A0A077YW98_TRITR Loading...

Receptor expression-enhancing protein

AlphaFold DB , UniProt , Accession A0A077YW98, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 161 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M60.1Low80.2Confident182 Ų18295.2 Ų95.290%0.89749%0.486SS*.  01330-157.9-177.6-71.200107.7V5 V6M1-V5 HydrophobicContact CG-CB 4.01Å; M1-V5 HydrophobicContact CG-CG1 3.94Å; M1-V5 HydrophobicContact SD-CB 4.24Å; M1-V5 HydrophobicContact SD-CG1 3.68Å; M1-V6 HydrophobicContact CB-CG2 4.46Å; M1-V6 HydrophobicContact SD-CG2 4.09Å
2P80.4Confident80.4Confident66 Ų6689.2 Ų89.243%0.42946%0.456SS..  trans-59.4144.4178.1-22.233000111.7W4 V5 V6P2-W4 HydrophobicContact CB-CG 4.18Å; P2-W4 PolarHBondContact O-N 3.22Å; P2-V5 HydrophobicContact CB-CG2 4.21Å; P2-V5 HydrophobicContact CG-CG2 4.21Å; P2-V5 WeakPolarHBondContact O-CB 3.2Å; P2-V5 PolarHBondContact O-N 3.23Å; P2-V6 PolarHBondContact O-N 3.48Å
3S81.6Confident80.7Confident90 Ų9083.4 Ų83.463%0.62943%0.427SS*.Hα-helixtrans-57.8-35.3-177.951.10000113.2V5 V6 N7S3-V5 VanDerWaalsContact C-N 3.3Å; S3-V5 PolarHBondContact O-N 3.48Å; S3-V6 PolarHBondContact O-N 3.37Å; S3-N7 VanDerWaalsContact O-CG 3.31Å; S3-N7 PolarHBondContact O-N 3.1Å; S3-N7 PolarHBondContact O-ND2 2.79Å
4W83.7Confident81Confident169 Ų16981.2 Ų81.264%0.6442%0.417SS*.Hα-helixtrans-62.6-34.2177.567.4-96.5000113P2 N7 Q8P2-W4 HydrophobicContact CB-CG 4.18Å; P2-W4 PolarHBondContact O-N 3.22Å; W4-N7 PolarHBondContact O-N 3.01Å; W4-Q8 WeakPolarHBondContact O-CB 3.33Å; W4-Q8 PolarHBondContact O-N 2.89Å
5V77.5Confident81.3Confident30 Ų3078.9 Ų78.918%0.18242%0.415CS..Hα-helixtrans-68.2-44.2176.9179.50000110.2M1 P2 S3 N7 Q8 V9M1-V5 HydrophobicContact CG-CB 4.01Å; M1-V5 HydrophobicContact CG-CG1 3.94Å; M1-V5 HydrophobicContact SD-CB 4.24Å; M1-V5 HydrophobicContact SD-CG1 3.68Å; P2-V5 HydrophobicContact CB-CG2 4.21Å; P2-V5 HydrophobicContact CG-CG2 4.21Å; P2-V5 WeakPolarHBondContact O-CB 3.2Å; P2-V5 PolarHBondContact O-N 3.23Å; S3-V5 VanDerWaalsContact C-N 3.3Å; S3-V5 PolarHBondContact O-N 3.48Å; V5-N7 VanDerWaalsContact C-N 3.29Å; V5-N7 PolarHBondContact O-N 3.42Å; V5-Q8 PolarHBondContact O-N 3.46Å; V5-V9 HydrophobicContact CG1-CG2 4.48Å; V5-V9 WeakPolarHBondContact O-CG2 3.33Å; V5-V9 PolarHBondContact O-N 3.45Å
6V80.6Confident81.3Confident57 Ų5779.8 Ų79.835%0.34542%0.418SS..Hα-helixtrans-62.1-41.7178.61780000110.5M1 P2 S3 V9 K10M1-V6 HydrophobicContact CB-CG2 4.46Å; M1-V6 HydrophobicContact SD-CG2 4.09Å; P2-V6 PolarHBondContact O-N 3.48Å; S3-V6 PolarHBondContact O-N 3.37Å; V6-V9 PolarHBondContact O-N 3.22Å; V6-K10 WeakPolarHBondContact O-CG 3.26Å; V6-K10 PolarHBondContact O-N 3.47Å
7N84.7Confident81.5Confident100 Ų10075.4 Ų75.454%0.53540%0.395SS..Hα-helixtrans-66.5-38177.5-67.8-16.7000112S3 W4 V5 K10 H11S3-N7 VanDerWaalsContact O-CG 3.31Å; S3-N7 PolarHBondContact O-N 3.1Å; S3-N7 PolarHBondContact O-ND2 2.79Å; W4-N7 PolarHBondContact O-N 3.01Å; V5-N7 VanDerWaalsContact C-N 3.29Å; V5-N7 PolarHBondContact O-N 3.42Å; N7-K10 PolarHBondContact O-N 3.17Å; N7-H11 WeakPolarHBondContact O-CB 3.23Å; N7-H11 PolarHBondContact O-N 3.31Å
8Q82.5Confident81.5Confident72 Ų7275.7 Ų75.734%0.33640%0.404SS..Hα-helixtrans-63.3-47.8174.6-172.263.342.700111.3W4 V5 K10 H11 D12W4-Q8 WeakPolarHBondContact O-CB 3.33Å; W4-Q8 PolarHBondContact O-N 2.89Å; V5-Q8 PolarHBondContact O-N 3.46Å; Q8-K10 VanDerWaalsContact C-N 3.29Å; Q8-K10 PolarHBondContact O-N 2.94Å; Q8-H11 PolarHBondContact O-N 2.68Å; Q8-H11 VanDerWaalsContact O-N 3.15Å; Q8-D12 PolarHBondContact NE2-OD1 2.79Å; Q8-D12 PolarHBondContact O-N 3.19Å
9V81.1Confident81.7Confident56 Ų5675.7 Ų75.734%0.33940%0.404SS..Hα-helixtrans-58.9-42.9177.9170.90000110.9V5 V6 D12 V13 W44V5-V9 HydrophobicContact CG1-CG2 4.48Å; V5-V9 WeakPolarHBondContact O-CG2 3.33Å; V5-V9 PolarHBondContact O-N 3.45Å; V6-V9 PolarHBondContact O-N 3.22Å; V9-D12 PolarHBondContact O-N 3.11Å; V9-V13 HydrophobicContact CG1-CG2 4.34Å; V9-V13 WeakPolarHBondContact O-CB 3.27Å; V9-V13 WeakPolarHBondContact O-CG2 3.3Å; V9-V13 PolarHBondContact O-N 3.07Å; V9-W44 HydrophobicContact CG1-CH2 4.45Å
10K85.1Confident81.4Confident99 Ų9977.6 Ų77.643%0.4341%0.41SS..Hα-helixtrans-59.8-50.3175-74.9-179.9176.4-171.50111.3V6 N7 Q8 D12 V13 D14V6-K10 WeakPolarHBondContact O-CG 3.26Å; V6-K10 PolarHBondContact O-N 3.47Å; N7-K10 PolarHBondContact O-N 3.17Å; Q8-K10 VanDerWaalsContact C-N 3.29Å; Q8-K10 PolarHBondContact O-N 2.94Å; K10-D12 VanDerWaalsContact C-N 3.31Å; K10-D12 PolarHBondContact O-N 2.75Å; K10-V13 PolarHBondContact O-N 3.5Å; K10-V13 VanDerWaalsContact O-N 3.17Å; K10-D14 WeakPolarHBondContact O-CB 3.2Å; K10-D14 PolarHBondContact O-N 3.03Å
11H84.9Confident81.1Confident126 Ų12678.4 Ų78.458%0.58343%0.428SS*.Hα-helixtrans-59.3-40.7179.1-174.5-79000112.8N7 Q8 D14 A15N7-H11 WeakPolarHBondContact O-CB 3.23Å; N7-H11 PolarHBondContact O-N 3.31Å; Q8-H11 PolarHBondContact O-N 2.68Å; Q8-H11 VanDerWaalsContact O-N 3.15Å; H11-D14 PolarHBondContact O-N 2.84Å; H11-A15 VanDerWaalsContact O-CB 3.29Å; H11-A15 WeakPolarHBondContact O-CB 3.48Å; H11-A15 PolarHBondContact O-N 2.93Å
12D82.9Confident81.9Confident23 Ų2372 Ų7212%0.12340%0.4CS..Hα-helixtrans-67-42.3177.5-62.5-20.1000111Q8 V9 K10 A15 M16 I133Q8-D12 PolarHBondContact NE2-OD1 2.79Å; Q8-D12 PolarHBondContact O-N 3.19Å; V9-D12 PolarHBondContact O-N 3.11Å; K10-D12 VanDerWaalsContact C-N 3.31Å; K10-D12 PolarHBondContact O-N 2.75Å; D12-A15 PolarHBondContact O-N 3.32Å; D12-M16 WeakPolarHBondContact O-CB 3.49Å; D12-M16 VanDerWaalsContact O-CG 3.22Å; D12-M16 WeakPolarHBondContact O-CG 3.5Å; D12-M16 PolarHBondContact O-N 2.76Å; D12-I133 HydrophobicContact CB-CD1 4.44Å; D12-I133 VanDerWaalsContact CG-CD1 3.45Å; D12-I133 WeakPolarHBondContact OD1-CD1 3.45Å; D12-I133 VanDerWaalsContact OD2-CD1 3.27Å; D12-I133 WeakPolarHBondContact OD2-CD1 3.3Å
13V83.7Confident82Confident14 Ų1473.8 Ų73.89%0.08541%0.412CS..Hα-helixtrans-62.8-46.4175.2167.50000110.8V9 K10 A15 M16 L17 F43V9-V13 HydrophobicContact CG1-CG2 4.34Å; V9-V13 WeakPolarHBondContact O-CB 3.27Å; V9-V13 WeakPolarHBondContact O-CG2 3.3Å; V9-V13 PolarHBondContact O-N 3.07Å; K10-V13 PolarHBondContact O-N 3.5Å; K10-V13 VanDerWaalsContact O-N 3.17Å; V13-A15 VanDerWaalsContact C-N 3.32Å; V13-A15 PolarHBondContact O-N 3.28Å; V13-M16 PolarHBondContact O-N 3.35Å; V13-L17 HydrophobicContact CG1-CD1 3.58Å; V13-L17 HydrophobicContact CG1-CG 4.18Å; V13-L17 WeakPolarHBondContact O-CB 3.48Å; V13-L17 VanDerWaalsContact O-CG 3.25Å; V13-L17 WeakPolarHBondContact O-CG 3.49Å; V13-L17 PolarHBondContact O-N 3.32Å; V13-F43 HydrophobicContact CB-CE1 4.35Å; V13-F43 HydrophobicContact CG1-CD1 3.52Å; V13-F43 HydrophobicContact CG1-CD2 4.49Å; V13-F43 HydrophobicContact CG1-CE1 3.58Å; V13-F43 HydrophobicContact CG1-CG 4.01Å; V13-F43 HydrophobicContact CG1-CZ 4.11Å; V13-F43 HydrophobicContact CG2-CD1 4.49Å; V13-F43 HydrophobicContact CG2-CE1 3.72Å; V13-F43 HydrophobicContact CG2-CZ 3.95Å
14D85.5Confident81.9Confident53 Ų5372.3 Ų72.328%0.28340%0.399SS..Hα-helixtrans-63.6-41.5180-60.9-20.8000110.4K10 H11 L17 S18 E40K10-D14 WeakPolarHBondContact O-CB 3.2Å; K10-D14 PolarHBondContact O-N 3.03Å; H11-D14 PolarHBondContact O-N 2.84Å; D14-L17 PolarHBondContact O-N 2.83Å; D14-S18 VanDerWaalsContact O-CB 3.23Å; D14-S18 WeakPolarHBondContact O-CB 3.45Å; D14-S18 PolarHBondContact O-N 3.25Å; D14-S18 PolarHBondContact O-OG 2.98Å; D14-E40 VanDerWaalsContact OD1-CD 3.31Å; D14-E40 VanDerWaalsContact OD1-CG 3.25Å; D14-E40 WeakPolarHBondContact OD1-CG 3.46Å
15A85Confident81.9Confident46 Ų4664.2 Ų64.238%0.3837%0.369SS..Hα-helixtrans-59.3-47.8173.400000111.6H11 D12 V13 L17 S18 D19H11-A15 VanDerWaalsContact O-CB 3.29Å; H11-A15 WeakPolarHBondContact O-CB 3.48Å; H11-A15 PolarHBondContact O-N 2.93Å; D12-A15 PolarHBondContact O-N 3.32Å; V13-A15 VanDerWaalsContact C-N 3.32Å; V13-A15 PolarHBondContact O-N 3.28Å; A15-L17 PolarHBondContact O-N 3.48Å; A15-S18 PolarHBondContact O-N 3.34Å; A15-S18 PolarHBondContact O-OG 3.06Å; A15-D19 PolarHBondContact O-N 2.89Å; A15-D19 VanDerWaalsContact O-N 3.11Å
16M82Confident82.3Confident94 Ų9470.1 Ų70.146%0.46339%0.388SS..Hα-helixtrans-64.3-37.5177.9-70.4175.774.900113.2D12 V13D12-M16 WeakPolarHBondContact O-CB 3.49Å; D12-M16 VanDerWaalsContact O-CG 3.22Å; D12-M16 WeakPolarHBondContact O-CG 3.5Å; D12-M16 PolarHBondContact O-N 2.76Å; V13-M16 PolarHBondContact O-N 3.35Å
17L84Confident82.6Confident5 Ų569 Ų693%0.02638%0.384CS..Hα-helixtrans-76.1-26.4178.6-69.2172.7000112.7V13 D14 A15 V24 F28 R39 E40 F43V13-L17 HydrophobicContact CG1-CD1 3.58Å; V13-L17 HydrophobicContact CG1-CG 4.18Å; V13-L17 WeakPolarHBondContact O-CB 3.48Å; V13-L17 VanDerWaalsContact O-CG 3.25Å; V13-L17 WeakPolarHBondContact O-CG 3.49Å; V13-L17 PolarHBondContact O-N 3.32Å; D14-L17 PolarHBondContact O-N 2.83Å; A15-L17 PolarHBondContact O-N 3.48Å; L17-V24 HydrophobicContact CD2-CG1 4.41Å; L17-F28 HydrophobicContact CD2-CB 3.84Å; L17-F28 HydrophobicContact CD2-CD1 4.11Å; L17-F28 HydrophobicContact CD2-CD2 3.51Å; L17-F28 HydrophobicContact CD2-CE2 4.08Å; L17-F28 HydrophobicContact CD2-CG 3.53Å; L17-R39 HydrophobicContact CB-CB 4.28Å; L17-R39 HydrophobicContact CD1-CB 4.31Å; L17-R39 WeakPolarHBondContact O-CD 3.27Å; L17-R39 PolarHBondContact O-NH1 3.09Å; L17-E40 HydrophobicContact CD1-CG 4.42Å; L17-F43 HydrophobicContact CD1-CB 3.74Å; L17-F43 HydrophobicContact CD1-CG 4.09Å; L17-F43 HydrophobicContact CD2-CB 4.14Å; L17-F43 HydrophobicContact CD2-CD2 4.1Å; L17-F43 HydrophobicContact CD2-CG 4.39Å
18S82.6Confident82.8Confident80 Ų8065 Ų6556%0.55936%0.362SS*.Hα-helixtrans-81-21.7176730000113.1D14 A15 E20D14-S18 VanDerWaalsContact O-CB 3.23Å; D14-S18 WeakPolarHBondContact O-CB 3.45Å; D14-S18 PolarHBondContact O-N 3.25Å; D14-S18 PolarHBondContact O-OG 2.98Å; A15-S18 PolarHBondContact O-N 3.34Å; A15-S18 PolarHBondContact O-OG 3.06Å; S18-E20 PolarHBondContact O-N 3.07Å; S18-E20 VanDerWaalsContact O-N 3.12Å
19D83.6Confident83Confident76 Ų7663.7 Ų63.741%0.40636%0.357SS..  trans-8288.9179.5-170.4-1.1000112A15 A21 T22 G25A15-D19 PolarHBondContact O-N 2.89Å; A15-D19 VanDerWaalsContact O-N 3.11Å; D19-A21 PolarHBondContact O-N 3.2Å; D19-A21 VanDerWaalsContact OD1-CB 3.27Å; D19-A21 WeakPolarHBondContact OD1-CB 3.49Å; D19-A21 PolarHBondContact OD1-N 2.99Å; D19-A21 VanDerWaalsContact OD1-N 3.07Å; D19-T22 HydrophobicContact CB-CG2 4.18Å; D19-T22 PolarHBondContact O-N 3.34Å; D19-T22 PolarHBondContact O-OG1 3.37Å; D19-T22 WeakPolarHBondContact OD2-CG2 3.47Å; D19-G25 WeakPolarHBondContact O-CA 3.48Å
20E76Confident83.3Confident113 Ų11364.7 Ų64.753%0.52836%0.357SS..THydrogen-bonded Turntrans-63.8-14.3177.8-66.9176.5-174.100113.8S18 T22 R39S18-E20 PolarHBondContact O-N 3.07Å; S18-E20 VanDerWaalsContact O-N 3.12Å; E20-T22 PolarHBondContact O-N 3.21Å; E20-R39 IonicContact OE1-CZ 3.76Å; E20-R39 IonicContact OE1-NH1 2.95Å; E20-R39 IonicContact OE1-NH2 3.98Å; E20-R39 PolarHBondContact OE1-NH2 3.09Å
21A76.5Confident83.4Confident96 Ų9663.7 Ų63.779%0.79336%0.355SS*.THydrogen-bonded Turntrans-72.6-21.8173.800000112D19D19-A21 PolarHBondContact O-N 3.2Å; D19-A21 VanDerWaalsContact OD1-CB 3.27Å; D19-A21 WeakPolarHBondContact OD1-CB 3.49Å; D19-A21 PolarHBondContact OD1-N 2.99Å; D19-A21 VanDerWaalsContact OD1-N 3.07Å
22T76.8Confident83.6Confident48 Ų4860.5 Ų60.529%0.29434%0.341SS..SBendtrans-82.8148176.269.30000111.2D19 E20 V24 G25 W26D19-T22 HydrophobicContact CB-CG2 4.18Å; D19-T22 PolarHBondContact O-N 3.34Å; D19-T22 PolarHBondContact O-OG1 3.37Å; D19-T22 WeakPolarHBondContact OD2-CG2 3.47Å; E20-T22 PolarHBondContact O-N 3.21Å; T22-V24 PolarHBondContact O-N 3.16Å; T22-V24 VanDerWaalsContact O-N 3.15Å; T22-G25 PolarHBondContact O-N 3.3Å; T22-G25 PolarHBondContact OG1-N 3.09Å; T22-W26 PolarHBondContact O-N 2.85Å
23C81.5Confident83.8Confident103 Ų10365.4 Ų65.470%0.69636%0.363SS*.Hα-helixtrans-54.6-33.4173.2-1780000111.9A27C23-A27 VanDerWaalsContact O-CB 3.22Å; C23-A27 WeakPolarHBondContact O-CB 3.36Å; C23-A27 PolarHBondContact O-N 3Å
24V79.5Confident84.1Confident58 Ų5874.4 Ų74.435%0.35240%0.397SS..Hα-helixtrans-68.9-52.3178.1-178.90000110.6L17 T22 W26 A27 F28L17-V24 HydrophobicContact CD2-CG1 4.41Å; T22-V24 PolarHBondContact O-N 3.16Å; T22-V24 VanDerWaalsContact O-N 3.15Å; V24-W26 VanDerWaalsContact C-N 3.34Å; V24-W26 PolarHBondContact O-N 3.39Å; V24-A27 PolarHBondContact O-N 3.2Å; V24-F28 HydrophobicContact CG1-CD2 3.67Å; V24-F28 HydrophobicContact CG1-CE2 3.86Å; V24-F28 WeakPolarHBondContact O-CD2 3.43Å; V24-F28 PolarHBondContact O-N 3.02Å
25G83.4Confident84.1Confident0 Ų074.2 Ų74.20%040%0.4CS..Hα-helixtrans-57.8-46.3177.600000112.1D19 T22 A27 F28 D29D19-G25 WeakPolarHBondContact O-CA 3.48Å; T22-G25 PolarHBondContact O-N 3.3Å; T22-G25 PolarHBondContact OG1-N 3.09Å; G25-A27 PolarHBondContact O-N 2.86Å; G25-F28 PolarHBondContact O-N 3.2Å; G25-D29 VanDerWaalsContact O-CB 3.31Å; G25-D29 WeakPolarHBondContact O-CB 3.2Å; G25-D29 PolarHBondContact O-N 3.27Å
26W87.2Confident84.1Confident154 Ų15475.2 Ų75.258%0.58342%0.415SS*.Hα-helixtrans-59-44.7174.8175.285.1000113T22 V24 K30T22-W26 PolarHBondContact O-N 2.85Å; V24-W26 VanDerWaalsContact C-N 3.34Å; V24-W26 PolarHBondContact O-N 3.39Å; W26-K30 HydrophobicContact CZ2-CG 4.36Å; W26-K30 PolarHBondContact O-N 3.46Å; W26-K30 VanDerWaalsContact O-N 3.17Å
27A87Confident84.3Confident32 Ų3277 Ų7726%0.26442%0.417SS..Hα-helixtrans-66-43.6-18000000111.7C23 V24 G25 K30 I31C23-A27 VanDerWaalsContact O-CB 3.22Å; C23-A27 WeakPolarHBondContact O-CB 3.36Å; C23-A27 PolarHBondContact O-N 3Å; V24-A27 PolarHBondContact O-N 3.2Å; G25-A27 PolarHBondContact O-N 2.86Å; A27-K30 PolarHBondContact O-N 3.15Å; A27-I31 VanDerWaalsContact O-CG1 3.26Å; A27-I31 WeakPolarHBondContact O-CG1 3.45Å; A27-I31 PolarHBondContact O-N 3.46Å
28F87.4Confident84.5Confident18 Ų1879 Ų798%0.07943%0.431CS..Hα-helixtrans-72.5-31.3179.6-83.9-79.2000113.1L17 V24 G25 I31 E32 C42 F43 F46L17-F28 HydrophobicContact CD2-CB 3.84Å; L17-F28 HydrophobicContact CD2-CD1 4.11Å; L17-F28 HydrophobicContact CD2-CD2 3.51Å; L17-F28 HydrophobicContact CD2-CE2 4.08Å; L17-F28 HydrophobicContact CD2-CG 3.53Å; V24-F28 HydrophobicContact CG1-CD2 3.67Å; V24-F28 HydrophobicContact CG1-CE2 3.86Å; V24-F28 WeakPolarHBondContact O-CD2 3.43Å; V24-F28 PolarHBondContact O-N 3.02Å; G25-F28 PolarHBondContact O-N 3.2Å; F28-I31 HydrophobicContact CD1-CD1 4.37Å; F28-I31 PolarHBondContact O-N 3.02Å; F28-E32 WeakPolarHBondContact O-CB 3.26Å; F28-E32 PolarHBondContact O-N 3.36Å; F28-C42 HydrophobicContact CD1-CB 3.91Å; F28-C42 HydrophobicContact CE1-CB 3.96Å; F28-F43 VanDerWaalsContact CE1-CA 3.48Å; F28-F43 HydrophobicContact CE1-CB 3.95Å; F28-F43 HydrophobicContact CE2-CD2 4.06Å; F28-F43 HydrophobicContact CZ-CB 4.11Å; F28-F43 AromaticContact CZ-CD2 3.87Å; F28-F43 HydrophobicContact CZ-CD2 3.87Å; F28-F43 HydrophobicContact CZ-CG 4.47Å; F28-F46 HydrophobicContact CZ-CB 4.42Å; F28-F46 HydrophobicContact CZ-CD1 4.39Å
29D86.5Confident84.7Confident44 Ų4477.3 Ų77.324%0.23541%0.412CS..Hα-helixtrans-60.5-45.9170.3-179.557.7000111.2G25 I31 E32 E33 R39G25-D29 VanDerWaalsContact O-CB 3.31Å; G25-D29 WeakPolarHBondContact O-CB 3.2Å; G25-D29 PolarHBondContact O-N 3.27Å; D29-I31 PolarHBondContact O-N 3.23Å; D29-E32 PolarHBondContact O-N 2.96Å; D29-E33 PolarHBondContact O-N 3.29Å; D29-R39 IonicContact OD1-CZ 2.79Å; D29-R39 IonicContact OD1-NE 3.54Å; D29-R39 IonicContact OD1-NH2 3.75Å; D29-R39 PolarHBondContact OD1-NH2 3.25Å
30K87.7Confident84.9Confident77 Ų7778.3 Ų78.334%0.33541%0.414SS..Hα-helixtrans-63.3-41.4173.7-69.5-55.2-179.7-1570113.1W26 A27 E32 E33 Y34W26-K30 HydrophobicContact CZ2-CG 4.36Å; W26-K30 PolarHBondContact O-N 3.46Å; W26-K30 VanDerWaalsContact O-N 3.17Å; A27-K30 PolarHBondContact O-N 3.15Å; K30-E32 VanDerWaalsContact C-N 3.33Å; K30-E32 PolarHBondContact O-N 3.42Å; K30-E33 WeakPolarHBondContact CD-OE2 3.26Å; K30-E33 IonicContact NZ-OE2 2.9Å; K30-E33 PolarHBondContact NZ-OE2 3.06Å; K30-E33 PolarHBondContact O-N 2.7Å; K30-Y34 WeakPolarHBondContact O-CD2 3.46Å; K30-Y34 PolarHBondContact O-N 3.38Å; K30-Y34 VanDerWaalsContact O-N 3.14Å
31I88.1Confident85.4Confident77 Ų7779.6 Ų79.640%0.39542%0.418SS..Hα-helixtrans-63.9-40.8176.6-68163.7000111A27 F28 D29 Y34 S35 C42A27-I31 VanDerWaalsContact O-CG1 3.26Å; A27-I31 WeakPolarHBondContact O-CG1 3.45Å; A27-I31 PolarHBondContact O-N 3.46Å; F28-I31 HydrophobicContact CD1-CD1 4.37Å; F28-I31 PolarHBondContact O-N 3.02Å; D29-I31 PolarHBondContact O-N 3.23Å; I31-Y34 PolarHBondContact O-N 2.97Å; I31-S35 WeakPolarHBondContact O-CB 3.48Å; I31-S35 PolarHBondContact O-N 3.43Å; I31-S35 PolarHBondContact O-OG 3.37Å; I31-C42 HydrophobicContact CG2-CB 4.16Å
32E88.5Confident86.1Confident60 Ų6075.5 Ų75.528%0.2838%0.384SS..Hα-helixtrans-62.2-44.1175.1175168.6-12700111.4F28 D29 K30 Y34 S35 G36 W37 S38 R39F28-E32 WeakPolarHBondContact O-CB 3.26Å; F28-E32 PolarHBondContact O-N 3.36Å; D29-E32 PolarHBondContact O-N 2.96Å; K30-E32 VanDerWaalsContact C-N 3.33Å; K30-E32 PolarHBondContact O-N 3.42Å; E32-Y34 VanDerWaalsContact C-N 3.3Å; E32-Y34 PolarHBondContact O-N 3.47Å; E32-S35 PolarHBondContact O-N 2.76Å; E32-G36 WeakPolarHBondContact O-CA 3.35Å; E32-G36 PolarHBondContact O-N 2.94Å; E32-W37 WeakPolarHBondContact CG-O 3.4Å; E32-S38 WeakPolarHBondContact OE1-CA 3.42Å; E32-R39 HydrophobicContact CB-CG 4.14Å; E32-R39 VanDerWaalsContact CD-CG 3.46Å; E32-R39 HydrophobicContact CG-CG 4.42Å; E32-R39 PolarHBondContact OE1-N 2.95Å; E32-R39 WeakPolarHBondContact OE2-CD 3.29Å; E32-R39 WeakPolarHBondContact OE2-CG 3.49Å; E32-R39 IonicContact OE2-CZ 3.55Å; E32-R39 IonicContact OE2-NE 3.9Å; E32-R39 PolarHBondContact OE2-NE 2.94Å; E32-R39 IonicContact OE2-NH2 2.68Å
33E88.3Confident86.7Confident126 Ų12675.6 Ų75.659%0.58938%0.38SS*.Hα-helixtrans-57.2-40.8176.9-169.1-179.9-175.300112.1D29 K30D29-E33 PolarHBondContact O-N 3.29Å; K30-E33 WeakPolarHBondContact CD-OE2 3.26Å; K30-E33 IonicContact NZ-OE2 2.9Å; K30-E33 PolarHBondContact NZ-OE2 3.06Å; K30-E33 PolarHBondContact O-N 2.7Å
34Y89Confident87.1Confident202 Ų20276 Ų7679%0.79237%0.367SS*.Hα-helixtrans-83.5-38.3179.6-73.3-67000114.4K30 I31 E32K30-Y34 WeakPolarHBondContact O-CD2 3.46Å; K30-Y34 PolarHBondContact O-N 3.38Å; K30-Y34 VanDerWaalsContact O-N 3.14Å; I31-Y34 PolarHBondContact O-N 2.97Å; E32-Y34 VanDerWaalsContact C-N 3.3Å; E32-Y34 PolarHBondContact O-N 3.47Å
35S85.3Confident87.8Confident49 Ų4980.9 Ų80.934%0.34338%0.38SS..Hα-helixtrans-90-23-172.366.10000113.8I31 E32 W37I31-S35 WeakPolarHBondContact O-CB 3.48Å; I31-S35 PolarHBondContact O-N 3.43Å; I31-S35 PolarHBondContact O-OG 3.37Å; E32-S35 PolarHBondContact O-N 2.76Å; S35-W37 PolarHBondContact O-N 3.38Å; S35-W37 PolarHBondContact OG-N 3Å
36G84.8Confident88.2Confident68 Ų6886.7 Ų86.770%0.70141%0.405SS*.  trans66.88.5-171.600000114.2E32E32-G36 WeakPolarHBondContact O-CA 3.35Å; E32-G36 PolarHBondContact O-N 2.94Å
37W86.3Confident88.4Confident132 Ų13280.8 Ų80.850%0.539%0.389SS..SBendtrans-93.1144176-70.99.3000110.2E32 S35 C42 W45E32-W37 WeakPolarHBondContact CG-O 3.4Å; S35-W37 PolarHBondContact O-N 3.38Å; S35-W37 PolarHBondContact OG-N 3Å; W37-C42 WeakPolarHBondContact CB-SG 3.25Å; W37-W45 HydrophobicContact CZ3-CG 4.25Å
38S88.2Confident88.7Confident47 Ų4783.7 Ų83.733%0.32940%0.403SS..  trans-59.3141.4177600000111.6E32 E40 K41 C42E32-S38 WeakPolarHBondContact OE1-CA 3.42Å; S38-E40 PolarHBondContact O-N 2.91Å; S38-E40 VanDerWaalsContact O-N 3.08Å; S38-K41 WeakPolarHBondContact O-CB 3.37Å; S38-K41 PolarHBondContact O-N 2.9Å; S38-K41 WeakPolarHBondContact OG-CD 3.38Å; S38-K41 WeakPolarHBondContact OG-CG 3.39Å; S38-C42 PolarHBondContact O-N 3.1Å; S38-C42 VanDerWaalsContact O-N 3.09Å
39R87Confident89Confident43 Ų4385.5 Ų85.516%0.16242%0.418CS..Hα-helixtrans-46.6-43.6-179.4-53.7-172.4-176.8174-0.1112.7L17 E20 D29 E32 K41 C42 F43L17-R39 HydrophobicContact CB-CB 4.28Å; L17-R39 HydrophobicContact CD1-CB 4.31Å; L17-R39 WeakPolarHBondContact O-CD 3.27Å; L17-R39 PolarHBondContact O-NH1 3.09Å; E20-R39 IonicContact OE1-CZ 3.76Å; E20-R39 IonicContact OE1-NH1 2.95Å; E20-R39 IonicContact OE1-NH2 3.98Å; E20-R39 PolarHBondContact OE1-NH2 3.09Å; D29-R39 IonicContact OD1-CZ 2.79Å; D29-R39 IonicContact OD1-NE 3.54Å; D29-R39 IonicContact OD1-NH2 3.75Å; D29-R39 PolarHBondContact OD1-NH2 3.25Å; E32-R39 HydrophobicContact CB-CG 4.14Å; E32-R39 VanDerWaalsContact CD-CG 3.46Å; E32-R39 HydrophobicContact CG-CG 4.42Å; E32-R39 PolarHBondContact OE1-N 2.95Å; E32-R39 WeakPolarHBondContact OE2-CD 3.29Å; E32-R39 WeakPolarHBondContact OE2-CG 3.49Å; E32-R39 IonicContact OE2-CZ 3.55Å; E32-R39 IonicContact OE2-NE 3.9Å; E32-R39 PolarHBondContact OE2-NE 2.94Å; E32-R39 IonicContact OE2-NH2 2.68Å; R39-K41 PolarHBondContact O-N 3.48Å; R39-C42 WeakPolarHBondContact O-CB 3.22Å; R39-C42 PolarHBondContact O-N 3.32Å; R39-F43 WeakPolarHBondContact O-CB 3.43Å; R39-F43 PolarHBondContact O-N 3.1Å
40E87.4Confident89.3Confident97 Ų9785.6 Ų85.645%0.45342%0.418SS..Hα-helixtrans-58.5-46.6176.5-70178.6-144.200113.2D14 L17 S38 F43 W44D14-E40 VanDerWaalsContact OD1-CD 3.31Å; D14-E40 VanDerWaalsContact OD1-CG 3.25Å; D14-E40 WeakPolarHBondContact OD1-CG 3.46Å; L17-E40 HydrophobicContact CD1-CG 4.42Å; S38-E40 PolarHBondContact O-N 2.91Å; S38-E40 VanDerWaalsContact O-N 3.08Å; E40-F43 PolarHBondContact O-N 3.35Å; E40-W44 PolarHBondContact O-N 3.24Å
41K87.9Confident89.6Confident140 Ų14083.2 Ų83.261%0.60941%0.413SS*.Hα-helixtrans-65.2-44.2179.9-74.3176.9-173.8172.80110.2S38 R39 F43 W44 W45S38-K41 WeakPolarHBondContact O-CB 3.37Å; S38-K41 PolarHBondContact O-N 2.9Å; S38-K41 WeakPolarHBondContact OG-CD 3.38Å; S38-K41 WeakPolarHBondContact OG-CG 3.39Å; R39-K41 PolarHBondContact O-N 3.48Å; K41-F43 VanDerWaalsContact C-N 3.3Å; K41-F43 PolarHBondContact O-N 3.31Å; K41-W44 PolarHBondContact O-N 3.45Å; K41-W45 WeakPolarHBondContact O-CB 3.22Å; K41-W45 PolarHBondContact O-N 3.15Å
42C89.7Confident89.8Confident10 Ų1082.2 Ų82.27%0.06842%0.416CS..Hα-helixtrans-57.3-45.4174.8-69.10000111.3F28 I31 W37 S38 R39 W45 F46F28-C42 HydrophobicContact CD1-CB 3.91Å; F28-C42 HydrophobicContact CE1-CB 3.96Å; I31-C42 HydrophobicContact CG2-CB 4.16Å; W37-C42 WeakPolarHBondContact CB-SG 3.25Å; S38-C42 PolarHBondContact O-N 3.1Å; S38-C42 VanDerWaalsContact O-N 3.09Å; R39-C42 WeakPolarHBondContact O-CB 3.22Å; R39-C42 PolarHBondContact O-N 3.32Å; C42-W45 PolarHBondContact O-N 3.47Å; C42-F46 VanDerWaalsContact O-CB 3.3Å; C42-F46 WeakPolarHBondContact O-CB 3.4Å; C42-F46 PolarHBondContact O-N 3.42Å
43F90.9Very high90Very high50 Ų5083.9 Ų83.922%0.21942%0.42CS..Hα-helixtrans-61.3-51178.8176.9-93.2000112.1V13 L17 F28 R39 E40 K41 W45 F46 A47V13-F43 HydrophobicContact CB-CE1 4.35Å; V13-F43 HydrophobicContact CG1-CD1 3.52Å; V13-F43 HydrophobicContact CG1-CD2 4.49Å; V13-F43 HydrophobicContact CG1-CE1 3.58Å; V13-F43 HydrophobicContact CG1-CG 4.01Å; V13-F43 HydrophobicContact CG1-CZ 4.11Å; V13-F43 HydrophobicContact CG2-CD1 4.49Å; V13-F43 HydrophobicContact CG2-CE1 3.72Å; V13-F43 HydrophobicContact CG2-CZ 3.95Å; L17-F43 HydrophobicContact CD1-CB 3.74Å; L17-F43 HydrophobicContact CD1-CG 4.09Å; L17-F43 HydrophobicContact CD2-CB 4.14Å; L17-F43 HydrophobicContact CD2-CD2 4.1Å; L17-F43 HydrophobicContact CD2-CG 4.39Å; F28-F43 VanDerWaalsContact CE1-CA 3.48Å; F28-F43 HydrophobicContact CE1-CB 3.95Å; F28-F43 HydrophobicContact CE2-CD2 4.06Å; F28-F43 HydrophobicContact CZ-CB 4.11Å; F28-F43 AromaticContact CZ-CD2 3.87Å; F28-F43 HydrophobicContact CZ-CD2 3.87Å; F28-F43 HydrophobicContact CZ-CG 4.47Å; R39-F43 WeakPolarHBondContact O-CB 3.43Å; R39-F43 PolarHBondContact O-N 3.1Å; E40-F43 PolarHBondContact O-N 3.35Å; K41-F43 VanDerWaalsContact C-N 3.3Å; K41-F43 PolarHBondContact O-N 3.31Å; F43-W45 VanDerWaalsContact C-N 3.29Å; F43-W45 PolarHBondContact O-N 2.88Å; F43-F46 PolarHBondContact O-N 2.91Å; F43-A47 VanDerWaalsContact O-CB 3.25Å; F43-A47 WeakPolarHBondContact O-CB 3.22Å; F43-A47 PolarHBondContact O-N 2.93Å
44W90Very high90.1Very high112 Ų11278 Ų7842%0.42439%0.393SS..Hα-helixtrans-64.1-35.6179.4-74.6112.9000112.5V9 E40 K41 T48V9-W44 HydrophobicContact CG1-CH2 4.45Å; E40-W44 PolarHBondContact O-N 3.24Å; K41-W44 PolarHBondContact O-N 3.45Å; W44-T48 WeakPolarHBondContact O-CB 3.46Å; W44-T48 PolarHBondContact O-N 2.94Å; W44-T48 PolarHBondContact O-OG1 3.44Å
45W93.1Very high90.2Very high161 Ų16170.7 Ų70.761%0.6137%0.369SS*.Hα-helixtrans-66.3-48.8175.6-141.993000111W37 K41 C42 F43 A47 T48 C49W37-W45 HydrophobicContact CZ3-CG 4.25Å; K41-W45 WeakPolarHBondContact O-CB 3.22Å; K41-W45 PolarHBondContact O-N 3.15Å; C42-W45 PolarHBondContact O-N 3.47Å; F43-W45 VanDerWaalsContact C-N 3.29Å; F43-W45 PolarHBondContact O-N 2.88Å; W45-A47 PolarHBondContact O-N 3.17Å; W45-T48 PolarHBondContact O-N 2.96Å; W45-C49 WeakPolarHBondContact CZ3-SG 3.24Å; W45-C49 PolarHBondContact O-N 3.33Å; W45-C49 PolarHBondContact O-SG 3.08Å
46F92.2Very high90.2Very high122 Ų12274.1 Ų74.154%0.53539%0.388SS..Hα-helixtrans-59.1-47.3175.4178.7-99.2000111.8F28 C42 F43 T48 C49 L50F28-F46 HydrophobicContact CZ-CB 4.42Å; F28-F46 HydrophobicContact CZ-CD1 4.39Å; C42-F46 VanDerWaalsContact O-CB 3.3Å; C42-F46 WeakPolarHBondContact O-CB 3.4Å; C42-F46 PolarHBondContact O-N 3.42Å; F43-F46 PolarHBondContact O-N 2.91Å; F46-T48 VanDerWaalsContact C-N 3.31Å; F46-T48 PolarHBondContact O-N 3.44Å; F46-C49 PolarHBondContact O-N 3.41Å; F46-L50 HydrophobicContact CE1-CD2 4.15Å; F46-L50 VanDerWaalsContact O-CB 3.24Å; F46-L50 WeakPolarHBondContact O-CB 3.39Å; F46-L50 PolarHBondContact O-N 2.99Å
47A91.9Very high90.3Very high29 Ų2971.6 Ų71.624%0.2436%0.362CS..Hα-helixtrans-61.1-39.5177.900000112F43 W45 A51F43-A47 VanDerWaalsContact O-CB 3.25Å; F43-A47 WeakPolarHBondContact O-CB 3.22Å; F43-A47 PolarHBondContact O-N 2.93Å; W45-A47 PolarHBondContact O-N 3.17Å; A47-A51 VanDerWaalsContact O-CB 3.26Å; A47-A51 WeakPolarHBondContact O-CB 3.39Å; A47-A51 PolarHBondContact O-N 2.92Å
48T92.9Very high90.2Very high93 Ų9372.3 Ų72.357%0.57138%0.375SS*.Hα-helixtrans-67.9-44.5177-57.50000111.4W44 W45 F46 A51 A52W44-T48 WeakPolarHBondContact O-CB 3.46Å; W44-T48 PolarHBondContact O-N 2.94Å; W44-T48 PolarHBondContact O-OG1 3.44Å; W45-T48 PolarHBondContact O-N 2.96Å; F46-T48 VanDerWaalsContact C-N 3.31Å; F46-T48 PolarHBondContact O-N 3.44Å; T48-A51 PolarHBondContact O-N 3.45Å; T48-A52 WeakPolarHBondContact O-CB 3.45Å; T48-A52 PolarHBondContact O-N 3.15Å
49C94Very high90.1Very high57 Ų5777.1 Ų77.139%0.38539%0.387SS..Hα-helixtrans-63.4-42.6175.6-74.10000112.2W45 F46 A52 Y53W45-C49 WeakPolarHBondContact CZ3-SG 3.24Å; W45-C49 PolarHBondContact O-N 3.33Å; W45-C49 PolarHBondContact O-SG 3.08Å; F46-C49 PolarHBondContact O-N 3.41Å; C49-A52 PolarHBondContact O-N 3.2Å; C49-Y53 WeakPolarHBondContact O-CB 3.49Å; C49-Y53 PolarHBondContact O-N 3.01Å
50L93.4Very high90.2Very high45 Ų4575.1 Ų75.124%0.23638%0.38CS..Hα-helixtrans-62.1-45.1175.317862.4000111F46 A52 Y53 L54 I63 I67F46-L50 HydrophobicContact CE1-CD2 4.15Å; F46-L50 VanDerWaalsContact O-CB 3.24Å; F46-L50 WeakPolarHBondContact O-CB 3.39Å; F46-L50 PolarHBondContact O-N 2.99Å; L50-A52 VanDerWaalsContact C-N 3.34Å; L50-A52 PolarHBondContact O-N 3.5Å; L50-Y53 PolarHBondContact O-N 2.8Å; L50-L54 WeakPolarHBondContact O-CG 3.29Å; L50-L54 PolarHBondContact O-N 3.19Å; L50-I63 HydrophobicContact CD1-CG2 3.67Å; L50-I67 HydrophobicContact CD1-CD1 3.92Å; L50-I67 HydrophobicContact CD2-CD1 3.7Å; L50-I67 HydrophobicContact CG-CD1 4.24Å
51A92.8Very high90.2Very high28 Ų2873.6 Ų73.623%0.23138%0.375CS..Hα-helixtrans-62-41.7176.800000112.1A47 T48 L54 V55 L120A47-A51 VanDerWaalsContact O-CB 3.26Å; A47-A51 WeakPolarHBondContact O-CB 3.39Å; A47-A51 PolarHBondContact O-N 2.92Å; T48-A51 PolarHBondContact O-N 3.45Å; A51-L54 PolarHBondContact O-N 3.42Å; A51-V55 WeakPolarHBondContact O-CG2 3.26Å; A51-V55 PolarHBondContact O-N 3.38Å; A51-L120 HydrophobicContact CB-CD1 3.7Å; A51-L120 HydrophobicContact CB-CD2 4.46Å
52A93Very high90.4Very high56 Ų5671.2 Ų71.246%0.46337%0.369SS..Hα-helixtrans-63.9-42.1174.800000111.8T48 C49 L50 L54 V55 V56T48-A52 WeakPolarHBondContact O-CB 3.45Å; T48-A52 PolarHBondContact O-N 3.15Å; C49-A52 PolarHBondContact O-N 3.2Å; L50-A52 VanDerWaalsContact C-N 3.34Å; L50-A52 PolarHBondContact O-N 3.5Å; A52-L54 VanDerWaalsContact C-N 3.34Å; A52-L54 PolarHBondContact O-N 2.83Å; A52-V55 PolarHBondContact O-N 3.16Å; A52-V55 VanDerWaalsContact O-N 3.15Å; A52-V56 PolarHBondContact O-N 3.45Å; A52-V56 VanDerWaalsContact O-N 3.1Å
53Y92.5Very high90.5Very high94 Ų9473.2 Ų73.237%0.36938%0.378SS..Hα-helixtrans-62.5-40176.1-175.7-92.2000112.1C49 L50 V55 V56 G57 I63C49-Y53 WeakPolarHBondContact O-CB 3.49Å; C49-Y53 PolarHBondContact O-N 3.01Å; L50-Y53 PolarHBondContact O-N 2.8Å; Y53-V55 PolarHBondContact O-N 3.08Å; Y53-V56 PolarHBondContact O-N 3.12Å; Y53-G57 VanDerWaalsContact O-CA 3.28Å; Y53-G57 WeakPolarHBondContact O-CA 3.26Å; Y53-G57 PolarHBondContact O-N 3.41Å; Y53-I63 HydrophobicContact CD1-CB 4.49Å; Y53-I63 HydrophobicContact CD1-CG1 4.17Å; Y53-I63 HydrophobicContact CE1-CB 4.23Å; Y53-I63 HydrophobicContact CE1-CG1 3.55Å
54L91.1Very high90.6Very high3 Ų370.9 Ų70.92%0.01637%0.368CS..Hα-helixtrans-64.7-19.2176.8-71.3177.2000113.6L50 A51 A52 G60 I63 C64 W119 L120 C123L50-L54 WeakPolarHBondContact O-CG 3.29Å; L50-L54 PolarHBondContact O-N 3.19Å; A51-L54 PolarHBondContact O-N 3.42Å; A52-L54 VanDerWaalsContact C-N 3.34Å; A52-L54 PolarHBondContact O-N 2.83Å; L54-G60 VanDerWaalsContact CD2-O 3.29Å; L54-G60 WeakPolarHBondContact CD2-O 3.42Å; L54-I63 HydrophobicContact CD2-CB 4.23Å; L54-I63 HydrophobicContact CD2-CG2 4.14Å; L54-C64 HydrophobicContact CD2-CB 3.92Å; L54-W119 HydrophobicContact CB-CB 4.48Å; L54-W119 WeakPolarHBondContact O-CB 3.19Å; L54-L120 HydrophobicContact CB-CB 4.38Å; L54-L120 HydrophobicContact CD1-CD1 4.38Å; L54-C123 HydrophobicContact CD1-CB 3.73Å
55V89.4Confident90.7Very high48 Ų4867.4 Ų67.429%0.29136%0.358SS..Hα-helixtrans-93.2-36178.6176.50000112.1A51 A52 Y53 L120A51-V55 WeakPolarHBondContact O-CG2 3.26Å; A51-V55 PolarHBondContact O-N 3.38Å; A52-V55 PolarHBondContact O-N 3.16Å; A52-V55 VanDerWaalsContact O-N 3.15Å; Y53-V55 PolarHBondContact O-N 3.08Å; V55-L120 HydrophobicContact CG2-CB 4.05Å; V55-L120 HydrophobicContact CG2-CD2 3.91Å
56V86.9Confident90.7Very high122 Ų12264 Ų6474%0.73935%0.351SS*.Hα-helixtrans-109.2-22.5-170.8-1760000113A52 Y53A52-V56 PolarHBondContact O-N 3.45Å; A52-V56 VanDerWaalsContact O-N 3.1Å; Y53-V56 PolarHBondContact O-N 3.12Å
57G86.4Confident90.7Very high14 Ų1460.4 Ų60.414%0.14434%0.337CS..  trans-77.2138.4-171.600000113.5Y53 Y59 G60Y53-G57 VanDerWaalsContact O-CA 3.28Å; Y53-G57 WeakPolarHBondContact O-CA 3.26Å; Y53-G57 PolarHBondContact O-N 3.41Å; G57-Y59 PolarHBondContact O-N 3.26Å; G57-G60 PolarHBondContact O-N 3Å
58D83.6Confident90.7Very high148 Ų14859.2 Ų59.279%0.79133%0.326SS*.THydrogen-bonded Turntrans-61.6-27178.9-59.5-42.4000113.2
59Y86.8Confident90.7Very high147 Ų14757.8 Ų57.858%0.57632%0.315SS*.THydrogen-bonded Turntrans-109.529-179.4-54.9-76.9000112.7G57 D61 L62 I63G57-Y59 PolarHBondContact O-N 3.26Å; Y59-D61 WeakPolarHBondContact CA-OD1 3.36Å; Y59-D61 PolarHBondContact O-N 3.47Å; Y59-L62 PolarHBondContact O-N 2.96Å; Y59-I63 PolarHBondContact O-N 3.5Å; Y59-I63 VanDerWaalsContact O-N 3.15Å
60G88Confident90.5Very high1 Ų159.8 Ų59.81%0.0133%0.325CS..Hα-helixtrans-57.5-31.6178.100000112.8L54 G57 C64L54-G60 VanDerWaalsContact CD2-O 3.29Å; L54-G60 WeakPolarHBondContact CD2-O 3.42Å; G57-G60 PolarHBondContact O-N 3Å; G60-C64 WeakPolarHBondContact O-CB 3.45Å; G60-C64 PolarHBondContact O-N 3.16Å
61D88.6Confident90.2Very high65 Ų6561.7 Ų61.735%0.34833%0.333SS..Hα-helixtrans-61.6-50.1174.869.5-43.6000112.5Y59 C64 N65 W119Y59-D61 WeakPolarHBondContact CA-OD1 3.36Å; Y59-D61 PolarHBondContact O-N 3.47Å; D61-C64 PolarHBondContact O-N 3.26Å; D61-N65 VanDerWaalsContact O-CB 3.3Å; D61-N65 WeakPolarHBondContact O-CB 3.41Å; D61-N65 PolarHBondContact O-N 3.33Å; D61-N65 PolarHBondContact O-ND2 3.41Å; D61-W119 HydrophobicContact CB-CD2 4.13Å; D61-W119 HydrophobicContact CB-CE3 4.18Å; D61-W119 HydrophobicContact CB-CH2 3.3Å; D61-W119 HydrophobicContact CB-CZ2 3.22Å; D61-W119 HydrophobicContact CB-CZ3 3.79Å
62L91.1Very high90.1Very high91 Ų9160.4 Ų60.448%0.47632%0.322SS..Hα-helixtrans-63.8-49.3-179.218065.6000110.4Y59 N65 L66Y59-L62 PolarHBondContact O-N 2.96Å; L62-N65 PolarHBondContact O-N 3.35Å; L62-L66 HydrophobicContact CD1-CD1 4.4Å; L62-L66 HydrophobicContact CD1-CG 4.48Å; L62-L66 HydrophobicContact CG-CD1 4.16Å; L62-L66 WeakPolarHBondContact O-CB 3.48Å; L62-L66 VanDerWaalsContact O-CG 3.27Å; L62-L66 WeakPolarHBondContact O-CG 3.33Å; L62-L66 PolarHBondContact O-N 3.35Å
63I92.7Very high90.1Very high52 Ų5260.4 Ų60.427%0.26732%0.316SS..Hα-helixtrans-64.2-44.1-179.9-62.3-55.1000110.9L50 Y53 L54 Y59 N65 L66 I67L50-I63 HydrophobicContact CD1-CG2 3.67Å; Y53-I63 HydrophobicContact CD1-CB 4.49Å; Y53-I63 HydrophobicContact CD1-CG1 4.17Å; Y53-I63 HydrophobicContact CE1-CB 4.23Å; Y53-I63 HydrophobicContact CE1-CG1 3.55Å; L54-I63 HydrophobicContact CD2-CB 4.23Å; L54-I63 HydrophobicContact CD2-CG2 4.14Å; Y59-I63 PolarHBondContact O-N 3.5Å; Y59-I63 VanDerWaalsContact O-N 3.15Å; I63-N65 PolarHBondContact O-N 3.04Å; I63-L66 HydrophobicContact CD1-CD1 4.46Å; I63-L66 PolarHBondContact O-N 2.89Å; I63-I67 HydrophobicContact CG2-CD1 3.9Å; I63-I67 WeakPolarHBondContact O-CD1 3.32Å; I63-I67 VanDerWaalsContact O-CG1 3.3Å; I63-I67 WeakPolarHBondContact O-CG1 3.47Å; I63-I67 PolarHBondContact O-N 3.39Å; I63-I67 VanDerWaalsContact O-N 3.08Å
64C92.4Very high90Very high0 Ų062.5 Ų62.50%032%0.324CS..Hα-helixtrans-58.1-48.6175.1-178.60000111.3L54 G60 D61 L66 I67 C68 W119L54-C64 HydrophobicContact CD2-CB 3.92Å; G60-C64 WeakPolarHBondContact O-CB 3.45Å; G60-C64 PolarHBondContact O-N 3.16Å; D61-C64 PolarHBondContact O-N 3.26Å; C64-L66 PolarHBondContact O-N 2.62Å; C64-I67 PolarHBondContact O-N 2.95Å; C64-C68 WeakPolarHBondContact O-CB 3.46Å; C64-C68 PolarHBondContact O-N 2.9Å; C64-C68 PolarHBondContact O-SG 3.47Å; C64-W119 HydrophobicContact CB-CE3 3.94Å
65N92.5Very high89.9Confident40 Ų4064.5 Ų64.521%0.21433%0.334CS..Hα-helixtrans-65.8-38.4-178.1-72.3-19.9000111.9D61 L62 I63 C68 I69 K122D61-N65 VanDerWaalsContact O-CB 3.3Å; D61-N65 WeakPolarHBondContact O-CB 3.41Å; D61-N65 PolarHBondContact O-N 3.33Å; D61-N65 PolarHBondContact O-ND2 3.41Å; L62-N65 PolarHBondContact O-N 3.35Å; I63-N65 PolarHBondContact O-N 3.04Å; N65-C68 PolarHBondContact O-N 3.25Å; N65-I69 WeakPolarHBondContact O-CB 3.46Å; N65-I69 WeakPolarHBondContact O-CD1 3.23Å; N65-I69 WeakPolarHBondContact O-CG1 3.45Å; N65-I69 PolarHBondContact O-N 3.27Å; N65-K122 PolarHBondContact OD1-NZ 3.47Å
66L93.1Very high90Very high89 Ų8963 Ų6347%0.46633%0.326SS..Hα-helixtrans-60-47.3174-74.1171.8000111.5L62 I63 C64 C68 I69 V70L62-L66 HydrophobicContact CD1-CD1 4.4Å; L62-L66 HydrophobicContact CD1-CG 4.48Å; L62-L66 HydrophobicContact CG-CD1 4.16Å; L62-L66 WeakPolarHBondContact O-CB 3.48Å; L62-L66 VanDerWaalsContact O-CG 3.27Å; L62-L66 WeakPolarHBondContact O-CG 3.33Å; L62-L66 PolarHBondContact O-N 3.35Å; I63-L66 HydrophobicContact CD1-CD1 4.46Å; I63-L66 PolarHBondContact O-N 2.89Å; C64-L66 PolarHBondContact O-N 2.62Å; L66-C68 VanDerWaalsContact C-N 3.31Å; L66-C68 PolarHBondContact O-N 2.83Å; L66-I69 PolarHBondContact O-N 2.85Å; L66-V70 VanDerWaalsContact O-CG2 3.23Å; L66-V70 WeakPolarHBondContact O-CG2 3.39Å; L66-V70 PolarHBondContact O-N 2.96Å
67I91.5Very high90.3Very high47 Ų4762.4 Ų62.424%0.24132%0.318CS..Hα-helixtrans-60.7-43.3177.7-66.5161.7000111L50 I63 C64 I69 L127L50-I67 HydrophobicContact CD1-CD1 3.92Å; L50-I67 HydrophobicContact CD2-CD1 3.7Å; L50-I67 HydrophobicContact CG-CD1 4.24Å; I63-I67 HydrophobicContact CG2-CD1 3.9Å; I63-I67 WeakPolarHBondContact O-CD1 3.32Å; I63-I67 VanDerWaalsContact O-CG1 3.3Å; I63-I67 WeakPolarHBondContact O-CG1 3.47Å; I63-I67 PolarHBondContact O-N 3.39Å; I63-I67 VanDerWaalsContact O-N 3.08Å; C64-I67 PolarHBondContact O-N 2.95Å; I67-I69 VanDerWaalsContact C-N 3.27Å; I67-I69 PolarHBondContact O-N 3.02Å; I67-L127 HydrophobicContact CG2-CD2 3.9Å; I67-L127 HydrophobicContact CG2-CG 4.41Å
68C91.6Very high90.5Very high3 Ų367.8 Ų67.82%0.0233%0.334CS..Hα-helixtrans-71.1-19.7-179.7-61.60000113.1C64 N65 L66 P72 Y94 F98 F126C64-C68 WeakPolarHBondContact O-CB 3.46Å; C64-C68 PolarHBondContact O-N 2.9Å; C64-C68 PolarHBondContact O-SG 3.47Å; N65-C68 PolarHBondContact O-N 3.25Å; L66-C68 VanDerWaalsContact C-N 3.31Å; L66-C68 PolarHBondContact O-N 2.83Å; C68-P72 WeakPolarHBondContact O-CD 3.27Å; C68-P72 VanDerWaalsContact O-CG 3.25Å; C68-P72 WeakPolarHBondContact O-CG 3.44Å; C68-Y94 PolarHBondContact O-OH 2.83Å; C68-F98 HydrophobicContact CB-CD2 4.31Å; C68-F98 HydrophobicContact CB-CE2 3.79Å; C68-F126 HydrophobicContact CB-CB 4.19Å; C68-F126 HydrophobicContact CB-CG 4.41Å; C68-F126 WeakPolarHBondContact SG-CB 3.43Å
69I93.1Very high90.8Very high63 Ų6360.9 Ų60.932%0.32330%0.297SS..Hα-helixtrans-97.4-44-176.8-71.9170000111.5N65 L66 I67 H71 P72 V73 W95 F98N65-I69 WeakPolarHBondContact O-CB 3.46Å; N65-I69 WeakPolarHBondContact O-CD1 3.23Å; N65-I69 WeakPolarHBondContact O-CG1 3.45Å; N65-I69 PolarHBondContact O-N 3.27Å; L66-I69 PolarHBondContact O-N 2.85Å; I67-I69 VanDerWaalsContact C-N 3.27Å; I67-I69 PolarHBondContact O-N 3.02Å; I69-H71 PolarHBondContact O-N 2.89Å; I69-P72 WeakPolarHBondContact O-CD 3.25Å; I69-V73 HydrophobicContact CG2-CG2 3.6Å; I69-V73 WeakPolarHBondContact O-CB 3.4Å; I69-V73 WeakPolarHBondContact O-CG2 3.41Å; I69-V73 PolarHBondContact O-N 3.34Å; I69-W95 HydrophobicContact CG1-CH2 4.3Å; I69-W95 HydrophobicContact CG1-CZ3 4.34Å; I69-W95 HydrophobicContact CG2-CH2 4.26Å; I69-F98 HydrophobicContact CD1-CE1 4.32Å; I69-F98 HydrophobicContact CD1-CZ 3.86Å; I69-F98 HydrophobicContact CG1-CE1 4.37Å; I69-F98 HydrophobicContact CG1-CE2 4.23Å; I69-F98 HydrophobicContact CG1-CZ 3.82Å
70V90.8Very high91.1Very high100 Ų10059 Ų5961%0.60630%0.296SS*.Hα-helixtrans-59-53.8-166.5169.50000112.7L66 Y74L66-V70 VanDerWaalsContact O-CG2 3.23Å; L66-V70 WeakPolarHBondContact O-CG2 3.39Å; L66-V70 PolarHBondContact O-N 2.96Å; V70-Y74 PolarHBondContact O-N 2.92Å
71H87.4Confident91.4Very high85 Ų8566.2 Ų66.239%0.39433%0.329SS..Hα-helixtrans-67.7-49-178.1171.1-89.5000112.4I69 V73 Y74 M75 W91I69-H71 PolarHBondContact O-N 2.89Å; H71-V73 VanDerWaalsContact C-N 3.33Å; H71-V73 PolarHBondContact O-N 2.75Å; H71-Y74 PolarHBondContact O-N 3.27Å; H71-M75 WeakPolarHBondContact O-CG 3.43Å; H71-M75 PolarHBondContact O-N 3.3Å; H71-W91 AromaticContact CE1-CH2 3.82Å
72P90.4Very high91.6Very high1 Ų168.2 Ų68.21%0.00634%0.338CS..Hα-helixtrans-62-34177.4-28.840.3000114.3C68 I69 S76 W91 Y94 W95C68-P72 WeakPolarHBondContact O-CD 3.27Å; C68-P72 VanDerWaalsContact O-CG 3.25Å; C68-P72 WeakPolarHBondContact O-CG 3.44Å; I69-P72 WeakPolarHBondContact O-CD 3.25Å; P72-S76 VanDerWaalsContact O-CB 3.26Å; P72-S76 WeakPolarHBondContact O-CB 3.35Å; P72-S76 PolarHBondContact O-N 2.94Å; P72-S76 PolarHBondContact O-OG 3.48Å; P72-W91 HydrophobicContact CB-CE3 3.86Å; P72-W91 HydrophobicContact CB-CZ3 3.79Å; P72-W91 HydrophobicContact CG-CZ3 4.04Å; P72-Y94 HydrophobicContact CB-CD1 3.84Å; P72-Y94 HydrophobicContact CB-CE1 3.57Å; P72-Y94 HydrophobicContact CG-CD1 4.17Å; P72-Y94 HydrophobicContact CG-CE1 3.51Å; P72-Y94 HydrophobicContact CG-CE2 4.01Å; P72-Y94 VanDerWaalsContact CG-CZ 3.42Å; P72-W95 HydrophobicContact CB-CZ2 4.1Å
73V93Very high91.6Very high56 Ų5674.1 Ų74.134%0.33935%0.354SS..Hα-helixtrans-61.8-50173.6167.40000110.4I69 H71 M75 S76 L77 W95I69-V73 HydrophobicContact CG2-CG2 3.6Å; I69-V73 WeakPolarHBondContact O-CB 3.4Å; I69-V73 WeakPolarHBondContact O-CG2 3.41Å; I69-V73 PolarHBondContact O-N 3.34Å; H71-V73 VanDerWaalsContact C-N 3.33Å; H71-V73 PolarHBondContact O-N 2.75Å; V73-M75 VanDerWaalsContact C-N 3.34Å; V73-M75 PolarHBondContact O-N 3.22Å; V73-S76 PolarHBondContact O-N 2.97Å; V73-L77 HydrophobicContact CG1-CD1 4.01Å; V73-L77 HydrophobicContact CG1-CG 4.49Å; V73-L77 WeakPolarHBondContact O-CG 3.37Å; V73-L77 PolarHBondContact O-N 2.85Å; V73-W95 HydrophobicContact CB-CZ2 4.41Å; V73-W95 HydrophobicContact CG2-CH2 3.58Å; V73-W95 HydrophobicContact CG2-CZ2 3.5Å
74Y90.8Very high91.3Very high138 Ų13874.8 Ų74.854%0.54136%0.358SS..Hα-helixtrans-56.8-49178.2175.8-97.2000111.5V70 H71 S76 L77 W78V70-Y74 PolarHBondContact O-N 2.92Å; H71-Y74 PolarHBondContact O-N 3.27Å; Y74-S76 PolarHBondContact O-N 3.41Å; Y74-L77 PolarHBondContact O-N 3.21Å; Y74-W78 WeakPolarHBondContact O-CB 3.42Å; Y74-W78 PolarHBondContact O-N 2.86Å
75M88.9Confident91Very high45 Ų4580.9 Ų80.922%0.22239%0.39CS..Hα-helixtrans-67.3-35.3-179.9-67-60-64.900113.1H71 V73 W78 A79 W91H71-M75 WeakPolarHBondContact O-CG 3.43Å; H71-M75 PolarHBondContact O-N 3.3Å; V73-M75 VanDerWaalsContact C-N 3.34Å; V73-M75 PolarHBondContact O-N 3.22Å; M75-W78 PolarHBondContact O-N 3.11Å; M75-A79 WeakPolarHBondContact O-CB 3.26Å; M75-A79 PolarHBondContact O-N 3.07Å; M75-W91 HydrophobicContact CB-CD2 3.89Å; M75-W91 HydrophobicContact CB-CE3 4.29Å; M75-W91 HydrophobicContact CB-CH2 3.71Å; M75-W91 HydrophobicContact CB-CZ2 3.24Å; M75-W91 HydrophobicContact CB-CZ3 4.21Å; M75-W91 HydrophobicContact CE-CZ2 3.97Å; M75-W91 HydrophobicContact CG-CH2 3.85Å; M75-W91 HydrophobicContact CG-CZ2 3.59Å
76S91.2Very high90.7Very high16 Ų1684.8 Ų84.811%0.11241%0.407CS..Hα-helixtrans-62.9-45.3174.3-57.60000111.1P72 V73 Y74 W78 A79 I80 W91 W95P72-S76 VanDerWaalsContact O-CB 3.26Å; P72-S76 WeakPolarHBondContact O-CB 3.35Å; P72-S76 PolarHBondContact O-N 2.94Å; P72-S76 PolarHBondContact O-OG 3.48Å; V73-S76 PolarHBondContact O-N 2.97Å; Y74-S76 PolarHBondContact O-N 3.41Å; S76-W78 VanDerWaalsContact C-N 3.33Å; S76-A79 PolarHBondContact O-N 3.17Å; S76-I80 WeakPolarHBondContact O-CD1 3.37Å; S76-I80 VanDerWaalsContact O-CG1 3.24Å; S76-I80 WeakPolarHBondContact O-CG1 3.25Å; S76-I80 PolarHBondContact O-N 2.88Å; S76-W91 WeakPolarHBondContact OG-CB 3.49Å; S76-W95 PolarHBondContact OG-NE1 3.35Å
77L92.7Very high90.3Very high109 Ų10982.7 Ų82.757%0.57140%0.395SS*.Hα-helixtrans-64.2-41.3177.8-69.3172.9000111.3V73 Y74 I80 E81V73-L77 HydrophobicContact CG1-CD1 4.01Å; V73-L77 HydrophobicContact CG1-CG 4.49Å; V73-L77 WeakPolarHBondContact O-CG 3.37Å; V73-L77 PolarHBondContact O-N 2.85Å; Y74-L77 PolarHBondContact O-N 3.21Å; L77-I80 PolarHBondContact O-N 3Å; L77-E81 PolarHBondContact O-N 3.33Å
78W90.2Very high90.2Very high128 Ų12882.5 Ų82.549%0.48540%0.395SS..Hα-helixtrans-61.6-45.2175-172.9-87.4000112.3Y74 M75 S76 I80 E81 M82Y74-W78 WeakPolarHBondContact O-CB 3.42Å; Y74-W78 PolarHBondContact O-N 2.86Å; M75-W78 PolarHBondContact O-N 3.11Å; S76-W78 VanDerWaalsContact C-N 3.33Å; W78-I80 VanDerWaalsContact C-N 3.3Å; W78-I80 PolarHBondContact O-N 2.96Å; W78-E81 PolarHBondContact O-N 2.88Å; W78-M82 HydrophobicContact CD2-CE 4.24Å; W78-M82 HydrophobicContact CG-CG 4.43Å; W78-M82 HydrophobicContact CH2-CE 3.71Å; W78-M82 HydrophobicContact CZ2-CE 3.27Å; W78-M82 HydrophobicContact CZ3-CE 4.34Å; W78-M82 WeakPolarHBondContact O-CB 3.32Å; W78-M82 WeakPolarHBondContact O-CG 3.47Å; W78-M82 PolarHBondContact O-N 3.16Å
79A90.4Very high90Very high3 Ų385.8 Ų85.83%0.02542%0.415CS..Hα-helixtrans-63.3-34.817800000112.8M75 S76 R83 D84 E87 N88M75-A79 WeakPolarHBondContact O-CB 3.26Å; M75-A79 PolarHBondContact O-N 3.07Å; S76-A79 PolarHBondContact O-N 3.17Å; A79-R83 PolarHBondContact O-N 3.12Å; A79-R83 VanDerWaalsContact O-N 3.1Å; A79-D84 PolarHBondContact O-N 3.38Å; A79-D84 VanDerWaalsContact O-N 3.1Å; A79-E87 HydrophobicContact CB-CB 3.68Å; A79-N88 VanDerWaalsContact C-OD1 3.25Å; A79-N88 VanDerWaalsContact CB-OD1 3.26Å; A79-N88 WeakPolarHBondContact CB-OD1 3.42Å; A79-N88 PolarHBondContact O-ND2 3.43Å; A79-N88 PolarHBondContact O-OD1 2.78Å
80I92.3Very high89.7Confident106 Ų10683 Ų8354%0.54440%0.4SS..Hα-helixtrans-66.2-48173.7-68.7164000110.5S76 L77 W78 R83 N88S76-I80 WeakPolarHBondContact O-CD1 3.37Å; S76-I80 VanDerWaalsContact O-CG1 3.24Å; S76-I80 WeakPolarHBondContact O-CG1 3.25Å; S76-I80 PolarHBondContact O-N 2.88Å; L77-I80 PolarHBondContact O-N 3Å; W78-I80 VanDerWaalsContact C-N 3.3Å; W78-I80 PolarHBondContact O-N 2.96Å; I80-R83 PolarHBondContact O-N 3.32Å; I80-N88 PolarHBondContact N-OD1 3.4Å
81E94.4Very high89.7Confident153 Ų15378.3 Ų78.372%0.71537%0.372SS*.Hα-helixtrans-65.1-41.6-178.8-169.561.6-149.700111.8L77 W78 R83L77-E81 PolarHBondContact O-N 3.33Å; W78-E81 PolarHBondContact O-N 2.88Å; E81-R83 PolarHBondContact O-N 3.25Å
82M92.4Very high89.8Confident107 Ų10780 Ų8053%0.52738%0.383SS..THydrogen-bonded Turntrans-76.6-7.8177.6-64.8-58.517300113.6W78 D84W78-M82 HydrophobicContact CD2-CE 4.24Å; W78-M82 HydrophobicContact CG-CG 4.43Å; W78-M82 HydrophobicContact CH2-CE 3.71Å; W78-M82 HydrophobicContact CZ2-CE 3.27Å; W78-M82 HydrophobicContact CZ3-CE 4.34Å; W78-M82 WeakPolarHBondContact O-CB 3.32Å; W78-M82 WeakPolarHBondContact O-CG 3.47Å; W78-M82 PolarHBondContact O-N 3.16Å; M82-D84 PolarHBondContact O-N 3.45Å
83R90.8Very high89.7Confident215 Ų21580.3 Ų80.381%0.81139%0.385SS*.THydrogen-bonded Turntrans53.340.5-176.6-54.6178.166.4-165.30.3112.5A79 I80 E81 D85A79-R83 PolarHBondContact O-N 3.12Å; A79-R83 VanDerWaalsContact O-N 3.1Å; I80-R83 PolarHBondContact O-N 3.32Å; E81-R83 PolarHBondContact O-N 3.25Å; R83-D85 PolarHBondContact O-N 3.02Å
84D87.2Confident89.6Confident66 Ų6677.7 Ų77.735%0.35337%0.369SS..  trans-89.9102.5178.3-172.9-30.8000109.9A79 M82 E86 E87 N88A79-D84 PolarHBondContact O-N 3.38Å; A79-D84 VanDerWaalsContact O-N 3.1Å; M82-D84 PolarHBondContact O-N 3.45Å; D84-E86 VanDerWaalsContact C-N 3.29Å; D84-E86 PolarHBondContact O-N 2.99Å; D84-E86 WeakPolarHBondContact OD1-CB 3.45Å; D84-E86 PolarHBondContact OD1-N 2.7Å; D84-E87 HydrophobicContact CB-CB 4.05Å; D84-E87 HydrophobicContact CB-CG 4.35Å; D84-E87 PolarHBondContact O-N 2.91Å; D84-E87 PolarHBondContact OD1-N 2.89Å; D84-E87 VanDerWaalsContact OD1-N 3.07Å; D84-N88 VanDerWaalsContact O-CB 3.26Å; D84-N88 WeakPolarHBondContact O-CB 3.32Å; D84-N88 PolarHBondContact O-N 3.22Å; D84-N88 PolarHBondContact O-ND2 3.24Å
85D86.6Confident89.7Confident128 Ų12874.5 Ų74.568%0.68436%0.356SS*.Hα-helixtrans-64.1-30.8-178-71.1-23.3000113.2R83 T89R83-D85 PolarHBondContact O-N 3.02Å; D85-T89 WeakPolarHBondContact O-CB 3.19Å; D85-T89 PolarHBondContact O-N 3.31Å; D85-T89 PolarHBondContact O-OG1 3.08Å
86E85.7Confident89.8Confident122 Ų12275.5 Ų75.557%0.5736%0.364SS*.Hα-helixtrans-70.8-49179.1-69.6-163.8-169.400110.7D84 T89 Q90 K135D84-E86 VanDerWaalsContact C-N 3.29Å; D84-E86 PolarHBondContact O-N 2.99Å; D84-E86 WeakPolarHBondContact OD1-CB 3.45Å; D84-E86 PolarHBondContact OD1-N 2.7Å; E86-T89 PolarHBondContact O-N 2.84Å; E86-Q90 PolarHBondContact O-N 2.79Å; E86-Q90 VanDerWaalsContact O-N 3.09Å; E86-K135 IonicContact OE2-NZ 2.72Å; E86-K135 PolarHBondContact OE2-NZ 3.36Å
87E85.6Confident89.7Confident46 Ų4675.1 Ų75.122%0.21536%0.361CS..Hα-helixtrans-63.4-43.4176.3-73.9-64.9142.700110.7A79 D84 T89 Q90 W91A79-E87 HydrophobicContact CB-CB 3.68Å; D84-E87 HydrophobicContact CB-CB 4.05Å; D84-E87 HydrophobicContact CB-CG 4.35Å; D84-E87 PolarHBondContact O-N 2.91Å; D84-E87 PolarHBondContact OD1-N 2.89Å; D84-E87 VanDerWaalsContact OD1-N 3.07Å; E87-T89 VanDerWaalsContact C-N 3.25Å; E87-T89 PolarHBondContact O-N 3.16Å; E87-Q90 WeakPolarHBondContact O-CB 3.35Å; E87-Q90 PolarHBondContact O-N 3.41Å; E87-Q90 VanDerWaalsContact O-N 3.09Å; E87-W91 PolarHBondContact O-N 3.38Å; E87-W91 PolarHBondContact OE2-NE1 3Å
88N88Confident89.7Confident43 Ų4371 Ų7123%0.2334%0.339CS..Hα-helixtrans-55.6-41.3175-77.6-36.8000112.1A79 I80 D84 L92A79-N88 VanDerWaalsContact C-OD1 3.25Å; A79-N88 VanDerWaalsContact CB-OD1 3.26Å; A79-N88 WeakPolarHBondContact CB-OD1 3.42Å; A79-N88 PolarHBondContact O-ND2 3.43Å; A79-N88 PolarHBondContact O-OD1 2.78Å; I80-N88 PolarHBondContact N-OD1 3.4Å; D84-N88 VanDerWaalsContact O-CB 3.26Å; D84-N88 WeakPolarHBondContact O-CB 3.32Å; D84-N88 PolarHBondContact O-N 3.22Å; D84-N88 PolarHBondContact O-ND2 3.24Å; N88-L92 VanDerWaalsContact O-CB 3.22Å; N88-L92 WeakPolarHBondContact O-CB 3.31Å; N88-L92 PolarHBondContact O-N 3.42Å
89T87.1Confident89.8Confident72 Ų7267.6 Ų67.644%0.44234%0.338SS..Hα-helixtrans-67.1-40.9177.7-56.40000111.9D85 E86 E87 T93 L138D85-T89 WeakPolarHBondContact O-CB 3.19Å; D85-T89 PolarHBondContact O-N 3.31Å; D85-T89 PolarHBondContact O-OG1 3.08Å; E86-T89 PolarHBondContact O-N 2.84Å; E87-T89 VanDerWaalsContact C-N 3.25Å; E87-T89 PolarHBondContact O-N 3.16Å; T89-T93 VanDerWaalsContact O-CB 3.26Å; T89-T93 WeakPolarHBondContact O-CB 3.27Å; T89-T93 PolarHBondContact O-N 3.3Å; T89-T93 PolarHBondContact O-OG1 2.88Å; T89-L138 HydrophobicContact CG2-CD2 3.87Å
90Q87.3Confident89.8Confident3 Ų371.6 Ų71.61%0.01436%0.358CS..Hα-helixtrans-61.3-49.1176.7170.269.613.300111.2E86 E87 T93 Y94 L129 L138E86-Q90 PolarHBondContact O-N 2.79Å; E86-Q90 VanDerWaalsContact O-N 3.09Å; E87-Q90 WeakPolarHBondContact O-CB 3.35Å; E87-Q90 PolarHBondContact O-N 3.41Å; E87-Q90 VanDerWaalsContact O-N 3.09Å; Q90-T93 WeakPolarHBondContact O-CB 3.28Å; Q90-T93 PolarHBondContact O-N 3.39Å; Q90-Y94 PolarHBondContact O-N 3.31Å; Q90-L129 PolarHBondContact NE2-O 2.98Å; Q90-L138 HydrophobicContact CB-CD1 4.28Å
91W90.5Very high89.6Confident3 Ų369.4 Ų69.41%0.01135%0.345CS..Hα-helixtrans-71.4-38.8-178.7-62.5114000112.5H71 P72 M75 S76 E87 T93 Y94 W95H71-W91 AromaticContact CE1-CH2 3.82Å; P72-W91 HydrophobicContact CB-CE3 3.86Å; P72-W91 HydrophobicContact CB-CZ3 3.79Å; P72-W91 HydrophobicContact CG-CZ3 4.04Å; M75-W91 HydrophobicContact CB-CD2 3.89Å; M75-W91 HydrophobicContact CB-CE3 4.29Å; M75-W91 HydrophobicContact CB-CH2 3.71Å; M75-W91 HydrophobicContact CB-CZ2 3.24Å; M75-W91 HydrophobicContact CB-CZ3 4.21Å; M75-W91 HydrophobicContact CE-CZ2 3.97Å; M75-W91 HydrophobicContact CG-CH2 3.85Å; M75-W91 HydrophobicContact CG-CZ2 3.59Å; S76-W91 WeakPolarHBondContact OG-CB 3.49Å; E87-W91 PolarHBondContact O-N 3.38Å; E87-W91 PolarHBondContact OE2-NE1 3Å; W91-T93 VanDerWaalsContact C-N 3.28Å; W91-T93 PolarHBondContact O-N 2.9Å; W91-Y94 VanDerWaalsContact O-CB 3.29Å; W91-Y94 WeakPolarHBondContact O-CB 3.39Å; W91-Y94 PolarHBondContact O-N 3.47Å; W91-Y94 VanDerWaalsContact O-N 3.16Å; W91-W95 PolarHBondContact O-N 3.25Å
92L90Very high89.3Confident119 Ų11963.9 Ų63.962%0.62332%0.323SS*.Hα-helixtrans-61.3-41173.4-173.765.7000111.3N88 Y94 W95 V96N88-L92 VanDerWaalsContact O-CB 3.22Å; N88-L92 WeakPolarHBondContact O-CB 3.31Å; N88-L92 PolarHBondContact O-N 3.42Å; L92-Y94 VanDerWaalsContact C-N 3.34Å; L92-Y94 PolarHBondContact O-N 3.47Å; L92-W95 PolarHBondContact O-N 2.93Å; L92-V96 WeakPolarHBondContact O-CG2 3.33Å; L92-V96 PolarHBondContact O-N 3.46Å
93T88.7Confident89.1Confident9 Ų964.3 Ų64.36%0.05533%0.326CS..Hα-helixtrans-62.8-41.6175-61.10000111.9T89 Q90 W91 W95 V96 I97 A137 Y141T89-T93 VanDerWaalsContact O-CB 3.26Å; T89-T93 WeakPolarHBondContact O-CB 3.27Å; T89-T93 PolarHBondContact O-N 3.3Å; T89-T93 PolarHBondContact O-OG1 2.88Å; Q90-T93 WeakPolarHBondContact O-CB 3.28Å; Q90-T93 PolarHBondContact O-N 3.39Å; W91-T93 VanDerWaalsContact C-N 3.28Å; W91-T93 PolarHBondContact O-N 2.9Å; T93-W95 VanDerWaalsContact C-N 3.32Å; T93-W95 PolarHBondContact O-N 3.32Å; T93-V96 PolarHBondContact O-N 3.47Å; T93-I97 HydrophobicContact CG2-CD1 4.26Å; T93-I97 WeakPolarHBondContact O-CG1 3.4Å; T93-I97 PolarHBondContact O-N 2.92Å; T93-I97 VanDerWaalsContact O-N 3.08Å; T93-A137 HydrophobicContact CG2-CB 3.85Å; T93-A137 WeakPolarHBondContact CG2-O 3.26Å; T93-Y141 VanDerWaalsContact CG2-CB 3.44Å; T93-Y141 HydrophobicContact CG2-CD2 4.2Å; T93-Y141 HydrophobicContact CG2-CG 4.14Å
94Y91.2Very high88.9Confident1 Ų157 Ų570%0.00431%0.306CS..Hα-helixtrans-55.8-48.6173.5177.6-82.2000110.9C68 P72 Q90 W91 L92 V96 I97 F98 F126 L129C68-Y94 PolarHBondContact O-OH 2.83Å; P72-Y94 HydrophobicContact CB-CD1 3.84Å; P72-Y94 HydrophobicContact CB-CE1 3.57Å; P72-Y94 HydrophobicContact CG-CD1 4.17Å; P72-Y94 HydrophobicContact CG-CE1 3.51Å; P72-Y94 HydrophobicContact CG-CE2 4.01Å; P72-Y94 VanDerWaalsContact CG-CZ 3.42Å; Q90-Y94 PolarHBondContact O-N 3.31Å; W91-Y94 VanDerWaalsContact O-CB 3.29Å; W91-Y94 WeakPolarHBondContact O-CB 3.39Å; W91-Y94 PolarHBondContact O-N 3.47Å; W91-Y94 VanDerWaalsContact O-N 3.16Å; L92-Y94 VanDerWaalsContact C-N 3.34Å; L92-Y94 PolarHBondContact O-N 3.47Å; Y94-V96 VanDerWaalsContact C-N 3.33Å; Y94-V96 PolarHBondContact O-N 3.07Å; Y94-I97 PolarHBondContact O-N 3.2Å; Y94-I97 VanDerWaalsContact O-N 3.16Å; Y94-F98 HydrophobicContact CE1-CB 4.43Å; Y94-F98 WeakPolarHBondContact O-CB 3.34Å; Y94-F98 PolarHBondContact O-N 3.4Å; Y94-F126 HydrophobicContact CE1-CD1 4.25Å; Y94-F126 AromaticContact CE2-CD1 3.72Å; Y94-F126 HydrophobicContact CE2-CD1 3.72Å; Y94-F126 HydrophobicContact CE2-CE1 4.49Å; Y94-F126 AromaticContact CZ-CD1 3.5Å; Y94-F126 VanDerWaalsContact CZ-CD1 3.5Å; Y94-F126 VanDerWaalsContact OH-CD1 3.26Å; Y94-F126 WeakPolarHBondContact OH-CD1 3.3Å; Y94-L129 HydrophobicContact CD2-CB 3.83Å; Y94-L129 HydrophobicContact CE2-CB 3.9Å
95W93.4Very high88.9Confident71 Ų7154.9 Ų54.927%0.26929%0.294SS..Hα-helixtrans-63.5-35.4178.7-71.3116.9000113.3I69 P72 V73 S76 W91 L92 T93 F98 A99I69-W95 HydrophobicContact CG1-CH2 4.3Å; I69-W95 HydrophobicContact CG1-CZ3 4.34Å; I69-W95 HydrophobicContact CG2-CH2 4.26Å; P72-W95 HydrophobicContact CB-CZ2 4.1Å; V73-W95 HydrophobicContact CB-CZ2 4.41Å; V73-W95 HydrophobicContact CG2-CH2 3.58Å; V73-W95 HydrophobicContact CG2-CZ2 3.5Å; S76-W95 PolarHBondContact OG-NE1 3.35Å; W91-W95 PolarHBondContact O-N 3.25Å; L92-W95 PolarHBondContact O-N 2.93Å; T93-W95 VanDerWaalsContact C-N 3.32Å; T93-W95 PolarHBondContact O-N 3.32Å; W95-F98 HydrophobicContact CE3-CB 4.28Å; W95-F98 HydrophobicContact CE3-CD1 4.16Å; W95-F98 HydrophobicContact CE3-CG 4.32Å; W95-F98 HydrophobicContact CZ3-CD1 4.1Å; W95-F98 HydrophobicContact CZ3-CE1 4.47Å; W95-F98 HydrophobicContact CZ3-CG 4.35Å; W95-F98 PolarHBondContact O-N 3.26Å; W95-A99 WeakPolarHBondContact O-CB 3.41Å; W95-A99 PolarHBondContact O-N 2.79Å
96V90.2Very high88.8Confident65 Ų6558.9 Ų58.939%0.39430%0.301SS..Hα-helixtrans-62.6-44.9173172.30000111L92 T93 Y94 A99 L100 L145L92-V96 WeakPolarHBondContact O-CG2 3.33Å; L92-V96 PolarHBondContact O-N 3.46Å; T93-V96 PolarHBondContact O-N 3.47Å; Y94-V96 VanDerWaalsContact C-N 3.33Å; Y94-V96 PolarHBondContact O-N 3.07Å; V96-A99 PolarHBondContact O-N 3.03Å; V96-L100 HydrophobicContact CG1-CD1 4.49Å; V96-L100 WeakPolarHBondContact O-CG 3.34Å; V96-L100 PolarHBondContact O-N 3.19Å; V96-L100 VanDerWaalsContact O-N 3.12Å; V96-L145 HydrophobicContact CG1-CD1 3.76Å
97I89.9Confident88.6Confident9 Ų955.5 Ų55.55%0.04629%0.294CS..Hα-helixtrans-65.2-43.8176.7-62.5164.8000110T93 Y94 A99 L100 F101 F126 L129 A137 V140 L145T93-I97 HydrophobicContact CG2-CD1 4.26Å; T93-I97 WeakPolarHBondContact O-CG1 3.4Å; T93-I97 PolarHBondContact O-N 2.92Å; T93-I97 VanDerWaalsContact O-N 3.08Å; Y94-I97 PolarHBondContact O-N 3.2Å; Y94-I97 VanDerWaalsContact O-N 3.16Å; I97-A99 VanDerWaalsContact C-N 3.35Å; I97-A99 PolarHBondContact O-N 3.43Å; I97-L100 PolarHBondContact O-N 3.15Å; I97-F101 HydrophobicContact CG2-CD2 3.81Å; I97-F101 HydrophobicContact CG2-CE2 3.88Å; I97-F101 WeakPolarHBondContact O-CD2 3.25Å; I97-F101 PolarHBondContact O-N 2.98Å; I97-F126 HydrophobicContact CG2-CE1 4.29Å; I97-F126 HydrophobicContact CG2-CZ 4.17Å; I97-L129 HydrophobicContact CB-CD1 4.49Å; I97-L129 HydrophobicContact CD1-CD1 4.3Å; I97-L129 HydrophobicContact CD1-CD2 4.11Å; I97-L129 HydrophobicContact CG2-CD1 3.78Å; I97-A137 HydrophobicContact CD1-CB 4.35Å; I97-V140 HydrophobicContact CD1-CB 3.81Å; I97-V140 HydrophobicContact CD1-CG1 3.59Å; I97-V140 HydrophobicContact CG1-CG1 4.23Å; I97-L145 HydrophobicContact CG1-CD1 4.31Å
98F92.1Very high88.4Confident23 Ų2354.2 Ų54.210%0.10129%0.29CS..Hα-helixtrans-55-49.4176.1-171.5-92.8000111.6C68 I69 Y94 W95 L100 F101 S102 F126C68-F98 HydrophobicContact CB-CD2 4.31Å; C68-F98 HydrophobicContact CB-CE2 3.79Å; I69-F98 HydrophobicContact CD1-CE1 4.32Å; I69-F98 HydrophobicContact CD1-CZ 3.86Å; I69-F98 HydrophobicContact CG1-CE1 4.37Å; I69-F98 HydrophobicContact CG1-CE2 4.23Å; I69-F98 HydrophobicContact CG1-CZ 3.82Å; Y94-F98 HydrophobicContact CE1-CB 4.43Å; Y94-F98 WeakPolarHBondContact O-CB 3.34Å; Y94-F98 PolarHBondContact O-N 3.4Å; W95-F98 HydrophobicContact CE3-CB 4.28Å; W95-F98 HydrophobicContact CE3-CD1 4.16Å; W95-F98 HydrophobicContact CE3-CG 4.32Å; W95-F98 HydrophobicContact CZ3-CD1 4.1Å; W95-F98 HydrophobicContact CZ3-CE1 4.47Å; W95-F98 HydrophobicContact CZ3-CG 4.35Å; W95-F98 PolarHBondContact O-N 3.26Å; F98-L100 VanDerWaalsContact C-N 3.34Å; F98-L100 PolarHBondContact O-N 2.71Å; F98-F101 PolarHBondContact O-N 2.97Å; F98-F101 VanDerWaalsContact O-N 3.16Å; F98-S102 PolarHBondContact O-N 3.38Å; F98-S102 PolarHBondContact O-OG 2.95Å; F98-F126 HydrophobicContact CB-CE1 3.74Å; F98-F126 HydrophobicContact CB-CZ 4.24Å; F98-F126 HydrophobicContact CD2-CD1 4.06Å; F98-F126 AromaticContact CD2-CE1 3.63Å; F98-F126 HydrophobicContact CD2-CE1 3.63Å; F98-F126 HydrophobicContact CD2-CZ 4.01Å; F98-F126 HydrophobicContact CG-CE1 4.16Å
99A91.9Very high87.9Confident55 Ų5560.5 Ų60.546%0.45532%0.318SS..Hα-helixtrans-61.9-37.3178.300000113.3W95 V96 I97 S102 I103W95-A99 WeakPolarHBondContact O-CB 3.41Å; W95-A99 PolarHBondContact O-N 2.79Å; V96-A99 PolarHBondContact O-N 3.03Å; I97-A99 VanDerWaalsContact C-N 3.35Å; I97-A99 PolarHBondContact O-N 3.43Å; A99-S102 WeakPolarHBondContact O-CB 3.31Å; A99-S102 PolarHBondContact O-N 3.45Å; A99-I103 PolarHBondContact O-N 3.48Å
100L89.8Confident87.5Confident87 Ų8759.9 Ų59.946%0.45532%0.32SS..Hα-helixtrans-65.2-41.8174.4-70.9172.1000111.8V96 I97 F98 S102 I103 L145V96-L100 HydrophobicContact CG1-CD1 4.49Å; V96-L100 WeakPolarHBondContact O-CG 3.34Å; V96-L100 PolarHBondContact O-N 3.19Å; V96-L100 VanDerWaalsContact O-N 3.12Å; I97-L100 PolarHBondContact O-N 3.15Å; F98-L100 VanDerWaalsContact C-N 3.34Å; F98-L100 PolarHBondContact O-N 2.71Å; L100-S102 VanDerWaalsContact C-N 3.31Å; L100-I103 WeakPolarHBondContact O-CB 3.5Å; L100-I103 PolarHBondContact O-N 3.42Å; L100-L145 HydrophobicContact CD1-CD2 3.85Å
101F89.5Confident87.1Confident60 Ų6062.1 Ų62.126%0.26333%0.332SS..Hα-helixtrans-68.1-30.7174.8-87.9-95.2000112.4I97 F98 I103 V104 D105 L125 F126I97-F101 HydrophobicContact CG2-CD2 3.81Å; I97-F101 HydrophobicContact CG2-CE2 3.88Å; I97-F101 WeakPolarHBondContact O-CD2 3.25Å; I97-F101 PolarHBondContact O-N 2.98Å; F98-F101 PolarHBondContact O-N 2.97Å; F98-F101 VanDerWaalsContact O-N 3.16Å; F101-I103 PolarHBondContact O-N 2.68Å; F101-V104 CarbonylContact O-C 3.53Å; F101-V104 WeakPolarHBondContact O-CA 2.96Å; F101-V104 WeakPolarHBondContact O-CB 3.39Å; F101-V104 PolarHBondContact O-N 2.78Å; F101-D105 VanDerWaalsContact O-CG 3.22Å; F101-D105 PolarHBondContact O-N 3.31Å; F101-L125 HydrophobicContact CE1-CD2 3.95Å; F101-L125 HydrophobicContact CE2-CD2 4Å; F101-L125 HydrophobicContact CZ-CD2 3.39Å; F101-F126 HydrophobicContact CB-CE2 3.9Å; F101-F126 HydrophobicContact CB-CZ 3.81Å; F101-F126 HydrophobicContact CD1-CE2 4.1Å; F101-F126 AromaticContact CD2-CE2 3.99Å; F101-F126 HydrophobicContact CD2-CE2 3.99Å; F101-F126 AromaticContact CD2-CZ 3.81Å; F101-F126 HydrophobicContact CD2-CZ 3.81Å; F101-F126 AromaticContact CG-CE2 3.72Å; F101-F126 HydrophobicContact CG-CE2 3.72Å; F101-F126 AromaticContact CG-CZ 3.84Å; F101-F126 HydrophobicContact CG-CZ 3.84Å
102S88.3Confident86.5Confident37 Ų3765.3 Ų65.326%0.25935%0.348SS..Hα-helixtrans-59.3-30.1172.7-55.20000112.8F98 A99 L100 D105 Y106F98-S102 PolarHBondContact O-N 3.38Å; F98-S102 PolarHBondContact O-OG 2.95Å; A99-S102 WeakPolarHBondContact O-CB 3.31Å; A99-S102 PolarHBondContact O-N 3.45Å; L100-S102 VanDerWaalsContact C-N 3.31Å; S102-D105 WeakPolarHBondContact CA-OD2 3.48Å; S102-D105 PolarHBondContact O-N 3.3Å; S102-Y106 WeakPolarHBondContact O-CD2 3.34Å; S102-Y106 PolarHBondContact O-N 2.87Å
103I88Confident85.9Confident117 Ų11763 Ų6360%0.635%0.352SS*.Hα-helixtrans-67.8-40.8172.7-59.2170.9000110.6A99 L100 F101 D105 Y106A99-I103 PolarHBondContact O-N 3.48Å; L100-I103 WeakPolarHBondContact O-CB 3.5Å; L100-I103 PolarHBondContact O-N 3.42Å; F101-I103 PolarHBondContact O-N 2.68Å; I103-D105 VanDerWaalsContact C-N 3.31Å; I103-Y106 WeakPolarHBondContact O-CB 3.44Å; I103-Y106 PolarHBondContact O-N 2.95Å
104V87.1Confident85.5Confident62 Ų6271.4 Ų71.438%0.37639%0.385SS..Hα-helixtrans-67.5-34.9176.7-178.30000110.9F101 Y106 A107 S108 L111 Y118F101-V104 CarbonylContact O-C 3.53Å; F101-V104 WeakPolarHBondContact O-CA 2.96Å; F101-V104 WeakPolarHBondContact O-CB 3.39Å; F101-V104 PolarHBondContact O-N 2.78Å; V104-Y106 PolarHBondContact O-N 3.38Å; V104-A107 CarbonylContact O-C 3.6Å; V104-A107 WeakPolarHBondContact O-CA 3.2Å; V104-A107 WeakPolarHBondContact O-CB 3.48Å; V104-A107 PolarHBondContact O-N 2.96Å; V104-S108 PolarHBondContact O-N 3.08Å; V104-L111 HydrophobicContact CG1-CD1 3.46Å; V104-L111 VanDerWaalsContact CG1-CD1 3.46Å; V104-Y118 HydrophobicContact CG1-CE2 4.3Å
105D87Confident85.1Confident21 Ų2177.5 Ų77.511%0.11241%0.411CS..Hα-helixtrans-61.7-27.9176.5-62.6-34.2000112.7F101 S102 I103 A107 S108 Y118 W119 K122F101-D105 VanDerWaalsContact O-CG 3.22Å; F101-D105 PolarHBondContact O-N 3.31Å; S102-D105 WeakPolarHBondContact CA-OD2 3.48Å; S102-D105 PolarHBondContact O-N 3.3Å; I103-D105 VanDerWaalsContact C-N 3.31Å; D105-A107 PolarHBondContact O-N 3.35Å; D105-S108 WeakPolarHBondContact O-CB 3.46Å; D105-S108 PolarHBondContact O-N 3.41Å; D105-S108 PolarHBondContact O-OG 2.87Å; D105-Y118 PolarHBondContact OD1-OH 2.76Å; D105-W119 HydrophobicContact CB-CH2 4.49Å; D105-K122 IonicContact OD1-NZ 2.56Å; D105-K122 PolarHBondContact OD1-NZ 3.31Å; D105-K122 IonicContact OD2-NZ 2.78Å; D105-K122 PolarHBondContact OD2-NZ 3.49Å
106Y84.2Confident84.6Confident211 Ų21177.6 Ų77.683%0.82742%0.421SS*.THydrogen-bonded Turntrans-62.8-25.7171.6-81.1-78.6000112.7S102 I103 V104S102-Y106 WeakPolarHBondContact O-CD2 3.34Å; S102-Y106 PolarHBondContact O-N 2.87Å; I103-Y106 WeakPolarHBondContact O-CB 3.44Å; I103-Y106 PolarHBondContact O-N 2.95Å; V104-Y106 PolarHBondContact O-N 3.38Å
107A81.8Confident84.5Confident51 Ų5179 Ų7942%0.42143%0.426SS..THydrogen-bonded Turntrans-94.911.5172.100000112.6V104 D105 E109 A110 L111V104-A107 CarbonylContact O-C 3.6Å; V104-A107 WeakPolarHBondContact O-CA 3.2Å; V104-A107 WeakPolarHBondContact O-CB 3.48Å; V104-A107 PolarHBondContact O-N 2.96Å; D105-A107 PolarHBondContact O-N 3.35Å; A107-E109 VanDerWaalsContact C-N 3.31Å; A107-E109 PolarHBondContact O-N 3.09Å; A107-A110 PolarHBondContact O-N 3.48Å; A107-A110 VanDerWaalsContact O-N 3.16Å; A107-L111 WeakPolarHBondContact O-CG 3.37Å; A107-L111 PolarHBondContact O-N 2.88Å
108S80.4Confident84.4Confident20 Ų2080 Ų8014%0.1443%0.429CS..Hα-helixtrans-61.2-34.3-174.159.20000113.5V104 D105 A110 L111 M112V104-S108 PolarHBondContact O-N 3.08Å; D105-S108 WeakPolarHBondContact O-CB 3.46Å; D105-S108 PolarHBondContact O-N 3.41Å; D105-S108 PolarHBondContact O-OG 2.87Å; S108-A110 VanDerWaalsContact C-N 3.31Å; S108-A110 PolarHBondContact O-N 3.23Å; S108-L111 CarbonylContact O-C 3.57Å; S108-L111 PolarHBondContact O-N 3.16Å; S108-L111 VanDerWaalsContact O-N 3.11Å; S108-M112 WeakPolarHBondContact O-CB 3.45Å; S108-M112 WeakPolarHBondContact O-CG 3.42Å; S108-M112 PolarHBondContact O-N 3.4Å
109E77Confident84.3Confident174 Ų17479.3 Ų79.381%0.81343%0.426SS*.Hα-helixtrans-58.2-44.3175.9-68.6-177.3-174.500111.6A107 G113A107-E109 VanDerWaalsContact C-N 3.31Å; A107-E109 PolarHBondContact O-N 3.09Å; E109-G113 PolarHBondContact O-N 3.33Å
110A80.2Confident84.2Confident59 Ų5979 Ų7949%0.48842%0.416SS..Hα-helixtrans-67.5-42.8174.700000110.9A107 S108 G113 Y114A107-A110 PolarHBondContact O-N 3.48Å; A107-A110 VanDerWaalsContact O-N 3.16Å; S108-A110 VanDerWaalsContact C-N 3.31Å; S108-A110 PolarHBondContact O-N 3.23Å; A110-G113 PolarHBondContact O-N 3.45Å; A110-Y114 WeakPolarHBondContact O-CD2 3.03Å; A110-Y114 PolarHBondContact O-N 3.44Å
111L79Confident84.3Confident50 Ų5077.5 Ų77.526%0.26242%0.416SS..Hα-helixtrans-64.3-40.5-179.5-68.9169.1000112.8V104 A107 S108 G113 Y114 F115 Y118V104-L111 HydrophobicContact CG1-CD1 3.46Å; V104-L111 VanDerWaalsContact CG1-CD1 3.46Å; A107-L111 WeakPolarHBondContact O-CG 3.37Å; A107-L111 PolarHBondContact O-N 2.88Å; S108-L111 CarbonylContact O-C 3.57Å; S108-L111 PolarHBondContact O-N 3.16Å; S108-L111 VanDerWaalsContact O-N 3.11Å; L111-G113 VanDerWaalsContact C-N 3.28Å; L111-G113 PolarHBondContact O-N 3.03Å; L111-Y114 PolarHBondContact O-N 3.3Å; L111-F115 CarbonylContact O-C 3.54Å; L111-F115 WeakPolarHBondContact O-CA 3.49Å; L111-F115 PolarHBondContact O-N 2.91Å; L111-Y118 HydrophobicContact CB-CD2 4.5Å; L111-Y118 HydrophobicContact CB-CG 4.48Å; L111-Y118 HydrophobicContact CD1-CD2 4.21Å; L111-Y118 HydrophobicContact CD1-CE2 3.88Å
112M77.8Confident84.3Confident71 Ų7174.8 Ų74.835%0.3541%0.405SS..Hα-helixtrans-63.6-35.2176.7-74.9-178.87600111.8S108 Y114 F115 W119S108-M112 WeakPolarHBondContact O-CB 3.45Å; S108-M112 WeakPolarHBondContact O-CG 3.42Å; S108-M112 PolarHBondContact O-N 3.4Å; M112-Y114 VanDerWaalsContact C-N 3.27Å; M112-Y114 PolarHBondContact O-N 2.9Å; M112-F115 CarbonylContact O-C 3.53Å; M112-W119 PolarHBondContact SD-NE1 3.26Å
113G77.2Confident84.5Confident69 Ų6973.3 Ų73.371%0.71139%0.394SS*.Hα-helixtrans-61.5-33.8174.800000113.4E109 A110 L111E109-G113 PolarHBondContact O-N 3.33Å; A110-G113 PolarHBondContact O-N 3.45Å; L111-G113 VanDerWaalsContact C-N 3.28Å; L111-G113 PolarHBondContact O-N 3.03Å
114Y79.2Confident84.6Confident187 Ų18771.9 Ų71.973%0.73339%0.391SS*.Hα-helixtrans-92.3-34176.7-67.9-73.5000113.3A110 L111 M112A110-Y114 WeakPolarHBondContact O-CD2 3.03Å; A110-Y114 PolarHBondContact O-N 3.44Å; L111-Y114 PolarHBondContact O-N 3.3Å; M112-Y114 VanDerWaalsContact C-N 3.27Å; M112-Y114 PolarHBondContact O-N 2.9Å
115F83.8Confident84.7Confident128 Ų12871.8 Ų71.856%0.56139%0.388SS*.  trans-140.586.3-171.2-66.3-77000110.3L111 M112 I117 Y118L111-F115 CarbonylContact O-C 3.54Å; L111-F115 WeakPolarHBondContact O-CA 3.49Å; L111-F115 PolarHBondContact O-N 2.91Å; M112-F115 CarbonylContact O-C 3.53Å; F115-I117 PolarHBondContact O-N 3.27Å; F115-Y118 WeakPolarHBondContact O-CB 3.46Å; F115-Y118 PolarHBondContact O-N 2.88Å
116P81.3Confident84.8Confident73 Ų7370.9 Ų70.947%0.47438%0.383SS..THydrogen-bonded Turntrans-64.5-12.1-179.926.3-35.1000113.3Y118P116-Y118 VanDerWaalsContact C-N 3.32Å
117I88.3Confident85Confident96 Ų9664.6 Ų64.649%0.49236%0.363SS..THydrogen-bonded Turntrans-85.83.7176.262.2168.9000113.9F115 W119 L120 A121F115-I117 PolarHBondContact O-N 3.27Å; I117-W119 PolarHBondContact O-N 2.64Å; I117-L120 PolarHBondContact O-N 2.56Å; I117-A121 WeakPolarHBondContact O-CB 3.43Å; I117-A121 PolarHBondContact O-N 2.9Å
118Y89.5Confident85.1Confident29 Ų2966.3 Ų66.311%0.11436%0.359CS..Hα-helixtrans-54.5-49.9-175173.2-103.3000112.8V104 D105 L111 F115 P116 L120 A121 K122V104-Y118 HydrophobicContact CG1-CE2 4.3Å; D105-Y118 PolarHBondContact OD1-OH 2.76Å; L111-Y118 HydrophobicContact CB-CD2 4.5Å; L111-Y118 HydrophobicContact CB-CG 4.48Å; L111-Y118 HydrophobicContact CD1-CD2 4.21Å; L111-Y118 HydrophobicContact CD1-CE2 3.88Å; F115-Y118 WeakPolarHBondContact O-CB 3.46Å; F115-Y118 PolarHBondContact O-N 2.88Å; P116-Y118 VanDerWaalsContact C-N 3.32Å; Y118-L120 PolarHBondContact O-N 3.27Å; Y118-A121 PolarHBondContact O-N 2.73Å; Y118-K122 HydrophobicContact CE1-CD 4.35Å; Y118-K122 WeakPolarHBondContact O-CB 3.3Å; Y118-K122 PolarHBondContact O-N 3.11Å
119W88.8Confident85.3Confident8 Ų865.4 Ų65.43%0.0335%0.352CS..Hα-helixtrans-64.9-40-178.6-65.3117.4000112.9L54 D61 C64 D105 M112 I117 K122 C123L54-W119 HydrophobicContact CB-CB 4.48Å; L54-W119 WeakPolarHBondContact O-CB 3.19Å; D61-W119 HydrophobicContact CB-CD2 4.13Å; D61-W119 HydrophobicContact CB-CE3 4.18Å; D61-W119 HydrophobicContact CB-CH2 3.3Å; D61-W119 HydrophobicContact CB-CZ2 3.22Å; D61-W119 HydrophobicContact CB-CZ3 3.79Å; C64-W119 HydrophobicContact CB-CE3 3.94Å; D105-W119 HydrophobicContact CB-CH2 4.49Å; M112-W119 PolarHBondContact SD-NE1 3.26Å; I117-W119 PolarHBondContact O-N 2.64Å; W119-K122 HydrophobicContact CE3-CD 4.08Å; W119-K122 HydrophobicContact CZ3-CD 4.01Å; W119-K122 PolarHBondContact O-N 3.27Å; W119-C123 VanDerWaalsContact O-CB 3.27Å; W119-C123 WeakPolarHBondContact O-CB 3.33Å; W119-C123 PolarHBondContact O-N 3.18Å
120L91Very high85.5Confident48 Ų4857.8 Ų57.825%0.25132%0.318SS..Hα-helixtrans-63-46.9173.9178.560.9000111.1A51 L54 V55 I117 Y118 K122 C123 V124A51-L120 HydrophobicContact CB-CD1 3.7Å; A51-L120 HydrophobicContact CB-CD2 4.46Å; L54-L120 HydrophobicContact CB-CB 4.38Å; L54-L120 HydrophobicContact CD1-CD1 4.38Å; V55-L120 HydrophobicContact CG2-CB 4.05Å; V55-L120 HydrophobicContact CG2-CD2 3.91Å; I117-L120 PolarHBondContact O-N 2.56Å; Y118-L120 PolarHBondContact O-N 3.27Å; L120-K122 VanDerWaalsContact C-N 3.35Å; L120-K122 PolarHBondContact O-N 3.41Å; L120-C123 PolarHBondContact O-N 2.97Å; L120-V124 HydrophobicContact CD1-CG2 4.2Å; L120-V124 VanDerWaalsContact O-CG2 3.31Å; L120-V124 WeakPolarHBondContact O-CG2 3.15Å; L120-V124 PolarHBondContact O-N 3.42Å
121A90.3Very high85.3Confident56 Ų5657.8 Ų57.846%0.46331%0.309SS..Hα-helixtrans-62-43.117900000111.7I117 Y118 L125I117-A121 WeakPolarHBondContact O-CB 3.43Å; I117-A121 PolarHBondContact O-N 2.9Å; Y118-A121 PolarHBondContact O-N 2.73Å; A121-L125 WeakPolarHBondContact O-CB 3.23Å; A121-L125 PolarHBondContact O-N 3.19Å
122K90.9Very high84.5Confident4 Ų458.3 Ų58.32%0.01732%0.318CS..Hα-helixtrans-59.8-51.6174.1-176.1-175.5178.3-169.70110.7N65 D105 Y118 W119 L120 V124 L125 F126N65-K122 PolarHBondContact OD1-NZ 3.47Å; D105-K122 IonicContact OD1-NZ 2.56Å; D105-K122 PolarHBondContact OD1-NZ 3.31Å; D105-K122 IonicContact OD2-NZ 2.78Å; D105-K122 PolarHBondContact OD2-NZ 3.49Å; Y118-K122 HydrophobicContact CE1-CD 4.35Å; Y118-K122 WeakPolarHBondContact O-CB 3.3Å; Y118-K122 PolarHBondContact O-N 3.11Å; W119-K122 HydrophobicContact CE3-CD 4.08Å; W119-K122 HydrophobicContact CZ3-CD 4.01Å; W119-K122 PolarHBondContact O-N 3.27Å; L120-K122 VanDerWaalsContact C-N 3.35Å; L120-K122 PolarHBondContact O-N 3.41Å; K122-V124 PolarHBondContact O-N 3.32Å; K122-L125 WeakPolarHBondContact O-CB 3.42Å; K122-L125 PolarHBondContact O-N 2.9Å; K122-L125 VanDerWaalsContact O-N 3.16Å; K122-F126 HydrophobicContact CG-CD2 3.67Å; K122-F126 HydrophobicContact CG-CE2 3.84Å; K122-F126 WeakPolarHBondContact O-CD2 3.29Å; K122-F126 PolarHBondContact O-N 2.9Å
123C91.8Very high83.7Confident5 Ų559.2 Ų59.23%0.03432%0.323CS..Hα-helixtrans-56.5-48.8179.5-172.20000111.6L54 W119 L120 L125 F126 L127L54-C123 HydrophobicContact CD1-CB 3.73Å; W119-C123 VanDerWaalsContact O-CB 3.27Å; W119-C123 WeakPolarHBondContact O-CB 3.33Å; W119-C123 PolarHBondContact O-N 3.18Å; L120-C123 PolarHBondContact O-N 2.97Å; C123-L125 VanDerWaalsContact C-N 3.34Å; C123-L125 PolarHBondContact O-N 3.08Å; C123-F126 PolarHBondContact O-N 3.39Å; C123-L127 WeakPolarHBondContact O-CB 3.37Å; C123-L127 VanDerWaalsContact O-CG 3.28Å; C123-L127 WeakPolarHBondContact O-CG 3.11Å; C123-L127 PolarHBondContact O-N 3.39Å
124V89.8Confident82.9Confident88 Ų8858.5 Ų58.553%0.53330%0.299SS..Hα-helixtrans-60.8-42.8177.41720000111.7L120 K122 W128L120-V124 HydrophobicContact CD1-CG2 4.2Å; L120-V124 VanDerWaalsContact O-CG2 3.31Å; L120-V124 WeakPolarHBondContact O-CG2 3.15Å; L120-V124 PolarHBondContact O-N 3.42Å; K122-V124 PolarHBondContact O-N 3.32Å; V124-W128 WeakPolarHBondContact O-CB 3.44Å; V124-W128 PolarHBondContact O-N 3.05Å
125L89.6Confident82.5Confident60 Ų6053.7 Ų53.731%0.31428%0.282SS..Hα-helixtrans-61.6-46.2177.1-179.967.5000111.5F101 A121 K122 C123 W128 L129F101-L125 HydrophobicContact CE1-CD2 3.95Å; F101-L125 HydrophobicContact CE2-CD2 4Å; F101-L125 HydrophobicContact CZ-CD2 3.39Å; A121-L125 WeakPolarHBondContact O-CB 3.23Å; A121-L125 PolarHBondContact O-N 3.19Å; K122-L125 WeakPolarHBondContact O-CB 3.42Å; K122-L125 PolarHBondContact O-N 2.9Å; K122-L125 VanDerWaalsContact O-N 3.16Å; C123-L125 VanDerWaalsContact C-N 3.34Å; C123-L125 PolarHBondContact O-N 3.08Å; L125-W128 HydrophobicContact CD1-CE3 4.17Å; L125-W128 WeakPolarHBondContact O-CB 3.48Å; L125-W128 PolarHBondContact O-N 2.99Å; L125-L129 HydrophobicContact CG-CD1 4.34Å; L125-L129 WeakPolarHBondContact O-CG 3.24Å; L125-L129 PolarHBondContact O-N 3Å
126F89.6Confident81.7Confident1 Ų147.6 Ų47.60%0.00426%0.255CS..Hα-helixtrans-72.7-34.4-178.7-85.9-80.5000113.1C68 Y94 I97 F98 F101 K122 C123 W128 L129 S130C68-F126 HydrophobicContact CB-CB 4.19Å; C68-F126 HydrophobicContact CB-CG 4.41Å; C68-F126 WeakPolarHBondContact SG-CB 3.43Å; Y94-F126 HydrophobicContact CE1-CD1 4.25Å; Y94-F126 AromaticContact CE2-CD1 3.72Å; Y94-F126 HydrophobicContact CE2-CD1 3.72Å; Y94-F126 HydrophobicContact CE2-CE1 4.49Å; Y94-F126 AromaticContact CZ-CD1 3.5Å; Y94-F126 VanDerWaalsContact CZ-CD1 3.5Å; Y94-F126 VanDerWaalsContact OH-CD1 3.26Å; Y94-F126 WeakPolarHBondContact OH-CD1 3.3Å; I97-F126 HydrophobicContact CG2-CE1 4.29Å; I97-F126 HydrophobicContact CG2-CZ 4.17Å; F98-F126 HydrophobicContact CB-CE1 3.74Å; F98-F126 HydrophobicContact CB-CZ 4.24Å; F98-F126 HydrophobicContact CD2-CD1 4.06Å; F98-F126 AromaticContact CD2-CE1 3.63Å; F98-F126 HydrophobicContact CD2-CE1 3.63Å; F98-F126 HydrophobicContact CD2-CZ 4.01Å; F98-F126 HydrophobicContact CG-CE1 4.16Å; F101-F126 HydrophobicContact CB-CE2 3.9Å; F101-F126 HydrophobicContact CB-CZ 3.81Å; F101-F126 HydrophobicContact CD1-CE2 4.1Å; F101-F126 AromaticContact CD2-CE2 3.99Å; F101-F126 HydrophobicContact CD2-CE2 3.99Å; F101-F126 AromaticContact CD2-CZ 3.81Å; F101-F126 HydrophobicContact CD2-CZ 3.81Å; F101-F126 AromaticContact CG-CE2 3.72Å; F101-F126 HydrophobicContact CG-CE2 3.72Å; F101-F126 AromaticContact CG-CZ 3.84Å; F101-F126 HydrophobicContact CG-CZ 3.84Å; K122-F126 HydrophobicContact CG-CD2 3.67Å; K122-F126 HydrophobicContact CG-CE2 3.84Å; K122-F126 WeakPolarHBondContact O-CD2 3.29Å; K122-F126 PolarHBondContact O-N 2.9Å; C123-F126 PolarHBondContact O-N 3.39Å; F126-W128 VanDerWaalsContact C-N 3.31Å; F126-L129 HydrophobicContact CD1-CD1 4.07Å; F126-L129 HydrophobicContact CE1-CD1 4.17Å; F126-L129 PolarHBondContact O-N 2.93Å; F126-S130 PolarHBondContact O-N 3.19Å; F126-S130 PolarHBondContact O-OG 3.38Å
127L87.5Confident81.3Confident79 Ų7944.1 Ų44.141%0.41423%0.233SC..Hα-helixtrans-60.8-43.5169.2-73.5173.2000110.7I67 C123 L129 S130 L131I67-L127 HydrophobicContact CG2-CD2 3.9Å; I67-L127 HydrophobicContact CG2-CG 4.41Å; C123-L127 WeakPolarHBondContact O-CB 3.37Å; C123-L127 VanDerWaalsContact O-CG 3.28Å; C123-L127 WeakPolarHBondContact O-CG 3.11Å; C123-L127 PolarHBondContact O-N 3.39Å; L127-L129 VanDerWaalsContact C-N 3.34Å; L127-L129 PolarHBondContact O-N 3.41Å; L127-S130 WeakPolarHBondContact CA-OG 3.22Å; L127-S130 PolarHBondContact O-N 3.15Å; L127-S130 PolarHBondContact O-OG 3.47Å; L127-L131 PolarHBondContact O-N 2.92Å; L127-L131 VanDerWaalsContact O-N 3.15Å
128W83.6Confident80.6Confident88 Ų8841 Ų4133%0.33322%0.217SC..Hα-helixtrans-62.8-38.6174.4179.169.7000113V124 L125 F126 S130 L131 Y134 V140V124-W128 WeakPolarHBondContact O-CB 3.44Å; V124-W128 PolarHBondContact O-N 3.05Å; L125-W128 HydrophobicContact CD1-CE3 4.17Å; L125-W128 WeakPolarHBondContact O-CB 3.48Å; L125-W128 PolarHBondContact O-N 2.99Å; F126-W128 VanDerWaalsContact C-N 3.31Å; W128-S130 VanDerWaalsContact C-N 3.33Å; W128-L131 PolarHBondContact O-N 3.35Å; W128-Y134 AromaticContact NE1-CD2 3.99Å; W128-V140 HydrophobicContact CZ3-CG2 4.14Å
129L84.5Confident79.9Confident1 Ų146.3 Ų46.31%0.00524%0.237CC..Hα-helixtrans-67-33.3175.1-71.2170.8000112.9Q90 Y94 I97 L125 F126 L127 V140Q90-L129 PolarHBondContact NE2-O 2.98Å; Y94-L129 HydrophobicContact CD2-CB 3.83Å; Y94-L129 HydrophobicContact CE2-CB 3.9Å; I97-L129 HydrophobicContact CB-CD1 4.49Å; I97-L129 HydrophobicContact CD1-CD1 4.3Å; I97-L129 HydrophobicContact CD1-CD2 4.11Å; I97-L129 HydrophobicContact CG2-CD1 3.78Å; L125-L129 HydrophobicContact CG-CD1 4.34Å; L125-L129 WeakPolarHBondContact O-CG 3.24Å; L125-L129 PolarHBondContact O-N 3Å; F126-L129 HydrophobicContact CD1-CD1 4.07Å; F126-L129 HydrophobicContact CE1-CD1 4.17Å; F126-L129 PolarHBondContact O-N 2.93Å; L127-L129 VanDerWaalsContact C-N 3.34Å; L127-L129 PolarHBondContact O-N 3.41Å; L129-V140 HydrophobicContact CD2-CB 4.38Å; L129-V140 HydrophobicContact CD2-CG2 3.81Å
130S81.6Confident79.2Confident14 Ų1447.3 Ų47.310%0.09824%0.244CC..Hα-helixtrans-77.8-17.5178.565.30000114.4F126 L127 W128 S132F126-S130 PolarHBondContact O-N 3.19Å; F126-S130 PolarHBondContact O-OG 3.38Å; L127-S130 WeakPolarHBondContact CA-OG 3.22Å; L127-S130 PolarHBondContact O-N 3.15Å; L127-S130 PolarHBondContact O-OG 3.47Å; W128-S130 VanDerWaalsContact C-N 3.33Å; S130-S132 PolarHBondContact O-N 2.87Å; S130-S132 VanDerWaalsContact O-N 3.08Å
131L75.6Confident78.4Confident58 Ų5848.5 Ų48.530%0.30425%0.245SC..  trans-68.7106.4175.2-78.6164000109.7L127 W128 I133 Y134L127-L131 PolarHBondContact O-N 2.92Å; L127-L131 VanDerWaalsContact O-N 3.15Å; W128-L131 PolarHBondContact O-N 3.35Å; L131-I133 PolarHBondContact O-N 3.24Å; L131-Y134 HydrophobicContact CB-CD2 4.07Å; L131-Y134 HydrophobicContact CD1-CE2 4.35Å; L131-Y134 PolarHBondContact O-N 3.46Å
132S61.9Low77.8Confident62 Ų6251 Ų5143%0.43425%0.247SC..G310 helixtrans-57.9-29.7178.956.40000112.7S130 Y134 K135S130-S132 PolarHBondContact O-N 2.87Å; S130-S132 VanDerWaalsContact O-N 3.08Å; S132-Y134 PolarHBondContact O-N 2.98Å; S132-Y134 VanDerWaalsContact O-N 3.09Å; S132-K135 PolarHBondContact O-N 3.45Å
133I61.2Low77Confident90 Ų9059 Ų5946%0.46228%0.282SS..G310 helixtrans-51.8-37.4179.9-56.9175.6000112D12 L131D12-I133 HydrophobicContact CB-CD1 4.44Å; D12-I133 VanDerWaalsContact CG-CD1 3.45Å; D12-I133 WeakPolarHBondContact OD1-CD1 3.45Å; D12-I133 VanDerWaalsContact OD2-CD1 3.27Å; D12-I133 WeakPolarHBondContact OD2-CD1 3.3Å; L131-I133 PolarHBondContact O-N 3.24Å
134Y61.4Low76.1Confident54 Ų5463.8 Ų63.821%0.21231%0.307CS..G310 helixtrans-97.9-6.4-175.7-59.3-69.5000114W128 L131 S132 G136 R139W128-Y134 AromaticContact NE1-CD2 3.99Å; L131-Y134 HydrophobicContact CB-CD2 4.07Å; L131-Y134 HydrophobicContact CD1-CE2 4.35Å; L131-Y134 PolarHBondContact O-N 3.46Å; S132-Y134 PolarHBondContact O-N 2.98Å; S132-Y134 VanDerWaalsContact O-N 3.09Å; Y134-G136 PolarHBondContact O-N 2.92Å; Y134-R139 PolarHBondContact O-NH2 3.47Å
135K69.9Low75.2Confident86 Ų8660.7 Ų60.737%0.37429%0.288SS..THydrogen-bonded Turntrans40.449.3-163.8-72.9-174.1170-172.40109.8E86 S132 A137 L138 R139E86-K135 IonicContact OE2-NZ 2.72Å; E86-K135 PolarHBondContact OE2-NZ 3.36Å; S132-K135 PolarHBondContact O-N 3.45Å; K135-A137 PolarHBondContact O-N 3.35Å; K135-L138 HydrophobicContact CB-CB 4.25Å; K135-L138 HydrophobicContact CB-CD1 4.09Å; K135-L138 HydrophobicContact CD-CD1 3.9Å; K135-L138 HydrophobicContact CG-CD1 4.23Å; K135-L138 WeakPolarHBondContact O-CB 3.26Å; K135-L138 PolarHBondContact O-N 2.82Å; K135-L138 VanDerWaalsContact O-N 3.16Å; K135-R139 PolarHBondContact O-N 3.3Å
136G68.5Low74.5Confident0 Ų064.6 Ų64.60%030%0.298CS..Hα-helixtrans-59.9-45.1-165.200000112.7Y134 R139 V140Y134-G136 PolarHBondContact O-N 2.92Å; G136-R139 WeakPolarHBondContact O-CB 3.35Å; G136-R139 PolarHBondContact O-N 2.94Å; G136-V140 WeakPolarHBondContact O-CG2 3.4Å; G136-V140 PolarHBondContact O-N 3.39Å
137A71.8Confident73.7Confident0 Ų066.7 Ų66.70%032%0.32CS..Hα-helixtrans-57.7-48.7174.200000112.3T93 I97 K135 R139 V140 Y141T93-A137 HydrophobicContact CG2-CB 3.85Å; T93-A137 WeakPolarHBondContact CG2-O 3.26Å; I97-A137 HydrophobicContact CD1-CB 4.35Å; K135-A137 PolarHBondContact O-N 3.35Å; A137-R139 VanDerWaalsContact C-N 3.3Å; A137-R139 PolarHBondContact O-N 2.87Å; A137-V140 PolarHBondContact O-N 3.32Å; A137-Y141 WeakPolarHBondContact O-CB 3.17Å; A137-Y141 PolarHBondContact O-N 2.99Å
138L73.6Confident72.9Confident31 Ų3169 Ų6916%0.16233%0.326CS..Hα-helixtrans-58.6-39.5175.4-79.5165.7000112.7T89 Q90 K135 Y141 H142T89-L138 HydrophobicContact CG2-CD2 3.87Å; Q90-L138 HydrophobicContact CB-CD1 4.28Å; K135-L138 HydrophobicContact CB-CB 4.25Å; K135-L138 HydrophobicContact CB-CD1 4.09Å; K135-L138 HydrophobicContact CD-CD1 3.9Å; K135-L138 HydrophobicContact CG-CD1 4.23Å; K135-L138 WeakPolarHBondContact O-CB 3.26Å; K135-L138 PolarHBondContact O-N 2.82Å; K135-L138 VanDerWaalsContact O-N 3.16Å; L138-Y141 WeakPolarHBondContact O-CB 3.5Å; L138-Y141 PolarHBondContact O-N 3.47Å; L138-H142 PolarHBondContact O-CD2 2.72Å; L138-H142 PolarHBondContact O-N 3.4Å
139R74.4Confident72.5Confident139 Ų13966.6 Ų66.653%0.52532%0.321SS..Hα-helixtrans-63.3-46176.2-167.9-177.9-58.7176.34.3111.7Y134 K135 G136 A137 Y141 H142 F143Y134-R139 PolarHBondContact O-NH2 3.47Å; K135-R139 PolarHBondContact O-N 3.3Å; G136-R139 WeakPolarHBondContact O-CB 3.35Å; G136-R139 PolarHBondContact O-N 2.94Å; A137-R139 VanDerWaalsContact C-N 3.3Å; A137-R139 PolarHBondContact O-N 2.87Å; R139-Y141 VanDerWaalsContact C-N 3.3Å; R139-Y141 PolarHBondContact O-N 2.84Å; R139-H142 PolarHBondContact O-N 3.17Å; R139-F143 WeakPolarHBondContact O-CB 3.2Å; R139-F143 PolarHBondContact O-N 2.65Å
140V75.9Confident71.8Confident30 Ų3070.4 Ų70.418%0.18235%0.345CS..Hα-helixtrans-64.4-37.8176.6173.70000111I97 W128 L129 G136 A137 F143 L144I97-V140 HydrophobicContact CD1-CB 3.81Å; I97-V140 HydrophobicContact CD1-CG1 3.59Å; I97-V140 HydrophobicContact CG1-CG1 4.23Å; W128-V140 HydrophobicContact CZ3-CG2 4.14Å; L129-V140 HydrophobicContact CD2-CB 4.38Å; L129-V140 HydrophobicContact CD2-CG2 3.81Å; G136-V140 WeakPolarHBondContact O-CG2 3.4Å; G136-V140 PolarHBondContact O-N 3.39Å; A137-V140 PolarHBondContact O-N 3.32Å; V140-F143 PolarHBondContact O-N 3.3Å; V140-L144 HydrophobicContact CG1-CD1 3.99Å; V140-L144 HydrophobicContact CG1-CG 4.48Å; V140-L144 PolarHBondContact O-N 3.28Å
141Y74.1Confident71.3Confident73 Ų7374.1 Ų74.129%0.28637%0.367SS..Iπ-helixtrans-62-48.9173.8175.4-91.5000112.5T93 A137 L138 R139 F143 L145 R146 V149T93-Y141 VanDerWaalsContact CG2-CB 3.44Å; T93-Y141 HydrophobicContact CG2-CD2 4.2Å; T93-Y141 HydrophobicContact CG2-CG 4.14Å; A137-Y141 WeakPolarHBondContact O-CB 3.17Å; A137-Y141 PolarHBondContact O-N 2.99Å; L138-Y141 WeakPolarHBondContact O-CB 3.5Å; L138-Y141 PolarHBondContact O-N 3.47Å; R139-Y141 VanDerWaalsContact C-N 3.3Å; R139-Y141 PolarHBondContact O-N 2.84Å; Y141-F143 PolarHBondContact O-N 3.49Å; Y141-L145 HydrophobicContact CD2-CB 3.55Å; Y141-L145 HydrophobicContact CD2-CD1 3.75Å; Y141-L145 HydrophobicContact CD2-CG 4.29Å; Y141-L145 HydrophobicContact CE2-CB 3.99Å; Y141-L145 HydrophobicContact CG-CB 4.19Å; Y141-L145 CarbonylContact O-C 3.52Å; Y141-L145 PolarHBondContact O-N 2.85Å; Y141-R146 HydrophobicContact CE1-CB 4.5Å; Y141-R146 PolarHBondContact O-N 3.4Å; Y141-V149 HydrophobicContact CE2-CG2 4.5Å
142H76.1Confident71.2Confident108 Ų10877.5 Ų77.550%0.538%0.379SS..Iπ-helixtrans-61.7-32.7178.6-77.9-58.2000112.8L138 R139L138-H142 PolarHBondContact O-CD2 2.72Å; L138-H142 PolarHBondContact O-N 3.4Å; R139-H142 PolarHBondContact O-N 3.17Å
143F75.3Confident71.7Confident171 Ų17178.8 Ų78.875%0.7538%0.38SS*.Iπ-helixtrans-83-49.7-178.3-171.6-107.8000113.5R139 V140 Y141R139-F143 WeakPolarHBondContact O-CB 3.2Å; R139-F143 PolarHBondContact O-N 2.65Å; V140-F143 PolarHBondContact O-N 3.3Å; Y141-F143 PolarHBondContact O-N 3.49Å
144L72.3Confident71.8Confident107 Ų10776.6 Ų76.656%0.5638%0.376SS*.Iπ-helixtrans-99.7-51.3-173.6-63.2-179.6000112.6V140V140-L144 HydrophobicContact CG1-CD1 3.99Å; V140-L144 HydrophobicContact CG1-CG 4.48Å; V140-L144 PolarHBondContact O-N 3.28Å
145L71.7Confident71.8Confident23 Ų2384.1 Ų84.112%0.1240%0.404CS..Iπ-helixtrans-80.2-35.1-168.3-64.3173000112.2V96 I97 L100 Y141 G147 F148 V149V96-L145 HydrophobicContact CG1-CD1 3.76Å; I97-L145 HydrophobicContact CG1-CD1 4.31Å; L100-L145 HydrophobicContact CD1-CD2 3.85Å; Y141-L145 HydrophobicContact CD2-CB 3.55Å; Y141-L145 HydrophobicContact CD2-CD1 3.75Å; Y141-L145 HydrophobicContact CD2-CG 4.29Å; Y141-L145 HydrophobicContact CE2-CB 3.99Å; Y141-L145 HydrophobicContact CG-CB 4.19Å; Y141-L145 CarbonylContact O-C 3.52Å; Y141-L145 PolarHBondContact O-N 2.85Å; L145-G147 VanDerWaalsContact C-N 3.29Å; L145-G147 PolarHBondContact O-N 3.33Å; L145-F148 PolarHBondContact O-N 2.92Å; L145-F148 VanDerWaalsContact O-N 3.11Å; L145-V149 VanDerWaalsContact O-CB 3.3Å; L145-V149 WeakPolarHBondContact O-CB 3.37Å; L145-V149 WeakPolarHBondContact O-CG2 3.43Å; L145-V149 PolarHBondContact O-N 3.33Å
146R73.5Confident71.5Confident142 Ų14283.1 Ų83.154%0.53641%0.408SS..Hα-helixtrans-60.7-39.3-179.4-170.1179.6-176.5-157.72.1111.6Y141 V150Y141-R146 HydrophobicContact CE1-CB 4.5Å; Y141-R146 PolarHBondContact O-N 3.4Å; R146-V150 HydrophobicContact CG-CG2 4.06Å; R146-V150 VanDerWaalsContact O-CB 3.26Å; R146-V150 WeakPolarHBondContact O-CB 3.44Å; R146-V150 WeakPolarHBondContact O-CG2 3.27Å; R146-V150 PolarHBondContact O-N 3.45Å
147G72.7Confident71Confident44 Ų4492.4 Ų92.445%0.45444%0.443SS..Hα-helixtrans-60-46.8174.500000112L145 T151L145-G147 VanDerWaalsContact C-N 3.29Å; L145-G147 PolarHBondContact O-N 3.33Å; G147-T151 WeakPolarHBondContact O-CB 3.46Å; G147-T151 PolarHBondContact O-N 3.14Å; G147-T151 PolarHBondContact O-OG1 3.37Å
148F72.6Confident70.2Confident127 Ų127103 Ų10356%0.55748%0.483SS*.Hα-helixtrans-69.1-49.1179.1-169.9-95.5000112.5L145 V150 T151 F152L145-F148 PolarHBondContact O-N 2.92Å; L145-F148 VanDerWaalsContact O-N 3.11Å; F148-V150 PolarHBondContact O-N 2.89Å; F148-T151 PolarHBondContact O-N 3.24Å; F148-F152 HydrophobicContact CD1-CD2 4.19Å; F148-F152 AromaticContact CD2-CD2 3.68Å; F148-F152 HydrophobicContact CD2-CD2 3.68Å; F148-F152 AromaticContact CD2-CE2 3.66Å; F148-F152 HydrophobicContact CD2-CE2 3.66Å; F148-F152 HydrophobicContact CE1-CD2 4.06Å; F148-F152 AromaticContact CE2-CD2 3.53Å; F148-F152 HydrophobicContact CE2-CD2 3.53Å; F148-F152 AromaticContact CE2-CE2 3.38Å; F148-F152 HydrophobicContact CE2-CE2 3.38Å; F148-F152 HydrophobicContact CE2-CZ 4.29Å; F148-F152 HydrophobicContact CG-CD2 4.01Å; F148-F152 HydrophobicContact CG-CE2 4.44Å; F148-F152 AromaticContact CZ-CD2 3.73Å; F148-F152 HydrophobicContact CZ-CD2 3.73Å; F148-F152 AromaticContact CZ-CE2 3.96Å; F148-F152 HydrophobicContact CZ-CE2 3.96Å; F148-F152 HydrophobicContact CZ-CG 4.37Å; F148-F152 WeakPolarHBondContact O-CD2 3.07Å; F148-F152 PolarHBondContact O-N 3.08Å
149V73.3Confident69.3Low38 Ų38110.3 Ų110.323%0.2351%0.513CS..Hα-helixtrans-60.3-46.5179.91690000111.1Y141 L145 T151 F152 I153 A154Y141-V149 HydrophobicContact CE2-CG2 4.5Å; L145-V149 VanDerWaalsContact O-CB 3.3Å; L145-V149 WeakPolarHBondContact O-CB 3.37Å; L145-V149 WeakPolarHBondContact O-CG2 3.43Å; L145-V149 PolarHBondContact O-N 3.33Å; V149-T151 VanDerWaalsContact C-N 3.31Å; V149-T151 PolarHBondContact O-N 3.38Å; V149-F152 PolarHBondContact O-N 3.25Å; V149-I153 HydrophobicContact CB-CD1 4.4Å; V149-I153 HydrophobicContact CG1-CB 4.2Å; V149-I153 HydrophobicContact CG1-CD1 4.01Å; V149-I153 HydrophobicContact CG2-CD1 4.21Å; V149-I153 WeakPolarHBondContact O-CA 3.28Å; V149-I153 VanDerWaalsContact O-CB 3.27Å; V149-I153 WeakPolarHBondContact O-CB 3.46Å; V149-I153 PolarHBondContact O-N 3.15Å; V149-A154 PolarHBondContact O-N 3.47Å
150V70.2Confident68.1Low82 Ų82110.6 Ų110.650%0.49753%0.525SS..Hα-helixtrans-65.3-39.1178.4172.70000110.8R146 F148 A154R146-V150 HydrophobicContact CG-CG2 4.06Å; R146-V150 VanDerWaalsContact O-CB 3.26Å; R146-V150 WeakPolarHBondContact O-CB 3.44Å; R146-V150 WeakPolarHBondContact O-CG2 3.27Å; R146-V150 PolarHBondContact O-N 3.45Å; F148-V150 PolarHBondContact O-N 2.89Å; V150-A154 HydrophobicContact CG1-CB 4.44Å; V150-A154 VanDerWaalsContact O-CB 3.23Å; V150-A154 WeakPolarHBondContact O-CB 3.44Å
151T70.7Confident67Low92 Ų92123.1 Ų123.156%0.56457%0.569SS**Hα-helixtrans-67.2-40.1-179.7-57.10000112.3G147 F148 V149G147-T151 WeakPolarHBondContact O-CB 3.46Å; G147-T151 PolarHBondContact O-N 3.14Å; G147-T151 PolarHBondContact O-OG1 3.37Å; F148-T151 PolarHBondContact O-N 3.24Å; V149-T151 VanDerWaalsContact C-N 3.31Å; V149-T151 PolarHBondContact O-N 3.38Å
152F74.6Confident66.7Low128 Ų128125.7 Ų125.756%0.56158%0.583SS**Hα-helixtrans-102.7-39.9-172-71.9-77.5000114.5F148 V149F148-F152 HydrophobicContact CD1-CD2 4.19Å; F148-F152 AromaticContact CD2-CD2 3.68Å; F148-F152 HydrophobicContact CD2-CD2 3.68Å; F148-F152 AromaticContact CD2-CE2 3.66Å; F148-F152 HydrophobicContact CD2-CE2 3.66Å; F148-F152 HydrophobicContact CE1-CD2 4.06Å; F148-F152 AromaticContact CE2-CD2 3.53Å; F148-F152 HydrophobicContact CE2-CD2 3.53Å; F148-F152 AromaticContact CE2-CE2 3.38Å; F148-F152 HydrophobicContact CE2-CE2 3.38Å; F148-F152 HydrophobicContact CE2-CZ 4.29Å; F148-F152 HydrophobicContact CG-CD2 4.01Å; F148-F152 HydrophobicContact CG-CE2 4.44Å; F148-F152 AromaticContact CZ-CD2 3.73Å; F148-F152 HydrophobicContact CZ-CD2 3.73Å; F148-F152 AromaticContact CZ-CE2 3.96Å; F148-F152 HydrophobicContact CZ-CE2 3.96Å; F148-F152 HydrophobicContact CZ-CG 4.37Å; F148-F152 WeakPolarHBondContact O-CD2 3.07Å; F148-F152 PolarHBondContact O-N 3.08Å; V149-F152 PolarHBondContact O-N 3.25Å
153I71.8Confident66.2Low89 Ų89126.6 Ų126.646%0.45659%0.587SS.*THydrogen-bonded Turntrans-91-36.9-174.6-62.6170.4000111.8V149 R155 S156 R157V149-I153 HydrophobicContact CB-CD1 4.4Å; V149-I153 HydrophobicContact CG1-CB 4.2Å; V149-I153 HydrophobicContact CG1-CD1 4.01Å; V149-I153 HydrophobicContact CG2-CD1 4.21Å; V149-I153 WeakPolarHBondContact O-CA 3.28Å; V149-I153 VanDerWaalsContact O-CB 3.27Å; V149-I153 WeakPolarHBondContact O-CB 3.46Å; V149-I153 PolarHBondContact O-N 3.15Å; I153-R155 PolarHBondContact O-N 3.2Å; I153-S156 PolarHBondContact O-N 3.22Å; I153-S156 PolarHBondContact O-OG 3.21Å; I153-R157 PolarHBondContact O-N 3.4Å
154A62.8Low65.7Low44 Ų44124.1 Ų124.136%0.36458%0.578SS.*THydrogen-bonded Turntrans-64.7-23.8177.300000112V149 V150 S156 W158V149-A154 PolarHBondContact O-N 3.47Å; V150-A154 HydrophobicContact CG1-CB 4.44Å; V150-A154 VanDerWaalsContact O-CB 3.23Å; V150-A154 WeakPolarHBondContact O-CB 3.44Å; A154-S156 VanDerWaalsContact C-N 3.34Å; A154-W158 VanDerWaalsContact O-CD1 3.29Å
155R63Low65.3Low212 Ų212125.1 Ų125.180%0.858%0.58SS**THydrogen-bonded Turntrans-71.2-24.9173.6-165.8171.5-176169.30.9113.4I153I153-R155 PolarHBondContact O-N 3.2Å
156S62.3Low64.9Low66 Ų66131.5 Ų131.546%0.46261%0.608SS.*THydrogen-bonded Turntrans-91.8-21-177.163.20000114.2I153 A154 W158 K159I153-S156 PolarHBondContact O-N 3.22Å; I153-S156 PolarHBondContact O-OG 3.21Å; A154-S156 VanDerWaalsContact C-N 3.34Å; S156-W158 VanDerWaalsContact C-N 3.33Å; S156-W158 PolarHBondContact O-N 2.76Å; S156-K159 PolarHBondContact O-N 3.1Å
157R59.3Low64.3Low195 Ų195130.8 Ų130.874%0.73661%0.613SS**G310 helixtrans-74.8-10.5-179.6-87.8-170.368-171.70.6116.2I153 K159I153-R157 PolarHBondContact O-N 3.4Å; R157-K159 VanDerWaalsContact C-N 3.29Å; R157-K159 PolarHBondContact O-N 2.88Å
158W53.2Low63.7Low223 Ų223137 Ų13785%0.84562%0.624SS**G310 helixtrans-85.67.7174.5-64.995.8000114.1A154 S156A154-W158 VanDerWaalsContact O-CD1 3.29Å; S156-W158 VanDerWaalsContact C-N 3.33Å; S156-W158 PolarHBondContact O-N 2.76Å
159K55.7Low63Low183 Ų183137.8 Ų137.880%0.79663%0.63SS**G310 helixtrans-116.73.7-178.2-78.2-167.7176.1-171.90115.3S156 R157S156-K159 PolarHBondContact O-N 3.1Å; R157-K159 VanDerWaalsContact C-N 3.29Å; R157-K159 PolarHBondContact O-N 2.88Å
160L49.2Very low62.2Low146 Ų146146.1 Ų146.176%0.76466%0.663SS**  trans-127.315-173.2-70.9169.8000114.5
161W53.2Low61.4Low293 Ų293151.9 Ų151.9100%1.1168%0.678SS**  trans-1430160.1-61.787.6000107.5

Retrieved 161 of 161 residues in 80.3 ms (Link to these results)

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