IonicContact OD1-NH2 3.41Å; D42-R48 IonicContact OD2-NH2 3.86Å
43W85.8Confident80.4Confident51 Ų5184.8 Ų84.819%0.19344%0.441CS..Hα-helixtrans-56.7-39.8176.2-63.2106.2000112E26 Y27 A30 R41 R46 L47E26-W43 HydrophobicContact CB-CE3 4.04Å; E26-W43 HydrophobicContact CB-CZ3 3.73Å; E26-W43 HydrophobicContact CG-CZ3 4.24Å; Y27-W43 HydrophobicContact CD2-CB 4.06Å; A30-W43 HydrophobicContact CB-CD2 4.04Å; A30-W43 HydrophobicContact CB-CG 3.9Å; R41-W43 VanDerWaalsContact CD-CZ2 3.49Å; R41-W43 HydrophobicContact CG-CD2 4.14Å; R41-W43 HydrophobicContact CG-CZ2 4.19Å; R41-W43 VanDerWaalsContact CZ-CZ3 3.45Å; R41-W43 VanDerWaalsContact NE-CZ3 3.34Å; R41-W43 VanDerWaalsContact NH2-CZ3 3.35Å; R41-W43 PolarHBondContact O-N 2.92Å; W43-R46 PolarHBondContact O-N 3.25Å; W43-L47 PolarHBondContact O-N 2.98Å
44G88.2Confident81.9Confident12 Ų1283.7 Ų83.712%0.12442%0.419CS..Hα-helixtrans-64.6-41.6177.800000112.3D42 L47 R48D42-G44 PolarHBondContact O-N 3.13Å; D42-G44 PolarHBondContact OD1-N 3.36Å; G44-L47 PolarHBondContact O-N 3.48Å; G44-R48 WeakPolarHBondContact O-CB 3.09Å; G44-R48 WeakPolarHBondContact O-CG 3.48Å; G44-R48 PolarHBondContact O-N 3.4Å
45G91.7Very high83.6Confident17 Ų1787.2 Ų87.218%0.17543%0.426CS..Hα-helixtrans-63.5-43.4174.900000112.8D42 R48 A49D42-G45 VanDerWaalsContact CG-N 3.25Å; D42-G45 PolarHBondContact O-N 3.43Å; D42-G45 PolarHBondContact OD1-N 2.92Å; D42-G45 WeakPolarHBondContact OD2-CA 3.39Å; D42-G45 PolarHBondContact OD2-N 2.95Å; G45-R48 PolarHBondContact O-N 2.98Å; G45-A49 WeakPolarHBondContact O-CB 3.44Å; G45-A49 PolarHBondContact O-N 3.32Å
46R91.5Very high85.5Confident113 Ų11382.6 Ų82.643%0.42640%0.403SS..Hα-helixtrans-62.7-43.5175.6-67.3-178.1177.5-153.63.1112.2Q23 R41 D42 W43 A49 S50Q23-R46 VanDerWaalsContact OE1-CB 3.23Å; R41-R46 VanDerWaalsContact CZ-NH1 3.3Å; R41-R46 VanDerWaalsContact NE-CZ 3.32Å; R41-R46 VanDerWaalsContact NE-NH1 3.18Å; D42-R46 PolarHBondContact O-N 3.45Å; W43-R46 PolarHBondContact O-N 3.25Å; R46-A49 PolarHBondContact O-N 3.38Å; R46-S50 WeakPolarHBondContact O-CB 3.41Å; R46-S50 PolarHBondContact O-N 3.33Å; R46-S50 PolarHBondContact O-OG 3.41Å
47L93.2Very high87.3Confident22 Ų2277.4 Ų77.412%0.11537%0.374CS..Hα-helixtrans-60.7-49.4174.8178.356.7000111.1Q23 K24 Y27 W43 G44 A49 S50 I51Q23-L47 HydrophobicContact CB-CD1 4.22Å; K24-L47 HydrophobicContact CB-CD1 3.93Å; Y27-L47 HydrophobicContact CD1-CD2 3.6Å; Y27-L47 HydrophobicContact CD2-CD2 4.31Å; Y27-L47 HydrophobicContact CE1-CD2 4.19Å; Y27-L47 HydrophobicContact CG-CD2 3.65Å; W43-L47 PolarHBondContact O-N 2.98Å; G44-L47 PolarHBondContact O-N 3.48Å; L47-A49 VanDerWaalsContact C-N 3.32Å; L47-A49 PolarHBondContact O-N 3.37Å; L47-S50 PolarHBondContact O-N 3.36Å; L47-S50 PolarHBondContact O-OG 3.44Å; L47-I51 HydrophobicContact CD1-CD1 3.67Å; L47-I51 HydrophobicContact CD1-CG1 3.98Å; L47-I51 HydrophobicContact CG-CD1 3.83Å; L47-I51 WeakPolarHBondContact O-CG1 3.44Å; L47-I51 PolarHBondContact O-N 3.03Å
48R94.9Very high89.1Confident160 Ų16079.7 Ų79.760%0.60438%0.377SS*.Hα-helixtrans-57.4-44.7177.3-76.4-173-62.5-96.2-1111.9D42 G44 G45 I51 S52D42-R48 IonicContact OD1-NH2 3.41Å; D42-R48 IonicContact OD2-NH2 3.86Å; G44-R48 WeakPolarHBondContact O-CB 3.09Å; G44-R48 WeakPolarHBondContact O-CG 3.48Å; G44-R48 PolarHBondContact O-N 3.4Å; G45-R48 PolarHBondContact O-N 2.98Å; R48-I51 PolarHBondContact O-N 3.46Å; R48-S52 WeakPolarHBondContact O-CB 3.45Å; R48-S52 PolarHBondContact O-N 3.44Å
49A95.3Very high90.6Very high62 Ų6281.9 Ų81.951%0.51239%0.385SS..Hα-helixtrans-62.3-45.9177.300000111.8G45 R46 L47 I51 S52 E53G45-A49 WeakPolarHBondContact O-CB 3.44Å; G45-A49 PolarHBondContact O-N 3.32Å; R46-A49 PolarHBondContact O-N 3.38Å; L47-A49 VanDerWaalsContact C-N 3.32Å; L47-A49 PolarHBondContact O-N 3.37Å; A49-I51 PolarHBondContact O-N 3.25Å; A49-S52 WeakPolarHBondContact O-CB 3.45Å; A49-S52 PolarHBondContact O-N 2.95Å; A49-E53 WeakPolarHBondContact O-CB 3.35Å; A49-E53 PolarHBondContact O-N 2.91Å
50S95.5Very high92.1Very high6 Ų678.4 Ų78.44%0.04236%0.359CS..Hα-helixtrans-65.6-37.6-179.973.40000113.3Q23 R46 L47 E53 K54Q23-S50 WeakPolarHBondContact CB-OG 3.41Å; R46-S50 WeakPolarHBondContact O-CB 3.41Å; R46-S50 PolarHBondContact O-N 3.33Å; R46-S50 PolarHBondContact O-OG 3.41Å; L47-S50 PolarHBondContact O-N 3.36Å; L47-S50 PolarHBondContact O-OG 3.44Å; S50-E53 PolarHBondContact O-N 3.25Å; S50-K54 WeakPolarHBondContact O-CB 3.16Å; S50-K54 PolarHBondContact O-N 3.29Å
51I95.4Very high93.4Very high67 Ų6767.6 Ų67.634%0.34432%0.318SS..Hα-helixtrans-67-44.6174.7-70.2170.5000109.7L47 R48 A49 E53 K54 W55L47-I51 HydrophobicContact CD1-CD1 3.67Å; L47-I51 HydrophobicContact CD1-CG1 3.98Å; L47-I51 HydrophobicContact CG-CD1 3.83Å; L47-I51 WeakPolarHBondContact O-CG1 3.44Å; L47-I51 PolarHBondContact O-N 3.03Å; R48-I51 PolarHBondContact O-N 3.46Å; A49-I51 PolarHBondContact O-N 3.25Å; I51-E53 VanDerWaalsContact C-N 3.31Å; I51-E53 PolarHBondContact O-N 2.86Å; I51-K54 PolarHBondContact O-N 2.71Å; I51-W55 PolarHBondContact O-N 3.43Å; I51-W55 VanDerWaalsContact O-N 3.1Å
52S96.8Very high94.3Very high55 Ų5566.6 Ų66.639%0.38532%0.319SS..Hα-helixtrans-58.2-45176.3-178.40000111.3R48 A49 W55 K56R48-S52 WeakPolarHBondContact O-CB 3.45Å; R48-S52 PolarHBondContact O-N 3.44Å; A49-S52 WeakPolarHBondContact O-CB 3.45Å; A49-S52 PolarHBondContact O-N 2.95Å; S52-W55 PolarHBondContact O-N 3.28Å; S52-K56 WeakPolarHBondContact O-CG 3.47Å; S52-K56 PolarHBondContact O-N 2.94Å
53E96.3Very high94.8Very high85 Ų8567 Ų6740%0.39732%0.321SS..Hα-helixtrans-65.3-42.1179.7-162.760.9-161.300112.5A49 S50 I51 W55 K56 E57A49-E53 WeakPolarHBondContact O-CB 3.35Å; A49-E53 PolarHBondContact O-N 2.91Å; S50-E53 PolarHBondContact O-N 3.25Å; I51-E53 VanDerWaalsContact C-N 3.31Å; I51-E53 PolarHBondContact O-N 2.86Å; E53-W55 VanDerWaalsContact C-N 3.29Å; E53-W55 PolarHBondContact O-N 3.03Å; E53-K56 PolarHBondContact O-N 3.46Å; E53-K56 IonicContact OE2-NZ 3.94Å; E53-E57 PolarHBondContact O-N 3.41Å
54K97.1Very high95.2Very high38 Ų3866.2 Ų66.217%0.16532%0.322CS..Hα-helixtrans-55.7-43.5173.3173.2-173.7163.2172.70112Y13 A16 Y17 S50 I51 R58Y13-K54 HydrophobicContact CE2-CG 4.27Å; A16-K54 HydrophobicContact CB-CB 4.48Å; Y17-K54 HydrophobicContact CD2-CD 4.14Å; Y17-K54 VanDerWaalsContact CD2-CE 3.49Å; Y17-K54 VanDerWaalsContact CD2-NZ 3.34Å; Y17-K54 VanDerWaalsContact CE2-NZ 3.3Å; S50-K54 WeakPolarHBondContact O-CB 3.16Å; S50-K54 PolarHBondContact O-N 3.29Å; I51-K54 PolarHBondContact O-N 2.71Å; K54-R58 PolarHBondContact O-N 3.46Å
55W97.4Very high95.4Very high161 Ų16169.4 Ų69.461%0.6133%0.334SS*.Hα-helixtrans-70.7-37.7179.8-72.5118.8000112.5I51 S52 E53 R58 E59I51-W55 PolarHBondContact O-N 3.43Å; I51-W55 VanDerWaalsContact O-N 3.1Å; S52-W55 PolarHBondContact O-N 3.28Å; E53-W55 VanDerWaalsContact C-N 3.29Å; E53-W55 PolarHBondContact O-N 3.03Å; W55-R58 PolarHBondContact O-N 2.98Å; W55-E59 PolarHBondContact O-N 3.36Å
56K97.2Very high95.6Very high100 Ų10072.1 Ų72.144%0.43535%0.35SS..Hα-helixtrans-60.8-46.9172.6-70.9175.8-174.6173.30111.9S52 E53 R58 E59 I60S52-K56 WeakPolarHBondContact O-CG 3.47Å; S52-K56 PolarHBondContact O-N 2.94Å; E53-K56 PolarHBondContact O-N 3.46Å; E53-K56 IonicContact OE2-NZ 3.94Å; K56-R58 PolarHBondContact O-N 3.33Å; K56-E59 PolarHBondContact O-N 2.94Å; K56-I60 VanDerWaalsContact O-CG1 3.28Å; K56-I60 WeakPolarHBondContact O-CG1 3.49Å; K56-I60 PolarHBondContact O-N 3.32Å
57E96.6Very high95.7Very high26 Ų2669.5 Ų69.512%0.12135%0.352CS..Hα-helixtrans-65.6-29.3177.2-75.8-64.7173.300112.5R9 H12 A16 E53 L61R9-E57 IonicContact CZ-OE2 3.93Å; R9-E57 IonicContact NH1-OE1 2.73Å; R9-E57 IonicContact NH1-OE2 2.68Å; R9-E57 PolarHBondContact NH1-OE2 3.01Å; H12-E57 WeakPolarHBondContact CB-OE2 3.42Å; H12-E57 IonicContact ND1-OE1 3.96Å; A16-E57 HydrophobicContact CB-CB 4.19Å; A16-E57 HydrophobicContact CB-CG 4.06Å; E53-E57 PolarHBondContact O-N 3.41Å; E57-L61 VanDerWaalsContact O-CB 3.32Å; E57-L61 WeakPolarHBondContact O-CB 3.36Å; E57-L61 PolarHBondContact O-N 3.39Å
58R97.4Very high95.6Very high74 Ų7471.6 Ų71.628%0.27936%0.359SS..Hα-helixtrans-69.9-45.8173.1-175.763.3-161.7-1769.3112.1Y13 K54 W55 K56 I60 L61 D62 E65Y13-R58 HydrophobicContact CD2-CB 3.92Å; Y13-R58 HydrophobicContact CE2-CB 3.77Å; Y13-R58 HydrophobicContact CE2-CG 4.22Å; K54-R58 PolarHBondContact O-N 3.46Å; W55-R58 PolarHBondContact O-N 2.98Å; K56-R58 PolarHBondContact O-N 3.33Å; R58-I60 VanDerWaalsContact C-N 3.31Å; R58-I60 PolarHBondContact O-N 3.48Å; R58-L61 WeakPolarHBondContact O-CB 3.4Å; R58-L61 PolarHBondContact O-N 3.4Å; R58-L61 VanDerWaalsContact O-N 3.12Å; R58-D62 IonicContact CZ-OD1 2.82Å; R58-D62 IonicContact NE-OD1 3.73Å; R58-D62 PolarHBondContact NE-OD1 3.41Å; R58-D62 IonicContact NE-OD2 3.89Å; R58-D62 PolarHBondContact NE-OD2 3.36Å; R58-D62 IonicContact NH2-OD1 3.89Å; R58-D62 PolarHBondContact NH2-OD1 3.48Å; R58-D62 PolarHBondContact O-N 2.64Å; R58-E65 IonicContact NH2-OE2 2.69Å
59E96.4Very high95.6Very high125 Ų12567.1 Ų67.158%0.58435%0.346SS*.Hα-helixtrans-55.7-47.9177.1-177.3174.7-157.800110.6W55 K56 L61 D62 D63W55-E59 PolarHBondContact O-N 3.36Å; K56-E59 PolarHBondContact O-N 2.94Å; E59-L61 VanDerWaalsContact C-N 3.33Å; E59-L61 PolarHBondContact O-N 2.95Å; E59-D62 PolarHBondContact O-N 3.08Å; E59-D63 PolarHBondContact O-N 3Å
60I95.9Very high95.5Very high60 Ų6066.6 Ų66.631%0.30834%0.342SS..Hα-helixtrans-69.5-32.2179-48.6158.4000112K56 R58 V64K56-I60 VanDerWaalsContact O-CG1 3.28Å; K56-I60 WeakPolarHBondContact O-CG1 3.49Å; K56-I60 PolarHBondContact O-N 3.32Å; R58-I60 VanDerWaalsContact C-N 3.31Å; R58-I60 PolarHBondContact O-N 3.48Å; I60-V64 VanDerWaalsContact O-CG2 3.29Å; I60-V64 WeakPolarHBondContact O-CG2 3.45Å; I60-V64 PolarHBondContact O-N 2.92Å
61L96.1Very high95.3Very high6 Ų671.5 Ų71.53%0.03136%0.364CS..Hα-helixtrans-64.7-43.1172.7177.460.9000111.5L6 R9 I10 Y13 E57 R58 E59 D63 V64 E65L6-L61 HydrophobicContact CD1-CD1 4.1Å; R9-L61 HydrophobicContact CB-CD1 4.14Å; R9-L61 HydrophobicContact CG-CB 3.84Å; R9-L61 HydrophobicContact CG-CD1 3.69Å; R9-L61 HydrophobicContact CG-CG 4.36Å; I10-L61 HydrophobicContact CG1-CD1 3.77Å; I10-L61 HydrophobicContact CG1-CD2 4.45Å; Y13-L61 HydrophobicContact CD1-CD2 3.94Å; Y13-L61 HydrophobicContact CG-CD2 3.97Å; E57-L61 VanDerWaalsContact O-CB 3.32Å; E57-L61 WeakPolarHBondContact O-CB 3.36Å; E57-L61 PolarHBondContact O-N 3.39Å; R58-L61 WeakPolarHBondContact O-CB 3.4Å; R58-L61 PolarHBondContact O-N 3.4Å; R58-L61 VanDerWaalsContact O-N 3.12Å; E59-L61 VanDerWaalsContact C-N 3.33Å; E59-L61 PolarHBondContact O-N 2.95Å; L61-D63 VanDerWaalsContact C-N 3.33Å; L61-D63 PolarHBondContact O-N 3.23Å; L61-V64 PolarHBondContact O-N 3.2Å; L61-E65 VanDerWaalsContact O-CB 3.26Å; L61-E65 WeakPolarHBondContact O-CB 3.37Å; L61-E65 PolarHBondContact O-N 3.5Å
62D95.7Very high95Very high62 Ų6270.6 Ų70.633%0.33236%0.362SS..Hα-helixtrans-63.1-39.5179.3-70.7-27.4000111.2R58 E59 S66R58-D62 IonicContact CZ-OD1 2.82Å; R58-D62 IonicContact NE-OD1 3.73Å; R58-D62 PolarHBondContact NE-OD1 3.41Å; R58-D62 IonicContact NE-OD2 3.89Å; R58-D62 PolarHBondContact NE-OD2 3.36Å; R58-D62 IonicContact NH2-OD1 3.89Å; R58-D62 PolarHBondContact NH2-OD1 3.48Å; R58-D62 PolarHBondContact O-N 2.64Å; E59-D62 PolarHBondContact O-N 3.08Å; D62-S66 WeakPolarHBondContact O-CB 3.5Å; D62-S66 PolarHBondContact O-N 3.29Å; D62-S66 PolarHBondContact O-OG 3.02Å
63D95.5Very high94.8Very high105 Ų10576 Ų7656%0.56137%0.374SS*.Hα-helixtrans-61.3-48.2174.4-75.1-20.6000112.1E59 L61 S66 A67E59-D63 PolarHBondContact O-N 3Å; L61-D63 VanDerWaalsContact C-N 3.33Å; L61-D63 PolarHBondContact O-N 3.23Å; D63-S66 PolarHBondContact O-N 3.33Å; D63-A67 WeakPolarHBondContact O-CB 3.42Å; D63-A67 PolarHBondContact O-N 3.48Å
64V94.2Very high94.6Very high34 Ų3475.8 Ų75.821%0.20638%0.379CS..Hα-helixtrans-68.3-41.4-179.1175.20000111.2L6 I60 L61 A67 Y68L6-V64 HydrophobicContact CD1-CG1 3.94Å; I60-V64 VanDerWaalsContact O-CG2 3.29Å; I60-V64 WeakPolarHBondContact O-CG2 3.45Å; I60-V64 PolarHBondContact O-N 2.92Å; L61-V64 PolarHBondContact O-N 3.2Å; V64-A67 PolarHBondContact O-N 2.88Å; V64-Y68 PolarHBondContact O-N 3.13Å
65E93.7Very high94.2Very high80 Ų8077.9 Ų77.937%0.37439%0.392SS..Hα-helixtrans-63.3-43.5176.2-175.8170.5-16800110.8R58 L61 A67 Y68 I69R58-E65 IonicContact NH2-OE2 2.69Å; L61-E65 VanDerWaalsContact O-CB 3.26Å; L61-E65 WeakPolarHBondContact O-CB 3.37Å; L61-E65 PolarHBondContact O-N 3.5Å; E65-A67 PolarHBondContact O-N 3.37Å; E65-Y68 PolarHBondContact O-N 3.43Å; E65-I69 HydrophobicContact CG-CD1 4.03Å; E65-I69 VanDerWaalsContact O-CG1 3.3Å; E65-I69 WeakPolarHBondContact O-CG1 3.49Å; E65-I69 PolarHBondContact O-N 3.48Å
66S95Very high94Very high74 Ų7474.1 Ų74.152%0.51739%0.386SS..Hα-helixtrans-61.6-44.3176.1-63.30000112D62 D63 I69 A70D62-S66 WeakPolarHBondContact O-CB 3.5Å; D62-S66 PolarHBondContact O-N 3.29Å; D62-S66 PolarHBondContact O-OG 3.02Å; D63-S66 PolarHBondContact O-N 3.33Å; S66-I69 PolarHBondContact O-N 3.01Å; S66-A70 WeakPolarHBondContact O-CB 3.43Å; S66-A70 PolarHBondContact O-N 3Å
67A93.8Very high93.7Very high58 Ų5874 Ų7448%0.47939%0.39SS..Hα-helixtrans-61.6-44.4176.300000112D63 V64 E65 I69 A70 E71D63-A67 WeakPolarHBondContact O-CB 3.42Å; D63-A67 PolarHBondContact O-N 3.48Å; V64-A67 PolarHBondContact O-N 2.88Å; E65-A67 PolarHBondContact O-N 3.37Å; A67-I69 PolarHBondContact O-N 3.34Å; A67-A70 PolarHBondContact O-N 3.01Å; A67-E71 WeakPolarHBondContact O-CB 3.49Å; A67-E71 PolarHBondContact O-N 3.49Å
68Y92.4Very high93.5Very high66 Ų6676.8 Ų76.826%0.25941%0.409SS..Hα-helixtrans-62.5-41.6176.6175.8-106.5000112.3P3 L6 V64 E65 E71 T72P3-Y68 HydrophobicContact CG-CD2 3.6Å; P3-Y68 HydrophobicContact CG-CE2 3.32Å; L6-Y68 HydrophobicContact CD2-CD1 4.06Å; L6-Y68 HydrophobicContact CD2-CE1 4.44Å; L6-Y68 HydrophobicContact CD2-CG 4.27Å; V64-Y68 PolarHBondContact O-N 3.13Å; E65-Y68 PolarHBondContact O-N 3.43Å; Y68-E71 PolarHBondContact O-N 3.32Å; Y68-T72 HydrophobicContact CD1-CG2 4.47Å; Y68-T72 HydrophobicContact CD2-CG2 4.19Å; Y68-T72 HydrophobicContact CE1-CG2 4.06Å; Y68-T72 HydrophobicContact CE2-CG2 3.76Å; Y68-T72 WeakPolarHBondContact O-CB 3.37Å; Y68-T72 VanDerWaalsContact O-CG2 3.3Å; Y68-T72 WeakPolarHBondContact O-CG2 3.36Å; Y68-T72 PolarHBondContact O-N 3Å; Y68-T72 PolarHBondContact O-OG1 3.26Å
69I93.2Very high93.3Very high65 Ų6578.1 Ų78.133%0.33342%0.422SS..Hα-helixtrans-65-40.1175.9-67.7167.2000111E65 S66 A67 T72 R73E65-I69 HydrophobicContact CG-CD1 4.03Å; E65-I69 VanDerWaalsContact O-CG1 3.3Å; E65-I69 WeakPolarHBondContact O-CG1 3.49Å; E65-I69 PolarHBondContact O-N 3.48Å; S66-I69 PolarHBondContact O-N 3.01Å; A67-I69 PolarHBondContact O-N 3.34Å; I69-T72 WeakPolarHBondContact CA-OG1 3.38Å; I69-T72 PolarHBondContact O-OG1 2.87Å; I69-R73 WeakPolarHBondContact O-CB 3.36Å; I69-R73 VanDerWaalsContact O-CG 3.26Å; I69-R73 WeakPolarHBondContact O-CG 3.44Å; I69-R73 PolarHBondContact O-N 3.04Å
70A93.5Very high93.3Very high51 Ų5175.6 Ų75.642%0.42141%0.411SS..Hα-helixtrans-65.6-43.8176.900000112.2S66 A67 R73 T74S66-A70 WeakPolarHBondContact O-CB 3.43Å; S66-A70 PolarHBondContact O-N 3Å; A67-A70 PolarHBondContact O-N 3.01Å; A70-R73 PolarHBondContact O-N 3.26Å; A70-T74 WeakPolarHBondContact O-CB 3.39Å; A70-T74 PolarHBondContact O-N 3.39Å; A70-T74 PolarHBondContact O-OG1 3.48Å
71E90.9Very high93.3Very high109 Ų10977.2 Ų77.251%0.50942%0.418SS..Hα-helixtrans-62.5-48.4176.6-175.1-175.7-178.100111.2A67 Y68 R73 T74 N75A67-E71 WeakPolarHBondContact O-CB 3.49Å; A67-E71 PolarHBondContact O-N 3.49Å; Y68-E71 PolarHBondContact O-N 3.32Å; E71-R73 PolarHBondContact O-N 3.25Å; E71-T74 WeakPolarHBondContact O-CB 3.27Å; E71-T74 PolarHBondContact O-N 3.44Å; E71-T74 VanDerWaalsContact O-N 3.12Å; E71-N75 PolarHBondContact O-N 3.45Å
72T90.8Very high93.3Very high48 Ų4881.2 Ų81.229%0.29444%0.436SS..Hα-helixtrans-61.5-41.8178.550.20000112.2Y68 I69 T74 N75 V76Y68-T72 HydrophobicContact CD1-CG2 4.47Å; Y68-T72 HydrophobicContact CD2-CG2 4.19Å; Y68-T72 HydrophobicContact CE1-CG2 4.06Å; Y68-T72 HydrophobicContact CE2-CG2 3.76Å; Y68-T72 WeakPolarHBondContact O-CB 3.37Å; Y68-T72 VanDerWaalsContact O-CG2 3.3Å; Y68-T72 WeakPolarHBondContact O-CG2 3.36Å; Y68-T72 PolarHBondContact O-N 3Å; Y68-T72 PolarHBondContact O-OG1 3.26Å; I69-T72 WeakPolarHBondContact CA-OG1 3.38Å; I69-T72 PolarHBondContact O-OG1 2.87Å; T72-T74 VanDerWaalsContact C-N 3.35Å; T72-T74 PolarHBondContact O-N 3.41Å; T72-N75 PolarHBondContact O-N 3.5Å; T72-V76 WeakPolarHBondContact O-CB 3.42Å; T72-V76 VanDerWaalsContact O-CG2 3.26Å; T72-V76 WeakPolarHBondContact O-CG2 3.46Å; T72-V76 PolarHBondContact O-N 2.94Å
73R92.7Very high93.4Very high168 Ų16883.5 Ų83.563%0.63445%0.448SS*.Hα-helixtrans-60.8-42.9172.4-76.2174.4177.8173.11.3112.1I69 A70 E71 V76 N77I69-R73 WeakPolarHBondContact O-CB 3.36Å; I69-R73 VanDerWaalsContact O-CG 3.26Å; I69-R73 WeakPolarHBondContact O-CG 3.44Å; I69-R73 PolarHBondContact O-N 3.04Å; A70-R73 PolarHBondContact O-N 3.26Å; E71-R73 PolarHBondContact O-N 3.25Å; R73-V76 PolarHBondContact O-N 3.22Å; R73-N77 WeakPolarHBondContact O-CB 3.44Å; R73-N77 PolarHBondContact O-N 3.46Å; R73-N77 PolarHBondContact O-ND2 3.35Å; R73-N77 PolarHBondContact O-OD1 3.43Å
74T91.4Very high93.5Very high81 Ų8183.6 Ų83.650%0.49744%0.444SS..Hα-helixtrans-62.5-47.7178.6-57.30000110.9A70 E71 T72 V76 N77 V78A70-T74 WeakPolarHBondContact O-CB 3.39Å; A70-T74 PolarHBondContact O-N 3.39Å; A70-T74 PolarHBondContact O-OG1 3.48Å; E71-T74 WeakPolarHBondContact O-CB 3.27Å; E71-T74 PolarHBondContact O-N 3.44Å; E71-T74 VanDerWaalsContact O-N 3.12Å; T72-T74 VanDerWaalsContact C-N 3.35Å; T72-T74 PolarHBondContact O-N 3.41Å; T74-V76 PolarHBondContact O-N 3.01Å; T74-N77 WeakPolarHBondContact O-CB 3.43Å; T74-N77 PolarHBondContact O-N 3.27Å; T74-V78 WeakPolarHBondContact O-CG2 3.49Å; T74-V78 PolarHBondContact O-N 3.45Å
75N89.2Confident93.7Very high83 Ų8387.9 Ų87.944%0.44446%0.459SS..Hα-helixtrans-62.4-41177.5-71.4-21.8000112.1E71 T72 V78 N79E71-N75 PolarHBondContact O-N 3.45Å; T72-N75 PolarHBondContact O-N 3.5Å; N75-V78 PolarHBondContact O-N 3.45Å; N75-N79 PolarHBondContact O-N 3.39Å; N75-N79 PolarHBondContact O-ND2 2.95Å
76V91.6Very high93.9Very high81 Ų8188.7 Ų88.749%0.49146%0.463SS..Hα-helixtrans-62.6-43.4174168.20000111T72 R73 T74 V78 N79 I80T72-V76 WeakPolarHBondContact O-CB 3.42Å; T72-V76 VanDerWaalsContact O-CG2 3.26Å; T72-V76 WeakPolarHBondContact O-CG2 3.46Å; T72-V76 PolarHBondContact O-N 2.94Å; R73-V76 PolarHBondContact O-N 3.22Å; T74-V76 PolarHBondContact O-N 3.01Å; V76-V78 PolarHBondContact O-N 3.14Å; V76-N79 PolarHBondContact O-N 2.94Å; V76-I80 HydrophobicContact CG1-CD1 3.76Å; V76-I80 HydrophobicContact CG1-CG1 4.38Å; V76-I80 VanDerWaalsContact O-CG1 3.29Å; V76-I80 WeakPolarHBondContact O-CG1 3.29Å; V76-I80 PolarHBondContact O-N 2.99Å
77N92.2Very high94.1Very high97 Ų9791.2 Ų91.252%0.51947%0.47SS..Hα-helixtrans-62.6-42.9177.4-72.3-11.9000112R73 T74 N79 I80 E81R73-N77 WeakPolarHBondContact O-CB 3.44Å; R73-N77 PolarHBondContact O-N 3.46Å; R73-N77 PolarHBondContact O-ND2 3.35Å; R73-N77 PolarHBondContact O-OD1 3.43Å; T74-N77 WeakPolarHBondContact O-CB 3.43Å; T74-N77 PolarHBondContact O-N 3.27Å; N77-N79 VanDerWaalsContact C-N 3.35Å; N77-N79 PolarHBondContact O-N 3.48Å; N77-I80 PolarHBondContact O-N 2.95Å; N77-E81 WeakPolarHBondContact O-CG 3.45Å; N77-E81 PolarHBondContact O-N 3.28Å
78V91.8Very high94.3Very high86 Ų8692.3 Ų92.352%0.52147%0.471SS..Hα-helixtrans-59.5-46.5174.9171.50000110.8T74 N75 V76 I80 E81 E82T74-V78 WeakPolarHBondContact O-CG2 3.49Å; T74-V78 PolarHBondContact O-N 3.45Å; N75-V78 PolarHBondContact O-N 3.45Å; V76-V78 PolarHBondContact O-N 3.14Å; V78-I80 VanDerWaalsContact C-N 3.33Å; V78-I80 PolarHBondContact O-N 3.22Å; V78-E81 PolarHBondContact O-N 3.48Å; V78-E82 PolarHBondContact O-N 2.86Å
79N94.3Very high94.5Very high102 Ų10293.7 Ų93.755%0.54548%0.483SS..Hα-helixtrans-62.7-39.2177.3-72.1-18000112.3N75 V76 N77 E82 L83N75-N79 PolarHBondContact O-N 3.39Å; N75-N79 PolarHBondContact O-ND2 2.95Å; V76-N79 PolarHBondContact O-N 2.94Å; N77-N79 VanDerWaalsContact C-N 3.35Å; N77-N79 PolarHBondContact O-N 3.48Å; N79-E82 PolarHBondContact O-N 3.34Å; N79-L83 WeakPolarHBondContact O-CB 3.41Å; N79-L83 VanDerWaalsContact O-CG 3.27Å; N79-L83 WeakPolarHBondContact O-CG 3.26Å; N79-L83 PolarHBondContact O-N 2.93Å
80I95.7Very high94.8Very high71 Ų7194.1 Ų94.136%0.36449%0.489SS..Hα-helixtrans-61.9-45.2175.6-73167.3000110.9V76 N77 V78 L83 K84V76-I80 HydrophobicContact CG1-CD1 3.76Å; V76-I80 HydrophobicContact CG1-CG1 4.38Å; V76-I80 VanDerWaalsContact O-CG1 3.29Å; V76-I80 WeakPolarHBondContact O-CG1 3.29Å; V76-I80 PolarHBondContact O-N 2.99Å; N77-I80 PolarHBondContact O-N 2.95Å; V78-I80 VanDerWaalsContact C-N 3.33Å; V78-I80 PolarHBondContact O-N 3.22Å; I80-L83 PolarHBondContact O-N 3.09Å; I80-K84 HydrophobicContact CG2-CD 4.39Å; I80-K84 WeakPolarHBondContact O-CG 3.46Å; I80-K84 PolarHBondContact O-N 3.2Å
81E96Very high95Very high94 Ų9493.4 Ų93.444%0.43949%0.486SS..Hα-helixtrans-66-37.5178.7-70.4-54.2129.200112.4N77 V78 K84 K85N77-E81 WeakPolarHBondContact O-CG 3.45Å; N77-E81 PolarHBondContact O-N 3.28Å; V78-E81 PolarHBondContact O-N 3.48Å; E81-K84 PolarHBondContact O-N 3.4Å; E81-K84 IonicContact OE1-NZ 2.64Å; E81-K84 PolarHBondContact OE1-NZ 2.98Å; E81-K85 WeakPolarHBondContact O-CG 3.35Å; E81-K85 PolarHBondContact O-N 3.27Å; E81-K85 VanDerWaalsContact O-N 3.09Å
82E96.7Very high95.3Very high90 Ų9092.3 Ų92.342%0.42148%0.483SS..Hα-helixtrans-65.6-44.1174.1-172.756.5-154.800111.7V78 N79 K84 K85 Q86V78-E82 PolarHBondContact O-N 2.86Å; N79-E82 PolarHBondContact O-N 3.34Å; E82-K84 VanDerWaalsContact C-N 3.32Å; E82-K84 PolarHBondContact O-N 2.93Å; E82-K85 WeakPolarHBondContact O-CB 3.45Å; E82-K85 PolarHBondContact O-N 2.98Å; E82-Q86 WeakPolarHBondContact O-CG 3.26Å; E82-Q86 PolarHBondContact O-N 2.78Å
83L97.5Very high95.7Very high110 Ų11094.9 Ų94.958%0.57650%0.496SS*.Hα-helixtrans-61.2-39.4174.9-74.1172.3000112.2N79 I80 Q86 L87N79-L83 WeakPolarHBondContact O-CB 3.41Å; N79-L83 VanDerWaalsContact O-CG 3.27Å; N79-L83 WeakPolarHBondContact O-CG 3.26Å; N79-L83 PolarHBondContact O-N 2.93Å; I80-L83 PolarHBondContact O-N 3.09Å; L83-Q86 PolarHBondContact O-N 2.73Å; L83-L87 WeakPolarHBondContact O-CB 3.3Å; L83-L87 PolarHBondContact O-N 3.41Å
84K97.9Very high96Very high108 Ų10891.7 Ų91.747%0.4749%0.49SS..Hα-helixtrans-59.8-46.6174-76.5174.9-177.81720111.5I80 E81 E82 Q86 L87 T88I80-K84 HydrophobicContact CG2-CD 4.39Å; I80-K84 WeakPolarHBondContact O-CG 3.46Å; I80-K84 PolarHBondContact O-N 3.2Å; E81-K84 PolarHBondContact O-N 3.4Å; E81-K84 IonicContact OE1-NZ 2.64Å; E81-K84 PolarHBondContact OE1-NZ 2.98Å; E82-K84 VanDerWaalsContact C-N 3.32Å; E82-K84 PolarHBondContact O-N 2.93Å; K84-Q86 PolarHBondContact O-N 3.41Å; K84-L87 PolarHBondContact O-N 3.41Å; K84-T88 PolarHBondContact O-N 2.92Å; K84-T88 PolarHBondContact O-OG1 3.49Å
85K97.7Very high96.3Very high123 Ų12393.4 Ų93.454%0.53549%0.492SS..Hα-helixtrans-59.9-45.2176.9-71.3173.3-176.2172.60111.9E81 E82 L87 T88 N89E81-K85 WeakPolarHBondContact O-CG 3.35Å; E81-K85 PolarHBondContact O-N 3.27Å; E81-K85 VanDerWaalsContact O-N 3.09Å; E82-K85 WeakPolarHBondContact O-CB 3.45Å; E82-K85 PolarHBondContact O-N 2.98Å; K85-L87 VanDerWaalsContact C-N 3.34Å; K85-L87 PolarHBondContact O-N 2.91Å; K85-T88 PolarHBondContact O-N 3.37Å; K85-N89 WeakPolarHBondContact O-CB 3.44Å; K85-N89 PolarHBondContact O-N 2.99Å; K85-N89 PolarHBondContact O-ND2 3.01Å
86Q97.9Very high96.7Very high97 Ų9791.8 Ų91.845%0.45349%0.49SS..Hα-helixtrans-61.8-42.2177.2-70.6-178.6-1.300112E82 L83 K84 N89 T90E82-Q86 WeakPolarHBondContact O-CG 3.26Å; E82-Q86 PolarHBondContact O-N 2.78Å; L83-Q86 PolarHBondContact O-N 2.73Å; K84-Q86 PolarHBondContact O-N 3.41Å; Q86-N89 PolarHBondContact O-N 2.93Å; Q86-T90 WeakPolarHBondContact O-CB 3.2Å; Q86-T90 PolarHBondContact O-N 3.28Å; Q86-T90 PolarHBondContact O-OG1 3.49Å
87L98.3Very high97Very high128 Ų12894.1 Ų94.167%0.6750%0.496SS*.Hα-helixtrans-63.2-45.2177-175.862.1000111.4L83 K84 K85 T90 G91L83-L87 WeakPolarHBondContact O-CB 3.3Å; L83-L87 PolarHBondContact O-N 3.41Å; K84-L87 PolarHBondContact O-N 3.41Å; K85-L87 VanDerWaalsContact C-N 3.34Å; K85-L87 PolarHBondContact O-N 2.91Å; L87-T90 PolarHBondContact O-N 3.43Å; L87-G91 PolarHBondContact O-N 3.47Å
88T97.9Very high97.3Very high80 Ų8093.7 Ų93.749%0.49149%0.493SS..Hα-helixtrans-60.2-48.3175.6-61.20000111.9K84 K85 T90 G91 N92K84-T88 PolarHBondContact O-N 2.92Å; K84-T88 PolarHBondContact O-OG1 3.49Å; K85-T88 PolarHBondContact O-N 3.37Å; T88-T90 VanDerWaalsContact C-N 3.3Å; T88-T90 PolarHBondContact O-N 3.49Å; T88-G91 PolarHBondContact O-N 3.26Å; T88-N92 VanDerWaalsContact O-CG 3.25Å; T88-N92 PolarHBondContact O-N 2.78Å; T88-N92 PolarHBondContact O-OD1 2.87Å
89N97.7Very high97.6Very high96 Ų9693.5 Ų93.551%0.51349%0.49SS..Hα-helixtrans-60.5-41.2178-72.7-19.5000111.9K85 Q86 N92 N93K85-N89 WeakPolarHBondContact O-CB 3.44Å; K85-N89 PolarHBondContact O-N 2.99Å; K85-N89 PolarHBondContact O-ND2 3.01Å; Q86-N89 PolarHBondContact O-N 2.93Å; N89-N92 PolarHBondContact O-N 3.37Å; N89-N93 VanDerWaalsContact O-CG 3.3Å; N89-N93 PolarHBondContact O-N 3.45Å; N89-N93 PolarHBondContact O-ND2 3.5Å
90T98.4Very high97.8Very high74 Ų7493.2 Ų93.245%0.45449%0.488SS..Hα-helixtrans-65.8-42.7176.9-56.70000111.3Q86 L87 T88 N92 N93 I94Q86-T90 WeakPolarHBondContact O-CB 3.2Å; Q86-T90 PolarHBondContact O-N 3.28Å; Q86-T90 PolarHBondContact O-OG1 3.49Å; L87-T90 PolarHBondContact O-N 3.43Å; T88-T90 VanDerWaalsContact C-N 3.3Å; T88-T90 PolarHBondContact O-N 3.49Å; T90-N92 PolarHBondContact O-N 3.47Å; T90-N93 PolarHBondContact O-N 3.18Å; T90-I94 HydrophobicContact CG2-CD1 4.06Å; T90-I94 WeakPolarHBondContact O-CG1 3.3Å; T90-I94 PolarHBondContact O-N 3.46Å
91G98.4Very high98Very high35 Ų3594 Ų9436%0.36150%0.495SS..Hα-helixtrans-57.5-48174.300000112.3L87 T88 N93 I94 E95L87-G91 PolarHBondContact O-N 3.47Å; T88-G91 PolarHBondContact O-N 3.26Å; G91-N93 VanDerWaalsContact C-N 3.32Å; G91-N93 PolarHBondContact O-N 2.94Å; G91-I94 PolarHBondContact O-N 2.88Å; G91-E95 PolarHBondContact O-N 2.89Å
92N98Very high98.1Very high86 Ų8695 Ų9546%0.4650%0.499SS..Hα-helixtrans-61.1-39.5177.3-65.3-13.6000112.2T88 N89 T90 E95 A96T88-N92 VanDerWaalsContact O-CG 3.25Å; T88-N92 PolarHBondContact O-N 2.78Å; T88-N92 PolarHBondContact O-OD1 2.87Å; N89-N92 PolarHBondContact O-N 3.37Å; T90-N92 PolarHBondContact O-N 3.47Å; N92-E95 PolarHBondContact O-N 3.44Å; N92-A96 PolarHBondContact O-N 2.95Å
93N98.2Very high98.1Very high103 Ų10395.6 Ų95.655%0.55150%0.501SS*.Hα-helixtrans-65.5-41.6176.5-73.7-19.6000112.2N89 T90 G91 A96 Q97N89-N93 VanDerWaalsContact O-CG 3.3Å; N89-N93 PolarHBondContact O-N 3.45Å; N89-N93 PolarHBondContact O-ND2 3.5Å; T90-N93 PolarHBondContact O-N 3.18Å; G91-N93 VanDerWaalsContact C-N 3.32Å; G91-N93 PolarHBondContact O-N 2.94Å; N93-A96 PolarHBondContact O-N 3.12Å; N93-Q97 WeakPolarHBondContact O-CG 3.45Å; N93-Q97 PolarHBondContact O-N 3.48Å
94I98.5Very high98.1Very high101 Ų10195.7 Ų95.752%0.51850%0.502SS..Hα-helixtrans-63.4-43.6175.8-69.7166.2000110.3T90 G91 A96 Q97 L98T90-I94 HydrophobicContact CG2-CD1 4.06Å; T90-I94 WeakPolarHBondContact O-CG1 3.3Å; T90-I94 PolarHBondContact O-N 3.46Å; G91-I94 PolarHBondContact O-N 2.88Å; I94-A96 PolarHBondContact O-N 3.42Å; I94-Q97 PolarHBondContact O-N 3.4Å; I94-L98 WeakPolarHBondContact O-CB 3.18Å; I94-L98 PolarHBondContact O-N 3.35Å
95E98.1Very high98.1Very high116 Ų11696.1 Ų96.154%0.54251%0.506SS..Hα-helixtrans-60.7-44.6177.5-174.7176.4-173.600111.8G91 N92 Q97 L98 N99G91-E95 PolarHBondContact O-N 2.89Å; N92-E95 PolarHBondContact O-N 3.44Å; E95-Q97 PolarHBondContact O-N 3.49Å; E95-L98 PolarHBondContact O-N 3.02Å; E95-N99 PolarHBondContact O-N 3.39Å; E95-N99 PolarHBondContact O-ND2 2.93Å
96A98.2Very high98.2Very high49 Ų4993.1 Ų93.141%0.40550%0.5SS..Hα-helixtrans-61.1-43.9175.400000112.2N92 N93 I94 L98 N99 N100N92-A96 PolarHBondContact O-N 2.95Å; N93-A96 PolarHBondContact O-N 3.12Å; I94-A96 PolarHBondContact O-N 3.42Å; A96-L98 VanDerWaalsContact C-N 3.35Å; A96-L98 PolarHBondContact O-N 3.25Å; A96-N99 PolarHBondContact O-N 2.94Å; A96-N100 PolarHBondContact O-N 2.89Å; A96-N100 VanDerWaalsContact O-N 3.13Å
97Q98.4Very high98.2Very high130 Ų13093.7 Ų93.761%0.60750%0.501SS*.Hα-helixtrans-62.6-41.6175.4-73.6-179.1-1.600111.9N93 I94 E95 N99 N100 V101N93-Q97 WeakPolarHBondContact O-CG 3.45Å; N93-Q97 PolarHBondContact O-N 3.48Å; I94-Q97 PolarHBondContact O-N 3.4Å; E95-Q97 PolarHBondContact O-N 3.49Å; Q97-N99 VanDerWaalsContact C-N 3.32Å; Q97-N99 PolarHBondContact O-N 2.96Å; Q97-N100 WeakPolarHBondContact O-CB 3.45Å; Q97-N100 PolarHBondContact O-N 3.46Å; Q97-V101 WeakPolarHBondContact O-CG2 3.26Å; Q97-V101 PolarHBondContact O-N 2.96Å
98L98.5Very high98.1Very high89 Ų8990.4 Ų90.447%0.46649%0.492SS..Hα-helixtrans-62-40.4177.5-17863.4000111.7I94 E95 A96 V101 K102I94-L98 WeakPolarHBondContact O-CB 3.18Å; I94-L98 PolarHBondContact O-N 3.35Å; E95-L98 PolarHBondContact O-N 3.02Å; A96-L98 VanDerWaalsContact C-N 3.35Å; A96-L98 PolarHBondContact O-N 3.25Å; L98-V101 PolarHBondContact O-N 2.72Å; L98-K102 WeakPolarHBondContact O-CG 3.28Å; L98-K102 PolarHBondContact O-N 3.2Å
99N98.1Very high98.2Very high82 Ų8290.8 Ų90.844%0.43949%0.491SS..Hα-helixtrans-64.3-40.8176.4-71.7-26.9000112E95 A96 Q97 V101 K102 E103E95-N99 PolarHBondContact O-N 3.39Å; E95-N99 PolarHBondContact O-ND2 2.93Å; A96-N99 PolarHBondContact O-N 2.94Å; Q97-N99 VanDerWaalsContact C-N 3.32Å; Q97-N99 PolarHBondContact O-N 2.96Å; N99-V101 PolarHBondContact O-N 2.94Å; N99-K102 PolarHBondContact O-N 2.86Å; N99-E103 PolarHBondContact O-N 3.31Å; N99-E103 VanDerWaalsContact O-N 3.08Å
100N98.2Very high98.2Very high96 Ų9692.3 Ų92.351%0.51350%0.495SS..Hα-helixtrans-62.1-42.5174.1-68.8-21.3000112A96 Q97 E103 L104A96-N100 PolarHBondContact O-N 2.89Å; A96-N100 VanDerWaalsContact O-N 3.13Å; Q97-N100 WeakPolarHBondContact O-CB 3.45Å; Q97-N100 PolarHBondContact O-N 3.46Å; N100-E103 PolarHBondContact O-N 3.43Å; N100-L104 WeakPolarHBondContact O-CG 3.38Å; N100-L104 PolarHBondContact O-N 3.07Å
101V98.4Very high98.2Very high86 Ų8691.7 Ų91.752%0.52150%0.497SS..Hα-helixtrans-61.8-44.5177.6171.50000111Q97 L98 N99 E103 L104 E105Q97-V101 WeakPolarHBondContact O-CG2 3.26Å; Q97-V101 PolarHBondContact O-N 2.96Å; L98-V101 PolarHBondContact O-N 2.72Å; N99-V101 PolarHBondContact O-N 2.94Å; V101-E103 VanDerWaalsContact C-N 3.32Å; V101-E103 PolarHBondContact O-N 2.99Å; V101-L104 PolarHBondContact O-N 3.47Å; V101-E105 WeakPolarHBondContact O-CB 3.46Å; V101-E105 PolarHBondContact O-N 3.41Å
102K98Very high98.1Very high116 Ų11692.4 Ų92.450%0.50450%0.499SS..Hα-helixtrans-59.9-40.4175.7-73.5176179.5174.90112.5L98 N99 E105 S106L98-K102 WeakPolarHBondContact O-CG 3.28Å; L98-K102 PolarHBondContact O-N 3.2Å; N99-K102 PolarHBondContact O-N 2.86Å; K102-E105 PolarHBondContact O-N 2.91Å; K102-S106 PolarHBondContact O-N 2.69Å
103E98Very high98.1Very high103 Ų10391.9 Ų91.948%0.48150%0.497SS..Hα-helixtrans-65-43.8176.6-168.2-170.3155.500111.4N99 N100 V101 S106 K107N99-E103 PolarHBondContact O-N 3.31Å; N99-E103 VanDerWaalsContact O-N 3.08Å; N100-E103 PolarHBondContact O-N 3.43Å; V101-E103 VanDerWaalsContact C-N 3.32Å; V101-E103 PolarHBondContact O-N 2.99Å; E103-S106 PolarHBondContact O-N 3.32Å; E103-K107 WeakPolarHBondContact O-CG 3.44Å; E103-K107 PolarHBondContact O-N 2.9Å; E103-K107 WeakPolarHBondContact OE1-CE 3.29Å; E103-K107 IonicContact OE1-NZ 3.81Å; E103-K107 PolarHBondContact OE1-NZ 2.84Å
104L98.3Very high98Very high111 Ų11193.8 Ų93.858%0.58150%0.5SS*.Hα-helixtrans-63.2-42176.5-71.8173.4000112.2N100 V101 S106 K107 A108N100-L104 WeakPolarHBondContact O-CG 3.38Å; N100-L104 PolarHBondContact O-N 3.07Å; V101-L104 PolarHBondContact O-N 3.47Å; L104-S106 VanDerWaalsContact C-N 3.35Å; L104-S106 PolarHBondContact O-N 2.88Å; L104-K107 PolarHBondContact O-N 3.28Å; L104-A108 WeakPolarHBondContact O-CB 3.49Å; L104-A108 PolarHBondContact O-N 3.22Å
105E97.8Very high97.9Very high118 Ų11894.9 Ų94.955%0.55150%0.502SS*.Hα-helixtrans-59.5-45.6175-175.8179.3-166.400111.2V101 K102 K107 A108 I109V101-E105 WeakPolarHBondContact O-CB 3.46Å; V101-E105 PolarHBondContact O-N 3.41Å; K102-E105 PolarHBondContact O-N 2.91Å; E105-K107 PolarHBondContact O-N 3.22Å; E105-A108 PolarHBondContact O-N 2.85Å; E105-I109 HydrophobicContact CG-CD1 4.09Å; E105-I109 WeakPolarHBondContact O-CG1 3.23Å; E105-I109 PolarHBondContact O-N 3.4Å
106S98Very high97.8Very high59 Ų5993.5 Ų93.541%0.41350%0.497SS..Hα-helixtrans-59.4-45176-170.90000112.2K102 E103 L104 A108 I109 Q110K102-S106 PolarHBondContact O-N 2.69Å; E103-S106 PolarHBondContact O-N 3.32Å; L104-S106 VanDerWaalsContact C-N 3.35Å; L104-S106 PolarHBondContact O-N 2.88Å; S106-A108 VanDerWaalsContact C-N 3.34Å; S106-A108 PolarHBondContact O-N 3.12Å; S106-I109 PolarHBondContact O-N 3.13Å; S106-Q110 WeakPolarHBondContact O-CG 3.42Å; S106-Q110 PolarHBondContact O-N 3.12Å
107K98.3Very high97.6Very high109 Ų10996.6 Ų96.647%0.47451%0.507SS..Hα-helixtrans-61.8-41.2176-72.3174.7-175.6168.20112E103 L104 E105 Q110 A111E103-K107 WeakPolarHBondContact O-CG 3.44Å; E103-K107 PolarHBondContact O-N 2.9Å; E103-K107 WeakPolarHBondContact OE1-CE 3.29Å; E103-K107 IonicContact OE1-NZ 3.81Å; E103-K107 PolarHBondContact OE1-NZ 2.84Å; L104-K107 PolarHBondContact O-N 3.28Å; E105-K107 PolarHBondContact O-N 3.22Å; K107-Q110 PolarHBondContact O-N 3.05Å; K107-A111 WeakPolarHBondContact O-CB 3.32Å; K107-A111 PolarHBondContact O-N 3.07Å
108A97.7Very high97.5Very high60 Ų6095 Ų9550%0.49650%0.502SS..Hα-helixtrans-64.2-43.7177.900000111.9L104 E105 S106 A111 A112L104-A108 WeakPolarHBondContact O-CB 3.49Å; L104-A108 PolarHBondContact O-N 3.22Å; E105-A108 PolarHBondContact O-N 2.85Å; S106-A108 VanDerWaalsContact C-N 3.34Å; S106-A108 PolarHBondContact O-N 3.12Å; A108-A111 PolarHBondContact O-N 3.14Å; A108-A112 WeakPolarHBondContact O-CB 3.33Å; A108-A112 PolarHBondContact O-N 2.95Å
109I98.1Very high97.3Very high88 Ų8898 Ų9845%0.45151%0.508SS..Hα-helixtrans-61.5-45.4176.1-67.8166.9000110.8E105 S106 A111 A112 N113E105-I109 HydrophobicContact CG-CD1 4.09Å; E105-I109 WeakPolarHBondContact O-CG1 3.23Å; E105-I109 PolarHBondContact O-N 3.4Å; S106-I109 PolarHBondContact O-N 3.13Å; I109-A111 PolarHBondContact O-N 3.33Å; I109-A112 PolarHBondContact O-N 3.18Å; I109-N113 WeakPolarHBondContact O-CB 3.34Å; I109-N113 VanDerWaalsContact O-CG 3.3Å; I109-N113 PolarHBondContact O-N 2.69Å; I109-N113 PolarHBondContact O-ND2 3.37Å
110Q98.1Very high97.1Very high128 Ų12895.5 Ų95.560%0.59850%0.501SS*.Hα-helixtrans-60.9-43.9177.2-72.818010.100112.2S106 K107 N113 K114S106-Q110 WeakPolarHBondContact O-CG 3.42Å; S106-Q110 PolarHBondContact O-N 3.12Å; K107-Q110 PolarHBondContact O-N 3.05Å; Q110-N113 PolarHBondContact O-N 3.42Å; Q110-K114 PolarHBondContact O-N 3.19Å
111A97.9Very high96.9Very high61 Ų6194.1 Ų94.150%0.50450%0.499SS..Hα-helixtrans-62.6-43.6177.200000111.9K107 A108 I109 K114 H115K107-A111 WeakPolarHBondContact O-CB 3.32Å; K107-A111 PolarHBondContact O-N 3.07Å; A108-A111 PolarHBondContact O-N 3.14Å; I109-A111 PolarHBondContact O-N 3.33Å; A111-K114 PolarHBondContact O-N 3Å; A111-H115 PolarHBondContact O-N 3.45Å
112A97.5Very high96.8Very high49 Ų4995 Ų9541%0.40550%0.5SS..Hα-helixtrans-62.1-44.5176.600000111.9A108 I109 K114 H115 M116A108-A112 WeakPolarHBondContact O-CB 3.33Å; A108-A112 PolarHBondContact O-N 2.95Å; I109-A112 PolarHBondContact O-N 3.18Å; A112-K114 PolarHBondContact O-N 3.13Å; A112-H115 PolarHBondContact O-N 3.47Å; A112-M116 WeakPolarHBondContact O-CG 3.45Å; A112-M116 PolarHBondContact O-N 3.33Å
113N97.4Very high96.6Very high76 Ų7693.8 Ų93.841%0.40650%0.502SS..Hα-helixtrans-62-43.4176.8-72.5-18.6000112I109 Q110 H115 M116 N117I109-N113 WeakPolarHBondContact O-CB 3.34Å; I109-N113 VanDerWaalsContact O-CG 3.3Å; I109-N113 PolarHBondContact O-N 2.69Å; I109-N113 PolarHBondContact O-ND2 3.37Å; Q110-N113 PolarHBondContact O-N 3.42Å; N113-H115 VanDerWaalsContact C-N 3.34Å; N113-H115 PolarHBondContact O-N 2.99Å; N113-M116 PolarHBondContact O-N 2.82Å; N113-M116 WeakPolarHBondContact OD1-CE 3.5Å; N113-N117 VanDerWaalsContact O-CG 3.29Å; N113-N117 PolarHBondContact O-N 3Å
114K97.1Very high96.5Very high142 Ų14294.4 Ų94.462%0.61751%0.509SS*.Hα-helixtrans-60.2-43.9174.9-174.5178.7-179.5-179.90111.7Q110 A111 A112 N117 N118Q110-K114 PolarHBondContact O-N 3.19Å; A111-K114 PolarHBondContact O-N 3Å; A112-K114 PolarHBondContact O-N 3.13Å; K114-N117 PolarHBondContact O-N 3.47Å; K114-N118 WeakPolarHBondContact O-CB 3.49Å; K114-N118 PolarHBondContact O-N 2.95Å; K114-N118 PolarHBondContact O-OD1 3.25Å
115H96Very high96.4Very high124 Ų12494.8 Ų94.857%0.57451%0.511SS*.Hα-helixtrans-62.1-44176.5177.3-90.3000112A111 A112 N113 N118 R119A111-H115 PolarHBondContact O-N 3.45Å; A112-H115 PolarHBondContact O-N 3.47Å; N113-H115 VanDerWaalsContact C-N 3.34Å; N113-H115 PolarHBondContact O-N 2.99Å; H115-N118 PolarHBondContact O-N 3.33Å; H115-R119 WeakPolarHBondContact O-CB 3.5Å; H115-R119 PolarHBondContact O-N 3.42Å
116M95.4Very high96.2Very high88 Ų8894 Ų9443%0.43351%0.508SS..Hα-helixtrans-62.1-43.3176.7-72.5-171.6-66.200112.4A112 N113 R119 G120A112-M116 WeakPolarHBondContact O-CG 3.45Å; A112-M116 PolarHBondContact O-N 3.33Å; N113-M116 PolarHBondContact O-N 2.82Å; N113-M116 WeakPolarHBondContact OD1-CE 3.5Å; M116-R119 PolarHBondContact O-N 3.34Å; M116-G120 PolarHBondContact O-N 3.06Å
117N95.1Very high96.1Very high113 Ų11393 Ų9360%0.60451%0.507SS*.Hα-helixtrans-62.6-47.4176.6-70.1-10.9000111.3N113 K114 R119 G120 S121N113-N117 VanDerWaalsContact O-CG 3.29Å; N113-N117 PolarHBondContact O-N 3Å; K114-N117 PolarHBondContact O-N 3.47Å; N117-R119 VanDerWaalsContact C-N 3.29Å; N117-R119 PolarHBondContact O-N 2.94Å; N117-G120 PolarHBondContact O-N 3.25Å; N117-G120 VanDerWaalsContact O-N 3.15Å; N117-S121 PolarHBondContact O-N 3.03Å; N117-S121 PolarHBondContact O-OG 3.02Å
118N95.1Very high96Very high96 Ų9692.5 Ų92.551%0.51351%0.507SS..Hα-helixtrans-59.6-40.3176.7-72-1.3000111.9K114 H115 S121 L122K114-N118 WeakPolarHBondContact O-CB 3.49Å; K114-N118 PolarHBondContact O-N 2.95Å; K114-N118 PolarHBondContact O-OD1 3.25Å; H115-N118 PolarHBondContact O-N 3.33Å; N118-S121 PolarHBondContact O-N 3.41Å; N118-L122 PolarHBondContact O-N 3.27Å
119R94Very high95.8Very high153 Ų15392.6 Ų92.658%0.57751%0.508SS*.Hα-helixtrans-63.7-44.3175.3-173.8-175.570.2-177.71.1111.4H115 M116 N117 L122 V123H115-R119 WeakPolarHBondContact O-CB 3.5Å; H115-R119 PolarHBondContact O-N 3.42Å; M116-R119 PolarHBondContact O-N 3.34Å; N117-R119 VanDerWaalsContact C-N 3.29Å; N117-R119 PolarHBondContact O-N 2.94Å; R119-L122 PolarHBondContact O-N 3.1Å; R119-V123 WeakPolarHBondContact O-CG2 3.44Å; R119-V123 PolarHBondContact O-N 2.9Å
120G94.2Very high95.6Very high30 Ų3094.1 Ų94.131%0.30951%0.513SS..Hα-helixtrans-56.9-51.3175.200000111.6M116 N117 L122 V123 D124M116-G120 PolarHBondContact O-N 3.06Å; N117-G120 PolarHBondContact O-N 3.25Å; N117-G120 VanDerWaalsContact O-N 3.15Å; G120-L122 VanDerWaalsContact C-N 3.29Å; G120-L122 PolarHBondContact O-N 3.35Å; G120-V123 WeakPolarHBondContact O-CB 3.46Å; G120-V123 PolarHBondContact O-N 3.48Å; G120-V123 VanDerWaalsContact O-N 3.1Å; G120-D124 PolarHBondContact O-N 3.43Å
121S94.7Very high95.4Very high67 Ų6793.8 Ų93.847%0.46951%0.51SS..Hα-helixtrans-59.6-36.6177.2-57.60000113.4N117 N118 D124 L125N117-S121 PolarHBondContact O-N 3.03Å; N117-S121 PolarHBondContact O-OG 3.02Å; N118-S121 PolarHBondContact O-N 3.41Å; S121-D124 PolarHBondContact O-N 3.05Å; S121-L125 WeakPolarHBondContact O-CB 3.49Å; S121-L125 VanDerWaalsContact O-CG 3.28Å; S121-L125 WeakPolarHBondContact O-CG 3.39Å; S121-L125 PolarHBondContact O-N 3.4Å
122L95.3Very high95.2Very high103 Ų10394.9 Ų94.954%0.53951%0.505SS..Hα-helixtrans-66.1-42.4175.9-176.166.1000111.6N118 R119 G120 D124 L125 M126N118-L122 PolarHBondContact O-N 3.27Å; R119-L122 PolarHBondContact O-N 3.1Å; G120-L122 VanDerWaalsContact C-N 3.29Å; G120-L122 PolarHBondContact O-N 3.35Å; L122-D124 VanDerWaalsContact C-N 3.33Å; L122-L125 PolarHBondContact O-N 3.48Å; L122-M126 HydrophobicContact CG-SD 4.17Å; L122-M126 WeakPolarHBondContact O-CB 3.45Å; L122-M126 VanDerWaalsContact O-CG 3.25Å; L122-M126 WeakPolarHBondContact O-CG 3.37Å; L122-M126 PolarHBondContact O-N 2.91Å
123V94.9Very high94.9Very high91 Ų9198.3 Ų98.355%0.55251%0.507SS*.Hα-helixtrans-61.8-43.4176.4171.90000110.7R119 G120 M126 G127R119-V123 WeakPolarHBondContact O-CG2 3.44Å; R119-V123 PolarHBondContact O-N 2.9Å; G120-V123 WeakPolarHBondContact O-CB 3.46Å; G120-V123 PolarHBondContact O-N 3.48Å; G120-V123 VanDerWaalsContact O-N 3.1Å; V123-M126 PolarHBondContact O-N 3.13Å; V123-G127 PolarHBondContact O-N 3.46Å
124D95Very high94.6Very high116 Ų11699.5 Ų99.562%0.6251%0.512SS*.Hα-helixtrans-61.6-45.3176.9-63.5-26.8000111.6G120 S121 L122 M126 G127 E128G120-D124 PolarHBondContact O-N 3.43Å; S121-D124 PolarHBondContact O-N 3.05Å; L122-D124 VanDerWaalsContact C-N 3.33Å; D124-M126 VanDerWaalsContact C-N 3.35Å; D124-M126 PolarHBondContact O-N 3.26Å; D124-G127 PolarHBondContact O-N 2.95Å; D124-E128 PolarHBondContact O-N 3.41Å
125L96.5Very high94.4Very high119 Ų11996.9 Ų96.962%0.62351%0.505SS*.Hα-helixtrans-63.7-38.3177.1-74.7170.8000112.7S121 L122 E128 A129S121-L125 WeakPolarHBondContact O-CB 3.49Å; S121-L125 VanDerWaalsContact O-CG 3.28Å; S121-L125 WeakPolarHBondContact O-CG 3.39Å; S121-L125 PolarHBondContact O-N 3.4Å; L122-L125 PolarHBondContact O-N 3.48Å; L125-E128 PolarHBondContact O-N 3.29Å; L125-A129 WeakPolarHBondContact O-CB 3.26Å; L125-A129 PolarHBondContact O-N 3.45Å
126M94.6Very high94.1Very high101 Ų10196.4 Ų96.450%0.49851%0.506SS..Hα-helixtrans-65.2-44.5175.4-73.4175.363.600111L122 V123 D124 E128 A129 E130L122-M126 HydrophobicContact CG-SD 4.17Å; L122-M126 WeakPolarHBondContact O-CB 3.45Å; L122-M126 VanDerWaalsContact O-CG 3.25Å; L122-M126 WeakPolarHBondContact O-CG 3.37Å; L122-M126 PolarHBondContact O-N 2.91Å; V123-M126 PolarHBondContact O-N 3.13Å; D124-M126 VanDerWaalsContact C-N 3.35Å; D124-M126 PolarHBondContact O-N 3.26Å; M126-E128 PolarHBondContact O-N 2.95Å; M126-A129 PolarHBondContact O-N 2.9Å; M126-E130 WeakPolarHBondContact O-CB 3.46Å; M126-E130 WeakPolarHBondContact O-CG 3Å; M126-E130 PolarHBondContact O-N 3.22Å
127G94.7Very high93.8Very high38 Ų3893.3 Ų93.339%0.39249%0.491SS..Hα-helixtrans-59.6-43.8175.500000112.5V123 D124 E130 F131V123-G127 PolarHBondContact O-N 3.46Å; D124-G127 PolarHBondContact O-N 2.95Å; G127-E130 PolarHBondContact O-N 3.37Å; G127-F131 WeakPolarHBondContact O-CB 3.39Å; G127-F131 PolarHBondContact O-N 3.38Å
128E96.1Very high93.5Very high99 Ų9992.3 Ų92.346%0.46349%0.489SS..Hα-helixtrans-63.3-45175.2-177.159.9-145.800111.6D124 L125 M126 E130 F131 Q132D124-E128 PolarHBondContact O-N 3.41Å; L125-E128 PolarHBondContact O-N 3.29Å; M126-E128 PolarHBondContact O-N 2.95Å; E128-E130 VanDerWaalsContact C-N 3.34Å; E128-E130 PolarHBondContact O-N 3.49Å; E128-F131 WeakPolarHBondContact O-CB 3.34Å; E128-F131 PolarHBondContact O-N 2.95Å; E128-Q132 HydrophobicContact CG-CG 4.47Å; E128-Q132 VanDerWaalsContact O-CG 3.29Å; E128-Q132 WeakPolarHBondContact O-CG 3.21Å; E128-Q132 PolarHBondContact O-N 2.86Å; E128-Q132 WeakPolarHBondContact OE1-CG 3.35Å; E128-Q132 PolarHBondContact OE1-NE2 3.01Å
129A94.5Very high93.4Very high62 Ų6292.6 Ų92.651%0.51249%0.494SS..Hα-helixtrans-62.5-40.4178.500000112.3L125 M126 R133L125-A129 WeakPolarHBondContact O-CB 3.26Å; L125-A129 PolarHBondContact O-N 3.45Å; M126-A129 PolarHBondContact O-N 2.9Å; A129-R133 WeakPolarHBondContact O-CB 3.44Å; A129-R133 PolarHBondContact O-N 3.39Å
130E92.8Very high93.3Very high120 Ų12087.7 Ų87.756%0.56148%0.479SS*.Hα-helixtrans-64.8-43173.8-75.2179-178.400111.7M126 G127 E128 R133 I134M126-E130 WeakPolarHBondContact O-CB 3.46Å; M126-E130 WeakPolarHBondContact O-CG 3Å; M126-E130 PolarHBondContact O-N 3.22Å; G127-E130 PolarHBondContact O-N 3.37Å; E128-E130 VanDerWaalsContact C-N 3.34Å; E128-E130 PolarHBondContact O-N 3.49Å; E130-R133 WeakPolarHBondContact O-CB 3.37Å; E130-R133 PolarHBondContact O-N 2.94Å; E130-I134 WeakPolarHBondContact O-CG1 3.44Å; E130-I134 PolarHBondContact O-N 3.49Å
131F94.5Very high93.2Very high122 Ų12289.5 Ų89.554%0.53549%0.486SS..Hα-helixtrans-60.2-48.7176.4-178.5-97.8000111.8G127 E128 R133 I134 L135G127-F131 WeakPolarHBondContact O-CB 3.39Å; G127-F131 PolarHBondContact O-N 3.38Å; E128-F131 WeakPolarHBondContact O-CB 3.34Å; E128-F131 PolarHBondContact O-N 2.95Å; F131-R133 VanDerWaalsContact C-N 3.32Å; F131-R133 PolarHBondContact O-N 2.85Å; F131-I134 PolarHBondContact O-N 3.25Å; F131-L135 PolarHBondContact O-N 3.48Å
132Q94.2Very high93.1Very high84 Ų8494.4 Ų94.439%0.39350%0.499SS..Hα-helixtrans-60.8-40.5176.1-67.7-64.2-24.300111.9E128 L135 L136E128-Q132 HydrophobicContact CG-CG 4.47Å; E128-Q132 VanDerWaalsContact O-CG 3.29Å; E128-Q132 WeakPolarHBondContact O-CG 3.21Å; E128-Q132 PolarHBondContact O-N 2.86Å; E128-Q132 WeakPolarHBondContact OE1-CG 3.35Å; E128-Q132 PolarHBondContact OE1-NE2 3.01Å; Q132-L135 PolarHBondContact O-N 2.93Å; Q132-L136 WeakPolarHBondContact O-CG 3.42Å; Q132-L136 PolarHBondContact O-N 3.37Å
133R90.9Very high92.9Very high120 Ų12094.9 Ų94.945%0.45350%0.502SS..Hα-helixtrans-60.4-44.8174.8179.2-179.6174.3-111.3-1.3111.7A129 E130 F131 L136 L137 A152A129-R133 WeakPolarHBondContact O-CB 3.44Å; A129-R133 PolarHBondContact O-N 3.39Å; E130-R133 WeakPolarHBondContact O-CB 3.37Å; E130-R133 PolarHBondContact O-N 2.94Å; F131-R133 VanDerWaalsContact C-N 3.32Å; F131-R133 PolarHBondContact O-N 2.85Å; R133-L136 PolarHBondContact O-N 3.04Å; R133-L137 HydrophobicContact CG-CD1 4.32Å; R133-L137 WeakPolarHBondContact O-CG 3.4Å; R133-L137 PolarHBondContact O-N 3.34Å; R133-A152 VanDerWaalsContact NH2-CB 3.28Å
134I90.7Very high92.8Very high101 Ų10194.9 Ų94.952%0.51850%0.495SS..Hα-helixtrans-62.2-47176.8-68.9165.7000110.2E130 F131 L136 L137 T138E130-I134 WeakPolarHBondContact O-CG1 3.44Å; E130-I134 PolarHBondContact O-N 3.49Å; F131-I134 PolarHBondContact O-N 3.25Å; I134-L136 VanDerWaalsContact C-N 3.35Å; I134-L136 PolarHBondContact O-N 3.4Å; I134-L137 WeakPolarHBondContact O-CB 3.34Å; I134-L137 PolarHBondContact O-N 3.41Å; I134-L137 VanDerWaalsContact O-N 3.16Å; I134-T138 WeakPolarHBondContact O-CG2 3.4Å; I134-T138 PolarHBondContact O-N 3.43Å
135L92.3Very high92.6Very high88 Ų8891.9 Ų91.946%0.46148%0.478SS..Hα-helixtrans-56.7-49.5179.2-176.863.5000111.1F131 Q132 L137 T138F131-L135 PolarHBondContact O-N 3.48Å; Q132-L135 PolarHBondContact O-N 2.93Å; L135-L137 VanDerWaalsContact C-N 3.35Å; L135-L137 PolarHBondContact O-N 2.84Å; L135-T138 PolarHBondContact O-N 3.46Å; L135-T138 VanDerWaalsContact O-N 3.15Å; L135-T138 PolarHBondContact O-OG1 3.03Å
136L90.5Very high92.3Very high113 Ų11391.1 Ų91.159%0.59247%0.473SS*.Hα-helixtrans-57.9-45.4176.3-72.2171.1000112.1Q132 R133 I134 T138 T139Q132-L136 WeakPolarHBondContact O-CG 3.42Å; Q132-L136 PolarHBondContact O-N 3.37Å; R133-L136 PolarHBondContact O-N 3.04Å; I134-L136 VanDerWaalsContact C-N 3.35Å; I134-L136 PolarHBondContact O-N 3.4Å; L136-T138 VanDerWaalsContact C-N 3.27Å; L136-T138 PolarHBondContact O-N 2.93Å; L136-T139 PolarHBondContact O-N 3.23Å; L136-T139 PolarHBondContact O-OG1 2.96Å
137L89Confident92.2Very high23 Ų2392.6 Ų92.612%0.1248%0.477CS..Hα-helixtrans-56.3-40.9177-75.3168.8000111.9R133 I134 L135 T139 L140 Q145 M148R133-L137 HydrophobicContact CG-CD1 4.32Å; R133-L137 WeakPolarHBondContact O-CG 3.4Å; R133-L137 PolarHBondContact O-N 3.34Å; I134-L137 WeakPolarHBondContact O-CB 3.34Å; I134-L137 PolarHBondContact O-N 3.41Å; I134-L137 VanDerWaalsContact O-N 3.16Å; L135-L137 VanDerWaalsContact C-N 3.35Å; L135-L137 PolarHBondContact O-N 2.84Å; L137-T139 PolarHBondContact O-N 3.37Å; L137-L140 HydrophobicContact CD2-CD1 4.37Å; L137-L140 PolarHBondContact O-N 2.81Å; L137-Q145 WeakPolarHBondContact O-CG 3.44Å; L137-Q145 PolarHBondContact O-NE2 2.8Å; L137-M148 HydrophobicContact CD2-CB 3.93Å; L137-M148 HydrophobicContact CD2-CE 3.77Å; L137-M148 HydrophobicContact CD2-CG 4.46Å; L137-M148 HydrophobicContact CD2-SD 3.72Å
138T90.1Very high91.8Very high93 Ų9394.3 Ų94.357%0.57148%0.476SS*.Hα-helixtrans-65.4-18.6179.964.50000114.3I134 L135 L136I134-T138 WeakPolarHBondContact O-CG2 3.4Å; I134-T138 PolarHBondContact O-N 3.43Å; L135-T138 PolarHBondContact O-N 3.46Å; L135-T138 VanDerWaalsContact O-N 3.15Å; L135-T138 PolarHBondContact O-OG1 3.03Å; L136-T138 VanDerWaalsContact C-N 3.27Å; L136-T138 PolarHBondContact O-N 2.93Å
139T92.6Very high91.3Very high101 Ų10193.6 Ų93.662%0.6247%0.474SS*.Hα-helixtrans-86.9-15.2178.467.80000113.9L136 L137L136-T139 PolarHBondContact O-N 3.23Å; L136-T139 PolarHBondContact O-OG1 2.96Å; L137-T139 PolarHBondContact O-N 3.37Å
140L91.6Very high91.1Very high50 Ų5095 Ų9526%0.26247%0.472SS..SBendtrans-82.2155-176.7-62176.7000112.2L137 E144 Q145 M148L137-L140 HydrophobicContact CD2-CD1 4.37Å; L137-L140 PolarHBondContact O-N 2.81Å; L140-E144 HydrophobicContact CB-CB 4.23Å; L140-Q145 HydrophobicContact CB-CG 4.01Å; L140-Q145 PolarHBondContact O-NE2 2.93Å; L140-M148 HydrophobicContact CD1-SD 3.36Å; L140-M148 WeakPolarHBondContact CD1-SD 3.29Å
141P92.5Very high90.8Very high69 Ų6994.5 Ų94.545%0.44847%0.47SS..  trans-53.6147.2165.2-25.636.4000112.4D143 E144 Q145P141-D143 VanDerWaalsContact C-N 3.27Å; P141-D143 WeakPolarHBondContact CB-OD1 3.42Å; P141-D143 PolarHBondContact O-N 3.45Å; P141-E144 PolarHBondContact O-N 3.46Å; P141-Q145 WeakPolarHBondContact O-CG 3.11Å; P141-Q145 PolarHBondContact O-N 2.99Å
142K91.2Very high90.3Very high170 Ų17089.8 Ų89.874%0.73945%0.453SS*.Hα-helixtrans-59-36.4-173.6-71.5-177.5178.1178.20113.5Q145 I146K142-Q145 PolarHBondContact O-N 3.29Å; K142-I146 VanDerWaalsContact O-CG1 3.28Å; K142-I146 WeakPolarHBondContact O-CG1 3.36Å; K142-I146 PolarHBondContact O-N 3.1Å
143D92.3Very high89.9Confident113 Ų11391.6 Ų91.660%0.60446%0.463SS*.Hα-helixtrans-64.5-41.4176.756.7-53.2000111.9P141 K147P141-D143 VanDerWaalsContact C-N 3.27Å; P141-D143 WeakPolarHBondContact CB-OD1 3.42Å; P141-D143 PolarHBondContact O-N 3.45Å; D143-K147 WeakPolarHBondContact O-CB 3.24Å; D143-K147 PolarHBondContact O-N 2.99Å; D143-K147 VanDerWaalsContact O-N 3.09Å
144E92.2Very high89.8Confident90 Ų9090.5 Ų90.542%0.42147%0.466SS..Hα-helixtrans-67-41.7173.6-68.7-168.9170.400112.1L140 P141 I146 K147 M148L140-E144 HydrophobicContact CB-CB 4.23Å; P141-E144 PolarHBondContact O-N 3.46Å; E144-I146 PolarHBondContact O-N 3.22Å; E144-K147 PolarHBondContact O-N 3.4Å; E144-M148 WeakPolarHBondContact O-CG 3.35Å; E144-M148 PolarHBondContact O-N 3Å
145Q91.2Very high89.5Confident53 Ų5392.3 Ų92.325%0.24847%0.47CS..Hα-helixtrans-56-50.1175.1-67.8-178.32400111.4L137 L140 P141 K142 K147 M148 I149L137-Q145 WeakPolarHBondContact O-CG 3.44Å; L137-Q145 PolarHBondContact O-NE2 2.8Å; L140-Q145 HydrophobicContact CB-CG 4.01Å; L140-Q145 PolarHBondContact O-NE2 2.93Å; P141-Q145 WeakPolarHBondContact O-CG 3.11Å; P141-Q145 PolarHBondContact O-N 2.99Å; K142-Q145 PolarHBondContact O-N 3.29Å; Q145-K147 VanDerWaalsContact C-N 3.33Å; Q145-K147 PolarHBondContact O-N 3.09Å; Q145-M148 PolarHBondContact O-N 2.94Å; Q145-I149 WeakPolarHBondContact O-CD1 3.45Å; Q145-I149 VanDerWaalsContact O-CG1 3.24Å; Q145-I149 WeakPolarHBondContact O-CG1 3.4Å; Q145-I149 PolarHBondContact O-N 2.88Å
146I90.1Very high88.9Confident103 Ų10393.1 Ų93.153%0.52848%0.475SS..Hα-helixtrans-59.4-45.4179-69164.8000110.5K142 E144 M148 I149 I150K142-I146 VanDerWaalsContact O-CG1 3.28Å; K142-I146 WeakPolarHBondContact O-CG1 3.36Å; K142-I146 PolarHBondContact O-N 3.1Å; E144-I146 PolarHBondContact O-N 3.22Å; I146-M148 PolarHBondContact O-N 3.36Å; I146-I149 PolarHBondContact O-N 2.84Å; I146-I150 HydrophobicContact CG2-CD1 3.9Å; I146-I150 WeakPolarHBondContact O-CG1 3.49Å; I146-I150 PolarHBondContact O-N 3.06Å
147K91.6Very high88.3Confident133 Ų13391 Ų9158%0.57847%0.47SS*.Hα-helixtrans-59.8-45.3178.5-174.4-178.6178.8-176.20111.9D143 E144 Q145 I150 Q151D143-K147 WeakPolarHBondContact O-CB 3.24Å; D143-K147 PolarHBondContact O-N 2.99Å; D143-K147 VanDerWaalsContact O-N 3.09Å; E144-K147 PolarHBondContact O-N 3.4Å; Q145-K147 VanDerWaalsContact C-N 3.33Å; Q145-K147 PolarHBondContact O-N 3.09Å; K147-I150 PolarHBondContact O-N 3.39Å; K147-Q151 WeakPolarHBondContact O-CG 3.27Å; K147-Q151 PolarHBondContact O-N 3.22Å; K147-Q151 VanDerWaalsContact O-N 3.08Å
148M87.4Confident87.6Confident74 Ų7494.4 Ų94.437%0.36549%0.492SS..Hα-helixtrans-66.8-36.7178.1-74-173.567.800112.9L137 L140 E144 Q145 I146 Q151 A152L137-M148 HydrophobicContact CD2-CB 3.93Å; L137-M148 HydrophobicContact CD2-CE 3.77Å; L137-M148 HydrophobicContact CD2-CG 4.46Å; L137-M148 HydrophobicContact CD2-SD 3.72Å; L140-M148 HydrophobicContact CD1-SD 3.36Å; L140-M148 WeakPolarHBondContact CD1-SD 3.29Å; E144-M148 WeakPolarHBondContact O-CG 3.35Å; E144-M148 PolarHBondContact O-N 3Å; Q145-M148 PolarHBondContact O-N 2.94Å; I146-M148 PolarHBondContact O-N 3.36Å; M148-Q151 PolarHBondContact O-N 3.49Å; M148-A152 PolarHBondContact O-N 3.28Å
149I86Confident86.6Confident84 Ų8495.5 Ų95.543%0.43149%0.494SS..Hα-helixtrans-63.1-47.5176-70.6164.5000110.2Q145 I146 Q151 A152 M153Q145-I149 WeakPolarHBondContact O-CD1 3.45Å; Q145-I149 VanDerWaalsContact O-CG1 3.24Å; Q145-I149 WeakPolarHBondContact O-CG1 3.4Å; Q145-I149 PolarHBondContact O-N 2.88Å; I146-I149 PolarHBondContact O-N 2.84Å; I149-Q151 VanDerWaalsContact C-N 3.34Å; I149-Q151 PolarHBondContact O-N 3.06Å; I149-A152 PolarHBondContact O-N 3.2Å; I149-M153 HydrophobicContact CG2-SD 3.94Å; I149-M153 WeakPolarHBondContact O-CG 3.04Å; I149-M153 PolarHBondContact O-N 3.46Å
150I88.7Confident84.8Confident90 Ų9096.2 Ų96.246%0.46250%0.502SS..Hα-helixtrans-58.8-46.7177.1-66.8168.4000110.5I146 K147 A152 M153 D154I146-I150 HydrophobicContact CG2-CD1 3.9Å; I146-I150 WeakPolarHBondContact O-CG1 3.49Å; I146-I150 PolarHBondContact O-N 3.06Å; K147-I150 PolarHBondContact O-N 3.39Å; I150-A152 VanDerWaalsContact C-N 3.31Å; I150-A152 PolarHBondContact O-N 3.43Å; I150-M153 PolarHBondContact O-N 3.34Å; I150-D154 PolarHBondContact O-N 2.88Å
151Q88Confident83Confident110 Ų110101.7 Ų101.751%0.51454%0.544SS..Hα-helixtrans-60.2-37.3177.7-74.1177.9-13.700113.4K147 M148 I149 K155K147-Q151 WeakPolarHBondContact O-CG 3.27Å; K147-Q151 PolarHBondContact O-N 3.22Å; K147-Q151 VanDerWaalsContact O-N 3.08Å; M148-Q151 PolarHBondContact O-N 3.49Å; I149-Q151 VanDerWaalsContact C-N 3.34Å; I149-Q151 PolarHBondContact O-N 3.06Å; Q151-K155 PolarHBondContact O-N 3.16Å; Q151-K155 VanDerWaalsContact O-N 3.13Å
152A84.2Confident82.5Confident23 Ų23103.3 Ų103.319%0.1955%0.549CS..Hα-helixtrans-68.9-42.7176.500000111.7R133 M148 I149 I150 D154 K155 D156R133-A152 VanDerWaalsContact NH2-CB 3.28Å; M148-A152 PolarHBondContact O-N 3.28Å; I149-A152 PolarHBondContact O-N 3.2Å; I150-A152 VanDerWaalsContact C-N 3.31Å; I150-A152 PolarHBondContact O-N 3.43Å; A152-D154 VanDerWaalsContact C-N 3.34Å; A152-D154 PolarHBondContact O-N 3.49Å; A152-K155 PolarHBondContact O-N 2.94Å; A152-D156 PolarHBondContact O-N 3.2Å
153M85.7Confident82Confident123 Ų12399.8 Ų99.861%0.60654%0.539SS*.Hα-helixtrans-61.1-42.1176-68.3173.16400111.9I149 I150 K155 D156 S157I149-M153 HydrophobicContact CG2-SD 3.94Å; I149-M153 WeakPolarHBondContact O-CG 3.04Å; I149-M153 PolarHBondContact O-N 3.46Å; I150-M153 PolarHBondContact O-N 3.34Å; M153-K155 VanDerWaalsContact C-N 3.32Å; M153-K155 PolarHBondContact O-N 2.68Å; M153-D156 PolarHBondContact O-N 3.02Å; M153-S157 PolarHBondContact O-N 3.06Å
154D87.8Confident81.4Confident96 Ų9699.1 Ų99.151%0.51354%0.535SS..Hα-helixtrans-62.1-40.9175.3-69.7-21.1000111.2I150 A152 S157 T158I150-D154 PolarHBondContact O-N 2.88Å; A152-D154 VanDerWaalsContact C-N 3.34Å; A152-D154 PolarHBondContact O-N 3.49Å; D154-S157 PolarHBondContact O-N 2.87Å; D154-S157 PolarHBondContact O-OG 2.97Å; D154-T158 PolarHBondContact O-N 3.2Å; D154-T158 PolarHBondContact O-OG1 2.93Å
155K84.9Confident80.8Confident140 Ų14099.6 Ų99.661%0.60954%0.542SS*.Hα-helixtrans-66.3-39.7177.2-167.8177.5-179.5-1780113Q151 A152 M153 S157 T158 N159Q151-K155 PolarHBondContact O-N 3.16Å; Q151-K155 VanDerWaalsContact O-N 3.13Å; A152-K155 PolarHBondContact O-N 2.94Å; M153-K155 VanDerWaalsContact C-N 3.32Å; M153-K155 PolarHBondContact O-N 2.68Å; K155-S157 VanDerWaalsContact C-N 3.35Å; K155-T158 PolarHBondContact O-N 2.87Å; K155-T158 PolarHBondContact O-OG1 3.06Å; K155-N159 PolarHBondContact O-N 2.93Å; K155-N159 PolarHBondContact O-ND2 2.97Å
156D79.3Confident80.2Confident104 Ų104102.5 Ų102.556%0.55656%0.561SS**Hα-helixtrans-71.1-33.5178.5-69.1-18.5000111.6A152 M153 T158 N159 C160A152-D156 PolarHBondContact O-N 3.2Å; M153-D156 PolarHBondContact O-N 3.02Å; D156-T158 VanDerWaalsContact C-N 3.29Å; D156-T158 PolarHBondContact O-N 3.49Å; D156-N159 PolarHBondContact O-N 2.89Å; D156-C160 PolarHBondContact O-N 3.21Å
157S77.2Confident79.5Confident70 Ų70102.5 Ų102.549%0.4956%0.563SS.*Hα-helixtrans-64.1-32.6173.976.40000113.2M153 D154 K155M153-S157 PolarHBondContact O-N 3.06Å; D154-S157 PolarHBondContact O-N 2.87Å; D154-S157 PolarHBondContact O-OG 2.97Å; K155-S157 VanDerWaalsContact C-N 3.35Å
158T74.3Confident78.6Confident93 Ų93100.3 Ų100.357%0.57156%0.562SS**Hα-helixtrans-80.3-22.6179.7480000113.7D154 K155 D156D154-T158 PolarHBondContact O-N 3.2Å; D154-T158 PolarHBondContact O-OG1 2.93Å; K155-T158 PolarHBondContact O-N 2.87Å; K155-T158 PolarHBondContact O-OG1 3.06Å; D156-T158 VanDerWaalsContact C-N 3.29Å; D156-T158 PolarHBondContact O-N 3.49Å
159N69.8Low78Confident116 Ų116102.3 Ų102.362%0.6258%0.577SS**Hα-helixtrans-84-13.1176-71-31.2000113.9K155 D156K155-N159 PolarHBondContact O-N 2.93Å; K155-N159 PolarHBondContact O-ND2 2.97Å; D156-N159 PolarHBondContact O-N 2.89Å
160C54.3Low77.3Confident117 Ų117103.8 Ų103.879%0.79159%0.589SS**THydrogen-bonded Turntrans-101.816.1-178.3-75.20000114D156D156-C160 PolarHBondContact O-N 3.21Å
161S53.7Low76.3Confident164 Ų164105.1 Ų105.1100%1.14760%0.601SS**  trans-114.30173.9-600000110.9

Retrieved 161 of 161 residues in 51.6 ms (Link to these results)

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