A0A077ZMR9_TRITR Loading...

Golgi SNAP receptor complex member 1

AlphaFold DB , UniProt , Accession A0A077ZMR9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 251 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
1M53.8Low70.5Confident211 Ų21190.4 Ų90.4100%1.03952%0.521SS*.  0-44.90-87.9177174.100113.1E3 A4 N5M1-E3 PolarHBondContact O-N 3.12Å; M1-A4 PolarHBondContact O-N 3.47Å; M1-N5 PolarHBondContact O-N 3.16Å
2A60Low72Confident76 Ų7689.3 Ų89.363%0.62852%0.517SS*.Hα-helixtrans-60.4-41-179.100000114.8A4 N5 T6A2-A4 PolarHBondContact O-N 2.74Å; A2-N5 PolarHBondContact O-N 3.32Å; A2-T6 PolarHBondContact O-N 2.88Å; A2-T6 VanDerWaalsContact O-N 3.15Å; A2-T6 PolarHBondContact O-OG1 3.49Å
3E58.8Low73.3Confident170 Ų17091.4 Ų91.479%0.79452%0.516SS*.Hα-helixtrans-64.9-39.3178-72.1-180156.900112.9M1 N5 T6 C7M1-E3 PolarHBondContact O-N 3.12Å; E3-N5 PolarHBondContact O-N 2.93Å; E3-T6 PolarHBondContact O-N 3.44Å; E3-C7 VanDerWaalsContact O-CB 3.3Å; E3-C7 WeakPolarHBondContact O-CB 3.26Å; E3-C7 PolarHBondContact O-N 3.29Å
4A62.5Low74.3Confident55 Ų5586.2 Ų86.246%0.45548%0.484SS..Hα-helixtrans-65-38.4178.300000112.2M1 A2 C7 N8M1-A4 PolarHBondContact O-N 3.47Å; A2-A4 PolarHBondContact O-N 2.74Å; A4-C7 WeakPolarHBondContact O-CB 3.4Å; A4-C7 PolarHBondContact O-N 3.35Å; A4-N8 PolarHBondContact O-N 2.97Å; A4-N8 PolarHBondContact O-ND2 3.36Å
5N68.6Low75.3Confident114 Ų11485.3 Ų85.361%0.6148%0.475SS*.Hα-helixtrans-66.7-40.1175.5-71-10.9000111.8M1 A2 E3 N8 S9M1-N5 PolarHBondContact O-N 3.16Å; A2-N5 PolarHBondContact O-N 3.32Å; E3-N5 PolarHBondContact O-N 2.93Å; N5-N8 PolarHBondContact O-N 3.32Å; N5-S9 PolarHBondContact O-N 2.81Å
6T69.4Low76.4Confident92 Ų9285.9 Ų85.956%0.56448%0.477SS*.Hα-helixtrans-64.6-44177.3-51.10000110.8A2 E3 S9 F10A2-T6 PolarHBondContact O-N 2.88Å; A2-T6 VanDerWaalsContact O-N 3.15Å; A2-T6 PolarHBondContact O-OG1 3.49Å; E3-T6 PolarHBondContact O-N 3.44Å; T6-S9 PolarHBondContact O-N 2.91Å; T6-S9 PolarHBondContact O-OG 2.84Å; T6-F10 PolarHBondContact O-N 2.7Å
7C71.4Confident77.3Confident46 Ų4682.4 Ų82.431%0.31146%0.457SS..Hα-helixtrans-56.2-51.3174.7172.90000112.4E3 A4 S9 F10 V11 Y98E3-C7 VanDerWaalsContact O-CB 3.3Å; E3-C7 WeakPolarHBondContact O-CB 3.26Å; E3-C7 PolarHBondContact O-N 3.29Å; A4-C7 WeakPolarHBondContact O-CB 3.4Å; A4-C7 PolarHBondContact O-N 3.35Å; C7-S9 VanDerWaalsContact C-N 3.31Å; C7-S9 PolarHBondContact O-N 2.78Å; C7-F10 PolarHBondContact O-N 2.87Å; C7-V11 WeakPolarHBondContact O-CG2 3.28Å; C7-V11 PolarHBondContact O-N 2.87Å; C7-Y98 PolarHBondContact SG-OH 3.19Å
8N79.9Confident78.1Confident104 Ų10479.7 Ų79.756%0.55644%0.439SS*.Hα-helixtrans-62-37.9177.1-75.4-40000112.6A4 N5 F10 V11 T12A4-N8 PolarHBondContact O-N 2.97Å; A4-N8 PolarHBondContact O-ND2 3.36Å; N5-N8 PolarHBondContact O-N 3.32Å; N8-F10 VanDerWaalsContact C-N 3.33Å; N8-F10 PolarHBondContact O-N 3.37Å; N8-V11 PolarHBondContact O-N 2.94Å; N8-T12 WeakPolarHBondContact O-CG2 3.41Å; N8-T12 PolarHBondContact O-N 2.88Å; N8-T12 VanDerWaalsContact O-N 3.11Å; N8-T12 PolarHBondContact O-OG1 3.41Å
9S83.6Confident78.9Confident49 Ų4982.5 Ų82.534%0.34345%0.446SS..Hα-helixtrans-66.9-34176.982.60000112.9N5 T6 C7 T12 K13N5-S9 PolarHBondContact O-N 2.81Å; T6-S9 PolarHBondContact O-N 2.91Å; T6-S9 PolarHBondContact O-OG 2.84Å; C7-S9 VanDerWaalsContact C-N 3.31Å; C7-S9 PolarHBondContact O-N 2.78Å; S9-T12 WeakPolarHBondContact CA-OG1 3.26Å; S9-T12 PolarHBondContact O-OG1 3.31Å; S9-K13 WeakPolarHBondContact O-CB 3.15Å; S9-K13 VanDerWaalsContact O-CG 3.27Å; S9-K13 WeakPolarHBondContact O-CG 3.36Å; S9-K13 PolarHBondContact O-N 2.9Å
10F83.3Confident79.6Confident22 Ų2284.8 Ų84.810%0.09645%0.448CS..Hα-helixtrans-68.6-49.8175.4168.7-90.8000110.6T6 C7 N8 T12 K13 W14 L92 L93 S96 Y98T6-F10 PolarHBondContact O-N 2.7Å; C7-F10 PolarHBondContact O-N 2.87Å; N8-F10 VanDerWaalsContact C-N 3.33Å; N8-F10 PolarHBondContact O-N 3.37Å; F10-T12 VanDerWaalsContact C-N 3.31Å; F10-T12 PolarHBondContact O-N 3.44Å; F10-K13 PolarHBondContact O-N 3.3Å; F10-W14 HydrophobicContact CE1-CB 4.24Å; F10-W14 HydrophobicContact CE1-CG 4.38Å; F10-W14 HydrophobicContact CE2-CE3 4.45Å; F10-W14 HydrophobicContact CZ-CB 4.3Å; F10-W14 HydrophobicContact CZ-CD2 4.23Å; F10-W14 HydrophobicContact CZ-CE3 4.05Å; F10-W14 HydrophobicContact CZ-CG 4.34Å; F10-W14 WeakPolarHBondContact O-CB 3.23Å; F10-W14 PolarHBondContact O-N 3.48Å; F10-L92 HydrophobicContact CD2-CB 4.46Å; F10-L92 HydrophobicContact CE2-CB 4Å; F10-L92 VanDerWaalsContact CE2-O 3.31Å; F10-L92 WeakPolarHBondContact CE2-O 3.27Å; F10-L93 HydrophobicContact CZ-CD2 3.99Å; F10-S96 WeakPolarHBondContact CE2-OG 3.03Å; F10-Y98 AromaticContact CD1-CD2 3.24Å; F10-Y98 HydrophobicContact CD1-CD2 3.24Å; F10-Y98 AromaticContact CD1-CE2 3.38Å; F10-Y98 HydrophobicContact CD1-CE2 3.38Å; F10-Y98 HydrophobicContact CD1-CG 4.11Å; F10-Y98 HydrophobicContact CE1-CD1 4.47Å; F10-Y98 AromaticContact CE1-CD2 3.21Å; F10-Y98 HydrophobicContact CE1-CD2 3.21Å; F10-Y98 AromaticContact CE1-CE2 3.78Å; F10-Y98 HydrophobicContact CE1-CE2 3.78Å; F10-Y98 AromaticContact CE1-CG 3.61Å; F10-Y98 HydrophobicContact CE1-CG 3.61Å; F10-Y98 AromaticContact CG-CD2 4Å; F10-Y98 HydrophobicContact CG-CD2 4Å; F10-Y98 HydrophobicContact CG-CE2 4.18Å; F10-Y98 AromaticContact CZ-CD2 3.93Å; F10-Y98 HydrophobicContact CZ-CD2 3.93Å; F10-Y98 HydrophobicContact CZ-CG 4.21Å
11V84.3Confident80.3Confident55 Ų5580.7 Ų80.733%0.33343%0.426SS..Hα-helixtrans-60.3-42.6-177.21750000111C7 N8 W14 E15C7-V11 WeakPolarHBondContact O-CG2 3.28Å; C7-V11 PolarHBondContact O-N 2.87Å; N8-V11 PolarHBondContact O-N 2.94Å; V11-W14 PolarHBondContact O-N 3.21Å; V11-E15 HydrophobicContact CG1-CG 4.39Å; V11-E15 WeakPolarHBondContact O-CB 3.34Å; V11-E15 VanDerWaalsContact O-CG 3.24Å; V11-E15 WeakPolarHBondContact O-CG 3.36Å; V11-E15 PolarHBondContact O-N 3.43Å
12T88Confident82.1Confident77 Ų7777.5 Ų77.547%0.47240%0.403SS..Hα-helixtrans-62.7-50.5177.146.60000112.3N8 S9 F10 W14 E15 D16N8-T12 WeakPolarHBondContact O-CG2 3.41Å; N8-T12 PolarHBondContact O-N 2.88Å; N8-T12 VanDerWaalsContact O-N 3.11Å; N8-T12 PolarHBondContact O-OG1 3.41Å; S9-T12 WeakPolarHBondContact CA-OG1 3.26Å; S9-T12 PolarHBondContact O-OG1 3.31Å; F10-T12 VanDerWaalsContact C-N 3.31Å; F10-T12 PolarHBondContact O-N 3.44Å; T12-W14 VanDerWaalsContact C-N 3.31Å; T12-W14 PolarHBondContact O-N 3.23Å; T12-E15 PolarHBondContact O-N 3.4Å; T12-D16 VanDerWaalsContact O-CG 3.27Å; T12-D16 PolarHBondContact O-N 2.91Å
13K88.8Confident83.8Confident117 Ų11776.3 Ų76.351%0.50939%0.39SS..Hα-helixtrans-59.8-40.4176-71.4176.6-179.3-178.10112.7S9 F10 D16 L17 L92S9-K13 WeakPolarHBondContact O-CB 3.15Å; S9-K13 VanDerWaalsContact O-CG 3.27Å; S9-K13 WeakPolarHBondContact O-CG 3.36Å; S9-K13 PolarHBondContact O-N 2.9Å; F10-K13 PolarHBondContact O-N 3.3Å; K13-D16 PolarHBondContact O-N 3.32Å; K13-L17 WeakPolarHBondContact O-CG 3.37Å; K13-L17 PolarHBondContact O-N 3.46Å; K13-L92 HydrophobicContact CB-CD1 3.92Å
14W88.3Confident85.5Confident19 Ų1968.3 Ų68.37%0.07235%0.352CS..Hα-helixtrans-63.1-45.6177.7179.1-104.5000112.1F10 V11 T12 R18 M89 L93 T107 M108F10-W14 HydrophobicContact CE1-CB 4.24Å; F10-W14 HydrophobicContact CE1-CG 4.38Å; F10-W14 HydrophobicContact CE2-CE3 4.45Å; F10-W14 HydrophobicContact CZ-CB 4.3Å; F10-W14 HydrophobicContact CZ-CD2 4.23Å; F10-W14 HydrophobicContact CZ-CE3 4.05Å; F10-W14 HydrophobicContact CZ-CG 4.34Å; F10-W14 WeakPolarHBondContact O-CB 3.23Å; F10-W14 PolarHBondContact O-N 3.48Å; V11-W14 PolarHBondContact O-N 3.21Å; T12-W14 VanDerWaalsContact C-N 3.31Å; T12-W14 PolarHBondContact O-N 3.23Å; W14-R18 VanDerWaalsContact CD1-NE 3.34Å; W14-R18 VanDerWaalsContact CD1-NH2 3.35Å; W14-R18 PolarHBondContact O-N 3.48Å; W14-M89 HydrophobicContact CD2-CG 4.47Å; W14-M89 HydrophobicContact CE3-CG 3.67Å; W14-M89 HydrophobicContact CH2-CG 3.26Å; W14-M89 HydrophobicContact CH2-SD 3.59Å; W14-M89 VanDerWaalsContact CH2-SD 3.59Å; W14-M89 HydrophobicContact CZ2-CG 4.18Å; W14-M89 HydrophobicContact CZ2-SD 4.06Å; W14-M89 HydrophobicContact CZ3-CB 4.16Å; W14-M89 HydrophobicContact CZ3-CG 2.98Å; W14-M89 WeakPolarHBondContact CZ3-O 3.47Å; W14-M89 HydrophobicContact CZ3-SD 3.95Å; W14-L93 HydrophobicContact CE3-CD2 4.19Å; W14-L93 HydrophobicContact CE3-CG 4.25Å; W14-L93 HydrophobicContact CH2-CD1 3.42Å; W14-L93 VanDerWaalsContact CH2-CD1 3.42Å; W14-L93 HydrophobicContact CH2-CD2 3.71Å; W14-L93 HydrophobicContact CH2-CG 3.5Å; W14-L93 HydrophobicContact CZ2-CD1 4.37Å; W14-L93 HydrophobicContact CZ2-CD2 4.28Å; W14-L93 HydrophobicContact CZ2-CG 4.5Å; W14-L93 HydrophobicContact CZ3-CD1 3.79Å; W14-L93 HydrophobicContact CZ3-CD2 3.63Å; W14-L93 HydrophobicContact CZ3-CG 3.33Å; W14-T107 HydrophobicContact CZ2-CG2 4.48Å; W14-M108 HydrophobicContact CH2-CE 4.03Å; W14-M108 HydrophobicContact CZ3-CE 4.32Å
15E89.5Confident87Confident72 Ų7266.5 Ų66.534%0.33634%0.335SS..Hα-helixtrans-62.9-42.7175.4-72.8-69.6166.600111.7V11 T12 R18 K19V11-E15 HydrophobicContact CG1-CG 4.39Å; V11-E15 WeakPolarHBondContact O-CB 3.34Å; V11-E15 VanDerWaalsContact O-CG 3.24Å; V11-E15 WeakPolarHBondContact O-CG 3.36Å; V11-E15 PolarHBondContact O-N 3.43Å; T12-E15 PolarHBondContact O-N 3.4Å; E15-R18 VanDerWaalsContact CD-CZ 3.49Å; E15-R18 PolarHBondContact O-N 3.4Å; E15-R18 IonicContact OE1-CZ 3.99Å; E15-R18 IonicContact OE1-NH1 3.51Å; E15-R18 IonicContact OE1-NH2 3.74Å; E15-R18 PolarHBondContact OE1-NH2 3.43Å; E15-R18 IonicContact OE2-CZ 2.68Å; E15-R18 IonicContact OE2-NH1 3.35Å; E15-R18 PolarHBondContact OE2-NH1 2.78Å; E15-R18 IonicContact OE2-NH2 2.81Å; E15-R18 PolarHBondContact OE2-NH2 2.93Å; E15-K19 WeakPolarHBondContact O-CG 3.44Å; E15-K19 PolarHBondContact O-N 3.36Å
16D92.4Very high88.2Confident96 Ų9665 Ų6551%0.51333%0.33SS..Hα-helixtrans-66.3-42.8-179.2-69.4-21.4000111.9T12 K13 R18 K19 R20T12-D16 VanDerWaalsContact O-CG 3.27Å; T12-D16 PolarHBondContact O-N 2.91Å; K13-D16 PolarHBondContact O-N 3.32Å; D16-R18 VanDerWaalsContact C-N 3.34Å; D16-R18 PolarHBondContact O-N 3.45Å; D16-K19 PolarHBondContact O-N 2.88Å; D16-R20 WeakPolarHBondContact O-CB 3.42Å; D16-R20 PolarHBondContact O-N 3.49Å
17L92.1Very high89.5Confident26 Ų2664.1 Ų64.114%0.13632%0.322CS..Hα-helixtrans-63.2-40173.6-73.5172.4000111.9K13 R20 A21 V85 R88 M89 L92K13-L17 WeakPolarHBondContact O-CG 3.37Å; K13-L17 PolarHBondContact O-N 3.46Å; L17-R20 PolarHBondContact O-N 2.67Å; L17-A21 WeakPolarHBondContact O-CB 3.23Å; L17-A21 PolarHBondContact O-N 3.44Å; L17-V85 HydrophobicContact CB-CG1 4.39Å; L17-V85 HydrophobicContact CD2-CG1 4.17Å; L17-V85 WeakPolarHBondContact O-CG1 3.45Å; L17-R88 HydrophobicContact CD1-CB 4.13Å; L17-R88 HydrophobicContact CD2-CB 4.24Å; L17-M89 HydrophobicContact CB-CE 4.14Å; L17-M89 HydrophobicContact CD1-CB 4.29Å; L17-L92 HydrophobicContact CD1-CD1 3.36Å; L17-L92 HydrophobicContact CD1-CG 4.35Å
18R90.8Very high90.6Very high34 Ų3461.9 Ų61.913%0.12831%0.307CS..Hα-helixtrans-65.2-40.5175.7-83.9-166.1-71.5114-22.3112.9W14 E15 D16 R20 A21 R22 M89W14-R18 VanDerWaalsContact CD1-NE 3.34Å; W14-R18 VanDerWaalsContact CD1-NH2 3.35Å; W14-R18 PolarHBondContact O-N 3.48Å; E15-R18 VanDerWaalsContact CD-CZ 3.49Å; E15-R18 PolarHBondContact O-N 3.4Å; E15-R18 IonicContact OE1-CZ 3.99Å; E15-R18 IonicContact OE1-NH1 3.51Å; E15-R18 IonicContact OE1-NH2 3.74Å; E15-R18 PolarHBondContact OE1-NH2 3.43Å; E15-R18 IonicContact OE2-CZ 2.68Å; E15-R18 IonicContact OE2-NH1 3.35Å; E15-R18 PolarHBondContact OE2-NH1 2.78Å; E15-R18 IonicContact OE2-NH2 2.81Å; E15-R18 PolarHBondContact OE2-NH2 2.93Å; D16-R18 VanDerWaalsContact C-N 3.34Å; D16-R18 PolarHBondContact O-N 3.45Å; R18-R20 VanDerWaalsContact C-N 3.31Å; R18-A21 PolarHBondContact O-N 3.35Å; R18-R22 WeakPolarHBondContact O-CG 3.16Å; R18-R22 PolarHBondContact O-N 3.31Å; R18-M89 HydrophobicContact CB-CE 4.34Å; R18-M89 HydrophobicContact CG-CE 3.56Å; R18-M89 HydrophobicContact CG-SD 4.06Å
19K93.4Very high91.2Very high132 Ų13260.2 Ų60.257%0.57430%0.298SS*.Hα-helixtrans-61.8-43174-72.8171.6-173.4169.30110.6E15 D16 R22 S23E15-K19 WeakPolarHBondContact O-CG 3.44Å; E15-K19 PolarHBondContact O-N 3.36Å; D16-K19 PolarHBondContact O-N 2.88Å; K19-R22 PolarHBondContact O-N 3.19Å; K19-S23 PolarHBondContact O-N 3.47Å
20R93.2Very high91.8Very high128 Ų12862.2 Ų62.248%0.48331%0.307SS..Hα-helixtrans-63.6-43.8176.7-171.664.7-178.7178.74.9112D16 L17 R18 S23 L24 V85D16-R20 WeakPolarHBondContact O-CB 3.42Å; D16-R20 PolarHBondContact O-N 3.49Å; L17-R20 PolarHBondContact O-N 2.67Å; R18-R20 VanDerWaalsContact C-N 3.31Å; R20-S23 WeakPolarHBondContact O-CB 3.3Å; R20-S23 PolarHBondContact O-N 2.82Å; R20-L24 HydrophobicContact CG-CD1 4.27Å; R20-L24 WeakPolarHBondContact O-CG 3.45Å; R20-L24 PolarHBondContact O-N 2.9Å; R20-V85 HydrophobicContact CG-CG2 3.98Å
21A93.5Very high92.3Very high0 Ų063.8 Ų63.80%031%0.314CS..Hα-helixtrans-58.5-51.3175.700000111L17 R18 S23 L24 E25 L82 V85 M89L17-A21 WeakPolarHBondContact O-CB 3.23Å; L17-A21 PolarHBondContact O-N 3.44Å; R18-A21 PolarHBondContact O-N 3.35Å; A21-S23 VanDerWaalsContact C-N 3.3Å; A21-S23 PolarHBondContact O-N 2.84Å; A21-L24 PolarHBondContact O-N 2.91Å; A21-L24 VanDerWaalsContact O-N 3.11Å; A21-E25 VanDerWaalsContact O-CG 3.23Å; A21-E25 WeakPolarHBondContact O-CG 3.25Å; A21-E25 PolarHBondContact O-N 2.98Å; A21-L82 HydrophobicContact CB-CD1 4.05Å; A21-V85 HydrophobicContact CB-CG1 3.87Å; A21-M89 HydrophobicContact CB-CE 4.18Å
22R92.7Very high92.7Very high143 Ų14361.2 Ų61.254%0.5430%0.299SS..Hα-helixtrans-60.2-37.3178.5-70.4177.6-170.9-173.42.9113.5R18 K19 T26R18-R22 WeakPolarHBondContact O-CG 3.16Å; R18-R22 PolarHBondContact O-N 3.31Å; K19-R22 PolarHBondContact O-N 3.19Å; R22-T26 PolarHBondContact O-N 3.38Å; R22-T26 PolarHBondContact O-OG1 2.83Å
23S95.1Very high92.9Very high52 Ų5262.3 Ų62.336%0.36430%0.301SS..Hα-helixtrans-63-48.5174.4-172.60000110.8K19 R20 A21 T26 D27K19-S23 PolarHBondContact O-N 3.47Å; R20-S23 WeakPolarHBondContact O-CB 3.3Å; R20-S23 PolarHBondContact O-N 2.82Å; A21-S23 VanDerWaalsContact C-N 3.3Å; A21-S23 PolarHBondContact O-N 2.84Å; S23-T26 WeakPolarHBondContact O-CB 3.47Å; S23-T26 PolarHBondContact O-N 2.91Å; S23-D27 VanDerWaalsContact O-CG 3.29Å; S23-D27 PolarHBondContact O-N 2.94Å
24L94.5Very high93Very high1 Ų158.9 Ų58.91%0.00529%0.292CS..Hα-helixtrans-63.8-40.7178-70.9170.4000112R20 A21 T26 D27 V28 L78 Q81 L82 V85R20-L24 HydrophobicContact CG-CD1 4.27Å; R20-L24 WeakPolarHBondContact O-CG 3.45Å; R20-L24 PolarHBondContact O-N 2.9Å; A21-L24 PolarHBondContact O-N 2.91Å; A21-L24 VanDerWaalsContact O-N 3.11Å; L24-T26 VanDerWaalsContact C-N 3.29Å; L24-T26 PolarHBondContact O-N 3.14Å; L24-D27 PolarHBondContact O-N 2.85Å; L24-V28 VanDerWaalsContact O-CG2 3.27Å; L24-V28 WeakPolarHBondContact O-CG2 3.48Å; L24-V28 PolarHBondContact O-N 3.24Å; L24-L78 HydrophobicContact CD2-CD2 3.82Å; L24-Q81 HydrophobicContact CD1-CB 4.03Å; L24-Q81 HydrophobicContact CD2-CB 4.25Å; L24-L82 HydrophobicContact CB-CB 4.41Å; L24-L82 HydrophobicContact CB-CD1 4.19Å; L24-L82 HydrophobicContact CD1-CB 4.42Å; L24-V85 HydrophobicContact CD1-CG2 3.93Å
25E94.1Very high93.2Very high17 Ų1758 Ų588%0.07929%0.289CS..Hα-helixtrans-57.7-43174.4-69.8166.6-17600111.1A21 V28 D29 L82 H111 I114 Y118A21-E25 VanDerWaalsContact O-CG 3.23Å; A21-E25 WeakPolarHBondContact O-CG 3.25Å; A21-E25 PolarHBondContact O-N 2.98Å; E25-V28 PolarHBondContact O-N 3.49Å; E25-D29 PolarHBondContact O-N 2.73Å; E25-L82 HydrophobicContact CG-CD1 4.06Å; E25-L82 HydrophobicContact CG-CD2 3.96Å; E25-H111 IonicContact OE1-CE1 2.7Å; E25-H111 PolarHBondContact OE1-CE1 2.96Å; E25-H111 IonicContact OE1-ND1 2.73Å; E25-H111 PolarHBondContact OE1-ND1 3.31Å; E25-I114 HydrophobicContact CG-CG2 4.22Å; E25-Y118 HydrophobicContact CB-CE2 4.02Å; E25-Y118 HydrophobicContact CG-CE2 4.04Å; E25-Y118 PolarHBondContact O-OH 2.84Å
26T94.8Very high93.2Very high84 Ų8457 Ų5752%0.51529%0.285SS..Hα-helixtrans-66.3-42177.1-54.70000111.5R22 S23 L24 V28 D29 V30R22-T26 PolarHBondContact O-N 3.38Å; R22-T26 PolarHBondContact O-OG1 2.83Å; S23-T26 WeakPolarHBondContact O-CB 3.47Å; S23-T26 PolarHBondContact O-N 2.91Å; L24-T26 VanDerWaalsContact C-N 3.29Å; L24-T26 PolarHBondContact O-N 3.14Å; T26-V28 VanDerWaalsContact C-N 3.34Å; T26-V28 PolarHBondContact O-N 2.95Å; T26-D29 PolarHBondContact O-N 3.01Å; T26-V30 WeakPolarHBondContact O-CG2 3.41Å; T26-V30 PolarHBondContact O-N 3.26Å; T26-V30 VanDerWaalsContact O-N 3.08Å
27D95.1Very high93.1Very high72 Ų7260 Ų6039%0.38529%0.294SS..Hα-helixtrans-64.8-38.8177.7-66.8-28.3000111.7S23 L24 K31 L78S23-D27 VanDerWaalsContact O-CG 3.29Å; S23-D27 PolarHBondContact O-N 2.94Å; L24-D27 PolarHBondContact O-N 2.85Å; D27-K31 WeakPolarHBondContact O-CG 3.38Å; D27-K31 PolarHBondContact O-N 3.38Å; D27-K31 VanDerWaalsContact O-N 3.13Å; D27-L78 HydrophobicContact CB-CD1 3.93Å; D27-L78 HydrophobicContact CB-CD2 4.26Å
28V94.7Very high92.9Very high0 Ų059.9 Ų59.90%029%0.293CS..Hα-helixtrans-63.1-46.5174.51700000110.6L24 E25 T26 V30 K31 L32 L78 L79 Y118L24-V28 VanDerWaalsContact O-CG2 3.27Å; L24-V28 WeakPolarHBondContact O-CG2 3.48Å; L24-V28 PolarHBondContact O-N 3.24Å; E25-V28 PolarHBondContact O-N 3.49Å; T26-V28 VanDerWaalsContact C-N 3.34Å; T26-V28 PolarHBondContact O-N 2.95Å; V28-V30 PolarHBondContact O-N 3.04Å; V28-K31 PolarHBondContact O-N 2.93Å; V28-L32 HydrophobicContact CG1-CD1 3.68Å; V28-L32 HydrophobicContact CG1-CG 4.19Å; V28-L32 WeakPolarHBondContact O-CB 3.2Å; V28-L32 WeakPolarHBondContact O-CG 3.49Å; V28-L32 PolarHBondContact O-N 3.17Å; V28-L78 HydrophobicContact CG2-CB 3.57Å; V28-L78 HydrophobicContact CG2-CD1 4.02Å; V28-L78 HydrophobicContact CG2-CG 4.44Å; V28-L79 HydrophobicContact CG1-CD2 4.25Å; V28-L79 HydrophobicContact CG2-CD2 4.35Å; V28-Y118 HydrophobicContact CG1-CD1 3.74Å; V28-Y118 HydrophobicContact CG1-CD2 4.22Å; V28-Y118 HydrophobicContact CG1-CE1 4.17Å; V28-Y118 HydrophobicContact CG1-CG 3.78Å
29D94.1Very high92.6Very high69 Ų6958.4 Ų58.437%0.36929%0.289SS..Hα-helixtrans-59.3-47.9179.2-170.935.6000111.7E25 T26 K31 L32 L33 Y118E25-D29 PolarHBondContact O-N 2.73Å; T26-D29 PolarHBondContact O-N 3.01Å; D29-K31 VanDerWaalsContact C-N 3.32Å; D29-K31 PolarHBondContact O-N 3.01Å; D29-L32 PolarHBondContact O-N 3.46Å; D29-L33 WeakPolarHBondContact O-CB 3.34Å; D29-L33 VanDerWaalsContact O-CG 3.28Å; D29-L33 WeakPolarHBondContact O-CG 3.4Å; D29-L33 PolarHBondContact O-N 3.35Å; D29-Y118 HydrophobicContact CB-CE1 4.48Å
30V95.1Very high92.1Very high90 Ų9055.2 Ų55.255%0.54529%0.287SS..Hα-helixtrans-59.8-41.5177.4173.10000111.9T26 V28 S34T26-V30 WeakPolarHBondContact O-CG2 3.41Å; T26-V30 PolarHBondContact O-N 3.26Å; T26-V30 VanDerWaalsContact O-N 3.08Å; V28-V30 PolarHBondContact O-N 3.04Å; V30-S34 PolarHBondContact O-N 3Å; V30-S34 VanDerWaalsContact O-N 3.11Å
31K93.3Very high91.5Very high56 Ų5651.8 Ų51.824%0.24328%0.283CS..Hα-helixtrans-73.7-35177.8-70.9-169.8-169.8-88.90112.7D27 V28 D29 L33 S34 L35 D74 I75 L78D27-K31 WeakPolarHBondContact O-CG 3.38Å; D27-K31 PolarHBondContact O-N 3.38Å; D27-K31 VanDerWaalsContact O-N 3.13Å; V28-K31 PolarHBondContact O-N 2.93Å; D29-K31 VanDerWaalsContact C-N 3.32Å; D29-K31 PolarHBondContact O-N 3.01Å; K31-L33 VanDerWaalsContact C-N 3.34Å; K31-S34 PolarHBondContact O-N 3.36Å; K31-S34 PolarHBondContact O-OG 2.94Å; K31-L35 WeakPolarHBondContact O-CB 3.31Å; K31-L35 PolarHBondContact O-N 3.42Å; K31-D74 HydrophobicContact CD-CB 3.93Å; K31-D74 IonicContact NZ-OD2 3.04Å; K31-D74 PolarHBondContact NZ-OD2 3Å; K31-I75 HydrophobicContact CB-CD1 4.03Å; K31-I75 HydrophobicContact CB-CG1 3.59Å; K31-I75 HydrophobicContact CD-CG1 4.2Å; K31-L78 HydrophobicContact CD-CD1 3.61Å; K31-L78 HydrophobicContact CG-CD1 4.4Å
32L92.7Very high90.8Very high0 Ų052.6 Ų52.60%029%0.287CS..Hα-helixtrans-65.7-38.8173.4-81.6173.2000111.4V28 D29 L35 N36 I75 Y118 F122V28-L32 HydrophobicContact CG1-CD1 3.68Å; V28-L32 HydrophobicContact CG1-CG 4.19Å; V28-L32 WeakPolarHBondContact O-CB 3.2Å; V28-L32 WeakPolarHBondContact O-CG 3.49Å; V28-L32 PolarHBondContact O-N 3.17Å; D29-L32 PolarHBondContact O-N 3.46Å; L32-L35 HydrophobicContact CD2-CD2 4.26Å; L32-L35 WeakPolarHBondContact O-CB 3.39Å; L32-L35 PolarHBondContact O-N 3.02Å; L32-N36 WeakPolarHBondContact O-CB 3.34Å; L32-N36 VanDerWaalsContact O-CG 3.3Å; L32-N36 PolarHBondContact O-N 3.37Å; L32-N36 PolarHBondContact O-ND2 3.49Å; L32-I75 HydrophobicContact CD2-CD1 4.19Å; L32-I75 HydrophobicContact CD2-CG2 4.49Å; L32-I75 HydrophobicContact CG-CD1 4.5Å; L32-Y118 HydrophobicContact CD1-CD1 3.64Å; L32-Y118 HydrophobicContact CD1-CE1 4.32Å; L32-Y118 HydrophobicContact CD1-CG 4.5Å; L32-F122 HydrophobicContact CD2-CB 3.97Å; L32-F122 HydrophobicContact CD2-CD2 4.08Å
33L92.7Very high89.8Confident101 Ų10147.8 Ų47.853%0.52928%0.282SS..Hα-helixtrans-63.2-40.8173.2-71.2172.2000111.9D29 K31 N36 K37D29-L33 WeakPolarHBondContact O-CB 3.34Å; D29-L33 VanDerWaalsContact O-CG 3.28Å; D29-L33 WeakPolarHBondContact O-CG 3.4Å; D29-L33 PolarHBondContact O-N 3.35Å; K31-L33 VanDerWaalsContact C-N 3.34Å; L33-N36 PolarHBondContact O-N 2.99Å; L33-K37 VanDerWaalsContact O-CB 3.32Å; L33-K37 WeakPolarHBondContact O-CB 3.35Å; L33-K37 PolarHBondContact O-N 3.42Å
34S91.8Very high88.1Confident45 Ų4547.3 Ų47.332%0.31529%0.285SS..Hα-helixtrans-68.1-37.1176.2750000112.2V30 K31 K37 L38V30-S34 PolarHBondContact O-N 3Å; V30-S34 VanDerWaalsContact O-N 3.11Å; K31-S34 PolarHBondContact O-N 3.36Å; K31-S34 PolarHBondContact O-OG 2.94Å; S34-K37 PolarHBondContact O-N 3.42Å; S34-L38 PolarHBondContact O-N 2.84Å
35L91.3Very high86.2Confident0 Ų051.1 Ų51.10%031%0.308CS..Hα-helixtrans-62.3-49.8172.3-17270.7000111.3K31 L32 K37 L38 G39 F68 L71 I75 F122 A125 I129K31-L35 WeakPolarHBondContact O-CB 3.31Å; K31-L35 PolarHBondContact O-N 3.42Å; L32-L35 HydrophobicContact CD2-CD2 4.26Å; L32-L35 WeakPolarHBondContact O-CB 3.39Å; L32-L35 PolarHBondContact O-N 3.02Å; L35-K37 VanDerWaalsContact C-N 3.29Å; L35-K37 PolarHBondContact O-N 2.83Å; L35-L38 WeakPolarHBondContact O-CB 3.28Å; L35-L38 PolarHBondContact O-N 2.84Å; L35-L38 VanDerWaalsContact O-N 3.12Å; L35-G39 PolarHBondContact O-N 2.78Å; L35-F68 HydrophobicContact CD1-CD2 3.48Å; L35-F68 VanDerWaalsContact CD1-CD2 3.48Å; L35-F68 HydrophobicContact CD1-CE2 3.82Å; L35-L71 HydrophobicContact CD1-CB 4.16Å; L35-L71 HydrophobicContact CD1-CD1 4.5Å; L35-I75 HydrophobicContact CB-CD1 4.13Å; L35-I75 HydrophobicContact CD2-CD1 3.82Å; L35-I75 HydrophobicContact CG-CD1 4.43Å; L35-F122 HydrophobicContact CD2-CD2 3.9Å; L35-F122 HydrophobicContact CD2-CE2 4.01Å; L35-A125 HydrophobicContact CD2-CB 3.81Å; L35-A125 HydrophobicContact CG-CB 4.45Å; L35-I129 HydrophobicContact CD1-CD1 3.65Å; L35-I129 HydrophobicContact CD2-CD1 4.44Å; L35-I129 HydrophobicContact CG-CD1 3.58Å; L35-I129 VanDerWaalsContact O-CD1 3.25Å; L35-I129 WeakPolarHBondContact O-CD1 3.4Å
36N91.2Very high84.1Confident50 Ų5058 Ų5827%0.26733%0.333SS..Hα-helixtrans-61.9-36.8176.8-76.3-34.5000111.7L32 L33 G39 A40 E121 A125L32-N36 WeakPolarHBondContact O-CB 3.34Å; L32-N36 VanDerWaalsContact O-CG 3.3Å; L32-N36 PolarHBondContact O-N 3.37Å; L32-N36 PolarHBondContact O-ND2 3.49Å; L33-N36 PolarHBondContact O-N 2.99Å; N36-G39 PolarHBondContact O-N 3.43Å; N36-A40 WeakPolarHBondContact O-CB 3.46Å; N36-A40 PolarHBondContact O-N 3.02Å; N36-E121 PolarHBondContact ND2-OE1 3.29Å; N36-A125 WeakPolarHBondContact OD1-CB 3.22Å
37K89.9Confident81.9Confident161 Ų16157.7 Ų57.770%0.735%0.347SS*.Hα-helixtrans-64.6-39.4174-173.8179-179.7-177.90111.9L33 S34 L35 A40 S41L33-K37 VanDerWaalsContact O-CB 3.32Å; L33-K37 WeakPolarHBondContact O-CB 3.35Å; L33-K37 PolarHBondContact O-N 3.42Å; S34-K37 PolarHBondContact O-N 3.42Å; L35-K37 VanDerWaalsContact C-N 3.29Å; L35-K37 PolarHBondContact O-N 2.83Å; K37-A40 PolarHBondContact O-N 2.68Å; K37-S41 WeakPolarHBondContact O-CB 3.44Å; K37-S41 PolarHBondContact O-N 3.27Å
38L86.3Confident79.3Confident22 Ų2259 Ų5912%0.11536%0.362CS..Hα-helixtrans-60.5-47.9172.8-178.765.1000110.3S34 L35 A40 S41 L42 F68S34-L38 PolarHBondContact O-N 2.84Å; L35-L38 WeakPolarHBondContact O-CB 3.28Å; L35-L38 PolarHBondContact O-N 2.84Å; L35-L38 VanDerWaalsContact O-N 3.12Å; L38-A40 PolarHBondContact O-N 3.25Å; L38-S41 PolarHBondContact O-N 2.91Å; L38-S41 VanDerWaalsContact O-N 3.13Å; L38-S41 PolarHBondContact O-OG 2.8Å; L38-L42 HydrophobicContact CD1-CD1 3.98Å; L38-L42 HydrophobicContact CG-CD1 4.32Å; L38-L42 VanDerWaalsContact O-CD1 3.28Å; L38-L42 WeakPolarHBondContact O-CD1 3.29Å; L38-L42 PolarHBondContact O-N 3.32Å; L38-F68 HydrophobicContact CD2-CB 3.67Å
39G85.7Confident76.6Confident3 Ų362.4 Ų62.43%0.03139%0.39CS..Hα-helixtrans-59-43.7174.600000113.5L35 N36 S41 L42 G43 L132L35-G39 PolarHBondContact O-N 2.78Å; N36-G39 PolarHBondContact O-N 3.43Å; G39-S41 VanDerWaalsContact C-N 3.31Å; G39-S41 PolarHBondContact O-N 3.13Å; G39-L42 PolarHBondContact O-N 3.41Å; G39-G43 PolarHBondContact O-N 2.7Å; G39-L132 VanDerWaalsContact O-CD1 3.27Å; G39-L132 WeakPolarHBondContact O-CD1 3.32Å
40A82.9Confident74.2Confident66 Ų6667.7 Ų67.755%0.54542%0.417SS..Hα-helixtrans-64.4-35.4175.700000112.1N36 K37 L38 G43 G44N36-A40 WeakPolarHBondContact O-CB 3.46Å; N36-A40 PolarHBondContact O-N 3.02Å; K37-A40 PolarHBondContact O-N 2.68Å; L38-A40 PolarHBondContact O-N 3.25Å; A40-G43 PolarHBondContact O-N 3.48Å; A40-G44 VanDerWaalsContact O-CA 3.31Å; A40-G44 WeakPolarHBondContact O-CA 3.35Å; A40-G44 PolarHBondContact O-N 2.96Å
41S80.6Confident71.4Confident56 Ų5671.9 Ų71.939%0.39243%0.431SS..Hα-helixtrans-67.4-38.3175.674.80000111.9K37 L38 G39 V45K37-S41 WeakPolarHBondContact O-CB 3.44Å; K37-S41 PolarHBondContact O-N 3.27Å; L38-S41 PolarHBondContact O-N 2.91Å; L38-S41 VanDerWaalsContact O-N 3.13Å; L38-S41 PolarHBondContact O-OG 2.8Å; G39-S41 VanDerWaalsContact C-N 3.31Å; G39-S41 PolarHBondContact O-N 3.13Å; S41-V45 VanDerWaalsContact O-CG2 3.27Å; S41-V45 WeakPolarHBondContact O-CG2 3.11Å
42L78.8Confident69Low17 Ų1776.6 Ų76.69%0.08945%0.453CS..Hα-helixtrans-67.2-40.6175.4-92.365.6000112L38 G39 L132 L133L38-L42 HydrophobicContact CD1-CD1 3.98Å; L38-L42 HydrophobicContact CG-CD1 4.32Å; L38-L42 VanDerWaalsContact O-CD1 3.28Å; L38-L42 WeakPolarHBondContact O-CD1 3.29Å; L38-L42 PolarHBondContact O-N 3.32Å; G39-L42 PolarHBondContact O-N 3.41Å; L42-L132 HydrophobicContact CB-CB 4.16Å; L42-L132 HydrophobicContact CB-CD1 4.3Å; L42-L132 HydrophobicContact CD2-CB 4.22Å; L42-L133 HydrophobicContact CD2-CD2 3.6Å; L42-L133 HydrophobicContact CD2-CG 3.68Å
43G70.9Confident66.6Low41 Ų4186.1 Ų86.142%0.42350%0.498SS..Hα-helixtrans-78.2-33.5177.700000114.2G39 A40G39-G43 PolarHBondContact O-N 2.7Å; A40-G43 PolarHBondContact O-N 3.48Å
44G59.9Low64.3Low43 Ų4384.2 Ų84.244%0.44349%0.493SS..Hα-helixtrans-77.3-22.5-168.700000115A40 R46 G47A40-G44 VanDerWaalsContact O-CA 3.31Å; A40-G44 WeakPolarHBondContact O-CA 3.35Å; A40-G44 PolarHBondContact O-N 2.96Å; G44-R46 PolarHBondContact O-N 2.84Å; G44-G47 PolarHBondContact O-N 3.45Å; G44-G47 VanDerWaalsContact O-N 3.12Å
45V53.9Low62.3Low80 Ų8089.3 Ų89.349%0.48552%0.517SS..THydrogen-bonded Turntrans-55-17.4179.1166.60000113.2S41 F56S41-V45 VanDerWaalsContact O-CG2 3.27Å; S41-V45 WeakPolarHBondContact O-CG2 3.11Å; V45-F56 HydrophobicContact CG2-CE2 4.25Å
46R50.6Low60.5Low162 Ų16292 Ų9261%0.61153%0.529SS*.THydrogen-bonded Turntrans-110.8-16.9178-72.9-179.9160.6-112.3-5.4116G44 S48 M139G44-R46 PolarHBondContact O-N 2.84Å; R46-S48 PolarHBondContact O-N 3.42Å; R46-M139 VanDerWaalsContact CZ-CE 3.46Å; R46-M139 VanDerWaalsContact NH2-CE 3.26Å
47G48.7Very low58.9Low78 Ų7890.5 Ų90.580%0.80452%0.524SS*.THydrogen-bonded Turntrans-69.4-26.9178.600000112.6G44G44-G47 PolarHBondContact O-N 3.45Å; G44-G47 VanDerWaalsContact O-N 3.12Å
48S40Very low57.7Low99 Ų9986.8 Ų86.869%0.69251%0.512SS*.SBendtrans-119.9127.1177.3-1550000108.9R46R46-S48 PolarHBondContact O-N 3.42Å
49A39.2Very low57.1Low71 Ų7192.1 Ų92.159%0.58754%0.54SS*.  trans78.885.5177.200000116.6H51A49-H51 PolarHBondContact O-N 2.97Å
50L42.3Very low56.7Low180 Ų18095.6 Ų95.694%0.94256%0.559SS**THydrogen-bonded Turntrans-49.818.7152.3-104.4155.6000115.7
51H37.9Very low56.5Low179 Ų17992.6 Ų92.683%0.82953%0.533SS*.THydrogen-bonded Turntrans-155.627.1-171.3-121.1-52.1000117.8A49A49-H51 PolarHBondContact O-N 2.97Å
52Q41.1Very low56.5Low154 Ų15492.4 Ų92.472%0.7253%0.532SS*.  trans-119.995.8165.5-139.2165-7.100111.9S54Q52-S54 WeakPolarHBondContact CB-OG 3.48Å; Q52-S54 VanDerWaalsContact CG-OG 3.3Å; Q52-S54 WeakPolarHBondContact CG-OG 3.38Å; Q52-S54 PolarHBondContact O-N 3.37Å
53E42.2Very low56.8Low200 Ų20096.7 Ų96.794%0.93556%0.555SS**  trans-59.528.8155.2-67.4-177.4139.200112.2N55E53-N55 PolarHBondContact O-N 2.97Å
54S45.8Very low57.5Low62 Ų6295.5 Ų95.543%0.43454%0.54SS..  trans-74.585.3171.647.30000107.4Q52 F56Q52-S54 WeakPolarHBondContact CB-OG 3.48Å; Q52-S54 VanDerWaalsContact CG-OG 3.3Å; Q52-S54 WeakPolarHBondContact CG-OG 3.38Å; Q52-S54 PolarHBondContact O-N 3.37Å; S54-F56 PolarHBondContact O-N 3.43Å
55N49.2Very low58.9Low151 Ų15197.4 Ų97.481%0.80753%0.534SS*.  20.161.4128.7-157.758.4000113.5E53 G57E53-N55 PolarHBondContact O-N 2.97Å; N55-G57 PolarHBondContact O-N 3.37Å
56F53.3Low60.5Low58 Ų5898.2 Ų98.225%0.25454%0.535SS..  trans-73.780.1168.7-160.8-91.2000103.5V45 S54 N60 V61 E136V45-F56 HydrophobicContact CG2-CE2 4.25Å; S54-F56 PolarHBondContact O-N 3.43Å; F56-N60 HydrophobicContact CD1-CB 4.05Å; F56-N60 HydrophobicContact CD2-CB 4.42Å; F56-N60 HydrophobicContact CE1-CB 3.74Å; F56-N60 HydrophobicContact CE2-CB 4.15Å; F56-N60 HydrophobicContact CG-CB 4.38Å; F56-N60 HydrophobicContact CZ-CB 3.8Å; F56-V61 HydrophobicContact CD1-CG2 3.72Å; F56-V61 HydrophobicContact CE1-CG2 3.75Å; F56-E136 HydrophobicContact CD1-CG 4.19Å; F56-E136 HydrophobicContact CE1-CG 4.29Å
57G57.7Low62.4Low17 Ų1793.1 Ų93.118%0.17552%0.522CS..  trans-59.7153.3-170.100000109.7N55 D59 N60 V61N55-G57 PolarHBondContact O-N 3.37Å; G57-D59 PolarHBondContact O-N 3.41Å; G57-N60 PolarHBondContact O-N 3.49Å; G57-V61 PolarHBondContact O-N 3.39Å
58L65.7Low64.5Low84 Ų8489.8 Ų89.844%0.4449%0.485SS..Hα-helixtrans-45.7-29.8169.1-76.7158.3000111.9V61 S62 A140L58-V61 PolarHBondContact O-N 2.88Å; L58-S62 VanDerWaalsContact O-CB 3.28Å; L58-S62 WeakPolarHBondContact O-CB 3.24Å; L58-S62 PolarHBondContact O-N 3Å; L58-S62 PolarHBondContact O-OG 3.33Å; L58-A140 HydrophobicContact CD2-CB 3.7Å; L58-A140 HydrophobicContact CG-CB 4.12Å
59D73.7Confident67Low133 Ų13389.7 Ų89.771%0.71147%0.474SS*.Hα-helixtrans-61.2-43.3175.1-58.8-23.4000113.4G57 S62 L63G57-D59 PolarHBondContact O-N 3.41Å; D59-S62 PolarHBondContact O-N 2.86Å; D59-L63 WeakPolarHBondContact O-CB 3.31Å; D59-L63 PolarHBondContact O-N 2.99Å
60N76.8Confident69.5Low77 Ų7788.9 Ų88.941%0.41247%0.468SS..Hα-helixtrans-68.4-42.2177.9-80.9-6.4000111F56 G57 S62 L63 S64F56-N60 HydrophobicContact CD1-CB 4.05Å; F56-N60 HydrophobicContact CD2-CB 4.42Å; F56-N60 HydrophobicContact CE1-CB 3.74Å; F56-N60 HydrophobicContact CE2-CB 4.15Å; F56-N60 HydrophobicContact CG-CB 4.38Å; F56-N60 HydrophobicContact CZ-CB 3.8Å; G57-N60 PolarHBondContact O-N 3.49Å; N60-S62 VanDerWaalsContact C-N 3.29Å; N60-S62 PolarHBondContact O-N 3.39Å; N60-L63 PolarHBondContact O-N 2.88Å; N60-S64 WeakPolarHBondContact O-CB 3.42Å; N60-S64 PolarHBondContact O-N 3.47Å; N60-S64 PolarHBondContact O-OG 2.82Å; N60-S64 VanDerWaalsContact O-OG 3.14Å
61V79Confident72Confident2 Ų282 Ų821%0.01243%0.432CS..Hα-helixtrans-61.1-42.3175.3-172.30000110.5F56 G57 L58 S64 R65 L133 E136 L137F56-V61 HydrophobicContact CD1-CG2 3.72Å; F56-V61 HydrophobicContact CE1-CG2 3.75Å; G57-V61 PolarHBondContact O-N 3.39Å; L58-V61 PolarHBondContact O-N 2.88Å; V61-S64 PolarHBondContact O-N 2.93Å; V61-R65 WeakPolarHBondContact O-CB 3.27Å; V61-R65 PolarHBondContact O-N 3.34Å; V61-L133 HydrophobicContact CG1-CD2 4.1Å; V61-E136 HydrophobicContact CG1-CB 4.36Å; V61-E136 HydrophobicContact CG1-CG 4.24Å; V61-E136 HydrophobicContact CG2-CB 4.45Å; V61-E136 HydrophobicContact CG2-CG 3.49Å; V61-E136 VanDerWaalsContact CG2-CG 3.49Å; V61-L137 HydrophobicContact CG1-CD2 3.7Å; V61-L137 HydrophobicContact CG1-CG 3.85Å
62S80.8Confident74.6Confident53 Ų5374.1 Ų74.137%0.37140%0.397SS..Hα-helixtrans-65.5-42.6177.9-59.20000111.7L58 D59 N60 R65 N66L58-S62 VanDerWaalsContact O-CB 3.28Å; L58-S62 WeakPolarHBondContact O-CB 3.24Å; L58-S62 PolarHBondContact O-N 3Å; L58-S62 PolarHBondContact O-OG 3.33Å; D59-S62 PolarHBondContact O-N 2.86Å; N60-S62 VanDerWaalsContact C-N 3.29Å; N60-S62 PolarHBondContact O-N 3.39Å; S62-R65 PolarHBondContact O-N 2.91Å; S62-N66 PolarHBondContact O-N 3.41Å; S62-N66 PolarHBondContact O-ND2 3.35Å
63L84.5Confident77.2Confident107 Ų10771.7 Ų71.756%0.5639%0.392SS*.Hα-helixtrans-63.8-42.7174.1-177.764.3000111.5D59 N60 R65 N66 T67D59-L63 WeakPolarHBondContact O-CB 3.31Å; D59-L63 PolarHBondContact O-N 2.99Å; N60-L63 PolarHBondContact O-N 2.88Å; L63-R65 VanDerWaalsContact C-N 3.33Å; L63-R65 PolarHBondContact O-N 3.42Å; L63-N66 PolarHBondContact O-N 3.06Å; L63-T67 HydrophobicContact CD1-CG2 4.44Å; L63-T67 WeakPolarHBondContact O-CB 3.46Å; L63-T67 WeakPolarHBondContact O-CG2 3.31Å; L63-T67 PolarHBondContact O-N 2.82Å; L63-T67 PolarHBondContact O-OG1 3.12Å
64S86Confident79.7Confident16 Ų1665.5 Ų65.511%0.11237%0.366CS..Hα-helixtrans-62.8-38.3174.7-690000112.1N60 V61 T67 F68N60-S64 WeakPolarHBondContact O-CB 3.42Å; N60-S64 PolarHBondContact O-N 3.47Å; N60-S64 PolarHBondContact O-OG 2.82Å; N60-S64 VanDerWaalsContact O-OG 3.14Å; V61-S64 PolarHBondContact O-N 2.93Å; S64-T67 VanDerWaalsContact CA-OG1 3.31Å; S64-T67 WeakPolarHBondContact CA-OG1 3.37Å; S64-T67 PolarHBondContact O-OG1 2.94Å; S64-F68 WeakPolarHBondContact O-CB 3.35Å; S64-F68 PolarHBondContact O-N 3.43Å
65R87.9Confident82Confident83 Ų8362.6 Ų62.631%0.31335%0.345SS..Hα-helixtrans-63.9-48.6172.3170.1169.1-101.1143.80.8111.7V61 S62 L63 T67 F68 E69 L133V61-R65 WeakPolarHBondContact O-CB 3.27Å; V61-R65 PolarHBondContact O-N 3.34Å; S62-R65 PolarHBondContact O-N 2.91Å; L63-R65 VanDerWaalsContact C-N 3.33Å; L63-R65 PolarHBondContact O-N 3.42Å; R65-T67 VanDerWaalsContact C-N 3.31Å; R65-T67 PolarHBondContact O-N 3.26Å; R65-F68 WeakPolarHBondContact O-CB 3.28Å; R65-F68 PolarHBondContact O-N 3.01Å; R65-E69 WeakPolarHBondContact CD-OE1 3.37Å; R65-E69 HydrophobicContact CG-CG 4.33Å; R65-E69 VanDerWaalsContact CG-OE1 3.25Å; R65-E69 WeakPolarHBondContact CG-OE1 3.47Å; R65-E69 IonicContact NE-OE1 3.67Å; R65-E69 WeakPolarHBondContact O-CG 3.45Å; R65-E69 PolarHBondContact O-N 3.36Å; R65-L133 HydrophobicContact CB-CD1 4.3Å; R65-L133 HydrophobicContact CB-CD2 4.16Å
66N88.9Confident84.2Confident96 Ų9659.3 Ų59.351%0.51333%0.325SS..Hα-helixtrans-61.7-40.7-179.9-67.8-21.9000111.9S62 L63 E69 A70S62-N66 PolarHBondContact O-N 3.41Å; S62-N66 PolarHBondContact O-ND2 3.35Å; L63-N66 PolarHBondContact O-N 3.06Å; N66-E69 PolarHBondContact O-N 3.48Å; N66-A70 WeakPolarHBondContact O-CB 3.43Å; N66-A70 PolarHBondContact O-N 3Å
67T89.9Confident86.2Confident56 Ų5660.7 Ų60.734%0.34434%0.335SS..Hα-helixtrans-68.8-38.417651.70000111.8L63 S64 R65 L71L63-T67 HydrophobicContact CD1-CG2 4.44Å; L63-T67 WeakPolarHBondContact O-CB 3.46Å; L63-T67 WeakPolarHBondContact O-CG2 3.31Å; L63-T67 PolarHBondContact O-N 2.82Å; L63-T67 PolarHBondContact O-OG1 3.12Å; S64-T67 VanDerWaalsContact CA-OG1 3.31Å; S64-T67 WeakPolarHBondContact CA-OG1 3.37Å; S64-T67 PolarHBondContact O-OG1 2.94Å; R65-T67 VanDerWaalsContact C-N 3.31Å; R65-T67 PolarHBondContact O-N 3.26Å; T67-L71 WeakPolarHBondContact O-CB 3.25Å; T67-L71 VanDerWaalsContact O-CG 3.28Å; T67-L71 WeakPolarHBondContact O-CG 3.33Å; T67-L71 PolarHBondContact O-N 2.97Å
68F91.8Very high88Confident7 Ų760.8 Ų60.83%0.03133%0.331CS..Hα-helixtrans-60.9-47.6172.1170.6-110.8000112.3L35 L38 S64 R65 L71 S72 Q126 I129 L133L35-F68 HydrophobicContact CD1-CD2 3.48Å; L35-F68 VanDerWaalsContact CD1-CD2 3.48Å; L35-F68 HydrophobicContact CD1-CE2 3.82Å; L38-F68 HydrophobicContact CD2-CB 3.67Å; S64-F68 WeakPolarHBondContact O-CB 3.35Å; S64-F68 PolarHBondContact O-N 3.43Å; R65-F68 WeakPolarHBondContact O-CB 3.28Å; R65-F68 PolarHBondContact O-N 3.01Å; F68-L71 PolarHBondContact O-N 2.91Å; F68-S72 VanDerWaalsContact O-CB 3.25Å; F68-S72 WeakPolarHBondContact O-CB 3.32Å; F68-S72 PolarHBondContact O-N 3.48Å; F68-S72 PolarHBondContact O-OG 3.33Å; F68-Q126 HydrophobicContact CE1-CG 4.49Å; F68-Q126 HydrophobicContact CE2-CG 4.22Å; F68-Q126 HydrophobicContact CZ-CB 4.27Å; F68-Q126 HydrophobicContact CZ-CG 3.56Å; F68-I129 HydrophobicContact CB-CG2 4.34Å; F68-I129 HydrophobicContact CD1-CG2 4.3Å; F68-I129 HydrophobicContact CD2-CB 3.89Å; F68-I129 HydrophobicContact CD2-CD1 3.77Å; F68-I129 HydrophobicContact CD2-CG1 4.43Å; F68-I129 HydrophobicContact CD2-CG2 3.36Å; F68-I129 HydrophobicContact CE1-CG2 4.43Å; F68-I129 HydrophobicContact CE2-CB 3.57Å; F68-I129 HydrophobicContact CE2-CD1 3.75Å; F68-I129 HydrophobicContact CE2-CG1 4.26Å; F68-I129 HydrophobicContact CE2-CG2 3.55Å; F68-I129 HydrophobicContact CG-CG2 3.75Å; F68-I129 HydrophobicContact CZ-CB 4.1Å; F68-I129 HydrophobicContact CZ-CG2 4.06Å; F68-L133 HydrophobicContact CB-CD1 4.4Å; F68-L133 HydrophobicContact CD1-CD1 3.87Å; F68-L133 HydrophobicContact CE1-CD1 4.39Å; F68-L133 HydrophobicContact CG-CD1 4.23Å
69E92.4Very high89.4Confident97 Ų9757 Ų5745%0.45331%0.311SS..Hα-helixtrans-63.6-45.4179.1-73.8175.6-169.200111.2R65 N66 S72 V73R65-E69 WeakPolarHBondContact CD-OE1 3.37Å; R65-E69 HydrophobicContact CG-CG 4.33Å; R65-E69 VanDerWaalsContact CG-OE1 3.25Å; R65-E69 WeakPolarHBondContact CG-OE1 3.47Å; R65-E69 IonicContact NE-OE1 3.67Å; R65-E69 WeakPolarHBondContact O-CG 3.45Å; R65-E69 PolarHBondContact O-N 3.36Å; N66-E69 PolarHBondContact O-N 3.48Å; E69-S72 PolarHBondContact O-N 2.75Å; E69-V73 WeakPolarHBondContact O-CG2 3.42Å; E69-V73 PolarHBondContact O-N 3.48Å
70A93.4Very high90.5Very high55 Ų5554.8 Ų54.846%0.45530%0.3SS..Hα-helixtrans-60.7-47.917600000112.2N66 S72 V73 D74N66-A70 WeakPolarHBondContact O-CB 3.43Å; N66-A70 PolarHBondContact O-N 3Å; A70-S72 VanDerWaalsContact C-N 3.3Å; A70-S72 PolarHBondContact O-N 3.48Å; A70-V73 PolarHBondContact O-N 2.83Å; A70-D74 WeakPolarHBondContact O-CB 3.19Å; A70-D74 PolarHBondContact O-N 3.12Å
71L93.2Very high91.3Very high35 Ų3554.3 Ų54.318%0.18330%0.295CS..Hα-helixtrans-63.1-37176-74.4173.5000112.1L35 T67 F68 D74 I75L35-L71 HydrophobicContact CD1-CB 4.16Å; L35-L71 HydrophobicContact CD1-CD1 4.5Å; T67-L71 WeakPolarHBondContact O-CB 3.25Å; T67-L71 VanDerWaalsContact O-CG 3.28Å; T67-L71 WeakPolarHBondContact O-CG 3.33Å; T67-L71 PolarHBondContact O-N 2.97Å; F68-L71 PolarHBondContact O-N 2.91Å; L71-D74 PolarHBondContact O-N 3.43Å; L71-I75 WeakPolarHBondContact O-CB 3.44Å; L71-I75 WeakPolarHBondContact O-CD1 3.48Å; L71-I75 WeakPolarHBondContact O-CG1 3.41Å; L71-I75 PolarHBondContact O-N 2.86Å
72S93.8Very high92Very high14 Ų1454.2 Ų54.210%0.09829%0.294CS..Hα-helixtrans-65.9-44.2178.7-62.40000111.8F68 E69 A70 I75 Q76F68-S72 VanDerWaalsContact O-CB 3.25Å; F68-S72 WeakPolarHBondContact O-CB 3.32Å; F68-S72 PolarHBondContact O-N 3.48Å; F68-S72 PolarHBondContact O-OG 3.33Å; E69-S72 PolarHBondContact O-N 2.75Å; A70-S72 VanDerWaalsContact C-N 3.3Å; A70-S72 PolarHBondContact O-N 3.48Å; S72-I75 PolarHBondContact O-N 2.8Å; S72-Q76 WeakPolarHBondContact O-CB 3.35Å; S72-Q76 PolarHBondContact O-N 2.91Å
73V95Very high92.7Very high103 Ų10354 Ų5462%0.62429%0.291SS*.Hα-helixtrans-63.4-43.4175.21720000110.8E69 A70 Q76 N77E69-V73 WeakPolarHBondContact O-CG2 3.42Å; E69-V73 PolarHBondContact O-N 3.48Å; A70-V73 PolarHBondContact O-N 2.83Å; V73-Q76 PolarHBondContact O-N 3.36Å; V73-N77 WeakPolarHBondContact O-CB 3.49Å; V73-N77 PolarHBondContact O-N 3.33Å
74D94.9Very high93.2Very high70 Ų7051.8 Ų51.837%0.37428%0.28SS..Hα-helixtrans-61.7-46.4177.4-88.17.4000112.6K31 A70 L71 Q76 N77 L78K31-D74 HydrophobicContact CD-CB 3.93Å; K31-D74 IonicContact NZ-OD2 3.04Å; K31-D74 PolarHBondContact NZ-OD2 3Å; A70-D74 WeakPolarHBondContact O-CB 3.19Å; A70-D74 PolarHBondContact O-N 3.12Å; L71-D74 PolarHBondContact O-N 3.43Å; D74-Q76 VanDerWaalsContact C-N 3.35Å; D74-N77 PolarHBondContact O-N 2.9Å; D74-L78 WeakPolarHBondContact O-CG 3.24Å; D74-L78 PolarHBondContact O-N 3.29Å
75I94.6Very high93.6Very high0 Ų051.6 Ų51.60%028%0.277CS..Hα-helixtrans-64.3-42.8178.4-68.4162.2000110K31 L32 L35 L71 S72 N77 L78 L79 F122K31-I75 HydrophobicContact CB-CD1 4.03Å; K31-I75 HydrophobicContact CB-CG1 3.59Å; K31-I75 HydrophobicContact CD-CG1 4.2Å; L32-I75 HydrophobicContact CD2-CD1 4.19Å; L32-I75 HydrophobicContact CD2-CG2 4.49Å; L32-I75 HydrophobicContact CG-CD1 4.5Å; L35-I75 HydrophobicContact CB-CD1 4.13Å; L35-I75 HydrophobicContact CD2-CD1 3.82Å; L35-I75 HydrophobicContact CG-CD1 4.43Å; L71-I75 WeakPolarHBondContact O-CB 3.44Å; L71-I75 WeakPolarHBondContact O-CD1 3.48Å; L71-I75 WeakPolarHBondContact O-CG1 3.41Å; L71-I75 PolarHBondContact O-N 2.86Å; S72-I75 PolarHBondContact O-N 2.8Å; I75-N77 VanDerWaalsContact C-N 3.33Å; I75-N77 PolarHBondContact O-N 2.98Å; I75-L78 PolarHBondContact O-N 3.12Å; I75-L79 HydrophobicContact CG2-CD1 4.02Å; I75-L79 HydrophobicContact CG2-CG 4.26Å; I75-L79 WeakPolarHBondContact O-CG 3.44Å; I75-L79 PolarHBondContact O-N 3.37Å; I75-F122 HydrophobicContact CB-CD2 4.08Å; I75-F122 HydrophobicContact CB-CE2 3.9Å; I75-F122 HydrophobicContact CB-CZ 4.42Å; I75-F122 HydrophobicContact CD1-CD2 4.07Å; I75-F122 HydrophobicContact CD1-CE2 4.03Å; I75-F122 HydrophobicContact CG2-CB 4.37Å; I75-F122 HydrophobicContact CG2-CD1 4.4Å; I75-F122 HydrophobicContact CG2-CD2 3.5Å; I75-F122 HydrophobicContact CG2-CE2 3.82Å; I75-F122 HydrophobicContact CG2-CG 3.83Å; I75-F122 HydrophobicContact CG2-CZ 4.38Å
76Q94.9Very high93.9Very high82 Ų8248 Ų4838%0.38327%0.265SS..Hα-helixtrans-59.6-45.2176.9-171.560.549.400111.4S72 V73 D74 L78 L79 D80S72-Q76 WeakPolarHBondContact O-CB 3.35Å; S72-Q76 PolarHBondContact O-N 2.91Å; V73-Q76 PolarHBondContact O-N 3.36Å; D74-Q76 VanDerWaalsContact C-N 3.35Å; Q76-L78 VanDerWaalsContact C-N 3.34Å; Q76-L78 PolarHBondContact O-N 2.88Å; Q76-L79 PolarHBondContact O-N 3.46Å; Q76-D80 PolarHBondContact NE2-OD1 2.88Å; Q76-D80 PolarHBondContact O-N 2.81Å
77N96.1Very high94.1Very high87 Ų8748.6 Ų48.647%0.46526%0.264SS..Hα-helixtrans-62-39.5176.2-176.58.8000112.3V73 D74 I75 D80 Q81V73-N77 WeakPolarHBondContact O-CB 3.49Å; V73-N77 PolarHBondContact O-N 3.33Å; D74-N77 PolarHBondContact O-N 2.9Å; I75-N77 VanDerWaalsContact C-N 3.33Å; I75-N77 PolarHBondContact O-N 2.98Å; N77-D80 PolarHBondContact O-N 2.88Å; N77-Q81 WeakPolarHBondContact O-CB 3.31Å; N77-Q81 WeakPolarHBondContact O-CG 3.38Å; N77-Q81 PolarHBondContact O-N 3.19Å; N77-Q81 PolarHBondContact O-NE2 3.11Å; N77-Q81 PolarHBondContact OD1-NE2 2.87Å
78L94.6Very high94.2Very high19 Ų1952.4 Ų52.410%0.09927%0.272CS..Hα-helixtrans-65.6-40.3174.4-72.3177000112.4L24 D27 V28 K31 D74 I75 Q76 Q81 L82L24-L78 HydrophobicContact CD2-CD2 3.82Å; D27-L78 HydrophobicContact CB-CD1 3.93Å; D27-L78 HydrophobicContact CB-CD2 4.26Å; V28-L78 HydrophobicContact CG2-CB 3.57Å; V28-L78 HydrophobicContact CG2-CD1 4.02Å; V28-L78 HydrophobicContact CG2-CG 4.44Å; K31-L78 HydrophobicContact CD-CD1 3.61Å; K31-L78 HydrophobicContact CG-CD1 4.4Å; D74-L78 WeakPolarHBondContact O-CG 3.24Å; D74-L78 PolarHBondContact O-N 3.29Å; I75-L78 PolarHBondContact O-N 3.12Å; Q76-L78 VanDerWaalsContact C-N 3.34Å; Q76-L78 PolarHBondContact O-N 2.88Å; L78-Q81 PolarHBondContact O-N 3.23Å; L78-L82 WeakPolarHBondContact O-CB 3.27Å; L78-L82 PolarHBondContact O-N 3.39Å
79L95.5Very high94Very high4 Ų452 Ų522%0.02127%0.271CS..Hα-helixtrans-65.2-40175.9-70.8175.2000111.6V28 I75 Q76 L82 T83 L115 F122V28-L79 HydrophobicContact CG1-CD2 4.25Å; V28-L79 HydrophobicContact CG2-CD2 4.35Å; I75-L79 HydrophobicContact CG2-CD1 4.02Å; I75-L79 HydrophobicContact CG2-CG 4.26Å; I75-L79 WeakPolarHBondContact O-CG 3.44Å; I75-L79 PolarHBondContact O-N 3.37Å; Q76-L79 PolarHBondContact O-N 3.46Å; L79-L82 PolarHBondContact O-N 2.97Å; L79-T83 WeakPolarHBondContact O-CB 3.25Å; L79-T83 PolarHBondContact O-N 3.37Å; L79-T83 PolarHBondContact O-OG1 2.92Å; L79-L115 HydrophobicContact CD2-CD1 4.05Å; L79-F122 HydrophobicContact CD1-CB 4.31Å; L79-F122 HydrophobicContact CD1-CD1 4.09Å; L79-F122 HydrophobicContact CD1-CG 4.34Å
80D95.9Very high93.8Very high88 Ų8851.3 Ų51.347%0.47127%0.267SS..Hα-helixtrans-64.9-42.5175.8-66.1-15.6000110.8Q76 N77 T83 N84Q76-D80 PolarHBondContact NE2-OD1 2.88Å; Q76-D80 PolarHBondContact O-N 2.81Å; N77-D80 PolarHBondContact O-N 2.88Å; D80-T83 WeakPolarHBondContact O-CB 3.31Å; D80-T83 PolarHBondContact O-N 3.2Å; D80-N84 PolarHBondContact O-N 3.42Å
81Q95Very high93.6Very high67 Ų6753.4 Ų53.431%0.31327%0.268SS..Hα-helixtrans-62.6-42.6173.2-75.5177.664.500112.3L24 N77 L78 T83 N84 V85L24-Q81 HydrophobicContact CD1-CB 4.03Å; L24-Q81 HydrophobicContact CD2-CB 4.25Å; N77-Q81 WeakPolarHBondContact O-CB 3.31Å; N77-Q81 WeakPolarHBondContact O-CG 3.38Å; N77-Q81 PolarHBondContact O-N 3.19Å; N77-Q81 PolarHBondContact O-NE2 3.11Å; N77-Q81 PolarHBondContact OD1-NE2 2.87Å; L78-Q81 PolarHBondContact O-N 3.23Å; Q81-T83 VanDerWaalsContact C-N 3.34Å; Q81-N84 PolarHBondContact O-N 2.8Å; Q81-V85 WeakPolarHBondContact O-CG2 3.32Å; Q81-V85 PolarHBondContact O-N 3.31Å
82L93.9Very high93.2Very high0 Ų053.7 Ų53.70%027%0.269CS..Hα-helixtrans-65.4-40.2177.7-178.459.4000111A21 L24 E25 L78 L79 V85 N86 L115 Y118A21-L82 HydrophobicContact CB-CD1 4.05Å; L24-L82 HydrophobicContact CB-CB 4.41Å; L24-L82 HydrophobicContact CB-CD1 4.19Å; L24-L82 HydrophobicContact CD1-CB 4.42Å; E25-L82 HydrophobicContact CG-CD1 4.06Å; E25-L82 HydrophobicContact CG-CD2 3.96Å; L78-L82 WeakPolarHBondContact O-CB 3.27Å; L78-L82 PolarHBondContact O-N 3.39Å; L79-L82 PolarHBondContact O-N 2.97Å; L82-V85 PolarHBondContact O-N 3.45Å; L82-N86 WeakPolarHBondContact O-CB 3.24Å; L82-N86 PolarHBondContact O-N 3.24Å; L82-L115 HydrophobicContact CB-CD1 4.27Å; L82-L115 HydrophobicContact CD2-CD1 3.81Å; L82-L115 HydrophobicContact CG-CD1 3.99Å; L82-Y118 HydrophobicContact CD2-CD2 4.39Å
83T94.9Very high92.9Very high47 Ų4753.7 Ų53.729%0.28827%0.268SS..Hα-helixtrans-58.9-48.5173-56.80000110.4L79 D80 Q81 V85 N86 E87 L115L79-T83 WeakPolarHBondContact O-CB 3.25Å; L79-T83 PolarHBondContact O-N 3.37Å; L79-T83 PolarHBondContact O-OG1 2.92Å; D80-T83 WeakPolarHBondContact O-CB 3.31Å; D80-T83 PolarHBondContact O-N 3.2Å; Q81-T83 VanDerWaalsContact C-N 3.34Å; T83-V85 VanDerWaalsContact C-N 3.33Å; T83-V85 PolarHBondContact O-N 3.33Å; T83-N86 PolarHBondContact O-N 3.13Å; T83-N86 VanDerWaalsContact O-N 3.15Å; T83-E87 WeakPolarHBondContact O-CG 3.49Å; T83-E87 PolarHBondContact O-N 3.41Å; T83-L115 HydrophobicContact CG2-CD2 4.39Å; T83-L115 WeakPolarHBondContact OG1-CD2 3.31Å
84N95.5Very high92.3Very high62 Ų6256.7 Ų56.733%0.33227%0.268SS..Hα-helixtrans-62.3-38.4178.3-169.9-107000113.2D80 Q81 E87 R88D80-N84 PolarHBondContact O-N 3.42Å; Q81-N84 PolarHBondContact O-N 2.8Å; N84-E87 PolarHBondContact O-N 3.5Å; N84-R88 WeakPolarHBondContact O-CG 3.44Å; N84-R88 PolarHBondContact O-N 2.96Å; N84-R88 PolarHBondContact OD1-NE 2.85Å; N84-R88 PolarHBondContact OD1-NH2 3.31Å
85V94.2Very high91.5Very high11 Ų1159.2 Ų59.27%0.06728%0.282CS..Hα-helixtrans-65.3-42175170.40000110.8L17 R20 A21 L24 Q81 L82 T83 R88 M89L17-V85 HydrophobicContact CB-CG1 4.39Å; L17-V85 HydrophobicContact CD2-CG1 4.17Å; L17-V85 WeakPolarHBondContact O-CG1 3.45Å; R20-V85 HydrophobicContact CG-CG2 3.98Å; A21-V85 HydrophobicContact CB-CG1 3.87Å; L24-V85 HydrophobicContact CD1-CG2 3.93Å; Q81-V85 WeakPolarHBondContact O-CG2 3.32Å; Q81-V85 PolarHBondContact O-N 3.31Å; L82-V85 PolarHBondContact O-N 3.45Å; T83-V85 VanDerWaalsContact C-N 3.33Å; T83-V85 PolarHBondContact O-N 3.33Å; V85-R88 PolarHBondContact O-N 3.31Å; V85-M89 VanDerWaalsContact O-CB 3.24Å; V85-M89 WeakPolarHBondContact O-CB 3.36Å; V85-M89 PolarHBondContact O-N 3.23Å
86N93.5Very high90.5Very high9 Ų960.1 Ų60.15%0.04829%0.288CS..Hα-helixtrans-65.3-40176.8-77.4-12.8000112.2L82 T83 M89 E90 H111L82-N86 WeakPolarHBondContact O-CB 3.24Å; L82-N86 PolarHBondContact O-N 3.24Å; T83-N86 PolarHBondContact O-N 3.13Å; T83-N86 VanDerWaalsContact O-N 3.15Å; N86-M89 WeakPolarHBondContact O-CB 3.35Å; N86-M89 PolarHBondContact O-N 3.47Å; N86-E90 PolarHBondContact O-N 3.08Å; N86-H111 PolarHBondContact ND2-O 3.37Å
87E93.2Very high89.5Confident108 Ų10862.6 Ų62.651%0.50531%0.308SS..Hα-helixtrans-63.1-45.9175-73.5174.6166.400112T83 N84 M89 E90 E91T83-E87 WeakPolarHBondContact O-CG 3.49Å; T83-E87 PolarHBondContact O-N 3.41Å; N84-E87 PolarHBondContact O-N 3.5Å; E87-M89 VanDerWaalsContact C-N 3.25Å; E87-M89 PolarHBondContact O-N 2.88Å; E87-E90 WeakPolarHBondContact O-CB 3.33Å; E87-E90 PolarHBondContact O-N 2.98Å; E87-E90 VanDerWaalsContact O-N 3.16Å; E87-E91 WeakPolarHBondContact O-CB 3.46Å; E87-E91 PolarHBondContact O-N 2.94Å
88R91.3Very high88.3Confident135 Ų13561.9 Ų61.951%0.50930%0.3SS..Hα-helixtrans-61.7-37.8174.8-72175.9-172-173.15.6111.7L17 N84 V85 L92L17-R88 HydrophobicContact CD1-CB 4.13Å; L17-R88 HydrophobicContact CD2-CB 4.24Å; N84-R88 WeakPolarHBondContact O-CG 3.44Å; N84-R88 PolarHBondContact O-N 2.96Å; N84-R88 PolarHBondContact OD1-NE 2.85Å; N84-R88 PolarHBondContact OD1-NH2 3.31Å; V85-R88 PolarHBondContact O-N 3.31Å; R88-L92 WeakPolarHBondContact O-CG 3.35Å; R88-L92 PolarHBondContact O-N 3.41Å
89M88.3Confident87Confident0 Ų063.6 Ų63.60%032%0.317CS..Hα-helixtrans-65.5-42.5176.3-172-171.7-58.900109.8W14 L17 R18 A21 V85 N86 E87 L92 L93 M108W14-M89 HydrophobicContact CD2-CG 4.47Å; W14-M89 HydrophobicContact CE3-CG 3.67Å; W14-M89 HydrophobicContact CH2-CG 3.26Å; W14-M89 HydrophobicContact CH2-SD 3.59Å; W14-M89 VanDerWaalsContact CH2-SD 3.59Å; W14-M89 HydrophobicContact CZ2-CG 4.18Å; W14-M89 HydrophobicContact CZ2-SD 4.06Å; W14-M89 HydrophobicContact CZ3-CB 4.16Å; W14-M89 HydrophobicContact CZ3-CG 2.98Å; W14-M89 WeakPolarHBondContact CZ3-O 3.47Å; W14-M89 HydrophobicContact CZ3-SD 3.95Å; L17-M89 HydrophobicContact CB-CE 4.14Å; L17-M89 HydrophobicContact CD1-CB 4.29Å; R18-M89 HydrophobicContact CB-CE 4.34Å; R18-M89 HydrophobicContact CG-CE 3.56Å; R18-M89 HydrophobicContact CG-SD 4.06Å; A21-M89 HydrophobicContact CB-CE 4.18Å; V85-M89 VanDerWaalsContact O-CB 3.24Å; V85-M89 WeakPolarHBondContact O-CB 3.36Å; V85-M89 PolarHBondContact O-N 3.23Å; N86-M89 WeakPolarHBondContact O-CB 3.35Å; N86-M89 PolarHBondContact O-N 3.47Å; E87-M89 VanDerWaalsContact C-N 3.25Å; E87-M89 PolarHBondContact O-N 2.88Å; M89-L92 PolarHBondContact O-N 2.99Å; M89-L93 PolarHBondContact O-N 3.46Å; M89-M108 HydrophobicContact CB-CE 3.6Å; M89-M108 HydrophobicContact CG-CE 3.32Å; M89-M108 HydrophobicContact SD-CE 3.72Å
90E89Confident85.7Confident81 Ų8174.4 Ų74.438%0.37936%0.357SS..Hα-helixtrans-63.6-44.3175.2175.4173-165.800112.5N86 E87 L92 L93 R94 M108 R112N86-E90 PolarHBondContact O-N 3.08Å; E87-E90 WeakPolarHBondContact O-CB 3.33Å; E87-E90 PolarHBondContact O-N 2.98Å; E87-E90 VanDerWaalsContact O-N 3.16Å; E90-L92 VanDerWaalsContact C-N 3.35Å; E90-L92 PolarHBondContact O-N 3.45Å; E90-L93 PolarHBondContact O-N 2.88Å; E90-L93 VanDerWaalsContact O-N 3.12Å; E90-R94 PolarHBondContact O-N 3.11Å; E90-M108 HydrophobicContact CB-CE 3.98Å; E90-M108 HydrophobicContact CB-SD 4.22Å; E90-R112 IonicContact OE1-CZ 3.97Å; E90-R112 IonicContact OE1-NH2 2.59Å; E90-R112 PolarHBondContact OE1-NH2 3.3Å; E90-R112 IonicContact OE2-CZ 3.96Å; E90-R112 IonicContact OE2-NE 3.15Å; E90-R112 IonicContact OE2-NH2 3.67Å; E90-R112 PolarHBondContact OE2-NH2 3Å
91E88.5Confident84.8Confident99 Ų9973.4 Ų73.446%0.46335%0.352SS..Hα-helixtrans-59.3-46.3177.1-177.1170.6-142.600111.3E87 L93 R94 D95E87-E91 WeakPolarHBondContact O-CB 3.46Å; E87-E91 PolarHBondContact O-N 2.94Å; E91-L93 VanDerWaalsContact C-N 3.3Å; E91-L93 PolarHBondContact O-N 3.23Å; E91-R94 PolarHBondContact O-N 2.98Å; E91-R94 IonicContact OE1-NH2 2.74Å; E91-D95 PolarHBondContact O-N 3.34Å; E91-D95 VanDerWaalsContact O-N 3.16Å
92L85.4Confident84.2Confident42 Ų4275.3 Ų75.322%0.2237%0.37CS..Hα-helixtrans-58.9-40.7174.1-75.4-177.5000112.1F10 K13 L17 R88 M89 E90 S96F10-L92 HydrophobicContact CD2-CB 4.46Å; F10-L92 HydrophobicContact CE2-CB 4Å; F10-L92 VanDerWaalsContact CE2-O 3.31Å; F10-L92 WeakPolarHBondContact CE2-O 3.27Å; K13-L92 HydrophobicContact CB-CD1 3.92Å; L17-L92 HydrophobicContact CD1-CD1 3.36Å; L17-L92 HydrophobicContact CD1-CG 4.35Å; R88-L92 WeakPolarHBondContact O-CG 3.35Å; R88-L92 PolarHBondContact O-N 3.41Å; M89-L92 PolarHBondContact O-N 2.99Å; E90-L92 VanDerWaalsContact C-N 3.35Å; E90-L92 PolarHBondContact O-N 3.45Å; L92-S96 VanDerWaalsContact O-CB 3.27Å; L92-S96 WeakPolarHBondContact O-CB 3.41Å; L92-S96 PolarHBondContact O-N 3.12Å; L92-S96 PolarHBondContact O-OG 2.79Å
93L85.8Confident83.7Confident13 Ų1378.1 Ų78.17%0.06839%0.393CS..Hα-helixtrans-64-47.9176.4-77.7178.6000111.7F10 W14 M89 E90 E91 D95 S96 A99 M108F10-L93 HydrophobicContact CZ-CD2 3.99Å; W14-L93 HydrophobicContact CE3-CD2 4.19Å; W14-L93 HydrophobicContact CE3-CG 4.25Å; W14-L93 HydrophobicContact CH2-CD1 3.42Å; W14-L93 VanDerWaalsContact CH2-CD1 3.42Å; W14-L93 HydrophobicContact CH2-CD2 3.71Å; W14-L93 HydrophobicContact CH2-CG 3.5Å; W14-L93 HydrophobicContact CZ2-CD1 4.37Å; W14-L93 HydrophobicContact CZ2-CD2 4.28Å; W14-L93 HydrophobicContact CZ2-CG 4.5Å; W14-L93 HydrophobicContact CZ3-CD1 3.79Å; W14-L93 HydrophobicContact CZ3-CD2 3.63Å; W14-L93 HydrophobicContact CZ3-CG 3.33Å; M89-L93 PolarHBondContact O-N 3.46Å; E90-L93 PolarHBondContact O-N 2.88Å; E90-L93 VanDerWaalsContact O-N 3.12Å; E91-L93 VanDerWaalsContact C-N 3.3Å; E91-L93 PolarHBondContact O-N 3.23Å; L93-D95 PolarHBondContact O-N 2.87Å; L93-S96 PolarHBondContact O-N 3.25Å; L93-S96 PolarHBondContact O-OG 2.86Å; L93-A99 WeakPolarHBondContact O-CB 3.36Å; L93-M108 HydrophobicContact CD1-CB 3.74Å; L93-M108 HydrophobicContact CD1-CE 3.97Å; L93-M108 HydrophobicContact CD1-CG 4.19Å
94R83.4Confident83.1Confident166 Ų16676.4 Ų76.463%0.62638%0.383SS*.Hα-helixtrans-56.1-40.4-176.5-172.8179.268.1-155.4-2.2112.2E90 E91 S96E90-R94 PolarHBondContact O-N 3.11Å; E91-R94 PolarHBondContact O-N 2.98Å; E91-R94 IonicContact OE1-NH2 2.74Å; R94-S96 VanDerWaalsContact C-N 3.29Å; R94-S96 PolarHBondContact O-N 3.44Å
95D77.5Confident82.5Confident123 Ų12376.8 Ų76.866%0.65839%0.391SS*.THydrogen-bonded Turntrans-83.2-6.4-177.2-64.5-8.9000113.2E91 L93E91-D95 PolarHBondContact O-N 3.34Å; E91-D95 VanDerWaalsContact O-N 3.16Å; L93-D95 PolarHBondContact O-N 2.87Å
96S73.2Confident82.2Confident20 Ų2082.4 Ų82.414%0.1442%0.416CS..SBendtrans-105.8152.6-173.477.70000113.6F10 L92 L93 R94 Y98 A99F10-S96 WeakPolarHBondContact CE2-OG 3.03Å; L92-S96 VanDerWaalsContact O-CB 3.27Å; L92-S96 WeakPolarHBondContact O-CB 3.41Å; L92-S96 PolarHBondContact O-N 3.12Å; L92-S96 PolarHBondContact O-OG 2.79Å; L93-S96 PolarHBondContact O-N 3.25Å; L93-S96 PolarHBondContact O-OG 2.86Å; R94-S96 VanDerWaalsContact C-N 3.29Å; R94-S96 PolarHBondContact O-N 3.44Å; S96-Y98 PolarHBondContact O-N 2.89Å; S96-Y98 VanDerWaalsContact O-N 3.12Å; S96-Y98 WeakPolarHBondContact OG-CB 3.49Å; S96-Y98 PolarHBondContact OG-N 3.44Å; S96-A99 WeakPolarHBondContact O-CB 3.39Å; S96-A99 PolarHBondContact O-N 3.4Å; S96-A99 VanDerWaalsContact O-N 3.07Å
97V74.4Confident82.1Confident133 Ų13384.1 Ų84.181%0.80643%0.427SS*.G310 helixtrans-60.4-21.1169.3-176.80000111.4A99 R100V97-A99 PolarHBondContact O-N 2.97Å; V97-R100 PolarHBondContact O-N 2.82Å
98Y70.5Confident81.8Confident73 Ų7379.3 Ų79.329%0.28640%0.404SS..G310 helixtrans-71.9-9.2176.1-62.8-80.7000114.3C7 F10 S96 R100 N101 S104C7-Y98 PolarHBondContact SG-OH 3.19Å; F10-Y98 AromaticContact CD1-CD2 3.24Å; F10-Y98 HydrophobicContact CD1-CD2 3.24Å; F10-Y98 AromaticContact CD1-CE2 3.38Å; F10-Y98 HydrophobicContact CD1-CE2 3.38Å; F10-Y98 HydrophobicContact CD1-CG 4.11Å; F10-Y98 HydrophobicContact CE1-CD1 4.47Å; F10-Y98 AromaticContact CE1-CD2 3.21Å; F10-Y98 HydrophobicContact CE1-CD2 3.21Å; F10-Y98 AromaticContact CE1-CE2 3.78Å; F10-Y98 HydrophobicContact CE1-CE2 3.78Å; F10-Y98 AromaticContact CE1-CG 3.61Å; F10-Y98 HydrophobicContact CE1-CG 3.61Å; F10-Y98 AromaticContact CG-CD2 4Å; F10-Y98 HydrophobicContact CG-CD2 4Å; F10-Y98 HydrophobicContact CG-CE2 4.18Å; F10-Y98 AromaticContact CZ-CD2 3.93Å; F10-Y98 HydrophobicContact CZ-CD2 3.93Å; F10-Y98 HydrophobicContact CZ-CG 4.21Å; S96-Y98 PolarHBondContact O-N 2.89Å; S96-Y98 VanDerWaalsContact O-N 3.12Å; S96-Y98 WeakPolarHBondContact OG-CB 3.49Å; S96-Y98 PolarHBondContact OG-N 3.44Å; Y98-R100 PolarHBondContact O-N 3.25Å; Y98-R100 VanDerWaalsContact O-N 3.11Å; Y98-N101 WeakPolarHBondContact O-CB 3.48Å; Y98-N101 PolarHBondContact O-N 2.95Å; Y98-S104 PolarHBondContact O-OG 3.39Å
99A67.1Low81.9Confident55 Ų5576.8 Ų76.846%0.45540%0.398SS..G310 helixtrans-52.4-31.6168.600000112.2L93 S96 V97 N101L93-A99 WeakPolarHBondContact O-CB 3.36Å; S96-A99 WeakPolarHBondContact O-CB 3.39Å; S96-A99 PolarHBondContact O-N 3.4Å; S96-A99 VanDerWaalsContact O-N 3.07Å; V97-A99 PolarHBondContact O-N 2.97Å; A99-N101 VanDerWaalsContact C-N 3.33Å
100R68.6Low82.1Confident231 Ų23183.4 Ų83.487%0.87242%0.423SS*.G310 helixtrans-83.6-8.3-178.6-141.1-177.2-60.4-138.71.2113.5V97 Y98 P102V97-R100 PolarHBondContact O-N 2.82Å; Y98-R100 PolarHBondContact O-N 3.25Å; Y98-R100 VanDerWaalsContact O-N 3.11Å; R100-P102 WeakPolarHBondContact O-CD 3.5Å
101N77.8Confident82.2Confident67 Ų6779.7 Ų79.736%0.35841%0.406SS..  trans-79120.4178.7-174.2-24.6000109.1Y98 A99 A103 S104 S105Y98-N101 WeakPolarHBondContact O-CB 3.48Å; Y98-N101 PolarHBondContact O-N 2.95Å; A99-N101 VanDerWaalsContact C-N 3.33Å; N101-A103 PolarHBondContact O-N 3.11Å; N101-A103 WeakPolarHBondContact OD1-CB 3.43Å; N101-A103 PolarHBondContact OD1-N 3.3Å; N101-S104 PolarHBondContact O-N 3.38Å; N101-S104 PolarHBondContact O-OG 3.22Å; N101-S105 PolarHBondContact O-N 3.29Å
102P82.6Confident82.4Confident107 Ų10779.1 Ų79.170%0.69540%0.4SS*.Hα-helixtrans-61.2-28.7-179.424.5-34000112.7R100 H106R100-P102 WeakPolarHBondContact O-CD 3.5Å; P102-H106 VanDerWaalsContact O-CB 3.32Å; P102-H106 WeakPolarHBondContact O-CB 3.36Å; P102-H106 PolarHBondContact O-N 3.27Å
103A83.5Confident82.9Confident58 Ų5881.3 Ų81.348%0.47941%0.409SS..Hα-helixtrans-70-39-179.200000113N101 T107N101-A103 PolarHBondContact O-N 3.11Å; N101-A103 WeakPolarHBondContact OD1-CB 3.43Å; N101-A103 PolarHBondContact OD1-N 3.3Å; A103-T107 WeakPolarHBondContact O-CB 3.48Å; A103-T107 PolarHBondContact O-N 2.74Å; A103-T107 PolarHBondContact O-OG1 3.37Å
104S81.5Confident83.3Confident12 Ų1282 Ų828%0.08441%0.412CS..Hα-helixtrans-71.2-41.8177.651.80000111.2Y98 N101 T107 M108Y98-S104 PolarHBondContact O-OG 3.39Å; N101-S104 PolarHBondContact O-N 3.38Å; N101-S104 PolarHBondContact O-OG 3.22Å; S104-T107 PolarHBondContact O-N 3.46Å; S104-M108 PolarHBondContact O-N 2.84Å
105S84.2Confident83.8Confident70 Ų7075.2 Ų75.249%0.4939%0.388SS..Hα-helixtrans-59.4-46.8174.1-176.40000111.8N101 T107 M108 Q109N101-S105 PolarHBondContact O-N 3.29Å; S105-T107 PolarHBondContact O-N 2.8Å; S105-M108 PolarHBondContact O-N 3.42Å; S105-Q109 WeakPolarHBondContact O-CB 3.38Å; S105-Q109 PolarHBondContact O-N 3.01Å
106H87.6Confident84.6Confident129 Ų12975.7 Ų75.760%0.59739%0.387SS*.Hα-helixtrans-61.8-41.7175.4177.9-90.2000112.6P102 M108 Q109 R110P102-H106 VanDerWaalsContact O-CB 3.32Å; P102-H106 WeakPolarHBondContact O-CB 3.36Å; P102-H106 PolarHBondContact O-N 3.27Å; H106-M108 PolarHBondContact O-N 3Å; H106-Q109 PolarHBondContact O-N 3.34Å; H106-R110 PolarHBondContact O-N 3.05Å
107T89.7Confident85.6Confident44 Ų4479.8 Ų79.827%0.2741%0.407SS..Hα-helixtrans-63.2-43.1177.9-57.90000111.5W14 A103 S104 S105 R110 H111W14-T107 HydrophobicContact CZ2-CG2 4.48Å; A103-T107 WeakPolarHBondContact O-CB 3.48Å; A103-T107 PolarHBondContact O-N 2.74Å; A103-T107 PolarHBondContact O-OG1 3.37Å; S104-T107 PolarHBondContact O-N 3.46Å; S105-T107 PolarHBondContact O-N 2.8Å; T107-R110 PolarHBondContact O-N 3.49Å; T107-H111 PolarHBondContact O-CD2 2.82Å; T107-H111 VanDerWaalsContact O-CD2 3.26Å; T107-H111 PolarHBondContact O-N 3.15Å; T107-H111 VanDerWaalsContact O-N 3.14Å
108M88.9Confident86.6Confident7 Ų775.4 Ų75.43%0.03438%0.376CS..Hα-helixtrans-61.2-46.1174.5175.254.463.100111.6W14 M89 E90 L93 S104 S105 H106 R110 H111 R112W14-M108 HydrophobicContact CH2-CE 4.03Å; W14-M108 HydrophobicContact CZ3-CE 4.32Å; M89-M108 HydrophobicContact CB-CE 3.6Å; M89-M108 HydrophobicContact CG-CE 3.32Å; M89-M108 HydrophobicContact SD-CE 3.72Å; E90-M108 HydrophobicContact CB-CE 3.98Å; E90-M108 HydrophobicContact CB-SD 4.22Å; L93-M108 HydrophobicContact CD1-CB 3.74Å; L93-M108 HydrophobicContact CD1-CE 3.97Å; L93-M108 HydrophobicContact CD1-CG 4.19Å; S104-M108 PolarHBondContact O-N 2.84Å; S105-M108 PolarHBondContact O-N 3.42Å; H106-M108 PolarHBondContact O-N 3Å; M108-R110 VanDerWaalsContact C-N 3.28Å; M108-R110 PolarHBondContact O-N 2.88Å; M108-H111 PolarHBondContact O-N 2.91Å; M108-H111 VanDerWaalsContact O-N 3.16Å; M108-R112 PolarHBondContact O-N 2.82Å; M108-R112 VanDerWaalsContact O-N 3.1Å
109Q91.4Very high87.7Confident83 Ų8373.4 Ų73.439%0.38837%0.373SS..Hα-helixtrans-56.7-44.4177.2-178.558.627.700111.3S105 H106 H111 R112 E113S105-Q109 WeakPolarHBondContact O-CB 3.38Å; S105-Q109 PolarHBondContact O-N 3.01Å; H106-Q109 PolarHBondContact O-N 3.34Å; Q109-H111 PolarHBondContact O-N 3.45Å; Q109-R112 WeakPolarHBondContact O-CB 3.44Å; Q109-R112 PolarHBondContact O-N 2.84Å; Q109-E113 WeakPolarHBondContact CG-OE1 3.3Å; Q109-E113 PolarHBondContact NE2-OE1 2.81Å; Q109-E113 WeakPolarHBondContact O-CG 3.33Å; Q109-E113 PolarHBondContact O-N 3Å
110R93Very high89Confident138 Ų13876.4 Ų76.452%0.52138%0.377SS..Hα-helixtrans-60.4-42.4176.2-173.3175.6-175.3-92.4-1112.9H106 T107 M108 R112 E113 I114H106-R110 PolarHBondContact O-N 3.05Å; T107-R110 PolarHBondContact O-N 3.49Å; M108-R110 VanDerWaalsContact C-N 3.28Å; M108-R110 PolarHBondContact O-N 2.88Å; R110-R112 VanDerWaalsContact C-N 3.28Å; R110-R112 PolarHBondContact O-N 3.06Å; R110-E113 PolarHBondContact O-N 2.94Å; R110-I114 HydrophobicContact CG-CD1 3.83Å; R110-I114 HydrophobicContact CG-CG1 4.44Å; R110-I114 WeakPolarHBondContact O-CB 3.4Å; R110-I114 VanDerWaalsContact O-CG1 3.26Å; R110-I114 WeakPolarHBondContact O-CG1 3.4Å; R110-I114 PolarHBondContact O-N 3.4Å
111H92.4Very high90.2Very high4 Ų467.8 Ų67.82%0.01935%0.347CS..Hα-helixtrans-64.3-33.7177-79.3-64.6000112.5E25 N86 T107 M108 Q109 L115E25-H111 IonicContact OE1-CE1 2.7Å; E25-H111 PolarHBondContact OE1-CE1 2.96Å; E25-H111 IonicContact OE1-ND1 2.73Å; E25-H111 PolarHBondContact OE1-ND1 3.31Å; N86-H111 PolarHBondContact ND2-O 3.37Å; T107-H111 PolarHBondContact O-CD2 2.82Å; T107-H111 VanDerWaalsContact O-CD2 3.26Å; T107-H111 PolarHBondContact O-N 3.15Å; T107-H111 VanDerWaalsContact O-N 3.14Å; M108-H111 PolarHBondContact O-N 2.91Å; M108-H111 VanDerWaalsContact O-N 3.16Å; Q109-H111 PolarHBondContact O-N 3.45Å; H111-L115 WeakPolarHBondContact O-CB 3.21Å; H111-L115 PolarHBondContact O-N 3.28Å; H111-L115 VanDerWaalsContact O-N 3.08Å
112R92.5Very high91Very high86 Ų8665 Ų6533%0.32533%0.331SS..Hα-helixtrans-68.6-44.7174-70.1-177178.3148.1-6.8112.6E90 M108 Q109 R110 L115 Q116E90-R112 IonicContact OE1-CZ 3.97Å; E90-R112 IonicContact OE1-NH2 2.59Å; E90-R112 PolarHBondContact OE1-NH2 3.3Å; E90-R112 IonicContact OE2-CZ 3.96Å; E90-R112 IonicContact OE2-NE 3.15Å; E90-R112 IonicContact OE2-NH2 3.67Å; E90-R112 PolarHBondContact OE2-NH2 3Å; M108-R112 PolarHBondContact O-N 2.82Å; M108-R112 VanDerWaalsContact O-N 3.1Å; Q109-R112 WeakPolarHBondContact O-CB 3.44Å; Q109-R112 PolarHBondContact O-N 2.84Å; R110-R112 VanDerWaalsContact C-N 3.28Å; R110-R112 PolarHBondContact O-N 3.06Å; R112-L115 PolarHBondContact O-N 2.93Å; R112-Q116 WeakPolarHBondContact O-CG 3.43Å; R112-Q116 PolarHBondContact O-N 3.48Å
113E95.4Very high91.6Very high89 Ų8967.6 Ų67.642%0.41633%0.327SS..Hα-helixtrans-60.3-48.3177.6-72.4167.8-173.300110.5Q109 R110 L115 Q116 D117Q109-E113 WeakPolarHBondContact CG-OE1 3.3Å; Q109-E113 PolarHBondContact NE2-OE1 2.81Å; Q109-E113 WeakPolarHBondContact O-CG 3.33Å; Q109-E113 PolarHBondContact O-N 3Å; R110-E113 PolarHBondContact O-N 2.94Å; E113-L115 PolarHBondContact O-N 3.05Å; E113-Q116 WeakPolarHBondContact O-CB 3.39Å; E113-Q116 PolarHBondContact O-N 3.29Å; E113-Q116 VanDerWaalsContact O-N 3.12Å; E113-D117 PolarHBondContact O-N 3.45Å
114I94Very high92Very high27 Ų2772.1 Ų72.114%0.13833%0.332CS..Hα-helixtrans-59.4-44.3177.2-69.8169000111.7E25 R110 Q116 D117 Y118E25-I114 HydrophobicContact CG-CG2 4.22Å; R110-I114 HydrophobicContact CG-CD1 3.83Å; R110-I114 HydrophobicContact CG-CG1 4.44Å; R110-I114 WeakPolarHBondContact O-CB 3.4Å; R110-I114 VanDerWaalsContact O-CG1 3.26Å; R110-I114 WeakPolarHBondContact O-CG1 3.4Å; R110-I114 PolarHBondContact O-N 3.4Å; I114-Q116 VanDerWaalsContact C-N 3.32Å; I114-Q116 PolarHBondContact O-N 3.02Å; I114-D117 PolarHBondContact O-N 2.97Å; I114-Y118 HydrophobicContact CG2-CD2 3.61Å; I114-Y118 HydrophobicContact CG2-CE2 3.21Å; I114-Y118 VanDerWaalsContact O-CD2 3.22Å; I114-Y118 WeakPolarHBondContact O-CD2 3.34Å; I114-Y118 PolarHBondContact O-N 3.42Å
115L93Very high92.4Very high23 Ų2371.6 Ų71.612%0.1233%0.329CS..Hα-helixtrans-62.2-40176.9175.765.1000112L79 L82 T83 H111 R112 E113 S119L79-L115 HydrophobicContact CD2-CD1 4.05Å; L82-L115 HydrophobicContact CB-CD1 4.27Å; L82-L115 HydrophobicContact CD2-CD1 3.81Å; L82-L115 HydrophobicContact CG-CD1 3.99Å; T83-L115 HydrophobicContact CG2-CD2 4.39Å; T83-L115 WeakPolarHBondContact OG1-CD2 3.31Å; H111-L115 WeakPolarHBondContact O-CB 3.21Å; H111-L115 PolarHBondContact O-N 3.28Å; H111-L115 VanDerWaalsContact O-N 3.08Å; R112-L115 PolarHBondContact O-N 2.93Å; E113-L115 PolarHBondContact O-N 3.05Å; L115-S119 WeakPolarHBondContact O-CB 3.39Å; L115-S119 PolarHBondContact O-N 3.36Å; L115-S119 PolarHBondContact O-OG 2.97Å
116Q94.6Very high92.8Very high134 Ų13471.6 Ų71.663%0.62632%0.321SS*.Hα-helixtrans-65.2-43.3175.6-74.9-179.3-6.400111.4R112 E113 I114 S119 H120R112-Q116 WeakPolarHBondContact O-CG 3.43Å; R112-Q116 PolarHBondContact O-N 3.48Å; E113-Q116 WeakPolarHBondContact O-CB 3.39Å; E113-Q116 PolarHBondContact O-N 3.29Å; E113-Q116 VanDerWaalsContact O-N 3.12Å; I114-Q116 VanDerWaalsContact C-N 3.32Å; I114-Q116 PolarHBondContact O-N 3.02Å; Q116-S119 PolarHBondContact O-N 2.99Å; Q116-H120 WeakPolarHBondContact O-CB 3.47Å; Q116-H120 PolarHBondContact O-N 2.91Å
117D96Very high92.9Very high106 Ų10667.2 Ų67.257%0.56731%0.311SS*.Hα-helixtrans-60.1-48.4177-71.4-20.8000110.9E113 I114 S119 H120 E121E113-D117 PolarHBondContact O-N 3.45Å; I114-D117 PolarHBondContact O-N 2.97Å; D117-S119 VanDerWaalsContact C-N 3.35Å; D117-S119 PolarHBondContact O-N 3.42Å; D117-H120 PolarHBondContact O-N 2.74Å; D117-E121 WeakPolarHBondContact O-CB 3.4Å; D117-E121 PolarHBondContact O-N 3.31Å
118Y94.5Very high93Very high40 Ų4069.3 Ų69.316%0.15732%0.32CS..Hα-helixtrans-61.6-41175.8-72.8-50000112.7E25 V28 D29 L32 L82 I114 H120 E121 F122E25-Y118 HydrophobicContact CB-CE2 4.02Å; E25-Y118 HydrophobicContact CG-CE2 4.04Å; E25-Y118 PolarHBondContact O-OH 2.84Å; V28-Y118 HydrophobicContact CG1-CD1 3.74Å; V28-Y118 HydrophobicContact CG1-CD2 4.22Å; V28-Y118 HydrophobicContact CG1-CE1 4.17Å; V28-Y118 HydrophobicContact CG1-CG 3.78Å; D29-Y118 HydrophobicContact CB-CE1 4.48Å; L32-Y118 HydrophobicContact CD1-CD1 3.64Å; L32-Y118 HydrophobicContact CD1-CE1 4.32Å; L32-Y118 HydrophobicContact CD1-CG 4.5Å; L82-Y118 HydrophobicContact CD2-CD2 4.39Å; I114-Y118 HydrophobicContact CG2-CD2 3.61Å; I114-Y118 HydrophobicContact CG2-CE2 3.21Å; I114-Y118 VanDerWaalsContact O-CD2 3.22Å; I114-Y118 WeakPolarHBondContact O-CD2 3.34Å; I114-Y118 PolarHBondContact O-N 3.42Å; Y118-H120 VanDerWaalsContact C-N 3.3Å; Y118-H120 PolarHBondContact O-N 3.25Å; Y118-E121 PolarHBondContact O-N 2.99Å; Y118-F122 WeakPolarHBondContact O-CB 3.28Å; Y118-F122 PolarHBondContact O-N 2.9Å
119S94.1Very high93Very high31 Ų3169 Ų6922%0.21732%0.319CS..Hα-helixtrans-66.3-33.4177.5-600000112.4L115 Q116 D117 R123L115-S119 WeakPolarHBondContact O-CB 3.39Å; L115-S119 PolarHBondContact O-N 3.36Å; L115-S119 PolarHBondContact O-OG 2.97Å; Q116-S119 PolarHBondContact O-N 2.99Å; D117-S119 VanDerWaalsContact C-N 3.35Å; D117-S119 PolarHBondContact O-N 3.42Å; S119-R123 PolarHBondContact O-N 3.33Å; S119-R123 PolarHBondContact O-NE 3.16Å; S119-R123 VanDerWaalsContact O-NE 3.11Å
120H94.6Very high92.9Very high119 Ų11968 Ų6855%0.55132%0.316SS*.Hα-helixtrans-74.9-44.9175.9-178.4-99000111.2Q116 D117 Y118 R123 R124Q116-H120 WeakPolarHBondContact O-CB 3.47Å; Q116-H120 PolarHBondContact O-N 2.91Å; D117-H120 PolarHBondContact O-N 2.74Å; Y118-H120 VanDerWaalsContact C-N 3.3Å; Y118-H120 PolarHBondContact O-N 3.25Å; H120-R123 PolarHBondContact O-N 3.06Å; H120-R124 WeakPolarHBondContact O-CB 3.47Å; H120-R124 PolarHBondContact O-N 2.91Å
121E93.9Very high92.6Very high50 Ų5065.9 Ų65.923%0.23432%0.318CS..Hα-helixtrans-61.3-45.6175.9-173.8178.3-177.500111.5N36 D117 Y118 R123 R124 A125N36-E121 PolarHBondContact ND2-OE1 3.29Å; D117-E121 WeakPolarHBondContact O-CB 3.4Å; D117-E121 PolarHBondContact O-N 3.31Å; Y118-E121 PolarHBondContact O-N 2.99Å; E121-R123 PolarHBondContact O-N 3.42Å; E121-R124 WeakPolarHBondContact O-CB 3.37Å; E121-R124 PolarHBondContact O-N 3.47Å; E121-A125 WeakPolarHBondContact O-CB 3.39Å; E121-A125 PolarHBondContact O-N 2.96Å
122F93.9Very high92.3Very high7 Ų767.2 Ų67.23%0.03133%0.325CS..Hα-helixtrans-56.7-50.2176.6176.1-121.5000111.5L32 L35 I75 L79 Y118 R124 A125 Q126L32-F122 HydrophobicContact CD2-CB 3.97Å; L32-F122 HydrophobicContact CD2-CD2 4.08Å; L35-F122 HydrophobicContact CD2-CD2 3.9Å; L35-F122 HydrophobicContact CD2-CE2 4.01Å; I75-F122 HydrophobicContact CB-CD2 4.08Å; I75-F122 HydrophobicContact CB-CE2 3.9Å; I75-F122 HydrophobicContact CB-CZ 4.42Å; I75-F122 HydrophobicContact CD1-CD2 4.07Å; I75-F122 HydrophobicContact CD1-CE2 4.03Å; I75-F122 HydrophobicContact CG2-CB 4.37Å; I75-F122 HydrophobicContact CG2-CD1 4.4Å; I75-F122 HydrophobicContact CG2-CD2 3.5Å; I75-F122 HydrophobicContact CG2-CE2 3.82Å; I75-F122 HydrophobicContact CG2-CG 3.83Å; I75-F122 HydrophobicContact CG2-CZ 4.38Å; L79-F122 HydrophobicContact CD1-CB 4.31Å; L79-F122 HydrophobicContact CD1-CD1 4.09Å; L79-F122 HydrophobicContact CD1-CG 4.34Å; Y118-F122 WeakPolarHBondContact O-CB 3.28Å; Y118-F122 PolarHBondContact O-N 2.9Å; F122-R124 VanDerWaalsContact C-N 3.32Å; F122-R124 PolarHBondContact O-N 3.13Å; F122-A125 PolarHBondContact O-N 3.42Å; F122-Q126 VanDerWaalsContact O-CB 3.24Å; F122-Q126 WeakPolarHBondContact O-CB 3.32Å; F122-Q126 PolarHBondContact O-N 3.24Å
123R93.8Very high91.9Very high162 Ų16263.1 Ų63.161%0.61131%0.31SS*.Hα-helixtrans-60.5-40.7176.8-82.3-178-74.8-161.6-1.2112.6S119 H120 E121 Q126 G127S119-R123 PolarHBondContact O-N 3.33Å; S119-R123 PolarHBondContact O-NE 3.16Å; S119-R123 VanDerWaalsContact O-NE 3.11Å; H120-R123 PolarHBondContact O-N 3.06Å; E121-R123 PolarHBondContact O-N 3.42Å; R123-Q126 PolarHBondContact O-N 2.81Å; R123-G127 PolarHBondContact O-N 3.2Å
124R92.6Very high91.4Very high153 Ų15364.3 Ų64.358%0.57732%0.315SS*.Hα-helixtrans-63.1-46.8176.3-172.8-174.570.6-169.6-1.7111.3H120 E121 F122 G127 N128H120-R124 WeakPolarHBondContact O-CB 3.47Å; H120-R124 PolarHBondContact O-N 2.91Å; E121-R124 WeakPolarHBondContact O-CB 3.37Å; E121-R124 PolarHBondContact O-N 3.47Å; F122-R124 VanDerWaalsContact C-N 3.32Å; F122-R124 PolarHBondContact O-N 3.13Å; R124-G127 PolarHBondContact O-N 3.43Å; R124-N128 WeakPolarHBondContact O-CB 3.23Å; R124-N128 PolarHBondContact O-N 3.12Å
125A90.9Very high90.9Very high2 Ų269.9 Ų69.92%0.01734%0.335CS..Hα-helixtrans-63.7-43.717800000111.2L35 N36 E121 F122 N128 I129L35-A125 HydrophobicContact CD2-CB 3.81Å; L35-A125 HydrophobicContact CG-CB 4.45Å; N36-A125 WeakPolarHBondContact OD1-CB 3.22Å; E121-A125 WeakPolarHBondContact O-CB 3.39Å; E121-A125 PolarHBondContact O-N 2.96Å; F122-A125 PolarHBondContact O-N 3.42Å; A125-N128 PolarHBondContact O-N 3.44Å; A125-I129 VanDerWaalsContact O-CG1 3.31Å; A125-I129 WeakPolarHBondContact O-CG1 3.24Å; A125-I129 PolarHBondContact O-N 2.97Å
126Q92.3Very high90.2Very high70 Ų7070.5 Ų70.533%0.32734%0.337SS..Hα-helixtrans-60.4-46.9176.4-166.2-171.72.100111.5F68 F122 R123 I129 N130F68-Q126 HydrophobicContact CE1-CG 4.49Å; F68-Q126 HydrophobicContact CE2-CG 4.22Å; F68-Q126 HydrophobicContact CZ-CB 4.27Å; F68-Q126 HydrophobicContact CZ-CG 3.56Å; F122-Q126 VanDerWaalsContact O-CB 3.24Å; F122-Q126 WeakPolarHBondContact O-CB 3.32Å; F122-Q126 PolarHBondContact O-N 3.24Å; R123-Q126 PolarHBondContact O-N 2.81Å; Q126-I129 PolarHBondContact O-N 3.44Å; Q126-N130 WeakPolarHBondContact O-CB 3.42Å; Q126-N130 PolarHBondContact O-N 3.44Å; Q126-N130 PolarHBondContact O-ND2 3.29Å
127G90.3Very high89.5Confident37 Ų3766.4 Ų66.438%0.38132%0.319SS..Hα-helixtrans-61.6-46175.900000112.3R123 R124 I129 N130 V131R123-G127 PolarHBondContact O-N 3.2Å; R124-G127 PolarHBondContact O-N 3.43Å; G127-I129 PolarHBondContact O-N 2.88Å; G127-N130 PolarHBondContact O-N 2.94Å; G127-V131 WeakPolarHBondContact O-CG2 3.45Å; G127-V131 PolarHBondContact O-N 2.86Å
128N90.4Very high88.6Confident87 Ų8766.8 Ų66.847%0.46532%0.321SS..Hα-helixtrans-60.7-45.9177.9-176.449.7000112.2R124 A125 V131 L132R124-N128 WeakPolarHBondContact O-CB 3.23Å; R124-N128 PolarHBondContact O-N 3.12Å; A125-N128 PolarHBondContact O-N 3.44Å; N128-V131 PolarHBondContact O-N 3.36Å; N128-L132 VanDerWaalsContact O-CG 3.31Å; N128-L132 WeakPolarHBondContact O-CG 3.36Å; N128-L132 PolarHBondContact O-N 3.08Å
129I88.7Confident87.6Confident1 Ų167 Ų671%0.00532%0.323CS..Hα-helixtrans-68.7-36.8179.9-65.9166000111.4L35 F68 A125 Q126 G127 L132 L133L35-I129 HydrophobicContact CD1-CD1 3.65Å; L35-I129 HydrophobicContact CD2-CD1 4.44Å; L35-I129 HydrophobicContact CG-CD1 3.58Å; L35-I129 VanDerWaalsContact O-CD1 3.25Å; L35-I129 WeakPolarHBondContact O-CD1 3.4Å; F68-I129 HydrophobicContact CB-CG2 4.34Å; F68-I129 HydrophobicContact CD1-CG2 4.3Å; F68-I129 HydrophobicContact CD2-CB 3.89Å; F68-I129 HydrophobicContact CD2-CD1 3.77Å; F68-I129 HydrophobicContact CD2-CG1 4.43Å; F68-I129 HydrophobicContact CD2-CG2 3.36Å; F68-I129 HydrophobicContact CE1-CG2 4.43Å; F68-I129 HydrophobicContact CE2-CB 3.57Å; F68-I129 HydrophobicContact CE2-CD1 3.75Å; F68-I129 HydrophobicContact CE2-CG1 4.26Å; F68-I129 HydrophobicContact CE2-CG2 3.55Å; F68-I129 HydrophobicContact CG-CG2 3.75Å; F68-I129 HydrophobicContact CZ-CB 4.1Å; F68-I129 HydrophobicContact CZ-CG2 4.06Å; A125-I129 VanDerWaalsContact O-CG1 3.31Å; A125-I129 WeakPolarHBondContact O-CG1 3.24Å; A125-I129 PolarHBondContact O-N 2.97Å; Q126-I129 PolarHBondContact O-N 3.44Å; G127-I129 PolarHBondContact O-N 2.88Å; I129-L132 PolarHBondContact O-N 3.38Å; I129-L133 HydrophobicContact CG2-CD1 3.83Å; I129-L133 HydrophobicContact CG2-CG 4.12Å; I129-L133 WeakPolarHBondContact O-CB 3.5Å; I129-L133 WeakPolarHBondContact O-CG 3.35Å; I129-L133 PolarHBondContact O-N 2.68Å
130N89.3Confident86.4Confident62 Ų6265.9 Ų65.933%0.33232%0.316SS..Hα-helixtrans-61.1-44.9174.1-85.1-65.9000111.8Q126 G127 L132 L133 E134Q126-N130 WeakPolarHBondContact O-CB 3.42Å; Q126-N130 PolarHBondContact O-N 3.44Å; Q126-N130 PolarHBondContact O-ND2 3.29Å; G127-N130 PolarHBondContact O-N 2.94Å; N130-L132 VanDerWaalsContact C-N 3.3Å; N130-L132 PolarHBondContact O-N 3.35Å; N130-L133 PolarHBondContact O-N 2.85Å; N130-E134 VanDerWaalsContact O-CB 3.31Å; N130-E134 WeakPolarHBondContact O-CB 3.27Å; N130-E134 PolarHBondContact O-N 3.27Å
131V87.7Confident85.1Confident93 Ų9364 Ų6456%0.56432%0.316SS*.Hα-helixtrans-61.4-41175.9172.10000111.1G127 N128 R135G127-V131 WeakPolarHBondContact O-CG2 3.45Å; G127-V131 PolarHBondContact O-N 2.86Å; N128-V131 PolarHBondContact O-N 3.36Å; V131-R135 VanDerWaalsContact O-CB 3.24Å; V131-R135 WeakPolarHBondContact O-CB 3.41Å; V131-R135 PolarHBondContact O-N 3.35Å
132L85.8Confident83.7Confident33 Ų3364.1 Ų64.117%0.17332%0.323CS..Hα-helixtrans-66.9-43.9176.7-70.1171.2000112.4G39 L42 N128 I129 N130 R135 E136G39-L132 VanDerWaalsContact O-CD1 3.27Å; G39-L132 WeakPolarHBondContact O-CD1 3.32Å; L42-L132 HydrophobicContact CB-CB 4.16Å; L42-L132 HydrophobicContact CB-CD1 4.3Å; L42-L132 HydrophobicContact CD2-CB 4.22Å; N128-L132 VanDerWaalsContact O-CG 3.31Å; N128-L132 WeakPolarHBondContact O-CG 3.36Å; N128-L132 PolarHBondContact O-N 3.08Å; I129-L132 PolarHBondContact O-N 3.38Å; N130-L132 VanDerWaalsContact C-N 3.3Å; N130-L132 PolarHBondContact O-N 3.35Å; L132-R135 PolarHBondContact O-N 3.16Å; L132-E136 WeakPolarHBondContact O-CB 3.45Å; L132-E136 PolarHBondContact O-N 3.23Å
133L85.1Confident82.2Confident0 Ų067.9 Ų67.90%034%0.343CS..Hα-helixtrans-63.5-45.7176.6-81.7170.6000111.3L42 V61 R65 F68 I129 N130 E136 L137L42-L133 HydrophobicContact CD2-CD2 3.6Å; L42-L133 HydrophobicContact CD2-CG 3.68Å; V61-L133 HydrophobicContact CG1-CD2 4.1Å; R65-L133 HydrophobicContact CB-CD1 4.3Å; R65-L133 HydrophobicContact CB-CD2 4.16Å; F68-L133 HydrophobicContact CB-CD1 4.4Å; F68-L133 HydrophobicContact CD1-CD1 3.87Å; F68-L133 HydrophobicContact CE1-CD1 4.39Å; F68-L133 HydrophobicContact CG-CD1 4.23Å; I129-L133 HydrophobicContact CG2-CD1 3.83Å; I129-L133 HydrophobicContact CG2-CG 4.12Å; I129-L133 WeakPolarHBondContact O-CB 3.5Å; I129-L133 WeakPolarHBondContact O-CG 3.35Å; I129-L133 PolarHBondContact O-N 2.68Å; N130-L133 PolarHBondContact O-N 2.85Å; L133-E136 PolarHBondContact O-N 3.16Å; L133-L137 WeakPolarHBondContact O-CB 3.4Å; L133-L137 WeakPolarHBondContact O-CD1 3.31Å; L133-L137 WeakPolarHBondContact O-CG 3.34Å; L133-L137 PolarHBondContact O-N 3.38Å
134E84.5Confident80.5Confident113 Ų11362.7 Ų62.753%0.52834%0.335SS..Hα-helixtrans-62.1-46178.1-175.2175.8-175.800111.1N130 E136 L137 L138N130-E134 VanDerWaalsContact O-CB 3.31Å; N130-E134 WeakPolarHBondContact O-CB 3.27Å; N130-E134 PolarHBondContact O-N 3.27Å; E134-E136 VanDerWaalsContact C-N 3.32Å; E134-E136 PolarHBondContact O-N 2.84Å; E134-L137 PolarHBondContact O-N 2.81Å; E134-L138 HydrophobicContact CG-CD1 4.27Å; E134-L138 VanDerWaalsContact O-CG 3.31Å; E134-L138 WeakPolarHBondContact O-CG 3.45Å; E134-L138 PolarHBondContact O-N 3.12Å
135R82.2Confident78.6Confident145 Ų14556.5 Ų56.555%0.54732%0.319SS..Hα-helixtrans-56.7-47.2173.4178-179.3168.5156.30111.4V131 L132 L138 M139V131-R135 VanDerWaalsContact O-CB 3.24Å; V131-R135 WeakPolarHBondContact O-CB 3.41Å; V131-R135 PolarHBondContact O-N 3.35Å; L132-R135 PolarHBondContact O-N 3.16Å; R135-L138 PolarHBondContact O-N 3.06Å; R135-M139 HydrophobicContact CG-SD 4.08Å; R135-M139 WeakPolarHBondContact O-CB 3.48Å; R135-M139 VanDerWaalsContact O-CG 3.24Å; R135-M139 WeakPolarHBondContact O-CG 3.39Å; R135-M139 PolarHBondContact O-N 3.48Å
136E80Confident76.8Confident36 Ų3661.3 Ų61.317%0.16834%0.343CS..Hα-helixtrans-66.9-37.3-178.8-166.361.1-153.800111.8F56 V61 L132 L133 E134 M139 A140F56-E136 HydrophobicContact CD1-CG 4.19Å; F56-E136 HydrophobicContact CE1-CG 4.29Å; V61-E136 HydrophobicContact CG1-CB 4.36Å; V61-E136 HydrophobicContact CG1-CG 4.24Å; V61-E136 HydrophobicContact CG2-CB 4.45Å; V61-E136 HydrophobicContact CG2-CG 3.49Å; V61-E136 VanDerWaalsContact CG2-CG 3.49Å; L132-E136 WeakPolarHBondContact O-CB 3.45Å; L132-E136 PolarHBondContact O-N 3.23Å; L133-E136 PolarHBondContact O-N 3.16Å; E134-E136 VanDerWaalsContact C-N 3.32Å; E134-E136 PolarHBondContact O-N 2.84Å; E136-M139 PolarHBondContact O-N 3.43Å; E136-A140 VanDerWaalsContact O-CB 3.23Å; E136-A140 WeakPolarHBondContact O-CB 3.42Å; E136-A140 PolarHBondContact O-N 3.41Å
137L78.9Confident74.7Confident48 Ų4863.2 Ų63.225%0.25136%0.363SS..Hα-helixtrans-65.3-43.7175.2-71.7161.2000112.5V61 L133 E134 M139 A140 S141V61-L137 HydrophobicContact CG1-CD2 3.7Å; V61-L137 HydrophobicContact CG1-CG 3.85Å; L133-L137 WeakPolarHBondContact O-CB 3.4Å; L133-L137 WeakPolarHBondContact O-CD1 3.31Å; L133-L137 WeakPolarHBondContact O-CG 3.34Å; L133-L137 PolarHBondContact O-N 3.38Å; E134-L137 PolarHBondContact O-N 2.81Å; L137-M139 VanDerWaalsContact C-N 3.31Å; L137-M139 PolarHBondContact O-N 3.36Å; L137-A140 PolarHBondContact O-N 2.59Å; L137-S141 VanDerWaalsContact O-CB 3.23Å; L137-S141 WeakPolarHBondContact O-CB 3.35Å; L137-S141 PolarHBondContact O-N 3.27Å
138L78.2Confident72.6Confident114 Ų11469.2 Ų69.260%0.59738%0.381SS*.Hα-helixtrans-62.5-41.1176-69.8173.2000110.9E134 R135 S141 S142E134-L138 HydrophobicContact CG-CD1 4.27Å; E134-L138 VanDerWaalsContact O-CG 3.31Å; E134-L138 WeakPolarHBondContact O-CG 3.45Å; E134-L138 PolarHBondContact O-N 3.12Å; R135-L138 PolarHBondContact O-N 3.06Å; L138-S141 PolarHBondContact O-N 2.93Å; L138-S142 PolarHBondContact O-N 3.49Å; L138-S142 PolarHBondContact O-OG 3.36Å
139M71.8Confident70.5Confident43 Ų4370.8 Ų70.821%0.21239%0.388CS..Hα-helixtrans-70.8-40.1177.7-69.6-174.467.900112.9R46 R135 E136 L137 S141 S142 N143R46-M139 VanDerWaalsContact CZ-CE 3.46Å; R46-M139 VanDerWaalsContact NH2-CE 3.26Å; R135-M139 HydrophobicContact CG-SD 4.08Å; R135-M139 WeakPolarHBondContact O-CB 3.48Å; R135-M139 VanDerWaalsContact O-CG 3.24Å; R135-M139 WeakPolarHBondContact O-CG 3.39Å; R135-M139 PolarHBondContact O-N 3.48Å; E136-M139 PolarHBondContact O-N 3.43Å; L137-M139 VanDerWaalsContact C-N 3.31Å; L137-M139 PolarHBondContact O-N 3.36Å; M139-S141 VanDerWaalsContact C-N 3.32Å; M139-S142 WeakPolarHBondContact CA-OG 3.44Å; M139-S142 PolarHBondContact O-N 3.18Å; M139-S142 PolarHBondContact O-OG 3.11Å; M139-N143 WeakPolarHBondContact O-CB 3.44Å; M139-N143 PolarHBondContact O-N 2.91Å; M139-N143 PolarHBondContact O-OD1 3.3Å
140A69.7Low68.4Low9 Ų977.6 Ų77.67%0.07443%0.425CS..Hα-helixtrans-64-40.1174.100000111L58 E136 L137 N143 A144L58-A140 HydrophobicContact CD2-CB 3.7Å; L58-A140 HydrophobicContact CG-CB 4.12Å; E136-A140 VanDerWaalsContact O-CB 3.23Å; E136-A140 WeakPolarHBondContact O-CB 3.42Å; E136-A140 PolarHBondContact O-N 3.41Å; L137-A140 PolarHBondContact O-N 2.59Å; A140-N143 PolarHBondContact O-N 3.04Å; A140-A144 WeakPolarHBondContact O-CB 3.36Å; A140-A144 PolarHBondContact O-N 3.48Å
141S66.4Low66.3Low78 Ų7882.2 Ų82.255%0.54545%0.448SS..Hα-helixtrans-63.9-44.4173.6-176.80000112L137 L138 M139 N143 A144 G145L137-S141 VanDerWaalsContact O-CB 3.23Å; L137-S141 WeakPolarHBondContact O-CB 3.35Å; L137-S141 PolarHBondContact O-N 3.27Å; L138-S141 PolarHBondContact O-N 2.93Å; M139-S141 VanDerWaalsContact C-N 3.32Å; S141-N143 VanDerWaalsContact C-N 3.33Å; S141-N143 PolarHBondContact O-N 2.74Å; S141-A144 PolarHBondContact O-N 2.96Å; S141-G145 PolarHBondContact O-N 2.95Å
142S66.3Low64.1Low53 Ų5381 Ų8137%0.37145%0.454SS..Hα-helixtrans-63.8-38.3176.162.70000112.2L138 M139 G145 I146L138-S142 PolarHBondContact O-N 3.49Å; L138-S142 PolarHBondContact O-OG 3.36Å; M139-S142 WeakPolarHBondContact CA-OG 3.44Å; M139-S142 PolarHBondContact O-N 3.18Å; M139-S142 PolarHBondContact O-OG 3.11Å; S142-G145 PolarHBondContact O-N 3.24Å; S142-I146 WeakPolarHBondContact O-CB 3.26Å; S142-I146 VanDerWaalsContact O-CD1 3.26Å; S142-I146 WeakPolarHBondContact O-CD1 3.48Å; S142-I146 WeakPolarHBondContact O-CG1 3.47Å; S142-I146 PolarHBondContact O-N 3.05Å
143N61.8Low62.2Low87 Ų8784.2 Ų84.247%0.46548%0.479SS..Hα-helixtrans-71.2-40.5178.5-69-7.4000111.8M139 A140 S141 G145 I146 C147M139-N143 WeakPolarHBondContact O-CB 3.44Å; M139-N143 PolarHBondContact O-N 2.91Å; M139-N143 PolarHBondContact O-OD1 3.3Å; A140-N143 PolarHBondContact O-N 3.04Å; S141-N143 VanDerWaalsContact C-N 3.33Å; S141-N143 PolarHBondContact O-N 2.74Å; N143-G145 VanDerWaalsContact C-N 3.31Å; N143-G145 PolarHBondContact O-N 3.03Å; N143-I146 PolarHBondContact O-N 3.47Å; N143-C147 PolarHBondContact O-N 3.29Å; N143-C147 PolarHBondContact O-SG 3.15Å; N143-C147 VanDerWaalsContact O-SG 3.35Å
144A58.1Low60.4Low52 Ų5292.5 Ų92.543%0.4352%0.524SS..Hα-helixtrans-62.2-41.3173.300000111.4A140 S141 Q148A140-A144 WeakPolarHBondContact O-CB 3.36Å; A140-A144 PolarHBondContact O-N 3.48Å; S141-A144 PolarHBondContact O-N 2.96Å; A144-Q148 PolarHBondContact O-N 3.05Å
145G53.7Low59Low24 Ų2489.1 Ų89.125%0.24752%0.519CS..Hα-helixtrans-61.6-50171.900000112S141 S142 N143 C147 Q148 I149S141-G145 PolarHBondContact O-N 2.95Å; S142-G145 PolarHBondContact O-N 3.24Å; N143-G145 VanDerWaalsContact C-N 3.31Å; N143-G145 PolarHBondContact O-N 3.03Å; G145-C147 VanDerWaalsContact C-N 3.32Å; G145-C147 PolarHBondContact O-N 3.37Å; G145-Q148 CarbonylContact O-C 3.57Å; G145-Q148 WeakPolarHBondContact O-CA 3.47Å; G145-Q148 PolarHBondContact O-N 3.46Å; G145-I149 VanDerWaalsContact C-CD1 3.47Å; G145-I149 WeakPolarHBondContact O-CB 3.44Å; G145-I149 VanDerWaalsContact O-CD1 3.26Å; G145-I149 WeakPolarHBondContact O-CD1 3.31Å; G145-I149 WeakPolarHBondContact O-CG1 3.34Å; G145-I149 PolarHBondContact O-N 3.49Å
146I51.2Low57.7Low103 Ų10388.8 Ų88.853%0.52853%0.528SS..Hα-helixtrans-61.7-38.8-178.5-72.7157.5000111.9S142 N143 Q148 I149S142-I146 WeakPolarHBondContact O-CB 3.26Å; S142-I146 VanDerWaalsContact O-CD1 3.26Å; S142-I146 WeakPolarHBondContact O-CD1 3.48Å; S142-I146 WeakPolarHBondContact O-CG1 3.47Å; S142-I146 PolarHBondContact O-N 3.05Å; N143-I146 PolarHBondContact O-N 3.47Å; I146-Q148 PolarHBondContact O-N 2.93Å; I146-I149 PolarHBondContact O-N 3.4Å; I146-I149 VanDerWaalsContact O-N 3.16Å
147C48.6Very low56.7Low110 Ų11093 Ų9374%0.74355%0.551SS**Hα-helixtrans-65.1-25.1173.4-69.40000113N143 G145N143-C147 PolarHBondContact O-N 3.29Å; N143-C147 PolarHBondContact O-SG 3.15Å; N143-C147 VanDerWaalsContact O-SG 3.35Å; G145-C147 VanDerWaalsContact C-N 3.32Å; G145-C147 PolarHBondContact O-N 3.37Å
148Q46.8Very low55.9Low163 Ų16396.8 Ų96.876%0.76257%0.572SS**Hα-helixtrans-93.4-16.4173-157.2170.743.800113.4A144 G145 I146 N150A144-Q148 PolarHBondContact O-N 3.05Å; G145-Q148 CarbonylContact O-C 3.57Å; G145-Q148 WeakPolarHBondContact O-CA 3.47Å; G145-Q148 PolarHBondContact O-N 3.46Å; I146-Q148 PolarHBondContact O-N 2.93Å; Q148-N150 VanDerWaalsContact C-N 3.3Å; Q148-N150 PolarHBondContact O-N 3.22Å
149I46.2Very low55.1Low119 Ų119100.6 Ų100.661%0.6158%0.578SS**  trans-86.75.2-178.5-67.3158.7000112.2G145 I146 I151G145-I149 VanDerWaalsContact C-CD1 3.47Å; G145-I149 WeakPolarHBondContact O-CB 3.44Å; G145-I149 VanDerWaalsContact O-CD1 3.26Å; G145-I149 WeakPolarHBondContact O-CD1 3.31Å; G145-I149 WeakPolarHBondContact O-CG1 3.34Å; G145-I149 PolarHBondContact O-N 3.49Å; I146-I149 PolarHBondContact O-N 3.4Å; I146-I149 VanDerWaalsContact O-N 3.16Å; I149-I151 PolarHBondContact O-N 3.43Å; I149-I151 VanDerWaalsContact O-N 3.12Å
150N43.7Very low54.8Low144 Ų144106.9 Ų106.977%0.7760%0.6SS**SBendtrans-81.172.2148.2-80.2-22.8000108.3Q148Q148-N150 VanDerWaalsContact C-N 3.3Å; Q148-N150 PolarHBondContact O-N 3.22Å
151I44.9Very low55Low159 Ų159109 Ų10982%0.81561%0.613SS**SBendtrans174.194149.6-77.7140.6000107.5I149I149-I151 PolarHBondContact O-N 3.43Å; I149-I151 VanDerWaalsContact O-N 3.12Å
152G43.2Very low55.3Low67 Ų67110.3 Ų110.369%0.69162%0.615SS**SBendtrans79.1124.5147.700000120.2
153S45.7Very low55.7Low102 Ų102113.3 Ų113.371%0.71363%0.626SS**  trans90.668.6164.582.10000118
154D46.2Very low56.5Low173 Ų173114.9 Ų114.993%0.92563%0.629SS**  trans-28.8132.2139.2-16112.3000114.2
155G54.8Low57.7Low42 Ų42118.2 Ų118.243%0.43364%0.638SS.*SBendtrans115.6-42.8158.900000119.4
156L55.9Low59.1Low139 Ų139123.8 Ų123.873%0.72866%0.656SS**Hα-helixtrans-88-39.2-169-73.9172.2000114.4N158 R159L156-N158 VanDerWaalsContact C-N 3.34Å; L156-N158 PolarHBondContact O-N 3.33Å; L156-R159 PolarHBondContact O-N 3.34Å
157N59.3Low60.6Low125 Ų125124 Ų12467%0.66866%0.655SS**Hα-helixtrans-68.7-34.4-178.3-70.4-42.6000112.2R159 R160 S161N157-R159 VanDerWaalsContact C-N 3.32Å; N157-R159 PolarHBondContact O-N 3.21Å; N157-R160 PolarHBondContact O-N 3.46Å; N157-S161 PolarHBondContact O-N 3.3Å; N157-S161 PolarHBondContact O-OG 2.81Å
158N61.2Low62.4Low126 Ų126124.1 Ų124.167%0.67464%0.644SS**Hα-helixtrans-67.3-31.3-178.1-152.535000112.8L156 S161 D162L156-N158 VanDerWaalsContact C-N 3.34Å; L156-N158 PolarHBondContact O-N 3.33Å; N158-S161 WeakPolarHBondContact CA-OG 3.27Å; N158-S161 PolarHBondContact O-OG 3.42Å; N158-D162 VanDerWaalsContact O-CB 3.29Å; N158-D162 WeakPolarHBondContact O-CB 3.48Å; N158-D162 PolarHBondContact O-N 2.85Å
159R62.2Low64.3Low194 Ų194122 Ų12273%0.73263%0.634SS**Hα-helixtrans-67.5-37.9175.6-85.7-173179.3171.61.8112.7L156 N157 L163L156-R159 PolarHBondContact O-N 3.34Å; N157-R159 VanDerWaalsContact C-N 3.32Å; N157-R159 PolarHBondContact O-N 3.21Å; R159-L163 WeakPolarHBondContact O-CB 3.44Å; R159-L163 PolarHBondContact O-N 3.01Å
160R64Low66.3Low176 Ų176122.9 Ų122.966%0.66464%0.636SS**Hα-helixtrans-70.9-42.4-179.9178.9176.4-90.8174.2-5.3110.7N157 L163 F164N157-R160 PolarHBondContact O-N 3.46Å; R160-L163 PolarHBondContact O-N 3.02Å; R160-F164 HydrophobicContact CG-CD2 3.86Å; R160-F164 HydrophobicContact CG-CE2 3.45Å; R160-F164 VanDerWaalsContact CG-CE2 3.45Å; R160-F164 HydrophobicContact CG-CZ 4.5Å; R160-F164 WeakPolarHBondContact O-CD2 3.24Å; R160-F164 PolarHBondContact O-N 3Å
161S75.1Confident68.6Low52 Ų52120.8 Ų120.836%0.36462%0.623SS.*Hα-helixtrans-63.1-41.5174.445.90000112.4N157 N158 L163 F164 L165N157-S161 PolarHBondContact O-N 3.3Å; N157-S161 PolarHBondContact O-OG 2.81Å; N158-S161 WeakPolarHBondContact CA-OG 3.27Å; N158-S161 PolarHBondContact O-OG 3.42Å; S161-L163 VanDerWaalsContact C-N 3.33Å; S161-L163 PolarHBondContact O-N 3.37Å; S161-F164 PolarHBondContact O-N 3.36Å; S161-L165 WeakPolarHBondContact O-CB 3.19Å; S161-L165 PolarHBondContact O-N 3.47Å
162D71.6Confident70.9Confident107 Ų107119.3 Ų119.357%0.57261%0.611SS**Hα-helixtrans-61.8-39.9175.7-172.773.6000112.1N158 L165 K166N158-D162 VanDerWaalsContact O-CB 3.29Å; N158-D162 WeakPolarHBondContact O-CB 3.48Å; N158-D162 PolarHBondContact O-N 2.85Å; D162-L165 PolarHBondContact O-N 3.17Å; D162-K166 WeakPolarHBondContact O-CB 3.45Å; D162-K166 PolarHBondContact O-N 3.1Å
163L75.1Confident73.2Confident115 Ų115119.2 Ų119.260%0.60260%0.6SS**Hα-helixtrans-62.2-45.6176.7-170.572000112.2R159 R160 S161 K166 E167R159-L163 WeakPolarHBondContact O-CB 3.44Å; R159-L163 PolarHBondContact O-N 3.01Å; R160-L163 PolarHBondContact O-N 3.02Å; S161-L163 VanDerWaalsContact C-N 3.33Å; S161-L163 PolarHBondContact O-N 3.37Å; L163-K166 PolarHBondContact O-N 2.84Å; L163-E167 PolarHBondContact O-N 2.7Å
164F80Confident75.4Confident120 Ų120117.1 Ų117.153%0.52659%0.585SS.*Hα-helixtrans-67.7-38.4178-74.6-61000112.6R160 S161 K166 E167 H168R160-F164 HydrophobicContact CG-CD2 3.86Å; R160-F164 HydrophobicContact CG-CE2 3.45Å; R160-F164 VanDerWaalsContact CG-CE2 3.45Å; R160-F164 HydrophobicContact CG-CZ 4.5Å; R160-F164 WeakPolarHBondContact O-CD2 3.24Å; R160-F164 PolarHBondContact O-N 3Å; S161-F164 PolarHBondContact O-N 3.36Å; F164-K166 VanDerWaalsContact C-N 3.34Å; F164-E167 PolarHBondContact O-N 3.16Å; F164-H168 WeakPolarHBondContact O-CB 3.29Å; F164-H168 PolarHBondContact O-N 2.98Å
165L83.3Confident77.7Confident122 Ų122113.4 Ų113.464%0.63957%0.565SS**Hα-helixtrans-62.2-43.4174-103.2145.7000111.4S161 D162 H168 E169S161-L165 WeakPolarHBondContact O-CB 3.19Å; S161-L165 PolarHBondContact O-N 3.47Å; D162-L165 PolarHBondContact O-N 3.17Å; L165-H168 PolarHBondContact O-N 3.31Å; L165-E169 PolarHBondContact O-N 3.42Å
166K83Confident79.5Confident141 Ų141118.1 Ų118.161%0.61357%0.574SS**Hα-helixtrans-64.2-41.2175.8-174.9174.5179.3174.20112D162 L163 F164 E169 H170D162-K166 WeakPolarHBondContact O-CB 3.45Å; D162-K166 PolarHBondContact O-N 3.1Å; L163-K166 PolarHBondContact O-N 2.84Å; F164-K166 VanDerWaalsContact C-N 3.34Å; K166-E169 PolarHBondContact O-N 3.44Å; K166-H170 WeakPolarHBondContact O-CB 3.25Å; K166-H170 PolarHBondContact O-N 2.98Å
167E81.8Confident81.3Confident107 Ų107116.3 Ų116.350%0.556%0.564SS.*Hα-helixtrans-61.8-44.9174.2-174.9-176.4-170.900111.1L163 F164 E169 H170 I171L163-E167 PolarHBondContact O-N 2.7Å; F164-E167 PolarHBondContact O-N 3.16Å; E167-E169 PolarHBondContact O-N 3.14Å; E167-H170 CarbonylContact O-C 3.38Å; E167-H170 WeakPolarHBondContact O-CA 3.48Å; E167-H170 WeakPolarHBondContact O-CB 3.48Å; E167-H170 PolarHBondContact O-N 3.36Å; E167-H170 VanDerWaalsContact O-N 3.12Å; E167-I171 HydrophobicContact CG-CD1 4.05Å; E167-I171 WeakPolarHBondContact O-CG1 3.39Å; E167-I171 PolarHBondContact O-N 3.35Å
168H87.5Confident82.9Confident113 Ų113114.4 Ų114.452%0.52355%0.553SS.*Hα-helixtrans-60.9-44.5177.1-175.694.5000112.2F164 L165 H170 I171 K172F164-H168 WeakPolarHBondContact O-CB 3.29Å; F164-H168 PolarHBondContact O-N 2.98Å; L165-H168 PolarHBondContact O-N 3.31Å; H168-H170 VanDerWaalsContact C-N 3.26Å; H168-H170 PolarHBondContact O-N 3.26Å; H168-I171 PolarHBondContact O-N 2.94Å; H168-K172 WeakPolarHBondContact O-CB 3.25Å; H168-K172 PolarHBondContact O-N 3.04Å
169E86.2Confident84.5Confident118 Ų118113.1 Ų113.155%0.55155%0.547SS*.Hα-helixtrans-61.5-38.3174.9-170.762.9-153.100111.1L165 K166 E167 K172 S173L165-E169 PolarHBondContact O-N 3.42Å; K166-E169 PolarHBondContact O-N 3.44Å; E167-E169 PolarHBondContact O-N 3.14Å; E169-K172 PolarHBondContact O-N 3.28Å; E169-S173 VanDerWaalsContact O-CB 3.3Å; E169-S173 WeakPolarHBondContact O-CB 3.44Å; E169-S173 PolarHBondContact O-N 2.93Å
170H87Confident86.1Confident139 Ų139108.6 Ų108.664%0.64454%0.537SS*.Hα-helixtrans-67.4-39.6176.3-141.2-83.3000112.3K166 E167 H168 S174K166-H170 WeakPolarHBondContact O-CB 3.25Å; K166-H170 PolarHBondContact O-N 2.98Å; E167-H170 CarbonylContact O-C 3.38Å; E167-H170 WeakPolarHBondContact O-CA 3.48Å; E167-H170 WeakPolarHBondContact O-CB 3.48Å; E167-H170 PolarHBondContact O-N 3.36Å; E167-H170 VanDerWaalsContact O-N 3.12Å; H168-H170 VanDerWaalsContact C-N 3.26Å; H168-H170 PolarHBondContact O-N 3.26Å; H170-S174 WeakPolarHBondContact O-CB 3.45Å; H170-S174 PolarHBondContact O-N 3.48Å
171I91.8Very high87.5Confident99 Ų99106.3 Ų106.351%0.50853%0.534SS..Hα-helixtrans-64-47174.2-70167.9000109.8E167 H168 S173 S174 D175E167-I171 HydrophobicContact CG-CD1 4.05Å; E167-I171 WeakPolarHBondContact O-CG1 3.39Å; E167-I171 PolarHBondContact O-N 3.35Å; H168-I171 PolarHBondContact O-N 2.94Å; I171-S173 VanDerWaalsContact C-N 3.34Å; I171-S173 PolarHBondContact O-N 3.26Å; I171-S174 CarbonylContact O-C 3.57Å; I171-S174 WeakPolarHBondContact O-CA 3.45Å; I171-S174 WeakPolarHBondContact O-CB 3.43Å; I171-S174 PolarHBondContact O-N 2.76Å; I171-S174 VanDerWaalsContact O-N 3.12Å; I171-D175 WeakPolarHBondContact O-CB 3.45Å; I171-D175 PolarHBondContact O-N 3.01Å
172K93.4Very high88.3Confident128 Ų128108.3 Ų108.356%0.55754%0.539SS*.Hα-helixtrans-64.3-39179-171.8178.9-178.9-179.20112.4H168 E169 D175 K176H168-K172 WeakPolarHBondContact O-CB 3.25Å; H168-K172 PolarHBondContact O-N 3.04Å; E169-K172 PolarHBondContact O-N 3.28Å; K172-D175 PolarHBondContact O-N 3.07Å; K172-K176 PolarHBondContact O-N 2.89Å; K172-K176 VanDerWaalsContact O-N 3.13Å
173S91.8Very high89.4Confident65 Ų65105 Ų10546%0.45553%0.531SS..Hα-helixtrans-63.7-42.7171.9-175.90000111.1E169 I171 K176 L177E169-S173 VanDerWaalsContact O-CB 3.3Å; E169-S173 WeakPolarHBondContact O-CB 3.44Å; E169-S173 PolarHBondContact O-N 2.93Å; I171-S173 VanDerWaalsContact C-N 3.34Å; I171-S173 PolarHBondContact O-N 3.26Å; S173-K176 PolarHBondContact O-N 3.31Å; S173-L177 WeakPolarHBondContact O-CG 3.36Å; S173-L177 PolarHBondContact O-N 3.12Å
174S91.6Very high90.3Very high58 Ų58105.1 Ų105.141%0.40653%0.532SS..Hα-helixtrans-62.9-40.6175.3-170.70000112.5H170 I171 L177 L178H170-S174 WeakPolarHBondContact O-CB 3.45Å; H170-S174 PolarHBondContact O-N 3.48Å; I171-S174 CarbonylContact O-C 3.57Å; I171-S174 WeakPolarHBondContact O-CA 3.45Å; I171-S174 WeakPolarHBondContact O-CB 3.43Å; I171-S174 PolarHBondContact O-N 2.76Å; I171-S174 VanDerWaalsContact O-N 3.12Å; S174-L177 PolarHBondContact O-N 2.86Å; S174-L178 VanDerWaalsContact O-CG 3.31Å; S174-L178 WeakPolarHBondContact O-CG 3.31Å; S174-L178 PolarHBondContact O-N 3.46Å
175D94.8Very high90.9Very high95 Ų95102.2 Ų102.251%0.50853%0.53SS..Hα-helixtrans-61.6-45.3178.3-166.959.7000111I171 K172 L177 L178 D179I171-D175 WeakPolarHBondContact O-CB 3.45Å; I171-D175 PolarHBondContact O-N 3.01Å; K172-D175 PolarHBondContact O-N 3.07Å; D175-L177 PolarHBondContact O-N 2.94Å; D175-L178 WeakPolarHBondContact O-CB 3.3Å; D175-L178 PolarHBondContact O-N 3.42Å; D175-L178 VanDerWaalsContact O-N 3.16Å; D175-D179 PolarHBondContact O-N 3.47Å
176K93.1Very high91.4Very high142 Ų142101.2 Ų101.262%0.61752%0.524SS*.Hα-helixtrans-60.9-42.2173.3-177.9171179.2161.70112.8K172 S173 L178 D179 D180K172-K176 PolarHBondContact O-N 2.89Å; K172-K176 VanDerWaalsContact O-N 3.13Å; S173-K176 PolarHBondContact O-N 3.31Å; K176-L178 VanDerWaalsContact C-N 3.29Å; K176-L178 PolarHBondContact O-N 2.85Å; K176-D179 PolarHBondContact O-N 3.41Å; K176-D180 PolarHBondContact O-N 3.27Å
177L92.7Very high91.9Very high100 Ų10098 Ų9852%0.52452%0.52SS..Hα-helixtrans-65-34.7176.8-69.9173.2000112S173 S174 D175 Q181S173-L177 WeakPolarHBondContact O-CG 3.36Å; S173-L177 PolarHBondContact O-N 3.12Å; S174-L177 PolarHBondContact O-N 2.86Å; D175-L177 PolarHBondContact O-N 2.94Å; L177-Q181 WeakPolarHBondContact O-CB 3.35Å; L177-Q181 VanDerWaalsContact O-CG 3.29Å; L177-Q181 WeakPolarHBondContact O-CG 3.42Å; L177-Q181 PolarHBondContact O-N 2.93Å
178L93Very high92.5Very high85 Ų8596.1 Ų96.145%0.44552%0.516SS..Hα-helixtrans-67.7-43.9175-72.2172.2000111.3S174 D175 K176 D180 Q181 I182S174-L178 VanDerWaalsContact O-CG 3.31Å; S174-L178 WeakPolarHBondContact O-CG 3.31Å; S174-L178 PolarHBondContact O-N 3.46Å; D175-L178 WeakPolarHBondContact O-CB 3.3Å; D175-L178 PolarHBondContact O-N 3.42Å; D175-L178 VanDerWaalsContact O-N 3.16Å; K176-L178 VanDerWaalsContact C-N 3.29Å; K176-L178 PolarHBondContact O-N 2.85Å; L178-D180 VanDerWaalsContact C-N 3.35Å; L178-D180 PolarHBondContact O-N 2.87Å; L178-Q181 PolarHBondContact O-N 2.82Å; L178-I182 WeakPolarHBondContact O-CB 3.35Å; L178-I182 VanDerWaalsContact O-CG1 3.25Å; L178-I182 WeakPolarHBondContact O-CG1 3.36Å; L178-I182 PolarHBondContact O-N 3.31Å
179D96Very high92.9Very high99 Ų9997.8 Ų97.853%0.52952%0.522SS..Hα-helixtrans-60.8-43175.3-87.9-13.9000112.1D175 K176 Q181 I182 G183D175-D179 PolarHBondContact O-N 3.47Å; K176-D179 PolarHBondContact O-N 3.41Å; D179-Q181 VanDerWaalsContact C-N 3.34Å; D179-Q181 PolarHBondContact O-N 3.33Å; D179-I182 PolarHBondContact O-N 2.98Å; D179-G183 PolarHBondContact O-N 3.49Å
180D94.6Very high93.3Very high100 Ų10098.7 Ų98.754%0.53553%0.526SS..Hα-helixtrans-63.4-39.8175.6-74.3-19.1000111.4K176 L178 G183 L184K176-D180 PolarHBondContact O-N 3.27Å; L178-D180 VanDerWaalsContact C-N 3.35Å; L178-D180 PolarHBondContact O-N 2.87Å; D180-G183 PolarHBondContact O-N 2.87Å; D180-L184 WeakPolarHBondContact O-CB 3.32Å; D180-L184 PolarHBondContact O-N 2.95Å
181Q93.3Very high93.6Very high128 Ų12894.9 Ų94.960%0.59852%0.515SS*.Hα-helixtrans-68.1-40.3175.7-77.9-178.36.600112.5L177 L178 D179 L184 A185L177-Q181 WeakPolarHBondContact O-CB 3.35Å; L177-Q181 VanDerWaalsContact O-CG 3.29Å; L177-Q181 WeakPolarHBondContact O-CG 3.42Å; L177-Q181 PolarHBondContact O-N 2.93Å; L178-Q181 PolarHBondContact O-N 2.82Å; D179-Q181 VanDerWaalsContact C-N 3.34Å; D179-Q181 PolarHBondContact O-N 3.33Å; Q181-L184 PolarHBondContact O-N 3.45Å; Q181-A185 VanDerWaalsContact O-CB 3.25Å; Q181-A185 WeakPolarHBondContact O-CB 3.31Å; Q181-A185 PolarHBondContact O-N 3.5Å
182I93.2Very high93.7Very high93 Ų9395 Ų9548%0.47752%0.516SS..Hα-helixtrans-64-44.5175-69.5165.9000109.5L178 D179 A185 L186L178-I182 WeakPolarHBondContact O-CB 3.35Å; L178-I182 VanDerWaalsContact O-CG1 3.25Å; L178-I182 WeakPolarHBondContact O-CG1 3.36Å; L178-I182 PolarHBondContact O-N 3.31Å; D179-I182 PolarHBondContact O-N 2.98Å; I182-A185 PolarHBondContact O-N 3.4Å; I182-L186 HydrophobicContact CG2-CD1 3.96Å; I182-L186 HydrophobicContact CG2-CG 4.35Å; I182-L186 WeakPolarHBondContact O-CB 3.47Å; I182-L186 VanDerWaalsContact O-CG 3.31Å; I182-L186 WeakPolarHBondContact O-CG 3.36Å; I182-L186 PolarHBondContact O-N 2.8Å
183G94.8Very high93.8Very high39 Ų3994.8 Ų94.840%0.40252%0.515SS..Hα-helixtrans-59.3-46.7175.100000112.4D179 D180 A185 L186 S187D179-G183 PolarHBondContact O-N 3.49Å; D180-G183 PolarHBondContact O-N 2.87Å; G183-A185 PolarHBondContact O-N 3.33Å; G183-L186 PolarHBondContact O-N 3.32Å; G183-S187 WeakPolarHBondContact O-CB 3.45Å; G183-S187 PolarHBondContact O-N 3.2Å
184L92.6Very high93.9Very high116 Ų11695.9 Ų95.961%0.60752%0.519SS*.Hα-helixtrans-62.7-41.1175.6-178.963.3000112D180 Q181 T188D180-L184 WeakPolarHBondContact O-CB 3.32Å; D180-L184 PolarHBondContact O-N 2.95Å; Q181-L184 PolarHBondContact O-N 3.45Å; L184-T188 VanDerWaalsContact O-CB 3.31Å; L184-T188 WeakPolarHBondContact O-CB 3.38Å; L184-T188 PolarHBondContact O-N 3.11Å; L184-T188 PolarHBondContact O-OG1 3.34Å
185A92.8Very high94Very high59 Ų5998.4 Ų98.449%0.48852%0.524SS..Hα-helixtrans-67.1-41.8178.400000112.1Q181 I182 G183 T188 K189Q181-A185 VanDerWaalsContact O-CB 3.25Å; Q181-A185 WeakPolarHBondContact O-CB 3.31Å; Q181-A185 PolarHBondContact O-N 3.5Å; I182-A185 PolarHBondContact O-N 3.4Å; G183-A185 PolarHBondContact O-N 3.33Å; A185-T188 PolarHBondContact O-N 2.74Å; A185-K189 WeakPolarHBondContact O-CB 3.34Å; A185-K189 PolarHBondContact O-N 2.97Å
186L95Very high93.8Very high101 Ų101102.8 Ų102.853%0.52953%0.534SS..Hα-helixtrans-63.8-46.1175-73.4174.1000111.4I182 G183 T188 K189 E190I182-L186 HydrophobicContact CG2-CD1 3.96Å; I182-L186 HydrophobicContact CG2-CG 4.35Å; I182-L186 WeakPolarHBondContact O-CB 3.47Å; I182-L186 VanDerWaalsContact O-CG 3.31Å; I182-L186 WeakPolarHBondContact O-CG 3.36Å; I182-L186 PolarHBondContact O-N 2.8Å; G183-L186 PolarHBondContact O-N 3.32Å; L186-T188 VanDerWaalsContact C-N 3.34Å; L186-T188 PolarHBondContact O-N 3.43Å; L186-K189 WeakPolarHBondContact O-CB 3.45Å; L186-K189 PolarHBondContact O-N 3.46Å; L186-E190 PolarHBondContact O-N 2.96Å
187S94Very high93.8Very high73 Ų7399.7 Ų99.751%0.5152%0.524SS..Hα-helixtrans-60.7-42.3175179.10000112G183 E190 S191G183-S187 WeakPolarHBondContact O-CB 3.45Å; G183-S187 PolarHBondContact O-N 3.2Å; S187-E190 PolarHBondContact O-N 2.76Å; S187-S191 WeakPolarHBondContact O-CB 3.36Å; S187-S191 PolarHBondContact O-N 3.44Å
188T94Very high93.8Very high69 Ų6996.3 Ų96.342%0.42351%0.513SS..Hα-helixtrans-64.7-43.3176.1-59.30000111.4L184 A185 L186 E190 S191 L192L184-T188 VanDerWaalsContact O-CB 3.31Å; L184-T188 WeakPolarHBondContact O-CB 3.38Å; L184-T188 PolarHBondContact O-N 3.11Å; L184-T188 PolarHBondContact O-OG1 3.34Å; A185-T188 PolarHBondContact O-N 2.74Å; L186-T188 VanDerWaalsContact C-N 3.34Å; L186-T188 PolarHBondContact O-N 3.43Å; T188-E190 VanDerWaalsContact C-N 3.33Å; T188-E190 PolarHBondContact O-N 2.92Å; T188-S191 PolarHBondContact O-N 3.27Å; T188-L192 HydrophobicContact CG2-CD1 4.36Å; T188-L192 WeakPolarHBondContact O-CG 3.43Å; T188-L192 PolarHBondContact O-N 2.91Å
189K95.2Very high93.7Very high148 Ų14898 Ų9864%0.64352%0.522SS*.Hα-helixtrans-59.6-44.1175175.3-172.2168.8-1760111.3A185 L186 L192 F193A185-K189 WeakPolarHBondContact O-CB 3.34Å; A185-K189 PolarHBondContact O-N 2.97Å; L186-K189 WeakPolarHBondContact O-CB 3.45Å; L186-K189 PolarHBondContact O-N 3.46Å; K189-L192 PolarHBondContact O-N 3.32Å; K189-F193 WeakPolarHBondContact O-CB 3.43Å; K189-F193 PolarHBondContact O-N 3.42Å
190E95.4Very high93.5Very high136 Ų13699.6 Ų99.664%0.63652%0.524SS*.Hα-helixtrans-64.3-45.2177.8-171.7171.1-169.200111.4L186 S187 T188 L192 F193 V194L186-E190 PolarHBondContact O-N 2.96Å; S187-E190 PolarHBondContact O-N 2.76Å; T188-E190 VanDerWaalsContact C-N 3.33Å; T188-E190 PolarHBondContact O-N 2.92Å; E190-L192 PolarHBondContact O-N 2.97Å; E190-F193 WeakPolarHBondContact O-CB 3.5Å; E190-F193 PolarHBondContact O-N 3.11Å; E190-F193 VanDerWaalsContact O-N 3.11Å; E190-V194 WeakPolarHBondContact O-CG2 3.46Å; E190-V194 PolarHBondContact O-N 3.46Å
191S92.9Very high93.4Very high60 Ų6098.9 Ų98.942%0.4252%0.52SS..Hα-helixtrans-58.5-45.1174.9-174.40000112.3S187 T188 F193 V194 Q195S187-S191 WeakPolarHBondContact O-CB 3.36Å; S187-S191 PolarHBondContact O-N 3.44Å; T188-S191 PolarHBondContact O-N 3.27Å; S191-F193 VanDerWaalsContact C-N 3.32Å; S191-F193 PolarHBondContact O-N 2.91Å; S191-V194 PolarHBondContact O-N 3.45Å; S191-Q195 WeakPolarHBondContact O-CG 3.42Å; S191-Q195 PolarHBondContact O-N 2.95Å
192L94.2Very high93.2Very high101 Ų10197.7 Ų97.753%0.52952%0.517SS..Hα-helixtrans-63.4-36.2175.2-71.7177.4000112.4T188 K189 E190 Q195 R196T188-L192 HydrophobicContact CG2-CD1 4.36Å; T188-L192 WeakPolarHBondContact O-CG 3.43Å; T188-L192 PolarHBondContact O-N 2.91Å; K189-L192 PolarHBondContact O-N 3.32Å; E190-L192 PolarHBondContact O-N 2.97Å; L192-Q195 PolarHBondContact O-N 3.47Å; L192-R196 WeakPolarHBondContact O-CB 3.43Å; L192-R196 PolarHBondContact O-N 2.94Å
193F95.2Very high93Very high123 Ų12396.7 Ų96.754%0.53952%0.518SS..Hα-helixtrans-66.8-43.9175.9-176.8-103.5000111.9K189 E190 S191 Q195 R196 L197K189-F193 WeakPolarHBondContact O-CB 3.43Å; K189-F193 PolarHBondContact O-N 3.42Å; E190-F193 WeakPolarHBondContact O-CB 3.5Å; E190-F193 PolarHBondContact O-N 3.11Å; E190-F193 VanDerWaalsContact O-N 3.11Å; S191-F193 VanDerWaalsContact C-N 3.32Å; S191-F193 PolarHBondContact O-N 2.91Å; F193-Q195 VanDerWaalsContact C-N 3.35Å; F193-R196 PolarHBondContact O-N 3.47Å; F193-L197 HydrophobicContact CD1-CD1 3.61Å; F193-L197 HydrophobicContact CE1-CD1 3.3Å; F193-L197 HydrophobicContact CE1-CG 4.24Å; F193-L197 HydrophobicContact CG-CD1 4.45Å; F193-L197 HydrophobicContact CZ-CD1 3.91Å; F193-L197 HydrophobicContact CZ-CG 4.43Å; F193-L197 PolarHBondContact O-N 2.89Å
194V93.6Very high92.8Very high89 Ų89100.5 Ų100.554%0.53952%0.524SS..Hα-helixtrans-61.8-42.7173.8173.10000110.9E190 S191 R196 L197 G198E190-V194 WeakPolarHBondContact O-CG2 3.46Å; E190-V194 PolarHBondContact O-N 3.46Å; S191-V194 PolarHBondContact O-N 3.45Å; V194-R196 PolarHBondContact O-N 3.25Å; V194-L197 WeakPolarHBondContact O-CB 3.32Å; V194-L197 PolarHBondContact O-N 2.85Å; V194-G198 PolarHBondContact O-N 3.27Å
195Q92.9Very high92.5Very high110 Ų110102 Ų10251%0.51453%0.525SS..Hα-helixtrans-60.6-44174.5-74177.123.700111.8S191 L192 F193 L197 G198 L199S191-Q195 WeakPolarHBondContact O-CG 3.42Å; S191-Q195 PolarHBondContact O-N 2.95Å; L192-Q195 PolarHBondContact O-N 3.47Å; F193-Q195 VanDerWaalsContact C-N 3.35Å; Q195-L197 VanDerWaalsContact C-N 3.34Å; Q195-L197 PolarHBondContact O-N 3.32Å; Q195-G198 WeakPolarHBondContact O-CA 3.33Å; Q195-G198 PolarHBondContact O-N 2.81Å; Q195-G198 VanDerWaalsContact O-N 3.16Å; Q195-L199 WeakPolarHBondContact O-CG 3.48Å; Q195-L199 PolarHBondContact O-N 2.84Å
196R92.1Very high92.1Very high188 Ų188105.2 Ų105.271%0.70953%0.532SS*.Hα-helixtrans-61.3-41.9176.1-176.7179.7178.2-179.10.2112L192 F193 V194 L199 K200L192-R196 WeakPolarHBondContact O-CB 3.43Å; L192-R196 PolarHBondContact O-N 2.94Å; F193-R196 PolarHBondContact O-N 3.47Å; V194-R196 PolarHBondContact O-N 3.25Å; R196-L199 PolarHBondContact O-N 2.92Å; R196-K200 WeakPolarHBondContact O-CB 3.46Å; R196-K200 PolarHBondContact O-N 3.45Å
197L93.2Very high91.7Very high77 Ų77103.9 Ų103.940%0.40353%0.528SS..Hα-helixtrans-62.4-43.1173.4-79.5159.9000111.4F193 V194 Q195 K200 N201F193-L197 HydrophobicContact CD1-CD1 3.61Å; F193-L197 HydrophobicContact CE1-CD1 3.3Å; F193-L197 HydrophobicContact CE1-CG 4.24Å; F193-L197 HydrophobicContact CG-CD1 4.45Å; F193-L197 HydrophobicContact CZ-CD1 3.91Å; F193-L197 HydrophobicContact CZ-CG 4.43Å; F193-L197 PolarHBondContact O-N 2.89Å; V194-L197 WeakPolarHBondContact O-CB 3.32Å; V194-L197 PolarHBondContact O-N 2.85Å; Q195-L197 VanDerWaalsContact C-N 3.34Å; Q195-L197 PolarHBondContact O-N 3.32Å; L197-K200 PolarHBondContact O-N 2.92Å; L197-N201 WeakPolarHBondContact O-CB 3.48Å; L197-N201 VanDerWaalsContact O-CG 3.26Å; L197-N201 PolarHBondContact O-N 2.86Å; L197-N201 PolarHBondContact O-OD1 3.24Å
198G92Very high91.3Very high29 Ų29104 Ų10430%0.29953%0.525SS..Hα-helixtrans-57.4-50.417400000112.4V194 Q195 K200 N201 I202V194-G198 PolarHBondContact O-N 3.27Å; Q195-G198 WeakPolarHBondContact O-CA 3.33Å; Q195-G198 PolarHBondContact O-N 2.81Å; Q195-G198 VanDerWaalsContact O-N 3.16Å; G198-K200 VanDerWaalsContact C-N 3.32Å; G198-K200 PolarHBondContact O-N 3.32Å; G198-N201 CarbonylContact O-C 3.54Å; G198-N201 WeakPolarHBondContact O-CB 3.45Å; G198-N201 PolarHBondContact O-N 3.49Å; G198-N201 VanDerWaalsContact O-N 3.11Å; G198-I202 WeakPolarHBondContact O-CG1 3.34Å; G198-I202 PolarHBondContact O-N 2.85Å
199L91.5Very high90.5Very high120 Ų120106.4 Ų106.463%0.62854%0.535SS*.Hα-helixtrans-61-39175.6-70.4175.9000112.1Q195 R196 N201 I202 S203Q195-L199 WeakPolarHBondContact O-CG 3.48Å; Q195-L199 PolarHBondContact O-N 2.84Å; R196-L199 PolarHBondContact O-N 2.92Å; L199-N201 VanDerWaalsContact C-N 3.32Å; L199-N201 PolarHBondContact O-N 3.11Å; L199-I202 PolarHBondContact O-N 3.4Å; L199-S203 WeakPolarHBondContact O-CB 3.43Å; L199-S203 PolarHBondContact O-N 3.16Å
200K91.8Very high89.7Confident132 Ų132103.6 Ų103.657%0.57453%0.531SS*.Hα-helixtrans-65.2-38175-164.6175-174.6178.80111.3R196 L197 G198 S203 K204R196-K200 WeakPolarHBondContact O-CB 3.46Å; R196-K200 PolarHBondContact O-N 3.45Å; L197-K200 PolarHBondContact O-N 2.92Å; G198-K200 VanDerWaalsContact C-N 3.32Å; G198-K200 PolarHBondContact O-N 3.32Å; K200-S203 PolarHBondContact O-N 3.47Å; K200-K204 WeakPolarHBondContact O-CB 3.49Å; K200-K204 VanDerWaalsContact O-CG 3.32Å; K200-K204 WeakPolarHBondContact O-CG 3.32Å; K200-K204 PolarHBondContact O-N 3.42Å
201N92.2Very high89Confident85 Ų85105.1 Ų105.146%0.45554%0.535SS..Hα-helixtrans-68.4-39.6175.2-71.5-4.9000111.8L197 G198 L199 K204 K205L197-N201 WeakPolarHBondContact O-CB 3.48Å; L197-N201 VanDerWaalsContact O-CG 3.26Å; L197-N201 PolarHBondContact O-N 2.86Å; L197-N201 PolarHBondContact O-OD1 3.24Å; G198-N201 CarbonylContact O-C 3.54Å; G198-N201 WeakPolarHBondContact O-CB 3.45Å; G198-N201 PolarHBondContact O-N 3.49Å; G198-N201 VanDerWaalsContact O-N 3.11Å; L199-N201 VanDerWaalsContact C-N 3.32Å; L199-N201 PolarHBondContact O-N 3.11Å; N201-K204 PolarHBondContact O-N 2.89Å; N201-K205 WeakPolarHBondContact O-CG 3.44Å; N201-K205 PolarHBondContact O-N 2.75Å
202I89.2Confident88.2Confident104 Ų104110.5 Ų110.553%0.53355%0.546SS..Hα-helixtrans-64.5-45173.6-67.4164.8000110.2G198 L199 K204 K205 M206G198-I202 WeakPolarHBondContact O-CG1 3.34Å; G198-I202 PolarHBondContact O-N 2.85Å; L199-I202 PolarHBondContact O-N 3.4Å; I202-K204 VanDerWaalsContact C-N 3.33Å; I202-K204 PolarHBondContact O-N 2.93Å; I202-K205 CarbonylContact O-C 3.59Å; I202-K205 WeakPolarHBondContact O-CB 3.37Å; I202-K205 PolarHBondContact O-N 3.09Å; I202-K205 VanDerWaalsContact O-N 3.09Å; I202-M206 WeakPolarHBondContact O-CB 3.42Å; I202-M206 PolarHBondContact O-N 2.72Å
203S88.7Confident87.2Confident71 Ų71114 Ų11450%0.49755%0.553SS.*Hα-helixtrans-59.3-42.4175.2-179.70000111.8L199 K200 M206 T207L199-S203 WeakPolarHBondContact O-CB 3.43Å; L199-S203 PolarHBondContact O-N 3.16Å; K200-S203 PolarHBondContact O-N 3.47Å; S203-M206 PolarHBondContact O-N 3.03Å; S203-T207 WeakPolarHBondContact O-CG2 3.24Å; S203-T207 PolarHBondContact O-N 3.38Å; S203-T207 PolarHBondContact O-OG1 3.19Å
204K89.8Confident86.3Confident120 Ų120111.7 Ų111.752%0.52255%0.551SS.*Hα-helixtrans-61.7-42.2171.8-75.7177.5180-177.30112.5K200 N201 I202 T207 T208K200-K204 WeakPolarHBondContact O-CB 3.49Å; K200-K204 VanDerWaalsContact O-CG 3.32Å; K200-K204 WeakPolarHBondContact O-CG 3.32Å; K200-K204 PolarHBondContact O-N 3.42Å; N201-K204 PolarHBondContact O-N 2.89Å; I202-K204 VanDerWaalsContact C-N 3.33Å; I202-K204 PolarHBondContact O-N 2.93Å; K204-T207 WeakPolarHBondContact CA-OG1 3.28Å; K204-T207 PolarHBondContact O-OG1 3.37Å; K204-T208 WeakPolarHBondContact O-CB 3.42Å; K204-T208 PolarHBondContact O-N 2.89Å; K204-T208 PolarHBondContact O-OG1 3.34Å
205K87Confident85.4Confident147 Ų147110.2 Ų110.264%0.63955%0.548SS*.Hα-helixtrans-65.6-42.9175.3-75.3177.7-177.8-75.50111.4N201 I202 T208 L209N201-K205 WeakPolarHBondContact O-CG 3.44Å; N201-K205 PolarHBondContact O-N 2.75Å; I202-K205 CarbonylContact O-C 3.59Å; I202-K205 WeakPolarHBondContact O-CB 3.37Å; I202-K205 PolarHBondContact O-N 3.09Å; I202-K205 VanDerWaalsContact O-N 3.09Å; K205-T208 CarbonylContact O-C 3.55Å; K205-T208 WeakPolarHBondContact O-CA 3.35Å; K205-T208 WeakPolarHBondContact O-CB 3.5Å; K205-T208 PolarHBondContact O-N 2.9Å; K205-T208 VanDerWaalsContact O-N 3.13Å; K205-L209 WeakPolarHBondContact O-CG 3.35Å; K205-L209 PolarHBondContact O-N 2.85Å
206M85.1Confident84.3Confident126 Ų126109 Ų10962%0.62155%0.548SS*.Hα-helixtrans-62.8-47.2178.6-175.6157.3-177.300111.4I202 S203 T208 L209 T210I202-M206 WeakPolarHBondContact O-CB 3.42Å; I202-M206 PolarHBondContact O-N 2.72Å; S203-M206 PolarHBondContact O-N 3.03Å; M206-T208 PolarHBondContact O-N 3.41Å; M206-L209 WeakPolarHBondContact O-CB 3.46Å; M206-L209 PolarHBondContact O-N 3.07Å; M206-L209 VanDerWaalsContact O-N 3.07Å; M206-T210 PolarHBondContact O-N 3.13Å; M206-T210 PolarHBondContact O-OG1 3.21Å; M206-T210 VanDerWaalsContact O-OG1 3.04Å
207T86.1Confident83.6Confident74 Ų74104.7 Ų104.745%0.45454%0.536SS..Hα-helixtrans-61.5-33.6173.851.10000112.3S203 K204 K211S203-T207 WeakPolarHBondContact O-CG2 3.24Å; S203-T207 PolarHBondContact O-N 3.38Å; S203-T207 PolarHBondContact O-OG1 3.19Å; K204-T207 WeakPolarHBondContact CA-OG1 3.28Å; K204-T207 PolarHBondContact O-OG1 3.37Å; T207-K211 WeakPolarHBondContact O-CG 3.44Å; T207-K211 PolarHBondContact O-N 2.81Å; T207-K211 VanDerWaalsContact O-N 3.08Å
208T85.1Confident82.8Confident74 Ų74104.1 Ų104.145%0.45454%0.538SS..Hα-helixtrans-67.4-39.5172.8-54.60000112K204 K205 M206 K211 R212K204-T208 WeakPolarHBondContact O-CB 3.42Å; K204-T208 PolarHBondContact O-N 2.89Å; K204-T208 PolarHBondContact O-OG1 3.34Å; K205-T208 CarbonylContact O-C 3.55Å; K205-T208 WeakPolarHBondContact O-CA 3.35Å; K205-T208 WeakPolarHBondContact O-CB 3.5Å; K205-T208 PolarHBondContact O-N 2.9Å; K205-T208 VanDerWaalsContact O-N 3.13Å; M206-T208 PolarHBondContact O-N 3.41Å; T208-K211 PolarHBondContact O-N 3.24Å; T208-R212 PolarHBondContact O-N 3.04Å
209L77.6Confident81.9Confident120 Ų120108 Ų10863%0.62855%0.552SS**Hα-helixtrans-66.6-42.6174.7-69.8173.8000111.7K205 M206 K211 R212 Y213K205-L209 WeakPolarHBondContact O-CG 3.35Å; K205-L209 PolarHBondContact O-N 2.85Å; M206-L209 WeakPolarHBondContact O-CB 3.46Å; M206-L209 PolarHBondContact O-N 3.07Å; M206-L209 VanDerWaalsContact O-N 3.07Å; L209-K211 VanDerWaalsContact C-N 3.27Å; L209-K211 PolarHBondContact O-N 2.86Å; L209-R212 CarbonylContact O-C 3.58Å; L209-R212 WeakPolarHBondContact O-CA 3.41Å; L209-R212 PolarHBondContact O-N 3.31Å; L209-Y213 PolarHBondContact O-N 3.01Å
210T78.9Confident81Confident90 Ų90108.6 Ų108.655%0.55255%0.553SS**Hα-helixtrans-58.6-39.8174.4-53.10000111.3M206 R212 Y213 P214M206-T210 PolarHBondContact O-N 3.13Å; M206-T210 PolarHBondContact O-OG1 3.21Å; M206-T210 VanDerWaalsContact O-OG1 3.04Å; T210-R212 VanDerWaalsContact C-N 3.27Å; T210-R212 PolarHBondContact O-N 3.38Å; T210-Y213 VanDerWaalsContact O-CB 3.24Å; T210-Y213 WeakPolarHBondContact O-CB 3.48Å; T210-Y213 PolarHBondContact O-N 3.08Å; T210-P214 VanDerWaalsContact O-CD 3.28Å; T210-P214 WeakPolarHBondContact O-CD 3.38Å
211K78.9Confident80.1Confident168 Ų168107.7 Ų107.773%0.7355%0.55SS**Hα-helixtrans-65.7-26.3173.8-73.7-180-179.3-173.60113.7T207 T208 L209 P214T207-K211 WeakPolarHBondContact O-CG 3.44Å; T207-K211 PolarHBondContact O-N 2.81Å; T207-K211 VanDerWaalsContact O-N 3.08Å; T208-K211 PolarHBondContact O-N 3.24Å; L209-K211 VanDerWaalsContact C-N 3.27Å; L209-K211 PolarHBondContact O-N 2.86Å; K211-P214 WeakPolarHBondContact O-CD 3.48Å; K211-P214 WeakPolarHBondContact O-CG 3.35Å
212R77.2Confident79.2Confident173 Ų173110.9 Ų110.965%0.65356%0.56SS**Hα-helixtrans-84.1-17.9174.1-68.7-164.6-179.5-153.11.5113.4T208 L209 T210 A215 V216T208-R212 PolarHBondContact O-N 3.04Å; L209-R212 CarbonylContact O-C 3.58Å; L209-R212 WeakPolarHBondContact O-CA 3.41Å; L209-R212 PolarHBondContact O-N 3.31Å; T210-R212 VanDerWaalsContact C-N 3.27Å; T210-R212 PolarHBondContact O-N 3.38Å; R212-A215 WeakPolarHBondContact O-CA 3.46Å; R212-A215 WeakPolarHBondContact O-CB 3.41Å; R212-A215 PolarHBondContact O-N 2.99Å; R212-V216 PolarHBondContact O-N 3.39Å
213Y73.1Confident78.4Confident173 Ų173111.8 Ų111.868%0.67857%0.565SS**Hα-helixtrans-53.6-45.3177.6-148.5-93.1000114L209 T210 A215 V216 H217L209-Y213 PolarHBondContact O-N 3.01Å; T210-Y213 VanDerWaalsContact O-CB 3.24Å; T210-Y213 WeakPolarHBondContact O-CB 3.48Å; T210-Y213 PolarHBondContact O-N 3.08Å; Y213-A215 VanDerWaalsContact C-N 3.3Å; Y213-A215 PolarHBondContact O-N 2.96Å; Y213-V216 PolarHBondContact O-N 3.35Å; Y213-H217 WeakPolarHBondContact O-CB 3.43Å; Y213-H217 PolarHBondContact O-N 3.02Å
214P76.8Confident77.6Confident76 Ų76114.8 Ų114.849%0.49457%0.571SS.*Hα-helixtrans-65-31.6174.422.1-31.9000113.1T210 K211 H217 S218T210-P214 VanDerWaalsContact O-CD 3.28Å; T210-P214 WeakPolarHBondContact O-CD 3.38Å; K211-P214 WeakPolarHBondContact O-CD 3.48Å; K211-P214 WeakPolarHBondContact O-CG 3.35Å; P214-H217 PolarHBondContact O-N 3.32Å; P214-S218 PolarHBondContact O-N 3.31Å; P214-S218 PolarHBondContact O-OG 2.85Å
215A73.3Confident76.6Confident57 Ų57112.9 Ų112.947%0.47157%0.569SS.*Hα-helixtrans-66.8-41.4174.400000111.5R212 Y213 S218 L219R212-A215 WeakPolarHBondContact O-CA 3.46Å; R212-A215 WeakPolarHBondContact O-CB 3.41Å; R212-A215 PolarHBondContact O-N 2.99Å; Y213-A215 VanDerWaalsContact C-N 3.3Å; Y213-A215 PolarHBondContact O-N 2.96Å; A215-S218 PolarHBondContact O-N 3.47Å; A215-L219 WeakPolarHBondContact O-CG 3.48Å; A215-L219 PolarHBondContact O-N 3.1Å; A215-L219 VanDerWaalsContact O-N 3.08Å
216V70.2Confident75.8Confident86 Ų86114.1 Ų114.152%0.52158%0.575SS.*Hα-helixtrans-64.9-41.6172.1178.20000110.7R212 Y213 S218 L219 M220R212-V216 PolarHBondContact O-N 3.39Å; Y213-V216 PolarHBondContact O-N 3.35Å; V216-S218 PolarHBondContact O-N 2.86Å; V216-L219 PolarHBondContact O-N 3.28Å; V216-M220 WeakPolarHBondContact O-CB 3.41Å; V216-M220 PolarHBondContact O-N 3.44Å
217H77.7Confident75.3Confident97 Ų97117 Ų11745%0.44958%0.584SS.*Hα-helixtrans-61-44.1176.9-171.376.3000111.9Y213 P214 L219 M220 Q221Y213-H217 WeakPolarHBondContact O-CB 3.43Å; Y213-H217 PolarHBondContact O-N 3.02Å; P214-H217 PolarHBondContact O-N 3.32Å; H217-L219 VanDerWaalsContact C-N 3.33Å; H217-L219 PolarHBondContact O-N 2.83Å; H217-M220 PolarHBondContact O-N 3.19Å; H217-Q221 PolarHBondContact NE2-NE2 3.29Å; H217-Q221 WeakPolarHBondContact O-CB 3.37Å; H217-Q221 PolarHBondContact O-N 3.47Å
218S77.1Confident74.8Confident65 Ų65115.4 Ų115.446%0.45558%0.575SS.*Hα-helixtrans-63.5-36.6174.8-71.60000112.8P214 A215 V216 K222P214-S218 PolarHBondContact O-N 3.31Å; P214-S218 PolarHBondContact O-OG 2.85Å; A215-S218 PolarHBondContact O-N 3.47Å; V216-S218 PolarHBondContact O-N 2.86Å; S218-K222 WeakPolarHBondContact O-CB 3.4Å; S218-K222 WeakPolarHBondContact O-CG 3.39Å; S218-K222 PolarHBondContact O-N 3.01Å
219L72.2Confident74.4Confident111 Ų111120.2 Ų120.258%0.58159%0.585SS**Hα-helixtrans-67.3-43.5174-72.8168.1000111.6A215 V216 H217 K222 I223A215-L219 WeakPolarHBondContact O-CG 3.48Å; A215-L219 PolarHBondContact O-N 3.1Å; A215-L219 VanDerWaalsContact O-N 3.08Å; V216-L219 PolarHBondContact O-N 3.28Å; H217-L219 VanDerWaalsContact C-N 3.33Å; H217-L219 PolarHBondContact O-N 2.83Å; L219-K222 PolarHBondContact O-N 3.01Å; L219-I223 PolarHBondContact O-N 3.08Å
220M72.6Confident74.7Confident132 Ų132120.4 Ų120.465%0.6559%0.587SS**Hα-helixtrans-61.2-46.7177.2-164.491.6-177.200111.1V216 H217 K222 I223 H224V216-M220 WeakPolarHBondContact O-CB 3.41Å; V216-M220 PolarHBondContact O-N 3.44Å; H217-M220 PolarHBondContact O-N 3.19Å; M220-K222 PolarHBondContact O-N 3.05Å; M220-I223 PolarHBondContact O-N 3.49Å; M220-H224 PolarHBondContact O-N 3.27Å
221Q73.7Confident75Confident112 Ų112119.1 Ų119.152%0.52359%0.586SS.*Hα-helixtrans-59.7-46.6175.4-80.2-171.3-20.100111.3H217 I223 H224 V225H217-Q221 PolarHBondContact NE2-NE2 3.29Å; H217-Q221 WeakPolarHBondContact O-CB 3.37Å; H217-Q221 PolarHBondContact O-N 3.47Å; Q221-I223 VanDerWaalsContact C-N 3.28Å; Q221-I223 PolarHBondContact O-N 3.04Å; Q221-H224 PolarHBondContact O-N 3.11Å; Q221-H224 VanDerWaalsContact O-N 3.13Å; Q221-V225 WeakPolarHBondContact O-CG2 3.36Å; Q221-V225 PolarHBondContact O-N 3.3Å
222K72.9Confident75.3Confident152 Ų152117 Ų11766%0.66158%0.58SS**Hα-helixtrans-59.1-36.4177.6-82.4-176.5171.3-174.90113.1S218 L219 M220 V225 K226S218-K222 WeakPolarHBondContact O-CB 3.4Å; S218-K222 WeakPolarHBondContact O-CG 3.39Å; S218-K222 PolarHBondContact O-N 3.01Å; L219-K222 PolarHBondContact O-N 3.01Å; M220-K222 PolarHBondContact O-N 3.05Å; K222-V225 VanDerWaalsContact O-CG2 3.3Å; K222-V225 WeakPolarHBondContact O-CG2 3.3Å; K222-K226 PolarHBondContact O-N 3.21Å
223I72.7Confident75.8Confident124 Ų124113.1 Ų113.164%0.63658%0.575SS**Hα-helixtrans-67.7-44.4174.9-75.7169.4000110.8L219 M220 Q221 K226 K227L219-I223 PolarHBondContact O-N 3.08Å; M220-I223 PolarHBondContact O-N 3.49Å; Q221-I223 VanDerWaalsContact C-N 3.28Å; Q221-I223 PolarHBondContact O-N 3.04Å; I223-K226 PolarHBondContact O-N 3.39Å; I223-K227 PolarHBondContact O-N 3.2Å
224H71.5Confident76.6Confident134 Ų134110 Ų11062%0.6257%0.569SS**Hα-helixtrans-66.1-42.6-177.1-143.5-95.8000112M220 Q221 K226 K227 S228M220-H224 PolarHBondContact O-N 3.27Å; Q221-H224 PolarHBondContact O-N 3.11Å; Q221-H224 VanDerWaalsContact O-N 3.13Å; H224-K226 VanDerWaalsContact C-N 3.31Å; H224-K226 PolarHBondContact O-N 3.13Å; H224-K227 PolarHBondContact O-N 3.25Å; H224-S228 PolarHBondContact O-N 3.27Å; H224-S228 VanDerWaalsContact O-N 3.11Å; H224-S228 PolarHBondContact O-OG 3.33Å
225V69.6Low77.4Confident80 Ų80109.3 Ų109.349%0.48557%0.569SS.*Hα-helixtrans-64.6-34.4176.1-70.80000112.4Q221 K222 K227 S228 R229Q221-V225 WeakPolarHBondContact O-CG2 3.36Å; Q221-V225 PolarHBondContact O-N 3.3Å; K222-V225 VanDerWaalsContact O-CG2 3.3Å; K222-V225 WeakPolarHBondContact O-CG2 3.3Å; V225-K227 VanDerWaalsContact C-N 3.28Å; V225-K227 PolarHBondContact O-N 3.44Å; V225-S228 PolarHBondContact O-N 3.3Å; V225-S228 PolarHBondContact O-OG 3.5Å; V225-R229 VanDerWaalsContact O-CG 3.27Å; V225-R229 WeakPolarHBondContact O-CG 3.4Å; V225-R229 PolarHBondContact O-N 3.44Å; V225-R229 VanDerWaalsContact O-N 3.12Å
226K70.1Confident78.3Confident173 Ų173109.4 Ų109.475%0.75257%0.571SS**Hα-helixtrans-66.6-32.6178-164.9173.7176.4-179.90111.8K222 I223 H224K222-K226 PolarHBondContact O-N 3.21Å; I223-K226 PolarHBondContact O-N 3.39Å; H224-K226 VanDerWaalsContact C-N 3.31Å; H224-K226 PolarHBondContact O-N 3.13Å
227K74.4Confident79.5Confident186 Ų186109.2 Ų109.281%0.80957%0.569SS**Hα-helixtrans-75.8-31.5176.2-171.8168.5179.8175.60113.1I223 H224 V225I223-K227 PolarHBondContact O-N 3.2Å; H224-K227 PolarHBondContact O-N 3.25Å; V225-K227 VanDerWaalsContact C-N 3.28Å; V225-K227 PolarHBondContact O-N 3.44Å
228S75.8Confident80.4Confident40 Ų40108.5 Ų108.528%0.2857%0.571SS.*Hα-helixtrans-95.8-3.7-175.563.70000115.2H224 V225 D230 A231 M232H224-S228 PolarHBondContact O-N 3.27Å; H224-S228 VanDerWaalsContact O-N 3.11Å; H224-S228 PolarHBondContact O-OG 3.33Å; V225-S228 PolarHBondContact O-N 3.3Å; V225-S228 PolarHBondContact O-OG 3.5Å; S228-D230 PolarHBondContact O-N 2.99Å; S228-A231 PolarHBondContact O-N 3.12Å; S228-M232 WeakPolarHBondContact O-CB 3.49Å; S228-M232 PolarHBondContact O-N 3.39Å
229R75.3Confident81.2Confident175 Ų175108.5 Ų108.566%0.6657%0.572SS**Hα-helixtrans-58-47.3-179.4-90.2171.286156.17.6112.6V225 A231 M232 V233V225-R229 VanDerWaalsContact O-CG 3.27Å; V225-R229 WeakPolarHBondContact O-CG 3.4Å; V225-R229 PolarHBondContact O-N 3.44Å; V225-R229 VanDerWaalsContact O-N 3.12Å; R229-A231 PolarHBondContact O-N 3.33Å; R229-M232 PolarHBondContact O-N 3.23Å; R229-V233 WeakPolarHBondContact O-CG2 3.32Å; R229-V233 PolarHBondContact O-N 3.43Å
230D83.9Confident82.3Confident125 Ų125108.2 Ų108.267%0.66857%0.57SS**Hα-helixtrans-66.8-41.5-177.4-64-11.5000111.6S228 M232 V233 I234S228-D230 PolarHBondContact O-N 2.99Å; D230-M232 VanDerWaalsContact C-N 3.34Å; D230-M232 PolarHBondContact O-N 3.08Å; D230-V233 PolarHBondContact O-N 3.46Å; D230-I234 VanDerWaalsContact O-CG1 3.32Å; D230-I234 WeakPolarHBondContact O-CG1 3.27Å; D230-I234 PolarHBondContact O-N 3.19Å
231A86.7Confident83.4Confident63 Ų63105.1 Ų105.152%0.52156%0.561SS.*Hα-helixtrans-63.5-38.8176.200000112.4S228 R229 I234 A235S228-A231 PolarHBondContact O-N 3.12Å; R229-A231 PolarHBondContact O-N 3.33Å; A231-I234 PolarHBondContact O-N 2.94Å; A231-A235 VanDerWaalsContact O-CB 3.32Å; A231-A235 WeakPolarHBondContact O-CB 3.38Å; A231-A235 PolarHBondContact O-N 3.43Å
232M84.7Confident84.4Confident123 Ų123105 Ų10561%0.60656%0.563SS**Hα-helixtrans-65.3-40.5176.5-170.9-172.4-52.700111.7S228 R229 D230 A236S228-M232 WeakPolarHBondContact O-CB 3.49Å; S228-M232 PolarHBondContact O-N 3.39Å; R229-M232 PolarHBondContact O-N 3.23Å; D230-M232 VanDerWaalsContact C-N 3.34Å; D230-M232 PolarHBondContact O-N 3.08Å; M232-A236 WeakPolarHBondContact O-CB 3.3Å; M232-A236 PolarHBondContact O-N 3.26Å
233V88.3Confident85.5Confident91 Ų91102 Ų10255%0.55255%0.553SS**Hα-helixtrans-64.8-46.8176.3172.90000110.6R229 D230 A235 A236 V237R229-V233 WeakPolarHBondContact O-CG2 3.32Å; R229-V233 PolarHBondContact O-N 3.43Å; D230-V233 PolarHBondContact O-N 3.46Å; V233-A235 PolarHBondContact O-N 2.92Å; V233-A236 PolarHBondContact O-N 2.98Å; V233-V237 WeakPolarHBondContact O-CG2 3.35Å; V233-V237 PolarHBondContact O-N 2.94Å
234I89.8Confident86.5Confident108 Ų108100.9 Ų100.955%0.55455%0.548SS*.Hα-helixtrans-62.2-45178.4-64.5164.9000110.7D230 A231 A236 V237 V238D230-I234 VanDerWaalsContact O-CG1 3.32Å; D230-I234 WeakPolarHBondContact O-CG1 3.27Å; D230-I234 PolarHBondContact O-N 3.19Å; A231-I234 PolarHBondContact O-N 2.94Å; I234-A236 VanDerWaalsContact C-N 3.32Å; I234-A236 PolarHBondContact O-N 3.46Å; I234-V237 PolarHBondContact O-N 3.43Å; I234-V238 HydrophobicContact CG2-CG2 4.39Å; I234-V238 WeakPolarHBondContact O-CG2 3.37Å; I234-V238 PolarHBondContact O-N 3.43Å
235A92.4Very high87.6Confident61 Ų61100.8 Ų100.850%0.50455%0.549SS..Hα-helixtrans-61-39.6177.400000112.4A231 V233 V238 S239A231-A235 VanDerWaalsContact O-CB 3.32Å; A231-A235 WeakPolarHBondContact O-CB 3.38Å; A231-A235 PolarHBondContact O-N 3.43Å; V233-A235 PolarHBondContact O-N 2.92Å; A235-V238 PolarHBondContact O-N 3.4Å; A235-S239 WeakPolarHBondContact O-CB 3.44Å; A235-S239 PolarHBondContact O-N 3.2Å
236A93.1Very high88.8Confident60 Ų60103.6 Ų103.650%0.49656%0.556SS.*Hα-helixtrans-63.5-41.9175.300000112M232 V233 I234 S239 L240M232-A236 WeakPolarHBondContact O-CB 3.3Å; M232-A236 PolarHBondContact O-N 3.26Å; V233-A236 PolarHBondContact O-N 2.98Å; I234-A236 VanDerWaalsContact C-N 3.32Å; I234-A236 PolarHBondContact O-N 3.46Å; A236-S239 PolarHBondContact O-N 2.93Å; A236-L240 WeakPolarHBondContact O-CB 3.35Å; A236-L240 PolarHBondContact O-N 2.98Å
237V95.6Very high90Very high82 Ų8299.6 Ų99.650%0.49754%0.541SS..Hα-helixtrans-64.7-46.4176.8174.20000111V233 I234 S239 L240 C241V233-V237 WeakPolarHBondContact O-CG2 3.35Å; V233-V237 PolarHBondContact O-N 2.94Å; I234-V237 PolarHBondContact O-N 3.43Å; V237-S239 VanDerWaalsContact C-N 3.33Å; V237-S239 PolarHBondContact O-N 3.47Å; V237-L240 WeakPolarHBondContact O-CB 3.32Å; V237-L240 PolarHBondContact O-N 3.49Å; V237-C241 PolarHBondContact O-N 3.02Å; V237-C241 PolarHBondContact O-SG 2.79Å; V237-C241 VanDerWaalsContact O-SG 3.32Å
238V95.1Very high90.9Very high81 Ų8199.6 Ų99.649%0.49154%0.538SS..Hα-helixtrans-60.7-44.3177.21740000110.7I234 A235 L240 C241 L242I234-V238 HydrophobicContact CG2-CG2 4.39Å; I234-V238 WeakPolarHBondContact O-CG2 3.37Å; I234-V238 PolarHBondContact O-N 3.43Å; A235-V238 PolarHBondContact O-N 3.4Å; V238-L240 VanDerWaalsContact C-N 3.33Å; V238-L240 PolarHBondContact O-N 3.28Å; V238-C241 PolarHBondContact O-N 3.04Å; V238-L242 HydrophobicContact CG1-CD1 4.29Å; V238-L242 WeakPolarHBondContact O-CG 3.32Å; V238-L242 PolarHBondContact O-N 3.34Å
239S94.6Very high91.6Very high66 Ų66101.9 Ų101.946%0.46255%0.553SS.*Hα-helixtrans-59.7-42.7175.7-172.80000112.1A235 A236 V237 L242 I243A235-S239 WeakPolarHBondContact O-CB 3.44Å; A235-S239 PolarHBondContact O-N 3.2Å; A236-S239 PolarHBondContact O-N 2.93Å; V237-S239 VanDerWaalsContact C-N 3.33Å; V237-S239 PolarHBondContact O-N 3.47Å; S239-L242 PolarHBondContact O-N 3.46Å; S239-I243 WeakPolarHBondContact O-CD1 3.41Å; S239-I243 VanDerWaalsContact O-CG1 3.3Å; S239-I243 WeakPolarHBondContact O-CG1 3.41Å; S239-I243 PolarHBondContact O-N 3.01Å; S239-I243 VanDerWaalsContact O-N 3.08Å
240L95.7Very high92.4Very high105 Ų10598.5 Ų98.555%0.5555%0.552SS.*Hα-helixtrans-64.1-43.6177-171.279.9000111.4A236 V237 V238 L242 I243 L244A236-L240 WeakPolarHBondContact O-CB 3.35Å; A236-L240 PolarHBondContact O-N 2.98Å; V237-L240 WeakPolarHBondContact O-CB 3.32Å; V237-L240 PolarHBondContact O-N 3.49Å; V238-L240 VanDerWaalsContact C-N 3.33Å; V238-L240 PolarHBondContact O-N 3.28Å; L240-L242 VanDerWaalsContact C-N 3.34Å; L240-L242 PolarHBondContact O-N 3.44Å; L240-I243 PolarHBondContact O-N 3.45Å; L240-L244 WeakPolarHBondContact O-CG 3.46Å; L240-L244 PolarHBondContact O-N 3.31Å
241C95Very high92Very high66 Ų6699.1 Ų99.145%0.44657%0.566SS.*Hα-helixtrans-61.4-41.6177-70.90000112.1V237 V238 I243 L244 M245V237-C241 PolarHBondContact O-N 3.02Å; V237-C241 PolarHBondContact O-SG 2.79Å; V237-C241 VanDerWaalsContact O-SG 3.32Å; V238-C241 PolarHBondContact O-N 3.04Å; C241-I243 VanDerWaalsContact C-N 3.34Å; C241-L244 PolarHBondContact O-N 2.98Å; C241-M245 WeakPolarHBondContact O-CB 3.35Å; C241-M245 VanDerWaalsContact O-CG 3.27Å; C241-M245 WeakPolarHBondContact O-CG 3.37Å; C241-M245 PolarHBondContact O-N 3.44Å
242L95.1Very high92.3Very high109 Ų109100.9 Ų100.957%0.57157%0.568SS**Hα-helixtrans-64-39.4175.8-69.7176.4000111.9V238 S239 L240 M245 F246V238-L242 HydrophobicContact CG1-CD1 4.29Å; V238-L242 WeakPolarHBondContact O-CG 3.32Å; V238-L242 PolarHBondContact O-N 3.34Å; S239-L242 PolarHBondContact O-N 3.46Å; L240-L242 VanDerWaalsContact C-N 3.34Å; L240-L242 PolarHBondContact O-N 3.44Å; L242-M245 PolarHBondContact O-N 3.44Å; L242-F246 WeakPolarHBondContact O-CB 3.27Å; L242-F246 PolarHBondContact O-N 2.94Å
243I95.3Very high92.7Very high89 Ų8999.7 Ų99.746%0.45657%0.566SS.*Hα-helixtrans-64.1-44.7175.4-69.3163.7000110.9S239 L240 C241 F246 I247S239-I243 WeakPolarHBondContact O-CD1 3.41Å; S239-I243 VanDerWaalsContact O-CG1 3.3Å; S239-I243 WeakPolarHBondContact O-CG1 3.41Å; S239-I243 PolarHBondContact O-N 3.01Å; S239-I243 VanDerWaalsContact O-N 3.08Å; L240-I243 PolarHBondContact O-N 3.45Å; C241-I243 VanDerWaalsContact C-N 3.34Å; I243-F246 PolarHBondContact O-N 3.39Å; I243-I247 HydrophobicContact CG2-CD1 3.87Å; I243-I247 WeakPolarHBondContact O-CG1 3.37Å; I243-I247 PolarHBondContact O-N 3.48Å
244L94.6Very high93Very high101 Ų101100.2 Ų100.253%0.52957%0.567SS.*Hα-helixtrans-64.3-41.1177.2-69.9175000112.1L240 C241 F246 I247 Y248L240-L244 WeakPolarHBondContact O-CG 3.46Å; L240-L244 PolarHBondContact O-N 3.31Å; C241-L244 PolarHBondContact O-N 2.98Å; L244-F246 VanDerWaalsContact C-N 3.31Å; L244-F246 PolarHBondContact O-N 2.92Å; L244-I247 PolarHBondContact O-N 3.25Å; L244-Y248 VanDerWaalsContact O-CB 3.31Å; L244-Y248 WeakPolarHBondContact O-CB 3.31Å; L244-Y248 PolarHBondContact O-N 2.84Å
245M93.9Very high93.1Very high132 Ų13299.8 Ų99.865%0.6557%0.568SS**Hα-helixtrans-61.8-40.9173.9-73.5-116-71.200111.5C241 L242 Y248 S249C241-M245 WeakPolarHBondContact O-CB 3.35Å; C241-M245 VanDerWaalsContact O-CG 3.27Å; C241-M245 WeakPolarHBondContact O-CG 3.37Å; C241-M245 PolarHBondContact O-N 3.44Å; L242-M245 PolarHBondContact O-N 3.44Å; M245-Y248 PolarHBondContact O-N 3.44Å; M245-S249 WeakPolarHBondContact O-CB 3.49Å; M245-S249 PolarHBondContact O-N 2.86Å; M245-S249 PolarHBondContact O-OG 3.36Å
246F95.1Very high93.2Very high140 Ų140102.2 Ų102.261%0.61457%0.572SS**Hα-helixtrans-64.2-47.5176.7-173.6-99.1000111.6L242 I243 L244 Y248 S249 V250L242-F246 WeakPolarHBondContact O-CB 3.27Å; L242-F246 PolarHBondContact O-N 2.94Å; I243-F246 PolarHBondContact O-N 3.39Å; L244-F246 VanDerWaalsContact C-N 3.31Å; L244-F246 PolarHBondContact O-N 2.92Å; F246-Y248 VanDerWaalsContact C-N 3.33Å; F246-Y248 PolarHBondContact O-N 2.91Å; F246-S249 PolarHBondContact O-N 3.22Å; F246-S249 PolarHBondContact O-OG 2.95Å; F246-V250 HydrophobicContact CE1-CG2 4.12Å; F246-V250 HydrophobicContact CZ-CG2 4.17Å; F246-V250 WeakPolarHBondContact O-CB 3.43Å; F246-V250 PolarHBondContact O-N 2.96Å
247I94.7Very high93.2Very high89 Ų89105 Ų10546%0.45658%0.577SS.*Hα-helixtrans-59.9-43.9176.1-68.2167.7000111.1I243 L244 V250 S251I243-I247 HydrophobicContact CG2-CD1 3.87Å; I243-I247 WeakPolarHBondContact O-CG1 3.37Å; I243-I247 PolarHBondContact O-N 3.48Å; L244-I247 PolarHBondContact O-N 3.25Å; I247-V250 PolarHBondContact O-N 3.46Å; I247-S251 PolarHBondContact O-N 3.27Å; I247-S251 PolarHBondContact O-OG 2.92Å
248Y93.9Very high93Very high186 Ų186106.6 Ų106.673%0.72958%0.583SS**Hα-helixtrans-65.9-38.1177.4-179.6-102.4000112.2L244 M245 F246 V250 S251L244-Y248 VanDerWaalsContact O-CB 3.31Å; L244-Y248 WeakPolarHBondContact O-CB 3.31Å; L244-Y248 PolarHBondContact O-N 2.84Å; M245-Y248 PolarHBondContact O-N 3.44Å; F246-Y248 VanDerWaalsContact C-N 3.33Å; F246-Y248 PolarHBondContact O-N 2.91Å; Y248-V250 VanDerWaalsContact C-N 3.27Å; Y248-V250 PolarHBondContact O-N 3.32Å; Y248-S251 PolarHBondContact O-N 2.9Å; Y248-S251 VanDerWaalsContact O-OXT 3.06Å
249S91.7Very high92.9Very high87 Ų87108.6 Ų108.661%0.60859%0.59SS**Hα-helixtrans-70.9-24.7176.873.40000113.5M245 F246M245-S249 WeakPolarHBondContact O-CB 3.49Å; M245-S249 PolarHBondContact O-N 2.86Å; M245-S249 PolarHBondContact O-OG 3.36Å; F246-S249 PolarHBondContact O-N 3.22Å; F246-S249 PolarHBondContact O-OG 2.95Å
250V91.9Very high92.7Very high104 Ų104112.2 Ų112.263%0.6360%0.6SS**Hα-helixtrans-84.5-25.5177.4146.90000112.2F246 I247 Y248F246-V250 HydrophobicContact CE1-CG2 4.12Å; F246-V250 HydrophobicContact CZ-CG2 4.17Å; F246-V250 WeakPolarHBondContact O-CB 3.43Å; F246-V250 PolarHBondContact O-N 2.96Å; I247-V250 PolarHBondContact O-N 3.46Å; Y248-V250 VanDerWaalsContact C-N 3.27Å; Y248-V250 PolarHBondContact O-N 3.32Å
251S75.9Confident92.5Very high138 Ų138112.8 Ų112.897%0.96561%0.605SS**  trans-86.60178.4-58.80000111.5I247 Y248I247-S251 PolarHBondContact O-N 3.27Å; I247-S251 PolarHBondContact O-OG 2.92Å; Y248-S251 PolarHBondContact O-N 2.9Å; Y248-S251 VanDerWaalsContact O-OXT 3.06Å

Retrieved 251 of 251 residues in 243.2 ms (Link to these results)