A0A087YM34_POEFO Loading...

SOWAHA-C winged helix-turn-helix domain-containing protein

AlphaFold DB , UniProt , Accession A0A087YM34, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 385 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
1D66.7Low78.6Confident131 Ų13170 Ų7070%0.70140%0.396SS*.  0-33.60-52.2-58.7000115.6V3 L4 V5D1-V3 PolarHBondContact O-N 2.91Å; D1-L4 WeakPolarHBondContact O-CA 3.31Å; D1-L4 WeakPolarHBondContact O-CB 3.43Å; D1-L4 PolarHBondContact O-N 3.29Å; D1-V5 PolarHBondContact O-N 3.33Å
2A77.6Confident78.5Confident64 Ų6464.8 Ų64.853%0.52937%0.369SS..Hα-helixtrans-46.2-38.5-178.900000115.9L4 V5 F6 F23A2-L4 VanDerWaalsContact C-N 3.35Å; A2-L4 PolarHBondContact O-N 2.99Å; A2-V5 PolarHBondContact O-N 2.88Å; A2-F6 WeakPolarHBondContact O-CB 3.44Å; A2-F6 PolarHBondContact O-N 3.32Å; A2-F23 HydrophobicContact CB-CE1 3.87Å; A2-F23 HydrophobicContact CB-CZ 4.14Å
3V78Confident78.8Confident9 Ų964.2 Ų64.26%0.05537%0.372CS..Hα-helixtrans-66.9-31.7176.7-1770000113D1 L7 L19 F23 F40 F43 V44D1-V3 PolarHBondContact O-N 2.91Å; V3-L7 HydrophobicContact CG1-CD1 4.08Å; V3-L7 WeakPolarHBondContact O-CB 3.45Å; V3-L7 WeakPolarHBondContact O-CG 3.33Å; V3-L7 PolarHBondContact O-N 2.76Å; V3-L19 HydrophobicContact CG1-CD1 4.17Å; V3-F23 HydrophobicContact CB-CE2 4.32Å; V3-F23 HydrophobicContact CB-CZ 4.38Å; V3-F23 HydrophobicContact CG2-CD2 4.16Å; V3-F23 HydrophobicContact CG2-CE1 4.2Å; V3-F23 HydrophobicContact CG2-CE2 3.8Å; V3-F23 HydrophobicContact CG2-CZ 3.83Å; V3-F40 HydrophobicContact CG2-CD2 4.03Å; V3-F40 HydrophobicContact CG2-CE2 3.51Å; V3-F40 HydrophobicContact CG2-CZ 4.33Å; V3-F43 HydrophobicContact CB-CD1 3.94Å; V3-F43 HydrophobicContact CB-CE1 3.92Å; V3-F43 HydrophobicContact CG1-CD1 4.5Å; V3-F43 HydrophobicContact CG2-CD1 4.36Å; V3-V44 HydrophobicContact CG1-CG2 4.1Å
4L80.8Confident79.3Confident29 Ų2959.9 Ų59.915%0.15235%0.347CS..Hα-helixtrans-64.6-52.1174.2-174.584.8000109.9D1 A2 F6 L7 Q8 F43 V47 L61 Y65D1-L4 WeakPolarHBondContact O-CA 3.31Å; D1-L4 WeakPolarHBondContact O-CB 3.43Å; D1-L4 PolarHBondContact O-N 3.29Å; A2-L4 VanDerWaalsContact C-N 3.35Å; A2-L4 PolarHBondContact O-N 2.99Å; L4-F6 VanDerWaalsContact C-N 3.35Å; L4-F6 PolarHBondContact O-N 3.26Å; L4-L7 PolarHBondContact O-N 3.23Å; L4-Q8 WeakPolarHBondContact O-CB 3.13Å; L4-Q8 WeakPolarHBondContact O-CG 3.2Å; L4-Q8 PolarHBondContact O-N 3.27Å; L4-F43 HydrophobicContact CB-CE1 4.48Å; L4-V47 HydrophobicContact CD1-CG1 3.66Å; L4-V47 HydrophobicContact CD1-CG2 4.44Å; L4-L61 HydrophobicContact CD1-CD1 4.29Å; L4-Y65 HydrophobicContact CD1-CD1 3.88Å; L4-Y65 HydrophobicContact CD1-CD2 4.43Å; L4-Y65 HydrophobicContact CD1-CG 3.79Å
5V80.3Confident79.7Confident87 Ų8762.3 Ų62.353%0.52735%0.352SS..Hα-helixtrans-61.8-42.7-179.5-178.90000111D1 A2 Q8 R9D1-V5 PolarHBondContact O-N 3.33Å; A2-V5 PolarHBondContact O-N 2.88Å; V5-Q8 PolarHBondContact O-N 2.79Å; V5-R9 WeakPolarHBondContact O-CB 3.18Å; V5-R9 PolarHBondContact O-N 3.21Å
6F82.4Confident80Confident35 Ų3561.9 Ų61.915%0.15435%0.349CS..Hα-helixtrans-59.2-51.2174.1-178.6-93.7000111.8A2 L4 Q8 R9 C10 A14 L19 H22 F23A2-F6 WeakPolarHBondContact O-CB 3.44Å; A2-F6 PolarHBondContact O-N 3.32Å; L4-F6 VanDerWaalsContact C-N 3.35Å; L4-F6 PolarHBondContact O-N 3.26Å; F6-Q8 VanDerWaalsContact C-N 3.29Å; F6-Q8 PolarHBondContact O-N 3.36Å; F6-R9 PolarHBondContact O-N 3Å; F6-C10 PolarHBondContact O-N 3Å; F6-C10 PolarHBondContact O-SG 3.09Å; F6-C10 VanDerWaalsContact O-SG 3.38Å; F6-A14 HydrophobicContact CE1-CB 3.96Å; F6-L19 HydrophobicContact CE1-CB 4.13Å; F6-H22 HydrophobicContact CD2-CB 4.19Å; F6-H22 AromaticContact CD2-CD2 3.65Å; F6-H22 AromaticContact CD2-CG 3.68Å; F6-H22 AromaticContact CD2-ND1 3.97Å; F6-H22 AromaticContact CD2-NE2 3.92Å; F6-H22 HydrophobicContact CE2-CB 3.65Å; F6-H22 AromaticContact CE2-CD2 3.5Å; F6-H22 AromaticContact CE2-CG 3.54Å; F6-H22 HydrophobicContact CZ-CB 3.99Å; F6-F23 HydrophobicContact CB-CE2 4.03Å; F6-F23 HydrophobicContact CB-CZ 4.06Å; F6-F23 HydrophobicContact CD1-CE2 4.22Å; F6-F23 HydrophobicContact CG-CE2 4Å; F6-F23 HydrophobicContact CG-CZ 4.42Å
7L82.1Confident80.3Confident0 Ų063.9 Ų63.90%036%0.363CS..Hα-helixtrans-65.5-29.9179.1-74.1171.6000113.1V3 L4 G12 A14 L19 A48 V59 L61V3-L7 HydrophobicContact CG1-CD1 4.08Å; V3-L7 WeakPolarHBondContact O-CB 3.45Å; V3-L7 WeakPolarHBondContact O-CG 3.33Å; V3-L7 PolarHBondContact O-N 2.76Å; L4-L7 PolarHBondContact O-N 3.23Å; L7-G12 VanDerWaalsContact O-CA 3.23Å; L7-G12 WeakPolarHBondContact O-CA 3.5Å; L7-G12 PolarHBondContact O-N 2.88Å; L7-A14 HydrophobicContact CD2-CB 3.77Å; L7-L19 HydrophobicContact CD1-CD1 4.4Å; L7-L19 HydrophobicContact CD2-CD1 4.03Å; L7-L19 HydrophobicContact CG-CD1 4.29Å; L7-A48 HydrophobicContact CD1-CB 4.19Å; L7-V59 HydrophobicContact CD1-CG1 4.05Å; L7-V59 HydrophobicContact CD2-CB 4.39Å; L7-V59 HydrophobicContact CD2-CG1 4.22Å; L7-L61 HydrophobicContact CB-CD1 3.97Å; L7-L61 HydrophobicContact CD1-CD1 3.98Å
8Q81.8Confident80.5Confident60 Ų6064.6 Ų64.628%0.2836%0.363SS..Hα-helixtrans-71-43.4172.9-74.7170.7-23.700111.4L4 V5 F6 C10 G11 L61 Y65 T68L4-Q8 WeakPolarHBondContact O-CB 3.13Å; L4-Q8 WeakPolarHBondContact O-CG 3.2Å; L4-Q8 PolarHBondContact O-N 3.27Å; V5-Q8 PolarHBondContact O-N 2.79Å; F6-Q8 VanDerWaalsContact C-N 3.29Å; F6-Q8 PolarHBondContact O-N 3.36Å; Q8-C10 PolarHBondContact O-N 3.31Å; Q8-G11 PolarHBondContact O-N 3.18Å; Q8-L61 HydrophobicContact CG-CD2 3.84Å; Q8-Y65 PolarHBondContact NE2-O 2.91Å; Q8-T68 PolarHBondContact NE2-OG1 2.94Å
9R80.8Confident80.6Confident232 Ų23261.3 Ų61.388%0.87534%0.344SS*.Hα-helixtrans-62.7-28.6173.6-170.9171-179.8155.60.7112.8V5 F6 G11V5-R9 WeakPolarHBondContact O-CB 3.18Å; V5-R9 PolarHBondContact O-N 3.21Å; F6-R9 PolarHBondContact O-N 3Å; R9-G11 VanDerWaalsContact C-N 3.26Å; R9-G11 PolarHBondContact O-N 3.28Å
10C77.4Confident80.7Confident51 Ų5161.2 Ų61.235%0.34534%0.342SS..THydrogen-bonded Turntrans-83.519.5170.1-62.50000114.2F6 Q8 G12 S13 A14F6-C10 PolarHBondContact O-N 3Å; F6-C10 PolarHBondContact O-SG 3.09Å; F6-C10 VanDerWaalsContact O-SG 3.38Å; Q8-C10 PolarHBondContact O-N 3.31Å; C10-G12 VanDerWaalsContact C-N 3.29Å; C10-G12 PolarHBondContact O-N 2.92Å; C10-S13 PolarHBondContact O-N 2.84Å; C10-A14 HydrophobicContact CB-CB 4.09Å
11G76.9Confident80.8Confident72 Ų7261.5 Ų61.574%0.74235%0.352SS*.THydrogen-bonded Turntrans70.718.817600000115.1Q8 R9Q8-G11 PolarHBondContact O-N 3.18Å; R9-G11 VanDerWaalsContact C-N 3.26Å; R9-G11 PolarHBondContact O-N 3.28Å
12G77.6Confident81.5Confident7 Ų759.4 Ų59.47%0.07234%0.338CS..THydrogen-bonded Turntrans91.95.6179.300000115.2L7 C10 L61L7-G12 VanDerWaalsContact O-CA 3.23Å; L7-G12 WeakPolarHBondContact O-CA 3.5Å; L7-G12 PolarHBondContact O-N 2.88Å; C10-G12 VanDerWaalsContact C-N 3.29Å; C10-G12 PolarHBondContact O-N 2.92Å; G12-L61 VanDerWaalsContact O-CB 3.28Å; G12-L61 WeakPolarHBondContact O-CB 3.44Å; G12-L61 PolarHBondContact O-N 3.02Å
13S81.6Confident81.5Confident57 Ų5757 Ų5740%0.39932%0.316SS..EExtended strand (participates in β ladder)trans-156.3138.1170.456.10000112.8C10 V59C10-S13 PolarHBondContact O-N 2.84Å; S13-V59 VanDerWaalsContact CA-O 3.31Å; S13-V59 WeakPolarHBondContact CA-O 3.48Å
14A86.2Confident81.3Confident4 Ų460.6 Ų60.63%0.03333%0.334CS..EExtended strand (participates in β ladder)trans-133154.817400000111.2F6 L7 C10 V59F6-A14 HydrophobicContact CE1-CB 3.96Å; L7-A14 HydrophobicContact CD2-CB 3.77Å; C10-A14 HydrophobicContact CB-CB 4.09Å; A14-V59 PolarHBondContact N-O 2.96Å; A14-V59 VanDerWaalsContact N-O 3.08Å; A14-V59 PolarHBondContact O-N 2.94Å
15K85.7Confident81Confident97 Ų9762 Ų6242%0.42235%0.346SS..EExtended strand (participates in β ladder)trans-68.7146171.3-54.6-174.9-165.589.60109.2T17 E18 L19 V56K15-T17 WeakPolarHBondContact CB-OG1 3.27Å; K15-T17 PolarHBondContact O-N 2.81Å; K15-E18 HydrophobicContact CB-CB 4.49Å; K15-E18 HydrophobicContact CB-CG 4.12Å; K15-E18 WeakPolarHBondContact CB-OE2 3.41Å; K15-E18 VanDerWaalsContact CD-OE1 3.32Å; K15-E18 WeakPolarHBondContact CD-OE1 3.38Å; K15-E18 WeakPolarHBondContact CG-OE1 3.28Å; K15-E18 WeakPolarHBondContact CG-OE2 3.45Å; K15-E18 PolarHBondContact N-OE2 3.29Å; K15-E18 IonicContact NZ-OE1 3.54Å; K15-E18 PolarHBondContact NZ-OE1 3.49Å; K15-E18 PolarHBondContact O-N 2.87Å; K15-E18 VanDerWaalsContact O-N 3.1Å; K15-L19 PolarHBondContact O-N 3.03Å; K15-V56 HydrophobicContact CB-CG1 4.48Å; K15-V56 HydrophobicContact CD-CG1 4.33Å; K15-V56 HydrophobicContact CG-CG1 4.41Å
16N84.8Confident80.5Confident55 Ų5565.9 Ų65.929%0.29435%0.352SS..Hα-helixtrans-61.1-26.7177.3-17570.6000112.3L20 S57 V59N16-L20 WeakPolarHBondContact ND2-CD1 3.43Å; N16-L20 VanDerWaalsContact O-CB 3.28Å; N16-L20 WeakPolarHBondContact O-CB 3.16Å; N16-L20 WeakPolarHBondContact O-CG 3.4Å; N16-L20 PolarHBondContact O-N 3.12Å; N16-S57 WeakPolarHBondContact CB-O 3.29Å; N16-S57 PolarHBondContact N-O 3.01Å; N16-V59 HydrophobicContact CB-CG2 4.34Å
17T84.8Confident79.9Confident96 Ų9666.1 Ų66.159%0.58936%0.355SS*.Hα-helixtrans-66.5-44.9172.745.10000112.7K15 L20 A21K15-T17 WeakPolarHBondContact CB-OG1 3.27Å; K15-T17 PolarHBondContact O-N 2.81Å; T17-L20 PolarHBondContact O-N 3.02Å; T17-A21 WeakPolarHBondContact O-CB 3.16Å; T17-A21 PolarHBondContact O-N 3.1Å
18E83.1Confident79.1Confident77 Ų7775.6 Ų75.636%0.3639%0.39SS..Hα-helixtrans-67.8-45.2179.2-65.7153.7-178.700111.1K15 A21 H22K15-E18 HydrophobicContact CB-CB 4.49Å; K15-E18 HydrophobicContact CB-CG 4.12Å; K15-E18 WeakPolarHBondContact CB-OE2 3.41Å; K15-E18 VanDerWaalsContact CD-OE1 3.32Å; K15-E18 WeakPolarHBondContact CD-OE1 3.38Å; K15-E18 WeakPolarHBondContact CG-OE1 3.28Å; K15-E18 WeakPolarHBondContact CG-OE2 3.45Å; K15-E18 PolarHBondContact N-OE2 3.29Å; K15-E18 IonicContact NZ-OE1 3.54Å; K15-E18 PolarHBondContact NZ-OE1 3.49Å; K15-E18 PolarHBondContact O-N 2.87Å; K15-E18 VanDerWaalsContact O-N 3.1Å; E18-A21 PolarHBondContact O-N 3.19Å; E18-H22 PolarHBondContact O-N 3.44Å; E18-H22 VanDerWaalsContact O-N 3.09Å
19L83.4Confident78.1Confident2 Ų278 Ų781%0.0141%0.405CS..Hα-helixtrans-62.8-41.2176.1178.4145.3000111.6V3 F6 L7 K15 F23 F40 V59V3-L19 HydrophobicContact CG1-CD1 4.17Å; F6-L19 HydrophobicContact CE1-CB 4.13Å; L7-L19 HydrophobicContact CD1-CD1 4.4Å; L7-L19 HydrophobicContact CD2-CD1 4.03Å; L7-L19 HydrophobicContact CG-CD1 4.29Å; K15-L19 PolarHBondContact O-N 3.03Å; L19-F23 HydrophobicContact CG-CD2 4.4Å; L19-F23 VanDerWaalsContact O-CD2 3.27Å; L19-F23 WeakPolarHBondContact O-CD2 3.16Å; L19-F23 PolarHBondContact O-N 3.48Å; L19-F40 HydrophobicContact CD2-CE1 3.99Å; L19-F40 HydrophobicContact CD2-CZ 3.68Å; L19-V59 HydrophobicContact CD1-CB 4.19Å; L19-V59 HydrophobicContact CD1-CG1 4.06Å; L19-V59 HydrophobicContact CD1-CG2 4.24Å
20L81.8Confident77Confident59 Ų5971.4 Ų71.431%0.30939%0.387SS..Hα-helixtrans-69.6-40.9173.7-73.3173.6000112N16 T17 H22 F23 L24N16-L20 WeakPolarHBondContact ND2-CD1 3.43Å; N16-L20 VanDerWaalsContact O-CB 3.28Å; N16-L20 WeakPolarHBondContact O-CB 3.16Å; N16-L20 WeakPolarHBondContact O-CG 3.4Å; N16-L20 PolarHBondContact O-N 3.12Å; T17-L20 PolarHBondContact O-N 3.02Å; L20-H22 VanDerWaalsContact C-N 3.29Å; L20-H22 PolarHBondContact O-N 2.96Å; L20-F23 PolarHBondContact O-N 2.9Å; L20-L24 HydrophobicContact CB-CD1 4.28Å; L20-L24 HydrophobicContact CB-CG 4.47Å; L20-L24 WeakPolarHBondContact O-CA 3.5Å; L20-L24 WeakPolarHBondContact O-CB 3.21Å; L20-L24 WeakPolarHBondContact O-CD1 3.37Å; L20-L24 WeakPolarHBondContact O-CG 3.28Å; L20-L24 PolarHBondContact O-N 2.93Å
21A83.2Confident75.9Confident67 Ų6774.8 Ų74.855%0.55441%0.409SS*.Hα-helixtrans-56.6-41.9177.800000112.4T17 E18T17-A21 WeakPolarHBondContact O-CB 3.16Å; T17-A21 PolarHBondContact O-N 3.1Å; E18-A21 PolarHBondContact O-N 3.19Å
22H80.4Confident75.1Confident87 Ų8779.5 Ų79.540%0.40341%0.411SS..Hα-helixtrans-69.7-35.7177.7-171.5-81.7000113.6F6 E18 L20F6-H22 HydrophobicContact CD2-CB 4.19Å; F6-H22 AromaticContact CD2-CD2 3.65Å; F6-H22 AromaticContact CD2-CG 3.68Å; F6-H22 AromaticContact CD2-ND1 3.97Å; F6-H22 AromaticContact CD2-NE2 3.92Å; F6-H22 HydrophobicContact CE2-CB 3.65Å; F6-H22 AromaticContact CE2-CD2 3.5Å; F6-H22 AromaticContact CE2-CG 3.54Å; F6-H22 HydrophobicContact CZ-CB 3.99Å; E18-H22 PolarHBondContact O-N 3.44Å; E18-H22 VanDerWaalsContact O-N 3.09Å; L20-H22 VanDerWaalsContact C-N 3.29Å; L20-H22 PolarHBondContact O-N 2.96Å
23F79Confident74.2Confident14 Ų1480.2 Ų80.26%0.06141%0.413CS..Hα-helixtrans-101.6-5.8-174.5-68.3-67.6000115.1A2 V3 F6 L19 L20 Y26 L27 F40A2-F23 HydrophobicContact CB-CE1 3.87Å; A2-F23 HydrophobicContact CB-CZ 4.14Å; V3-F23 HydrophobicContact CB-CE2 4.32Å; V3-F23 HydrophobicContact CB-CZ 4.38Å; V3-F23 HydrophobicContact CG2-CD2 4.16Å; V3-F23 HydrophobicContact CG2-CE1 4.2Å; V3-F23 HydrophobicContact CG2-CE2 3.8Å; V3-F23 HydrophobicContact CG2-CZ 3.83Å; F6-F23 HydrophobicContact CB-CE2 4.03Å; F6-F23 HydrophobicContact CB-CZ 4.06Å; F6-F23 HydrophobicContact CD1-CE2 4.22Å; F6-F23 HydrophobicContact CG-CE2 4Å; F6-F23 HydrophobicContact CG-CZ 4.42Å; L19-F23 HydrophobicContact CG-CD2 4.4Å; L19-F23 VanDerWaalsContact O-CD2 3.27Å; L19-F23 WeakPolarHBondContact O-CD2 3.16Å; L19-F23 PolarHBondContact O-N 3.48Å; L20-F23 PolarHBondContact O-N 2.9Å; F23-Y26 HydrophobicContact CD1-CD2 4.26Å; F23-L27 VanDerWaalsContact O-CG 3.29Å; F23-L27 WeakPolarHBondContact O-CG 3.32Å; F23-L27 PolarHBondContact O-N 3.41Å; F23-L27 VanDerWaalsContact O-N 3.12Å; F23-F40 HydrophobicContact CB-CE2 3.59Å; F23-F40 HydrophobicContact CB-CZ 3.8Å; F23-F40 HydrophobicContact CD1-CE2 4.23Å; F23-F40 AromaticContact CD2-CE2 3.83Å; F23-F40 HydrophobicContact CD2-CE2 3.83Å; F23-F40 AromaticContact CD2-CZ 4Å; F23-F40 HydrophobicContact CD2-CZ 4Å; F23-F40 AromaticContact CG-CE2 3.6Å; F23-F40 HydrophobicContact CG-CE2 3.6Å; F23-F40 HydrophobicContact CG-CZ 4.05Å
24L74.1Confident73.1Confident84 Ų8484 Ų8444%0.4443%0.434SS..Hα-helixtrans-60.2-41.9178.7-94.1165.2000114.7L20 L27 R28L20-L24 HydrophobicContact CB-CD1 4.28Å; L20-L24 HydrophobicContact CB-CG 4.47Å; L20-L24 WeakPolarHBondContact O-CA 3.5Å; L20-L24 WeakPolarHBondContact O-CB 3.21Å; L20-L24 WeakPolarHBondContact O-CD1 3.37Å; L20-L24 WeakPolarHBondContact O-CG 3.28Å; L20-L24 PolarHBondContact O-N 2.93Å; L24-L27 PolarHBondContact O-N 2.99Å; L24-R28 VanDerWaalsContact O-CB 3.31Å; L24-R28 WeakPolarHBondContact O-CB 3.48Å; L24-R28 PolarHBondContact O-N 2.96Å
25P73.5Confident72.2Confident60 Ų6085.3 Ų85.339%0.3945%0.448SS..Hα-helixtrans-60.5-53.8176.2-23.334.4000111.5L27 R28 D29P25-L27 PolarHBondContact O-N 3.47Å; P25-R28 PolarHBondContact O-N 2.8Å; P25-D29 WeakPolarHBondContact CA-OD2 3.33Å; P25-D29 PolarHBondContact O-N 3.46Å; P25-D29 VanDerWaalsContact O-OD2 3.09Å
26Y70Confident71.5Confident167 Ų16783.1 Ų83.166%0.65544%0.441SS*.Hα-helixtrans-54.9-26.5176.2-59.6-80.1000114.2F23 N33F23-Y26 HydrophobicContact CD1-CD2 4.26Å; Y26-N33 PolarHBondContact O-ND2 2.84Å
27L69.8Low70.9Confident41 Ų4189 Ų8922%0.21546%0.459CS..Hα-helixtrans-87.9-24.4175.6-71.6170.2000113.9F23 L24 P25 N33 F40F23-L27 VanDerWaalsContact O-CG 3.29Å; F23-L27 WeakPolarHBondContact O-CG 3.32Å; F23-L27 PolarHBondContact O-N 3.41Å; F23-L27 VanDerWaalsContact O-N 3.12Å; L24-L27 PolarHBondContact O-N 2.99Å; P25-L27 PolarHBondContact O-N 3.47Å; L27-N33 VanDerWaalsContact C-ND2 3.3Å; L27-N33 PolarHBondContact O-ND2 2.61Å; L27-F40 HydrophobicContact CD1-CD1 4.38Å; L27-F40 HydrophobicContact CD1-CE1 4.48Å; L27-F40 HydrophobicContact CD1-CG 4.43Å; L27-F40 HydrophobicContact CD2-CB 4.23Å; L27-F40 HydrophobicContact CD2-CG 4.44Å
28R65.7Low70.5Confident198 Ų19888.3 Ų88.375%0.74745%0.452SS*.Hα-helixtrans-94.7-34.2-174.6179.1173.9-81.9-174.8-6.2113.4L24 P25 N30L24-R28 VanDerWaalsContact O-CB 3.31Å; L24-R28 WeakPolarHBondContact O-CB 3.48Å; L24-R28 PolarHBondContact O-N 2.96Å; P25-R28 PolarHBondContact O-N 2.8Å; R28-N30 PolarHBondContact O-N 3.32Å
29D59.9Low70.2Confident110 Ų11093 Ų9359%0.58847%0.466SS*.SBendtrans-93.415.9-159.3-53.8-27.7000114.8P25P25-D29 WeakPolarHBondContact CA-OD2 3.33Å; P25-D29 PolarHBondContact O-N 3.46Å; P25-D29 VanDerWaalsContact O-OD2 3.09Å
30N57.5Low70.1Confident95 Ų9594.5 Ų94.551%0.50847%0.473SS..  trans-132.6124.8-178.6-102.9-65.4000112.5R28 E32 N33R28-N30 PolarHBondContact O-N 3.32Å; N30-E32 VanDerWaalsContact C-N 3.31Å; N30-E32 PolarHBondContact O-N 3.23Å; N30-N33 WeakPolarHBondContact CB-OD1 3.36Å; N30-N33 WeakPolarHBondContact O-CB 3.34Å; N30-N33 PolarHBondContact O-N 3.09Å
31P55.2Low70.1Confident122 Ų12297.8 Ų97.879%0.79249%0.485SS*.THydrogen-bonded Turntrans-71.2-21.2-177.127.8-34.2000114N33P31-N33 PolarHBondContact O-N 3.18Å
32E58.9Low70.1Confident170 Ų17098.3 Ų98.379%0.79448%0.484SS*.THydrogen-bonded Turntrans-77.2-1.4175.6-58.1-168.3165.600113.7N30 V34N30-E32 VanDerWaalsContact C-N 3.31Å; N30-E32 PolarHBondContact O-N 3.23Å; E32-V34 PolarHBondContact O-N 3.3Å
33N58.8Low70.2Confident22 Ų2297.1 Ų97.112%0.11848%0.478CS..G310 helixtrans-69.78.7-168.4-85.9-3.3000116.8Y26 L27 N30 P31 G35 N36Y26-N33 PolarHBondContact O-ND2 2.84Å; L27-N33 VanDerWaalsContact C-ND2 3.3Å; L27-N33 PolarHBondContact O-ND2 2.61Å; N30-N33 WeakPolarHBondContact CB-OD1 3.36Å; N30-N33 WeakPolarHBondContact O-CB 3.34Å; N30-N33 PolarHBondContact O-N 3.09Å; P31-N33 PolarHBondContact O-N 3.18Å; N33-G35 PolarHBondContact O-N 2.99Å; N33-N36 HydrophobicContact CB-CB 4.12Å; N33-N36 PolarHBondContact O-N 2.88Å; N33-N36 PolarHBondContact OD1-ND2 3.4Å
34V59.6Low70.4Confident136 Ų13697 Ų9782%0.82448%0.478SS*.G310 helixtrans-50.7-37.9-172.8-175.50000112.8E32E32-V34 PolarHBondContact O-N 3.3Å
35G66.5Low70.9Confident33 Ų3397.2 Ų97.234%0.3448%0.48SS..G310 helixtrans-98.9-6.317400000116.2N33 R37 D38 R39N33-G35 PolarHBondContact O-N 2.99Å; G35-R37 PolarHBondContact O-N 2.95Å; G35-D38 PolarHBondContact O-N 3.23Å; G35-R39 WeakPolarHBondContact O-CG 3.3Å; G35-R39 PolarHBondContact O-N 3.38Å
36N71.4Confident71.3Confident51 Ų5196.9 Ų96.927%0.27348%0.479SS..Hα-helixtrans-72.7-29.6-172-85.3-8.8000113.3N33 D38 R39 F40N33-N36 HydrophobicContact CB-CB 4.12Å; N33-N36 PolarHBondContact O-N 2.88Å; N33-N36 PolarHBondContact OD1-ND2 3.4Å; N36-D38 VanDerWaalsContact C-N 3.29Å; N36-D38 PolarHBondContact O-N 2.9Å; N36-R39 WeakPolarHBondContact OD1-CD 3.33Å; N36-R39 PolarHBondContact OD1-NH1 3.39Å; N36-F40 VanDerWaalsContact O-CB 3.28Å; N36-F40 WeakPolarHBondContact O-CB 3.46Å; N36-F40 PolarHBondContact O-N 2.85Å
37R73.1Confident71.8Confident179 Ų17989.1 Ų89.168%0.67545%0.449SS*.Hα-helixtrans-62.2-37.1169.5-172.2-179.266.7-175.5-4.2112.2G35 K41G35-R37 PolarHBondContact O-N 2.95Å; R37-K41 WeakPolarHBondContact O-CB 3.4Å; R37-K41 PolarHBondContact O-N 3.42Å
38D74.7Confident72.5Confident80 Ų8087.3 Ų87.343%0.42844%0.44SS..Hα-helixtrans-82.8-32.8-178.4-63.8-46.5000112.2G35 N36 K41 S42G35-D38 PolarHBondContact O-N 3.23Å; N36-D38 VanDerWaalsContact C-N 3.29Å; N36-D38 PolarHBondContact O-N 2.9Å; D38-K41 PolarHBondContact O-N 3.35Å; D38-S42 VanDerWaalsContact O-CB 3.3Å; D38-S42 WeakPolarHBondContact O-CB 3.43Å; D38-S42 PolarHBondContact O-N 3.32Å
39R78.3Confident73.4Confident175 Ų17581 Ų8166%0.6642%0.423SS*.Hα-helixtrans-58.5-46.3164.2-72.2165.2171.6171.3-2.8111.4G35 N36 S42 F43G35-R39 WeakPolarHBondContact O-CG 3.3Å; G35-R39 PolarHBondContact O-N 3.38Å; N36-R39 WeakPolarHBondContact OD1-CD 3.33Å; N36-R39 PolarHBondContact OD1-NH1 3.39Å; R39-S42 PolarHBondContact O-N 3.4Å; R39-F43 PolarHBondContact O-N 3.35Å
40F80Confident74.6Confident35 Ų3579.7 Ų79.715%0.15442%0.419CS..Hα-helixtrans-59.6-49.3175.4-178.9-94.4000111.8V3 L19 F23 L27 N36 S42 F43 V44V3-F40 HydrophobicContact CG2-CD2 4.03Å; V3-F40 HydrophobicContact CG2-CE2 3.51Å; V3-F40 HydrophobicContact CG2-CZ 4.33Å; L19-F40 HydrophobicContact CD2-CE1 3.99Å; L19-F40 HydrophobicContact CD2-CZ 3.68Å; F23-F40 HydrophobicContact CB-CE2 3.59Å; F23-F40 HydrophobicContact CB-CZ 3.8Å; F23-F40 HydrophobicContact CD1-CE2 4.23Å; F23-F40 AromaticContact CD2-CE2 3.83Å; F23-F40 HydrophobicContact CD2-CE2 3.83Å; F23-F40 AromaticContact CD2-CZ 4Å; F23-F40 HydrophobicContact CD2-CZ 4Å; F23-F40 AromaticContact CG-CE2 3.6Å; F23-F40 HydrophobicContact CG-CE2 3.6Å; F23-F40 HydrophobicContact CG-CZ 4.05Å; L27-F40 HydrophobicContact CD1-CD1 4.38Å; L27-F40 HydrophobicContact CD1-CE1 4.48Å; L27-F40 HydrophobicContact CD1-CG 4.43Å; L27-F40 HydrophobicContact CD2-CB 4.23Å; L27-F40 HydrophobicContact CD2-CG 4.44Å; N36-F40 VanDerWaalsContact O-CB 3.28Å; N36-F40 WeakPolarHBondContact O-CB 3.46Å; N36-F40 PolarHBondContact O-N 2.85Å; F40-S42 VanDerWaalsContact C-N 3.33Å; F40-S42 PolarHBondContact O-N 2.97Å; F40-F43 PolarHBondContact O-N 3.25Å; F40-V44 HydrophobicContact CD1-CG2 4.23Å; F40-V44 HydrophobicContact CE1-CG2 4Å; F40-V44 HydrophobicContact CZ-CG2 4.27Å; F40-V44 WeakPolarHBondContact O-CG2 3.34Å; F40-V44 PolarHBondContact O-N 3.05Å
41K83.4Confident75.7Confident128 Ų12877 Ų7756%0.55741%0.407SS*.Hα-helixtrans-58.8-41.4175.6-174.7-179.8178-175.10112.3R37 D38 N45R37-K41 WeakPolarHBondContact O-CB 3.4Å; R37-K41 PolarHBondContact O-N 3.42Å; D38-K41 PolarHBondContact O-N 3.35Å; K41-N45 WeakPolarHBondContact O-CB 2.87Å; K41-N45 PolarHBondContact O-N 3.22Å; K41-N45 PolarHBondContact O-ND2 2.97Å
42S82.8Confident77.1Confident77 Ų7778.5 Ų78.554%0.53840%0.402SS..Hα-helixtrans-64.2-44.7175.6-1710000112D38 R39 F40 N45 S46D38-S42 VanDerWaalsContact O-CB 3.3Å; D38-S42 WeakPolarHBondContact O-CB 3.43Å; D38-S42 PolarHBondContact O-N 3.32Å; R39-S42 PolarHBondContact O-N 3.4Å; F40-S42 VanDerWaalsContact C-N 3.33Å; F40-S42 PolarHBondContact O-N 2.97Å; S42-N45 PolarHBondContact O-N 2.87Å; S42-S46 PolarHBondContact O-N 2.9Å
43F82Confident78Confident62 Ų6274.5 Ų74.527%0.27239%0.385SS..Hα-helixtrans-62.3-47.7176.4-167.5-91.4000111.7V3 L4 R39 F40 N45 S46 V47V3-F43 HydrophobicContact CB-CD1 3.94Å; V3-F43 HydrophobicContact CB-CE1 3.92Å; V3-F43 HydrophobicContact CG1-CD1 4.5Å; V3-F43 HydrophobicContact CG2-CD1 4.36Å; L4-F43 HydrophobicContact CB-CE1 4.48Å; R39-F43 PolarHBondContact O-N 3.35Å; F40-F43 PolarHBondContact O-N 3.25Å; F43-N45 VanDerWaalsContact C-N 3.32Å; F43-N45 PolarHBondContact O-N 2.84Å; F43-S46 PolarHBondContact O-N 3.08Å; F43-S46 VanDerWaalsContact O-N 3.1Å; F43-V47 HydrophobicContact CD1-CG2 4.02Å; F43-V47 HydrophobicContact CE1-CB 4.4Å; F43-V47 HydrophobicContact CE1-CG2 3.66Å; F43-V47 HydrophobicContact CE2-CG2 4.32Å; F43-V47 HydrophobicContact CG-CG2 4.5Å; F43-V47 HydrophobicContact CZ-CG2 3.82Å; F43-V47 WeakPolarHBondContact O-CB 3.21Å; F43-V47 WeakPolarHBondContact O-CG2 3.28Å; F43-V47 PolarHBondContact O-N 2.91Å
44V82.8Confident78.5Confident13 Ų1380.9 Ų80.98%0.07942%0.419CS..Hα-helixtrans-56.8-44.8174.2171.80000110.9V3 F40 S46 V47 A48 V59V3-V44 HydrophobicContact CG1-CG2 4.1Å; F40-V44 HydrophobicContact CD1-CG2 4.23Å; F40-V44 HydrophobicContact CE1-CG2 4Å; F40-V44 HydrophobicContact CZ-CG2 4.27Å; F40-V44 WeakPolarHBondContact O-CG2 3.34Å; F40-V44 PolarHBondContact O-N 3.05Å; V44-S46 VanDerWaalsContact C-N 3.31Å; V44-S46 PolarHBondContact O-N 2.89Å; V44-V47 PolarHBondContact O-N 2.9Å; V44-A48 WeakPolarHBondContact O-CA 3.23Å; V44-A48 WeakPolarHBondContact O-CB 3.36Å; V44-A48 PolarHBondContact O-N 3.21Å; V44-V59 HydrophobicContact CG1-CG1 4.18Å
45N85.3Confident79.1Confident87 Ų8777.1 Ų77.147%0.46541%0.408SS..Hα-helixtrans-68.2-24.8177.7-72.5-13.4000114K41 S42 F43 R62K41-N45 WeakPolarHBondContact O-CB 2.87Å; K41-N45 PolarHBondContact O-N 3.22Å; K41-N45 PolarHBondContact O-ND2 2.97Å; S42-N45 PolarHBondContact O-N 2.87Å; F43-N45 VanDerWaalsContact C-N 3.32Å; F43-N45 PolarHBondContact O-N 2.84Å; N45-R62 PolarHBondContact O-NH1 2.92Å; N45-R62 PolarHBondContact O-NH2 2.93Å
46S82.5Confident79.7Confident54 Ų5478.6 Ų78.638%0.37841%0.41SS..Hα-helixtrans-79.6-39.8175.2-1760000112.3S42 F43 V44 R62 K64S42-S46 PolarHBondContact O-N 2.9Å; F43-S46 PolarHBondContact O-N 3.08Å; F43-S46 VanDerWaalsContact O-N 3.1Å; V44-S46 VanDerWaalsContact C-N 3.31Å; V44-S46 PolarHBondContact O-N 2.89Å; S46-R62 WeakPolarHBondContact O-CD 3.31Å; S46-R62 PolarHBondContact O-NH1 2.83Å; S46-K64 WeakPolarHBondContact O-CE 3.43Å; S46-K64 PolarHBondContact O-NZ 3.44Å; S46-K64 VanDerWaalsContact O-NZ 3.15Å
47V80.6Confident80.2Confident4 Ų478.6 Ų78.62%0.02441%0.414CS..Hα-helixtrans-89.6-35.2-171.5170.20000113.5L4 F43 V44 L61 R62 Y65L4-V47 HydrophobicContact CD1-CG1 3.66Å; L4-V47 HydrophobicContact CD1-CG2 4.44Å; F43-V47 HydrophobicContact CD1-CG2 4.02Å; F43-V47 HydrophobicContact CE1-CB 4.4Å; F43-V47 HydrophobicContact CE1-CG2 3.66Å; F43-V47 HydrophobicContact CE2-CG2 4.32Å; F43-V47 HydrophobicContact CG-CG2 4.5Å; F43-V47 HydrophobicContact CZ-CG2 3.82Å; F43-V47 WeakPolarHBondContact O-CB 3.21Å; F43-V47 WeakPolarHBondContact O-CG2 3.28Å; F43-V47 PolarHBondContact O-N 2.91Å; V44-V47 PolarHBondContact O-N 2.9Å; V47-L61 HydrophobicContact CG1-CD1 3.43Å; V47-L61 VanDerWaalsContact CG1-CD1 3.43Å; V47-R62 WeakPolarHBondContact O-CB 3.4Å; V47-R62 WeakPolarHBondContact O-CG 3.28Å; V47-R62 PolarHBondContact O-N 3.39Å; V47-Y65 HydrophobicContact CB-CD2 4.3Å; V47-Y65 HydrophobicContact CB-CE2 4.25Å; V47-Y65 HydrophobicContact CG1-CD2 4.11Å; V47-Y65 HydrophobicContact CG2-CD2 4.38Å; V47-Y65 HydrophobicContact CG2-CE2 4Å; V47-Y65 WeakPolarHBondContact O-CD2 3.32Å
48A83.2Confident80.8Confident3 Ų371.2 Ų71.23%0.02539%0.389CS..EExtended strand (participates in β ladder)trans-127.2172.5-170.100000113.3L7 V44 V59 T60 R62L7-A48 HydrophobicContact CD1-CB 4.19Å; V44-A48 WeakPolarHBondContact O-CA 3.23Å; V44-A48 WeakPolarHBondContact O-CB 3.36Å; V44-A48 PolarHBondContact O-N 3.21Å; A48-V59 HydrophobicContact CB-CG1 3.43Å; A48-V59 VanDerWaalsContact CB-CG1 3.43Å; A48-T60 CarbonylContact C-O 3.42Å; A48-T60 WeakPolarHBondContact CA-O 3.45Å; A48-T60 VanDerWaalsContact CB-O 3.28Å; A48-T60 WeakPolarHBondContact CB-O 3.37Å; A48-R62 PolarHBondContact O-NE 3.28Å
49T85.7Confident81.3Confident64 Ų6467.4 Ų67.439%0.39337%0.368SS..EExtended strand (participates in β ladder)trans-124.3118.2170.729.40000107.6S51 T60 R62T49-S51 PolarHBondContact O-N 3.41Å; T49-T60 PolarHBondContact N-O 2.81Å; T49-T60 PolarHBondContact O-N 2.94Å; T49-T60 PolarHBondContact O-OG1 3.1Å; T49-T60 PolarHBondContact OG1-O 3.15Å; T49-T60 PolarHBondContact OG1-OG1 3.04Å; T49-R62 HydrophobicContact CG2-CG 4.11Å
50V84.1Confident81.6Confident84 Ų8460.2 Ų60.251%0.50934%0.344SS..EExtended strand (participates in β ladder)trans-80.8117.9175.3-172.30000108.1V59V50-V59 HydrophobicContact CG2-CG2 4.41Å
51S80.8Confident81.9Confident37 Ų3758.7 Ų58.726%0.25934%0.337SS..EExtended strand (participates in β ladder)trans-116.1146.617551.30000109.3T49 T58T49-S51 PolarHBondContact O-N 3.41Å; S51-T58 PolarHBondContact N-O 3.02Å; S51-T58 PolarHBondContact O-N 3.29Å; S51-T58 VanDerWaalsContact O-O 3.05Å; S51-T58 PolarHBondContact OG-O 3.01Å
52K84.8Confident81.8Confident155 Ų15557.1 Ų57.167%0.67433%0.328SS*.EExtended strand (participates in β ladder)trans-102.6117.7171.7-161.6177.1-175.5-176.80108.7G55 V56K52-G55 WeakPolarHBondContact CE-O 3.34Å; K52-V56 CarbonylContact C-O 3.6Å; K52-V56 WeakPolarHBondContact CA-O 3.49Å
53I76.8Confident81.5Confident85 Ų8562.5 Ų62.544%0.43634%0.342SS..EExtended strand (participates in β ladder)trans-125.6127.2-176.9-55.3176.4000106.2G55 V56I53-G55 PolarHBondContact O-N 3.39Å; I53-G55 VanDerWaalsContact O-N 3.12Å; I53-V56 PolarHBondContact N-O 2.83Å; I53-V56 PolarHBondContact O-N 2.81Å; I53-V56 VanDerWaalsContact O-O 3.07Å
54D69.6Low81.1Confident157 Ų15765.3 Ų65.384%0.8435%0.354SS*.THydrogen-bonded Turntrans49.541.6177.5-49.6-33000114.1V56D54-V56 PolarHBondContact O-N 3.48Å
55G73.4Confident80.5Confident57 Ų5767.8 Ų67.859%0.58836%0.362SS*.THydrogen-bonded Turntrans80.9-17.5-178.100000115.1K52 I53K52-G55 WeakPolarHBondContact CE-O 3.34Å; I53-G55 PolarHBondContact O-N 3.39Å; I53-G55 VanDerWaalsContact O-N 3.12Å
56V78.1Confident79.6Confident64 Ų6470.3 Ų70.339%0.38837%0.365SS..EExtended strand (participates in β ladder)trans-90.4137.5-179.2-177.10000111K15 K52 I53 D54K15-V56 HydrophobicContact CB-CG1 4.48Å; K15-V56 HydrophobicContact CD-CG1 4.33Å; K15-V56 HydrophobicContact CG-CG1 4.41Å; K52-V56 CarbonylContact C-O 3.6Å; K52-V56 WeakPolarHBondContact CA-O 3.49Å; I53-V56 PolarHBondContact N-O 2.83Å; I53-V56 PolarHBondContact O-N 2.81Å; I53-V56 VanDerWaalsContact O-O 3.07Å; D54-V56 PolarHBondContact O-N 3.48Å
57S83.5Confident78.2Confident51 Ų5170.6 Ų70.636%0.35738%0.377SS..EExtended strand (participates in β ladder)trans-82.2118.2170.7-620000110.1N16N16-S57 WeakPolarHBondContact CB-O 3.29Å; N16-S57 PolarHBondContact N-O 3.01Å
58T85.3Confident76.9Confident23 Ų2375.2 Ų75.214%0.14141%0.405CS..EExtended strand (participates in β ladder)trans-119.2136.2-176.7-61.50000110S51 T60S51-T58 PolarHBondContact N-O 3.02Å; S51-T58 PolarHBondContact O-N 3.29Å; S51-T58 VanDerWaalsContact O-O 3.05Å; S51-T58 PolarHBondContact OG-O 3.01Å; T58-T60 HydrophobicContact CG2-CG2 4.25Å
59V85.4Confident75.2Confident0 Ų078.7 Ų78.70%043%0.434CS..EExtended strand (participates in β ladder)trans-101.3108.9-177.9-176.60000108L7 S13 A14 N16 L19 V44 A48 V50L7-V59 HydrophobicContact CD1-CG1 4.05Å; L7-V59 HydrophobicContact CD2-CB 4.39Å; L7-V59 HydrophobicContact CD2-CG1 4.22Å; S13-V59 VanDerWaalsContact CA-O 3.31Å; S13-V59 WeakPolarHBondContact CA-O 3.48Å; A14-V59 PolarHBondContact N-O 2.96Å; A14-V59 VanDerWaalsContact N-O 3.08Å; A14-V59 PolarHBondContact O-N 2.94Å; N16-V59 HydrophobicContact CB-CG2 4.34Å; L19-V59 HydrophobicContact CD1-CB 4.19Å; L19-V59 HydrophobicContact CD1-CG1 4.06Å; L19-V59 HydrophobicContact CD1-CG2 4.24Å; V44-V59 HydrophobicContact CG1-CG1 4.18Å; A48-V59 HydrophobicContact CB-CG1 3.43Å; A48-V59 VanDerWaalsContact CB-CG1 3.43Å; V50-V59 HydrophobicContact CG2-CG2 4.41Å
60T83.6Confident73Confident25 Ų2583.4 Ų83.415%0.15346%0.456CS..EExtended strand (participates in β ladder)trans-103.4133.8-176.361.20000111A48 T49 T58A48-T60 CarbonylContact C-O 3.42Å; A48-T60 WeakPolarHBondContact CA-O 3.45Å; A48-T60 VanDerWaalsContact CB-O 3.28Å; A48-T60 WeakPolarHBondContact CB-O 3.37Å; T49-T60 PolarHBondContact N-O 2.81Å; T49-T60 PolarHBondContact O-N 2.94Å; T49-T60 PolarHBondContact O-OG1 3.1Å; T49-T60 PolarHBondContact OG1-O 3.15Å; T49-T60 PolarHBondContact OG1-OG1 3.04Å; T58-T60 HydrophobicContact CG2-CG2 4.25Å
61L86.7Confident70.8Confident2 Ų287.3 Ų87.31%0.0147%0.473CS..EExtended strand (participates in β ladder)trans-71.3134.3-177.8-161.671.4000110.6L4 L7 Q8 G12 V47 Y65 R66L4-L61 HydrophobicContact CD1-CD1 4.29Å; L7-L61 HydrophobicContact CB-CD1 3.97Å; L7-L61 HydrophobicContact CD1-CD1 3.98Å; Q8-L61 HydrophobicContact CG-CD2 3.84Å; G12-L61 VanDerWaalsContact O-CB 3.28Å; G12-L61 WeakPolarHBondContact O-CB 3.44Å; G12-L61 PolarHBondContact O-N 3.02Å; V47-L61 HydrophobicContact CG1-CD1 3.43Å; V47-L61 VanDerWaalsContact CG1-CD1 3.43Å; L61-Y65 VanDerWaalsContact CD2-O 3.32Å; L61-Y65 WeakPolarHBondContact CD2-O 3.34Å; L61-R66 HydrophobicContact CB-CG 4.27Å; L61-R66 HydrophobicContact CD2-CG 4.17Å; L61-R66 HydrophobicContact CG-CG 4.45Å; L61-R66 PolarHBondContact O-NE 2.97Å; L61-R66 PolarHBondContact O-NH2 2.96Å
62R81.6Confident68.6Low95 Ų9592.5 Ų92.536%0.35850%0.498SS..PPolyproline II helixtrans-67.2145.9178.1-72.4170170.9-167.1-12.1110.8N45 S46 V47 A48 T49 K64 Y65N45-R62 PolarHBondContact O-NH1 2.92Å; N45-R62 PolarHBondContact O-NH2 2.93Å; S46-R62 WeakPolarHBondContact O-CD 3.31Å; S46-R62 PolarHBondContact O-NH1 2.83Å; V47-R62 WeakPolarHBondContact O-CB 3.4Å; V47-R62 WeakPolarHBondContact O-CG 3.28Å; V47-R62 PolarHBondContact O-N 3.39Å; A48-R62 PolarHBondContact O-NE 3.28Å; T49-R62 HydrophobicContact CG2-CG 4.11Å; R62-K64 HydrophobicContact CB-CG 4.11Å; R62-K64 PolarHBondContact O-N 2.79Å; R62-Y65 HydrophobicContact CB-CD2 4.46Å; R62-Y65 PolarHBondContact O-N 3.12Å
63K75.7Confident66.6Low191 Ų19191.3 Ų91.383%0.8351%0.506SS*.G310 helixtrans-50.6-38.6-174.2-164.5175-177.8-179.80113.4Y65 R66K63-Y65 PolarHBondContact O-N 3.47Å; K63-Y65 VanDerWaalsContact O-N 3.1Å; K63-R66 PolarHBondContact O-N 2.78Å; K63-R66 VanDerWaalsContact O-N 3.16Å
64K74.3Confident64.7Low121 Ų12192.7 Ų92.753%0.52652%0.523SS..G310 helixtrans-56.2-20.6175.155.4160.4172.9155.30115.8S46 R62S46-K64 WeakPolarHBondContact O-CE 3.43Å; S46-K64 PolarHBondContact O-NZ 3.44Å; S46-K64 VanDerWaalsContact O-NZ 3.15Å; R62-K64 HydrophobicContact CB-CG 4.11Å; R62-K64 PolarHBondContact O-N 2.79Å
65Y70.1Confident63.1Low64 Ų6493.9 Ų93.925%0.25152%0.524SS..G310 helixtrans-112.6-2.5-179.6-63.3-58.6000114L4 Q8 V47 L61 R62 K63 G67L4-Y65 HydrophobicContact CD1-CD1 3.88Å; L4-Y65 HydrophobicContact CD1-CD2 4.43Å; L4-Y65 HydrophobicContact CD1-CG 3.79Å; Q8-Y65 PolarHBondContact NE2-O 2.91Å; V47-Y65 HydrophobicContact CB-CD2 4.3Å; V47-Y65 HydrophobicContact CB-CE2 4.25Å; V47-Y65 HydrophobicContact CG1-CD2 4.11Å; V47-Y65 HydrophobicContact CG2-CD2 4.38Å; V47-Y65 HydrophobicContact CG2-CE2 4Å; V47-Y65 WeakPolarHBondContact O-CD2 3.32Å; L61-Y65 VanDerWaalsContact CD2-O 3.32Å; L61-Y65 WeakPolarHBondContact CD2-O 3.34Å; R62-Y65 HydrophobicContact CB-CD2 4.46Å; R62-Y65 PolarHBondContact O-N 3.12Å; K63-Y65 PolarHBondContact O-N 3.47Å; K63-Y65 VanDerWaalsContact O-N 3.1Å; Y65-G67 VanDerWaalsContact C-N 3.3Å
66R65.8Low61.2Low140 Ų14099.3 Ų99.353%0.52854%0.539SS..SBendtrans-78.9-13.5173.5-62.9-171.5-172-158.30.6113.1L61 K63L61-R66 HydrophobicContact CB-CG 4.27Å; L61-R66 HydrophobicContact CD2-CG 4.17Å; L61-R66 HydrophobicContact CG-CG 4.45Å; L61-R66 PolarHBondContact O-NE 2.97Å; L61-R66 PolarHBondContact O-NH2 2.96Å; K63-R66 PolarHBondContact O-N 2.78Å; K63-R66 VanDerWaalsContact O-N 3.16Å
67G54Low59Low61 Ų61104.8 Ų104.863%0.62956%0.563SS**SBendtrans-85.3-16.2-172.800000116.2Y65 A69Y65-G67 VanDerWaalsContact C-N 3.3Å; G67-A69 PolarHBondContact O-N 3.05Å
68T52.7Low56.7Low100 Ų100109.3 Ų109.361%0.61358%0.582SS**  trans-85.257-179.961.90000111.2Q8Q8-T68 PolarHBondContact NE2-OG1 2.94Å
69A46.7Very low54.2Low77 Ų77114.3 Ų114.364%0.63661%0.612SS**  trans-13331.5-178.300000111.9G67G67-A69 PolarHBondContact O-N 3.05Å
70L40.9Very low51.5Low162 Ų162119.9 Ų119.985%0.84865%0.647SS**SBendtrans-13340.7174.4-74.1-179.8000112.1
71L36.2Very low49Very low166 Ų166124.5 Ų124.587%0.86967%0.674SS**  trans-138.4111.4156.5-75.7-179.7000107.9
72N36.1Very low46.2Very low147 Ų147135.2 Ų135.279%0.78672%0.715SS**  trans-78132.5172.1-66.5-20.6000108.8S74N72-S74 PolarHBondContact O-N 3.27Å; N72-S74 VanDerWaalsContact O-N 3.09Å
73P42.7Very low43.6Very low130 Ų130136.1 Ų136.184%0.84473%0.731SS**  trans-76.690.7165.931.2-31.5000109.1E75P73-E75 PolarHBondContact O-N 2.82Å
74S35.9Very low41.3Very low113 Ų113133.2 Ų133.279%0.7973%0.729SS**  trans-86.677.6176.758.30000111.4N72N72-S74 PolarHBondContact O-N 3.27Å; N72-S74 VanDerWaalsContact O-N 3.09Å
75E37.1Very low39Very low183 Ų183131.8 Ų131.886%0.85574%0.735SS**  trans-129.876.2168.4-72.4-164146.300111.1P73 M77P73-E75 PolarHBondContact O-N 2.82Å; E75-M77 PolarHBondContact O-N 3.06Å
76D31.9Very low37.2Very low170 Ų170137.1 Ų137.191%0.90976%0.762SS**  trans-72.883.2157.6-84.1-46.5000108.6L78D76-L78 VanDerWaalsContact C-N 3.29Å; D76-L78 PolarHBondContact O-N 3.16Å
77M33Very low35.4Very low179 Ų179137.5 Ų137.588%0.88277%0.77SS**  trans-72.882.6176.8-169.5-175-177.100110.5E75 V79E75-M77 PolarHBondContact O-N 3.06Å; M77-V79 PolarHBondContact O-N 2.87Å
78L34.6Very low34.2Very low147 Ų147140.3 Ų140.377%0.7777%0.77SS**  trans-70.8114.1-176.7-167.7137.6000111.8D76 T80D76-L78 VanDerWaalsContact C-N 3.29Å; D76-L78 PolarHBondContact O-N 3.16Å; L78-T80 PolarHBondContact O-N 3.1Å
79V33.5Very low33.1Very low127 Ų127143.4 Ų143.477%0.7778%0.781SS**  trans-67118-179.3179.70000110.8M77 V81M77-V79 PolarHBondContact O-N 2.87Å; V79-V81 HydrophobicContact CG1-CG2 4.45Å
80T28.6Very low32.2Very low117 Ų117143.2 Ų143.272%0.71879%0.787SS**  trans-128.9107.9166-600000110.5L78L78-T80 PolarHBondContact O-N 3.1Å
81V30.3Very low31.6Very low122 Ų122142.6 Ų142.674%0.73979%0.785SS**  trans-107.1113.2168.4176.20000108.7V79V79-V81 HydrophobicContact CG1-CG2 4.45Å
82R28.8Very low31.3Very low227 Ų227138.6 Ų138.686%0.85777%0.771SS**  trans-171.294155-96.8140-169.3-176.33.9109
83T26.3Very low31Very low115 Ų115142.7 Ų142.771%0.70678%0.775SS**  50.9132.497.622.50000117.8
84T27Very low30.3Very low129 Ų129141.4 Ų141.479%0.79177%0.769SS**  trans63.214015855.50000118.1
85S27.3Very low29.8Very low92 Ų92145.1 Ų145.164%0.64377%0.771SS**  cis-173.4158.8-2.8-100.30000110.6
86Q31.1Very low29.4Very low175 Ų175143.7 Ų143.782%0.81877%0.768SS**  trans67.2157.5161.3-63.7163.92.300116.3
87H29Very low29.3Very low149 Ų149144 Ų14469%0.6976%0.761SS**  cis-153.7149.82-141.1-151.9000113.4
88L29.2Very low29.2Very low120 Ų120139.7 Ų139.763%0.62875%0.745SS**  trans42.7127.2151.8-60.5179.6000125.3
89L29.6Very low29Very low164 Ų164140.4 Ų140.486%0.85974%0.744SS**  65.2156.2125.1-60.3174.2000123.7
90G27.7Very low28.8Very low73 Ų73139.3 Ų139.375%0.75374%0.742SS**  trans94.993.8169.500000113.2
91D27.1Very low29.1Very low150 Ų150142.6 Ų142.680%0.80275%0.749SS**  cis83.2125.547.7-161.329.8000115.8
92S30.5Very low30.1Very low82 Ų82141.9 Ų141.957%0.57375%0.747SS**  trans26.1129.9156.3-64.50000123.9
93R29.5Very low30.7Very low232 Ų232137 Ų13788%0.87575%0.745SS**  trans79.5112.7136.4-70.3170.9177.6174.5-0.5121.3
94S28Very low30.8Very low104 Ų104136.8 Ų136.873%0.72774%0.743SS**  100.1123.2113.672.60000123.3
95F25.8Very low31Very low190 Ų190138.3 Ų138.383%0.83374%0.742SS**  trans81.4161.7133.5-99.1-98.8000123.8
96I29.3Very low31Very low154 Ų154141.8 Ų141.879%0.7975%0.748SS**  trans86.1118.8177.1-57.2175.5000113.6
97K30Very low30.9Very low176 Ų176139.5 Ų139.577%0.76574%0.737SS**  cis86.9150.121.4-137.9-170.9175.4-171.40112.5
98V30.5Very low30.9Very low89 Ų89136.1 Ų136.154%0.53973%0.73SS.*  cis-153.517621.8-1540000111.2
99H29Very low30.9Very low161 Ų161139.4 Ų139.475%0.74573%0.734SS**  trans100.7130.6163-53.3109.3000116.7
100S31.1Very low30.7Very low104 Ų104137.5 Ų137.573%0.72773%0.73SS**  cis82142.824.7-42.80000113.5
101Q34.7Very low30.8Very low186 Ų186138.6 Ų138.687%0.86973%0.726SS**  cis-148.2178.229-88.1-170.9-22.400113.9
102P50.9Low31Very low107 Ų107140.1 Ų140.170%0.69573%0.728SS**  trans-103.9-169175.442.7-36000113.6
103P42.1Very low30.9Very low125 Ų125139.4 Ų139.481%0.81273%0.733SS**  trans-126.3-177.5146.839.3-28.7000114.1
104T26.4Very low31Very low110 Ų110134.4 Ų134.468%0.67573%0.729SS**  trans-138.2-166.7-16133.40000113.1
105E31.6Very low31.2Very low162 Ų162137.3 Ų137.376%0.75773%0.733SS**  trans74.1149.6169.5-71116.5-106.700118
106E27.7Very low31.4Very low164 Ų164134.4 Ų134.477%0.76673%0.726SS**  cis-151.7162.10.9-133.8-176.6-179.600114.9
107E29.7Very low31.8Very low127 Ų127131.6 Ų131.659%0.59372%0.72SS**  trans28.3154144.3-79.2-127.1127.800123.9R109E107-R109 IonicContact OE1-CZ 3.16Å; E107-R109 IonicContact OE1-NE 3.81Å; E107-R109 PolarHBondContact OE1-NE 3.45Å; E107-R109 VanDerWaalsContact OE1-NE 3.16Å; E107-R109 IonicContact OE1-NH2 2.65Å; E107-R109 PolarHBondContact OE1-NH2 3.33Å; E107-R109 IonicContact OE2-NE 2.71Å; E107-R109 IonicContact OE2-NH2 3.37Å
108S28Very low31.9Very low78 Ų78131 Ų13155%0.54573%0.725SS.*  cis-170.1168.6-7.351.50000115.6
109R29.5Very low32.1Very low189 Ų189132.1 Ų132.171%0.71374%0.736SS**  trans58117.7143.1-70.8155.7-145.9-136.611.6119.6E107E107-R109 IonicContact OE1-CZ 3.16Å; E107-R109 IonicContact OE1-NE 3.81Å; E107-R109 PolarHBondContact OE1-NE 3.45Å; E107-R109 VanDerWaalsContact OE1-NE 3.16Å; E107-R109 IonicContact OE1-NH2 2.65Å; E107-R109 PolarHBondContact OE1-NH2 3.33Å; E107-R109 IonicContact OE2-NE 2.71Å; E107-R109 IonicContact OE2-NH2 3.37Å
110T25.6Very low32.2Very low125 Ų125127.7 Ų127.777%0.76773%0.734SS**  54.8135.883.761.50000115.2
111S30.6Very low33Very low95 Ų95128.3 Ų128.366%0.66474%0.736SS**  cis-176.5174.78.939.80000112.6
112Q30.6Very low32.8Very low183 Ų183123.8 Ų123.886%0.85572%0.724SS**  trans83.9122.4148.4-131.579.6-13.600121.7
113G28.8Very low31.9Very low66 Ų66127.2 Ų127.268%0.6873%0.728SS**  trans77.6162.515000000119.4
114T31Very low31.4Very low128 Ų128126.1 Ų126.179%0.78572%0.724SS**  cis-163.5152.9-19.4-13.20000111.7
115M31.8Very low31.6Very low165 Ų165131.7 Ų131.781%0.81373%0.732SS**  trans74.8140.1153.3-80.3164.517000123.3
116D30.8Very low31.5Very low128 Ų128129.6 Ų129.668%0.68473%0.731SS**  trans60.9125.2155-70.4-60000122
117S37.1Very low31.6Very low96 Ų96127.4 Ų127.467%0.67173%0.734SS**  74.7128.362.9-54.30000111.6
118L33.6Very low31.8Very low164 Ų164130.7 Ų130.786%0.85975%0.749SS**  cis-137.2-176.311.5-60.9165.8000108.4
119S32.8Very low31.9Very low111 Ų111130 Ų13078%0.77675%0.754SS**  cis-156.4154.4-0.426.90000108.3
120G31.9Very low31.9Very low68 Ų68127.4 Ų127.470%0.70176%0.76SS**  trans-89.7-142.2173.700000113.6
121P47.2Very low32.2Very low118 Ų118127.2 Ų127.277%0.76676%0.758SS**  cis-145.2170.3-3.744.9-27.7000116.7
122S30.4Very low32.2Very low90 Ų90129.1 Ų129.163%0.62976%0.761SS**  trans30.5145.8135.8760000121.7
123K33.8Very low32.3Very low180 Ų180124.4 Ų124.478%0.78375%0.748SS**  cis-159.2146.649.9-77.5179.9-174.7171.20109.6
124S31Very low32.6Very low102 Ų102128.5 Ų128.571%0.71375%0.754SS**  62.8143.378.2117.70000114.3
125R30.4Very low32.7Very low227 Ų227128.1 Ų128.186%0.85776%0.757SS**  cis-162.1172.8-4.7-132.9-179.9-168.5-170.22.9110.8
126T29.1Very low32.6Very low117 Ų117123.7 Ų123.772%0.71875%0.753SS**  trans-39.4144.3161.650.60000116.3
127S30.2Very low33.4Very low119 Ų119124 Ų12483%0.83276%0.762SS**  175168.210562.50000113.3
128E33.3Very low33Very low196 Ų196124.3 Ų124.392%0.91676%0.764SS**  trans-82167169.4-58164.511300111.6
129G29.4Very low33Very low64 Ų64125.6 Ų125.666%0.6676%0.763SS**  trans138.9120.7143.600000120.5
130T29.9Very low33Very low134 Ų134125.2 Ų125.282%0.82276%0.76SS**  trans84.3146.4137.6-4.80000122.1
131T32.8Very low32.9Very low121 Ų121132.9 Ų132.974%0.74277%0.768SS**  trans65.5154.1163.671.90000118.6
132D29.3Very low32.2Very low135 Ų135131.3 Ų131.372%0.72277%0.765SS**  cis-151.1169.41-142.5-64.7000113.8
133S33.7Very low32.3Very low84 Ų84131.5 Ų131.559%0.58777%0.766SS**  trans85.6107.9137.7-78.80000124.8
134L34.8Very low32.2Very low152 Ų152132 Ų13280%0.79677%0.771SS**  82.6112.2118.6-66.1173.1000123.5
135S33Very low32.1Very low120 Ų120129.9 Ų129.984%0.83977%0.766SS**  trans80.7143.4132.772.10000121.3
136G29.7Very low32.2Very low72 Ų72125.7 Ų125.774%0.74277%0.766SS**  trans-105.1-135.6175.800000112.6
137P47Very low32.4Very low134 Ų134128.2 Ų128.287%0.8777%0.771SS**  cis-132.7-178.831.342.5-27.4000115.9
138S29.8Very low32.3Very low102 Ų102129.6 Ų129.671%0.71377%0.769SS**  trans-113.2156.317257.90000112.4
139K33.9Very low32.3Very low191 Ų191124.8 Ų124.883%0.8376%0.757SS**  trans171.8126.6150.7-96150.6-167.9175.40110.2
140S31.7Very low32.5Very low104 Ų104127.4 Ų127.473%0.72777%0.766SS**  57.9140.791.584.60000114
141R30.8Very low32.5Very low229 Ų229126.5 Ų126.586%0.86477%0.765SS**  cis-174.6119.847.9-179.9176.6-177.1175.20.4107.9
142A31.4Very low32.2Very low84 Ų84123.8 Ų123.869%0.69476%0.761SS**  74.2126.889.600000118.4
143S33Very low32.3Very low94 Ų94125.7 Ų125.766%0.65777%0.771SS**  trans71.9136141.3590000124.4
144Q33Very low32.2Very low191 Ų191127.7 Ų127.789%0.89378%0.78SS**  trans71.7146.1155-65.5149.2-27.600117.7
145G28.5Very low32.7Very low58 Ų58126.8 Ų126.860%0.59878%0.783SS**  cis172.1-177.7-5.700000112.3
146T32.5Very low32.6Very low139 Ų139128.8 Ų128.885%0.85378%0.779SS**  trans66.8156.5170.568.60000117.5
147M32.8Very low32.7Very low170 Ų170129.1 Ų129.184%0.83777%0.77SS**  cis-159-173.5-28.9-114.2171.317500110
148D28.5Very low31.9Very low147 Ų147132.1 Ų132.179%0.78676%0.764SS**  trans68.2129.2-179.3-69.8-45.1000117.8
149S33.5Very low32Very low96 Ų96136 Ų13667%0.67176%0.763SS**  cis94.7134.39.7-49.60000117.8
150S32.1Very low31.9Very low119 Ų119132.4 Ų132.483%0.83275%0.749SS**  trans67.1150.6169.7-46.70000115.7
151S30.1Very low31.9Very low115 Ų115134.7 Ų134.780%0.80475%0.748SS**  cis-156.9145.8-18.136.40000105.2
152G27.9Very low31.9Very low64 Ų64130 Ų13066%0.6675%0.745SS**  89.2106.167.100000110.3
153D29.7Very low32.8Very low175 Ų175130.9 Ų130.994%0.93674%0.744SS**  trans173.9139.6134.7-90.4-18.9000114.7
154T32.1Very low32.6Very low126 Ų126134.7 Ų134.777%0.77375%0.751SS**  trans-109.4155.2161.140.70000108.4
155P46.1Very low32.4Very low133 Ų133130.3 Ų130.386%0.86474%0.742SS**  -134.3-128.498.933.3-18.1000115
156E30.7Very low33.3Very low162 Ų162133.5 Ų133.576%0.75775%0.751SS**  trans-154.5170.9-134.9-149.2-79.8109.800113.5
157S30.9Very low33.2Very low79 Ų79134.6 Ų134.655%0.55275%0.747SS**  trans76.7152.8161-100.80000117.2
158R30.4Very low33.1Very low196 Ų196134 Ų13474%0.7475%0.747SS**  cis-158.7125.320.6-147.5-174.6-170.5-140.17.2115.2
159R32.3Very low33.1Very low184 Ų184136.3 Ų136.369%0.69474%0.744SS**  trans64.2161.9146.6-75170.4165.6-1265.7118.9
160Q32.2Very low33Very low116 Ų116141.5 Ų141.554%0.54275%0.749SS.*  cis-156.2146.74.7-133.2162.9-88.200114.3
161Q32.2Very low32.8Very low152 Ų152145.6 Ų145.671%0.7175%0.752SS**  trans63.3139.7151.6-78153.3-27.200121.4
162V30.9Very low32.8Very low131 Ų131148.1 Ų148.179%0.79475%0.751SS**  cis82.8137.921.9179.60000113.1
163P50.2Low32.8Very low102 Ų102149.8 Ų149.866%0.66275%0.753SS**  cis-123.4-157.118.344.9-27.9000113.9
164Q28.2Very low32.6Very low173 Ų173146.7 Ų146.781%0.80875%0.745SS**  cis-158.1178.60-146.6151.8-2400112.5
165S29.3Very low32.8Very low100 Ų100147 Ų14770%0.69975%0.746SS**  trans-127.8170.6166.5-510000110.5
166P46.3Very low33Very low124 Ų124145.3 Ų145.381%0.80574%0.736SS**  -138.1164.278.423.4-0.8000113.3
167E31.6Very low32.9Very low162 Ų162145 Ų14576%0.75774%0.739SS**  cis93.2119.227.7-167.3179.7167.200116.3
168L29.8Very low32.7Very low159 Ų159146 Ų14683%0.83275%0.752SS**  trans-179.4101.7146.7-96.9169.5000108.3
169R28.7Very low32.5Very low195 Ų195142.9 Ų142.974%0.73676%0.755SS**  76.29076.5-159.2177.9-147.1-116.58.1113.3
170R31.5Very low32.4Very low205 Ų205142.5 Ų142.577%0.77476%0.763SS**  86120.372.9176.4-171.5-179.1-176.52.2114.7
171K27.9Very low32.3Very low205 Ų205143.6 Ų143.689%0.89178%0.778SS**  trans-168.9159.4139.1-109.8171.2-176.4-174.90113.9
172Q30.2Very low32.1Very low167 Ų167141.2 Ų141.278%0.7878%0.778SS**  trans-101.7-175.4172.4-62.5146.6-46.600107.9
173S27Very low32.1Very low100 Ų100140.8 Ų140.870%0.69978%0.775SS**  cis-168.6-173.125.255.50000112.8
174S27.1Very low31.1Very low110 Ų110142.8 Ų142.877%0.76978%0.78SS**  trans74.6126.6146.343.20000122.8
175T36Very low31.2Very low131 Ų131144.1 Ų144.180%0.80478%0.783SS**  trans-92.2-171.4154.252.30000109
176P50.3Low31.1Very low99 Ų99142.1 Ų142.164%0.64378%0.778SS**  cis-144.8-169.610.145.9-25.5000118
177N27.1Very low31.4Very low156 Ų156141.8 Ų141.883%0.83478%0.776SS**  trans59.5126.5153-64.2-10.1000122.6
178A27.6Very low31.3Very low98 Ų98142.2 Ų142.281%0.8178%0.783SS**  -177.3109.6127.500000115.5
179T27.1Very low31.2Very low132 Ų132140.8 Ų140.881%0.8178%0.776SS**  trans22.4123.4132.7-47.50000124
180M28.4Very low31.4Very low176 Ų176139.2 Ų139.287%0.86778%0.777SS**  trans27.7130.3141.1-62-74.1-170.300123.4
181T30.6Very low31.4Very low139 Ų139135.2 Ų135.285%0.85378%0.781SS**  trans-145.5151.5132.6-32.60000111.6
182S27.8Very low31.6Very low101 Ų101128.7 Ų128.771%0.70677%0.771SS**  trans-80.1-176.516546.90000110.6
183V30.6Very low31.8Very low122 Ų122127 Ų12774%0.73977%0.774SS**  cis-157.1162.446.9178.80000111.8
184L30.3Very low32.1Very low144 Ų144130 Ų13075%0.75478%0.781SS**  trans-33.1139.4169.4-54.7157.5000116.8
185F29.7Very low32.2Very low201 Ų201136 Ų13688%0.88279%0.787SS**  178.5167.7101.1-110.8-90.1000112
186G26.8Very low32.1Very low58 Ų58136.6 Ų136.660%0.59879%0.79SS**  trans-151.4-168160.800000108.4
187P53Low31.2Very low117 Ų117143.8 Ų143.876%0.7681%0.805SS**  cis-128176.2-4.539.4-24000113.1
188L29Very low31.3Very low171 Ų171139.7 Ų139.790%0.89580%0.8SS**  -167168122.4-128.985.2000113.6
189N29.2Very low31.5Very low129 Ų129141.3 Ų141.369%0.6980%0.804SS**  trans-95.7135.4-172173.528.4000111.7
190Q32.2Very low31.9Very low162 Ų162146 Ų14676%0.75781%0.807SS**  163.5146.2118.6-86.6-169.253.800116.4
191S31.8Very low32.2Very low122 Ų122143 Ų14385%0.85380%0.8SS**  trans75.5144.6155.780.10000120.9
192G31.1Very low32.3Very low67 Ų67144.6 Ų144.669%0.69180%0.802SS**  trans108.194.6162.500000117.9
193P34.3Very low32.4Very low131 Ų131145 Ų14585%0.85180%0.803SS**  trans-90.6123.1176.233.5-31.9000113.6
194I33.3Very low32.7Very low165 Ų165145.8 Ų145.885%0.84681%0.808SS**  trans-94.4103.9176-60.4-178.2000111.6T196I194-T196 PolarHBondContact O-N 2.84Å
195R29.4Very low32.8Very low236 Ų236150.7 Ų150.789%0.89182%0.817SS**  trans3.5105.2157.4-70.3173.3160176.6-5.7117.6
196T34.5Very low33Very low142 Ų142150.6 Ų150.687%0.87182%0.816SS**  trans-74.8145.5150.948.60000110.4I194 G198I194-T196 PolarHBondContact O-N 2.84Å; T196-G198 PolarHBondContact O-N 3.44Å
197R31.2Very low33.3Very low250 Ų250158.8 Ų158.894%0.94383%0.829SS**  trans-82.7103.2179.4-71.8-178.9176176.6-1.3110.4
198G28.5Very low32.4Very low71 Ų71163 Ų16373%0.73284%0.835SS**PPolyproline II helixtrans-71.5132.1177.100000113.6T196T196-G198 PolarHBondContact O-N 3.44Å
199C32.4Very low32.6Very low132 Ų132163.1 Ų163.189%0.89283%0.831SS**PPolyproline II helixtrans-68.4138.3168.5-65.10000110.6
200R35.6Very low32.8Very low231 Ų231164.2 Ų164.287%0.87283%0.83SS**PPolyproline II helixtrans-86.5136.2-179.6-64.5-179.3179.9-126.13.6111.4
201P35.2Very low32.8Very low113 Ų113165.4 Ų165.473%0.73484%0.838SS**PPolyproline II helixtrans-72.8139.5165.131.1-33.1000110.5
202I32.3Very low32.9Very low171 Ų171166.9 Ų166.988%0.87783%0.831SS**  trans-96.897.6175.4-60178000108.8
203C31Very low33.1Very low110 Ų110173.5 Ų173.574%0.74384%0.841SS**  trans-77.2153173.5-63.20000112
204T36.6Very low33.2Very low138 Ų138175.9 Ų175.985%0.84785%0.845SS**  trans-72.1126.3-170.946.20000113.3K206T204-K206 PolarHBondContact O-N 2.89Å
205R32.1Very low33.1Very low248 Ų248171.1 Ų171.194%0.93684%0.837SS**  trans-91.190.2-177.9-151.2174.7-166-179.63.6110.9R207R205-R207 PolarHBondContact O-N 3.1Å
206K33.2Very low33.2Very low199 Ų199167 Ų16787%0.86583%0.832SS**PPolyproline II helixtrans-54.8118.4172.6-75.4-177.2175.4179.10110.6T204T204-K206 PolarHBondContact O-N 2.89Å
207R34.2Very low33.1Very low230 Ų230170.9 Ų170.987%0.86883%0.831SS**PPolyproline II helixtrans-75.2125.7163.5-98.8-176.8166.8171.2-4.9108.7R205R205-R207 PolarHBondContact O-N 3.1Å
208K32.8Very low33.7Very low204 Ų204164.6 Ų164.689%0.88782%0.823SS**PPolyproline II helixtrans-78.8136.7165.7-67.2-178.3177.4-178.40108.6
209H33.7Very low33.9Very low175 Ų175164.9 Ų164.981%0.8183%0.826SS**  trans-114.5151.2158.2-88.9-96.5000109.9
210K33.6Very low34.7Very low151 Ų151165.3 Ų165.366%0.65783%0.826SS**  trans-103.7132.9-173.9176.2-159.4178.3-1480109E212K210-E212 VanDerWaalsContact CE-CD 3.41Å; K210-E212 WeakPolarHBondContact CE-OE1 3.34Å; K210-E212 IonicContact NZ-OE1 2.67Å; K210-E212 PolarHBondContact NZ-OE1 3.1Å; K210-E212 IonicContact NZ-OE2 3.25Å; K210-E212 PolarHBondContact NZ-OE2 2.67Å
211M32.3Very low34.4Very low188 Ų188158 Ų15893%0.92682%0.824SS**  trans-143.7164.1155.5-86-166.675.600109.6
212E33.8Very low34.3Very low153 Ų153164.2 Ų164.272%0.71583%0.832SS**  trans-119.3-179-153.3-74170124.500114.6K210K210-E212 VanDerWaalsContact CE-CD 3.41Å; K210-E212 WeakPolarHBondContact CE-OE1 3.34Å; K210-E212 IonicContact NZ-OE1 2.67Å; K210-E212 PolarHBondContact NZ-OE1 3.1Å; K210-E212 IonicContact NZ-OE2 3.25Å; K210-E212 PolarHBondContact NZ-OE2 2.67Å
213K35.9Very low34.3Very low206 Ų206168.2 Ų168.290%0.89684%0.836SS**  trans-67135.9-167.8-79.7176.7169.8176.90115.2
214L35.5Very low34.3Very low181 Ų181174.2 Ų174.295%0.94884%0.843SS**  trans-159.5161.8136.5-99.7163.5000107.2
215G31.3Very low33.9Very low64 Ų64173.2 Ų173.266%0.6684%0.841SS**  cis-170.6-167.1-0.700000113.1
216N31.4Very low33.9Very low149 Ų149171.8 Ų171.880%0.79784%0.835SS**  trans-98.2161.7172-87.2-33.5000109
217R33.4Very low33.8Very low225 Ų225168.8 Ų168.885%0.84983%0.834SS**  cis-158.5-160.85.1-124.9-178.3-170.6-150.32.6111
218P43.8Very low33.6Very low118 Ų118161.7 Ų161.777%0.76683%0.832SS**  trans-127.6153.8-136.443.2-26.4000120.6
219G32.3Very low33.4Very low77 Ų77155.8 Ų155.879%0.79483%0.829SS**  trans66-17315000000118.4
220P48Very low33.4Very low140 Ų140157.4 Ų157.491%0.90983%0.828SS**  cis-126.8177.9-13.341.5-27.5000113.8
221G30.3Very low33.4Very low79 Ų79157 Ų15781%0.81483%0.829SS**  trans-174.7128169.500000114.8
222R33.5Very low33.3Very low243 Ų243154.6 Ų154.692%0.91782%0.824SS**  trans-113.2152.2-180-66.6179.2173.4-170.1-0.6111.8
223R31.8Very low33.2Very low255 Ų255150.2 Ų150.296%0.96282%0.82SS**  -170.5151.4118.6-100.2159.2-163.9-131.42.7112.5
224R30.9Very low33.1Very low235 Ų235147.2 Ų147.289%0.88782%0.819SS**  trans-160.2124.9-179.5178.9-167.2-172.9-161.96.2110
225C27.7Very low32.9Very low117 Ų117143.4 Ų143.479%0.79181%0.814SS**  trans-138.9145.7159.8-74.20000107.3
226R32.2Very low33.1Very low219 Ų219145.9 Ų145.983%0.82682%0.822SS**  cis72.2135.141.3-71.6-162.1160.9-173.6-4.7112.3
227T32Very low34.4Very low136 Ų136144.5 Ų144.583%0.83482%0.82SS**  cis-164.9169.253.90000112.6
228G28.8Very low34.2Very low81 Ų81141.4 Ų141.484%0.83582%0.821SS**  trans109.2146.8170.400000112.8
229G29.9Very low34.1Very low79 Ų79143.4 Ų143.481%0.81482%0.824SS**  cis131.2146.5800000109.5
230R33.2Very low34.3Very low209 Ų209146.6 Ų146.679%0.78983%0.828SS**  cis-172.6125.63.1165.7-168.1168.3-174.9-2.3110.1
231Q34.4Very low34.1Very low144 Ų144148 Ų14867%0.67383%0.827SS**  trans62.9165157.2-64.2167.2-10.400116.5
232T29.9Very low34.3Very low136 Ų136148.9 Ų148.983%0.83483%0.826SS**  cis-159.4163.2-4.51.50000111.3
233G30.8Very low34.8Very low61 Ų61146.7 Ų146.763%0.62983%0.827SS**  trans94.7156.3159.800000116.2
234T33.8Very low35Very low143 Ų143140.5 Ų140.588%0.87782%0.822SS**  cis172.9151.4-25.714.90000105.8
235A30.5Very low35.4Very low102 Ų102134.3 Ų134.384%0.84382%0.815SS**  trans76.2143.5171.800000119.3
236S36.5Very low36.2Very low116 Ų116134.1 Ų134.181%0.81181%0.812SS**  trans-143.2169.1165.1-58.70000105.2
237P58Low36.7Very low119 Ų119129.1 Ų129.177%0.77381%0.808SS**  cis-124.2177.22.742-29.1000113.5
238D29Very low37.2Very low160 Ų160128.5 Ų128.586%0.85681%0.807SS**  trans-162.7170.1132.1-131.3-34.5000113.4
239L42Very low37.9Very low161 Ų161130.7 Ų130.784%0.84380%0.803SS**  trans-102.6114.7-171.5-71.9165.2000114.3
240V37.3Very low38.4Very low143 Ų143132.1 Ų132.187%0.86780%0.801SS**  trans-142.2147159.7-173.90000110.6
241L43.9Very low39Very low171 Ų171128 Ų12890%0.89580%0.798SS**  trans-65.1134.9179.1-73.172.5000112.7
242A34.4Very low39.9Very low96 Ų96126.6 Ų126.679%0.79380%0.8SS**  trans-143.7133.1153.600000109.5
243Q44.4Very low41Very low198 Ų198125.3 Ų125.393%0.92579%0.793SS**  trans-83.5133-178.9-62.3173.59.900110.6
244S35.2Very low42.4Very low125 Ų125125.4 Ų125.487%0.87478%0.779SS**  trans-139.996167.452.90000111.2
245S39.2Very low44.3Very low105 Ų105124.7 Ų124.773%0.73477%0.766SS**  trans-121158.9165.566.40000108.2
246P45.3Very low46.6Very low112 Ų112123.7 Ų123.773%0.72776%0.758SS**  trans-66153.4-160.325.3-34.3000113.1
247P42.6Very low48.9Very low114 Ų114122.5 Ų122.574%0.7474%0.739SS**  trans-56.4135-177.924-34.6000110.5V249P247-V249 PolarHBondContact O-N 3.37Å
248P42.1Very low50.2Low124 Ų124117.6 Ų117.681%0.80571%0.706SS**  trans-63.8113.3-177.725.6-33.5000109.4S250P248-S250 PolarHBondContact O-N 3.25Å
249V43.5Very low53Low127 Ų127114.6 Ų114.677%0.7769%0.687SS**  trans-55.5123.3164.2-75.50000107.5P247 V251P247-V249 PolarHBondContact O-N 3.37Å; V249-V251 HydrophobicContact CG2-CG2 4.38Å; V249-V251 PolarHBondContact O-N 3Å
250S39.8Very low55.3Low109 Ų109109.5 Ų109.576%0.76266%0.661SS**  trans-76.365.3-171.748.10000112P248 V252P248-S250 PolarHBondContact O-N 3.25Å; S250-V252 PolarHBondContact O-N 3.06Å
251V45.7Very low57.9Low121 Ų121102.9 Ų102.973%0.73362%0.62SS**  trans-68.773.4158.1-172.60000106.7V249 P253V249-V251 HydrophobicContact CG2-CG2 4.38Å; V249-V251 PolarHBondContact O-N 3Å; V251-P253 WeakPolarHBondContact O-CD 3.38Å; V251-P253 VanDerWaalsContact O-N 3.09Å
252V54.1Low60Low115 Ų11595.6 Ų95.670%0.69758%0.581SS**  trans-56.8113.9172.2177.80000106.2S250 L254S250-V252 PolarHBondContact O-N 3.06Å; V252-L254 PolarHBondContact O-N 2.79Å; V252-L254 VanDerWaalsContact O-N 3.16Å
253P54Low62.7Low109 Ų10994.6 Ų94.671%0.70857%0.565SS**PPolyproline II helixtrans-63.5122.6173.7-16.431.6000106.7V251 E255V251-P253 WeakPolarHBondContact O-CD 3.38Å; V251-P253 VanDerWaalsContact O-N 3.09Å; P253-E255 PolarHBondContact O-N 3.22Å
254L60.1Low65Low63 Ų6387.3 Ų87.333%0.3353%0.53SS..PPolyproline II helixtrans-54.8131.4163.2-73.9130.2000107V252 A256 H259 M262 F289V252-L254 PolarHBondContact O-N 2.79Å; V252-L254 VanDerWaalsContact O-N 3.16Å; L254-A256 PolarHBondContact O-N 3.44Å; L254-H259 HydrophobicContact CB-CB 4.19Å; L254-M262 HydrophobicContact CD2-CE 4.45Å; L254-M262 HydrophobicContact CD2-SD 4.43Å; L254-F289 HydrophobicContact CD1-CD1 3.86Å; L254-F289 HydrophobicContact CD1-CE1 3.48Å; L254-F289 VanDerWaalsContact CD1-CE1 3.48Å; L254-F289 HydrophobicContact CD1-CZ 3.98Å; L254-F289 HydrophobicContact CD2-CD1 3.88Å; L254-F289 HydrophobicContact CD2-CE1 4.18Å; L254-F289 HydrophobicContact CG-CE1 4.5Å
255E72.1Confident67.6Low128 Ų12881.4 Ų81.460%0.59849%0.489SS*.PPolyproline II helixtrans-52.9133.8174.7-65.6178.2149.900108.1P253 Q257 E258 H259P253-E255 PolarHBondContact O-N 3.22Å; E255-Q257 PolarHBondContact O-N 3.44Å; E255-E258 HydrophobicContact CB-CB 4.47Å; E255-E258 HydrophobicContact CB-CG 4.16Å; E255-E258 WeakPolarHBondContact O-CA 3.01Å; E255-E258 WeakPolarHBondContact O-CB 3.41Å; E255-E258 PolarHBondContact O-N 3.48Å; E255-H259 PolarHBondContact O-N 3.06Å
256A80.6Confident70.1Confident81 Ų8178.3 Ų78.367%0.66947%0.47SS*.Hα-helixtrans-57.6-30.9-166.700000112.6L254 D260L254-A256 PolarHBondContact O-N 3.44Å; A256-D260 VanDerWaalsContact O-CB 3.26Å; A256-D260 WeakPolarHBondContact O-CB 3.44Å; A256-D260 PolarHBondContact O-N 3.38Å
257Q83.1Confident72.3Confident91 Ų9176.5 Ų76.543%0.42547%0.465SS..Hα-helixtrans-69.7-39.3173.3-71.4152-76.900113.1E255 W261 D280 L283E255-Q257 PolarHBondContact O-N 3.44Å; Q257-W261 WeakPolarHBondContact O-CB 3.49Å; Q257-W261 PolarHBondContact O-N 3.35Å; Q257-D280 PolarHBondContact NE2-OD1 3.4Å; Q257-D280 PolarHBondContact NE2-OD2 2.96Å; Q257-L283 HydrophobicContact CB-CD1 4.45Å
258E86.3Confident74.5Confident17 Ų1772 Ų728%0.07944%0.438CS..Hα-helixtrans-64-43.4173.3-68-161144.600111.7E255 M262 L283 R286E255-E258 HydrophobicContact CB-CB 4.47Å; E255-E258 HydrophobicContact CB-CG 4.16Å; E255-E258 WeakPolarHBondContact O-CA 3.01Å; E255-E258 WeakPolarHBondContact O-CB 3.41Å; E255-E258 PolarHBondContact O-N 3.48Å; E258-M262 VanDerWaalsContact O-CG 3.27Å; E258-M262 WeakPolarHBondContact O-CG 3.36Å; E258-M262 PolarHBondContact O-N 3.21Å; E258-L283 HydrophobicContact CG-CD2 3.74Å; E258-R286 WeakPolarHBondContact OE1-CD 3.31Å; E258-R286 WeakPolarHBondContact OE1-CG 3.42Å; E258-R286 IonicContact OE1-CZ 3.21Å; E258-R286 IonicContact OE1-NE 2.92Å; E258-R286 PolarHBondContact OE1-NE 3.48Å; E258-R286 IonicContact OE1-NH2 3.27Å; E258-R286 PolarHBondContact OE1-NH2 3.34Å; E258-R286 IonicContact OE2-CZ 3.25Å; E258-R286 VanDerWaalsContact OE2-CZ 3.25Å; E258-R286 IonicContact OE2-NE 2.67Å; E258-R286 PolarHBondContact OE2-NE 2.71Å; E258-R286 IonicContact OE2-NH2 2.74Å; E258-R286 PolarHBondContact OE2-NH2 3.48Å
259H88.3Confident77Confident97 Ų9767.2 Ų67.245%0.44941%0.41SS..Hα-helixtrans-64.6-50177.6174.7-91.9000111.8L254 E255 W261 M262 V263L254-H259 HydrophobicContact CB-CB 4.19Å; E255-H259 PolarHBondContact O-N 3.06Å; H259-W261 VanDerWaalsContact C-N 3.32Å; H259-W261 PolarHBondContact O-N 3.44Å; H259-M262 PolarHBondContact O-N 3.32Å; H259-V263 WeakPolarHBondContact O-CG2 3.32Å; H259-V263 PolarHBondContact O-N 3Å
260D90.3Very high79.2Confident54 Ų5462.2 Ų62.229%0.28938%0.377SS..Hα-helixtrans-60.4-41.2178.5-175.844.5000111.8A256 V263 K264A256-D260 VanDerWaalsContact O-CB 3.26Å; A256-D260 WeakPolarHBondContact O-CB 3.44Å; A256-D260 PolarHBondContact O-N 3.38Å; D260-V263 PolarHBondContact O-N 3.4Å; D260-K264 WeakPolarHBondContact O-CB 3.37Å; D260-K264 WeakPolarHBondContact O-CD 3.44Å; D260-K264 WeakPolarHBondContact O-CG 3.46Å; D260-K264 PolarHBondContact O-N 3.46Å; D260-K264 WeakPolarHBondContact OD1-CD 3.44Å; D260-K264 WeakPolarHBondContact OD1-CE 3.32Å; D260-K264 IonicContact OD1-NZ 3.87Å; D260-K264 PolarHBondContact OD1-NZ 3.16Å; D260-K264 IonicContact OD2-NZ 2.61Å; D260-K264 PolarHBondContact OD2-NZ 2.91Å
261W90.5Very high81.7Confident4 Ų461.6 Ų61.62%0.01537%0.371CS..Hα-helixtrans-57.8-49.3172.1172.8-102.3000113.1Q257 H259 K264 A265 I273 L276 F277 L283 L284 V295Q257-W261 WeakPolarHBondContact O-CB 3.49Å; Q257-W261 PolarHBondContact O-N 3.35Å; H259-W261 VanDerWaalsContact C-N 3.32Å; H259-W261 PolarHBondContact O-N 3.44Å; W261-K264 PolarHBondContact O-N 2.94Å; W261-A265 WeakPolarHBondContact O-CB 3.41Å; W261-A265 PolarHBondContact O-N 3.33Å; W261-I273 HydrophobicContact CE3-CG1 4.1Å; W261-I273 HydrophobicContact CH2-CG2 3.99Å; W261-I273 HydrophobicContact CZ3-CB 4.22Å; W261-I273 HydrophobicContact CZ3-CG1 4.11Å; W261-I273 HydrophobicContact CZ3-CG2 3.8Å; W261-L276 HydrophobicContact CB-CD1 4.12Å; W261-L276 HydrophobicContact CE3-CB 3.87Å; W261-L276 HydrophobicContact CE3-CD1 4.17Å; W261-L276 HydrophobicContact CZ3-CB 4.25Å; W261-F277 HydrophobicContact CH2-CB 4.16Å; W261-F277 HydrophobicContact CZ3-CB 3.93Å; W261-L283 HydrophobicContact CB-CD1 3.97Å; W261-L283 HydrophobicContact CD2-CB 3.73Å; W261-L283 HydrophobicContact CD2-CD1 4.12Å; W261-L283 HydrophobicContact CE3-CB 4.21Å; W261-L283 HydrophobicContact CE3-CD1 4.13Å; W261-L283 HydrophobicContact CG-CB 3.91Å; W261-L283 HydrophobicContact CG-CD1 4.09Å; W261-L283 HydrophobicContact CZ2-CB 4.19Å; W261-L283 PolarHBondContact NE1-O 3.14Å; W261-L284 HydrophobicContact CH2-CD2 4.06Å; W261-L284 HydrophobicContact CZ2-CD2 4.16Å; W261-V295 HydrophobicContact CH2-CG1 4.42Å; W261-V295 HydrophobicContact CZ2-CB 3.79Å; W261-V295 HydrophobicContact CZ2-CG1 3.71Å; W261-V295 HydrophobicContact CZ2-CG2 4.08Å
262M89.3Confident83.9Confident17 Ų1759.4 Ų59.48%0.08436%0.355CS..Hα-helixtrans-64.1-43.1178.5-71.7177.1-169.700112.2L254 E258 H259 A265 A266 R286 K287 D288 F289L254-M262 HydrophobicContact CD2-CE 4.45Å; L254-M262 HydrophobicContact CD2-SD 4.43Å; E258-M262 VanDerWaalsContact O-CG 3.27Å; E258-M262 WeakPolarHBondContact O-CG 3.36Å; E258-M262 PolarHBondContact O-N 3.21Å; H259-M262 PolarHBondContact O-N 3.32Å; M262-A265 PolarHBondContact O-N 2.92Å; M262-A266 WeakPolarHBondContact O-CB 3.08Å; M262-A266 PolarHBondContact O-N 3.46Å; M262-R286 HydrophobicContact CE-CG 3.71Å; M262-K287 VanDerWaalsContact CE-O 3.3Å; M262-K287 WeakPolarHBondContact CE-O 3.25Å; M262-D288 HydrophobicContact SD-CB 4.36Å; M262-F289 HydrophobicContact SD-CD1 4.18Å; M262-F289 HydrophobicContact SD-CE1 4.43Å
263V90.4Very high85.7Confident75 Ų7554 Ų5446%0.45532%0.322SS..Hα-helixtrans-63.9-44178.4170.80000110.9H259 D260 A266 A267H259-V263 WeakPolarHBondContact O-CG2 3.32Å; H259-V263 PolarHBondContact O-N 3Å; D260-V263 PolarHBondContact O-N 3.4Å; V263-A266 PolarHBondContact O-N 2.93Å; V263-A267 WeakPolarHBondContact O-CB 3.37Å; V263-A267 PolarHBondContact O-N 3.44Å
264K91.9Very high87.4Confident45 Ų4550.7 Ų50.720%0.19630%0.296CS..Hα-helixtrans-66.3-35.6176.3-77.1161.9169.4166.30112.7D260 W261 A267 G268 A269 D272 I273 L276D260-K264 WeakPolarHBondContact O-CB 3.37Å; D260-K264 WeakPolarHBondContact O-CD 3.44Å; D260-K264 WeakPolarHBondContact O-CG 3.46Å; D260-K264 PolarHBondContact O-N 3.46Å; D260-K264 WeakPolarHBondContact OD1-CD 3.44Å; D260-K264 WeakPolarHBondContact OD1-CE 3.32Å; D260-K264 IonicContact OD1-NZ 3.87Å; D260-K264 PolarHBondContact OD1-NZ 3.16Å; D260-K264 IonicContact OD2-NZ 2.61Å; D260-K264 PolarHBondContact OD2-NZ 2.91Å; W261-K264 PolarHBondContact O-N 2.94Å; K264-A267 PolarHBondContact O-N 2.94Å; K264-G268 PolarHBondContact O-N 3.42Å; K264-A269 HydrophobicContact CB-CB 4.04Å; K264-A269 HydrophobicContact CG-CB 4.06Å; K264-A269 PolarHBondContact O-N 3.35Å; K264-D272 HydrophobicContact CD-CB 3.61Å; K264-D272 HydrophobicContact CG-CB 4.2Å; K264-I273 HydrophobicContact CB-CG1 4.24Å; K264-L276 HydrophobicContact CD-CD1 3.78Å
265A91.6Very high88.9Confident1 Ų150.1 Ų50.11%0.00830%0.3CS..Hα-helixtrans-65.1-46.4172.700000112W261 M262 A267 G268 I273 V295 W298 H302W261-A265 WeakPolarHBondContact O-CB 3.41Å; W261-A265 PolarHBondContact O-N 3.33Å; M262-A265 PolarHBondContact O-N 2.92Å; A265-A267 VanDerWaalsContact C-N 3.3Å; A265-A267 PolarHBondContact O-N 2.9Å; A265-G268 PolarHBondContact O-N 2.96Å; A265-I273 VanDerWaalsContact CA-CD1 3.5Å; A265-I273 HydrophobicContact CB-CD1 3.84Å; A265-V295 HydrophobicContact CB-CG2 4.13Å; A265-W298 HydrophobicContact CB-CB 4.06Å; A265-W298 HydrophobicContact CB-CG 3.83Å; A265-H302 PolarHBondContact O-NE2 2.91Å
266A90.4Very high89.7Confident40 Ų4045 Ų4533%0.33128%0.276SS..Hα-helixtrans-60.6-40.117600000112.3M262 V263 W298 H302M262-A266 WeakPolarHBondContact O-CB 3.08Å; M262-A266 PolarHBondContact O-N 3.46Å; V263-A266 PolarHBondContact O-N 2.93Å; A266-W298 HydrophobicContact CB-CD2 4.4Å; A266-W298 HydrophobicContact CB-CE3 4.15Å; A266-W298 HydrophobicContact CB-CH2 3.85Å; A266-W298 HydrophobicContact CB-CZ2 4.13Å; A266-W298 HydrophobicContact CB-CZ3 3.85Å; A266-H302 PolarHBondContact O-CE1 3.06Å; A266-H302 PolarHBondContact O-NE2 2.94Å; A266-H302 VanDerWaalsContact O-NE2 3.16Å
267A91.3Very high90.1Very high75 Ų7541.5 Ų41.562%0.6225%0.246SC*.Hα-helixtrans-73.4-21.3177.500000114.6V263 K264 A265V263-A267 WeakPolarHBondContact O-CB 3.37Å; V263-A267 PolarHBondContact O-N 3.44Å; K264-A267 PolarHBondContact O-N 2.94Å; A265-A267 VanDerWaalsContact C-N 3.3Å; A265-A267 PolarHBondContact O-N 2.9Å
268G90.1Very high90.2Very high18 Ų1845.7 Ų45.719%0.18626%0.258CS..THydrogen-bonded Turntrans78.624.3-171.800000113.6K264 A265 W270 H302K264-G268 PolarHBondContact O-N 3.42Å; A265-G268 PolarHBondContact O-N 2.96Å; G268-W270 VanDerWaalsContact O-CD1 3.22Å; G268-W270 PolarHBondContact O-N 3.23Å; G268-W270 PolarHBondContact O-NE1 2.92Å; G268-H302 PolarHBondContact N-NE2 2.94Å
269A93.4Very high90.4Very high25 Ų2549.8 Ų49.821%0.20728%0.284CS..  trans-78.462.4179.600000111.6K264 P271 D272 I273K264-A269 HydrophobicContact CB-CB 4.04Å; K264-A269 HydrophobicContact CG-CB 4.06Å; K264-A269 PolarHBondContact O-N 3.35Å; A269-P271 VanDerWaalsContact C-CD 3.46Å; A269-D272 HydrophobicContact CB-CB 4.42Å; A269-D272 PolarHBondContact O-N 2.98Å; A269-D272 VanDerWaalsContact O-N 3.1Å; A269-I273 PolarHBondContact O-N 2.81Å; A269-I273 VanDerWaalsContact O-N 3.1Å
270W91.1Very high90.2Very high21 Ų2146.7 Ų46.78%0.0827%0.271CS..Hα-helixtrans-55.8-39.7-173.6-48.9123.7000115.4G268 D272 I273 Y274 V295 W298 I299 H302 D304 V307G268-W270 VanDerWaalsContact O-CD1 3.22Å; G268-W270 PolarHBondContact O-N 3.23Å; G268-W270 PolarHBondContact O-NE1 2.92Å; W270-D272 VanDerWaalsContact C-N 3.29Å; W270-D272 PolarHBondContact O-N 2.85Å; W270-I273 HydrophobicContact CE3-CD1 3.66Å; W270-I273 HydrophobicContact CZ3-CD1 3.72Å; W270-I273 WeakPolarHBondContact O-CB 3.48Å; W270-I273 PolarHBondContact O-N 3.02Å; W270-Y274 HydrophobicContact CB-CE2 4.17Å; W270-Y274 WeakPolarHBondContact O-CD2 3.26Å; W270-Y274 PolarHBondContact O-N 2.95Å; W270-V295 HydrophobicContact CZ3-CG2 4.32Å; W270-W298 HydrophobicContact CH2-CB 4.35Å; W270-I299 HydrophobicContact CE3-CG1 4.27Å; W270-I299 HydrophobicContact CH2-CB 4.15Å; W270-I299 HydrophobicContact CH2-CG1 3.44Å; W270-I299 VanDerWaalsContact CH2-CG1 3.44Å; W270-I299 HydrophobicContact CZ2-CG1 4.17Å; W270-I299 HydrophobicContact CZ3-CD1 4.39Å; W270-I299 HydrophobicContact CZ3-CG1 3.5Å; W270-I299 VanDerWaalsContact CZ3-CG1 3.5Å; W270-H302 AromaticContact CH2-CD2 3.71Å; W270-H302 HydrophobicContact CZ2-CB 3.9Å; W270-H302 AromaticContact CZ2-CD2 3.41Å; W270-H302 VanDerWaalsContact CZ2-CD2 3.41Å; W270-H302 WeakPolarHBondContact CZ2-CD2 3.42Å; W270-H302 AromaticContact CZ2-CG 3.92Å; W270-D304 PolarHBondContact NE1-OD2 2.6Å; W270-V307 HydrophobicContact CB-CG1 4.18Å; W270-V307 HydrophobicContact CB-CG2 3.91Å; W270-V307 HydrophobicContact CD2-CB 4.3Å; W270-V307 HydrophobicContact CD2-CG1 3.53Å; W270-V307 HydrophobicContact CD2-CG2 3.9Å; W270-V307 HydrophobicContact CE3-CG1 3.6Å; W270-V307 HydrophobicContact CG-CB 4.28Å; W270-V307 HydrophobicContact CG-CG1 3.81Å; W270-V307 HydrophobicContact CG-CG2 3.44Å; W270-V307 VanDerWaalsContact CG-CG2 3.44Å; W270-V307 HydrophobicContact CZ3-CG1 4.21Å
271P91.3Very high89.9Confident96 Ų9645.4 Ų45.462%0.62327%0.266SS*.Hα-helixtrans-57.9-40.6175.1-25.336.3000113A269 Y274 A275A269-P271 VanDerWaalsContact C-CD 3.46Å; P271-Y274 PolarHBondContact O-N 2.99Å; P271-A275 PolarHBondContact O-N 2.75Å
272D91.8Very high89.6Confident75 Ų7549.6 Ų49.640%0.40130%0.297SS..Hα-helixtrans-73.8-34-179.9-59.4-20000111.3K264 A269 W270 Y274 A275 L276K264-D272 HydrophobicContact CD-CB 3.61Å; K264-D272 HydrophobicContact CG-CB 4.2Å; A269-D272 HydrophobicContact CB-CB 4.42Å; A269-D272 PolarHBondContact O-N 2.98Å; A269-D272 VanDerWaalsContact O-N 3.1Å; W270-D272 VanDerWaalsContact C-N 3.29Å; W270-D272 PolarHBondContact O-N 2.85Å; D272-Y274 VanDerWaalsContact C-N 3.29Å; D272-Y274 PolarHBondContact O-N 3.37Å; D272-A275 WeakPolarHBondContact O-CB 3.45Å; D272-A275 PolarHBondContact O-N 3.33Å; D272-A275 VanDerWaalsContact O-N 3.1Å; D272-L276 WeakPolarHBondContact O-CG 3.28Å; D272-L276 PolarHBondContact O-N 3.44Å
273I91.6Very high89.3Confident1 Ų149 Ų491%0.00529%0.294CS..Hα-helixtrans-58.9-40.8168-87.6166.8000111.3W261 K264 A265 A269 W270 A275 L276 F277 V295W261-I273 HydrophobicContact CE3-CG1 4.1Å; W261-I273 HydrophobicContact CH2-CG2 3.99Å; W261-I273 HydrophobicContact CZ3-CB 4.22Å; W261-I273 HydrophobicContact CZ3-CG1 4.11Å; W261-I273 HydrophobicContact CZ3-CG2 3.8Å; K264-I273 HydrophobicContact CB-CG1 4.24Å; A265-I273 VanDerWaalsContact CA-CD1 3.5Å; A265-I273 HydrophobicContact CB-CD1 3.84Å; A269-I273 PolarHBondContact O-N 2.81Å; A269-I273 VanDerWaalsContact O-N 3.1Å; W270-I273 HydrophobicContact CE3-CD1 3.66Å; W270-I273 HydrophobicContact CZ3-CD1 3.72Å; W270-I273 WeakPolarHBondContact O-CB 3.48Å; W270-I273 PolarHBondContact O-N 3.02Å; I273-A275 VanDerWaalsContact C-N 3.29Å; I273-A275 PolarHBondContact O-N 2.73Å; I273-L276 PolarHBondContact O-N 3.46Å; I273-F277 WeakPolarHBondContact O-CB 3.45Å; I273-F277 PolarHBondContact O-N 3.1Å; I273-V295 HydrophobicContact CD1-CG2 3.89Å
274Y90Very high89Confident40 Ų4045.5 Ų45.516%0.15727%0.272CS..Hα-helixtrans-71.7-22.9174.6-60.9-52.9000113.4W270 P271 D272 R278 V307 T310 L311W270-Y274 HydrophobicContact CB-CE2 4.17Å; W270-Y274 WeakPolarHBondContact O-CD2 3.26Å; W270-Y274 PolarHBondContact O-N 2.95Å; P271-Y274 PolarHBondContact O-N 2.99Å; D272-Y274 VanDerWaalsContact C-N 3.29Å; D272-Y274 PolarHBondContact O-N 3.37Å; Y274-R278 VanDerWaalsContact C-NH1 3.35Å; Y274-R278 VanDerWaalsContact O-CG 3.31Å; Y274-R278 WeakPolarHBondContact O-CG 3.5Å; Y274-R278 PolarHBondContact O-N 3.4Å; Y274-R278 PolarHBondContact O-NH1 3.15Å; Y274-V307 VanDerWaalsContact OH-CA 3.22Å; Y274-V307 WeakPolarHBondContact OH-CA 3.31Å; Y274-V307 VanDerWaalsContact OH-CG1 3.28Å; Y274-V307 WeakPolarHBondContact OH-CG1 3.05Å; Y274-V307 PolarHBondContact OH-O 2.9Å; Y274-T310 PolarHBondContact OH-OG1 3.4Å; Y274-L311 HydrophobicContact CD1-CD1 4.18Å; Y274-L311 HydrophobicContact CE1-CB 3.85Å; Y274-L311 HydrophobicContact CE1-CD1 3.83Å; Y274-L311 HydrophobicContact CE1-CG 4.44Å
275A90.9Very high88.5Confident51 Ų5147.3 Ų47.342%0.42128%0.284SS..Hα-helixtrans-71.7-53169.800000110.2P271 D272 I273 F277 R278 T279P271-A275 PolarHBondContact O-N 2.75Å; D272-A275 WeakPolarHBondContact O-CB 3.45Å; D272-A275 PolarHBondContact O-N 3.33Å; D272-A275 VanDerWaalsContact O-N 3.1Å; I273-A275 VanDerWaalsContact C-N 3.29Å; I273-A275 PolarHBondContact O-N 2.73Å; A275-F277 PolarHBondContact O-N 3.4Å; A275-R278 WeakPolarHBondContact O-CB 3.4Å; A275-R278 PolarHBondContact O-N 3.46Å; A275-R278 VanDerWaalsContact O-N 3.15Å; A275-T279 PolarHBondContact O-N 2.82Å; A275-T279 PolarHBondContact O-OG1 3.12Å
276L89.6Confident88.2Confident20 Ų2053.1 Ų53.111%0.10531%0.306CS..Hα-helixtrans-58-46.9177.6-70175.2000112.2W261 K264 D272 I273 R278 T279 D280W261-L276 HydrophobicContact CB-CD1 4.12Å; W261-L276 HydrophobicContact CE3-CB 3.87Å; W261-L276 HydrophobicContact CE3-CD1 4.17Å; W261-L276 HydrophobicContact CZ3-CB 4.25Å; K264-L276 HydrophobicContact CD-CD1 3.78Å; D272-L276 WeakPolarHBondContact O-CG 3.28Å; D272-L276 PolarHBondContact O-N 3.44Å; I273-L276 PolarHBondContact O-N 3.46Å; L276-R278 PolarHBondContact O-N 2.86Å; L276-T279 CarbonylContact O-C 3.33Å; L276-T279 WeakPolarHBondContact O-CB 3.21Å; L276-T279 PolarHBondContact O-N 3.46Å; L276-T279 VanDerWaalsContact O-N 3.1Å; L276-D280 PolarHBondContact O-N 3.09Å
277F88.4Confident88.1Confident8 Ų855.2 Ų55.24%0.03531%0.308CS..Hα-helixtrans-64.1-24.1179.2174-111.7000113.8W261 I273 A275 S281 L284 L311 G314 M315 K318W261-F277 HydrophobicContact CH2-CB 4.16Å; W261-F277 HydrophobicContact CZ3-CB 3.93Å; I273-F277 WeakPolarHBondContact O-CB 3.45Å; I273-F277 PolarHBondContact O-N 3.1Å; A275-F277 PolarHBondContact O-N 3.4Å; F277-S281 WeakPolarHBondContact CE2-OG 3.22Å; F277-L284 HydrophobicContact CD2-CD1 4.05Å; F277-L284 HydrophobicContact CD2-CD2 3.94Å; F277-L284 HydrophobicContact CD2-CG 3.88Å; F277-L284 HydrophobicContact CE2-CD1 3.47Å; F277-L284 VanDerWaalsContact CE2-CD1 3.47Å; F277-L284 HydrophobicContact CE2-CD2 4.12Å; F277-L284 HydrophobicContact CE2-CG 3.84Å; F277-L284 HydrophobicContact CZ-CD1 4.24Å; F277-L311 HydrophobicContact CD1-CD1 4.09Å; F277-L311 HydrophobicContact CG-CD1 4.23Å; F277-G314 WeakPolarHBondContact CE1-O 3.26Å; F277-M315 HydrophobicContact CE1-CG 4.1Å; F277-M315 HydrophobicContact CE2-CG 4.13Å; F277-M315 HydrophobicContact CZ-CB 4.38Å; F277-M315 HydrophobicContact CZ-CG 3.57Å; F277-K318 HydrophobicContact CE1-CD 4.41Å; F277-K318 HydrophobicContact CE2-CD 4.37Å; F277-K318 HydrophobicContact CZ-CD 3.85Å; F277-K318 PolarHBondContact O-NZ 2.87Å
278R86.9Confident87.9Confident179 Ų17952.3 Ų52.368%0.67528%0.281SS*.Hα-helixtrans-68.2-47.8172.1-79176.4-175.998.9-7.9110.3Y274 A275 L276 K318Y274-R278 VanDerWaalsContact C-NH1 3.35Å; Y274-R278 VanDerWaalsContact O-CG 3.31Å; Y274-R278 WeakPolarHBondContact O-CG 3.5Å; Y274-R278 PolarHBondContact O-N 3.4Å; Y274-R278 PolarHBondContact O-NH1 3.15Å; A275-R278 WeakPolarHBondContact O-CB 3.4Å; A275-R278 PolarHBondContact O-N 3.46Å; A275-R278 VanDerWaalsContact O-N 3.15Å; L276-R278 PolarHBondContact O-N 2.86Å; R278-K318 PolarHBondContact O-NZ 3.44Å
279T89.3Confident87.6Confident103 Ų10358 Ų5863%0.63230%0.301SS*.Hα-helixtrans-63-60.4174.8-42.70000111.4A275 L276A275-T279 PolarHBondContact O-N 2.82Å; A275-T279 PolarHBondContact O-OG1 3.12Å; L276-T279 CarbonylContact O-C 3.33Å; L276-T279 WeakPolarHBondContact O-CB 3.21Å; L276-T279 PolarHBondContact O-N 3.46Å; L276-T279 VanDerWaalsContact O-N 3.1Å
280D84.9Confident87.2Confident32 Ų3262.6 Ų62.617%0.17132%0.321CS..  trans-119.999.2-162.6-54-56.7000110.4Q257 L276 L283Q257-D280 PolarHBondContact NE2-OD1 3.4Å; Q257-D280 PolarHBondContact NE2-OD2 2.96Å; L276-D280 PolarHBondContact O-N 3.09Å; D280-L283 HydrophobicContact CB-CD1 3.58Å; D280-L283 HydrophobicContact CB-CG 3.82Å
281S84.1Confident86.9Confident27 Ų2763 Ų6319%0.18933%0.327CS..SBendtrans-80.5-16.5-173.5-149.30000114.1F277 K318 L320F277-S281 WeakPolarHBondContact CE2-OG 3.22Å; S281-K318 WeakPolarHBondContact OG-CD 3.5Å; S281-L320 VanDerWaalsContact O-CD2 3.32Å; S281-L320 WeakPolarHBondContact O-CD2 3.45Å; S281-L320 WeakPolarHBondContact OG-CD1 3.21Å; S281-L320 VanDerWaalsContact OG-CD2 3.32Å; S281-L320 WeakPolarHBondContact OG-CD2 3.05Å
282S83.3Confident86.8Confident93 Ų9358.7 Ų58.765%0.6530%0.301SS*.G310 helixtrans-71.9-28-177.547.60000113.8L284S282-L284 PolarHBondContact O-N 3.07Å; S282-L284 VanDerWaalsContact O-N 3.11Å
283L83.8Confident86.8Confident5 Ų556.7 Ų56.73%0.02629%0.288CS..G310 helixtrans-64.1-20.5-169.2-56.2179.6000114.2Q257 E258 W261 D280 N285 R286Q257-L283 HydrophobicContact CB-CD1 4.45Å; E258-L283 HydrophobicContact CG-CD2 3.74Å; W261-L283 HydrophobicContact CB-CD1 3.97Å; W261-L283 HydrophobicContact CD2-CB 3.73Å; W261-L283 HydrophobicContact CD2-CD1 4.12Å; W261-L283 HydrophobicContact CE3-CB 4.21Å; W261-L283 HydrophobicContact CE3-CD1 4.13Å; W261-L283 HydrophobicContact CG-CB 3.91Å; W261-L283 HydrophobicContact CG-CD1 4.09Å; W261-L283 HydrophobicContact CZ2-CB 4.19Å; W261-L283 PolarHBondContact NE1-O 3.14Å; D280-L283 HydrophobicContact CB-CD1 3.58Å; D280-L283 HydrophobicContact CB-CG 3.82Å; L283-N285 PolarHBondContact O-N 3.07Å; L283-R286 WeakPolarHBondContact O-CB 3.46Å; L283-R286 PolarHBondContact O-N 3.31Å
284L82.6Confident86.8Confident0 Ų056.7 Ų56.70%029%0.288CS..G310 helixtrans-52.6-48.9-177.9-71.9171000114.4W261 F277 S282 R286 V295 L311 M315 L320 F322W261-L284 HydrophobicContact CH2-CD2 4.06Å; W261-L284 HydrophobicContact CZ2-CD2 4.16Å; F277-L284 HydrophobicContact CD2-CD1 4.05Å; F277-L284 HydrophobicContact CD2-CD2 3.94Å; F277-L284 HydrophobicContact CD2-CG 3.88Å; F277-L284 HydrophobicContact CE2-CD1 3.47Å; F277-L284 VanDerWaalsContact CE2-CD1 3.47Å; F277-L284 HydrophobicContact CE2-CD2 4.12Å; F277-L284 HydrophobicContact CE2-CG 3.84Å; F277-L284 HydrophobicContact CZ-CD1 4.24Å; S282-L284 PolarHBondContact O-N 3.07Å; S282-L284 VanDerWaalsContact O-N 3.11Å; L284-R286 VanDerWaalsContact C-N 3.33Å; L284-V295 HydrophobicContact CD2-CG1 4.33Å; L284-L311 HydrophobicContact CD2-CD1 4.13Å; L284-L311 HydrophobicContact CD2-CD2 4.19Å; L284-L311 HydrophobicContact CD2-CG 4.38Å; L284-M315 HydrophobicContact CD1-CE 3.65Å; L284-M315 HydrophobicContact CD1-CG 3.76Å; L284-M315 HydrophobicContact CD1-SD 3.56Å; L284-M315 VanDerWaalsContact CD1-SD 3.56Å; L284-M315 HydrophobicContact CD2-CG 4.42Å; L284-M315 HydrophobicContact CD2-SD 3.76Å; L284-M315 HydrophobicContact CG-SD 4.3Å; L284-L320 HydrophobicContact CD1-CB 4.41Å; L284-L320 HydrophobicContact CD1-CD2 3.8Å; L284-F322 HydrophobicContact CD2-CE2 4.18Å
285N81.9Confident86.8Confident83 Ų8354.9 Ų54.944%0.44428%0.281SS..G310 helixtrans-90.2-1.6-173.3-68.4-29.7000112.3L283L283-N285 PolarHBondContact O-N 3.07Å
286R85.5Confident86.9Confident124 Ų12452.6 Ų52.647%0.46826%0.262SS..  trans-69.8145.3175.5-164.161.8162.6-174-21.3110.2E258 M262 L283 L284E258-R286 WeakPolarHBondContact OE1-CD 3.31Å; E258-R286 WeakPolarHBondContact OE1-CG 3.42Å; E258-R286 IonicContact OE1-CZ 3.21Å; E258-R286 IonicContact OE1-NE 2.92Å; E258-R286 PolarHBondContact OE1-NE 3.48Å; E258-R286 IonicContact OE1-NH2 3.27Å; E258-R286 PolarHBondContact OE1-NH2 3.34Å; E258-R286 IonicContact OE2-CZ 3.25Å; E258-R286 VanDerWaalsContact OE2-CZ 3.25Å; E258-R286 IonicContact OE2-NE 2.67Å; E258-R286 PolarHBondContact OE2-NE 2.71Å; E258-R286 IonicContact OE2-NH2 2.74Å; E258-R286 PolarHBondContact OE2-NH2 3.48Å; M262-R286 HydrophobicContact CE-CG 3.71Å; L283-R286 WeakPolarHBondContact O-CB 3.46Å; L283-R286 PolarHBondContact O-N 3.31Å; L284-R286 VanDerWaalsContact C-N 3.33Å
287K87.9Confident87Confident84 Ų8451.7 Ų51.737%0.36526%0.257SS..  trans-113.9134.6-177.1-65.7-175.4-177.7-172.20109.8M262 F289 T294 K327M262-K287 VanDerWaalsContact CE-O 3.3Å; M262-K287 WeakPolarHBondContact CE-O 3.25Å; K287-F289 PolarHBondContact O-N 3.16Å; K287-T294 HydrophobicContact CG-CG2 3.73Å; K287-K327 PolarHBondContact NZ-O 3.26Å
288D87.1Confident87.2Confident13 Ų1352.4 Ų52.47%0.0726%0.26CS..  trans-52.9132.8168.9165.630.2000111M262 I290 S291 G292 F293M262-D288 HydrophobicContact SD-CB 4.36Å; D288-I290 VanDerWaalsContact C-N 3.27Å; D288-I290 PolarHBondContact O-N 3.29Å; D288-I290 WeakPolarHBondContact OD1-CB 3.42Å; D288-I290 PolarHBondContact OD1-N 2.65Å; D288-S291 WeakPolarHBondContact OD2-CA 3.48Å; D288-S291 WeakPolarHBondContact OD2-CB 3.27Å; D288-S291 PolarHBondContact OD2-N 2.99Å; D288-S291 PolarHBondContact OD2-OG 3.38Å; D288-G292 WeakPolarHBondContact O-CA 3.39Å; D288-G292 PolarHBondContact O-N 3.36Å; D288-F293 HydrophobicContact CB-CB 4.29Å; D288-F293 PolarHBondContact N-O 3.03Å
289F83.5Confident87.5Confident137 Ų13743.9 Ų43.960%0.60123%0.228SC*.THydrogen-bonded Turntrans-71.7-21179.560.8-83.8000113L254 M262 K287L254-F289 HydrophobicContact CD1-CD1 3.86Å; L254-F289 HydrophobicContact CD1-CE1 3.48Å; L254-F289 VanDerWaalsContact CD1-CE1 3.48Å; L254-F289 HydrophobicContact CD1-CZ 3.98Å; L254-F289 HydrophobicContact CD2-CD1 3.88Å; L254-F289 HydrophobicContact CD2-CE1 4.18Å; L254-F289 HydrophobicContact CG-CE1 4.5Å; M262-F289 HydrophobicContact SD-CD1 4.18Å; M262-F289 HydrophobicContact SD-CE1 4.43Å; K287-F289 PolarHBondContact O-N 3.16Å
290I85Confident87.7Confident122 Ų12239 Ų3963%0.62620%0.198SC*.THydrogen-bonded Turntrans-83.3-53178.2-51.7176.1000110.3D288D288-I290 VanDerWaalsContact C-N 3.27Å; D288-I290 PolarHBondContact O-N 3.29Å; D288-I290 WeakPolarHBondContact OD1-CB 3.42Å; D288-I290 PolarHBondContact OD1-N 2.65Å
291S86.1Confident88.1Confident30 Ų3041.2 Ų41.221%0.2121%0.206CC..THydrogen-bonded Turntrans-108.4-10-169.3-34.10000114.1D288 F293 S328 T329D288-S291 WeakPolarHBondContact OD2-CA 3.48Å; D288-S291 WeakPolarHBondContact OD2-CB 3.27Å; D288-S291 PolarHBondContact OD2-N 2.99Å; D288-S291 PolarHBondContact OD2-OG 3.38Å; S291-F293 WeakPolarHBondContact O-CD1 3.46Å; S291-F293 PolarHBondContact O-N 3.5Å; S291-S328 WeakPolarHBondContact O-CB 3.44Å; S291-T329 VanDerWaalsContact C-OG1 3.27Å; S291-T329 PolarHBondContact O-N 3.09Å; S291-T329 PolarHBondContact O-OG1 3.05Å; S291-T329 VanDerWaalsContact O-OG1 3.05Å
292G89.5Confident88.4Confident6 Ų643.2 Ų43.26%0.06221%0.212CC..  trans68.111.2-168.400000114.1D288 S328D288-G292 WeakPolarHBondContact O-CA 3.39Å; D288-G292 PolarHBondContact O-N 3.36Å; G292-S328 WeakPolarHBondContact O-CA 3.5Å
293F91.2Very high88.9Confident32 Ų3239.6 Ų39.614%0.1419%0.189CC..  trans-77.7124.4-171.3-7912.5000111.6D288 S291 H297 W298 I337D288-F293 HydrophobicContact CB-CB 4.29Å; D288-F293 PolarHBondContact N-O 3.03Å; S291-F293 WeakPolarHBondContact O-CD1 3.46Å; S291-F293 PolarHBondContact O-N 3.5Å; F293-H297 HydrophobicContact CB-CB 3.7Å; F293-H297 HydrophobicContact CD1-CB 3.95Å; F293-H297 AromaticContact CD1-CD2 3.75Å; F293-H297 AromaticContact CD1-CG 3.99Å; F293-H297 HydrophobicContact CD2-CB 3.86Å; F293-H297 HydrophobicContact CE2-CB 4.47Å; F293-H297 HydrophobicContact CG-CB 3.56Å; F293-W298 HydrophobicContact CB-CD2 4.47Å; F293-W298 HydrophobicContact CB-CZ2 4.07Å; F293-W298 AromaticContact CD2-CD2 3.99Å; F293-W298 HydrophobicContact CD2-CD2 3.99Å; F293-W298 AromaticContact CD2-CE2 3.8Å; F293-W298 HydrophobicContact CD2-CE3 4.19Å; F293-W298 HydrophobicContact CD2-CH2 4.07Å; F293-W298 AromaticContact CD2-CZ2 3.84Å; F293-W298 HydrophobicContact CD2-CZ2 3.84Å; F293-W298 HydrophobicContact CD2-CZ3 4.25Å; F293-W298 HydrophobicContact CG-CZ2 4.38Å; F293-I337 HydrophobicContact CE1-CD1 4.12Å; F293-I337 HydrophobicContact CZ-CD1 3.76Å; F293-I337 HydrophobicContact CZ-CG1 4.41Å
294T91.1Very high89.2Confident1 Ų142.7 Ų42.71%0.00621%0.206CC..  trans-75.7167.2161.960.40000110.5K287 L296 H297 W298 A326K287-T294 HydrophobicContact CG-CG2 3.73Å; T294-L296 PolarHBondContact O-N 2.84Å; T294-L296 VanDerWaalsContact O-N 3.08Å; T294-H297 PolarHBondContact N-ND1 3.15Å; T294-H297 WeakPolarHBondContact O-CB 3.33Å; T294-H297 PolarHBondContact O-N 3.26Å; T294-H297 PolarHBondContact OG1-ND1 2.93Å; T294-W298 VanDerWaalsContact O-CD1 3.29Å; T294-W298 PolarHBondContact O-N 3.46Å; T294-A326 HydrophobicContact CG2-CB 3.84Å
295V90.9Very high89.5Confident2 Ų246.1 Ų46.11%0.01222%0.222CC..Hα-helixtrans-55.7-29.9177.170.20000112.7W261 A265 W270 I273 L284 W298 I299 L311 F322W261-V295 HydrophobicContact CH2-CG1 4.42Å; W261-V295 HydrophobicContact CZ2-CB 3.79Å; W261-V295 HydrophobicContact CZ2-CG1 3.71Å; W261-V295 HydrophobicContact CZ2-CG2 4.08Å; A265-V295 HydrophobicContact CB-CG2 4.13Å; W270-V295 HydrophobicContact CZ3-CG2 4.32Å; I273-V295 HydrophobicContact CD1-CG2 3.89Å; L284-V295 HydrophobicContact CD2-CG1 4.33Å; V295-W298 WeakPolarHBondContact O-CB 3.38Å; V295-W298 PolarHBondContact O-N 3.39Å; V295-I299 HydrophobicContact CG2-CD1 4.37Å; V295-I299 WeakPolarHBondContact O-CG1 3.16Å; V295-I299 PolarHBondContact O-N 3.21Å; V295-L311 HydrophobicContact CG1-CD2 4.07Å; V295-F322 HydrophobicContact CG1-CE2 4.01Å; V295-F322 HydrophobicContact CG1-CZ 3.63Å
296L91.6Very high90Very high4 Ų451.2 Ų51.22%0.02124%0.235CC..Hα-helixtrans-70-29.3175.6-17759.1000114T294 W298 A300 I308 F322 V324 P334 L350T294-L296 PolarHBondContact O-N 2.84Å; T294-L296 VanDerWaalsContact O-N 3.08Å; L296-W298 VanDerWaalsContact C-N 3.33Å; L296-A300 WeakPolarHBondContact O-CB 3.19Å; L296-A300 PolarHBondContact O-N 3.01Å; L296-I308 HydrophobicContact CD1-CD1 3.43Å; L296-I308 VanDerWaalsContact CD1-CD1 3.43Å; L296-I308 HydrophobicContact CD1-CG1 3.91Å; L296-F322 HydrophobicContact CB-CD1 4.16Å; L296-F322 HydrophobicContact CB-CE1 3.35Å; L296-F322 HydrophobicContact CB-CE2 4.29Å; L296-F322 HydrophobicContact CB-CZ 3.46Å; L296-F322 VanDerWaalsContact CB-CZ 3.46Å; L296-F322 HydrophobicContact CD2-CD1 3.65Å; L296-F322 HydrophobicContact CD2-CE1 3.73Å; L296-F322 HydrophobicContact CD2-CG 4.34Å; L296-F322 HydrophobicContact CD2-CZ 4.42Å; L296-F322 HydrophobicContact CG-CE1 4.16Å; L296-F322 HydrophobicContact CG-CZ 4.49Å; L296-V324 HydrophobicContact CD2-CG1 4.47Å; L296-P334 HydrophobicContact CB-CG 4.21Å; L296-P334 HydrophobicContact CD2-CB 4.2Å; L296-P334 HydrophobicContact CD2-CG 3.88Å; L296-P334 HydrophobicContact CG-CB 3.77Å; L296-P334 HydrophobicContact CG-CG 3.72Å; L296-L350 HydrophobicContact CD1-CD2 4.26Å; L296-L350 HydrophobicContact CD2-CD2 4.16Å
297H92.6Very high90.3Very high0 Ų045.9 Ų45.90%022%0.216CC..Hα-helixtrans-65.9-39.5169.8-70.276.3000110.9F293 T294 A300 K301 A326 Q332F293-H297 HydrophobicContact CB-CB 3.7Å; F293-H297 HydrophobicContact CD1-CB 3.95Å; F293-H297 AromaticContact CD1-CD2 3.75Å; F293-H297 AromaticContact CD1-CG 3.99Å; F293-H297 HydrophobicContact CD2-CB 3.86Å; F293-H297 HydrophobicContact CE2-CB 4.47Å; F293-H297 HydrophobicContact CG-CB 3.56Å; T294-H297 PolarHBondContact N-ND1 3.15Å; T294-H297 WeakPolarHBondContact O-CB 3.33Å; T294-H297 PolarHBondContact O-N 3.26Å; T294-H297 PolarHBondContact OG1-ND1 2.93Å; H297-A300 PolarHBondContact O-N 3.36Å; H297-K301 WeakPolarHBondContact O-CB 3.34Å; H297-K301 PolarHBondContact O-N 3.06Å; H297-A326 PolarHBondContact CE1-O 3.3Å; H297-A326 PolarHBondContact NE2-O 2.89Å; H297-Q332 PolarHBondContact NE2-O 2.94Å; H297-Q332 VanDerWaalsContact NE2-O 3.17Å
298W92.8Very high90.5Very high23 Ų2342.3 Ų42.39%0.08720%0.201CC..Hα-helixtrans-67-42.7176.1-63.6109.2000111.8A265 A266 W270 F293 T294 V295 L296 A300 K301 H302A265-W298 HydrophobicContact CB-CB 4.06Å; A265-W298 HydrophobicContact CB-CG 3.83Å; A266-W298 HydrophobicContact CB-CD2 4.4Å; A266-W298 HydrophobicContact CB-CE3 4.15Å; A266-W298 HydrophobicContact CB-CH2 3.85Å; A266-W298 HydrophobicContact CB-CZ2 4.13Å; A266-W298 HydrophobicContact CB-CZ3 3.85Å; W270-W298 HydrophobicContact CH2-CB 4.35Å; F293-W298 HydrophobicContact CB-CD2 4.47Å; F293-W298 HydrophobicContact CB-CZ2 4.07Å; F293-W298 AromaticContact CD2-CD2 3.99Å; F293-W298 HydrophobicContact CD2-CD2 3.99Å; F293-W298 AromaticContact CD2-CE2 3.8Å; F293-W298 HydrophobicContact CD2-CE3 4.19Å; F293-W298 HydrophobicContact CD2-CH2 4.07Å; F293-W298 AromaticContact CD2-CZ2 3.84Å; F293-W298 HydrophobicContact CD2-CZ2 3.84Å; F293-W298 HydrophobicContact CD2-CZ3 4.25Å; F293-W298 HydrophobicContact CG-CZ2 4.38Å; T294-W298 VanDerWaalsContact O-CD1 3.29Å; T294-W298 PolarHBondContact O-N 3.46Å; V295-W298 WeakPolarHBondContact O-CB 3.38Å; V295-W298 PolarHBondContact O-N 3.39Å; L296-W298 VanDerWaalsContact C-N 3.33Å; W298-A300 VanDerWaalsContact C-N 3.33Å; W298-A300 PolarHBondContact O-N 3.4Å; W298-K301 HydrophobicContact CE3-CD 3.89Å; W298-K301 HydrophobicContact CZ3-CD 3.97Å; W298-K301 WeakPolarHBondContact O-CB 3.1Å; W298-K301 PolarHBondContact O-N 2.83Å; W298-K301 VanDerWaalsContact O-N 3.15Å; W298-H302 PolarHBondContact O-CD2 2.96Å; W298-H302 PolarHBondContact O-N 2.83Å
299I92.2Very high90.6Very high1 Ų143.3 Ų43.31%0.00521%0.206CC..Hα-helixtrans-60.3-45.3173.2-62.8163.1000110.3W270 V295 K301 H302 G303 V307 I308 L311 I346W270-I299 HydrophobicContact CE3-CG1 4.27Å; W270-I299 HydrophobicContact CH2-CB 4.15Å; W270-I299 HydrophobicContact CH2-CG1 3.44Å; W270-I299 VanDerWaalsContact CH2-CG1 3.44Å; W270-I299 HydrophobicContact CZ2-CG1 4.17Å; W270-I299 HydrophobicContact CZ3-CD1 4.39Å; W270-I299 HydrophobicContact CZ3-CG1 3.5Å; W270-I299 VanDerWaalsContact CZ3-CG1 3.5Å; V295-I299 HydrophobicContact CG2-CD1 4.37Å; V295-I299 WeakPolarHBondContact O-CG1 3.16Å; V295-I299 PolarHBondContact O-N 3.21Å; I299-K301 PolarHBondContact O-N 3Å; I299-H302 PolarHBondContact O-N 3.13Å; I299-G303 PolarHBondContact O-N 2.77Å; I299-V307 HydrophobicContact CD1-CG1 3.87Å; I299-V307 HydrophobicContact CG1-CG1 3.84Å; I299-V307 HydrophobicContact CG2-CB 4.46Å; I299-V307 HydrophobicContact CG2-CG1 4.45Å; I299-I308 HydrophobicContact CG2-CB 4.09Å; I299-L311 HydrophobicContact CD1-CD2 3.91Å; I299-I346 HydrophobicContact CG2-CD1 4.09Å; I299-I346 WeakPolarHBondContact O-CD1 3.43Å
300A93.6Very high91Very high0 Ų040.5 Ų40.50%020%0.2CC..Hα-helixtrans-65.4-21.3176.800000114.4L296 H297 W298 P334 I337 A338 H343 I346L296-A300 WeakPolarHBondContact O-CB 3.19Å; L296-A300 PolarHBondContact O-N 3.01Å; H297-A300 PolarHBondContact O-N 3.36Å; W298-A300 VanDerWaalsContact C-N 3.33Å; W298-A300 PolarHBondContact O-N 3.4Å; A300-P334 HydrophobicContact CB-CB 4.03Å; A300-P334 WeakPolarHBondContact CB-O 3.32Å; A300-I337 HydrophobicContact CB-CB 4.14Å; A300-I337 HydrophobicContact CB-CG2 4.25Å; A300-A338 HydrophobicContact CB-CB 4.2Å; A300-H343 PolarHBondContact O-CD2 2.8Å; A300-I346 HydrophobicContact CB-CG2 4.32Å
301K93.3Very high91.2Very high79 Ų7934.8 Ų34.834%0.34317%0.171SC..Hα-helixtrans-79.3-45.8173.2-174.7-165.8176.6-171.80111.8H297 W298 I299 I337 H343H297-K301 WeakPolarHBondContact O-CB 3.34Å; H297-K301 PolarHBondContact O-N 3.06Å; W298-K301 HydrophobicContact CE3-CD 3.89Å; W298-K301 HydrophobicContact CZ3-CD 3.97Å; W298-K301 WeakPolarHBondContact O-CB 3.1Å; W298-K301 PolarHBondContact O-N 2.83Å; W298-K301 VanDerWaalsContact O-N 3.15Å; I299-K301 PolarHBondContact O-N 3Å; K301-I337 HydrophobicContact CB-CG2 3.87Å; K301-H343 PolarHBondContact O-CD2 3.03Å; K301-H343 PolarHBondContact O-NE2 3.19Å
302H91.8Very high91.3Very high69 Ų6936.1 Ų36.132%0.31917%0.171SC..Hα-helixtrans-75.6-35.9-175.5-73-66.8000113.2A265 A266 G268 W270 W298 I299 H343A265-H302 PolarHBondContact O-NE2 2.91Å; A266-H302 PolarHBondContact O-CE1 3.06Å; A266-H302 PolarHBondContact O-NE2 2.94Å; A266-H302 VanDerWaalsContact O-NE2 3.16Å; G268-H302 PolarHBondContact N-NE2 2.94Å; W270-H302 AromaticContact CH2-CD2 3.71Å; W270-H302 HydrophobicContact CZ2-CB 3.9Å; W270-H302 AromaticContact CZ2-CD2 3.41Å; W270-H302 VanDerWaalsContact CZ2-CD2 3.41Å; W270-H302 WeakPolarHBondContact CZ2-CD2 3.42Å; W270-H302 AromaticContact CZ2-CG 3.92Å; W298-H302 PolarHBondContact O-CD2 2.96Å; W298-H302 PolarHBondContact O-N 2.83Å; I299-H302 PolarHBondContact O-N 3.13Å; H302-H343 PolarHBondContact O-CE1 3.4Å; H302-H343 PolarHBondContact O-NE2 3.34Å
303G92.1Very high91.2Very high16 Ų1642.2 Ų42.217%0.16519%0.193CC..  trans102.4-4.8175.600000115.7I299 H305 H343 I346I299-G303 PolarHBondContact O-N 2.77Å; G303-H305 VanDerWaalsContact C-N 3.34Å; G303-H305 PolarHBondContact O-N 2.95Å; G303-H343 VanDerWaalsContact CA-CD2 3.49Å; G303-H343 WeakPolarHBondContact CA-CD2 3.48Å; G303-H343 VanDerWaalsContact CA-CE1 3.44Å; G303-H343 WeakPolarHBondContact CA-CE1 3.24Å; G303-H343 WeakPolarHBondContact CA-ND1 3.41Å; G303-H343 WeakPolarHBondContact CA-NE2 3.42Å; G303-H343 PolarHBondContact N-NE2 2.93Å; G303-I346 VanDerWaalsContact C-CD1 3.46Å
304D90.9Very high91Very high71 Ų7142 Ų4238%0.3820%0.2SC..  trans-69.379.7-177-76.4-51.3000113.8W270 R306 V307W270-D304 PolarHBondContact NE1-OD2 2.6Å; D304-R306 PolarHBondContact O-N 3.2Å; D304-V307 HydrophobicContact CB-CB 4.04Å; D304-V307 HydrophobicContact CB-CG2 3.57Å; D304-V307 WeakPolarHBondContact O-CB 3.44Å; D304-V307 PolarHBondContact O-N 3.22Å
305H89.8Confident90.8Very high72 Ų7242 Ų4233%0.33320%0.2SC..THydrogen-bonded Turntrans-61.6-8.6175.177.187.5000114.6G303 I308 N309 N345 I346 L349G303-H305 VanDerWaalsContact C-N 3.34Å; G303-H305 PolarHBondContact O-N 2.95Å; H305-I308 WeakPolarHBondContact O-CG2 3.35Å; H305-N309 PolarHBondContact O-ND2 3.1Å; H305-N345 HydrophobicContact CB-CB 3.76Å; H305-I346 HydrophobicContact CB-CG1 4.01Å; H305-L349 HydrophobicContact CB-CD1 3.82Å; H305-L349 WeakPolarHBondContact O-CD1 3.43Å
306R92.3Very high90.6Very high190 Ų19046.5 Ų46.572%0.71722%0.221SC*.THydrogen-bonded Turntrans-75.5-43.1169.4-63.2-179.870.2-175.12.3110.7D304 I308 N309 T310D304-R306 PolarHBondContact O-N 3.2Å; R306-I308 PolarHBondContact O-N 3Å; R306-N309 PolarHBondContact O-N 3.48Å; R306-N309 VanDerWaalsContact O-N 3.12Å; R306-T310 PolarHBondContact O-N 2.76Å; R306-T310 PolarHBondContact O-OG1 3.1Å; R306-T310 VanDerWaalsContact O-OG1 3.09Å
307V91.9Very high90.2Very high11 Ų1154.4 Ų54.47%0.06726%0.258CS..Hα-helixtrans-65.8-41.1-172.2171.50000111.9W270 Y274 I299 D304 N309 T310 L311W270-V307 HydrophobicContact CB-CG1 4.18Å; W270-V307 HydrophobicContact CB-CG2 3.91Å; W270-V307 HydrophobicContact CD2-CB 4.3Å; W270-V307 HydrophobicContact CD2-CG1 3.53Å; W270-V307 HydrophobicContact CD2-CG2 3.9Å; W270-V307 HydrophobicContact CE3-CG1 3.6Å; W270-V307 HydrophobicContact CG-CB 4.28Å; W270-V307 HydrophobicContact CG-CG1 3.81Å; W270-V307 HydrophobicContact CG-CG2 3.44Å; W270-V307 VanDerWaalsContact CG-CG2 3.44Å; W270-V307 HydrophobicContact CZ3-CG1 4.21Å; Y274-V307 VanDerWaalsContact OH-CA 3.22Å; Y274-V307 WeakPolarHBondContact OH-CA 3.31Å; Y274-V307 VanDerWaalsContact OH-CG1 3.28Å; Y274-V307 WeakPolarHBondContact OH-CG1 3.05Å; Y274-V307 PolarHBondContact OH-O 2.9Å; I299-V307 HydrophobicContact CD1-CG1 3.87Å; I299-V307 HydrophobicContact CG1-CG1 3.84Å; I299-V307 HydrophobicContact CG2-CB 4.46Å; I299-V307 HydrophobicContact CG2-CG1 4.45Å; D304-V307 HydrophobicContact CB-CB 4.04Å; D304-V307 HydrophobicContact CB-CG2 3.57Å; D304-V307 WeakPolarHBondContact O-CB 3.44Å; D304-V307 PolarHBondContact O-N 3.22Å; V307-N309 PolarHBondContact O-N 3.27Å; V307-T310 WeakPolarHBondContact CA-OG1 3.48Å; V307-T310 PolarHBondContact O-N 3Å; V307-T310 PolarHBondContact O-OG1 3.43Å; V307-L311 VanDerWaalsContact O-CB 3.26Å; V307-L311 WeakPolarHBondContact O-CB 3.34Å; V307-L311 PolarHBondContact O-N 2.98Å
308I90.4Very high89.8Confident10 Ų1058.5 Ų58.55%0.05128%0.276CS..Hα-helixtrans-60.8-34.6175.5-164.5173.8000112L296 I299 H305 R306 W312 L349 L350 F354L296-I308 HydrophobicContact CD1-CD1 3.43Å; L296-I308 VanDerWaalsContact CD1-CD1 3.43Å; L296-I308 HydrophobicContact CD1-CG1 3.91Å; I299-I308 HydrophobicContact CG2-CB 4.09Å; H305-I308 WeakPolarHBondContact O-CG2 3.35Å; R306-I308 PolarHBondContact O-N 3Å; I308-W312 WeakPolarHBondContact O-CB 3.46Å; I308-W312 PolarHBondContact O-N 3.49Å; I308-L349 HydrophobicContact CG2-CD1 3.58Å; I308-L350 HydrophobicContact CD1-CD2 3.99Å; I308-L350 HydrophobicContact CD1-CG 4.49Å; I308-F354 HydrophobicContact CD1-CD2 3.83Å; I308-F354 HydrophobicContact CD1-CE2 3.46Å; I308-F354 VanDerWaalsContact CD1-CE2 3.46Å; I308-F354 HydrophobicContact CD1-CZ 4.4Å; I308-F354 HydrophobicContact CG1-CD2 4.41Å; I308-F354 HydrophobicContact CG1-CE2 3.63Å; I308-F354 HydrophobicContact CG1-CZ 4.12Å; I308-F354 HydrophobicContact CG2-CE2 4.47Å
309N90.9Very high89.2Confident34 Ų3460.8 Ų60.818%0.18231%0.306CS..Hα-helixtrans-75.6-45.7177.4-79.9-62.3000112.1H305 R306 V307 L311 W312 Y313 L349 K353H305-N309 PolarHBondContact O-ND2 3.1Å; R306-N309 PolarHBondContact O-N 3.48Å; R306-N309 VanDerWaalsContact O-N 3.12Å; V307-N309 PolarHBondContact O-N 3.27Å; N309-L311 VanDerWaalsContact C-N 3.29Å; N309-L311 PolarHBondContact O-N 3.47Å; N309-W312 WeakPolarHBondContact O-CB 3.39Å; N309-W312 PolarHBondContact O-N 2.85Å; N309-Y313 HydrophobicContact CB-CE2 4.41Å; N309-Y313 WeakPolarHBondContact O-CD2 3.35Å; N309-Y313 PolarHBondContact O-N 3.45Å; N309-L349 VanDerWaalsContact ND2-CD1 3.31Å; N309-L349 WeakPolarHBondContact ND2-CD1 3.47Å; N309-K353 PolarHBondContact OD1-NZ 2.97Å
310T90.8Very high88.8Confident77 Ų7763.6 Ų63.647%0.47232%0.321SS..Hα-helixtrans-67.7-28.2176.7360000113Y274 R306 V307 G314Y274-T310 PolarHBondContact OH-OG1 3.4Å; R306-T310 PolarHBondContact O-N 2.76Å; R306-T310 PolarHBondContact O-OG1 3.1Å; R306-T310 VanDerWaalsContact O-OG1 3.09Å; V307-T310 WeakPolarHBondContact CA-OG1 3.48Å; V307-T310 PolarHBondContact O-N 3Å; V307-T310 PolarHBondContact O-OG1 3.43Å; T310-G314 PolarHBondContact O-N 3.17Å
311L88.6Confident88Confident2 Ų267.8 Ų67.81%0.0135%0.35CS..Hα-helixtrans-71.4-44.9170.2-168.860.8000111.4Y274 F277 L284 V295 I299 V307 N309 Y313 G314 M315 F322Y274-L311 HydrophobicContact CD1-CD1 4.18Å; Y274-L311 HydrophobicContact CE1-CB 3.85Å; Y274-L311 HydrophobicContact CE1-CD1 3.83Å; Y274-L311 HydrophobicContact CE1-CG 4.44Å; F277-L311 HydrophobicContact CD1-CD1 4.09Å; F277-L311 HydrophobicContact CG-CD1 4.23Å; L284-L311 HydrophobicContact CD2-CD1 4.13Å; L284-L311 HydrophobicContact CD2-CD2 4.19Å; L284-L311 HydrophobicContact CD2-CG 4.38Å; V295-L311 HydrophobicContact CG1-CD2 4.07Å; I299-L311 HydrophobicContact CD1-CD2 3.91Å; V307-L311 VanDerWaalsContact O-CB 3.26Å; V307-L311 WeakPolarHBondContact O-CB 3.34Å; V307-L311 PolarHBondContact O-N 2.98Å; N309-L311 VanDerWaalsContact C-N 3.29Å; N309-L311 PolarHBondContact O-N 3.47Å; L311-Y313 PolarHBondContact O-N 2.78Å; L311-G314 PolarHBondContact O-N 2.89Å; L311-G314 VanDerWaalsContact O-N 3.17Å; L311-M315 HydrophobicContact CG-SD 4.1Å; L311-M315 WeakPolarHBondContact O-CG 3.43Å; L311-M315 PolarHBondContact O-N 2.82Å; L311-F322 HydrophobicContact CD2-CE2 3.96Å
312W88.2Confident87.3Confident59 Ų5965.1 Ų65.122%0.22334%0.339CS..Hα-helixtrans-54.4-52.6174.7178.7-90.1000112.3I308 N309 G314 M315 E316 F354I308-W312 WeakPolarHBondContact O-CB 3.46Å; I308-W312 PolarHBondContact O-N 3.49Å; N309-W312 WeakPolarHBondContact O-CB 3.39Å; N309-W312 PolarHBondContact O-N 2.85Å; W312-G314 VanDerWaalsContact C-N 3.25Å; W312-G314 PolarHBondContact O-N 3.27Å; W312-M315 WeakPolarHBondContact O-CB 3.45Å; W312-M315 PolarHBondContact O-N 3.03Å; W312-E316 VanDerWaalsContact NE1-CD 3.26Å; W312-E316 PolarHBondContact NE1-OE1 3.3Å; W312-E316 PolarHBondContact NE1-OE2 2.79Å; W312-E316 WeakPolarHBondContact O-CB 3.35Å; W312-E316 PolarHBondContact O-N 3.29Å; W312-F354 HydrophobicContact CB-CE1 4.16Å; W312-F354 HydrophobicContact CB-CZ 4.18Å; W312-F354 HydrophobicContact CD2-CD1 4.25Å; W312-F354 AromaticContact CD2-CE1 3.46Å; W312-F354 HydrophobicContact CD2-CE1 3.46Å; W312-F354 VanDerWaalsContact CD2-CE1 3.46Å; W312-F354 HydrophobicContact CD2-CZ 4.34Å; W312-F354 AromaticContact CE3-CD1 3.76Å; W312-F354 HydrophobicContact CE3-CD1 3.76Å; W312-F354 AromaticContact CE3-CE1 3.32Å; W312-F354 HydrophobicContact CE3-CE1 3.32Å; W312-F354 HydrophobicContact CE3-CZ 4.32Å; W312-F354 AromaticContact CG-CE1 3.83Å; W312-F354 HydrophobicContact CG-CE1 3.83Å; W312-F354 HydrophobicContact CG-CZ 4.28Å; W312-F354 HydrophobicContact CH2-CD1 4.39Å; W312-F354 HydrophobicContact CH2-CE1 4.49Å; W312-F354 AromaticContact CZ3-CD1 3.83Å; W312-F354 HydrophobicContact CZ3-CD1 3.83Å; W312-F354 AromaticContact CZ3-CE1 3.88Å; W312-F354 HydrophobicContact CZ3-CE1 3.88Å
313Y88.6Confident87Confident134 Ų13465 Ų6553%0.52534%0.341SS..Hα-helixtrans-58.7-37.9179.1-70.1-58.2000112N309 L311 M315 E316 Q317N309-Y313 HydrophobicContact CB-CE2 4.41Å; N309-Y313 WeakPolarHBondContact O-CD2 3.35Å; N309-Y313 PolarHBondContact O-N 3.45Å; L311-Y313 PolarHBondContact O-N 2.78Å; Y313-M315 VanDerWaalsContact C-N 3.31Å; Y313-M315 PolarHBondContact O-N 3.06Å; Y313-E316 WeakPolarHBondContact CD1-OE2 3.23Å; Y313-Q317 VanDerWaalsContact O-CG 3.27Å; Y313-Q317 WeakPolarHBondContact O-CG 3.27Å; Y313-Q317 PolarHBondContact O-N 2.75Å
314G86.6Confident86.8Confident28 Ų2865.3 Ų65.329%0.28934%0.339SS..Hα-helixtrans-66.4-29.6174.400000114.3F277 T310 L311 W312F277-G314 WeakPolarHBondContact CE1-O 3.26Å; T310-G314 PolarHBondContact O-N 3.17Å; L311-G314 PolarHBondContact O-N 2.89Å; L311-G314 VanDerWaalsContact O-N 3.17Å; W312-G314 VanDerWaalsContact C-N 3.25Å; W312-G314 PolarHBondContact O-N 3.27Å
315M86.5Confident86.7Confident0 Ų064.3 Ų64.30%033%0.334CS..Hα-helixtrans-81.4-41178.1-71.8175.353.200112.8F277 L284 L311 W312 Y313 Q317 K318 G319 L320 S321 F322F277-M315 HydrophobicContact CE1-CG 4.1Å; F277-M315 HydrophobicContact CE2-CG 4.13Å; F277-M315 HydrophobicContact CZ-CB 4.38Å; F277-M315 HydrophobicContact CZ-CG 3.57Å; L284-M315 HydrophobicContact CD1-CE 3.65Å; L284-M315 HydrophobicContact CD1-CG 3.76Å; L284-M315 HydrophobicContact CD1-SD 3.56Å; L284-M315 VanDerWaalsContact CD1-SD 3.56Å; L284-M315 HydrophobicContact CD2-CG 4.42Å; L284-M315 HydrophobicContact CD2-SD 3.76Å; L284-M315 HydrophobicContact CG-SD 4.3Å; L311-M315 HydrophobicContact CG-SD 4.1Å; L311-M315 WeakPolarHBondContact O-CG 3.43Å; L311-M315 PolarHBondContact O-N 2.82Å; W312-M315 WeakPolarHBondContact O-CB 3.45Å; W312-M315 PolarHBondContact O-N 3.03Å; Y313-M315 VanDerWaalsContact C-N 3.31Å; Y313-M315 PolarHBondContact O-N 3.06Å; M315-Q317 VanDerWaalsContact C-N 3.29Å; M315-Q317 PolarHBondContact O-N 2.82Å; M315-K318 CarbonylContact O-C 3.47Å; M315-K318 WeakPolarHBondContact O-CA 3.15Å; M315-K318 PolarHBondContact O-N 3.22Å; M315-G319 PolarHBondContact O-N 2.65Å; M315-L320 HydrophobicContact CB-CB 4.45Å; M315-L320 HydrophobicContact CE-CB 4.29Å; M315-L320 PolarHBondContact O-N 3.47Å; M315-S321 VanDerWaalsContact CE-C 3.44Å; M315-S321 WeakPolarHBondContact CE-O 3.44Å; M315-F322 HydrophobicContact CE-CB 3.81Å; M315-F322 HydrophobicContact CE-CD2 3.63Å; M315-F322 HydrophobicContact CE-CE2 4.49Å; M315-F322 HydrophobicContact CE-CG 4.11Å; M315-F322 HydrophobicContact SD-CD2 3.51Å; M315-F322 VanDerWaalsContact SD-CD2 3.51Å; M315-F322 HydrophobicContact SD-CE2 4.01Å
316E86.9Confident86.7Confident97 Ų9760.9 Ų60.945%0.45332%0.318SS..Hα-helixtrans-56.6-42.6175.8-169.9166-115.700110.8W312 Y313 K318 G319W312-E316 VanDerWaalsContact NE1-CD 3.26Å; W312-E316 PolarHBondContact NE1-OE1 3.3Å; W312-E316 PolarHBondContact NE1-OE2 2.79Å; W312-E316 WeakPolarHBondContact O-CB 3.35Å; W312-E316 PolarHBondContact O-N 3.29Å; Y313-E316 WeakPolarHBondContact CD1-OE2 3.23Å; E316-K318 VanDerWaalsContact C-N 3.28Å; E316-K318 PolarHBondContact O-N 3.05Å; E316-G319 PolarHBondContact O-N 3.18Å
317Q84Confident86.7Confident169 Ų16956.1 Ų56.179%0.7930%0.302SS*.THydrogen-bonded Turntrans-67-21.2173.2-64.4-62.4-60.700114.7Y313 M315Y313-Q317 VanDerWaalsContact O-CG 3.27Å; Y313-Q317 WeakPolarHBondContact O-CG 3.27Å; Y313-Q317 PolarHBondContact O-N 2.75Å; M315-Q317 VanDerWaalsContact C-N 3.29Å; M315-Q317 PolarHBondContact O-N 2.82Å
318K83.2Confident86.7Confident87 Ų8756 Ų5638%0.37830%0.303SS..THydrogen-bonded Turntrans-97.8-4.9173.9-71-168.7173-174.30113.2F277 R278 S281 M315 E316 L320F277-K318 HydrophobicContact CE1-CD 4.41Å; F277-K318 HydrophobicContact CE2-CD 4.37Å; F277-K318 HydrophobicContact CZ-CD 3.85Å; F277-K318 PolarHBondContact O-NZ 2.87Å; R278-K318 PolarHBondContact O-NZ 3.44Å; S281-K318 WeakPolarHBondContact OG-CD 3.5Å; M315-K318 CarbonylContact O-C 3.47Å; M315-K318 WeakPolarHBondContact O-CA 3.15Å; M315-K318 PolarHBondContact O-N 3.22Å; E316-K318 VanDerWaalsContact C-N 3.28Å; E316-K318 PolarHBondContact O-N 3.05Å; K318-L320 VanDerWaalsContact C-N 3.32Å; K318-L320 HydrophobicContact CB-CD1 3.65Å; K318-L320 WeakPolarHBondContact O-CD1 3.38Å
319G81.6Confident86.7Confident71 Ų7160.3 Ų60.373%0.73233%0.329SS*.THydrogen-bonded Turntrans71.317.8-173.500000115.3M315 E316M315-G319 PolarHBondContact O-N 2.65Å; E316-G319 PolarHBondContact O-N 3.18Å
320L82.6Confident86.6Confident59 Ų5960.4 Ų60.431%0.30934%0.335SS..PPolyproline II helixtrans-90.6138.8178.1-83.583.2000112S281 L284 M315 K318S281-L320 VanDerWaalsContact O-CD2 3.32Å; S281-L320 WeakPolarHBondContact O-CD2 3.45Å; S281-L320 WeakPolarHBondContact OG-CD1 3.21Å; S281-L320 VanDerWaalsContact OG-CD2 3.32Å; S281-L320 WeakPolarHBondContact OG-CD2 3.05Å; L284-L320 HydrophobicContact CD1-CB 4.41Å; L284-L320 HydrophobicContact CD1-CD2 3.8Å; M315-L320 HydrophobicContact CB-CB 4.45Å; M315-L320 HydrophobicContact CE-CB 4.29Å; M315-L320 PolarHBondContact O-N 3.47Å; K318-L320 VanDerWaalsContact C-N 3.32Å; K318-L320 HydrophobicContact CB-CD1 3.65Å; K318-L320 WeakPolarHBondContact O-CD1 3.38Å
321S77.6Confident86.6Confident88 Ų8857.3 Ų57.362%0.61532%0.318SS*.PPolyproline II helixtrans-97.1158.4171.4-169.90000112M315M315-S321 VanDerWaalsContact CE-C 3.44Å; M315-S321 WeakPolarHBondContact CE-O 3.44Å
322F78.6Confident86.9Confident23 Ų2358.7 Ų58.710%0.10132%0.324CS..PPolyproline II helixtrans-102.8132.9178.8-147.5-61.3000110.6L284 V295 L296 L311 M315 V324L284-F322 HydrophobicContact CD2-CE2 4.18Å; V295-F322 HydrophobicContact CG1-CE2 4.01Å; V295-F322 HydrophobicContact CG1-CZ 3.63Å; L296-F322 HydrophobicContact CB-CD1 4.16Å; L296-F322 HydrophobicContact CB-CE1 3.35Å; L296-F322 HydrophobicContact CB-CE2 4.29Å; L296-F322 HydrophobicContact CB-CZ 3.46Å; L296-F322 VanDerWaalsContact CB-CZ 3.46Å; L296-F322 HydrophobicContact CD2-CD1 3.65Å; L296-F322 HydrophobicContact CD2-CE1 3.73Å; L296-F322 HydrophobicContact CD2-CG 4.34Å; L296-F322 HydrophobicContact CD2-CZ 4.42Å; L296-F322 HydrophobicContact CG-CE1 4.16Å; L296-F322 HydrophobicContact CG-CZ 4.49Å; L311-F322 HydrophobicContact CD2-CE2 3.96Å; M315-F322 HydrophobicContact CE-CB 3.81Å; M315-F322 HydrophobicContact CE-CD2 3.63Å; M315-F322 HydrophobicContact CE-CE2 4.49Å; M315-F322 HydrophobicContact CE-CG 4.11Å; M315-F322 HydrophobicContact SD-CD2 3.51Å; M315-F322 VanDerWaalsContact SD-CD2 3.51Å; M315-F322 HydrophobicContact SD-CE2 4.01Å; F322-V324 VanDerWaalsContact C-N 3.27Å; F322-V324 HydrophobicContact CB-CG2 4.41Å; F322-V324 WeakPolarHBondContact O-CG2 3.44Å; F322-V324 PolarHBondContact O-N 3.16Å
323D85.6Confident87.1Confident68 Ų6856 Ų5636%0.36432%0.315SS..  trans-72.483.3163.9-17711.3000110.9N325 A326D323-N325 PolarHBondContact O-N 3.29Å; D323-N325 PolarHBondContact OD1-N 3.19Å; D323-A326 HydrophobicContact CB-CB 4.14Å; D323-A326 VanDerWaalsContact CG-N 3.35Å; D323-A326 VanDerWaalsContact O-CB 3.24Å; D323-A326 WeakPolarHBondContact O-CB 3.43Å; D323-A326 PolarHBondContact O-N 2.9Å; D323-A326 PolarHBondContact OD1-N 3.25Å; D323-A326 WeakPolarHBondContact OD2-CA 3.06Å; D323-A326 VanDerWaalsContact OD2-CB 3.26Å; D323-A326 WeakPolarHBondContact OD2-CB 3.18Å; D323-A326 PolarHBondContact OD2-N 3.08Å
324V87.8Confident87.4Confident21 Ų2149.6 Ų49.613%0.12729%0.29CS..THydrogen-bonded Turntrans-63.4-30.6178.9-167.20000111.4L296 F322 A326 P334 L350 F354 A356L296-V324 HydrophobicContact CD2-CG1 4.47Å; F322-V324 VanDerWaalsContact C-N 3.27Å; F322-V324 HydrophobicContact CB-CG2 4.41Å; F322-V324 WeakPolarHBondContact O-CG2 3.44Å; F322-V324 PolarHBondContact O-N 3.16Å; V324-A326 VanDerWaalsContact C-N 3.34Å; V324-P334 WeakPolarHBondContact O-CD 3.43Å; V324-L350 HydrophobicContact CG1-CD2 3.9Å; V324-F354 HydrophobicContact CG1-CB 3.93Å; V324-F354 HydrophobicContact CG2-CB 3.96Å; V324-A356 HydrophobicContact CG1-CB 3.62Å
325N88.8Confident87.7Confident50 Ų5048.4 Ų48.427%0.26728%0.277SS..THydrogen-bonded Turntrans-92.85.9-177.1-74-28.3000113D323 K327 D357 L360D323-N325 PolarHBondContact O-N 3.29Å; D323-N325 PolarHBondContact OD1-N 3.19Å; N325-K327 PolarHBondContact O-N 3.22Å; N325-D357 PolarHBondContact ND2-OD2 2.96Å; N325-D357 PolarHBondContact OD1-N 3.1Å; N325-L360 HydrophobicContact CB-CD1 3.92Å
326A90.1Very high88.1Confident1 Ų148.5 Ų48.51%0.00828%0.277CS..  trans-47.1125.2179.600000111.2T294 H297 D323 V324 T333 P334T294-A326 HydrophobicContact CG2-CB 3.84Å; H297-A326 PolarHBondContact CE1-O 3.3Å; H297-A326 PolarHBondContact NE2-O 2.89Å; D323-A326 HydrophobicContact CB-CB 4.14Å; D323-A326 VanDerWaalsContact CG-N 3.35Å; D323-A326 VanDerWaalsContact O-CB 3.24Å; D323-A326 WeakPolarHBondContact O-CB 3.43Å; D323-A326 PolarHBondContact O-N 2.9Å; D323-A326 PolarHBondContact OD1-N 3.25Å; D323-A326 WeakPolarHBondContact OD2-CA 3.06Å; D323-A326 VanDerWaalsContact OD2-CB 3.26Å; D323-A326 WeakPolarHBondContact OD2-CB 3.18Å; D323-A326 PolarHBondContact OD2-N 3.08Å; V324-A326 VanDerWaalsContact C-N 3.34Å; A326-T333 WeakPolarHBondContact O-CA 3.4Å; A326-P334 WeakPolarHBondContact O-CD 3.43Å
327K91.3Very high88.4Confident89 Ų8944.2 Ų44.239%0.38726%0.257SS..  trans-93.2133172.4-65.2-172.7-177.4-172.40111.5K287 N325 T333K287-K327 PolarHBondContact NZ-O 3.26Å; N325-K327 PolarHBondContact O-N 3.22Å; K327-T333 HydrophobicContact CG-CG2 4.04Å
328S91.9Very high88.8Confident10 Ų1036.1 Ų36.17%0.0722%0.219CC..  trans-70.8177166.158.40000112.8S291 G292 A330 G331 Q332S291-S328 WeakPolarHBondContact O-CB 3.44Å; G292-S328 WeakPolarHBondContact O-CA 3.5Å; S328-A330 PolarHBondContact O-N 3.47Å; S328-G331 WeakPolarHBondContact O-CA 3.3Å; S328-G331 PolarHBondContact O-N 2.9Å; S328-Q332 WeakPolarHBondContact CB-O 3.4Å; S328-Q332 PolarHBondContact N-O 2.91Å; S328-Q332 WeakPolarHBondContact OG-CB 3.36Å; S328-Q332 PolarHBondContact OG-N 2.93Å; S328-Q332 VanDerWaalsContact OG-N 3.13Å; S328-Q332 PolarHBondContact OG-O 2.91Å
329T91.4Very high89.3Confident99 Ų9932 Ų3261%0.60720%0.201SC*.THydrogen-bonded Turntrans-62.8-28.9174.749.90000112.4S291 G331S291-T329 VanDerWaalsContact C-OG1 3.27Å; S291-T329 PolarHBondContact O-N 3.09Å; S291-T329 PolarHBondContact O-OG1 3.05Å; S291-T329 VanDerWaalsContact O-OG1 3.05Å; T329-G331 PolarHBondContact O-N 3.33Å
330A88.5Confident89.8Confident37 Ų3731.6 Ų31.631%0.30618%0.182SC..THydrogen-bonded Turntrans-77.82.3171.700000113.8S328 Q332 T363S328-A330 PolarHBondContact O-N 3.47Å; A330-Q332 HydrophobicContact CB-CG 4.15Å; A330-Q332 PolarHBondContact O-N 3.08Å; A330-Q332 VanDerWaalsContact O-N 3.11Å; A330-T363 WeakPolarHBondContact O-CB 3.37Å; A330-T363 VanDerWaalsContact O-CG2 3.31Å; A330-T363 WeakPolarHBondContact O-CG2 3.17Å; A330-T363 PolarHBondContact O-N 3.09Å; A330-T363 VanDerWaalsContact O-N 3.15Å; A330-T363 PolarHBondContact O-OG1 3.33Å
331G91.2Very high90.2Very high11 Ų1133.3 Ų33.311%0.11319%0.188CC..SBendtrans70.1-3.5-173.700000114.8S328 T329S328-G331 WeakPolarHBondContact O-CA 3.3Å; S328-G331 PolarHBondContact O-N 2.9Å; T329-G331 PolarHBondContact O-N 3.33Å
332Q93Very high90.8Very high31 Ų3131 Ų3115%0.14518%0.178CC..  trans-67.6140.4176.2-66.9176.6-15.300109.8H297 S328 A330 H336 I337 D362H297-Q332 PolarHBondContact NE2-O 2.94Å; H297-Q332 VanDerWaalsContact NE2-O 3.17Å; S328-Q332 WeakPolarHBondContact CB-O 3.4Å; S328-Q332 PolarHBondContact N-O 2.91Å; S328-Q332 WeakPolarHBondContact OG-CB 3.36Å; S328-Q332 PolarHBondContact OG-N 2.93Å; S328-Q332 VanDerWaalsContact OG-N 3.13Å; S328-Q332 PolarHBondContact OG-O 2.91Å; A330-Q332 HydrophobicContact CB-CG 4.15Å; A330-Q332 PolarHBondContact O-N 3.08Å; A330-Q332 VanDerWaalsContact O-N 3.11Å; Q332-H336 HydrophobicContact CB-CB 3.93Å; Q332-H336 HydrophobicContact CG-CB 4.22Å; Q332-I337 HydrophobicContact CB-CD1 4.26Å; Q332-D362 HydrophobicContact CG-CB 3.68Å
333T94.1Very high91.5Very high3 Ų332.2 Ų32.22%0.01818%0.184CC..  trans-94.7168.3170.964.70000110.5A326 K327 L335 H336 I337 L360A326-T333 WeakPolarHBondContact O-CA 3.4Å; K327-T333 HydrophobicContact CG-CG2 4.04Å; T333-L335 PolarHBondContact O-N 2.72Å; T333-L335 VanDerWaalsContact O-N 3.1Å; T333-H336 WeakPolarHBondContact O-CA 3.47Å; T333-H336 WeakPolarHBondContact O-CB 3.39Å; T333-H336 PolarHBondContact O-N 2.74Å; T333-H336 PolarHBondContact OG1-ND1 3.39Å; T333-I337 PolarHBondContact O-N 3.04Å; T333-L360 HydrophobicContact CG2-CB 4.43Å; T333-L360 HydrophobicContact CG2-CD1 3.87Å
334P93.8Very high91.8Very high0 Ų033 Ų330%018%0.184CC..Hα-helixtrans-54.7-31.4175.2-26.334.8000113.5L296 A300 V324 A326 H336 I337 A338 L350L296-P334 HydrophobicContact CB-CG 4.21Å; L296-P334 HydrophobicContact CD2-CB 4.2Å; L296-P334 HydrophobicContact CD2-CG 3.88Å; L296-P334 HydrophobicContact CG-CB 3.77Å; L296-P334 HydrophobicContact CG-CG 3.72Å; A300-P334 HydrophobicContact CB-CB 4.03Å; A300-P334 WeakPolarHBondContact CB-O 3.32Å; V324-P334 WeakPolarHBondContact O-CD 3.43Å; A326-P334 WeakPolarHBondContact O-CD 3.43Å; P334-H336 VanDerWaalsContact C-N 3.33Å; P334-H336 PolarHBondContact O-N 3.27Å; P334-I337 PolarHBondContact O-N 3.13Å; P334-A338 WeakPolarHBondContact O-CB 3.37Å; P334-A338 PolarHBondContact O-N 3.23Å; P334-L350 HydrophobicContact CB-CD1 4.33Å
335L93.9Very high92Very high3 Ų335.8 Ų35.82%0.01620%0.198CC..Hα-helixtrans-64.4-35.5175.5-164.865.9000112.6T333 A339 I347 L350 V351 A356 V358 A368 L383T333-L335 PolarHBondContact O-N 2.72Å; T333-L335 VanDerWaalsContact O-N 3.1Å; L335-A339 WeakPolarHBondContact O-CB 3.26Å; L335-A339 PolarHBondContact O-N 3.1Å; L335-A339 VanDerWaalsContact O-N 3.08Å; L335-I347 HydrophobicContact CD1-CG2 4.19Å; L335-L350 HydrophobicContact CB-CD1 4.26Å; L335-L350 HydrophobicContact CD1-CB 3.81Å; L335-L350 HydrophobicContact CD1-CD1 3.83Å; L335-L350 HydrophobicContact CD1-CG 4.5Å; L335-V351 HydrophobicContact CD1-CG2 4.1Å; L335-A356 HydrophobicContact CD2-CB 4.33Å; L335-V358 HydrophobicContact CD2-CG2 4.18Å; L335-A368 HydrophobicContact CD2-CB 4.33Å; L335-A368 HydrophobicContact CG-CB 4.05Å; L335-L383 HydrophobicContact CD1-CD2 4.03Å; L335-L383 HydrophobicContact CD2-CD2 3.79Å; L335-L383 HydrophobicContact CG-CD2 4.06Å
336H93.3Very high92.2Very high1 Ų133.4 Ų33.41%0.00519%0.185CC..Hα-helixtrans-68.6-43.3173.1-69.374.7000110.9Q332 T333 P334 A339 I340 L360 K366 A368Q332-H336 HydrophobicContact CB-CB 3.93Å; Q332-H336 HydrophobicContact CG-CB 4.22Å; T333-H336 WeakPolarHBondContact O-CA 3.47Å; T333-H336 WeakPolarHBondContact O-CB 3.39Å; T333-H336 PolarHBondContact O-N 2.74Å; T333-H336 PolarHBondContact OG1-ND1 3.39Å; P334-H336 VanDerWaalsContact C-N 3.33Å; P334-H336 PolarHBondContact O-N 3.27Å; H336-A339 PolarHBondContact O-N 3.39Å; H336-I340 WeakPolarHBondContact O-CB 3.48Å; H336-I340 WeakPolarHBondContact O-CD1 3.46Å; H336-I340 VanDerWaalsContact O-CG1 3.23Å; H336-I340 WeakPolarHBondContact O-CG1 3.39Å; H336-I340 PolarHBondContact O-N 3.4Å; H336-L360 PolarHBondContact CE1-O 3.08Å; H336-K366 PolarHBondContact NE2-O 2.92Å; H336-A368 PolarHBondContact NE2-N 2.98Å; H336-A368 VanDerWaalsContact NE2-N 3.2Å
337I93.8Very high92.3Very high7 Ų733.3 Ų33.34%0.03619%0.185CC..Hα-helixtrans-60.9-46.9176.6-53.9-56.2000110.7F293 A300 K301 Q332 T333 P334 A339 I340 H341F293-I337 HydrophobicContact CE1-CD1 4.12Å; F293-I337 HydrophobicContact CZ-CD1 3.76Å; F293-I337 HydrophobicContact CZ-CG1 4.41Å; A300-I337 HydrophobicContact CB-CB 4.14Å; A300-I337 HydrophobicContact CB-CG2 4.25Å; K301-I337 HydrophobicContact CB-CG2 3.87Å; Q332-I337 HydrophobicContact CB-CD1 4.26Å; T333-I337 PolarHBondContact O-N 3.04Å; P334-I337 PolarHBondContact O-N 3.13Å; I337-A339 VanDerWaalsContact C-N 3.29Å; I337-A339 PolarHBondContact O-N 3.19Å; I337-I340 PolarHBondContact O-N 3.35Å; I337-H341 PolarHBondContact O-CD2 3.37Å; I337-H341 PolarHBondContact O-N 3.33Å
338A93.6Very high92.4Very high0 Ų034 Ų340%019%0.185CC..Hα-helixtrans-61-37.1177.300000112.4A300 P334 G342 H343 I346 I347 L350A300-A338 HydrophobicContact CB-CB 4.2Å; P334-A338 WeakPolarHBondContact O-CB 3.37Å; P334-A338 PolarHBondContact O-N 3.23Å; A338-G342 PolarHBondContact O-N 3.15Å; A338-H343 HydrophobicContact CB-CB 4.49Å; A338-H343 PolarHBondContact O-N 2.83Å; A338-I346 HydrophobicContact CB-CB 4.31Å; A338-I346 HydrophobicContact CB-CG2 3.86Å; A338-I347 HydrophobicContact CB-CG1 3.77Å; A338-L350 HydrophobicContact CB-CD1 4.44Å
339A92.6Very high92.4Very high0 Ų035.2 Ų35.20%019%0.19CC..Hα-helixtrans-69.9-4317500000113L335 H336 I337 H341 G342 I347 A368 L372L335-A339 WeakPolarHBondContact O-CB 3.26Å; L335-A339 PolarHBondContact O-N 3.1Å; L335-A339 VanDerWaalsContact O-N 3.08Å; H336-A339 PolarHBondContact O-N 3.39Å; I337-A339 VanDerWaalsContact C-N 3.29Å; I337-A339 PolarHBondContact O-N 3.19Å; A339-H341 VanDerWaalsContact C-N 3.28Å; A339-H341 PolarHBondContact O-N 3.03Å; A339-G342 PolarHBondContact O-N 3.11Å; A339-G342 VanDerWaalsContact O-N 3.09Å; A339-I347 HydrophobicContact CB-CD1 4.42Å; A339-A368 HydrophobicContact CB-CB 4.3Å; A339-A368 WeakPolarHBondContact CB-O 3.16Å; A339-L372 HydrophobicContact CB-CD2 4.1Å
340I91.8Very high92.4Very high63 Ų6330.5 Ų30.532%0.32316%0.162SC..Hα-helixtrans-57.5-41.4175.6-72.1161.9000111.4H336 I337 Y371H336-I340 WeakPolarHBondContact O-CB 3.48Å; H336-I340 WeakPolarHBondContact O-CD1 3.46Å; H336-I340 VanDerWaalsContact O-CG1 3.23Å; H336-I340 WeakPolarHBondContact O-CG1 3.39Å; H336-I340 PolarHBondContact O-N 3.4Å; I337-I340 PolarHBondContact O-N 3.35Å; I340-Y371 HydrophobicContact CD1-CD1 4.09Å; I340-Y371 HydrophobicContact CD1-CE1 4.23Å; I340-Y371 HydrophobicContact CD1-CG 4.31Å; I340-Y371 HydrophobicContact CG1-CD1 3.44Å; I340-Y371 VanDerWaalsContact CG1-CD1 3.44Å; I340-Y371 HydrophobicContact CG1-CD2 4.36Å; I340-Y371 HydrophobicContact CG1-CE1 4.06Å; I340-Y371 HydrophobicContact CG1-CG 3.59Å
341H91.1Very high92.5Very high94 Ų9430.2 Ų30.244%0.43516%0.156SC..THydrogen-bonded Turntrans-87.3-3.1178.4-74.4-84.6000114.1I337 A339 H343I337-H341 PolarHBondContact O-CD2 3.37Å; I337-H341 PolarHBondContact O-N 3.33Å; A339-H341 VanDerWaalsContact C-N 3.28Å; A339-H341 PolarHBondContact O-N 3.03Å; H341-H343 VanDerWaalsContact C-N 3.31Å; H341-H343 WeakPolarHBondContact CB-CD2 3.32Å; H341-H343 PolarHBondContact O-N 2.84Å
342G90.8Very high92.4Very high39 Ų3937.1 Ų37.140%0.40218%0.183SC..THydrogen-bonded Turntrans70.120.6179.900000114.9A338 A339 K344A338-G342 PolarHBondContact O-N 3.15Å; A339-G342 PolarHBondContact O-N 3.11Å; A339-G342 VanDerWaalsContact O-N 3.09Å; G342-K344 VanDerWaalsContact C-N 3.28Å; G342-K344 WeakPolarHBondContact O-CG 3.49Å; G342-K344 PolarHBondContact O-N 2.93Å
343H93Very high92.2Very high49 Ų4939 Ų3923%0.22719%0.191CC..  trans-77.271.3-172.8-73.2-47.3000113.1A300 K301 H302 G303 A338 H341 N345 I346 I347A300-H343 PolarHBondContact O-CD2 2.8Å; K301-H343 PolarHBondContact O-CD2 3.03Å; K301-H343 PolarHBondContact O-NE2 3.19Å; H302-H343 PolarHBondContact O-CE1 3.4Å; H302-H343 PolarHBondContact O-NE2 3.34Å; G303-H343 VanDerWaalsContact CA-CD2 3.49Å; G303-H343 WeakPolarHBondContact CA-CD2 3.48Å; G303-H343 VanDerWaalsContact CA-CE1 3.44Å; G303-H343 WeakPolarHBondContact CA-CE1 3.24Å; G303-H343 WeakPolarHBondContact CA-ND1 3.41Å; G303-H343 WeakPolarHBondContact CA-NE2 3.42Å; G303-H343 PolarHBondContact N-NE2 2.93Å; A338-H343 HydrophobicContact CB-CB 4.49Å; A338-H343 PolarHBondContact O-N 2.83Å; H341-H343 VanDerWaalsContact C-N 3.31Å; H341-H343 WeakPolarHBondContact CB-CD2 3.32Å; H341-H343 PolarHBondContact O-N 2.84Å; H343-N345 PolarHBondContact O-N 2.89Å; H343-I346 HydrophobicContact CB-CB 4.33Å; H343-I346 PolarHBondContact O-N 3.03Å; H343-I347 PolarHBondContact O-N 3.28Å; H343-I347 VanDerWaalsContact O-N 3.13Å
344K91.6Very high91.7Very high84 Ų8439.9 Ų39.937%0.36519%0.194SC..Hα-helixtrans-41.4-44.3-177.5-58.9-168.8173.7-179.80114.3G342 R348 D374 I379G342-K344 VanDerWaalsContact C-N 3.28Å; G342-K344 WeakPolarHBondContact O-CG 3.49Å; G342-K344 PolarHBondContact O-N 2.93Å; K344-R348 WeakPolarHBondContact O-CG 3.32Å; K344-R348 PolarHBondContact O-N 3.31Å; K344-R348 VanDerWaalsContact O-N 3.1Å; K344-D374 VanDerWaalsContact CE-OD2 3.25Å; K344-D374 WeakPolarHBondContact CE-OD2 3.34Å; K344-D374 IonicContact NZ-OD2 2.6Å; K344-D374 PolarHBondContact NZ-OD2 3.15Å; K344-I379 HydrophobicContact CB-CD1 3.45Å; K344-I379 VanDerWaalsContact CB-CD1 3.45Å; K344-I379 HydrophobicContact CD-CD1 3.53Å; K344-I379 HydrophobicContact CG-CD1 3.35Å
345N92.5Very high91.4Very high80 Ų8044.6 Ų44.643%0.42823%0.227SC..Hα-helixtrans-72.5-34.8-177-67.1-4.7000112.9H305 H343 L349H305-N345 HydrophobicContact CB-CB 3.76Å; H343-N345 PolarHBondContact O-N 2.89Å; N345-L349 WeakPolarHBondContact O-CG 3.38Å; N345-L349 PolarHBondContact O-N 3.19Å
346I93.8Very high91.1Very high0 Ų044.8 Ų44.80%023%0.229CC..Hα-helixtrans-70.9-42.5174.7-68.6-172000110.3I299 A300 G303 H305 A338 H343 R348 L349 L350I299-I346 HydrophobicContact CG2-CD1 4.09Å; I299-I346 WeakPolarHBondContact O-CD1 3.43Å; A300-I346 HydrophobicContact CB-CG2 4.32Å; G303-I346 VanDerWaalsContact C-CD1 3.46Å; H305-I346 HydrophobicContact CB-CG1 4.01Å; A338-I346 HydrophobicContact CB-CB 4.31Å; A338-I346 HydrophobicContact CB-CG2 3.86Å; H343-I346 HydrophobicContact CB-CB 4.33Å; H343-I346 PolarHBondContact O-N 3.03Å; I346-R348 VanDerWaalsContact C-N 3.32Å; I346-R348 PolarHBondContact O-N 3.02Å; I346-L349 PolarHBondContact O-N 3.05Å; I346-L349 VanDerWaalsContact O-N 3.15Å; I346-L350 HydrophobicContact CG2-CD1 3.68Å; I346-L350 HydrophobicContact CG2-CG 3.98Å; I346-L350 WeakPolarHBondContact O-CB 3.43Å; I346-L350 WeakPolarHBondContact O-CG 3.38Å; I346-L350 PolarHBondContact O-N 3.35Å
347I92.3Very high90.9Very high0 Ų048.6 Ų48.60%025%0.249CC..Hα-helixtrans-55.9-48.7175.9-61169.6000110.4L335 A338 A339 H343 L349 L350 V351 L372 I379 L383L335-I347 HydrophobicContact CD1-CG2 4.19Å; A338-I347 HydrophobicContact CB-CG1 3.77Å; A339-I347 HydrophobicContact CB-CD1 4.42Å; H343-I347 PolarHBondContact O-N 3.28Å; H343-I347 VanDerWaalsContact O-N 3.13Å; I347-L349 VanDerWaalsContact C-N 3.32Å; I347-L349 PolarHBondContact O-N 3.11Å; I347-L350 PolarHBondContact O-N 2.91Å; I347-V351 WeakPolarHBondContact O-CG2 3.47Å; I347-V351 PolarHBondContact O-N 2.73Å; I347-L372 HydrophobicContact CD1-CD2 4Å; I347-I379 HydrophobicContact CB-CG2 4.48Å; I347-I379 HydrophobicContact CD1-CG2 4Å; I347-I379 HydrophobicContact CG2-CG2 3.94Å; I347-L383 HydrophobicContact CD1-CD1 4.49Å; I347-L383 HydrophobicContact CG2-CD1 3.79Å; I347-L383 HydrophobicContact CG2-CD2 3.96Å; I347-L383 HydrophobicContact CG2-CG 3.93Å
348R91.9Very high90.7Very high102 Ų10249 Ų4939%0.38525%0.252SS..Hα-helixtrans-59.7-38177.9-76.2174.4169.6-176.8-4.1112.9K344 I346 K352 D378 L382K344-R348 WeakPolarHBondContact O-CG 3.32Å; K344-R348 PolarHBondContact O-N 3.31Å; K344-R348 VanDerWaalsContact O-N 3.1Å; I346-R348 VanDerWaalsContact C-N 3.32Å; I346-R348 PolarHBondContact O-N 3.02Å; R348-K352 VanDerWaalsContact O-CB 3.24Å; R348-K352 WeakPolarHBondContact O-CB 3.43Å; R348-K352 WeakPolarHBondContact O-CG 3.48Å; R348-K352 PolarHBondContact O-N 3.03Å; R348-D378 IonicContact CZ-OD2 2.91Å; R348-D378 IonicContact NH2-OD2 2.72Å; R348-D378 PolarHBondContact NH2-OD2 3.09Å; R348-L382 HydrophobicContact CG-CD1 3.99Å
349L92.3Very high90.4Very high36 Ų3655.3 Ų55.319%0.18828%0.28CS..Hα-helixtrans-72.9-44.8175.7-71.2171.6000112.8H305 I308 N309 N345 I346 I347 V351 K353 F354H305-L349 HydrophobicContact CB-CD1 3.82Å; H305-L349 WeakPolarHBondContact O-CD1 3.43Å; I308-L349 HydrophobicContact CG2-CD1 3.58Å; N309-L349 VanDerWaalsContact ND2-CD1 3.31Å; N309-L349 WeakPolarHBondContact ND2-CD1 3.47Å; N345-L349 WeakPolarHBondContact O-CG 3.38Å; N345-L349 PolarHBondContact O-N 3.19Å; I346-L349 PolarHBondContact O-N 3.05Å; I346-L349 VanDerWaalsContact O-N 3.15Å; I347-L349 VanDerWaalsContact C-N 3.32Å; I347-L349 PolarHBondContact O-N 3.11Å; L349-V351 VanDerWaalsContact C-N 3.32Å; L349-V351 PolarHBondContact O-N 3.12Å; L349-K353 WeakPolarHBondContact O-CA 3.31Å; L349-K353 WeakPolarHBondContact O-CB 3.46Å; L349-K353 PolarHBondContact O-N 3.23Å; L349-F354 HydrophobicContact CB-CE2 4.2Å; L349-F354 WeakPolarHBondContact O-CD2 3.49Å; L349-F354 PolarHBondContact O-N 3.13Å
350L91.3Very high90.3Very high1 Ų157.4 Ų57.41%0.00529%0.291CS..Hα-helixtrans-57.5-44.1178.3-74.9175000111.8L296 I308 V324 P334 L335 A338 I346 I347 F354 S355 A356L296-L350 HydrophobicContact CD1-CD2 4.26Å; L296-L350 HydrophobicContact CD2-CD2 4.16Å; I308-L350 HydrophobicContact CD1-CD2 3.99Å; I308-L350 HydrophobicContact CD1-CG 4.49Å; V324-L350 HydrophobicContact CG1-CD2 3.9Å; P334-L350 HydrophobicContact CB-CD1 4.33Å; L335-L350 HydrophobicContact CB-CD1 4.26Å; L335-L350 HydrophobicContact CD1-CB 3.81Å; L335-L350 HydrophobicContact CD1-CD1 3.83Å; L335-L350 HydrophobicContact CD1-CG 4.5Å; A338-L350 HydrophobicContact CB-CD1 4.44Å; I346-L350 HydrophobicContact CG2-CD1 3.68Å; I346-L350 HydrophobicContact CG2-CG 3.98Å; I346-L350 WeakPolarHBondContact O-CB 3.43Å; I346-L350 WeakPolarHBondContact O-CG 3.38Å; I346-L350 PolarHBondContact O-N 3.35Å; I347-L350 PolarHBondContact O-N 2.91Å; L350-F354 HydrophobicContact CD2-CD2 4.34Å; L350-F354 CarbonylContact O-C 3.6Å; L350-F354 VanDerWaalsContact O-C 3.28Å; L350-F354 PolarHBondContact O-N 3.15Å; L350-S355 PolarHBondContact O-N 3.31Å; L350-S355 VanDerWaalsContact O-N 3.13Å; L350-A356 HydrophobicContact CB-CB 4.06Å; L350-A356 WeakPolarHBondContact O-CB 3.44Å; L350-A356 PolarHBondContact O-N 3.44Å
351V91.1Very high90.2Very high30 Ų3061.6 Ų61.618%0.18230%0.303CS..Hα-helixtrans-76-49.4178.4-179.90000111.7L335 I347 L349 S355 V358 L383L335-V351 HydrophobicContact CD1-CG2 4.1Å; I347-V351 WeakPolarHBondContact O-CG2 3.47Å; I347-V351 PolarHBondContact O-N 2.73Å; L349-V351 VanDerWaalsContact C-N 3.32Å; L349-V351 PolarHBondContact O-N 3.12Å; V351-S355 PolarHBondContact O-N 3.2Å; V351-V358 HydrophobicContact CG1-CG2 4.5Å; V351-V358 HydrophobicContact CG2-CG2 4.03Å; V351-L383 HydrophobicContact CG2-CD2 3.89Å
352K89.1Confident90.3Very high156 Ų15657.7 Ų57.768%0.67829%0.285SS*.Hα-helixtrans-84-27.8-170.3-63.8-166.4173.7-1640116R348R348-K352 VanDerWaalsContact O-CB 3.24Å; R348-K352 WeakPolarHBondContact O-CB 3.43Å; R348-K352 WeakPolarHBondContact O-CG 3.48Å; R348-K352 PolarHBondContact O-N 3.03Å
353K87.8Confident90.3Very high71 Ų7161.1 Ų61.131%0.30930%0.298SS..THydrogen-bonded Turntrans-108.8-30.1-177.4-175.1174.7170.8174.80112.7N309 L349N309-K353 PolarHBondContact OD1-NZ 2.97Å; L349-K353 WeakPolarHBondContact O-CA 3.31Å; L349-K353 WeakPolarHBondContact O-CB 3.46Å; L349-K353 PolarHBondContact O-N 3.23Å
354F84.5Confident90.1Very high22 Ų2262 Ų6210%0.09631%0.314CS..THydrogen-bonded Turntrans-115.16.5-173.8-51.8-55.9000113.7I308 W312 V324 L349 L350 A356I308-F354 HydrophobicContact CD1-CD2 3.83Å; I308-F354 HydrophobicContact CD1-CE2 3.46Å; I308-F354 VanDerWaalsContact CD1-CE2 3.46Å; I308-F354 HydrophobicContact CD1-CZ 4.4Å; I308-F354 HydrophobicContact CG1-CD2 4.41Å; I308-F354 HydrophobicContact CG1-CE2 3.63Å; I308-F354 HydrophobicContact CG1-CZ 4.12Å; I308-F354 HydrophobicContact CG2-CE2 4.47Å; W312-F354 HydrophobicContact CB-CE1 4.16Å; W312-F354 HydrophobicContact CB-CZ 4.18Å; W312-F354 HydrophobicContact CD2-CD1 4.25Å; W312-F354 AromaticContact CD2-CE1 3.46Å; W312-F354 HydrophobicContact CD2-CE1 3.46Å; W312-F354 VanDerWaalsContact CD2-CE1 3.46Å; W312-F354 HydrophobicContact CD2-CZ 4.34Å; W312-F354 AromaticContact CE3-CD1 3.76Å; W312-F354 HydrophobicContact CE3-CD1 3.76Å; W312-F354 AromaticContact CE3-CE1 3.32Å; W312-F354 HydrophobicContact CE3-CE1 3.32Å; W312-F354 HydrophobicContact CE3-CZ 4.32Å; W312-F354 AromaticContact CG-CE1 3.83Å; W312-F354 HydrophobicContact CG-CE1 3.83Å; W312-F354 HydrophobicContact CG-CZ 4.28Å; W312-F354 HydrophobicContact CH2-CD1 4.39Å; W312-F354 HydrophobicContact CH2-CE1 4.49Å; W312-F354 AromaticContact CZ3-CD1 3.83Å; W312-F354 HydrophobicContact CZ3-CD1 3.83Å; W312-F354 AromaticContact CZ3-CE1 3.88Å; W312-F354 HydrophobicContact CZ3-CE1 3.88Å; V324-F354 HydrophobicContact CG1-CB 3.93Å; V324-F354 HydrophobicContact CG2-CB 3.96Å; L349-F354 HydrophobicContact CB-CE2 4.2Å; L349-F354 WeakPolarHBondContact O-CD2 3.49Å; L349-F354 PolarHBondContact O-N 3.13Å; L350-F354 HydrophobicContact CD2-CD2 4.34Å; L350-F354 CarbonylContact O-C 3.6Å; L350-F354 VanDerWaalsContact O-C 3.28Å; L350-F354 PolarHBondContact O-N 3.15Å; F354-A356 PolarHBondContact O-N 2.9Å
355S86.4Confident90.1Very high98 Ų9859.6 Ų59.669%0.68531%0.313SS*.  trans47.637.4174.4-56.50000114.8L350 V351L350-S355 PolarHBondContact O-N 3.31Å; L350-S355 VanDerWaalsContact O-N 3.13Å; V351-S355 PolarHBondContact O-N 3.2Å
356A88.7Confident90Very high8 Ų859.9 Ų59.97%0.06631%0.31CS..  trans-60.5136.8-175.200000112.6V324 L335 L350 F354 V358V324-A356 HydrophobicContact CG1-CB 3.62Å; L335-A356 HydrophobicContact CD2-CB 4.33Å; L350-A356 HydrophobicContact CB-CB 4.06Å; L350-A356 WeakPolarHBondContact O-CB 3.44Å; L350-A356 PolarHBondContact O-N 3.44Å; F354-A356 PolarHBondContact O-N 2.9Å; A356-V358 PolarHBondContact O-N 3.17Å
357D88.7Confident89.9Confident80 Ų8062.2 Ų62.243%0.42832%0.32SS..  trans-72.991.9-176.7-84.1-65.8000112.9N325 K359 L360N325-D357 PolarHBondContact ND2-OD2 2.96Å; N325-D357 PolarHBondContact OD1-N 3.1Å; D357-K359 PolarHBondContact O-N 2.87Å; D357-L360 HydrophobicContact CB-CD1 3.71Å; D357-L360 HydrophobicContact CB-CG 3.68Å; D357-L360 WeakPolarHBondContact O-CB 3.5Å; D357-L360 PolarHBondContact O-N 3.24Å; D357-L360 VanDerWaalsContact O-N 3.09Å
358V89.1Confident89.8Confident16 Ų1662.2 Ų62.210%0.09732%0.321CS..THydrogen-bonded Turntrans-51-27.6170.7179.50000112.8L335 V351 A356 L383L335-V358 HydrophobicContact CD2-CG2 4.18Å; V351-V358 HydrophobicContact CG1-CG2 4.5Å; V351-V358 HydrophobicContact CG2-CG2 4.03Å; A356-V358 PolarHBondContact O-N 3.17Å; V358-L383 VanDerWaalsContact CG1-C 3.42Å; V358-L383 HydrophobicContact CG1-CB 4.27Å; V358-L383 HydrophobicContact CG1-CD2 4.2Å; V358-L383 WeakPolarHBondContact CG1-O 2.93Å; V358-L383 HydrophobicContact CG2-CD2 4.01Å
359K87.8Confident89.7Confident133 Ų13361.9 Ų61.958%0.57832%0.319SS*.THydrogen-bonded Turntrans-79.1-15.7-176.4-73.2163.3-179.5154.60113.7D357 A385D357-K359 PolarHBondContact O-N 2.87Å; K359-A385 WeakPolarHBondContact CE-O 3.11Å; K359-A385 PolarHBondContact NZ-O 2.67Å
360L89.9Confident89.6Confident43 Ų4364.6 Ų64.623%0.22533%0.331CS..  trans-63.3149.1177.3-71.6173000112.1N325 T333 H336 D357N325-L360 HydrophobicContact CB-CD1 3.92Å; T333-L360 HydrophobicContact CG2-CB 4.43Å; T333-L360 HydrophobicContact CG2-CD1 3.87Å; H336-L360 PolarHBondContact CE1-O 3.08Å; D357-L360 HydrophobicContact CB-CD1 3.71Å; D357-L360 HydrophobicContact CB-CG 3.68Å; D357-L360 WeakPolarHBondContact O-CB 3.5Å; D357-L360 PolarHBondContact O-N 3.24Å; D357-L360 VanDerWaalsContact O-N 3.09Å
361R90.8Very high89.5Confident152 Ų15267.1 Ų67.157%0.57434%0.341SS*.  trans-118.8151.2175.7-59.1175.2-173.7-135.615.6111.5G365 K366 K367R361-G365 WeakPolarHBondContact CD-O 3.17Å; R361-G365 PolarHBondContact NH1-O 3.5Å; R361-G365 VanDerWaalsContact NH1-O 3.15Å; R361-K366 WeakPolarHBondContact CA-O 3.12Å; R361-K366 WeakPolarHBondContact CB-O 3.47Å; R361-K367 HydrophobicContact CG-CG 4.29Å
362D92.1Very high89.3Confident12 Ų1267.1 Ų67.16%0.06434%0.34CS..  trans-81.3-178.6170.472.83000113.1Q332 A364 G365 K366 Y371Q332-D362 HydrophobicContact CG-CB 3.68Å; D362-A364 PolarHBondContact O-N 2.87Å; D362-A364 WeakPolarHBondContact OD1-CA 3.45Å; D362-A364 WeakPolarHBondContact OD1-CB 3.43Å; D362-A364 PolarHBondContact OD1-N 3.04Å; D362-G365 PolarHBondContact O-N 3.25Å; D362-G365 PolarHBondContact OD1-N 3.38Å; D362-G365 VanDerWaalsContact OD1-N 3.1Å; D362-K366 PolarHBondContact N-O 3.02Å; D362-K366 PolarHBondContact OD1-N 3.3Å; D362-Y371 PolarHBondContact OD2-OH 3.39Å; D362-Y371 VanDerWaalsContact OD2-OH 3.05Å
363T92.7Very high88.6Confident111 Ų11165.6 Ų65.668%0.68135%0.348SS*.THydrogen-bonded Turntrans-65.3-18.1176.6520000114.2A330 G365A330-T363 WeakPolarHBondContact O-CB 3.37Å; A330-T363 VanDerWaalsContact O-CG2 3.31Å; A330-T363 WeakPolarHBondContact O-CG2 3.17Å; A330-T363 PolarHBondContact O-N 3.09Å; A330-T363 VanDerWaalsContact O-N 3.15Å; A330-T363 PolarHBondContact O-OG1 3.33Å; T363-G365 VanDerWaalsContact C-N 3.26Å
364A88.5Confident87.9Confident67 Ų6766.4 Ų66.455%0.55436%0.356SS*.THydrogen-bonded Turntrans-85.82.5172.700000112.6D362 K366D362-A364 PolarHBondContact O-N 2.87Å; D362-A364 WeakPolarHBondContact OD1-CA 3.45Å; D362-A364 WeakPolarHBondContact OD1-CB 3.43Å; D362-A364 PolarHBondContact OD1-N 3.04Å; A364-K366 HydrophobicContact CB-CD 4.37Å; A364-K366 HydrophobicContact CB-CG 4.37Å; A364-K366 PolarHBondContact O-N 3.14Å
365G91.3Very high87.1Confident33 Ų3375.6 Ų75.634%0.3439%0.39SS..SBendtrans74.210.4-178.900000114.2R361 D362 T363R361-G365 WeakPolarHBondContact CD-O 3.17Å; R361-G365 PolarHBondContact NH1-O 3.5Å; R361-G365 VanDerWaalsContact NH1-O 3.15Å; D362-G365 PolarHBondContact O-N 3.25Å; D362-G365 PolarHBondContact OD1-N 3.38Å; D362-G365 VanDerWaalsContact OD1-N 3.1Å; T363-G365 VanDerWaalsContact C-N 3.26Å
366K90.2Very high86.5Confident87 Ų8771.5 Ų71.538%0.37836%0.363SS..  trans-90.2155.8-177-69.5177.9174.8-174.90111.9H336 R361 D362 A364 Y371H336-K366 PolarHBondContact NE2-O 2.92Å; R361-K366 WeakPolarHBondContact CA-O 3.12Å; R361-K366 WeakPolarHBondContact CB-O 3.47Å; D362-K366 PolarHBondContact N-O 3.02Å; D362-K366 PolarHBondContact OD1-N 3.3Å; A364-K366 HydrophobicContact CB-CD 4.37Å; A364-K366 HydrophobicContact CB-CG 4.37Å; A364-K366 PolarHBondContact O-N 3.14Å; K366-Y371 HydrophobicContact CB-CE2 3.84Å; K366-Y371 HydrophobicContact CD-CE2 3.78Å; K366-Y371 WeakPolarHBondContact CD-OH 3.26Å
367K91.8Very high86Confident48 Ų4875.6 Ų75.621%0.20939%0.389CS..  trans-98.5157.3170.3-75.4-173.2167-163.80111.2R361 W369 Q370R361-K367 HydrophobicContact CG-CG 4.29Å; K367-W369 VanDerWaalsContact C-N 3.33Å; K367-W369 PolarHBondContact O-N 3.06Å; K367-Q370 WeakPolarHBondContact O-CB 3.24Å; K367-Q370 PolarHBondContact O-N 3.13Å
368A89.5Confident85.8Confident1 Ų175.1 Ų75.11%0.00839%0.386CS..G310 helixtrans-51.8-43.718000000114.1L335 H336 A339 Q370 Y371L335-A368 HydrophobicContact CD2-CB 4.33Å; L335-A368 HydrophobicContact CG-CB 4.05Å; H336-A368 PolarHBondContact NE2-N 2.98Å; H336-A368 VanDerWaalsContact NE2-N 3.2Å; A339-A368 HydrophobicContact CB-CB 4.3Å; A339-A368 WeakPolarHBondContact CB-O 3.16Å; A368-Q370 PolarHBondContact O-N 3.49Å; A368-Q370 VanDerWaalsContact O-N 3.12Å; A368-Y371 PolarHBondContact O-N 2.91Å
369W89.6Confident85.6Confident95 Ų9574.5 Ų74.536%0.3638%0.382SS..G310 helixtrans-60.2-25179.866-97.7000114.3K367 Y371 L372 L380 L383K367-W369 VanDerWaalsContact C-N 3.33Å; K367-W369 PolarHBondContact O-N 3.06Å; W369-Y371 PolarHBondContact O-N 3.49Å; W369-L372 HydrophobicContact CB-CD1 4.42Å; W369-L372 WeakPolarHBondContact O-CB 3.17Å; W369-L372 PolarHBondContact O-N 2.94Å; W369-L380 HydrophobicContact CB-CD1 4Å; W369-L380 HydrophobicContact CD2-CD1 4.25Å; W369-L380 HydrophobicContact CE3-CD1 3.84Å; W369-L380 HydrophobicContact CG-CD1 4.37Å; W369-L383 HydrophobicContact CB-CB 3.75Å; W369-L383 HydrophobicContact CB-CD1 4.42Å
370Q90.5Very high85.4Confident92 Ų9270.6 Ų70.643%0.4337%0.367SS..G310 helixtrans-74.6-5180-58.5-179.9-49.300113K367 A368K367-Q370 WeakPolarHBondContact O-CB 3.24Å; K367-Q370 PolarHBondContact O-N 3.13Å; A368-Q370 PolarHBondContact O-N 3.49Å; A368-Q370 VanDerWaalsContact O-N 3.12Å
371Y88.8Confident85.2Confident54 Ų5475.4 Ų75.421%0.21239%0.388CS..G310 helixtrans-101.3-5.4173.2-74.3-81.4000113.6I340 D362 K366 A368 W369 S373I340-Y371 HydrophobicContact CD1-CD1 4.09Å; I340-Y371 HydrophobicContact CD1-CE1 4.23Å; I340-Y371 HydrophobicContact CD1-CG 4.31Å; I340-Y371 HydrophobicContact CG1-CD1 3.44Å; I340-Y371 VanDerWaalsContact CG1-CD1 3.44Å; I340-Y371 HydrophobicContact CG1-CD2 4.36Å; I340-Y371 HydrophobicContact CG1-CE1 4.06Å; I340-Y371 HydrophobicContact CG1-CG 3.59Å; D362-Y371 PolarHBondContact OD2-OH 3.39Å; D362-Y371 VanDerWaalsContact OD2-OH 3.05Å; K366-Y371 HydrophobicContact CB-CE2 3.84Å; K366-Y371 HydrophobicContact CD-CE2 3.78Å; K366-Y371 WeakPolarHBondContact CD-OH 3.26Å; A368-Y371 PolarHBondContact O-N 2.91Å; W369-Y371 PolarHBondContact O-N 3.49Å; Y371-S373 PolarHBondContact O-N 3.19Å
372L86.9Confident84.8Confident31 Ų3170.1 Ų70.116%0.16237%0.371CS..  trans-65.5106.3174.4-66.8177.2000110.2A339 I347 W369 D374 I379 L383A339-L372 HydrophobicContact CB-CD2 4.1Å; I347-L372 HydrophobicContact CD1-CD2 4Å; W369-L372 HydrophobicContact CB-CD1 4.42Å; W369-L372 WeakPolarHBondContact O-CB 3.17Å; W369-L372 PolarHBondContact O-N 2.94Å; L372-D374 VanDerWaalsContact C-N 3.25Å; L372-D374 PolarHBondContact O-N 3.27Å; L372-I379 HydrophobicContact CD1-CG2 4.23Å; L372-I379 HydrophobicContact CD2-CG2 4.29Å; L372-L383 HydrophobicContact CD1-CD1 4.25Å
373S74.6Confident84.3Confident123 Ų12369.5 Ų69.586%0.8637%0.368SS*.SBendtrans-72.3-21.5173.8-61.10000112.7Y371Y371-S373 PolarHBondContact O-N 3.19Å
374D74.3Confident83.4Confident88 Ų8867.2 Ų67.247%0.47136%0.361SS..SBendtrans-113.9122.8176.5175.323.5000109.9K344 L372 A376K344-D374 VanDerWaalsContact CE-OD2 3.25Å; K344-D374 WeakPolarHBondContact CE-OD2 3.34Å; K344-D374 IonicContact NZ-OD2 2.6Å; K344-D374 PolarHBondContact NZ-OD2 3.15Å; L372-D374 VanDerWaalsContact C-N 3.25Å; L372-D374 PolarHBondContact O-N 3.27Å; D374-A376 PolarHBondContact O-N 2.68Å
375R66.5Low82.2Confident215 Ų21568.1 Ų68.181%0.81137%0.368SS*.  trans-8259.7178.5-81.6-175.7164.6-177.5-5.2111.3P377R375-P377 WeakPolarHBondContact O-CD 3.39Å
376A73.9Confident81.8Confident13 Ų1369.9 Ų69.911%0.10737%0.369CS..  trans-65.4112.1164.500000108.9D374 D378 I379 L380D374-A376 PolarHBondContact O-N 2.68Å; A376-D378 PolarHBondContact O-N 3.07Å; A376-I379 HydrophobicContact CB-CB 4.26Å; A376-I379 HydrophobicContact CB-CD1 4Å; A376-I379 HydrophobicContact CB-CG1 4.13Å; A376-I379 PolarHBondContact O-N 3.34Å; A376-I379 VanDerWaalsContact O-N 3.08Å; A376-L380 PolarHBondContact O-N 2.93Å
377P78.8Confident81.3Confident94 Ų9469 Ų6961%0.6137%0.369SS*.Hα-helixtrans-61.8-45.4-166.922.7-32.3000112R375 I379 L380 E381R375-P377 WeakPolarHBondContact O-CD 3.39Å; P377-I379 PolarHBondContact O-N 3.1Å; P377-I379 VanDerWaalsContact O-N 3.1Å; P377-L380 PolarHBondContact O-N 2.88Å; P377-L380 VanDerWaalsContact O-N 3.13Å; P377-E381 WeakPolarHBondContact O-CB 3.46Å; P377-E381 PolarHBondContact O-N 3.01Å
378D84.8Confident80.7Confident70 Ų7070.2 Ų70.237%0.37438%0.378SS..Hα-helixtrans-67-10.5179.540.6-60.6000114.2R348 A376 L382R348-D378 IonicContact CZ-OD2 2.91Å; R348-D378 IonicContact NH2-OD2 2.72Å; R348-D378 PolarHBondContact NH2-OD2 3.09Å; A376-D378 PolarHBondContact O-N 3.07Å; D378-L382 WeakPolarHBondContact O-CB 3.44Å; D378-L382 VanDerWaalsContact O-CD1 3.26Å; D378-L382 WeakPolarHBondContact O-CD1 3.44Å; D378-L382 WeakPolarHBondContact O-CG 3.15Å
379I85Confident80.2Confident3 Ų374.2 Ų74.22%0.01540%0.4CS..Hα-helixtrans-100.2-32.3173.6-54.7-178.6000110.9K344 I347 L372 A376 P377 E381 L383K344-I379 HydrophobicContact CB-CD1 3.45Å; K344-I379 VanDerWaalsContact CB-CD1 3.45Å; K344-I379 HydrophobicContact CD-CD1 3.53Å; K344-I379 HydrophobicContact CG-CD1 3.35Å; I347-I379 HydrophobicContact CB-CG2 4.48Å; I347-I379 HydrophobicContact CD1-CG2 4Å; I347-I379 HydrophobicContact CG2-CG2 3.94Å; L372-I379 HydrophobicContact CD1-CG2 4.23Å; L372-I379 HydrophobicContact CD2-CG2 4.29Å; A376-I379 HydrophobicContact CB-CB 4.26Å; A376-I379 HydrophobicContact CB-CD1 4Å; A376-I379 HydrophobicContact CB-CG1 4.13Å; A376-I379 PolarHBondContact O-N 3.34Å; A376-I379 VanDerWaalsContact O-N 3.08Å; P377-I379 PolarHBondContact O-N 3.1Å; P377-I379 VanDerWaalsContact O-N 3.1Å; I379-E381 VanDerWaalsContact C-N 3.35Å; I379-L383 HydrophobicContact CG2-CD1 4.46Å; I379-L383 WeakPolarHBondContact O-CB 3.34Å; I379-L383 WeakPolarHBondContact O-CG 3.39Å; I379-L383 PolarHBondContact O-N 3.06Å
380L84Confident79.6Confident51 Ų5172.9 Ų72.927%0.26740%0.402SS..Hα-helixtrans-63.8-43.2167.6-178.659.3000110.5W369 A376 P377 L383 A384W369-L380 HydrophobicContact CB-CD1 4Å; W369-L380 HydrophobicContact CD2-CD1 4.25Å; W369-L380 HydrophobicContact CE3-CD1 3.84Å; W369-L380 HydrophobicContact CG-CD1 4.37Å; A376-L380 PolarHBondContact O-N 2.93Å; P377-L380 PolarHBondContact O-N 2.88Å; P377-L380 VanDerWaalsContact O-N 3.13Å; L380-L383 CarbonylContact O-C 3.28Å; L380-L383 PolarHBondContact O-N 2.78Å; L380-L383 VanDerWaalsContact O-N 3.14Å; L380-A384 WeakPolarHBondContact O-CB 3.42Å; L380-A384 PolarHBondContact O-N 2.73Å
381E83.8Confident78.9Confident143 Ų14371.7 Ų71.767%0.66840%0.4SS*.Hα-helixtrans-59.9-52.5175.1-175.2177.6-161.300111.8P377 I379 L383 A384P377-E381 WeakPolarHBondContact O-CB 3.46Å; P377-E381 PolarHBondContact O-N 3.01Å; I379-E381 VanDerWaalsContact C-N 3.35Å; E381-L383 PolarHBondContact O-N 2.98Å; E381-A384 PolarHBondContact O-N 3.25Å
382L83.6Confident78.2Confident41 Ų4172.9 Ų72.922%0.21541%0.414CS..THydrogen-bonded Turntrans-59.8-14.1174.3-75.7172.7000114.3R348 D378R348-L382 HydrophobicContact CG-CD1 3.99Å; D378-L382 WeakPolarHBondContact O-CB 3.44Å; D378-L382 VanDerWaalsContact O-CD1 3.26Å; D378-L382 WeakPolarHBondContact O-CD1 3.44Å; D378-L382 WeakPolarHBondContact O-CG 3.15Å
383L80.4Confident77.5Confident0 Ų076.2 Ų76.20%043%0.433CS..THydrogen-bonded Turntrans-116.87.3176.3-64.8-178.2000114.2L335 I347 V351 V358 W369 L372 I379 L380 E381L335-L383 HydrophobicContact CD1-CD2 4.03Å; L335-L383 HydrophobicContact CD2-CD2 3.79Å; L335-L383 HydrophobicContact CG-CD2 4.06Å; I347-L383 HydrophobicContact CD1-CD1 4.49Å; I347-L383 HydrophobicContact CG2-CD1 3.79Å; I347-L383 HydrophobicContact CG2-CD2 3.96Å; I347-L383 HydrophobicContact CG2-CG 3.93Å; V351-L383 HydrophobicContact CG2-CD2 3.89Å; V358-L383 VanDerWaalsContact CG1-C 3.42Å; V358-L383 HydrophobicContact CG1-CB 4.27Å; V358-L383 HydrophobicContact CG1-CD2 4.2Å; V358-L383 WeakPolarHBondContact CG1-O 2.93Å; V358-L383 HydrophobicContact CG2-CD2 4.01Å; W369-L383 HydrophobicContact CB-CB 3.75Å; W369-L383 HydrophobicContact CB-CD1 4.42Å; L372-L383 HydrophobicContact CD1-CD1 4.25Å; I379-L383 HydrophobicContact CG2-CD1 4.46Å; I379-L383 WeakPolarHBondContact O-CB 3.34Å; I379-L383 WeakPolarHBondContact O-CG 3.39Å; I379-L383 PolarHBondContact O-N 3.06Å; L380-L383 CarbonylContact O-C 3.28Å; L380-L383 PolarHBondContact O-N 2.78Å; L380-L383 VanDerWaalsContact O-N 3.14Å; E381-L383 PolarHBondContact O-N 2.98Å
384A75.6Confident77.8Confident63 Ų6372.3 Ų72.352%0.52140%0.398SS..THydrogen-bonded Turntrans-103.8-18.6177.900000113.4L380 E381L380-A384 WeakPolarHBondContact O-CB 3.42Å; L380-A384 PolarHBondContact O-N 2.73Å; E381-A384 PolarHBondContact O-N 3.25Å
385A62.9Low78.1Confident86 Ų8670.8 Ų70.871%0.71139%0.391SS*.  trans-67.30173.800000114.9K359K359-A385 WeakPolarHBondContact CE-O 3.11Å; K359-A385 PolarHBondContact NZ-O 2.67Å

Retrieved 385 of 385 residues in 276.6 ms (Link to these results)