A0A060X1F7_ONCMY Loading...

ADP/ATP translocase

Catalyzes the exchange of ADP and ATP across the membrane.

AlphaFold DB , UniProt , Accession A0A060X1F7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene slc25a4, Length 298 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
1M57.8Low82.9Confident178 Ų17895.8 Ų95.888%0.87753%0.531SS*.  0134.10-91.5177.7-76.200107.3V5 V6 I9M1-V5 HydrophobicContact CB-CB 4.47Å; M1-V5 HydrophobicContact CB-CG1 4.41Å; M1-V5 HydrophobicContact CG-CG1 3.95Å; M1-V5 HydrophobicContact SD-CG1 3.9Å; M1-V6 HydrophobicContact CB-CG2 3.9Å; M1-I9 HydrophobicContact SD-CD1 3.99Å
2S81.8Confident83.2Confident73 Ų7392.4 Ų92.451%0.5151%0.506SS..  trans-65.8152.9173.859.20000110.6A4 V5 V6S2-A4 PolarHBondContact O-N 2.92Å; S2-A4 VanDerWaalsContact O-N 3.11Å; S2-V5 PolarHBondContact O-N 2.98Å; S2-V5 WeakPolarHBondContact OG-CG2 3.31Å; S2-V6 PolarHBondContact O-N 3.19Å
3D84.5Confident83.7Confident147 Ų14791.9 Ų91.979%0.78650%0.502SS*.Hα-helixtrans-55.2-32.3180-65.5-32.1000112.6V6 S7D3-V6 PolarHBondContact O-N 3.11Å; D3-S7 VanDerWaalsContact O-CB 3.31Å; D3-S7 WeakPolarHBondContact O-CB 3.41Å; D3-S7 PolarHBondContact O-N 2.88Å
4A83.2Confident84Confident73 Ų7387.1 Ų87.160%0.60348%0.481SS*.Hα-helixtrans-62.8-40.7174.400000113S2 F8S2-A4 PolarHBondContact O-N 2.92Å; S2-A4 VanDerWaalsContact O-N 3.11Å; A4-F8 WeakPolarHBondContact O-CB 3.29Å; A4-F8 PolarHBondContact O-N 3.4Å
5V86.4Confident84.2Confident62 Ų6282.8 Ų82.838%0.37646%0.464SS..Hα-helixtrans-69.4-41.3177.7173.70000110.5M1 S2 F8 I9M1-V5 HydrophobicContact CB-CB 4.47Å; M1-V5 HydrophobicContact CB-CG1 4.41Å; M1-V5 HydrophobicContact CG-CG1 3.95Å; M1-V5 HydrophobicContact SD-CG1 3.9Å; S2-V5 PolarHBondContact O-N 2.98Å; S2-V5 WeakPolarHBondContact OG-CG2 3.31Å; V5-F8 PolarHBondContact O-N 2.99Å; V5-I9 HydrophobicContact CG1-CD1 3.88Å; V5-I9 VanDerWaalsContact O-CG1 3.29Å; V5-I9 WeakPolarHBondContact O-CG1 3.27Å; V5-I9 PolarHBondContact O-N 3.35Å
6V86.6Confident84.5Confident48 Ų4877.7 Ų77.729%0.29144%0.436SS..Hα-helixtrans-64.4-44.9177.2177.10000110.8M1 S2 D3 I9 K10M1-V6 HydrophobicContact CB-CG2 3.9Å; S2-V6 PolarHBondContact O-N 3.19Å; D3-V6 PolarHBondContact O-N 3.11Å; V6-I9 PolarHBondContact O-N 2.98Å; V6-K10 HydrophobicContact CG1-CD 4.28Å; V6-K10 WeakPolarHBondContact O-CG 3.3Å; V6-K10 PolarHBondContact O-N 3.44Å
7S85.8Confident84.9Confident64 Ų6478.5 Ų78.545%0.44844%0.438SS..Hα-helixtrans-59.4-47.9176.1-171.70000111.5D3 I9 K10 D11D3-S7 VanDerWaalsContact O-CB 3.31Å; D3-S7 WeakPolarHBondContact O-CB 3.41Å; D3-S7 PolarHBondContact O-N 2.88Å; S7-I9 PolarHBondContact O-N 3.43Å; S7-K10 WeakPolarHBondContact O-CB 3.23Å; S7-K10 PolarHBondContact O-N 2.99Å; S7-D11 PolarHBondContact O-N 2.82Å
8F86.5Confident85.1Confident92 Ų9274.8 Ų74.840%0.40442%0.419SS..Hα-helixtrans-57.7-45.9176.3174.5-95.6000112.8A4 V5 K10 D11 F12 F89A4-F8 WeakPolarHBondContact O-CB 3.29Å; A4-F8 PolarHBondContact O-N 3.4Å; V5-F8 PolarHBondContact O-N 2.99Å; F8-K10 VanDerWaalsContact C-N 3.34Å; F8-K10 PolarHBondContact O-N 2.95Å; F8-D11 PolarHBondContact O-N 3.43Å; F8-F12 VanDerWaalsContact O-CB 3.24Å; F8-F12 WeakPolarHBondContact O-CB 3.23Å; F8-F12 PolarHBondContact O-N 3.33Å; F8-F89 HydrophobicContact CD2-CE2 4.44Å; F8-F89 AromaticContact CE2-CD2 3.88Å; F8-F89 HydrophobicContact CE2-CD2 3.88Å; F8-F89 AromaticContact CE2-CE2 3.76Å; F8-F89 HydrophobicContact CE2-CE2 3.76Å; F8-F89 HydrophobicContact CE2-CG 4.34Å; F8-F89 HydrophobicContact CE2-CZ 4.13Å; F8-F89 HydrophobicContact CZ-CD2 4.4Å; F8-F89 HydrophobicContact CZ-CE2 4.47Å; F8-F89 HydrophobicContact CZ-CG 4.42Å
9I88.4Confident85.3Confident70 Ų7071.6 Ų71.636%0.35940%0.403SS..Hα-helixtrans-63.6-42178.9-69.6168.4000110.5M1 V5 V6 S7 F12 L13M1-I9 HydrophobicContact SD-CD1 3.99Å; V5-I9 HydrophobicContact CG1-CD1 3.88Å; V5-I9 VanDerWaalsContact O-CG1 3.29Å; V5-I9 WeakPolarHBondContact O-CG1 3.27Å; V5-I9 PolarHBondContact O-N 3.35Å; V6-I9 PolarHBondContact O-N 2.98Å; S7-I9 PolarHBondContact O-N 3.43Å; I9-F12 PolarHBondContact O-N 2.95Å; I9-L13 HydrophobicContact CG2-CD1 3.77Å; I9-L13 HydrophobicContact CG2-CG 4.25Å; I9-L13 WeakPolarHBondContact O-CB 3.34Å; I9-L13 VanDerWaalsContact O-CG 3.27Å; I9-L13 WeakPolarHBondContact O-CG 3.36Å; I9-L13 PolarHBondContact O-N 3.38Å
10K87.1Confident85.6Confident138 Ų13869 Ų6960%0.639%0.391SS*.Hα-helixtrans-60-48.1176.7-75.3176.9178-1790111.4V6 S7 F8 L13 A14V6-K10 HydrophobicContact CG1-CD 4.28Å; V6-K10 WeakPolarHBondContact O-CG 3.3Å; V6-K10 PolarHBondContact O-N 3.44Å; S7-K10 WeakPolarHBondContact O-CB 3.23Å; S7-K10 PolarHBondContact O-N 2.99Å; F8-K10 VanDerWaalsContact C-N 3.34Å; F8-K10 PolarHBondContact O-N 2.95Å; K10-L13 PolarHBondContact O-N 3.18Å; K10-A14 VanDerWaalsContact O-CB 3.22Å; K10-A14 WeakPolarHBondContact O-CB 3.22Å; K10-A14 PolarHBondContact O-N 3.36Å
11D84.3Confident86Confident109 Ų10969.2 Ų69.258%0.58339%0.39SS*.Hα-helixtrans-65.3-40.9179.2-71.6-18.4000112.2S7 F8 A14 G15S7-D11 PolarHBondContact O-N 2.82Å; F8-D11 PolarHBondContact O-N 3.43Å; D11-A14 PolarHBondContact O-N 3.25Å; D11-G15 PolarHBondContact O-N 2.93Å
12F86.4Confident87.6Confident55 Ų5561.2 Ų61.224%0.24135%0.352CS..Hα-helixtrans-62.5-44.6177-179.5-101.6000112.1F8 I9 G16 F82 Q85F8-F12 VanDerWaalsContact O-CB 3.24Å; F8-F12 WeakPolarHBondContact O-CB 3.23Å; F8-F12 PolarHBondContact O-N 3.33Å; I9-F12 PolarHBondContact O-N 2.95Å; F12-G16 PolarHBondContact O-N 3.1Å; F12-F82 HydrophobicContact CD1-CD1 4.37Å; F12-F82 AromaticContact CE1-CD1 3.58Å; F12-F82 HydrophobicContact CE1-CD1 3.58Å; F12-F82 HydrophobicContact CE1-CE1 4.32Å; F12-F82 HydrophobicContact CZ-CB 4.06Å; F12-F82 AromaticContact CZ-CD1 3.78Å; F12-F82 HydrophobicContact CZ-CD1 3.78Å; F12-F82 HydrophobicContact CZ-CG 4.43Å; F12-Q85 HydrophobicContact CD2-CB 4.3Å; F12-Q85 HydrophobicContact CE2-CB 3.72Å
13L89.9Confident88Confident86 Ų8660 Ų6045%0.4534%0.337SS..Hα-helixtrans-69.7-44.5177.3-70.2175.6000111.8I9 K10 G15 G16 I17I9-L13 HydrophobicContact CG2-CD1 3.77Å; I9-L13 HydrophobicContact CG2-CG 4.25Å; I9-L13 WeakPolarHBondContact O-CB 3.34Å; I9-L13 VanDerWaalsContact O-CG 3.27Å; I9-L13 WeakPolarHBondContact O-CG 3.36Å; I9-L13 PolarHBondContact O-N 3.38Å; K10-L13 PolarHBondContact O-N 3.18Å; L13-G15 VanDerWaalsContact C-N 3.35Å; L13-G15 PolarHBondContact O-N 2.94Å; L13-G16 WeakPolarHBondContact O-CA 3.36Å; L13-G16 PolarHBondContact O-N 3.47Å; L13-G16 VanDerWaalsContact O-N 3.1Å; L13-I17 WeakPolarHBondContact O-CG1 3.47Å; L13-I17 PolarHBondContact O-N 3.23Å
14A87.2Confident88.5Confident25 Ų2555.4 Ų55.421%0.20732%0.315CS..Hα-helixtrans-60.2-45.9177.300000111.2K10 D11 G16 I17 A18K10-A14 VanDerWaalsContact O-CB 3.22Å; K10-A14 WeakPolarHBondContact O-CB 3.22Å; K10-A14 PolarHBondContact O-N 3.36Å; D11-A14 PolarHBondContact O-N 3.25Å; A14-G16 VanDerWaalsContact C-N 3.29Å; A14-G16 PolarHBondContact O-N 3.47Å; A14-I17 PolarHBondContact O-N 2.99Å; A14-A18 WeakPolarHBondContact O-CB 3.24Å; A14-A18 PolarHBondContact O-N 3.47Å
15G86.9Confident89.1Confident22 Ų2254.6 Ų54.623%0.22731%0.308CS..Hα-helixtrans-61.1-37.5173.800000112.7D11 L13 A19 Y81D11-G15 PolarHBondContact O-N 2.93Å; L13-G15 VanDerWaalsContact C-N 3.35Å; L13-G15 PolarHBondContact O-N 2.94Å; G15-A19 VanDerWaalsContact O-CB 3.23Å; G15-A19 WeakPolarHBondContact O-CB 3.27Å; G15-A19 PolarHBondContact O-N 3.49Å; G15-Y81 WeakPolarHBondContact CA-OH 3.49Å; G15-Y81 VanDerWaalsContact O-CZ 3.3Å; G15-Y81 PolarHBondContact O-OH 3.07Å
16G89.8Confident89.4Confident1 Ų152.2 Ų52.21%0.0129%0.293CS..Hα-helixtrans-65.5-44.1175.400000113.5F12 L13 A14 A19 A20 Y81F12-G16 PolarHBondContact O-N 3.1Å; L13-G16 WeakPolarHBondContact O-CA 3.36Å; L13-G16 PolarHBondContact O-N 3.47Å; L13-G16 VanDerWaalsContact O-N 3.1Å; A14-G16 VanDerWaalsContact C-N 3.29Å; A14-G16 PolarHBondContact O-N 3.47Å; G16-A19 PolarHBondContact O-N 3.44Å; G16-A20 WeakPolarHBondContact O-CB 3.44Å; G16-A20 PolarHBondContact O-N 3.34Å; G16-Y81 VanDerWaalsContact N-CE1 3.25Å
17I90.7Very high89.9Confident92 Ų9250.1 Ų50.147%0.47228%0.281SS..Hα-helixtrans-65.6-48.3176.9-67.5165.3000110.2L13 A14 A19 A20 I21L13-I17 WeakPolarHBondContact O-CG1 3.47Å; L13-I17 PolarHBondContact O-N 3.23Å; A14-I17 PolarHBondContact O-N 2.99Å; I17-A19 VanDerWaalsContact C-N 3.29Å; I17-A19 PolarHBondContact O-N 2.92Å; I17-A20 WeakPolarHBondContact O-CB 3.22Å; I17-A20 PolarHBondContact O-N 3.3Å; I17-A20 VanDerWaalsContact O-N 3.08Å; I17-I21 HydrophobicContact CG2-CD1 3.79Å; I17-I21 HydrophobicContact CG2-CG1 4.42Å; I17-I21 WeakPolarHBondContact O-CG1 3.43Å; I17-I21 PolarHBondContact O-N 2.9Å
18A88.9Confident90.4Very high12 Ų1248.5 Ų48.510%0.09927%0.269CS..Hα-helixtrans-57.1-44176.700000111.5A14 I21 S22 L288 Y291A14-A18 WeakPolarHBondContact O-CB 3.24Å; A14-A18 PolarHBondContact O-N 3.47Å; A18-I21 PolarHBondContact O-N 3.39Å; A18-S22 WeakPolarHBondContact O-CB 3.19Å; A18-S22 PolarHBondContact O-N 3.49Å; A18-L288 HydrophobicContact CB-CD2 4.14Å; A18-Y291 HydrophobicContact CB-CD1 3.76Å; A18-Y291 HydrophobicContact CB-CE1 3.6Å
19A88.9Confident90.8Very high13 Ų1345.6 Ų45.611%0.10726%0.257CS..Hα-helixtrans-65.8-38.5175.900000112.8G15 G16 I17 K23 Y81G15-A19 VanDerWaalsContact O-CB 3.23Å; G15-A19 WeakPolarHBondContact O-CB 3.27Å; G15-A19 PolarHBondContact O-N 3.49Å; G16-A19 PolarHBondContact O-N 3.44Å; I17-A19 VanDerWaalsContact C-N 3.29Å; I17-A19 PolarHBondContact O-N 2.92Å; A19-K23 VanDerWaalsContact O-CB 3.3Å; A19-K23 WeakPolarHBondContact O-CB 3.39Å; A19-K23 WeakPolarHBondContact O-CG 3.49Å; A19-K23 PolarHBondContact O-N 3.03Å; A19-Y81 HydrophobicContact CB-CD2 3.23Å; A19-Y81 HydrophobicContact CB-CE2 3.49Å; A19-Y81 VanDerWaalsContact CB-CE2 3.49Å; A19-Y81 HydrophobicContact CB-CG 3.82Å
20A91.9Very high91.2Very high20 Ų2042.7 Ų42.717%0.16524%0.242CC..Hα-helixtrans-64.2-44.9176.700000111.5G16 I17 T24 V78G16-A20 WeakPolarHBondContact O-CB 3.44Å; G16-A20 PolarHBondContact O-N 3.34Å; I17-A20 WeakPolarHBondContact O-CB 3.22Å; I17-A20 PolarHBondContact O-N 3.3Å; I17-A20 VanDerWaalsContact O-N 3.08Å; A20-T24 VanDerWaalsContact O-CB 3.22Å; A20-T24 WeakPolarHBondContact O-CB 3.17Å; A20-T24 PolarHBondContact O-N 3.45Å; A20-T24 PolarHBondContact O-OG1 3.38Å; A20-V78 HydrophobicContact CB-CB 4.45Å; A20-V78 HydrophobicContact CB-CG1 3.73Å; A20-V78 HydrophobicContact CB-CG2 4.13Å
21I92.4Very high91.7Very high74 Ų7436.2 Ų36.238%0.37921%0.214SC..Hα-helixtrans-61.9-54.5177.1-67.3167.7000110I17 A18 K23 T24 A25 V287 Y291I17-I21 HydrophobicContact CG2-CD1 3.79Å; I17-I21 HydrophobicContact CG2-CG1 4.42Å; I17-I21 WeakPolarHBondContact O-CG1 3.43Å; I17-I21 PolarHBondContact O-N 2.9Å; A18-I21 PolarHBondContact O-N 3.39Å; I21-K23 PolarHBondContact O-N 3.41Å; I21-T24 PolarHBondContact O-N 2.96Å; I21-T24 VanDerWaalsContact O-N 3.14Å; I21-A25 WeakPolarHBondContact O-CB 3.4Å; I21-A25 PolarHBondContact O-N 2.85Å; I21-V287 HydrophobicContact CG2-CG1 4.17Å; I21-Y291 HydrophobicContact CD1-CD2 3.93Å; I21-Y291 HydrophobicContact CD1-CE2 3.68Å
22S90.9Very high92.3Very high10 Ų1031 Ų317%0.0719%0.186CC..Hα-helixtrans-56.6-47-179.8173.20000112A18 T24 A25 V26 G284A18-S22 WeakPolarHBondContact O-CB 3.19Å; A18-S22 PolarHBondContact O-N 3.49Å; S22-T24 PolarHBondContact O-N 2.75Å; S22-A25 PolarHBondContact O-N 3.16Å; S22-V26 WeakPolarHBondContact O-CG2 3.32Å; S22-V26 PolarHBondContact O-N 3.18Å; S22-G284 WeakPolarHBondContact OG-CA 3.43Å; S22-G284 PolarHBondContact OG-O 2.92Å
23K91.2Very high92.7Very high48 Ų4828.9 Ų28.921%0.20918%0.177CC..Hα-helixtrans-66.2-36.2178.6-71.5-174.9-166.3-51.70112.9A19 I21 A27 N77A19-K23 VanDerWaalsContact O-CB 3.3Å; A19-K23 WeakPolarHBondContact O-CB 3.39Å; A19-K23 WeakPolarHBondContact O-CG 3.49Å; A19-K23 PolarHBondContact O-N 3.03Å; I21-K23 PolarHBondContact O-N 3.41Å; K23-A27 WeakPolarHBondContact O-CB 3.48Å; K23-A27 PolarHBondContact O-N 3.38Å; K23-N77 HydrophobicContact CB-CB 4.17Å; K23-N77 HydrophobicContact CD-CB 3.79Å; K23-N77 WeakPolarHBondContact CD-O 3.38Å
24T95.3Very high93.1Very high50 Ų5025 Ų2531%0.30716%0.156SC..Hα-helixtrans-71-38.7178.4-58.50000111.2A20 I21 S22 V26 A27 W71 N74A20-T24 VanDerWaalsContact O-CB 3.22Å; A20-T24 WeakPolarHBondContact O-CB 3.17Å; A20-T24 PolarHBondContact O-N 3.45Å; A20-T24 PolarHBondContact O-OG1 3.38Å; I21-T24 PolarHBondContact O-N 2.96Å; I21-T24 VanDerWaalsContact O-N 3.14Å; S22-T24 PolarHBondContact O-N 2.75Å; T24-V26 VanDerWaalsContact C-N 3.33Å; T24-V26 PolarHBondContact O-N 3.03Å; T24-A27 WeakPolarHBondContact O-CB 3.48Å; T24-A27 PolarHBondContact O-N 2.94Å; T24-W71 PolarHBondContact O-NE1 3.48Å; T24-N74 PolarHBondContact OG1-ND2 3.37Å
25A94.7Very high93.5Very high55 Ų5523.9 Ų23.946%0.45515%0.147SC..Hα-helixtrans-61.4-40.6175.800000112.1I21 S22 V287I21-A25 WeakPolarHBondContact O-CB 3.4Å; I21-A25 PolarHBondContact O-N 2.85Å; S22-A25 PolarHBondContact O-N 3.16Å; A25-V287 HydrophobicContact CB-CG1 4.17Å; A25-V287 HydrophobicContact CB-CG2 3.86Å
26V94.4Very high94Very high13 Ų1323.6 Ų23.68%0.07914%0.14CC..Hα-helixtrans-93.91.5179.6-54.60000114.7S22 T24 P28 I29 E30 R280S22-V26 WeakPolarHBondContact O-CG2 3.32Å; S22-V26 PolarHBondContact O-N 3.18Å; T24-V26 VanDerWaalsContact C-N 3.33Å; T24-V26 PolarHBondContact O-N 3.03Å; V26-P28 VanDerWaalsContact C-CD 3.42Å; V26-P28 VanDerWaalsContact C-N 3.34Å; V26-I29 HydrophobicContact CB-CG2 4.05Å; V26-I29 WeakPolarHBondContact O-CG2 3.26Å; V26-I29 PolarHBondContact O-N 3.25Å; V26-E30 WeakPolarHBondContact O-CB 3.41Å; V26-E30 PolarHBondContact O-N 2.91Å; V26-R280 HydrophobicContact CB-CG 4.05Å; V26-R280 HydrophobicContact CG2-CG 3.87Å
27A95.5Very high94.3Very high4 Ų423.6 Ų23.63%0.03314%0.14CC..Hα-helixtrans-56.1-39.4179.200000113.5K23 T24 E30 R31 W71 N74K23-A27 WeakPolarHBondContact O-CB 3.48Å; K23-A27 PolarHBondContact O-N 3.38Å; T24-A27 WeakPolarHBondContact O-CB 3.48Å; T24-A27 PolarHBondContact O-N 2.94Å; A27-E30 PolarHBondContact O-N 3.22Å; A27-R31 PolarHBondContact O-N 3.06Å; A27-W71 VanDerWaalsContact CB-CD1 3.49Å; A27-W71 HydrophobicContact CB-CG 4.27Å; A27-N74 HydrophobicContact CB-CB 4.16Å
28P97Very high94.5Very high29 Ų2919.2 Ų19.219%0.18812%0.118CC..Hα-helixtrans-58.5-51.2177.1-25.735.1000113.6V26 E30 R31 V32 F70 W71V26-P28 VanDerWaalsContact C-CD 3.42Å; V26-P28 VanDerWaalsContact C-N 3.34Å; P28-E30 VanDerWaalsContact C-N 3.3Å; P28-E30 PolarHBondContact O-N 3Å; P28-R31 PolarHBondContact O-N 3.17Å; P28-V32 WeakPolarHBondContact O-CG2 3.29Å; P28-V32 PolarHBondContact O-N 2.73Å; P28-V32 VanDerWaalsContact O-N 3.12Å; P28-F70 HydrophobicContact CB-CB 3.83Å; P28-F70 HydrophobicContact CB-CD1 3.82Å; P28-F70 HydrophobicContact CB-CG 3.85Å; P28-F70 HydrophobicContact CG-CB 3.97Å; P28-F70 HydrophobicContact CG-CG 4.41Å; P28-W71 HydrophobicContact CG-CH2 4Å; P28-W71 HydrophobicContact CG-CZ2 3.64Å
29I95.9Very high94.7Very high31 Ų3119.1 Ų19.116%0.15912%0.115CC..Hα-helixtrans-69.4-31.1179.5-173.560.3000111.6V26 V32 K33 I54 I279 R280V26-I29 HydrophobicContact CB-CG2 4.05Å; V26-I29 WeakPolarHBondContact O-CG2 3.26Å; V26-I29 PolarHBondContact O-N 3.25Å; I29-V32 HydrophobicContact CD1-CB 4.41Å; I29-V32 PolarHBondContact O-N 3.46Å; I29-K33 PolarHBondContact O-N 3.01Å; I29-I54 HydrophobicContact CD1-CG2 4.04Å; I29-I279 HydrophobicContact CG1-CB 4.32Å; I29-I279 HydrophobicContact CG1-CG2 4.06Å; I29-R280 HydrophobicContact CG2-CB 3.9Å; I29-R280 HydrophobicContact CG2-CG 4.19Å
30E95.4Very high94.9Very high9 Ų921.7 Ų21.74%0.04213%0.125CC..Hα-helixtrans-69.8-33.9175.2-163.9160.5-163.100112.5V26 A27 P28 K33 L34 R138 R280V26-E30 WeakPolarHBondContact O-CB 3.41Å; V26-E30 PolarHBondContact O-N 2.91Å; A27-E30 PolarHBondContact O-N 3.22Å; P28-E30 VanDerWaalsContact C-N 3.3Å; P28-E30 PolarHBondContact O-N 3Å; E30-K33 WeakPolarHBondContact O-CB 3.37Å; E30-K33 PolarHBondContact O-N 3.43Å; E30-L34 WeakPolarHBondContact O-CG 3.21Å; E30-L34 PolarHBondContact O-N 2.89Å; E30-R138 VanDerWaalsContact CD-NH1 3.27Å; E30-R138 IonicContact OE1-CZ 3.32Å; E30-R138 VanDerWaalsContact OE1-CZ 3.27Å; E30-R138 IonicContact OE1-NH1 3.27Å; E30-R138 PolarHBondContact OE1-NH1 3.05Å; E30-R138 IonicContact OE1-NH2 3.16Å; E30-R138 PolarHBondContact OE1-NH2 3.26Å; E30-R138 VanDerWaalsContact OE1-NH2 3.11Å; E30-R138 IonicContact OE2-CZ 3.96Å; E30-R138 IonicContact OE2-NH1 3.49Å; E30-R138 IonicContact OE2-NH2 3.74Å; E30-R138 PolarHBondContact OE2-NH2 3.34Å; E30-R280 HydrophobicContact CB-CG 3.96Å; E30-R280 VanDerWaalsContact CG-CD 3.41Å; E30-R280 HydrophobicContact CG-CG 4.24Å; E30-R280 WeakPolarHBondContact OE1-CD 3.19Å; E30-R280 IonicContact OE1-CZ 2.83Å; E30-R280 IonicContact OE1-NE 2.65Å; E30-R280 IonicContact OE1-NH1 3.56Å; E30-R280 PolarHBondContact OE1-NH1 3.35Å; E30-R280 VanDerWaalsContact OE1-NH1 3.16Å
31R97Very high94.8Very high3 Ų320.8 Ų20.81%0.01112%0.117CC..Hα-helixtrans-65.8-44.2171.5-171.5176.9-177.3-132.2-1.5111.2A27 P28 K33 L34 L35 I61 S69 F70 A142 D144A27-R31 PolarHBondContact O-N 3.06Å; P28-R31 PolarHBondContact O-N 3.17Å; R31-K33 VanDerWaalsContact C-N 3.31Å; R31-K33 PolarHBondContact O-N 3.46Å; R31-L34 PolarHBondContact O-N 3.28Å; R31-L34 VanDerWaalsContact O-N 3.17Å; R31-L35 HydrophobicContact CG-CD1 4.1Å; R31-L35 HydrophobicContact CG-CG 4.48Å; R31-L35 WeakPolarHBondContact O-CG 3.43Å; R31-L35 PolarHBondContact O-N 3.26Å; R31-I61 VanDerWaalsContact NH1-CG2 3.27Å; R31-S69 WeakPolarHBondContact CD-O 3.17Å; R31-S69 PolarHBondContact NE-O 3.3Å; R31-S69 VanDerWaalsContact NH1-C 3.27Å; R31-S69 PolarHBondContact NH1-O 2.9Å; R31-S69 PolarHBondContact NH1-OG 2.88Å; R31-F70 WeakPolarHBondContact CD-O 3.09Å; R31-A142 HydrophobicContact CG-CB 4.33Å; R31-A142 PolarHBondContact NE-O 2.9Å; R31-D144 PolarHBondContact NH2-O 3.24Å; R31-D144 VanDerWaalsContact NH2-O 3.11Å
32V96.9Very high94.8Very high0 Ų018.1 Ų18.10%011%0.105CC..Hα-helixtrans-58-44.6174.5172.50000111.1P28 I29 L34 L35 L36 I54 C57 V58 I61 F70P28-V32 WeakPolarHBondContact O-CG2 3.29Å; P28-V32 PolarHBondContact O-N 2.73Å; P28-V32 VanDerWaalsContact O-N 3.12Å; I29-V32 HydrophobicContact CD1-CB 4.41Å; I29-V32 PolarHBondContact O-N 3.46Å; V32-L34 PolarHBondContact O-N 3.29Å; V32-L35 PolarHBondContact O-N 2.87Å; V32-L36 HydrophobicContact CG1-CD1 3.93Å; V32-L36 HydrophobicContact CG1-CG 4.39Å; V32-L36 WeakPolarHBondContact O-CG 3.45Å; V32-L36 PolarHBondContact O-N 3Å; V32-I54 HydrophobicContact CG1-CB 4.29Å; V32-I54 HydrophobicContact CG1-CG1 4.3Å; V32-I54 HydrophobicContact CG1-CG2 4.07Å; V32-C57 HydrophobicContact CG1-CB 3.84Å; V32-C57 HydrophobicContact CG2-CB 4.21Å; V32-V58 HydrophobicContact CG2-CG2 3.82Å; V32-I61 HydrophobicContact CG2-CD1 4.03Å; V32-F70 HydrophobicContact CG2-CE1 4.39Å
33K96.6Very high94.7Very high10 Ų1022.5 Ų22.54%0.04312%0.124CC..Hα-helixtrans-52.4-55.4172.9178-148.3162.2173.10110.7I29 E30 R31 L35 L36 Q37 Y229 D232 N277I29-K33 PolarHBondContact O-N 3.01Å; E30-K33 WeakPolarHBondContact O-CB 3.37Å; E30-K33 PolarHBondContact O-N 3.43Å; R31-K33 VanDerWaalsContact C-N 3.31Å; R31-K33 PolarHBondContact O-N 3.46Å; K33-L35 PolarHBondContact O-N 3.46Å; K33-L36 PolarHBondContact O-N 3.49Å; K33-Q37 VanDerWaalsContact O-CB 3.25Å; K33-Q37 WeakPolarHBondContact O-CB 3.44Å; K33-Q37 PolarHBondContact O-N 3.49Å; K33-Y229 VanDerWaalsContact CE-OH 3.25Å; K33-Y229 WeakPolarHBondContact CE-OH 3.38Å; K33-D232 IonicContact NZ-OD2 3.49Å; K33-D232 PolarHBondContact NZ-OD2 2.92Å; K33-N277 HydrophobicContact CD-CB 3.78Å; K33-N277 WeakPolarHBondContact CE-OD1 3.41Å; K33-N277 HydrophobicContact CG-CB 4.09Å; K33-N277 PolarHBondContact NZ-OD1 2.87Å
34L96.8Very high94.6Very high4 Ų422.6 Ų22.62%0.02113%0.126CC..Hα-helixtrans-62.6-44-175.5-72170000111.5E30 R31 V32 Q37 V38 A142 R236E30-L34 WeakPolarHBondContact O-CG 3.21Å; E30-L34 PolarHBondContact O-N 2.89Å; R31-L34 PolarHBondContact O-N 3.28Å; R31-L34 VanDerWaalsContact O-N 3.17Å; V32-L34 PolarHBondContact O-N 3.29Å; L34-Q37 PolarHBondContact O-N 2.91Å; L34-V38 WeakPolarHBondContact O-CG2 2.95Å; L34-V38 PolarHBondContact O-N 2.97Å; L34-A142 HydrophobicContact CB-CB 4.1Å; L34-A142 HydrophobicContact CD1-CB 3.5Å; L34-A142 VanDerWaalsContact CD1-CB 3.5Å; L34-A142 HydrophobicContact CG-CB 4.45Å; L34-R236 HydrophobicContact CD2-CG 4.41Å
35L96.8Very high94.4Very high1 Ų120.8 Ų20.81%0.00511%0.114CC..Hα-helixtrans-59.1-51.1176.6-75.2168.2000111.3R31 V32 K33 Q37 V38 Q39 Y51 I61 A142 I145R31-L35 HydrophobicContact CG-CD1 4.1Å; R31-L35 HydrophobicContact CG-CG 4.48Å; R31-L35 WeakPolarHBondContact O-CG 3.43Å; R31-L35 PolarHBondContact O-N 3.26Å; V32-L35 PolarHBondContact O-N 2.87Å; K33-L35 PolarHBondContact O-N 3.46Å; L35-Q37 PolarHBondContact O-N 3.5Å; L35-V38 PolarHBondContact O-N 2.85Å; L35-Q39 WeakPolarHBondContact O-CA 3.44Å; L35-Q39 WeakPolarHBondContact O-CB 3.35Å; L35-Q39 WeakPolarHBondContact O-CG 3.22Å; L35-Q39 PolarHBondContact O-N 2.86Å; L35-Y51 HydrophobicContact CB-CD2 4.28Å; L35-Y51 HydrophobicContact CB-CE2 4.33Å; L35-Y51 HydrophobicContact CD1-CE2 4.09Å; L35-Y51 HydrophobicContact CD2-CE2 4.27Å; L35-Y51 HydrophobicContact CG-CE2 4.48Å; L35-I61 HydrophobicContact CD1-CD1 3.7Å; L35-I61 HydrophobicContact CD1-CG1 4.14Å; L35-A142 WeakPolarHBondContact CD2-O 3.26Å; L35-I145 HydrophobicContact CD2-CG2 3.72Å
36L95.9Very high94.2Very high17 Ų1721.4 Ų21.49%0.08911%0.112CC..Hα-helixtrans-59.8-36.8178.1-68.3174.4000112.4V32 K33 I54V32-L36 HydrophobicContact CG1-CD1 3.93Å; V32-L36 HydrophobicContact CG1-CG 4.39Å; V32-L36 WeakPolarHBondContact O-CG 3.45Å; V32-L36 PolarHBondContact O-N 3Å; K33-L36 PolarHBondContact O-N 3.49Å; L36-I54 HydrophobicContact CD1-CG1 3.95Å
37Q96.1Very high93.9Very high0 Ų028.9 Ų28.90%014%0.143CC..Hα-helixtrans-71.8-40.4-178-168.8175.527.700112.6K33 L34 L35 Y229 D232 T233 R237 K272K33-Q37 VanDerWaalsContact O-CB 3.25Å; K33-Q37 WeakPolarHBondContact O-CB 3.44Å; K33-Q37 PolarHBondContact O-N 3.49Å; L34-Q37 PolarHBondContact O-N 2.91Å; L35-Q37 PolarHBondContact O-N 3.5Å; Q37-Y229 PolarHBondContact NE2-OH 3.33Å; Q37-D232 PolarHBondContact NE2-OD2 2.91Å; Q37-D232 PolarHBondContact OE1-OD2 3.36Å; Q37-T233 HydrophobicContact CG-CG2 4.2Å; Q37-T233 VanDerWaalsContact NE2-CA 3.29Å; Q37-T233 PolarHBondContact NE2-OG1 2.95Å; Q37-R237 PolarHBondContact O-NE 3.16Å; Q37-R237 PolarHBondContact O-NH2 3.11Å; Q37-K272 WeakPolarHBondContact CB-O 3.41Å
38V95.2Very high93.6Very high1 Ų136 Ų361%0.00618%0.176CC..Hα-helixtrans-111.8-7.3-171.7-57.70000116.1L34 L35 H40 A41 S42 A143 R236 M240L34-V38 WeakPolarHBondContact O-CG2 2.95Å; L34-V38 PolarHBondContact O-N 2.97Å; L35-V38 PolarHBondContact O-N 2.85Å; V38-H40 PolarHBondContact O-N 3.47Å; V38-H40 VanDerWaalsContact O-N 3.11Å; V38-A41 CarbonylContact O-C 3.41Å; V38-A41 WeakPolarHBondContact O-CA 3.43Å; V38-A41 WeakPolarHBondContact O-CB 3.37Å; V38-A41 PolarHBondContact O-N 3.41Å; V38-S42 PolarHBondContact O-N 2.62Å; V38-A143 HydrophobicContact CG2-CB 3.67Å; V38-R236 HydrophobicContact CG1-CB 3.45Å; V38-R236 VanDerWaalsContact CG1-CB 3.45Å; V38-M240 HydrophobicContact CB-CG 3.9Å; V38-M240 HydrophobicContact CB-SD 4.32Å; V38-M240 HydrophobicContact CG1-CG 4.18Å; V38-M240 HydrophobicContact CG2-CG 4.32Å; V38-M240 HydrophobicContact CG2-SD 4.09Å
39Q94.6Very high93.3Very high10 Ų1038.5 Ų38.55%0.04719%0.186CC..G310 helixtrans-55.2-33-176.156.8-179.3-26.400114.6L35 A41 S42 I45 Q50 Y51L35-Q39 WeakPolarHBondContact O-CA 3.44Å; L35-Q39 WeakPolarHBondContact O-CB 3.35Å; L35-Q39 WeakPolarHBondContact O-CG 3.22Å; L35-Q39 PolarHBondContact O-N 2.86Å; Q39-A41 PolarHBondContact O-N 2.87Å; Q39-S42 WeakPolarHBondContact O-CB 3.29Å; Q39-S42 PolarHBondContact O-N 3.25Å; Q39-I45 HydrophobicContact CB-CD1 3.67Å; Q39-I45 HydrophobicContact CB-CG2 4.41Å; Q39-Q50 HydrophobicContact CG-CG 4.47Å; Q39-Q50 VanDerWaalsContact OE1-CA 3.3Å; Q39-Y51 PolarHBondContact NE2-O 3.1Å; Q39-Y51 VanDerWaalsContact NE2-O 3.14Å
40H91.6Very high93.2Very high67 Ų6739.2 Ų39.231%0.3119%0.189SC..G310 helixtrans-64.6-21.8176.5-169.180000112.5V38 E265V38-H40 PolarHBondContact O-N 3.47Å; V38-H40 VanDerWaalsContact O-N 3.11Å; H40-E265 IonicContact CD2-OE1 3.64Å; H40-E265 PolarHBondContact CD2-OE1 3.02Å; H40-E265 VanDerWaalsContact CD2-OE1 3.24Å; H40-E265 IonicContact CD2-OE2 2.64Å; H40-E265 IonicContact CG-OE1 3.45Å; H40-E265 IonicContact CG-OE2 3.29Å; H40-E265 IonicContact NE2-OE1 3.58Å
41A90.9Very high93.2Very high0 Ų039.2 Ų39.20%019%0.188CC..G310 helixtrans-105.421.1175.400000112.2V38 Q39 M240 R244 M250 Y251V38-A41 CarbonylContact O-C 3.41Å; V38-A41 WeakPolarHBondContact O-CA 3.43Å; V38-A41 WeakPolarHBondContact O-CB 3.37Å; V38-A41 PolarHBondContact O-N 3.41Å; Q39-A41 PolarHBondContact O-N 2.87Å; A41-M240 HydrophobicContact CB-CB 4.24Å; A41-M240 HydrophobicContact CB-CG 4.44Å; A41-R244 PolarHBondContact O-NH2 2.91Å; A41-M250 HydrophobicContact CB-CE 3.27Å; A41-M250 HydrophobicContact CB-SD 4.45Å; A41-Y251 HydrophobicContact CB-CE2 4.24Å
42S91.3Very high93Very high18 Ų1848.3 Ų48.313%0.12623%0.228CC..  trans-90.6148175.1-178.10000111.2V38 Q39 Q44 I45V38-S42 PolarHBondContact O-N 2.62Å; Q39-S42 WeakPolarHBondContact O-CB 3.29Å; Q39-S42 PolarHBondContact O-N 3.25Å; S42-Q44 PolarHBondContact OG-N 3.4Å; S42-Q44 VanDerWaalsContact OG-N 3.16Å; S42-I45 PolarHBondContact OG-N 2.9Å
43Q89.3Confident92.9Very high102 Ų10249.4 Ų49.448%0.47724%0.239SC..SBendtrans-85.5-19.9169.5-69.5-174.7-57.900112.4D248Q43-D248 PolarHBondContact NE2-OD2 3.26Å
44Q89.7Confident92.8Very high51 Ų5151.1 Ų51.124%0.23825%0.248CC..SBendtrans-89.9-22.1-179.8-66169.1-4100112.6S42 M49 D144 I145 E151S42-Q44 PolarHBondContact OG-N 3.4Å; S42-Q44 VanDerWaalsContact OG-N 3.16Å; Q44-M49 WeakPolarHBondContact O-CE 3.39Å; Q44-D144 PolarHBondContact NE2-OD1 2.95Å; Q44-D144 PolarHBondContact OE1-OD1 3.28Å; Q44-I145 HydrophobicContact CB-CD1 3.86Å; Q44-I145 HydrophobicContact CB-CG1 3.52Å; Q44-I145 HydrophobicContact CG-CG1 4.36Å; Q44-E151 PolarHBondContact NE2-O 3.16Å
45I91Very high92.7Very high11 Ų1156.2 Ų56.26%0.05627%0.273CS..  trans-103.1104.5-175.4-56.2169.4000109.3Q39 S42 M49 Q50 Y51 I145Q39-I45 HydrophobicContact CB-CD1 3.67Å; Q39-I45 HydrophobicContact CB-CG2 4.41Å; S42-I45 PolarHBondContact OG-N 2.9Å; I45-M49 HydrophobicContact CG2-CB 4.16Å; I45-Q50 HydrophobicContact CG2-CB 4.46Å; I45-Q50 HydrophobicContact CG2-CG 3.78Å; I45-Y51 HydrophobicContact CD1-CE2 4.44Å; I45-I145 HydrophobicContact CD1-CD1 4.34Å; I45-I145 HydrophobicContact CD1-CG1 4.49Å; I45-I145 HydrophobicContact CD1-CG2 3.96Å; I45-I145 HydrophobicContact CG1-CD1 3.44Å; I45-I145 VanDerWaalsContact CG1-CD1 3.44Å; I45-I145 HydrophobicContact CG1-CG1 3.92Å; I45-I145 HydrophobicContact CG1-CG2 4.28Å
46T90.1Very high92.7Very high69 Ų6958.3 Ų58.342%0.42328%0.284SS..  trans-70.7167.2168.870.60000110.8E48 M49 Q50T46-E48 WeakPolarHBondContact CB-OE2 3.41Å; T46-E48 PolarHBondContact O-N 2.86Å; T46-E48 PolarHBondContact OG1-OE2 3.14Å; T46-M49 HydrophobicContact CG2-CE 3.85Å; T46-M49 PolarHBondContact O-N 3.35Å; T46-M49 VanDerWaalsContact O-N 3.1Å; T46-Q50 PolarHBondContact O-N 3.38Å
47K88Confident92.6Very high169 Ų16957.5 Ų57.574%0.73528%0.28SS*.G310 helixtrans-59.1-34.4-176.5-171.3178.1177.7-176.10112.4
48E89.2Confident92.5Very high153 Ų15360.2 Ų60.272%0.71530%0.297SS*.G310 helixtrans-75.1-28.9-179.2-52.568.5-140.900111.8T46T46-E48 WeakPolarHBondContact CB-OE2 3.41Å; T46-E48 PolarHBondContact O-N 2.86Å; T46-E48 PolarHBondContact OG1-OE2 3.14Å
49M90.9Very high92.6Very high82 Ų8268.2 Ų68.240%0.40433%0.327SS..G310 helixtrans-85.6-7.6-179.9-68-164-70.200113.6Q44 I45 T46 Y51 R60Q44-M49 WeakPolarHBondContact O-CE 3.39Å; I45-M49 HydrophobicContact CG2-CB 4.16Å; T46-M49 HydrophobicContact CG2-CE 3.85Å; T46-M49 PolarHBondContact O-N 3.35Å; T46-M49 VanDerWaalsContact O-N 3.1Å; M49-Y51 PolarHBondContact O-N 3.29Å; M49-R60 PolarHBondContact O-NH1 2.84Å; M49-R60 PolarHBondContact O-NH2 3.42Å
50Q94.1Very high92.7Very high46 Ų4670.3 Ų70.322%0.21534%0.335CS..  trans-56.8136.1-178.3-71.7-179.31200111.8Q39 I45 T46 K52 R60Q39-Q50 HydrophobicContact CG-CG 4.47Å; Q39-Q50 VanDerWaalsContact OE1-CA 3.3Å; I45-Q50 HydrophobicContact CG2-CB 4.46Å; I45-Q50 HydrophobicContact CG2-CG 3.78Å; T46-Q50 PolarHBondContact O-N 3.38Å; Q50-K52 PolarHBondContact O-N 3.41Å; Q50-R60 PolarHBondContact O-NH1 2.99Å
51Y95.2Very high92.9Very high9 Ų967.1 Ų67.14%0.03532%0.32CS..  trans-68.6128.5175.2-59.4-68.8000110L35 Q39 I45 M49 G53 D56 C57 R60 E64L35-Y51 HydrophobicContact CB-CD2 4.28Å; L35-Y51 HydrophobicContact CB-CE2 4.33Å; L35-Y51 HydrophobicContact CD1-CE2 4.09Å; L35-Y51 HydrophobicContact CD2-CE2 4.27Å; L35-Y51 HydrophobicContact CG-CE2 4.48Å; Q39-Y51 PolarHBondContact NE2-O 3.1Å; Q39-Y51 VanDerWaalsContact NE2-O 3.14Å; I45-Y51 HydrophobicContact CD1-CE2 4.44Å; M49-Y51 PolarHBondContact O-N 3.29Å; Y51-G53 VanDerWaalsContact C-N 3.28Å; Y51-G53 PolarHBondContact O-N 2.81Å; Y51-D56 WeakPolarHBondContact CA-OD2 3.49Å; Y51-C57 HydrophobicContact CD1-CB 4.12Å; Y51-C57 HydrophobicContact CG-CB 4.05Å; Y51-R60 HydrophobicContact CD1-CB 4.3Å; Y51-R60 HydrophobicContact CE1-CB 3.82Å; Y51-E64 PolarHBondContact OH-OE2 3.44Å
52K93.6Very high93.1Very high195 Ų19569 Ų6985%0.84833%0.332SS*.  trans-75.9-18-175.7-60.3-178.4-178.3178.60113.2Q50 D56Q50-K52 PolarHBondContact O-N 3.41Å; K52-D56 HydrophobicContact CB-CB 4.21Å; K52-D56 PolarHBondContact N-OD2 3.34Å
53G93.6Very high93.2Very high22 Ų2276.8 Ų76.823%0.22736%0.363CS..SBendtrans169.1-170.3-179.500000112.2Y51 D56 C57Y51-G53 VanDerWaalsContact C-N 3.28Å; Y51-G53 PolarHBondContact O-N 2.81Å; G53-D56 PolarHBondContact O-N 3.35Å; G53-C57 VanDerWaalsContact O-CB 3.31Å; G53-C57 WeakPolarHBondContact O-CB 3.41Å; G53-C57 PolarHBondContact O-N 2.96Å
54I94Very high93.4Very high46 Ų4674.2 Ų74.224%0.23635%0.352CS..Hα-helixtrans-59.9-51.7-175.1-59.6178000111.1I29 V32 L36 D56 C57 V58 S276 I279I29-I54 HydrophobicContact CD1-CG2 4.04Å; V32-I54 HydrophobicContact CG1-CB 4.29Å; V32-I54 HydrophobicContact CG1-CG1 4.3Å; V32-I54 HydrophobicContact CG1-CG2 4.07Å; L36-I54 HydrophobicContact CD1-CG1 3.95Å; I54-D56 VanDerWaalsContact C-N 3.35Å; I54-D56 PolarHBondContact O-N 2.9Å; I54-C57 WeakPolarHBondContact O-CB 3.28Å; I54-C57 PolarHBondContact O-N 3.42Å; I54-V58 HydrophobicContact CG2-CG2 4.31Å; I54-V58 WeakPolarHBondContact O-CG2 3.34Å; I54-V58 PolarHBondContact O-N 3.4Å; I54-S276 WeakPolarHBondContact CD1-OG 3.31Å; I54-S276 VanDerWaalsContact CG1-OG 3.26Å; I54-S276 WeakPolarHBondContact CG1-OG 3.47Å; I54-I279 HydrophobicContact CD1-CD1 4.26Å
55M95.6Very high93.5Very high111 Ų11172.7 Ų72.755%0.54734%0.344SS..Hα-helixtrans-65.4-39.1-175.7-170.358.864.600112.3R59M55-R59 WeakPolarHBondContact O-CB 3.4Å; M55-R59 VanDerWaalsContact O-CG 3.28Å; M55-R59 WeakPolarHBondContact O-CG 3.34Å; M55-R59 PolarHBondContact O-N 2.78Å; M55-R59 HydrophobicContact SD-CG 4.48Å
56D96Very high93.7Very high45 Ų4573.8 Ų73.824%0.24136%0.358CS..Hα-helixtrans-61.1-47174.1-174.555.9000110.8Y51 K52 G53 I54 R59 R60Y51-D56 WeakPolarHBondContact CA-OD2 3.49Å; K52-D56 HydrophobicContact CB-CB 4.21Å; K52-D56 PolarHBondContact N-OD2 3.34Å; G53-D56 PolarHBondContact O-N 3.35Å; I54-D56 VanDerWaalsContact C-N 3.35Å; I54-D56 PolarHBondContact O-N 2.9Å; D56-R59 PolarHBondContact O-N 3.32Å; D56-R60 VanDerWaalsContact O-CB 3.26Å; D56-R60 WeakPolarHBondContact O-CB 3.27Å; D56-R60 VanDerWaalsContact O-CG 3.28Å; D56-R60 WeakPolarHBondContact O-CG 3.48Å; D56-R60 PolarHBondContact O-N 3.49Å; D56-R60 WeakPolarHBondContact OD1-CD 3.27Å; D56-R60 WeakPolarHBondContact OD2-CD 3.39Å; D56-R60 IonicContact OD2-NH1 3.16Å; D56-R60 PolarHBondContact OD2-NH1 3.48Å; D56-R60 VanDerWaalsContact OD2-NH1 3.16Å
57C94.2Very high93.9Very high0 Ų076.8 Ų76.80%037%0.366CS..Hα-helixtrans-61.9-47.8178.4-1590000112.1V32 Y51 G53 I54 R59 R60 I61V32-C57 HydrophobicContact CG1-CB 3.84Å; V32-C57 HydrophobicContact CG2-CB 4.21Å; Y51-C57 HydrophobicContact CD1-CB 4.12Å; Y51-C57 HydrophobicContact CG-CB 4.05Å; G53-C57 VanDerWaalsContact O-CB 3.31Å; G53-C57 WeakPolarHBondContact O-CB 3.41Å; G53-C57 PolarHBondContact O-N 2.96Å; I54-C57 WeakPolarHBondContact O-CB 3.28Å; I54-C57 PolarHBondContact O-N 3.42Å; C57-R59 VanDerWaalsContact C-N 3.31Å; C57-R59 PolarHBondContact O-N 2.98Å; C57-R60 PolarHBondContact O-N 3.14Å; C57-I61 WeakPolarHBondContact O-CB 2.95Å; C57-I61 WeakPolarHBondContact O-CD1 3.48Å; C57-I61 WeakPolarHBondContact O-CG1 3.42Å; C57-I61 PolarHBondContact O-N 3Å; C57-I61 WeakPolarHBondContact SG-CD1 3.46Å
58V95.1Very high94.3Very high58 Ų5875.5 Ų75.535%0.35237%0.365SS..Hα-helixtrans-62.5-36.3179.1172.80000112V32 I54 P62 F70V32-V58 HydrophobicContact CG2-CG2 3.82Å; I54-V58 HydrophobicContact CG2-CG2 4.31Å; I54-V58 WeakPolarHBondContact O-CG2 3.34Å; I54-V58 PolarHBondContact O-N 3.4Å; V58-P62 WeakPolarHBondContact O-CD 3.32Å; V58-F70 HydrophobicContact CG1-CZ 4.18Å
59R96.4Very high94.5Very high169 Ų16968.7 Ų68.764%0.63834%0.335SS*.Hα-helixtrans-75.7-37.1177.8-72.5175-178.11730.4112.9M55 D56 C57M55-R59 WeakPolarHBondContact O-CB 3.4Å; M55-R59 VanDerWaalsContact O-CG 3.28Å; M55-R59 WeakPolarHBondContact O-CG 3.34Å; M55-R59 PolarHBondContact O-N 2.78Å; M55-R59 HydrophobicContact SD-CG 4.48Å; D56-R59 PolarHBondContact O-N 3.32Å; C57-R59 VanDerWaalsContact C-N 3.31Å; C57-R59 PolarHBondContact O-N 2.98Å
60R96.5Very high94.8Very high54 Ų5465.3 Ų65.320%0.20432%0.318CS..Hα-helixtrans-82-39.7-174.4-74.4174.760.3-164.6-4.4112.9M49 Q50 Y51 D56 C57 K63 E64M49-R60 PolarHBondContact O-NH1 2.84Å; M49-R60 PolarHBondContact O-NH2 3.42Å; Q50-R60 PolarHBondContact O-NH1 2.99Å; Y51-R60 HydrophobicContact CD1-CB 4.3Å; Y51-R60 HydrophobicContact CE1-CB 3.82Å; D56-R60 VanDerWaalsContact O-CB 3.26Å; D56-R60 WeakPolarHBondContact O-CB 3.27Å; D56-R60 VanDerWaalsContact O-CG 3.28Å; D56-R60 WeakPolarHBondContact O-CG 3.48Å; D56-R60 PolarHBondContact O-N 3.49Å; D56-R60 WeakPolarHBondContact OD1-CD 3.27Å; D56-R60 WeakPolarHBondContact OD2-CD 3.39Å; D56-R60 IonicContact OD2-NH1 3.16Å; D56-R60 PolarHBondContact OD2-NH1 3.48Å; D56-R60 VanDerWaalsContact OD2-NH1 3.16Å; C57-R60 PolarHBondContact O-N 3.14Å; R60-K63 PolarHBondContact O-N 2.78Å; R60-E64 HydrophobicContact CB-CG 4.47Å; R60-E64 IonicContact CZ-OE1 3.36Å; R60-E64 VanDerWaalsContact CZ-OE1 3.23Å; R60-E64 IonicContact NE-OE1 2.76Å; R60-E64 PolarHBondContact NE-OE1 2.94Å; R60-E64 IonicContact NH2-OE1 3.84Å; R60-E64 PolarHBondContact NH2-OE1 3.1Å; R60-E64 WeakPolarHBondContact O-CB 3.34Å; R60-E64 WeakPolarHBondContact O-CG 3.44Å; R60-E64 PolarHBondContact O-N 3.49Å
61I95.3Very high95Very high0 Ų067.2 Ų67.20%032%0.323CS..Hα-helixtrans-50.5-51.6-178.1-76.6165.1000112.8R31 V32 L35 C57 K63 E64 Q65 S69 F70R31-I61 VanDerWaalsContact NH1-CG2 3.27Å; V32-I61 HydrophobicContact CG2-CD1 4.03Å; L35-I61 HydrophobicContact CD1-CD1 3.7Å; L35-I61 HydrophobicContact CD1-CG1 4.14Å; C57-I61 WeakPolarHBondContact O-CB 2.95Å; C57-I61 WeakPolarHBondContact O-CD1 3.48Å; C57-I61 WeakPolarHBondContact O-CG1 3.42Å; C57-I61 PolarHBondContact O-N 3Å; C57-I61 WeakPolarHBondContact SG-CD1 3.46Å; I61-K63 VanDerWaalsContact C-N 3.31Å; I61-K63 PolarHBondContact O-N 3.34Å; I61-E64 PolarHBondContact O-N 3.27Å; I61-Q65 PolarHBondContact O-N 3.33Å; I61-S69 WeakPolarHBondContact CG2-OG 3.48Å; I61-F70 HydrophobicContact CB-CE1 3.95Å; I61-F70 HydrophobicContact CB-CZ 4.14Å; I61-F70 HydrophobicContact CD1-CD1 4.09Å; I61-F70 HydrophobicContact CD1-CE1 3.68Å; I61-F70 HydrophobicContact CG1-CE1 4.45Å; I61-F70 HydrophobicContact CG2-CD1 3.91Å; I61-F70 HydrophobicContact CG2-CD2 4.5Å; I61-F70 HydrophobicContact CG2-CE1 3.79Å; I61-F70 HydrophobicContact CG2-CE2 4.42Å; I61-F70 HydrophobicContact CG2-CG 4.25Å; I61-F70 HydrophobicContact CG2-CZ 4.05Å
62P95.6Very high95Very high40 Ų4068 Ų6826%0.2633%0.326SS..Hα-helixtrans-64-35.8-179.5-24.836.5000113.3V58 G66 F67 F70V58-P62 WeakPolarHBondContact O-CD 3.32Å; P62-G66 WeakPolarHBondContact O-CA 3.38Å; P62-G66 PolarHBondContact O-N 3.01Å; P62-F67 HydrophobicContact CG-CD2 4.41Å; P62-F70 HydrophobicContact CG-CE2 3.52Å; P62-F70 HydrophobicContact CG-CZ 3.81Å
63K93.9Very high95Very high180 Ų18059.3 Ų59.378%0.78329%0.291SS*.Hα-helixtrans-73.2-37.2179.2-65.5-176.6177.5-172.20112R60 I61R60-K63 PolarHBondContact O-N 2.78Å; I61-K63 VanDerWaalsContact C-N 3.31Å; I61-K63 PolarHBondContact O-N 3.34Å
64E93.1Very high95.1Very high49 Ų4959 Ų5923%0.22928%0.284CS..Hα-helixtrans-79.6-44.9-177.6-70.5173.4-179.200110.9Y51 R60 I61 K147Y51-E64 PolarHBondContact OH-OE2 3.44Å; R60-E64 HydrophobicContact CB-CG 4.47Å; R60-E64 IonicContact CZ-OE1 3.36Å; R60-E64 VanDerWaalsContact CZ-OE1 3.23Å; R60-E64 IonicContact NE-OE1 2.76Å; R60-E64 PolarHBondContact NE-OE1 2.94Å; R60-E64 IonicContact NH2-OE1 3.84Å; R60-E64 PolarHBondContact NH2-OE1 3.1Å; R60-E64 WeakPolarHBondContact O-CB 3.34Å; R60-E64 WeakPolarHBondContact O-CG 3.44Å; R60-E64 PolarHBondContact O-N 3.49Å; I61-E64 PolarHBondContact O-N 3.27Å; E64-K147 WeakPolarHBondContact O-CD 3.38Å; E64-K147 WeakPolarHBondContact O-CE 3.35Å; E64-K147 WeakPolarHBondContact O-CG 3.45Å
65Q92.9Very high95.1Very high18 Ų1861.8 Ų61.88%0.08430%0.299CS..Hα-helixtrans-127.9-1.2-165.6-63.9151.319.900114.4I61 I145I61-Q65 PolarHBondContact O-N 3.33Å; Q65-I145 VanDerWaalsContact CG-O 3.28Å; Q65-I145 WeakPolarHBondContact CG-O 3.2Å; Q65-I145 VanDerWaalsContact NE2-CA 3.25Å; Q65-I145 PolarHBondContact NE2-O 2.87Å
66G94.1Very high95.1Very high34 Ų3456.6 Ų56.635%0.35127%0.274SS..  trans86.8153.8-172.700000113.3P62 I68 S69P62-G66 WeakPolarHBondContact O-CA 3.38Å; P62-G66 PolarHBondContact O-N 3.01Å; G66-I68 PolarHBondContact O-N 2.81Å; G66-S69 VanDerWaalsContact O-CB 3.24Å; G66-S69 WeakPolarHBondContact O-CB 3.47Å; G66-S69 PolarHBondContact O-N 2.95Å; G66-S69 VanDerWaalsContact O-N 3.15Å; G66-S69 PolarHBondContact O-OG 2.86Å
67F94.9Very high94.7Very high133 Ų13354.6 Ų54.658%0.58326%0.263SS*.G310 helixtrans-60.3-40.5-173.2-177.6-103.7000114P62 S69 F70 W71P62-F67 HydrophobicContact CG-CD2 4.41Å; F67-S69 PolarHBondContact O-N 2.98Å; F67-S69 VanDerWaalsContact O-N 3.08Å; F67-F70 HydrophobicContact CD2-CD2 4.17Å; F67-F70 HydrophobicContact CD2-CE2 4.13Å; F67-F70 HydrophobicContact CE2-CD2 4.22Å; F67-F70 HydrophobicContact CE2-CE2 4.18Å; F67-F70 VanDerWaalsContact O-CD2 3.3Å; F67-F70 WeakPolarHBondContact O-CD2 3.18Å; F67-F70 PolarHBondContact O-N 2.67Å; F67-W71 HydrophobicContact CD1-CZ3 4.27Å; F67-W71 HydrophobicContact CE1-CH2 4.05Å; F67-W71 AromaticContact CE1-CZ3 3.87Å; F67-W71 HydrophobicContact CE1-CZ3 3.87Å; F67-W71 HydrophobicContact CZ-CH2 4.24Å; F67-W71 HydrophobicContact CZ-CZ3 4.31Å
68I95.2Very high94.7Very high141 Ų14156.4 Ų56.472%0.72327%0.274SS*.G310 helixtrans-62.6-20.9-178.9-61.2173.7000111.8G66 F70 W71G66-I68 PolarHBondContact O-N 2.81Å; I68-F70 PolarHBondContact O-N 3.25Å; I68-F70 VanDerWaalsContact O-N 3.07Å; I68-W71 PolarHBondContact O-N 3.24Å
69S95Very high94.6Very high10 Ų1056.9 Ų56.97%0.0727%0.274CS..G310 helixtrans-61.6-18.9179.872.80000113.4R31 I61 G66 F67 W71 R72R31-S69 WeakPolarHBondContact CD-O 3.17Å; R31-S69 PolarHBondContact NE-O 3.3Å; R31-S69 VanDerWaalsContact NH1-C 3.27Å; R31-S69 PolarHBondContact NH1-O 2.9Å; R31-S69 PolarHBondContact NH1-OG 2.88Å; I61-S69 WeakPolarHBondContact CG2-OG 3.48Å; G66-S69 VanDerWaalsContact O-CB 3.24Å; G66-S69 WeakPolarHBondContact O-CB 3.47Å; G66-S69 PolarHBondContact O-N 2.95Å; G66-S69 VanDerWaalsContact O-N 3.15Å; G66-S69 PolarHBondContact O-OG 2.86Å; F67-S69 PolarHBondContact O-N 2.98Å; F67-S69 VanDerWaalsContact O-N 3.08Å; S69-W71 PolarHBondContact O-N 3.4Å; S69-W71 VanDerWaalsContact O-N 3.15Å; S69-R72 WeakPolarHBondContact O-CB 3.32Å; S69-R72 PolarHBondContact O-N 3.33Å
70F96.6Very high94.5Very high12 Ų1251.6 Ų51.65%0.05325%0.254CS..G310 helixtrans-54.5-30.5171.1-81.5-57.1000113.7P28 R31 V32 V58 I61 P62 F67 I68 R72P28-F70 HydrophobicContact CB-CB 3.83Å; P28-F70 HydrophobicContact CB-CD1 3.82Å; P28-F70 HydrophobicContact CB-CG 3.85Å; P28-F70 HydrophobicContact CG-CB 3.97Å; P28-F70 HydrophobicContact CG-CG 4.41Å; R31-F70 WeakPolarHBondContact CD-O 3.09Å; V32-F70 HydrophobicContact CG2-CE1 4.39Å; V58-F70 HydrophobicContact CG1-CZ 4.18Å; I61-F70 HydrophobicContact CB-CE1 3.95Å; I61-F70 HydrophobicContact CB-CZ 4.14Å; I61-F70 HydrophobicContact CD1-CD1 4.09Å; I61-F70 HydrophobicContact CD1-CE1 3.68Å; I61-F70 HydrophobicContact CG1-CE1 4.45Å; I61-F70 HydrophobicContact CG2-CD1 3.91Å; I61-F70 HydrophobicContact CG2-CD2 4.5Å; I61-F70 HydrophobicContact CG2-CE1 3.79Å; I61-F70 HydrophobicContact CG2-CE2 4.42Å; I61-F70 HydrophobicContact CG2-CG 4.25Å; I61-F70 HydrophobicContact CG2-CZ 4.05Å; P62-F70 HydrophobicContact CG-CE2 3.52Å; P62-F70 HydrophobicContact CG-CZ 3.81Å; F67-F70 HydrophobicContact CD2-CD2 4.17Å; F67-F70 HydrophobicContact CD2-CE2 4.13Å; F67-F70 HydrophobicContact CE2-CD2 4.22Å; F67-F70 HydrophobicContact CE2-CE2 4.18Å; F67-F70 VanDerWaalsContact O-CD2 3.3Å; F67-F70 WeakPolarHBondContact O-CD2 3.18Å; F67-F70 PolarHBondContact O-N 2.67Å; I68-F70 PolarHBondContact O-N 3.25Å; I68-F70 VanDerWaalsContact O-N 3.07Å; F70-R72 VanDerWaalsContact C-N 3.34Å
71W97.3Very high94.1Very high85 Ų8551 Ų5132%0.32225%0.252SS..G310 helixtrans-9311.4178.6-69.6-91.8000113.6T24 A27 P28 F67 I68 S69 G73 N74T24-W71 PolarHBondContact O-NE1 3.48Å; A27-W71 VanDerWaalsContact CB-CD1 3.49Å; A27-W71 HydrophobicContact CB-CG 4.27Å; P28-W71 HydrophobicContact CG-CH2 4Å; P28-W71 HydrophobicContact CG-CZ2 3.64Å; F67-W71 HydrophobicContact CD1-CZ3 4.27Å; F67-W71 HydrophobicContact CE1-CH2 4.05Å; F67-W71 AromaticContact CE1-CZ3 3.87Å; F67-W71 HydrophobicContact CE1-CZ3 3.87Å; F67-W71 HydrophobicContact CZ-CH2 4.24Å; F67-W71 HydrophobicContact CZ-CZ3 4.31Å; I68-W71 PolarHBondContact O-N 3.24Å; S69-W71 PolarHBondContact O-N 3.4Å; S69-W71 VanDerWaalsContact O-N 3.15Å; W71-G73 PolarHBondContact O-N 3.07Å; W71-G73 VanDerWaalsContact O-N 3.15Å; W71-N74 HydrophobicContact CB-CB 4.17Å; W71-N74 WeakPolarHBondContact O-CB 3.48Å; W71-N74 PolarHBondContact O-N 3.06Å
72R95.7Very high93.9Very high27 Ų2754.5 Ų54.510%0.10227%0.268CS..THydrogen-bonded Turntrans-61.4121.2179.5-164.7174.8-175.2135.86.2110.8S69 F70 L141 D144 G146 R152 F154S69-R72 WeakPolarHBondContact O-CB 3.32Å; S69-R72 PolarHBondContact O-N 3.33Å; F70-R72 VanDerWaalsContact C-N 3.34Å; R72-L141 WeakPolarHBondContact CD-O 3.3Å; R72-L141 HydrophobicContact CG-CB 4.37Å; R72-L141 WeakPolarHBondContact CG-O 3.26Å; R72-L141 PolarHBondContact NE-O 2.84Å; R72-D144 IonicContact CZ-OD2 3.71Å; R72-D144 VanDerWaalsContact CZ-OD2 3.29Å; R72-D144 IonicContact NE-OD2 2.9Å; R72-D144 IonicContact NH2-OD2 2.65Å; R72-D144 PolarHBondContact NH2-OD2 3.27Å; R72-G146 PolarHBondContact NH1-O 2.72Å; R72-G146 VanDerWaalsContact NH1-O 3.16Å; R72-R152 VanDerWaalsContact NH1-CZ 3.3Å; R72-R152 VanDerWaalsContact NH1-NE 3.11Å; R72-F154 PolarHBondContact NH2-O 2.89Å
73G94.1Very high93.8Very high11 Ų1154.8 Ų54.811%0.11327%0.269CS..THydrogen-bonded Turntrans87.7-3.3-174.400000115.1W71 L75 A76 R138W71-G73 PolarHBondContact O-N 3.07Å; W71-G73 VanDerWaalsContact O-N 3.15Å; G73-L75 VanDerWaalsContact C-N 3.27Å; G73-L75 PolarHBondContact O-N 3.4Å; G73-A76 PolarHBondContact O-N 3.4Å; G73-R138 WeakPolarHBondContact O-CG 3.18Å
74N95.9Very high93.6Very high15 Ų1547.1 Ų47.18%0.0824%0.238CC..Hα-helixtrans-66.1-24.7-177.5-170.752.7000113.8T24 A27 W71 A76 N77 V78T24-N74 PolarHBondContact OG1-ND2 3.37Å; A27-N74 HydrophobicContact CB-CB 4.16Å; W71-N74 HydrophobicContact CB-CB 4.17Å; W71-N74 WeakPolarHBondContact O-CB 3.48Å; W71-N74 PolarHBondContact O-N 3.06Å; N74-A76 PolarHBondContact O-N 2.92Å; N74-N77 VanDerWaalsContact O-CB 3.23Å; N74-N77 WeakPolarHBondContact O-CB 3.5Å; N74-N77 PolarHBondContact O-N 2.97Å; N74-N77 PolarHBondContact OD1-ND2 3.49Å; N74-V78 PolarHBondContact O-N 2.91Å
75L94.5Very high93.4Very high106 Ų10647.9 Ų47.956%0.55524%0.241SC*.Hα-helixtrans-54.3-41.8175.1178.561.2000112G73 N77 V78 I79 L157G73-L75 VanDerWaalsContact C-N 3.27Å; G73-L75 PolarHBondContact O-N 3.4Å; L75-N77 VanDerWaalsContact C-N 3.27Å; L75-N77 PolarHBondContact O-N 3.32Å; L75-V78 PolarHBondContact O-N 2.87Å; L75-I79 HydrophobicContact CD1-CD1 3.81Å; L75-I79 HydrophobicContact CD1-CG1 4.16Å; L75-I79 HydrophobicContact CD2-CD1 4.4Å; L75-I79 HydrophobicContact CG-CD1 3.77Å; L75-I79 HydrophobicContact CG-CG1 4.46Å; L75-I79 WeakPolarHBondContact O-CG1 3.01Å; L75-I79 PolarHBondContact O-N 3.44Å; L75-L157 HydrophobicContact CD2-CB 4.32Å; L75-L157 HydrophobicContact CD2-CD2 4.3Å; L75-L157 HydrophobicContact CG-CD2 4.29Å
76A93.8Very high93.2Very high2 Ų249.6 Ų49.62%0.01726%0.259CS..Hα-helixtrans-64.4-31.9177.600000112.5G73 N74 R80 L134 R138 L157G73-A76 PolarHBondContact O-N 3.4Å; N74-A76 PolarHBondContact O-N 2.92Å; A76-R80 WeakPolarHBondContact O-CB 3.23Å; A76-R80 PolarHBondContact O-N 3.46Å; A76-L134 HydrophobicContact CB-CB 4.5Å; A76-R138 HydrophobicContact CB-CB 3.74Å; A76-R138 HydrophobicContact CB-CG 4.19Å; A76-L157 HydrophobicContact CB-CD1 4.07Å; A76-L157 HydrophobicContact CB-CD2 4.27Å
77N89Confident93.1Very high2 Ų249.1 Ų49.11%0.01125%0.248CC..Hα-helixtrans-63.6-44.9175.2-85.1-32000113.1K23 N74 L75 R138K23-N77 HydrophobicContact CB-CB 4.17Å; K23-N77 HydrophobicContact CD-CB 3.79Å; K23-N77 WeakPolarHBondContact CD-O 3.38Å; N74-N77 VanDerWaalsContact O-CB 3.23Å; N74-N77 WeakPolarHBondContact O-CB 3.5Å; N74-N77 PolarHBondContact O-N 2.97Å; N74-N77 PolarHBondContact OD1-ND2 3.49Å; L75-N77 VanDerWaalsContact C-N 3.27Å; L75-N77 PolarHBondContact O-N 3.32Å; N77-R138 PolarHBondContact ND2-NE 2.93Å; N77-R138 PolarHBondContact ND2-NH2 3.14Å; N77-R138 VanDerWaalsContact OD1-CD 3.3Å; N77-R138 WeakPolarHBondContact OD1-CD 3.32Å; N77-R138 PolarHBondContact OD1-NE 3.47Å; N77-R138 PolarHBondContact OD1-NH1 2.92Å; N77-R138 PolarHBondContact OD1-NH2 3.15Å
78V93.3Very high92.7Very high39 Ų3944.8 Ų44.824%0.23623%0.231CC..Hα-helixtrans-67.5-50.5-177.4175.30000109A20 N74 L75 R80 Y81A20-V78 HydrophobicContact CB-CB 4.45Å; A20-V78 HydrophobicContact CB-CG1 3.73Å; A20-V78 HydrophobicContact CB-CG2 4.13Å; N74-V78 PolarHBondContact O-N 2.91Å; L75-V78 PolarHBondContact O-N 2.87Å; V78-R80 VanDerWaalsContact C-N 3.32Å; V78-R80 PolarHBondContact O-N 3.03Å; V78-Y81 PolarHBondContact O-N 3.19Å
79I94.4Very high92.2Very high67 Ų6745 Ų4534%0.34423%0.227SC..Hα-helixtrans-59.6-43.2179.6-66.8172.8000111.1L75 Y81 F82 P83 L134 L157L75-I79 HydrophobicContact CD1-CD1 3.81Å; L75-I79 HydrophobicContact CD1-CG1 4.16Å; L75-I79 HydrophobicContact CD2-CD1 4.4Å; L75-I79 HydrophobicContact CG-CD1 3.77Å; L75-I79 HydrophobicContact CG-CG1 4.46Å; L75-I79 WeakPolarHBondContact O-CG1 3.01Å; L75-I79 PolarHBondContact O-N 3.44Å; I79-Y81 PolarHBondContact O-N 2.75Å; I79-F82 PolarHBondContact O-N 3.43Å; I79-P83 WeakPolarHBondContact O-CD 3.42Å; I79-L134 HydrophobicContact CG2-CD1 3.95Å; I79-L134 HydrophobicContact CG2-CD2 4.46Å; I79-L157 HydrophobicContact CD1-CD2 3.89Å
80R92.4Very high91.9Very high58 Ų5846.9 Ų46.922%0.21924%0.243CC..Hα-helixtrans-57.6-27.5-173.5-174.217975.585.4-5.4113.9A76 V78 P83 T84 V131 L134 D135A76-R80 WeakPolarHBondContact O-CB 3.23Å; A76-R80 PolarHBondContact O-N 3.46Å; V78-R80 VanDerWaalsContact C-N 3.32Å; V78-R80 PolarHBondContact O-N 3.03Å; R80-P83 WeakPolarHBondContact O-CD 3.48Å; R80-T84 VanDerWaalsContact O-CB 3.27Å; R80-T84 WeakPolarHBondContact O-CB 3.43Å; R80-T84 PolarHBondContact O-N 3.02Å; R80-T84 PolarHBondContact O-OG1 3.3Å; R80-V131 HydrophobicContact CG-CB 4.18Å; R80-V131 HydrophobicContact CG-CG2 4.21Å; R80-L134 HydrophobicContact CB-CD1 4.09Å; R80-L134 HydrophobicContact CG-CD1 4.49Å; R80-D135 WeakPolarHBondContact CD-OD1 3.4Å; R80-D135 IonicContact CZ-OD1 3.24Å; R80-D135 IonicContact NE-OD1 3.85Å; R80-D135 PolarHBondContact NE-OD1 2.86Å
81Y90.1Very high91.6Very high43 Ų4350 Ų5017%0.16926%0.257CS..Hα-helixtrans-57.7-53.3-179.4178.3-88.8000111.8G15 G16 A19 V78 I79 T84 Q85G15-Y81 WeakPolarHBondContact CA-OH 3.49Å; G15-Y81 VanDerWaalsContact O-CZ 3.3Å; G15-Y81 PolarHBondContact O-OH 3.07Å; G16-Y81 VanDerWaalsContact N-CE1 3.25Å; A19-Y81 HydrophobicContact CB-CD2 3.23Å; A19-Y81 HydrophobicContact CB-CE2 3.49Å; A19-Y81 VanDerWaalsContact CB-CE2 3.49Å; A19-Y81 HydrophobicContact CB-CG 3.82Å; V78-Y81 PolarHBondContact O-N 3.19Å; I79-Y81 PolarHBondContact O-N 2.75Å; Y81-T84 PolarHBondContact O-N 3.04Å; Y81-Q85 HydrophobicContact CD1-CG 3.94Å; Y81-Q85 HydrophobicContact CD2-CG 4.14Å; Y81-Q85 HydrophobicContact CE1-CB 4.35Å; Y81-Q85 HydrophobicContact CE1-CG 3.5Å; Y81-Q85 HydrophobicContact CE2-CG 3.76Å; Y81-Q85 HydrophobicContact CG-CG 4.25Å; Y81-Q85 VanDerWaalsContact CZ-CG 3.43Å; Y81-Q85 WeakPolarHBondContact O-CG 3.28Å; Y81-Q85 PolarHBondContact O-N 3.1Å
82F90.6Very high91Very high72 Ų7250.3 Ų50.332%0.31626%0.26SS..Hα-helixtrans-58.5-54.8-173.4-58.7-76.5000114.2F12 I79 T84 Q85 A86F12-F82 HydrophobicContact CD1-CD1 4.37Å; F12-F82 AromaticContact CE1-CD1 3.58Å; F12-F82 HydrophobicContact CE1-CD1 3.58Å; F12-F82 HydrophobicContact CE1-CE1 4.32Å; F12-F82 HydrophobicContact CZ-CB 4.06Å; F12-F82 AromaticContact CZ-CD1 3.78Å; F12-F82 HydrophobicContact CZ-CD1 3.78Å; F12-F82 HydrophobicContact CZ-CG 4.43Å; I79-F82 PolarHBondContact O-N 3.43Å; F82-T84 VanDerWaalsContact C-N 3.3Å; F82-T84 PolarHBondContact O-N 2.71Å; F82-Q85 PolarHBondContact O-N 3.47Å; F82-A86 PolarHBondContact O-N 3.28Å
83P92.9Very high90.6Very high46 Ų4653.5 Ų53.530%0.29928%0.279SS..Hα-helixtrans-66.4-33.6178.227.4-33000111.8I79 R80 Q85 A86 L87 V131 L134I79-P83 WeakPolarHBondContact O-CD 3.42Å; R80-P83 WeakPolarHBondContact O-CD 3.48Å; P83-Q85 PolarHBondContact O-N 3.43Å; P83-A86 PolarHBondContact O-N 3.34Å; P83-L87 WeakPolarHBondContact O-CB 3.45Å; P83-L87 WeakPolarHBondContact O-CD1 3.03Å; P83-L87 WeakPolarHBondContact O-CG 3.36Å; P83-L87 PolarHBondContact O-N 3.18Å; P83-V131 HydrophobicContact CB-CG1 3.84Å; P83-V131 HydrophobicContact CG-CG1 3.75Å; P83-L134 HydrophobicContact CG-CD1 4.42Å
84T90.1Very high90.5Very high19 Ų1959.4 Ų59.412%0.11730%0.302CS..Hα-helixtrans-63.9-42.6175.8-55.50000111.1R80 Y81 F82 L87 N88R80-T84 VanDerWaalsContact O-CB 3.27Å; R80-T84 WeakPolarHBondContact O-CB 3.43Å; R80-T84 PolarHBondContact O-N 3.02Å; R80-T84 PolarHBondContact O-OG1 3.3Å; Y81-T84 PolarHBondContact O-N 3.04Å; F82-T84 VanDerWaalsContact C-N 3.3Å; F82-T84 PolarHBondContact O-N 2.71Å; T84-L87 PolarHBondContact O-N 3.14Å; T84-N88 WeakPolarHBondContact O-CB 3.36Å; T84-N88 VanDerWaalsContact O-CG 3.27Å; T84-N88 PolarHBondContact O-N 3.03Å; T84-N88 PolarHBondContact O-ND2 3.4Å
85Q87.9Confident90.4Very high66 Ų6660.9 Ų60.931%0.30831%0.307SS..Hα-helixtrans-70.2-39.1178.6-69.8-53.3-10.800112.7F12 Y81 F82 P83 L87 N88 F89F12-Q85 HydrophobicContact CD2-CB 4.3Å; F12-Q85 HydrophobicContact CE2-CB 3.72Å; Y81-Q85 HydrophobicContact CD1-CG 3.94Å; Y81-Q85 HydrophobicContact CD2-CG 4.14Å; Y81-Q85 HydrophobicContact CE1-CB 4.35Å; Y81-Q85 HydrophobicContact CE1-CG 3.5Å; Y81-Q85 HydrophobicContact CE2-CG 3.76Å; Y81-Q85 HydrophobicContact CG-CG 4.25Å; Y81-Q85 VanDerWaalsContact CZ-CG 3.43Å; Y81-Q85 WeakPolarHBondContact O-CG 3.28Å; Y81-Q85 PolarHBondContact O-N 3.1Å; F82-Q85 PolarHBondContact O-N 3.47Å; P83-Q85 PolarHBondContact O-N 3.43Å; Q85-L87 VanDerWaalsContact C-N 3.31Å; Q85-L87 PolarHBondContact O-N 2.86Å; Q85-N88 PolarHBondContact O-N 3.22Å; Q85-N88 PolarHBondContact OE1-ND2 2.96Å; Q85-F89 WeakPolarHBondContact O-CB 3.4Å; Q85-F89 PolarHBondContact O-N 3.26Å
86A89.7Confident90.2Very high54 Ų5460 Ų6045%0.44630%0.298SS..Hα-helixtrans-58-44.9173.300000111.5F82 P83 F89 A90F82-A86 PolarHBondContact O-N 3.28Å; P83-A86 PolarHBondContact O-N 3.34Å; A86-F89 PolarHBondContact O-N 3.44Å; A86-A90 PolarHBondContact O-N 3.43Å
87L91Very high90.1Very high24 Ų2467.4 Ų67.413%0.12633%0.33CS..Hα-helixtrans-68.1-39.6177.1-68166000112.3P83 T84 Q85 F89 A90 F91 F130 V131P83-L87 WeakPolarHBondContact O-CB 3.45Å; P83-L87 WeakPolarHBondContact O-CD1 3.03Å; P83-L87 WeakPolarHBondContact O-CG 3.36Å; P83-L87 PolarHBondContact O-N 3.18Å; T84-L87 PolarHBondContact O-N 3.14Å; Q85-L87 VanDerWaalsContact C-N 3.31Å; Q85-L87 PolarHBondContact O-N 2.86Å; L87-F89 VanDerWaalsContact C-N 3.34Å; L87-F89 PolarHBondContact O-N 2.97Å; L87-A90 PolarHBondContact O-N 3.49Å; L87-F91 HydrophobicContact CB-CD2 4.46Å; L87-F91 HydrophobicContact CD2-CD2 4.13Å; L87-F91 HydrophobicContact CD2-CE2 3.76Å; L87-F91 WeakPolarHBondContact O-CB 3.12Å; L87-F91 WeakPolarHBondContact O-CD2 3.03Å; L87-F91 PolarHBondContact O-N 3.49Å; L87-F130 HydrophobicContact CD1-CB 3.75Å; L87-F130 HydrophobicContact CD1-CD2 3.67Å; L87-F130 HydrophobicContact CD1-CG 3.96Å; L87-F130 HydrophobicContact CD2-CD2 3.8Å; L87-F130 HydrophobicContact CD2-CE2 3.98Å; L87-F130 HydrophobicContact CD2-CG 4.42Å; L87-F130 HydrophobicContact CG-CD2 4.42Å; L87-V131 HydrophobicContact CD1-CG1 4.34Å
88N86.4Confident90.4Very high41 Ų4172.7 Ų72.722%0.21936%0.357CS..Hα-helixtrans-60.4-45.4173.8-79.2-31.7000111.2T84 Q85 A90 F91 K92T84-N88 WeakPolarHBondContact O-CB 3.36Å; T84-N88 VanDerWaalsContact O-CG 3.27Å; T84-N88 PolarHBondContact O-N 3.03Å; T84-N88 PolarHBondContact O-ND2 3.4Å; Q85-N88 PolarHBondContact O-N 3.22Å; Q85-N88 PolarHBondContact OE1-ND2 2.96Å; N88-A90 VanDerWaalsContact C-N 3.31Å; N88-A90 PolarHBondContact O-N 2.88Å; N88-F91 PolarHBondContact O-N 3.34Å; N88-K92 WeakPolarHBondContact O-CB 3.46Å; N88-K92 PolarHBondContact O-N 2.94Å
89F85.6Confident90.3Very high146 Ų14673.8 Ų73.864%0.6436%0.359SS*.Hα-helixtrans-60.6-42.2177.3-177.1-99.6000111.5F8 Q85 A86 L87F8-F89 HydrophobicContact CD2-CE2 4.44Å; F8-F89 AromaticContact CE2-CD2 3.88Å; F8-F89 HydrophobicContact CE2-CD2 3.88Å; F8-F89 AromaticContact CE2-CE2 3.76Å; F8-F89 HydrophobicContact CE2-CE2 3.76Å; F8-F89 HydrophobicContact CE2-CG 4.34Å; F8-F89 HydrophobicContact CE2-CZ 4.13Å; F8-F89 HydrophobicContact CZ-CD2 4.4Å; F8-F89 HydrophobicContact CZ-CE2 4.47Å; F8-F89 HydrophobicContact CZ-CG 4.42Å; Q85-F89 WeakPolarHBondContact O-CB 3.4Å; Q85-F89 PolarHBondContact O-N 3.26Å; A86-F89 PolarHBondContact O-N 3.44Å; L87-F89 VanDerWaalsContact C-N 3.34Å; L87-F89 PolarHBondContact O-N 2.97Å
90A89.1Confident90.2Very high50 Ų5072 Ų7241%0.41335%0.35SS..Hα-helixtrans-68.7-41.9179.300000113.8A86 L87 N88A86-A90 PolarHBondContact O-N 3.43Å; L87-A90 PolarHBondContact O-N 3.49Å; N88-A90 VanDerWaalsContact C-N 3.31Å; N88-A90 PolarHBondContact O-N 2.88Å
91F89.8Confident90.2Very high77 Ų7771.7 Ų71.734%0.33837%0.365SS..Hα-helixtrans-114.9-24.3-164-64.9-71.1000115.6L87 N88 D93 K94 Y95 T126L87-F91 HydrophobicContact CB-CD2 4.46Å; L87-F91 HydrophobicContact CD2-CD2 4.13Å; L87-F91 HydrophobicContact CD2-CE2 3.76Å; L87-F91 WeakPolarHBondContact O-CB 3.12Å; L87-F91 WeakPolarHBondContact O-CD2 3.03Å; L87-F91 PolarHBondContact O-N 3.49Å; N88-F91 PolarHBondContact O-N 3.34Å; F91-D93 PolarHBondContact O-N 3.27Å; F91-K94 PolarHBondContact O-N 3.08Å; F91-Y95 HydrophobicContact CB-CD2 3.97Å; F91-Y95 HydrophobicContact CB-CE2 3.71Å; F91-Y95 HydrophobicContact CG-CE2 4.38Å; F91-Y95 VanDerWaalsContact O-CD2 3.23Å; F91-Y95 WeakPolarHBondContact O-CD2 3.48Å; F91-Y95 PolarHBondContact O-N 3.36Å; F91-T126 HydrophobicContact CD2-CG2 3.88Å; F91-T126 HydrophobicContact CE2-CG2 4.08Å; F91-T126 HydrophobicContact CG-CG2 4.15Å
92K84.5Confident90.1Very high91 Ų9173.7 Ų73.740%0.39640%0.399SS..Hα-helixtrans-59.8-47-171.8-175.8179.8177.7-174.60112N88 Y95 K96N88-K92 WeakPolarHBondContact O-CB 3.46Å; N88-K92 PolarHBondContact O-N 2.94Å; K92-Y95 PolarHBondContact O-N 2.86Å; K92-K96 WeakPolarHBondContact O-CG 3.21Å; K92-K96 PolarHBondContact O-N 3.29Å
93D87.8Confident90.1Very high94 Ų9471.5 Ų71.550%0.50339%0.391SS..Hα-helixtrans-74.5-30.5-178.7-66.8-24.9000112.4F91 K96 K97F91-D93 PolarHBondContact O-N 3.27Å; D93-K96 PolarHBondContact O-N 3.45Å; D93-K97 WeakPolarHBondContact O-CB 3.22Å; D93-K97 VanDerWaalsContact O-CG 3.3Å; D93-K97 WeakPolarHBondContact O-CG 3.44Å; D93-K97 PolarHBondContact O-N 3Å
94K92.4Very high89.8Confident135 Ų13573 Ų7359%0.58740%0.397SS*.Hα-helixtrans-62.1-49.4171.7-66-68.7-174.7172.90110.7F91 K96 K97 I98F91-K94 PolarHBondContact O-N 3.08Å; K94-K96 PolarHBondContact O-N 3.37Å; K94-K97 PolarHBondContact O-N 3.35Å; K94-I98 VanDerWaalsContact O-CG1 3.27Å; K94-I98 WeakPolarHBondContact O-CG1 3.36Å; K94-I98 PolarHBondContact O-N 3.05Å
95Y93Very high89.5Confident47 Ų4776.6 Ų76.618%0.18441%0.412CS..Hα-helixtrans-64.7-39.1176.7-71.2-51.8000112.7F91 K92 K97 I98 F99 A122 A123 T126F91-Y95 HydrophobicContact CB-CD2 3.97Å; F91-Y95 HydrophobicContact CB-CE2 3.71Å; F91-Y95 HydrophobicContact CG-CE2 4.38Å; F91-Y95 VanDerWaalsContact O-CD2 3.23Å; F91-Y95 WeakPolarHBondContact O-CD2 3.48Å; F91-Y95 PolarHBondContact O-N 3.36Å; K92-Y95 PolarHBondContact O-N 2.86Å; Y95-K97 VanDerWaalsContact C-N 3.35Å; Y95-K97 PolarHBondContact O-N 3.35Å; Y95-I98 HydrophobicContact CD1-CD1 4.43Å; Y95-I98 PolarHBondContact O-N 3.29Å; Y95-F99 HydrophobicContact CD1-CD2 4.4Å; Y95-F99 AromaticContact CD1-CE2 3.76Å; Y95-F99 HydrophobicContact CD1-CE2 3.76Å; Y95-F99 HydrophobicContact CG-CE2 4.4Å; Y95-F99 WeakPolarHBondContact O-CD2 3.45Å; Y95-F99 PolarHBondContact O-N 3.34Å; Y95-A122 HydrophobicContact CD1-CB 3.77Å; Y95-A122 HydrophobicContact CD2-CB 4.23Å; Y95-A122 HydrophobicContact CE1-CB 3.8Å; Y95-A122 HydrophobicContact CE2-CB 4.22Å; Y95-A122 HydrophobicContact CG-CB 4.01Å; Y95-A123 HydrophobicContact CD2-CB 3.82Å; Y95-A123 HydrophobicContact CE2-CB 4.39Å; Y95-T126 PolarHBondContact OH-OG1 3.38Å
96K90.2Very high89.3Confident87 Ų8782.9 Ų82.938%0.37844%0.439SS..Hα-helixtrans-58.2-47.8173-77.4179.8172.8-1740111.3K92 D93 K94 I98 F99 L100 S119K92-K96 WeakPolarHBondContact O-CG 3.21Å; K92-K96 PolarHBondContact O-N 3.29Å; D93-K96 PolarHBondContact O-N 3.45Å; K94-K96 PolarHBondContact O-N 3.37Å; K96-I98 VanDerWaalsContact C-N 3.34Å; K96-I98 PolarHBondContact O-N 2.87Å; K96-F99 PolarHBondContact O-N 3.17Å; K96-L100 HydrophobicContact CG-CD1 4.47Å; K96-L100 WeakPolarHBondContact O-CA 3.3Å; K96-L100 VanDerWaalsContact O-CB 3.22Å; K96-L100 WeakPolarHBondContact O-CB 3.23Å; K96-L100 PolarHBondContact O-N 3.33Å; K96-S119 PolarHBondContact N-OG 3.01Å
97K92.8Very high89.2Confident157 Ų15785.6 Ų85.668%0.68345%0.45SS*.Hα-helixtrans-60.7-41.9177.3-72.7176.7-177.4-173.90112.3D93 K94 Y95 G101D93-K97 WeakPolarHBondContact O-CB 3.22Å; D93-K97 VanDerWaalsContact O-CG 3.3Å; D93-K97 WeakPolarHBondContact O-CG 3.44Å; D93-K97 PolarHBondContact O-N 3Å; K94-K97 PolarHBondContact O-N 3.35Å; Y95-K97 VanDerWaalsContact C-N 3.35Å; Y95-K97 PolarHBondContact O-N 3.35Å; K97-G101 VanDerWaalsContact O-CA 3.23Å; K97-G101 WeakPolarHBondContact O-CA 3.47Å; K97-G101 PolarHBondContact O-N 3.18Å
98I94.4Very high89.2Confident113 Ų11388.8 Ų88.858%0.57946%0.464SS*.Hα-helixtrans-64.7-46.8179.1-68.6164000111.8K94 Y95 K96K94-I98 VanDerWaalsContact O-CG1 3.27Å; K94-I98 WeakPolarHBondContact O-CG1 3.36Å; K94-I98 PolarHBondContact O-N 3.05Å; Y95-I98 HydrophobicContact CD1-CD1 4.43Å; Y95-I98 PolarHBondContact O-N 3.29Å; K96-I98 VanDerWaalsContact C-N 3.34Å; K96-I98 PolarHBondContact O-N 2.87Å
99F92.2Very high89.3Confident62 Ų6290.7 Ų90.727%0.27247%0.471SS..Hα-helixtrans-95-21.7-170.5-65.9-66.4000114.8Y95 K96 R111 G115 A118 A122Y95-F99 HydrophobicContact CD1-CD2 4.4Å; Y95-F99 AromaticContact CD1-CE2 3.76Å; Y95-F99 HydrophobicContact CD1-CE2 3.76Å; Y95-F99 HydrophobicContact CG-CE2 4.4Å; Y95-F99 WeakPolarHBondContact O-CD2 3.45Å; Y95-F99 PolarHBondContact O-N 3.34Å; K96-F99 PolarHBondContact O-N 3.17Å; F99-R111 PolarHBondContact O-NH1 2.89Å; F99-R111 VanDerWaalsContact O-NH1 3.16Å; F99-G115 WeakPolarHBondContact CB-O 3.39Å; F99-A118 HydrophobicContact CB-CB 4.41Å; F99-A118 HydrophobicContact CD1-CB 3.67Å; F99-A118 HydrophobicContact CD2-CB 4.28Å; F99-A118 HydrophobicContact CE1-CB 3.92Å; F99-A118 HydrophobicContact CE2-CB 4.49Å; F99-A118 HydrophobicContact CG-CB 3.87Å; F99-A118 HydrophobicContact CZ-CB 4.32Å; F99-A122 HydrophobicContact CE2-CB 3.83Å; F99-A122 HydrophobicContact CZ-CB 4.39Å
100L92.1Very high89.5Confident29 Ų2993 Ų9315%0.15248%0.475CS..Hα-helixtrans-121.80.4-176.9-60.8167.8000113.5K96 G102 V103 W112 N116K96-L100 HydrophobicContact CG-CD1 4.47Å; K96-L100 WeakPolarHBondContact O-CA 3.3Å; K96-L100 VanDerWaalsContact O-CB 3.22Å; K96-L100 WeakPolarHBondContact O-CB 3.23Å; K96-L100 PolarHBondContact O-N 3.33Å; L100-G102 PolarHBondContact O-N 2.98Å; L100-V103 PolarHBondContact O-N 3.4Å; L100-V103 VanDerWaalsContact O-N 3.1Å; L100-W112 HydrophobicContact CD2-CG 4.4Å; L100-W112 WeakPolarHBondContact CD2-O 3.34Å; L100-N116 WeakPolarHBondContact CD1-OD1 3.45Å
101G91.4Very high89.6Confident53 Ų5396.6 Ų96.655%0.54648%0.478SS..THydrogen-bonded Turntrans-57.4121.3176.100000111K97 V103K97-G101 VanDerWaalsContact O-CA 3.23Å; K97-G101 WeakPolarHBondContact O-CA 3.47Å; K97-G101 PolarHBondContact O-N 3.18Å; G101-V103 VanDerWaalsContact C-N 3.28Å; G101-V103 PolarHBondContact O-N 3.27Å
102G88.6Confident89.6Confident85 Ų8594.4 Ų94.488%0.87647%0.467SS*.THydrogen-bonded Turntrans73.79.9-179.900000115.6L100L100-G102 PolarHBondContact O-N 2.98Å
103V89.5Confident89.9Confident25 Ų2591.7 Ų91.715%0.15246%0.456CS..  trans-96.6119.5178.3-175.80000110.2L100 G101 Q108 R111 W112L100-V103 PolarHBondContact O-N 3.4Å; L100-V103 VanDerWaalsContact O-N 3.1Å; G101-V103 VanDerWaalsContact C-N 3.28Å; G101-V103 PolarHBondContact O-N 3.27Å; V103-Q108 HydrophobicContact CG1-CB 4.31Å; V103-R111 HydrophobicContact CG1-CB 4.13Å; V103-R111 HydrophobicContact CG1-CG 3.83Å; V103-R111 HydrophobicContact CG2-CG 4Å; V103-W112 HydrophobicContact CG1-CB 3.81Å
104D86.8Confident90.1Very high79 Ų7989.7 Ų89.742%0.42245%0.452SS..  trans-88.4127.4174.5-173.3-54.7000110.7K106 T107 Q108D104-K106 VanDerWaalsContact C-N 3.35Å; D104-K106 PolarHBondContact O-N 2.9Å; D104-K106 WeakPolarHBondContact OD1-CA 3.5Å; D104-K106 WeakPolarHBondContact OD1-CB 3.46Å; D104-K106 PolarHBondContact OD1-N 3.46Å; D104-T107 WeakPolarHBondContact CB-OG1 3.34Å; D104-T107 PolarHBondContact OD1-N 2.69Å; D104-Q108 WeakPolarHBondContact O-CA 3.24Å; D104-Q108 WeakPolarHBondContact O-CB 3.46Å; D104-Q108 PolarHBondContact O-N 2.94Å
105Q84Confident90.1Very high93 Ų9383.3 Ų83.344%0.43543%0.425SS..THydrogen-bonded Turntrans-65.6-34.5-178-178.3176.5-2.400113.2W112Q105-W112 HydrophobicContact CB-CD2 4.15Å; Q105-W112 HydrophobicContact CB-CG 3.93Å; Q105-W112 HydrophobicContact CG-CD2 3.67Å; Q105-W112 HydrophobicContact CG-CE3 4.08Å; Q105-W112 HydrophobicContact CG-CG 3.97Å; Q105-W112 HydrophobicContact CG-CZ2 4.16Å
106K83.3Confident89.9Confident199 Ų19981.9 Ų81.987%0.86542%0.42SS*.THydrogen-bonded Turntrans-79.1-38.7-174.5-63.5-176.5179.2-179.70111.9D104D104-K106 VanDerWaalsContact C-N 3.35Å; D104-K106 PolarHBondContact O-N 2.9Å; D104-K106 WeakPolarHBondContact OD1-CA 3.5Å; D104-K106 WeakPolarHBondContact OD1-CB 3.46Å; D104-K106 PolarHBondContact OD1-N 3.46Å
107T88.8Confident90Very high110 Ų11079 Ų7968%0.67541%0.409SS*.THydrogen-bonded Turntrans-91.9-25.8-17862.30000112.9D104D104-T107 WeakPolarHBondContact CB-OG1 3.34Å; D104-T107 PolarHBondContact OD1-N 2.69Å
108Q90.3Very high90Very high92 Ų9273.4 Ų73.443%0.4339%0.392SS..  trans-129.752-173.8-55.8179.9-55.800112.8V103 D104 W110 R111 W112V103-Q108 HydrophobicContact CG1-CB 4.31Å; D104-Q108 WeakPolarHBondContact O-CA 3.24Å; D104-Q108 WeakPolarHBondContact O-CB 3.46Å; D104-Q108 PolarHBondContact O-N 2.94Å; Q108-W110 PolarHBondContact O-N 3.08Å; Q108-R111 HydrophobicContact CB-CB 4.03Å; Q108-R111 PolarHBondContact O-N 3.34Å; Q108-W112 PolarHBondContact O-N 3.46Å
109F88.4Confident89.9Confident81 Ų8168.2 Ų68.236%0.35537%0.366SS..Hα-helixtrans-48.1-51.6-174.9178.1-97.3000114R111 W112 F113F109-R111 VanDerWaalsContact C-N 3.35Å; F109-R111 PolarHBondContact O-N 3.26Å; F109-W112 HydrophobicContact CD2-CE3 4.49Å; F109-W112 HydrophobicContact CE2-CE3 4.46Å; F109-W112 HydrophobicContact CE2-CZ3 4.37Å; F109-W112 WeakPolarHBondContact O-CB 3.31Å; F109-W112 PolarHBondContact O-N 3.49Å; F109-F113 WeakPolarHBondContact O-CB 3.46Å; F109-F113 PolarHBondContact O-N 2.96Å
110W89.9Confident89.7Confident193 Ų19365.3 Ų65.373%0.73135%0.353SS*.Hα-helixtrans-66.5-34.6-177.8-69.7117.5000113.4Q108 F113 A114Q108-W110 PolarHBondContact O-N 3.08Å; W110-F113 HydrophobicContact CE3-CD1 4.31Å; W110-F113 HydrophobicContact CZ3-CD1 4.32Å; W110-F113 PolarHBondContact O-N 3.27Å; W110-A114 WeakPolarHBondContact O-CB 3.36Å; W110-A114 PolarHBondContact O-N 2.95Å
111R90.8Very high89.7Confident126 Ų12664.1 Ų64.148%0.47535%0.348SS..Hα-helixtrans-68.8-40.8175-177.962.9179.987.70.6111.2F99 V103 Q108 F109 G115F99-R111 PolarHBondContact O-NH1 2.89Å; F99-R111 VanDerWaalsContact O-NH1 3.16Å; V103-R111 HydrophobicContact CG1-CB 4.13Å; V103-R111 HydrophobicContact CG1-CG 3.83Å; V103-R111 HydrophobicContact CG2-CG 4Å; Q108-R111 HydrophobicContact CB-CB 4.03Å; Q108-R111 PolarHBondContact O-N 3.34Å; F109-R111 VanDerWaalsContact C-N 3.35Å; F109-R111 PolarHBondContact O-N 3.26Å; R111-G115 PolarHBondContact O-N 3.38Å
112W91.1Very high89.8Confident31 Ų3162.7 Ų62.712%0.11733%0.331CS..Hα-helixtrans-64.7-44174.417591.3000111.3L100 V103 Q105 Q108 F109 G115 N116 F192L100-W112 HydrophobicContact CD2-CG 4.4Å; L100-W112 WeakPolarHBondContact CD2-O 3.34Å; V103-W112 HydrophobicContact CG1-CB 3.81Å; Q105-W112 HydrophobicContact CB-CD2 4.15Å; Q105-W112 HydrophobicContact CB-CG 3.93Å; Q105-W112 HydrophobicContact CG-CD2 3.67Å; Q105-W112 HydrophobicContact CG-CE3 4.08Å; Q105-W112 HydrophobicContact CG-CG 3.97Å; Q105-W112 HydrophobicContact CG-CZ2 4.16Å; Q108-W112 PolarHBondContact O-N 3.46Å; F109-W112 HydrophobicContact CD2-CE3 4.49Å; F109-W112 HydrophobicContact CE2-CE3 4.46Å; F109-W112 HydrophobicContact CE2-CZ3 4.37Å; F109-W112 WeakPolarHBondContact O-CB 3.31Å; F109-W112 PolarHBondContact O-N 3.49Å; W112-G115 PolarHBondContact O-N 2.93Å; W112-N116 VanDerWaalsContact CZ2-ND2 3.27Å; W112-N116 WeakPolarHBondContact CZ2-ND2 3.41Å; W112-N116 PolarHBondContact NE1-ND2 2.69Å; W112-N116 VanDerWaalsContact NE1-ND2 3.17Å; W112-N116 WeakPolarHBondContact O-CB 3.48Å; W112-N116 PolarHBondContact O-N 2.99Å; W112-N116 PolarHBondContact O-ND2 3.22Å; W112-F192 HydrophobicContact CH2-CD1 4.19Å; W112-F192 HydrophobicContact CH2-CE1 4.32Å
113F89.5Confident89.9Confident35 Ų3559 Ų5915%0.15429%0.292CS..Hα-helixtrans-62.4-52.1178.6-176.4-102.9000110.7F109 W110 G115 N116 L117 A189 F192F109-F113 WeakPolarHBondContact O-CB 3.46Å; F109-F113 PolarHBondContact O-N 2.96Å; W110-F113 HydrophobicContact CE3-CD1 4.31Å; W110-F113 HydrophobicContact CZ3-CD1 4.32Å; W110-F113 PolarHBondContact O-N 3.27Å; F113-G115 VanDerWaalsContact C-N 3.31Å; F113-G115 PolarHBondContact O-N 3.46Å; F113-N116 PolarHBondContact O-N 3.31Å; F113-N116 VanDerWaalsContact O-N 3.14Å; F113-L117 HydrophobicContact CD1-CD1 4.01Å; F113-L117 HydrophobicContact CD1-CG 4.42Å; F113-L117 HydrophobicContact CE1-CD1 3.51Å; F113-L117 HydrophobicContact CE1-CG 4.2Å; F113-L117 HydrophobicContact CZ-CD1 3.97Å; F113-L117 HydrophobicContact CZ-CD2 4.43Å; F113-L117 HydrophobicContact CZ-CG 4.38Å; F113-L117 WeakPolarHBondContact O-CG 3.4Å; F113-L117 PolarHBondContact O-N 3.4Å; F113-A189 HydrophobicContact CZ-CB 3.99Å; F113-F192 HydrophobicContact CD2-CB 4.45Å; F113-F192 HydrophobicContact CE2-CB 3.96Å
114A92.3Very high90Very high52 Ų5258.5 Ų58.543%0.4329%0.292SS..Hα-helixtrans-58.2-41.9175.400000112.2W110 N116 L117 A118W110-A114 WeakPolarHBondContact O-CB 3.36Å; W110-A114 PolarHBondContact O-N 2.95Å; A114-N116 PolarHBondContact O-N 3.5Å; A114-L117 PolarHBondContact O-N 3.23Å; A114-A118 WeakPolarHBondContact O-CB 3.36Å; A114-A118 PolarHBondContact O-N 3.33Å
115G92.4Very high90.3Very high1 Ų155.8 Ų55.81%0.0128%0.281CS..Hα-helixtrans-63-38.1175.900000113.3F99 R111 W112 F113 S119F99-G115 WeakPolarHBondContact CB-O 3.39Å; R111-G115 PolarHBondContact O-N 3.38Å; W112-G115 PolarHBondContact O-N 2.93Å; F113-G115 VanDerWaalsContact C-N 3.31Å; F113-G115 PolarHBondContact O-N 3.46Å; G115-S119 WeakPolarHBondContact O-CB 3.28Å; G115-S119 PolarHBondContact O-N 2.94Å
116N89.6Confident90.9Very high16 Ų1652.6 Ų52.69%0.08627%0.268CS..Hα-helixtrans-69.5-38.7175.9-87.3-73.5000112.4L100 W112 F113 A114 G120L100-N116 WeakPolarHBondContact CD1-OD1 3.45Å; W112-N116 VanDerWaalsContact CZ2-ND2 3.27Å; W112-N116 WeakPolarHBondContact CZ2-ND2 3.41Å; W112-N116 PolarHBondContact NE1-ND2 2.69Å; W112-N116 VanDerWaalsContact NE1-ND2 3.17Å; W112-N116 WeakPolarHBondContact O-CB 3.48Å; W112-N116 PolarHBondContact O-N 2.99Å; W112-N116 PolarHBondContact O-ND2 3.22Å; F113-N116 PolarHBondContact O-N 3.31Å; F113-N116 VanDerWaalsContact O-N 3.14Å; A114-N116 PolarHBondContact O-N 3.5Å; N116-G120 PolarHBondContact O-N 2.89Å
117L92Very high91.3Very high27 Ų2743.6 Ų43.614%0.14123%0.23CC..Hα-helixtrans-64.7-46.3173.8-64.6-172.1000111.1F113 A114 G120 G121 R188 A189F113-L117 HydrophobicContact CD1-CD1 4.01Å; F113-L117 HydrophobicContact CD1-CG 4.42Å; F113-L117 HydrophobicContact CE1-CD1 3.51Å; F113-L117 HydrophobicContact CE1-CG 4.2Å; F113-L117 HydrophobicContact CZ-CD1 3.97Å; F113-L117 HydrophobicContact CZ-CD2 4.43Å; F113-L117 HydrophobicContact CZ-CG 4.38Å; F113-L117 WeakPolarHBondContact O-CG 3.4Å; F113-L117 PolarHBondContact O-N 3.4Å; A114-L117 PolarHBondContact O-N 3.23Å; L117-G120 PolarHBondContact O-N 3.09Å; L117-G121 PolarHBondContact O-N 2.93Å; L117-R188 HydrophobicContact CD2-CB 3.82Å; L117-A189 HydrophobicContact CD1-CB 3.94Å; L117-A189 HydrophobicContact CD2-CB 3.83Å
118A93.1Very high91.5Very high39 Ų3938.9 Ų38.932%0.32220%0.201SC..Hα-helixtrans-63.5-47.2177.600000111.8F99 A114 G120 G121 A122F99-A118 HydrophobicContact CB-CB 4.41Å; F99-A118 HydrophobicContact CD1-CB 3.67Å; F99-A118 HydrophobicContact CD2-CB 4.28Å; F99-A118 HydrophobicContact CE1-CB 3.92Å; F99-A118 HydrophobicContact CE2-CB 4.49Å; F99-A118 HydrophobicContact CG-CB 3.87Å; F99-A118 HydrophobicContact CZ-CB 4.32Å; A114-A118 WeakPolarHBondContact O-CB 3.36Å; A114-A118 PolarHBondContact O-N 3.33Å; A118-G120 VanDerWaalsContact C-N 3.35Å; A118-G120 PolarHBondContact O-N 3.44Å; A118-G121 PolarHBondContact O-N 2.87Å; A118-A122 WeakPolarHBondContact O-CB 3.2Å; A118-A122 PolarHBondContact O-N 3.32Å
119S91.9Very high91.8Very high5 Ų537.5 Ų37.54%0.03520%0.2CC..Hα-helixtrans-59.3-46175.81740000111.8K96 G115 A123K96-S119 PolarHBondContact N-OG 3.01Å; G115-S119 WeakPolarHBondContact O-CB 3.28Å; G115-S119 PolarHBondContact O-N 2.94Å; S119-A123 VanDerWaalsContact O-CB 3.29Å; S119-A123 WeakPolarHBondContact O-CB 3.47Å; S119-A123 PolarHBondContact O-N 3.18Å
120G88.6Confident92.1Very high0 Ų039.9 Ų39.90%021%0.211CC..Hα-helixtrans-66.9-43.1178.700000114.2N116 L117 A118 G124 R188N116-G120 PolarHBondContact O-N 2.89Å; L117-G120 PolarHBondContact O-N 3.09Å; A118-G120 VanDerWaalsContact C-N 3.35Å; A118-G120 PolarHBondContact O-N 3.44Å; G120-G124 PolarHBondContact O-N 3.42Å; G120-R188 VanDerWaalsContact CA-NE 3.34Å; G120-R188 VanDerWaalsContact CA-NH1 3.32Å
121G91.9Very high92.4Very high5 Ų530.9 Ų30.95%0.05218%0.177CC..Hα-helixtrans-64.2-46.2176.500000111.6L117 A118 G124 A125L117-G121 PolarHBondContact O-N 2.93Å; A118-G121 PolarHBondContact O-N 2.87Å; G121-G124 PolarHBondContact O-N 3.38Å; G121-A125 VanDerWaalsContact O-CB 3.29Å; G121-A125 WeakPolarHBondContact O-CB 3.39Å; G121-A125 PolarHBondContact O-N 3.33Å
122A93.5Very high92.6Very high23 Ų2324.9 Ų24.919%0.1915%0.154CC..Hα-helixtrans-63.8-49.4177.300000111.8Y95 F99 A118 G124 A125 T126Y95-A122 HydrophobicContact CD1-CB 3.77Å; Y95-A122 HydrophobicContact CD2-CB 4.23Å; Y95-A122 HydrophobicContact CE1-CB 3.8Å; Y95-A122 HydrophobicContact CE2-CB 4.22Å; Y95-A122 HydrophobicContact CG-CB 4.01Å; F99-A122 HydrophobicContact CE2-CB 3.83Å; F99-A122 HydrophobicContact CZ-CB 4.39Å; A118-A122 WeakPolarHBondContact O-CB 3.2Å; A118-A122 PolarHBondContact O-N 3.32Å; A122-G124 VanDerWaalsContact C-N 3.29Å; A122-G124 PolarHBondContact O-N 3.47Å; A122-A125 PolarHBondContact O-N 3.44Å; A122-T126 WeakPolarHBondContact O-CB 3.36Å; A122-T126 PolarHBondContact O-N 3.38Å; A122-T126 PolarHBondContact O-OG1 2.66Å
123A91Very high93Very high6 Ų624.3 Ų24.35%0.0516%0.155CC..Hα-helixtrans-59.7-40.9176.500000112.1Y95 S119 S127Y95-A123 HydrophobicContact CD2-CB 3.82Å; Y95-A123 HydrophobicContact CE2-CB 4.39Å; S119-A123 VanDerWaalsContact O-CB 3.29Å; S119-A123 WeakPolarHBondContact O-CB 3.47Å; S119-A123 PolarHBondContact O-N 3.18Å; A123-S127 WeakPolarHBondContact O-CB 3.13Å; A123-S127 PolarHBondContact O-N 3.01Å; A123-S127 PolarHBondContact O-OG 3.2Å
124G90.3Very high93.3Very high16 Ų1623.9 Ų23.917%0.16515%0.154CC..Hα-helixtrans-64.6-4817600000112.7G120 G121 A122 S127 L128G120-G124 PolarHBondContact O-N 3.42Å; G121-G124 PolarHBondContact O-N 3.38Å; A122-G124 VanDerWaalsContact C-N 3.29Å; A122-G124 PolarHBondContact O-N 3.47Å; G124-S127 PolarHBondContact O-N 3.23Å; G124-L128 WeakPolarHBondContact O-CB 3.47Å; G124-L128 VanDerWaalsContact O-CG 3.28Å; G124-L128 WeakPolarHBondContact O-CG 3.32Å; G124-L128 PolarHBondContact O-N 3.01Å
125A94.6Very high93.5Very high22 Ų2221.9 Ų21.918%0.18214%0.136CC..Hα-helixtrans-61.2-47.8178.100000111.3G121 A122 S127 L128 C129 V181G121-A125 VanDerWaalsContact O-CB 3.29Å; G121-A125 WeakPolarHBondContact O-CB 3.39Å; G121-A125 PolarHBondContact O-N 3.33Å; A122-A125 PolarHBondContact O-N 3.44Å; A125-S127 VanDerWaalsContact C-N 3.32Å; A125-S127 PolarHBondContact O-N 2.94Å; A125-L128 CarbonylContact O-C 3.56Å; A125-L128 PolarHBondContact O-N 3.4Å; A125-L128 VanDerWaalsContact O-N 3.14Å; A125-C129 PolarHBondContact O-N 2.92Å; A125-C129 PolarHBondContact O-SG 3.18Å; A125-V181 HydrophobicContact CB-CG1 4.14Å; A125-V181 HydrophobicContact CB-CG2 3.95Å
126T94.8Very high93.7Very high26 Ų2621.8 Ų21.816%0.1614%0.135CC..Hα-helixtrans-59.6-42.9176.8-60.70000111.6F91 Y95 A122 L128 C129 F130F91-T126 HydrophobicContact CD2-CG2 3.88Å; F91-T126 HydrophobicContact CE2-CG2 4.08Å; F91-T126 HydrophobicContact CG-CG2 4.15Å; Y95-T126 PolarHBondContact OH-OG1 3.38Å; A122-T126 WeakPolarHBondContact O-CB 3.36Å; A122-T126 PolarHBondContact O-N 3.38Å; A122-T126 PolarHBondContact O-OG1 2.66Å; T126-L128 PolarHBondContact O-N 3.17Å; T126-C129 WeakPolarHBondContact O-CB 3.47Å; T126-C129 PolarHBondContact O-N 3.21Å; T126-F130 VanDerWaalsContact O-CD2 3.26Å; T126-F130 WeakPolarHBondContact O-CD2 3.28Å
127S92.7Very high94.1Very high10 Ų1021 Ų217%0.0713%0.131CC..Hα-helixtrans-60.7-48175.3-59.80000111.1A123 G124 A125 C129 F130 V131A123-S127 WeakPolarHBondContact O-CB 3.13Å; A123-S127 PolarHBondContact O-N 3.01Å; A123-S127 PolarHBondContact O-OG 3.2Å; G124-S127 PolarHBondContact O-N 3.23Å; A125-S127 VanDerWaalsContact C-N 3.32Å; A125-S127 PolarHBondContact O-N 2.94Å; S127-C129 VanDerWaalsContact C-N 3.27Å; S127-C129 PolarHBondContact O-N 2.88Å; S127-F130 PolarHBondContact O-N 3.11Å; S127-F130 VanDerWaalsContact O-N 3.1Å; S127-V131 WeakPolarHBondContact O-CG2 3.35Å; S127-V131 PolarHBondContact O-N 3.31Å
128L93.9Very high94.3Very high11 Ų1120.6 Ų20.66%0.05813%0.128CC..Hα-helixtrans-63.1-30.5178.9-70.2176.1000112.4G124 A125 T126 F130 V131 Y132 F177 S180 V181 I184G124-L128 WeakPolarHBondContact O-CB 3.47Å; G124-L128 VanDerWaalsContact O-CG 3.28Å; G124-L128 WeakPolarHBondContact O-CG 3.32Å; G124-L128 PolarHBondContact O-N 3.01Å; A125-L128 CarbonylContact O-C 3.56Å; A125-L128 PolarHBondContact O-N 3.4Å; A125-L128 VanDerWaalsContact O-N 3.14Å; T126-L128 PolarHBondContact O-N 3.17Å; L128-F130 PolarHBondContact O-N 2.62Å; L128-V131 HydrophobicContact CD2-CG2 4.43Å; L128-V131 PolarHBondContact O-N 3.03Å; L128-Y132 HydrophobicContact CB-CD2 4.21Å; L128-Y132 HydrophobicContact CD1-CD2 4.4Å; L128-Y132 HydrophobicContact CD2-CD2 3.99Å; L128-Y132 HydrophobicContact CG-CD2 4.43Å; L128-Y132 WeakPolarHBondContact O-CB 3.5Å; L128-Y132 PolarHBondContact O-N 3.1Å; L128-F177 HydrophobicContact CB-CD2 4.27Å; L128-F177 HydrophobicContact CB-CE2 3.56Å; L128-F177 HydrophobicContact CB-CZ 4.33Å; L128-S180 WeakPolarHBondContact CD1-OG 3.21Å; L128-V181 HydrophobicContact CD1-CG2 4.47Å; L128-I184 HydrophobicContact CD1-CD1 3.51Å; L128-I184 HydrophobicContact CG-CD1 4.4Å
129C95.2Very high94.5Very high62 Ų6218.8 Ų18.842%0.41911%0.112SC..Hα-helixtrans-52.5-29.6173.9-69.30000112.5A125 T126 S127 Y174A125-C129 PolarHBondContact O-N 2.92Å; A125-C129 PolarHBondContact O-SG 3.18Å; T126-C129 WeakPolarHBondContact O-CB 3.47Å; T126-C129 PolarHBondContact O-N 3.21Å; S127-C129 VanDerWaalsContact C-N 3.27Å; S127-C129 PolarHBondContact O-N 2.88Å; C129-Y174 WeakPolarHBondContact O-CE1 3.49Å; C129-Y174 PolarHBondContact O-OH 3.36Å
130F94.9Very high94.7Very high132 Ų13218.7 Ų18.758%0.57911%0.111SC*.Hα-helixtrans-102.1-43177.9-60.3-86.4000113.2L87 T126 S127 L128L87-F130 HydrophobicContact CD1-CB 3.75Å; L87-F130 HydrophobicContact CD1-CD2 3.67Å; L87-F130 HydrophobicContact CD1-CG 3.96Å; L87-F130 HydrophobicContact CD2-CD2 3.8Å; L87-F130 HydrophobicContact CD2-CE2 3.98Å; L87-F130 HydrophobicContact CD2-CG 4.42Å; L87-F130 HydrophobicContact CG-CD2 4.42Å; T126-F130 VanDerWaalsContact O-CD2 3.26Å; T126-F130 WeakPolarHBondContact O-CD2 3.28Å; S127-F130 PolarHBondContact O-N 3.11Å; S127-F130 VanDerWaalsContact O-N 3.1Å; L128-F130 PolarHBondContact O-N 2.62Å
131V95.5Very high95.1Very high4 Ų419 Ų192%0.02411%0.113CC..Hα-helixtrans-95.9-4.8-169.8-52.10000114.4R80 P83 L87 S127 L128 P133 L134 D135R80-V131 HydrophobicContact CG-CB 4.18Å; R80-V131 HydrophobicContact CG-CG2 4.21Å; P83-V131 HydrophobicContact CB-CG1 3.84Å; P83-V131 HydrophobicContact CG-CG1 3.75Å; L87-V131 HydrophobicContact CD1-CG1 4.34Å; S127-V131 WeakPolarHBondContact O-CG2 3.35Å; S127-V131 PolarHBondContact O-N 3.31Å; L128-V131 HydrophobicContact CD2-CG2 4.43Å; L128-V131 PolarHBondContact O-N 3.03Å; V131-P133 VanDerWaalsContact C-CD 3.48Å; V131-L134 WeakPolarHBondContact O-CB 3.1Å; V131-L134 PolarHBondContact O-N 2.95Å; V131-L134 VanDerWaalsContact O-N 3.08Å; V131-D135 PolarHBondContact O-N 3.4Å
132Y97Very high95.3Very high0 Ų018.9 Ų18.90%011%0.111CC..Hα-helixtrans-58.8-38.2-179.4-162.9-80.8000114L128 L134 D135 F136 L173 Y174 Q175 G176 F177 S180 M239L128-Y132 HydrophobicContact CB-CD2 4.21Å; L128-Y132 HydrophobicContact CD1-CD2 4.4Å; L128-Y132 HydrophobicContact CD2-CD2 3.99Å; L128-Y132 HydrophobicContact CG-CD2 4.43Å; L128-Y132 WeakPolarHBondContact O-CB 3.5Å; L128-Y132 PolarHBondContact O-N 3.1Å; Y132-L134 PolarHBondContact O-N 2.91Å; Y132-D135 WeakPolarHBondContact O-CB 3.19Å; Y132-D135 PolarHBondContact O-N 3.31Å; Y132-F136 HydrophobicContact CD1-CB 4.46Å; Y132-F136 PolarHBondContact O-N 3.32Å; Y132-L173 VanDerWaalsContact CD1-O 3.28Å; Y132-L173 WeakPolarHBondContact CD1-O 3.46Å; Y132-Y174 HydrophobicContact CD1-CD1 4.27Å; Y132-Y174 HydrophobicContact CD1-CG 4.42Å; Y132-Y174 HydrophobicContact CG-CD1 4.23Å; Y132-Q175 PolarHBondContact OH-O 3.12Å; Y132-G176 WeakPolarHBondContact OH-CA 3.39Å; Y132-G176 PolarHBondContact OH-O 3.25Å; Y132-F177 AromaticContact CD2-CD2 3.7Å; Y132-F177 HydrophobicContact CD2-CD2 3.7Å; Y132-F177 HydrophobicContact CD2-CE2 4.44Å; Y132-F177 HydrophobicContact CE2-CB 4.26Å; Y132-F177 HydrophobicContact CE2-CD2 4.12Å; Y132-F177 HydrophobicContact CG-CD2 4.12Å; Y132-F177 PolarHBondContact OH-N 2.71Å; Y132-S180 WeakPolarHBondContact CE2-OG 3.36Å; Y132-M239 HydrophobicContact CD1-CE 4.41Å; Y132-M239 HydrophobicContact CE1-CE 3.54Å; Y132-M239 HydrophobicContact CE2-CE 4.11Å; Y132-M239 WeakPolarHBondContact OH-CE 3.35Å
133P97.6Very high95.5Very high19 Ų1917.9 Ų17.912%0.12310%0.103CC..Hα-helixtrans-57.2-34.1174.8-27.737.2000113.1V131 F136 A137 L161 L173 Y174V131-P133 VanDerWaalsContact C-CD 3.48Å; P133-F136 WeakPolarHBondContact O-CB 3.38Å; P133-F136 PolarHBondContact O-N 2.92Å; P133-A137 WeakPolarHBondContact O-CB 3.44Å; P133-A137 PolarHBondContact O-N 3.38Å; P133-L161 HydrophobicContact CB-CD2 3.76Å; P133-L161 WeakPolarHBondContact O-CD2 3.28Å; P133-L173 HydrophobicContact CB-CB 4.49Å; P133-L173 HydrophobicContact CG-CB 4.45Å; P133-Y174 HydrophobicContact CG-CD2 4.43Å; P133-Y174 HydrophobicContact CG-CE2 3.57Å
134L97.1Very high95.6Very high26 Ų2617.6 Ų17.614%0.13610%0.101CC..Hα-helixtrans-66.3-44.7174.5-61176.3000111.1A76 I79 R80 P83 V131 Y132 F136 A137 R138 L157A76-L134 HydrophobicContact CB-CB 4.5Å; I79-L134 HydrophobicContact CG2-CD1 3.95Å; I79-L134 HydrophobicContact CG2-CD2 4.46Å; R80-L134 HydrophobicContact CB-CD1 4.09Å; R80-L134 HydrophobicContact CG-CD1 4.49Å; P83-L134 HydrophobicContact CG-CD1 4.42Å; V131-L134 WeakPolarHBondContact O-CB 3.1Å; V131-L134 PolarHBondContact O-N 2.95Å; V131-L134 VanDerWaalsContact O-N 3.08Å; Y132-L134 PolarHBondContact O-N 2.91Å; L134-F136 VanDerWaalsContact C-N 3.29Å; L134-F136 PolarHBondContact O-N 3.44Å; L134-A137 PolarHBondContact O-N 2.75Å; L134-R138 WeakPolarHBondContact O-CB 3.48Å; L134-R138 PolarHBondContact O-N 2.98Å; L134-L157 HydrophobicContact CD2-CD1 4.26Å; L134-L157 HydrophobicContact CD2-CD2 4.07Å
135D95.6Very high95.8Very high9 Ų918.1 Ų18.15%0.04810%0.1CC..Hα-helixtrans-61.5-38.8175-83.9-17.1000112.2R80 V131 Y132 T139 R235 R236 M239R80-D135 WeakPolarHBondContact CD-OD1 3.4Å; R80-D135 IonicContact CZ-OD1 3.24Å; R80-D135 IonicContact NE-OD1 3.85Å; R80-D135 PolarHBondContact NE-OD1 2.86Å; V131-D135 PolarHBondContact O-N 3.4Å; Y132-D135 WeakPolarHBondContact O-CB 3.19Å; Y132-D135 PolarHBondContact O-N 3.31Å; D135-T139 PolarHBondContact O-N 3.12Å; D135-T139 VanDerWaalsContact O-N 3.17Å; D135-T139 PolarHBondContact O-OG1 3.48Å; D135-R235 IonicContact OD2-CZ 3.73Å; D135-R235 IonicContact OD2-NH1 3.9Å; D135-R235 IonicContact OD2-NH2 2.75Å; D135-R235 PolarHBondContact OD2-NH2 2.98Å; D135-R236 PolarHBondContact O-NH1 3.12Å; D135-M239 HydrophobicContact CB-CE 4.36Å
136F97.4Very high95.6Very high0 Ų017.3 Ų17.30%09%0.093CC..Hα-helixtrans-63-56.5176.8170-87.6000111Y132 P133 L134 R138 T139 R140 I164 G172 L173 M239 S242Y132-F136 HydrophobicContact CD1-CB 4.46Å; Y132-F136 PolarHBondContact O-N 3.32Å; P133-F136 WeakPolarHBondContact O-CB 3.38Å; P133-F136 PolarHBondContact O-N 2.92Å; L134-F136 VanDerWaalsContact C-N 3.29Å; L134-F136 PolarHBondContact O-N 3.44Å; F136-R138 VanDerWaalsContact C-N 3.25Å; F136-R138 PolarHBondContact O-N 2.85Å; F136-T139 PolarHBondContact O-N 3.45Å; F136-R140 HydrophobicContact CD1-CG 4.36Å; F136-R140 HydrophobicContact CE1-CG 3.83Å; F136-R140 HydrophobicContact CE2-CG 4.09Å; F136-R140 HydrophobicContact CZ-CG 3.67Å; F136-R140 PolarHBondContact O-N 3.49Å; F136-I164 HydrophobicContact CE1-CB 4.07Å; F136-I164 HydrophobicContact CE1-CG1 3.79Å; F136-I164 HydrophobicContact CE1-CG2 3.92Å; F136-I164 HydrophobicContact CZ-CB 4.28Å; F136-I164 HydrophobicContact CZ-CD1 4.46Å; F136-I164 HydrophobicContact CZ-CG1 3.89Å; F136-I164 HydrophobicContact CZ-CG2 3.77Å; F136-G172 WeakPolarHBondContact CE2-O 3.13Å; F136-L173 WeakPolarHBondContact CB-O 3.15Å; F136-L173 HydrophobicContact CD1-CD2 3.9Å; F136-L173 HydrophobicContact CE1-CD2 3.94Å; F136-M239 HydrophobicContact CB-CE 4.49Å; F136-M239 HydrophobicContact CD2-CB 3.84Å; F136-M239 HydrophobicContact CD2-CG 3.92Å; F136-M239 HydrophobicContact CE2-CB 4.09Å; F136-M239 VanDerWaalsContact CE2-O 3.22Å; F136-M239 WeakPolarHBondContact CE2-O 3.06Å; F136-S242 WeakPolarHBondContact CE2-OG 3.43Å
137A97.4Very high95.1Very high0 Ų021.3 Ų21.30%011%0.108CC..Hα-helixtrans-63.4-36.5-176.800000111.6P133 L134 T139 R140 L141 L157 C160 L161P133-A137 WeakPolarHBondContact O-CB 3.44Å; P133-A137 PolarHBondContact O-N 3.38Å; L134-A137 PolarHBondContact O-N 2.75Å; A137-T139 PolarHBondContact O-N 3.46Å; A137-R140 PolarHBondContact O-N 2.92Å; A137-L141 VanDerWaalsContact O-CB 3.3Å; A137-L141 WeakPolarHBondContact O-CB 3.12Å; A137-L141 WeakPolarHBondContact O-CD1 3.24Å; A137-L141 WeakPolarHBondContact O-CG 3.36Å; A137-L141 PolarHBondContact O-N 3.32Å; A137-L157 HydrophobicContact CB-CD1 3.32Å; A137-C160 HydrophobicContact CB-CB 4.11Å; A137-L161 HydrophobicContact CB-CD2 3.81Å; A137-L161 HydrophobicContact CB-CG 4.07Å
138R96.7Very high94.7Very high18 Ų1824.5 Ų24.57%0.06813%0.131CC..Hα-helixtrans-55.3-49.6171.7-170.8-151.4164.4170.610.3112.2E30 G73 A76 N77 L134 F136 A142E30-R138 VanDerWaalsContact CD-NH1 3.27Å; E30-R138 IonicContact OE1-CZ 3.32Å; E30-R138 VanDerWaalsContact OE1-CZ 3.27Å; E30-R138 IonicContact OE1-NH1 3.27Å; E30-R138 PolarHBondContact OE1-NH1 3.05Å; E30-R138 IonicContact OE1-NH2 3.16Å; E30-R138 PolarHBondContact OE1-NH2 3.26Å; E30-R138 VanDerWaalsContact OE1-NH2 3.11Å; E30-R138 IonicContact OE2-CZ 3.96Å; E30-R138 IonicContact OE2-NH1 3.49Å; E30-R138 IonicContact OE2-NH2 3.74Å; E30-R138 PolarHBondContact OE2-NH2 3.34Å; G73-R138 WeakPolarHBondContact O-CG 3.18Å; A76-R138 HydrophobicContact CB-CB 3.74Å; A76-R138 HydrophobicContact CB-CG 4.19Å; N77-R138 PolarHBondContact ND2-NE 2.93Å; N77-R138 PolarHBondContact ND2-NH2 3.14Å; N77-R138 VanDerWaalsContact OD1-CD 3.3Å; N77-R138 WeakPolarHBondContact OD1-CD 3.32Å; N77-R138 PolarHBondContact OD1-NE 3.47Å; N77-R138 PolarHBondContact OD1-NH1 2.92Å; N77-R138 PolarHBondContact OD1-NH2 3.15Å; L134-R138 WeakPolarHBondContact O-CB 3.48Å; L134-R138 PolarHBondContact O-N 2.98Å; F136-R138 VanDerWaalsContact C-N 3.25Å; F136-R138 PolarHBondContact O-N 2.85Å; R138-A142 WeakPolarHBondContact O-CB 3.07Å; R138-A142 PolarHBondContact O-N 2.92Å
139T96.9Very high94.2Very high0 Ų027 Ų270%016%0.159CC..Hα-helixtrans-64.8-43.5179.4-71.10000111.9D135 F136 A137 A142 A143 R236 M239 M240D135-T139 PolarHBondContact O-N 3.12Å; D135-T139 VanDerWaalsContact O-N 3.17Å; D135-T139 PolarHBondContact O-OG1 3.48Å; F136-T139 PolarHBondContact O-N 3.45Å; A137-T139 PolarHBondContact O-N 3.46Å; T139-A142 PolarHBondContact O-N 2.97Å; T139-A143 WeakPolarHBondContact O-CB 3.46Å; T139-A143 PolarHBondContact O-N 3.3Å; T139-R236 HydrophobicContact CG2-CB 4.32Å; T139-R236 VanDerWaalsContact OG1-CD 3.24Å; T139-R236 WeakPolarHBondContact OG1-CD 3.39Å; T139-R236 PolarHBondContact OG1-NH1 3.24Å; T139-M239 HydrophobicContact CG2-SD 4.1Å; T139-M240 HydrophobicContact CG2-SD 4.43Å
140R97.2Very high93.5Very high3 Ų329.3 Ų29.31%0.01118%0.183CC..Hα-helixtrans-64.2-44178.8-68.2-61.3-71.1-90.8-0.5112.5F136 A137 A142 A143 D144 E153 F154 M239 S242F136-R140 HydrophobicContact CD1-CG 4.36Å; F136-R140 HydrophobicContact CE1-CG 3.83Å; F136-R140 HydrophobicContact CE2-CG 4.09Å; F136-R140 HydrophobicContact CZ-CG 3.67Å; F136-R140 PolarHBondContact O-N 3.49Å; A137-R140 PolarHBondContact O-N 2.92Å; R140-A142 VanDerWaalsContact C-N 3.35Å; R140-A142 PolarHBondContact O-N 3.17Å; R140-A143 PolarHBondContact O-N 3.3Å; R140-D144 PolarHBondContact O-N 3.4Å; R140-E153 IonicContact CZ-OE1 2.72Å; R140-E153 IonicContact NE-OE1 3.95Å; R140-E153 IonicContact NH2-OE1 3.67Å; R140-E153 PolarHBondContact NH2-OE1 2.72Å; R140-E153 IonicContact NH2-OE2 3.16Å; R140-F154 HydrophobicContact CB-CD2 4.3Å; R140-F154 HydrophobicContact CB-CE2 3.8Å; R140-F154 HydrophobicContact CG-CE2 4.5Å; R140-M239 PolarHBondContact NH1-O 3.41Å; R140-S242 VanDerWaalsContact CZ-O 3.31Å; R140-S242 PolarHBondContact NH1-O 3.12Å; R140-S242 PolarHBondContact NH2-O 3.38Å
141L96.8Very high93.2Very high8 Ų828.3 Ų28.34%0.04218%0.179CC..Hα-helixtrans-64.4-39.1175-71.9168.2000112.3R72 A137 A143 D144 F154 L157 C160R72-L141 WeakPolarHBondContact CD-O 3.3Å; R72-L141 HydrophobicContact CG-CB 4.37Å; R72-L141 WeakPolarHBondContact CG-O 3.26Å; R72-L141 PolarHBondContact NE-O 2.84Å; A137-L141 VanDerWaalsContact O-CB 3.3Å; A137-L141 WeakPolarHBondContact O-CB 3.12Å; A137-L141 WeakPolarHBondContact O-CD1 3.24Å; A137-L141 WeakPolarHBondContact O-CG 3.36Å; A137-L141 PolarHBondContact O-N 3.32Å; L141-A143 VanDerWaalsContact C-N 3.31Å; L141-D144 PolarHBondContact O-N 3.04Å; L141-F154 HydrophobicContact CD2-CB 3.77Å; L141-L157 HydrophobicContact CD1-CB 4.38Å; L141-C160 HydrophobicContact CG-CB 4.45Å
142A96.1Very high93Very high2 Ų232.5 Ų32.52%0.01720%0.195CC..Hα-helixtrans-66.1-36.4177.700000112.3R31 L34 L35 R138 T139 R140R31-A142 HydrophobicContact CG-CB 4.33Å; R31-A142 PolarHBondContact NE-O 2.9Å; L34-A142 HydrophobicContact CB-CB 4.1Å; L34-A142 HydrophobicContact CD1-CB 3.5Å; L34-A142 VanDerWaalsContact CD1-CB 3.5Å; L34-A142 HydrophobicContact CG-CB 4.45Å; L35-A142 WeakPolarHBondContact CD2-O 3.26Å; R138-A142 WeakPolarHBondContact O-CB 3.07Å; R138-A142 PolarHBondContact O-N 2.92Å; T139-A142 PolarHBondContact O-N 2.97Å; R140-A142 VanDerWaalsContact C-N 3.35Å; R140-A142 PolarHBondContact O-N 3.17Å
143A96.1Very high92.8Very high2 Ų234.6 Ų34.62%0.01721%0.205CC..Hα-helixtrans-77.1-20179.100000114V38 T139 R140 L141 I145 M240V38-A143 HydrophobicContact CG2-CB 3.67Å; T139-A143 WeakPolarHBondContact O-CB 3.46Å; T139-A143 PolarHBondContact O-N 3.3Å; R140-A143 PolarHBondContact O-N 3.3Å; L141-A143 VanDerWaalsContact C-N 3.31Å; A143-I145 PolarHBondContact O-N 2.91Å; A143-M240 HydrophobicContact CB-CE 3.64Å; A143-M240 HydrophobicContact CB-SD 3.78Å
144D94.9Very high92.6Very high0 Ų033.8 Ų33.80%020%0.199CC..  trans-69115.5175.8-175.1-2.3000110.1R31 Q44 R72 R140 L141 G146 E153 F154R31-D144 PolarHBondContact NH2-O 3.24Å; R31-D144 VanDerWaalsContact NH2-O 3.11Å; Q44-D144 PolarHBondContact NE2-OD1 2.95Å; Q44-D144 PolarHBondContact OE1-OD1 3.28Å; R72-D144 IonicContact CZ-OD2 3.71Å; R72-D144 VanDerWaalsContact CZ-OD2 3.29Å; R72-D144 IonicContact NE-OD2 2.9Å; R72-D144 IonicContact NH2-OD2 2.65Å; R72-D144 PolarHBondContact NH2-OD2 3.27Å; R140-D144 PolarHBondContact O-N 3.4Å; L141-D144 PolarHBondContact O-N 3.04Å; D144-G146 PolarHBondContact OD1-N 3.22Å; D144-E153 PolarHBondContact OD1-N 3.01Å; D144-E153 PolarHBondContact OD2-N 3.42Å; D144-F154 PolarHBondContact OD2-N 3.48Å
145I93.3Very high92.4Very high27 Ų2737.1 Ų37.114%0.13823%0.225CC..  trans-102.15-179.459.6147.3000113.3L35 Q44 I45 Q65 A143L35-I145 HydrophobicContact CD2-CG2 3.72Å; Q44-I145 HydrophobicContact CB-CD1 3.86Å; Q44-I145 HydrophobicContact CB-CG1 3.52Å; Q44-I145 HydrophobicContact CG-CG1 4.36Å; I45-I145 HydrophobicContact CD1-CD1 4.34Å; I45-I145 HydrophobicContact CD1-CG1 4.49Å; I45-I145 HydrophobicContact CD1-CG2 3.96Å; I45-I145 HydrophobicContact CG1-CD1 3.44Å; I45-I145 VanDerWaalsContact CG1-CD1 3.44Å; I45-I145 HydrophobicContact CG1-CG1 3.92Å; I45-I145 HydrophobicContact CG1-CG2 4.28Å; Q65-I145 VanDerWaalsContact CG-O 3.28Å; Q65-I145 WeakPolarHBondContact CG-O 3.2Å; Q65-I145 VanDerWaalsContact NE2-CA 3.25Å; Q65-I145 PolarHBondContact NE2-O 2.87Å; A143-I145 PolarHBondContact O-N 2.91Å
146G90.6Very high92.3Very high4 Ų437.9 Ų37.94%0.04123%0.234CC..  trans-63.5135.717800000112.3R72 D144 E151 R152R72-G146 PolarHBondContact NH1-O 2.72Å; R72-G146 VanDerWaalsContact NH1-O 3.16Å; D144-G146 PolarHBondContact OD1-N 3.22Å; G146-E151 WeakPolarHBondContact CA-O 3.37Å; G146-R152 WeakPolarHBondContact O-CG 3.42Å
147K85.2Confident92.2Very high111 Ų11138.9 Ų38.948%0.48324%0.24SC..  trans-70.7-58.4-174-53.3-171.1178.5178.70111E64 E151 R152E64-K147 WeakPolarHBondContact O-CD 3.38Å; E64-K147 WeakPolarHBondContact O-CE 3.35Å; E64-K147 WeakPolarHBondContact O-CG 3.45Å; K147-E151 WeakPolarHBondContact CB-OE2 3.23Å; K147-E151 WeakPolarHBondContact CG-OE2 3.15Å; K147-E151 PolarHBondContact N-OE2 2.7Å; K147-E151 VanDerWaalsContact N-OE2 3.13Å; K147-R152 PolarHBondContact O-NE 3.48Å; K147-R152 PolarHBondContact O-NH2 3.25Å; K147-R152 VanDerWaalsContact O-NH2 3.08Å
148S82.6Confident92.2Very high77 Ų7741.4 Ų41.454%0.53827%0.266SS..SBendtrans-153.5164.6-176.862.20000112.3A150 E151S148-A150 PolarHBondContact O-N 3.36Å; S148-E151 WeakPolarHBondContact O-CB 3.44Å; S148-E151 PolarHBondContact O-N 3.07Å
149G83.2Confident92.2Very high63 Ų6342.5 Ų42.565%0.64928%0.276SS*.G310 helixtrans49.9-123.3170.800000114E151 R152G149-E151 VanDerWaalsContact C-N 3.27Å; G149-E151 PolarHBondContact O-N 3.06Å; G149-R152 WeakPolarHBondContact O-CB 3.21Å; G149-R152 PolarHBondContact O-N 3.43Å
150A82.4Confident92.2Very high111 Ų11142.5 Ų42.592%0.91728%0.276SS*.G310 helixtrans-67.9-19.2-176.500000114.5S148 R152S148-A150 PolarHBondContact O-N 3.36Å; A150-R152 PolarHBondContact O-N 2.83Å
151E87.6Confident92.2Very high110 Ų11044.4 Ų44.451%0.51429%0.286SS..G310 helixtrans-72.7-21.8176.2-61.3-179.2-172.700112.3Q44 G146 K147 S148 G149Q44-E151 PolarHBondContact NE2-O 3.16Å; G146-E151 WeakPolarHBondContact CA-O 3.37Å; K147-E151 WeakPolarHBondContact CB-OE2 3.23Å; K147-E151 WeakPolarHBondContact CG-OE2 3.15Å; K147-E151 PolarHBondContact N-OE2 2.7Å; K147-E151 VanDerWaalsContact N-OE2 3.13Å; S148-E151 WeakPolarHBondContact O-CB 3.44Å; S148-E151 PolarHBondContact O-N 3.07Å; G149-E151 VanDerWaalsContact C-N 3.27Å; G149-E151 PolarHBondContact O-N 3.06Å
152R91.7Very high92.2Very high93 Ų9346.6 Ų46.635%0.35130%0.302SS..  trans-78129.5179.2-68.3-176.5170.1-154.64.7110.1R72 G146 K147 G149 A150 F154R72-R152 VanDerWaalsContact NH1-CZ 3.3Å; R72-R152 VanDerWaalsContact NH1-NE 3.11Å; G146-R152 WeakPolarHBondContact O-CG 3.42Å; K147-R152 PolarHBondContact O-NE 3.48Å; K147-R152 PolarHBondContact O-NH2 3.25Å; K147-R152 VanDerWaalsContact O-NH2 3.08Å; G149-R152 WeakPolarHBondContact O-CB 3.21Å; G149-R152 PolarHBondContact O-N 3.43Å; A150-R152 PolarHBondContact O-N 2.83Å; R152-F154 VanDerWaalsContact C-N 3.27Å; R152-F154 PolarHBondContact O-N 2.88Å
153E91.6Very high92.2Very high44 Ų4451.6 Ų51.621%0.20632%0.324CS..SBendtrans-65.1-37.2173.5-165.2-171.816800111.2R140 D144 K163R140-E153 IonicContact CZ-OE1 2.72Å; R140-E153 IonicContact NE-OE1 3.95Å; R140-E153 IonicContact NH2-OE1 3.67Å; R140-E153 PolarHBondContact NH2-OE1 2.72Å; R140-E153 IonicContact NH2-OE2 3.16Å; D144-E153 PolarHBondContact OD1-N 3.01Å; D144-E153 PolarHBondContact OD2-N 3.42Å; E153-K163 PolarHBondContact O-NZ 3.27Å
154F93.9Very high92.3Very high1 Ų151.7 Ų51.70%0.00432%0.324CS..  trans-139.4136179-49.4-74.7000112R72 R140 L141 D144 R152 G156 C160 K163 I164R72-F154 PolarHBondContact NH2-O 2.89Å; R140-F154 HydrophobicContact CB-CD2 4.3Å; R140-F154 HydrophobicContact CB-CE2 3.8Å; R140-F154 HydrophobicContact CG-CE2 4.5Å; L141-F154 HydrophobicContact CD2-CB 3.77Å; D144-F154 PolarHBondContact OD2-N 3.48Å; R152-F154 VanDerWaalsContact C-N 3.27Å; R152-F154 PolarHBondContact O-N 2.88Å; F154-G156 VanDerWaalsContact C-N 3.33Å; F154-G156 PolarHBondContact O-N 3.37Å; F154-C160 HydrophobicContact CB-CB 4.01Å; F154-C160 HydrophobicContact CD1-CB 3.82Å; F154-C160 HydrophobicContact CD2-CB 4.31Å; F154-C160 HydrophobicContact CE1-CB 4.34Å; F154-C160 HydrophobicContact CG-CB 3.78Å; F154-K163 HydrophobicContact CD1-CB 4.36Å; F154-K163 HydrophobicContact CD1-CD 3.93Å; F154-K163 HydrophobicContact CE1-CB 4.18Å; F154-K163 HydrophobicContact CE1-CD 3.81Å; F154-K163 HydrophobicContact CE1-CG 4.26Å; F154-I164 HydrophobicContact CE1-CD1 4.12Å; F154-I164 HydrophobicContact CE1-CG1 4.02Å; F154-I164 HydrophobicContact CZ-CD1 3.97Å; F154-I164 HydrophobicContact CZ-CG1 4.08Å
155S92.6Very high92.4Very high97 Ų9758.2 Ų58.268%0.67835%0.349SS*.SBendtrans-73.5-24176.961.30000113.3S159S155-S159 WeakPolarHBondContact OG-CB 3.41Å; S155-S159 PolarHBondContact OG-OG 3.14Å
156G94.4Very high92.6Very high24 Ų2465 Ų6525%0.24738%0.378CS..SBendtrans176.6-168.4-179.500000113.3F154 S159 C160F154-G156 VanDerWaalsContact C-N 3.33Å; F154-G156 PolarHBondContact O-N 3.37Å; G156-S159 PolarHBondContact O-N 3.43Å; G156-C160 WeakPolarHBondContact O-CB 3.38Å; G156-C160 PolarHBondContact O-N 2.96Å
157L95.6Very high92.7Very high22 Ų2267.8 Ų67.812%0.11540%0.401CS..Hα-helixtrans-58.5-53.5-176.6176.757.4000112.5L75 A76 I79 L134 A137 L141 S159 C160 L161L75-L157 HydrophobicContact CD2-CB 4.32Å; L75-L157 HydrophobicContact CD2-CD2 4.3Å; L75-L157 HydrophobicContact CG-CD2 4.29Å; A76-L157 HydrophobicContact CB-CD1 4.07Å; A76-L157 HydrophobicContact CB-CD2 4.27Å; I79-L157 HydrophobicContact CD1-CD2 3.89Å; L134-L157 HydrophobicContact CD2-CD1 4.26Å; L134-L157 HydrophobicContact CD2-CD2 4.07Å; A137-L157 HydrophobicContact CB-CD1 3.32Å; L141-L157 HydrophobicContact CD1-CB 4.38Å; L157-S159 PolarHBondContact O-N 3.37Å; L157-C160 PolarHBondContact O-N 2.89Å; L157-L161 HydrophobicContact CD1-CD1 4.04Å; L157-L161 HydrophobicContact CD1-CG 4.25Å; L157-L161 HydrophobicContact CG-CD1 4.37Å; L157-L161 WeakPolarHBondContact O-CG 3.46Å; L157-L161 PolarHBondContact O-N 2.97Å
158G96.6Very high93.2Very high53 Ų5365.3 Ų65.355%0.54639%0.393SS..Hα-helixtrans-62.9-41-179.700000113.1L161 S162G158-L161 PolarHBondContact O-N 3.1Å; G158-S162 VanDerWaalsContact O-CB 3.23Å; G158-S162 WeakPolarHBondContact O-CB 3.5Å; G158-S162 PolarHBondContact O-N 3.34Å
159S96.4Very high93.8Very high41 Ų4162.8 Ų62.829%0.28738%0.379SS..Hα-helixtrans-63.2-42.3175.21690000111.8S155 G156 L157 K163S155-S159 WeakPolarHBondContact OG-CB 3.41Å; S155-S159 PolarHBondContact OG-OG 3.14Å; G156-S159 PolarHBondContact O-N 3.43Å; L157-S159 PolarHBondContact O-N 3.37Å; S159-K163 WeakPolarHBondContact O-CB 3.4Å; S159-K163 PolarHBondContact O-N 3.35Å
160C96.9Very high94.4Very high0 Ų065.1 Ų65.10%038%0.375CS..Hα-helixtrans-60.4-50.5176.4-173.80000112.2A137 L141 F154 G156 L157 I164A137-C160 HydrophobicContact CB-CB 4.11Å; L141-C160 HydrophobicContact CG-CB 4.45Å; F154-C160 HydrophobicContact CB-CB 4.01Å; F154-C160 HydrophobicContact CD1-CB 3.82Å; F154-C160 HydrophobicContact CD2-CB 4.31Å; F154-C160 HydrophobicContact CE1-CB 4.34Å; F154-C160 HydrophobicContact CG-CB 3.78Å; G156-C160 WeakPolarHBondContact O-CB 3.38Å; G156-C160 PolarHBondContact O-N 2.96Å; L157-C160 PolarHBondContact O-N 2.89Å; C160-I164 WeakPolarHBondContact O-CB 3.5Å; C160-I164 WeakPolarHBondContact O-CG1 3.27Å; C160-I164 PolarHBondContact O-N 2.89Å; C160-I164 VanDerWaalsContact O-N 3.12Å
161L97.4Very high95Very high42 Ų4267.4 Ų67.422%0.2237%0.365CS..Hα-helixtrans-62.2-47.4178.9-66.2177.3000111.7P133 A137 L157 G158 Y165 L173P133-L161 HydrophobicContact CB-CD2 3.76Å; P133-L161 WeakPolarHBondContact O-CD2 3.28Å; A137-L161 HydrophobicContact CB-CD2 3.81Å; A137-L161 HydrophobicContact CB-CG 4.07Å; L157-L161 HydrophobicContact CD1-CD1 4.04Å; L157-L161 HydrophobicContact CD1-CG 4.25Å; L157-L161 HydrophobicContact CG-CD1 4.37Å; L157-L161 WeakPolarHBondContact O-CG 3.46Å; L157-L161 PolarHBondContact O-N 2.97Å; G158-L161 PolarHBondContact O-N 3.1Å; L161-Y165 WeakPolarHBondContact O-CB 3.34Å; L161-Y165 PolarHBondContact O-N 3.19Å; L161-L173 HydrophobicContact CD2-CD2 3.83Å
162S97.6Very high95.3Very high54 Ų5462.2 Ų62.238%0.37834%0.341SS..Hα-helixtrans-64.5-46.6-179-176.20000112.3G158 I164 Y165 K166G158-S162 VanDerWaalsContact O-CB 3.23Å; G158-S162 WeakPolarHBondContact O-CB 3.5Å; G158-S162 PolarHBondContact O-N 3.34Å; S162-I164 PolarHBondContact O-N 2.98Å; S162-Y165 PolarHBondContact O-N 3.21Å; S162-K166 WeakPolarHBondContact O-CB 3.47Å; S162-K166 VanDerWaalsContact O-CG 3.31Å; S162-K166 WeakPolarHBondContact O-CG 3.49Å; S162-K166 PolarHBondContact O-N 2.95Å
163K96.5Very high95.6Very high108 Ų10858.5 Ų58.547%0.4733%0.328SS..Hα-helixtrans-63.2-43.6-178.8-174.3173.7174.6-175.80111.6E153 F154 S159 A167E153-K163 PolarHBondContact O-NZ 3.27Å; F154-K163 HydrophobicContact CD1-CB 4.36Å; F154-K163 HydrophobicContact CD1-CD 3.93Å; F154-K163 HydrophobicContact CE1-CB 4.18Å; F154-K163 HydrophobicContact CE1-CD 3.81Å; F154-K163 HydrophobicContact CE1-CG 4.26Å; S159-K163 WeakPolarHBondContact O-CB 3.4Å; S159-K163 PolarHBondContact O-N 3.35Å; K163-A167 PolarHBondContact O-N 2.87Å
164I97.1Very high95.8Very high3 Ų359.2 Ų59.22%0.01533%0.329CS..Hα-helixtrans-72.6-39.5178.8-63.8-59.7000111.7F136 F154 C160 S162 K166 A167 D168 L173F136-I164 HydrophobicContact CE1-CB 4.07Å; F136-I164 HydrophobicContact CE1-CG1 3.79Å; F136-I164 HydrophobicContact CE1-CG2 3.92Å; F136-I164 HydrophobicContact CZ-CB 4.28Å; F136-I164 HydrophobicContact CZ-CD1 4.46Å; F136-I164 HydrophobicContact CZ-CG1 3.89Å; F136-I164 HydrophobicContact CZ-CG2 3.77Å; F154-I164 HydrophobicContact CE1-CD1 4.12Å; F154-I164 HydrophobicContact CE1-CG1 4.02Å; F154-I164 HydrophobicContact CZ-CD1 3.97Å; F154-I164 HydrophobicContact CZ-CG1 4.08Å; C160-I164 WeakPolarHBondContact O-CB 3.5Å; C160-I164 WeakPolarHBondContact O-CG1 3.27Å; C160-I164 PolarHBondContact O-N 2.89Å; C160-I164 VanDerWaalsContact O-N 3.12Å; S162-I164 PolarHBondContact O-N 2.98Å; I164-K166 VanDerWaalsContact C-N 3.31Å; I164-K166 PolarHBondContact O-N 3.39Å; I164-A167 PolarHBondContact O-N 3.38Å; I164-D168 PolarHBondContact O-N 3.45Å; I164-L173 HydrophobicContact CB-CD2 3.93Å; I164-L173 HydrophobicContact CG2-CD2 3.74Å; I164-L173 HydrophobicContact CG2-CG 4.34Å
165Y97.2Very high96Very high137 Ų13761.4 Ų61.454%0.53734%0.339SS..Hα-helixtrans-60.9-40.9175.2-176.7-97.9000111.9L161 S162 A167 G169 L173L161-Y165 WeakPolarHBondContact O-CB 3.34Å; L161-Y165 PolarHBondContact O-N 3.19Å; S162-Y165 PolarHBondContact O-N 3.21Å; Y165-A167 VanDerWaalsContact C-N 3.31Å; Y165-A167 PolarHBondContact O-N 3.14Å; Y165-G169 WeakPolarHBondContact O-CA 3.47Å; Y165-G169 PolarHBondContact O-N 2.89Å; Y165-L173 HydrophobicContact CD2-CD1 4.12Å
166K96.7Very high96.1Very high170 Ų17057 Ų5774%0.73931%0.309SS*.Hα-helixtrans-65.8-31.6175.9-73.4178.5-179.3-172.60113.2S162 I164S162-K166 WeakPolarHBondContact O-CB 3.47Å; S162-K166 VanDerWaalsContact O-CG 3.31Å; S162-K166 WeakPolarHBondContact O-CG 3.49Å; S162-K166 PolarHBondContact O-N 2.95Å; I164-K166 VanDerWaalsContact C-N 3.31Å; I164-K166 PolarHBondContact O-N 3.39Å
167A94.6Very high96.3Very high63 Ų6357.8 Ų57.852%0.52131%0.306SS..Hα-helixtrans-81.7-48.3-179.200000112.8K163 I164 Y165K163-A167 PolarHBondContact O-N 2.87Å; I164-A167 PolarHBondContact O-N 3.38Å; Y165-A167 VanDerWaalsContact C-N 3.31Å; Y165-A167 PolarHBondContact O-N 3.14Å
168D93.9Very high96.2Very high59 Ų5962 Ų6232%0.31633%0.329SS..Hα-helixtrans-125.93.1-166.2-66.92.8000113.3I164 G172 S242 G243I164-D168 PolarHBondContact O-N 3.45Å; D168-G172 PolarHBondContact O-N 3.35Å; D168-S242 WeakPolarHBondContact OD2-CA 3.11Å; D168-S242 WeakPolarHBondContact OD2-CB 3.45Å; D168-G243 PolarHBondContact OD2-N 3.06Å
169G95.8Very high96.3Very high24 Ų2459.5 Ų59.525%0.24730%0.303CS..Hα-helixtrans62.1-153.9-174.100000113.3Y165 K171 G172Y165-G169 WeakPolarHBondContact O-CA 3.47Å; Y165-G169 PolarHBondContact O-N 2.89Å; G169-K171 VanDerWaalsContact C-N 3.28Å; G169-K171 PolarHBondContact O-N 2.89Å; G169-G172 PolarHBondContact O-N 2.88Å
170I95.7Very high96.2Very high111 Ų11157.8 Ų57.857%0.56929%0.291SS*.Hα-helixtrans-65.2-32.6178.9-163.5160.7000112.2G172 L173 Y174I170-G172 VanDerWaalsContact C-N 3.26Å; I170-G172 PolarHBondContact O-N 3.2Å; I170-L173 PolarHBondContact O-N 2.95Å; I170-L173 VanDerWaalsContact O-N 3.1Å; I170-Y174 HydrophobicContact CD1-CE2 4.17Å; I170-Y174 HydrophobicContact CG1-CD2 3.77Å; I170-Y174 HydrophobicContact CG1-CE2 3.69Å; I170-Y174 WeakPolarHBondContact O-CD2 3.28Å; I170-Y174 PolarHBondContact O-N 3.32Å
171K94.6Very high96.1Very high160 Ų16059 Ų5970%0.69630%0.298SS*.Hα-helixtrans-58.6-39.9179.4-173.8179.3177.7-177.90111.4G169 L173 Y174 Q175G169-K171 VanDerWaalsContact C-N 3.28Å; G169-K171 PolarHBondContact O-N 2.89Å; K171-L173 PolarHBondContact O-N 3.08Å; K171-Y174 PolarHBondContact O-N 3.31Å; K171-Q175 PolarHBondContact O-N 3.43Å
172G94.8Very high96.1Very high1 Ų161.5 Ų61.51%0.0131%0.309CS..Hα-helixtrans-60.3-41.2175.700000113.7F136 D168 G169 I170 Y174 S242F136-G172 WeakPolarHBondContact CE2-O 3.13Å; D168-G172 PolarHBondContact O-N 3.35Å; G169-G172 PolarHBondContact O-N 2.88Å; I170-G172 VanDerWaalsContact C-N 3.26Å; I170-G172 PolarHBondContact O-N 3.2Å; G172-Y174 VanDerWaalsContact C-N 3.27Å; G172-Y174 PolarHBondContact O-N 3.39Å; G172-S242 WeakPolarHBondContact O-CB 3.44Å; G172-S242 PolarHBondContact O-OG 3.24Å
173L97.1Very high96Very high15 Ų1559.5 Ų59.58%0.07930%0.296CS..Hα-helixtrans-72-19.9-179-63.2178.4000113.5Y132 P133 F136 L161 I164 Y165 I170 K171Y132-L173 VanDerWaalsContact CD1-O 3.28Å; Y132-L173 WeakPolarHBondContact CD1-O 3.46Å; P133-L173 HydrophobicContact CB-CB 4.49Å; P133-L173 HydrophobicContact CG-CB 4.45Å; F136-L173 WeakPolarHBondContact CB-O 3.15Å; F136-L173 HydrophobicContact CD1-CD2 3.9Å; F136-L173 HydrophobicContact CE1-CD2 3.94Å; L161-L173 HydrophobicContact CD2-CD2 3.83Å; I164-L173 HydrophobicContact CB-CD2 3.93Å; I164-L173 HydrophobicContact CG2-CD2 3.74Å; I164-L173 HydrophobicContact CG2-CG 4.34Å; Y165-L173 HydrophobicContact CD2-CD1 4.12Å; I170-L173 PolarHBondContact O-N 2.95Å; I170-L173 VanDerWaalsContact O-N 3.1Å; K171-L173 PolarHBondContact O-N 3.08Å
174Y97.8Very high95.8Very high59 Ų5956.4 Ų56.423%0.23128%0.284CS..THydrogen-bonded Turntrans-110.114.6-177.2-73-104.2000113.4C129 Y132 P133 I170 K171 G172 G176 F177C129-Y174 WeakPolarHBondContact O-CE1 3.49Å; C129-Y174 PolarHBondContact O-OH 3.36Å; Y132-Y174 HydrophobicContact CD1-CD1 4.27Å; Y132-Y174 HydrophobicContact CD1-CG 4.42Å; Y132-Y174 HydrophobicContact CG-CD1 4.23Å; P133-Y174 HydrophobicContact CG-CD2 4.43Å; P133-Y174 HydrophobicContact CG-CE2 3.57Å; I170-Y174 HydrophobicContact CD1-CE2 4.17Å; I170-Y174 HydrophobicContact CG1-CD2 3.77Å; I170-Y174 HydrophobicContact CG1-CE2 3.69Å; I170-Y174 WeakPolarHBondContact O-CD2 3.28Å; I170-Y174 PolarHBondContact O-N 3.32Å; K171-Y174 PolarHBondContact O-N 3.31Å; G172-Y174 VanDerWaalsContact C-N 3.27Å; G172-Y174 PolarHBondContact O-N 3.39Å; Y174-G176 PolarHBondContact O-N 2.85Å; Y174-F177 AromaticContact CD1-CD2 3.89Å; Y174-F177 HydrophobicContact CD1-CD2 3.89Å; Y174-F177 HydrophobicContact CD1-CE2 4.41Å; Y174-F177 VanDerWaalsContact O-CB 3.26Å; Y174-F177 WeakPolarHBondContact O-CB 3.22Å; Y174-F177 PolarHBondContact O-N 3.47Å
175Q96.9Very high95.7Very high47 Ų4759.3 Ų59.322%0.2230%0.299CS..THydrogen-bonded Turntrans-58.4123.5175.9-80.8-707.600111.7Y132 K171 M239 S242Y132-Q175 PolarHBondContact OH-O 3.12Å; K171-Q175 PolarHBondContact O-N 3.43Å; Q175-M239 WeakPolarHBondContact O-CG 3.34Å; Q175-S242 VanDerWaalsContact CG-OG 3.28Å; Q175-S242 WeakPolarHBondContact CG-OG 3.41Å
176G95.8Very high95.6Very high5 Ų555.8 Ų55.85%0.05229%0.289CS..THydrogen-bonded Turntrans87.611.6-175.800000114.7Y132 Y174 V179 S180Y132-G176 WeakPolarHBondContact OH-CA 3.39Å; Y132-G176 PolarHBondContact OH-O 3.25Å; Y174-G176 PolarHBondContact O-N 2.85Å; G176-V179 VanDerWaalsContact O-CG1 3.28Å; G176-V179 WeakPolarHBondContact O-CG1 3.32Å; G176-S180 WeakPolarHBondContact O-CB 3.39Å; G176-S180 PolarHBondContact O-N 3.4Å
177F96.8Very high95.5Very high39 Ų3951.4 Ų51.417%0.17127%0.268CS..Hα-helixtrans-57.4-50.5178.6-177.2-92000112.4L128 Y132 Y174 V179 S180 V181L128-F177 HydrophobicContact CB-CD2 4.27Å; L128-F177 HydrophobicContact CB-CE2 3.56Å; L128-F177 HydrophobicContact CB-CZ 4.33Å; Y132-F177 AromaticContact CD2-CD2 3.7Å; Y132-F177 HydrophobicContact CD2-CD2 3.7Å; Y132-F177 HydrophobicContact CD2-CE2 4.44Å; Y132-F177 HydrophobicContact CE2-CB 4.26Å; Y132-F177 HydrophobicContact CE2-CD2 4.12Å; Y132-F177 HydrophobicContact CG-CD2 4.12Å; Y132-F177 PolarHBondContact OH-N 2.71Å; Y174-F177 AromaticContact CD1-CD2 3.89Å; Y174-F177 HydrophobicContact CD1-CD2 3.89Å; Y174-F177 HydrophobicContact CD1-CE2 4.41Å; Y174-F177 VanDerWaalsContact O-CB 3.26Å; Y174-F177 WeakPolarHBondContact O-CB 3.22Å; Y174-F177 PolarHBondContact O-N 3.47Å; F177-V179 PolarHBondContact O-N 2.72Å; F177-S180 WeakPolarHBondContact O-CA 3.42Å; F177-S180 VanDerWaalsContact O-CB 3.32Å; F177-S180 WeakPolarHBondContact O-CB 3.45Å; F177-S180 PolarHBondContact O-N 3Å; F177-S180 PolarHBondContact O-OG 3.24Å; F177-V181 HydrophobicContact CD1-CG2 4.21Å; F177-V181 HydrophobicContact CE1-CG2 3.81Å; F177-V181 HydrophobicContact CZ-CG2 4.08Å; F177-V181 PolarHBondContact O-N 3.1Å; F177-V181 VanDerWaalsContact O-N 3.11Å
178N95.3Very high95.4Very high112 Ų11252 Ų5260%0.59926%0.257SS*.Hα-helixtrans-58.8-49.1-176.2-63.7-10.8000113S180 V181 Q182N178-S180 PolarHBondContact O-N 3.22Å; N178-V181 PolarHBondContact O-N 2.96Å; N178-Q182 WeakPolarHBondContact O-CG 3.35Å; N178-Q182 PolarHBondContact O-N 2.97Å; N178-Q182 VanDerWaalsContact O-N 3.1Å
179V96.7Very high95.3Very high0 Ų050.4 Ų50.40%025%0.252CS..Hα-helixtrans-66.1-26.7178.166.70000112G176 F177 G183 F231 V234 R235 T254 W258G176-V179 VanDerWaalsContact O-CG1 3.28Å; G176-V179 WeakPolarHBondContact O-CG1 3.32Å; F177-V179 PolarHBondContact O-N 2.72Å; V179-G183 PolarHBondContact O-N 2.65Å; V179-F231 HydrophobicContact CG2-CB 4.15Å; V179-F231 HydrophobicContact CG2-CD1 3.82Å; V179-F231 HydrophobicContact CG2-CG 4.43Å; V179-V234 HydrophobicContact CG1-CG1 4.37Å; V179-V234 HydrophobicContact CG2-CB 4.2Å; V179-V234 HydrophobicContact CG2-CG1 4.16Å; V179-R235 HydrophobicContact CG1-CB 3.83Å; V179-R235 HydrophobicContact CG1-CG 4.5Å; V179-T254 HydrophobicContact CB-CG2 3.76Å; V179-T254 HydrophobicContact CG1-CG2 4.35Å; V179-T254 HydrophobicContact CG2-CG2 4.08Å; V179-W258 HydrophobicContact CG2-CZ2 4.41Å
180S95.6Very high95.2Very high5 Ų549.9 Ų49.94%0.03525%0.245CC..Hα-helixtrans-68.9-39.2173.8850000112.7L128 Y132 G176 F177 N178 G183 I184 R235L128-S180 WeakPolarHBondContact CD1-OG 3.21Å; Y132-S180 WeakPolarHBondContact CE2-OG 3.36Å; G176-S180 WeakPolarHBondContact O-CB 3.39Å; G176-S180 PolarHBondContact O-N 3.4Å; F177-S180 WeakPolarHBondContact O-CA 3.42Å; F177-S180 VanDerWaalsContact O-CB 3.32Å; F177-S180 WeakPolarHBondContact O-CB 3.45Å; F177-S180 PolarHBondContact O-N 3Å; F177-S180 PolarHBondContact O-OG 3.24Å; N178-S180 PolarHBondContact O-N 3.22Å; S180-G183 PolarHBondContact O-N 2.99Å; S180-I184 WeakPolarHBondContact O-CG1 3.21Å; S180-I184 PolarHBondContact O-N 3.23Å; S180-R235 VanDerWaalsContact CB-CD 3.43Å
181V95.4Very high95Very high26 Ų2647.7 Ų47.716%0.15823%0.23CC..Hα-helixtrans-67.9-43.1177.21770000110.1A125 L128 F177 N178 G183 I184 I185A125-V181 HydrophobicContact CB-CG1 4.14Å; A125-V181 HydrophobicContact CB-CG2 3.95Å; L128-V181 HydrophobicContact CD1-CG2 4.47Å; F177-V181 HydrophobicContact CD1-CG2 4.21Å; F177-V181 HydrophobicContact CE1-CG2 3.81Å; F177-V181 HydrophobicContact CZ-CG2 4.08Å; F177-V181 PolarHBondContact O-N 3.1Å; F177-V181 VanDerWaalsContact O-N 3.11Å; N178-V181 PolarHBondContact O-N 2.96Å; V181-G183 VanDerWaalsContact C-N 3.32Å; V181-G183 PolarHBondContact O-N 3.33Å; V181-I184 WeakPolarHBondContact O-CB 3.23Å; V181-I184 PolarHBondContact O-N 3.4Å; V181-I185 HydrophobicContact CG1-CD1 4.33Å; V181-I185 WeakPolarHBondContact O-CG1 3.49Å; V181-I185 PolarHBondContact O-N 3.4Å; V181-I185 VanDerWaalsContact O-N 3.14Å
182Q96.2Very high94.6Very high94 Ų9442 Ų4244%0.43921%0.206SC..Hα-helixtrans-56.9-47.1171.6-66.61708.200111.1N178 I184 I185 I186 F231N178-Q182 WeakPolarHBondContact O-CG 3.35Å; N178-Q182 PolarHBondContact O-N 2.97Å; N178-Q182 VanDerWaalsContact O-N 3.1Å; Q182-I184 VanDerWaalsContact C-N 3.3Å; Q182-I184 PolarHBondContact O-N 3.29Å; Q182-I185 PolarHBondContact O-N 2.91Å; Q182-I185 VanDerWaalsContact O-N 3.12Å; Q182-I186 WeakPolarHBondContact O-CG1 3.34Å; Q182-I186 PolarHBondContact O-N 2.85Å; Q182-F231 HydrophobicContact CB-CD1 3.88Å; Q182-F231 HydrophobicContact CB-CE1 3.89Å
183G95.6Very high94.1Very high11 Ų1143.5 Ų43.511%0.11322%0.221CC..Hα-helixtrans-58.1-37.5176.300000113.6V179 S180 V181 Y187V179-G183 PolarHBondContact O-N 2.65Å; S180-G183 PolarHBondContact O-N 2.99Å; V181-G183 VanDerWaalsContact C-N 3.32Å; V181-G183 PolarHBondContact O-N 3.33Å; G183-Y187 WeakPolarHBondContact O-CB 3.33Å; G183-Y187 PolarHBondContact O-N 3.2Å
184I93.6Very high93.7Very high43 Ų4345.2 Ų45.222%0.22123%0.232CC..Hα-helixtrans-63.8-43.9174.9-72.1165000111.4L128 S180 V181 Q182 Y187 R188L128-I184 HydrophobicContact CD1-CD1 3.51Å; L128-I184 HydrophobicContact CG-CD1 4.4Å; S180-I184 WeakPolarHBondContact O-CG1 3.21Å; S180-I184 PolarHBondContact O-N 3.23Å; V181-I184 WeakPolarHBondContact O-CB 3.23Å; V181-I184 PolarHBondContact O-N 3.4Å; Q182-I184 VanDerWaalsContact C-N 3.3Å; Q182-I184 PolarHBondContact O-N 3.29Å; I184-Y187 PolarHBondContact O-N 2.92Å; I184-R188 WeakPolarHBondContact O-CB 3.25Å; I184-R188 WeakPolarHBondContact O-CG 3.28Å; I184-R188 PolarHBondContact O-N 3.07Å
185I94.3Very high93.1Very high65 Ų6545.7 Ų45.733%0.33323%0.234SC..Hα-helixtrans-64.8-47.6179.6-65.3163.9000109.9V181 Q182 Y187 R188 A189V181-I185 HydrophobicContact CG1-CD1 4.33Å; V181-I185 WeakPolarHBondContact O-CG1 3.49Å; V181-I185 PolarHBondContact O-N 3.4Å; V181-I185 VanDerWaalsContact O-N 3.14Å; Q182-I185 PolarHBondContact O-N 2.91Å; Q182-I185 VanDerWaalsContact O-N 3.12Å; I185-Y187 PolarHBondContact O-N 3.47Å; I185-R188 PolarHBondContact O-N 3.12Å; I185-A189 WeakPolarHBondContact O-CB 3.3Å; I185-A189 PolarHBondContact O-N 3.02Å
186I95.7Very high92.3Very high62 Ų6245.5 Ų45.532%0.31823%0.234SC..Hα-helixtrans-62.5-43.8177.4-62.9-59.9000111.4Q182 R188 A189 A190 I227 F231Q182-I186 WeakPolarHBondContact O-CG1 3.34Å; Q182-I186 PolarHBondContact O-N 2.85Å; I186-R188 VanDerWaalsContact C-N 3.33Å; I186-R188 PolarHBondContact O-N 3.36Å; I186-A189 PolarHBondContact O-N 3.21Å; I186-A190 WeakPolarHBondContact O-CB 3.49Å; I186-A190 PolarHBondContact O-N 3.1Å; I186-I227 HydrophobicContact CG2-CG2 4.02Å; I186-F231 HydrophobicContact CB-CE2 4.44Å; I186-F231 HydrophobicContact CG1-CE1 4.45Å; I186-F231 HydrophobicContact CG1-CE2 3.98Å; I186-F231 HydrophobicContact CG1-CZ 3.92Å; I186-F231 HydrophobicContact CG2-CE2 4.28Å
187Y94.8Very high91.6Very high79 Ų7949.5 Ų49.531%0.3126%0.258SS..Hα-helixtrans-57.9-46.2175.6175.1-96.8000111.3G183 I184 I185 Y191 A224G183-Y187 WeakPolarHBondContact O-CB 3.33Å; G183-Y187 PolarHBondContact O-N 3.2Å; I184-Y187 PolarHBondContact O-N 2.92Å; I185-Y187 PolarHBondContact O-N 3.47Å; Y187-Y191 VanDerWaalsContact O-CB 3.24Å; Y187-Y191 WeakPolarHBondContact O-CB 3.24Å; Y187-Y191 PolarHBondContact O-N 3.2Å; Y187-A224 HydrophobicContact CD2-CB 3.87Å; Y187-A224 HydrophobicContact CE2-CB 3.75Å
188R91.1Very high90.8Very high75 Ų7548.8 Ų48.828%0.28326%0.259SS..Hα-helixtrans-66.2-43178.4-80.3-175.5169.5-115.92.4112.5L117 G120 I184 I185 I186 Y191 F192L117-R188 HydrophobicContact CD2-CB 3.82Å; G120-R188 VanDerWaalsContact CA-NE 3.34Å; G120-R188 VanDerWaalsContact CA-NH1 3.32Å; I184-R188 WeakPolarHBondContact O-CB 3.25Å; I184-R188 WeakPolarHBondContact O-CG 3.28Å; I184-R188 PolarHBondContact O-N 3.07Å; I185-R188 PolarHBondContact O-N 3.12Å; I186-R188 VanDerWaalsContact C-N 3.33Å; I186-R188 PolarHBondContact O-N 3.36Å; R188-Y191 PolarHBondContact O-N 3.08Å; R188-F192 VanDerWaalsContact O-CD2 3.28Å; R188-F192 WeakPolarHBondContact O-CD2 3.44Å; R188-F192 PolarHBondContact O-N 3.44Å
189A91.9Very high89.9Confident25 Ų2547.8 Ų47.821%0.20725%0.25CC..Hα-helixtrans-60.1-47.5177.600000111.2F113 L117 I185 I186 G193F113-A189 HydrophobicContact CZ-CB 3.99Å; L117-A189 HydrophobicContact CD1-CB 3.94Å; L117-A189 HydrophobicContact CD2-CB 3.83Å; I185-A189 WeakPolarHBondContact O-CB 3.3Å; I185-A189 PolarHBondContact O-N 3.02Å; I186-A189 PolarHBondContact O-N 3.21Å; A189-G193 PolarHBondContact O-N 2.87Å
190A93.8Very high88.8Confident13 Ų1351 Ų5111%0.10728%0.283CS..Hα-helixtrans-63.6-42.8175.200000112I186 V194 A224 I227I186-A190 WeakPolarHBondContact O-CB 3.49Å; I186-A190 PolarHBondContact O-N 3.1Å; A190-V194 WeakPolarHBondContact O-CB 3.35Å; A190-V194 WeakPolarHBondContact O-CG2 3.2Å; A190-V194 PolarHBondContact O-N 3.04Å; A190-A224 HydrophobicContact CB-CB 3.95Å; A190-I227 HydrophobicContact CB-CB 4.13Å; A190-I227 HydrophobicContact CB-CD1 3.82Å; A190-I227 HydrophobicContact CB-CG2 4.03Å
191Y91.5Very high87.8Confident65 Ų6558.1 Ų58.126%0.25532%0.318SS..Hα-helixtrans-59.8-53.7179.1-175.9-86.6000111.6Y187 R188 Y195 V220 A224Y187-Y191 VanDerWaalsContact O-CB 3.24Å; Y187-Y191 WeakPolarHBondContact O-CB 3.24Å; Y187-Y191 PolarHBondContact O-N 3.2Å; R188-Y191 PolarHBondContact O-N 3.08Å; Y191-Y195 WeakPolarHBondContact O-CB 3.38Å; Y191-Y195 PolarHBondContact O-N 3.31Å; Y191-V220 HydrophobicContact CD2-CG1 3.72Å; Y191-V220 HydrophobicContact CE2-CG1 3.79Å; Y191-V220 HydrophobicContact CG-CG1 4.16Å; Y191-V220 WeakPolarHBondContact O-CG1 3.38Å; Y191-A224 HydrophobicContact CD2-CB 4.46Å
192F85.9Confident86.8Confident41 Ų4158.8 Ų58.818%0.1832%0.32CS..Hα-helixtrans-66.1-44.1179.7-78-69000112W112 F113 R188 V194 Y195 D196W112-F192 HydrophobicContact CH2-CD1 4.19Å; W112-F192 HydrophobicContact CH2-CE1 4.32Å; F113-F192 HydrophobicContact CD2-CB 4.45Å; F113-F192 HydrophobicContact CE2-CB 3.96Å; R188-F192 VanDerWaalsContact O-CD2 3.28Å; R188-F192 WeakPolarHBondContact O-CD2 3.44Å; R188-F192 PolarHBondContact O-N 3.44Å; F192-V194 PolarHBondContact O-N 3.48Å; F192-Y195 PolarHBondContact O-N 3.38Å; F192-D196 WeakPolarHBondContact O-CB 3.17Å; F192-D196 VanDerWaalsContact O-CG 3.27Å; F192-D196 PolarHBondContact O-N 2.98Å
193G85.1Confident85.4Confident32 Ų3260.7 Ų60.733%0.3334%0.341SS..Hα-helixtrans-59.8-46.7178.700000112.8A189 T197A189-G193 PolarHBondContact O-N 2.87Å; G193-T197 PolarHBondContact O-N 3Å; G193-T197 PolarHBondContact O-OG1 2.99Å
194V87.6Confident84.2Confident51 Ų5163.2 Ų63.231%0.30935%0.352SS..Hα-helixtrans-70.8-37.7178.4-179.20000111.1A190 F192 A198 V220 A223A190-V194 WeakPolarHBondContact O-CB 3.35Å; A190-V194 WeakPolarHBondContact O-CG2 3.2Å; A190-V194 PolarHBondContact O-N 3.04Å; F192-V194 PolarHBondContact O-N 3.48Å; V194-A198 WeakPolarHBondContact O-CB 3.37Å; V194-A198 PolarHBondContact O-N 3.31Å; V194-V220 HydrophobicContact CB-CG1 4.41Å; V194-V220 HydrophobicContact CG1-CB 4.44Å; V194-V220 HydrophobicContact CG1-CG1 4.48Å; V194-V220 HydrophobicContact CG1-CG2 4.03Å; V194-A223 HydrophobicContact CG1-CB 4.38Å; V194-A223 HydrophobicContact CG2-CB 4.5Å
195Y84.8Confident82.8Confident69 Ų6964.5 Ų64.527%0.27136%0.363SS..Hα-helixtrans-65.7-42.9178.5-172.8-108.9000112.9Y191 F192 A198 K199 V220Y191-Y195 WeakPolarHBondContact O-CB 3.38Å; Y191-Y195 PolarHBondContact O-N 3.31Å; F192-Y195 PolarHBondContact O-N 3.38Å; Y195-A198 PolarHBondContact O-N 3.47Å; Y195-K199 HydrophobicContact CD1-CD 4.05Å; Y195-K199 HydrophobicContact CE1-CD 3.6Å; Y195-K199 HydrophobicContact CE1-CG 4.31Å; Y195-K199 WeakPolarHBondContact O-CB 3.32Å; Y195-K199 PolarHBondContact O-N 3.05Å; Y195-K199 WeakPolarHBondContact OH-CE 3.18Å; Y195-K199 PolarHBondContact OH-NZ 2.85Å; Y195-V220 HydrophobicContact CD2-CG1 4.38Å; Y195-V220 HydrophobicContact CD2-CG2 4.25Å
196D81Confident81.5Confident43 Ų4370.7 Ų70.723%0.2339%0.387CS..Hα-helixtrans-67.4-42.7-179.8-71.4-15.3000110.7F192 K199 G200F192-D196 WeakPolarHBondContact O-CB 3.17Å; F192-D196 VanDerWaalsContact O-CG 3.27Å; F192-D196 PolarHBondContact O-N 2.98Å; D196-K199 PolarHBondContact O-N 3.16Å; D196-G200 PolarHBondContact O-N 2.83Å
197T81.3Confident80.3Confident90 Ų9074 Ų7455%0.55241%0.406SS*.Hα-helixtrans-61.2-46.4171.6-55.80000111.4G193 K199 G200 M201G193-T197 PolarHBondContact O-N 3Å; G193-T197 PolarHBondContact O-OG1 2.99Å; T197-K199 VanDerWaalsContact C-N 3.3Å; T197-K199 PolarHBondContact O-N 3.46Å; T197-G200 PolarHBondContact O-N 3.16Å; T197-G200 VanDerWaalsContact O-N 3.17Å; T197-M201 HydrophobicContact CG2-SD 4.16Å; T197-M201 WeakPolarHBondContact O-CG 3.49Å; T197-M201 PolarHBondContact O-N 3.49Å; T197-M201 VanDerWaalsContact O-N 3.14Å
198A80.5Confident79.2Confident24 Ų2471.9 Ų71.920%0.19840%0.401CS..Hα-helixtrans-61.1-39.5179.200000111.9V194 Y195 M201 L202 I216 V220V194-A198 WeakPolarHBondContact O-CB 3.37Å; V194-A198 PolarHBondContact O-N 3.31Å; Y195-A198 PolarHBondContact O-N 3.47Å; A198-M201 PolarHBondContact O-N 2.98Å; A198-L202 WeakPolarHBondContact O-CG 3.45Å; A198-L202 PolarHBondContact O-N 2.91Å; A198-I216 HydrophobicContact CB-CG2 4.06Å; A198-V220 HydrophobicContact CB-CG2 4.32Å
199K75.1Confident78.6Confident90 Ų9073.8 Ų73.839%0.39141%0.413SS..Hα-helixtrans-64.5-41.7173.9-85.8-174.3163.2174.70113.1Y195 D196 T197 M201 L202Y195-K199 HydrophobicContact CD1-CD 4.05Å; Y195-K199 HydrophobicContact CE1-CD 3.6Å; Y195-K199 HydrophobicContact CE1-CG 4.31Å; Y195-K199 WeakPolarHBondContact O-CB 3.32Å; Y195-K199 PolarHBondContact O-N 3.05Å; Y195-K199 WeakPolarHBondContact OH-CE 3.18Å; Y195-K199 PolarHBondContact OH-NZ 2.85Å; D196-K199 PolarHBondContact O-N 3.16Å; T197-K199 VanDerWaalsContact C-N 3.3Å; T197-K199 PolarHBondContact O-N 3.46Å; K199-M201 PolarHBondContact O-N 2.77Å; K199-L202 PolarHBondContact O-N 2.94Å
200G73.5Confident77.9Confident69 Ų6978.9 Ų78.971%0.71144%0.435SS*.Hα-helixtrans-65-23.7177.800000113.6D196 T197D196-G200 PolarHBondContact O-N 2.83Å; T197-G200 PolarHBondContact O-N 3.16Å; T197-G200 VanDerWaalsContact O-N 3.17Å
201M74.8Confident77.2Confident154 Ų15485.1 Ų85.176%0.75946%0.46SS*.THydrogen-bonded Turntrans-87.2-8.6176.3-65176.472.600113.7T197 A198 K199T197-M201 HydrophobicContact CG2-SD 4.16Å; T197-M201 WeakPolarHBondContact O-CG 3.49Å; T197-M201 PolarHBondContact O-N 3.49Å; T197-M201 VanDerWaalsContact O-N 3.14Å; A198-M201 PolarHBondContact O-N 2.98Å; K199-M201 PolarHBondContact O-N 2.77Å
202L75.1Confident76.7Confident39 Ų3984.8 Ų84.820%0.20447%0.465CS..  trans-83.9126.6179.2-73.2169.1000110.9A198 K199 D204 P205 I216A198-L202 WeakPolarHBondContact O-CG 3.45Å; A198-L202 PolarHBondContact O-N 2.91Å; K199-L202 PolarHBondContact O-N 2.94Å; L202-D204 VanDerWaalsContact C-N 3.33Å; L202-D204 PolarHBondContact O-N 3.22Å; L202-P205 HydrophobicContact CB-CG 4.12Å; L202-I216 HydrophobicContact CD1-CD1 3.79Å; L202-I216 HydrophobicContact CD2-CD1 3.51Å; L202-I216 HydrophobicContact CG-CD1 4.1Å
203P66.3Low76.4Confident135 Ų13585.3 Ų85.388%0.87747%0.474SS*.SBendtrans-65.5-33.5-179.412.8-16.6000113.1
204D71.5Confident76.3Confident64 Ų6487.6 Ų87.634%0.34247%0.472SS..  trans-144.794.2170.7-171.2-16.9000111.6L202 K206 N207 T208L202-D204 VanDerWaalsContact C-N 3.33Å; L202-D204 PolarHBondContact O-N 3.22Å; D204-K206 PolarHBondContact O-N 3.36Å; D204-K206 VanDerWaalsContact O-N 3.15Å; D204-K206 PolarHBondContact OD1-N 2.95Å; D204-N207 PolarHBondContact O-N 3.48Å; D204-N207 PolarHBondContact OD1-N 2.85Å; D204-N207 VanDerWaalsContact OD1-N 3.14Å; D204-N207 WeakPolarHBondContact OD2-CB 3.24Å; D204-N207 PolarHBondContact OD2-ND2 2.92Å; D204-T208 PolarHBondContact O-N 3.15Å; D204-T208 PolarHBondContact O-OG1 2.65Å
205P64.1Low76.2Confident70 Ų7089.9 Ų89.946%0.45548%0.481SS..SBendtrans-62.9-17.9179.3-20.330.6000114.7L202L202-P205 HydrophobicContact CB-CG 4.12Å
206K65.6Low76.2Confident194 Ų19488.3 Ų88.384%0.84348%0.477SS*.SBendtrans-94-29.7-175.7-69.7-175.4179.3179.60112.8D204D204-K206 PolarHBondContact O-N 3.36Å; D204-K206 VanDerWaalsContact O-N 3.15Å; D204-K206 PolarHBondContact OD1-N 2.95Å
207N70.8Confident76.5Confident133 Ų13387.7 Ų87.771%0.71148%0.477SS*.SBendtrans-105.915.1178.3-65.6-45.5000114D204D204-N207 PolarHBondContact O-N 3.48Å; D204-N207 PolarHBondContact OD1-N 2.85Å; D204-N207 VanDerWaalsContact OD1-N 3.14Å; D204-N207 WeakPolarHBondContact OD2-CB 3.24Å; D204-N207 PolarHBondContact OD2-ND2 2.92Å
208T71.9Confident76.9Confident34 Ų3484.4 Ų84.421%0.20946%0.456CS..  trans-67.8133.7176.6-63.40000110.9D204 V212 S213D204-T208 PolarHBondContact O-N 3.15Å; D204-T208 PolarHBondContact O-OG1 2.65Å; T208-V212 HydrophobicContact CG2-CB 3.54Å; T208-V212 HydrophobicContact CG2-CG1 3.51Å; T208-S213 WeakPolarHBondContact CG2-OG 3.49Å
209H77.7Confident77.4Confident115 Ų11586.9 Ų86.953%0.53247%0.472SS..  trans-56.2139.4176.4-168.2-83.7000111.5F211 V212 S213H209-F211 AromaticContact CE1-CD2 3.13Å; H209-F211 WeakPolarHBondContact CE1-CD2 3.45Å; H209-F211 AromaticContact CE1-CE2 3.7Å; H209-F211 AromaticContact ND1-CD2 3.44Å; H209-F211 WeakPolarHBondContact ND1-CD2 3.49Å; H209-F211 AromaticContact ND1-CG 3.92Å; H209-F211 PolarHBondContact ND1-N 2.87Å; H209-F211 PolarHBondContact O-N 3.11Å; H209-F211 VanDerWaalsContact O-N 3.09Å; H209-V212 HydrophobicContact CB-CG2 4.36Å; H209-V212 WeakPolarHBondContact O-CA 3.36Å; H209-V212 WeakPolarHBondContact O-CB 3.39Å; H209-V212 PolarHBondContact O-N 2.98Å; H209-S213 PolarHBondContact O-N 3.15Å; H209-S213 VanDerWaalsContact O-N 3.12Å
210I77.8Confident78.2Confident131 Ų13182.8 Ų82.867%0.67245%0.454SS*.Hα-helixtrans-52.4-38.6-174.9-169.1168.2000113.4V212 S213 W214I210-V212 PolarHBondContact O-N 2.94Å; I210-S213 PolarHBondContact O-N 2.8Å; I210-W214 WeakPolarHBondContact O-CB 3.44Å; I210-W214 PolarHBondContact O-N 3.33Å
211F79.5Confident79Confident144 Ų14481.5 Ų81.563%0.63243%0.433SS*.Hα-helixtrans-62.4-39.7174.9-71.5-59.3000113.3H209 W214 M215H209-F211 AromaticContact CE1-CD2 3.13Å; H209-F211 WeakPolarHBondContact CE1-CD2 3.45Å; H209-F211 AromaticContact CE1-CE2 3.7Å; H209-F211 AromaticContact ND1-CD2 3.44Å; H209-F211 WeakPolarHBondContact ND1-CD2 3.49Å; H209-F211 AromaticContact ND1-CG 3.92Å; H209-F211 PolarHBondContact ND1-N 2.87Å; H209-F211 PolarHBondContact O-N 3.11Å; H209-F211 VanDerWaalsContact O-N 3.09Å; F211-W214 PolarHBondContact O-N 3.05Å; F211-M215 WeakPolarHBondContact O-CG 3.49Å; F211-M215 PolarHBondContact O-N 3.3Å
212V81.1Confident79.9Confident59 Ų5975.2 Ų75.236%0.35841%0.405SS..Hα-helixtrans-69.7-44.7179.3176.90000109.9T208 H209 I210 W214 M215 I216T208-V212 HydrophobicContact CG2-CB 3.54Å; T208-V212 HydrophobicContact CG2-CG1 3.51Å; H209-V212 HydrophobicContact CB-CG2 4.36Å; H209-V212 WeakPolarHBondContact O-CA 3.36Å; H209-V212 WeakPolarHBondContact O-CB 3.39Å; H209-V212 PolarHBondContact O-N 2.98Å; I210-V212 PolarHBondContact O-N 2.94Å; V212-W214 VanDerWaalsContact C-N 3.28Å; V212-W214 PolarHBondContact O-N 2.86Å; V212-M215 HydrophobicContact CG2-CE 4.17Å; V212-M215 PolarHBondContact O-N 3.34Å; V212-I216 HydrophobicContact CG1-CD1 3.9Å; V212-I216 VanDerWaalsContact O-CG1 3.27Å; V212-I216 WeakPolarHBondContact O-CG1 3.34Å; V212-I216 PolarHBondContact O-N 2.99Å
213S79.6Confident80.8Confident52 Ų5274.9 Ų74.936%0.36441%0.408SS..Hα-helixtrans-59.6-39.2173.5-57.40000112.3T208 H209 I210 A217T208-S213 WeakPolarHBondContact CG2-OG 3.49Å; H209-S213 PolarHBondContact O-N 3.15Å; H209-S213 VanDerWaalsContact O-N 3.12Å; I210-S213 PolarHBondContact O-N 2.8Å; S213-A217 WeakPolarHBondContact O-CB 3.45Å; S213-A217 PolarHBondContact O-N 2.94Å
214W82.8Confident82.2Confident80 Ų8068.4 Ų68.430%0.30337%0.366SS..Hα-helixtrans-64.8-47.6175-18088000111.9I210 F211 V212 I216 A217 Q218I210-W214 WeakPolarHBondContact O-CB 3.44Å; I210-W214 PolarHBondContact O-N 3.33Å; F211-W214 PolarHBondContact O-N 3.05Å; V212-W214 VanDerWaalsContact C-N 3.28Å; V212-W214 PolarHBondContact O-N 2.86Å; W214-I216 VanDerWaalsContact C-N 3.31Å; W214-I216 PolarHBondContact O-N 3.35Å; W214-A217 WeakPolarHBondContact O-CB 3.38Å; W214-A217 PolarHBondContact O-N 3.43Å; W214-Q218 HydrophobicContact CD2-CG 3.92Å; W214-Q218 HydrophobicContact CE3-CG 4.17Å; W214-Q218 HydrophobicContact CH2-CG 3.98Å; W214-Q218 HydrophobicContact CZ2-CG 3.7Å; W214-Q218 HydrophobicContact CZ3-CG 4.2Å; W214-Q218 WeakPolarHBondContact O-CG 3.29Å; W214-Q218 PolarHBondContact O-N 3.01Å
215M85.2Confident83.3Confident99 Ų9965.8 Ų65.849%0.48835%0.354SS..Hα-helixtrans-59.1-42.3177.2-75.2-170-62.200111.7F211 V212 Q218 S219F211-M215 WeakPolarHBondContact O-CG 3.49Å; F211-M215 PolarHBondContact O-N 3.3Å; V212-M215 HydrophobicContact CG2-CE 4.17Å; V212-M215 PolarHBondContact O-N 3.34Å; M215-Q218 PolarHBondContact O-N 2.95Å; M215-S219 WeakPolarHBondContact O-CB 3.31Å; M215-S219 PolarHBondContact O-N 2.95Å; M215-S219 PolarHBondContact O-OG 2.85Å; M215-S219 VanDerWaalsContact O-OG 3.07Å
216I85.9Confident84.8Confident36 Ų3665.9 Ų65.919%0.18535%0.35CS..Hα-helixtrans-63-46.4176.4-67.1165.4000110.5A198 L202 V212 W214 Q218 S219 V220A198-I216 HydrophobicContact CB-CG2 4.06Å; L202-I216 HydrophobicContact CD1-CD1 3.79Å; L202-I216 HydrophobicContact CD2-CD1 3.51Å; L202-I216 HydrophobicContact CG-CD1 4.1Å; V212-I216 HydrophobicContact CG1-CD1 3.9Å; V212-I216 VanDerWaalsContact O-CG1 3.27Å; V212-I216 WeakPolarHBondContact O-CG1 3.34Å; V212-I216 PolarHBondContact O-N 2.99Å; W214-I216 VanDerWaalsContact C-N 3.31Å; W214-I216 PolarHBondContact O-N 3.35Å; I216-Q218 VanDerWaalsContact C-N 3.28Å; I216-Q218 PolarHBondContact O-N 3.31Å; I216-S219 PolarHBondContact O-N 3.43Å; I216-V220 HydrophobicContact CG2-CG2 4.2Å; I216-V220 WeakPolarHBondContact O-CB 3.45Å; I216-V220 WeakPolarHBondContact O-CG2 3.43Å; I216-V220 PolarHBondContact O-N 3.07Å
217A86.1Confident86.3Confident29 Ų2960.9 Ų60.924%0.2433%0.332CS..Hα-helixtrans-59.3-39.5176.500000112S213 W214 T221S213-A217 WeakPolarHBondContact O-CB 3.45Å; S213-A217 PolarHBondContact O-N 2.94Å; W214-A217 WeakPolarHBondContact O-CB 3.38Å; W214-A217 PolarHBondContact O-N 3.43Å; A217-T221 VanDerWaalsContact O-CB 3.26Å; A217-T221 WeakPolarHBondContact O-CB 3.22Å; A217-T221 PolarHBondContact O-N 3.44Å; A217-T221 PolarHBondContact O-OG1 2.93Å
218Q90.1Very high87.5Confident21 Ų2155.2 Ų55.210%0.09830%0.303CS..Hα-helixtrans-67.3-44.3174.8-65.2-44-5500112.2W214 M215 I216 T221 A222 M282 A285W214-Q218 HydrophobicContact CD2-CG 3.92Å; W214-Q218 HydrophobicContact CE3-CG 4.17Å; W214-Q218 HydrophobicContact CH2-CG 3.98Å; W214-Q218 HydrophobicContact CZ2-CG 3.7Å; W214-Q218 HydrophobicContact CZ3-CG 4.2Å; W214-Q218 WeakPolarHBondContact O-CG 3.29Å; W214-Q218 PolarHBondContact O-N 3.01Å; M215-Q218 PolarHBondContact O-N 2.95Å; I216-Q218 VanDerWaalsContact C-N 3.28Å; I216-Q218 PolarHBondContact O-N 3.31Å; Q218-T221 PolarHBondContact O-N 3.27Å; Q218-A222 VanDerWaalsContact O-CB 3.32Å; Q218-A222 WeakPolarHBondContact O-CB 3.41Å; Q218-A222 PolarHBondContact O-N 3.28Å; Q218-M282 HydrophobicContact CB-CG 4.45Å; Q218-A285 VanDerWaalsContact NE2-CB 3.31Å
219S90.9Very high88.7Confident77 Ų7753.8 Ų53.854%0.53829%0.293SS..Hα-helixtrans-61.7-45.7178-66.90000112.1M215 I216 T221 A222 A223M215-S219 WeakPolarHBondContact O-CB 3.31Å; M215-S219 PolarHBondContact O-N 2.95Å; M215-S219 PolarHBondContact O-OG 2.85Å; M215-S219 VanDerWaalsContact O-OG 3.07Å; I216-S219 PolarHBondContact O-N 3.43Å; S219-T221 VanDerWaalsContact C-N 3.34Å; S219-T221 PolarHBondContact O-N 2.76Å; S219-A222 PolarHBondContact O-N 3.46Å; S219-A223 WeakPolarHBondContact O-CB 3.39Å; S219-A223 PolarHBondContact O-N 2.86Å
220V91.4Very high89.7Confident3 Ų349 Ų492%0.01827%0.273CS..Hα-helixtrans-60.2-45.9174.51720000110.3Y191 V194 Y195 A198 I216 A222 A223 A224Y191-V220 HydrophobicContact CD2-CG1 3.72Å; Y191-V220 HydrophobicContact CE2-CG1 3.79Å; Y191-V220 HydrophobicContact CG-CG1 4.16Å; Y191-V220 WeakPolarHBondContact O-CG1 3.38Å; V194-V220 HydrophobicContact CB-CG1 4.41Å; V194-V220 HydrophobicContact CG1-CB 4.44Å; V194-V220 HydrophobicContact CG1-CG1 4.48Å; V194-V220 HydrophobicContact CG1-CG2 4.03Å; Y195-V220 HydrophobicContact CD2-CG1 4.38Å; Y195-V220 HydrophobicContact CD2-CG2 4.25Å; A198-V220 HydrophobicContact CB-CG2 4.32Å; I216-V220 HydrophobicContact CG2-CG2 4.2Å; I216-V220 WeakPolarHBondContact O-CB 3.45Å; I216-V220 WeakPolarHBondContact O-CG2 3.43Å; I216-V220 PolarHBondContact O-N 3.07Å; V220-A222 PolarHBondContact O-N 2.85Å; V220-A223 PolarHBondContact O-N 2.82Å; V220-A224 WeakPolarHBondContact O-CB 3.18Å; V220-A224 PolarHBondContact O-N 3.02Å
221T91.3Very high90.6Very high43 Ų4344.8 Ų44.826%0.26425%0.25SC..Hα-helixtrans-63.5-41.3179.3-61.20000111.7A217 Q218 S219 G225A217-T221 VanDerWaalsContact O-CB 3.26Å; A217-T221 WeakPolarHBondContact O-CB 3.22Å; A217-T221 PolarHBondContact O-N 3.44Å; A217-T221 PolarHBondContact O-OG1 2.93Å; Q218-T221 PolarHBondContact O-N 3.27Å; S219-T221 VanDerWaalsContact C-N 3.34Å; S219-T221 PolarHBondContact O-N 2.76Å; T221-G225 PolarHBondContact O-N 2.88Å
222A93.8Very high91.5Very high21 Ų2139.4 Ų39.417%0.17423%0.227CC..Hα-helixtrans-66.1-47.2177.200000111.2Q218 S219 V220 G225 I226 V278Q218-A222 VanDerWaalsContact O-CB 3.32Å; Q218-A222 WeakPolarHBondContact O-CB 3.41Å; Q218-A222 PolarHBondContact O-N 3.28Å; S219-A222 PolarHBondContact O-N 3.46Å; V220-A222 PolarHBondContact O-N 2.85Å; A222-G225 CarbonylContact O-C 3.59Å; A222-G225 PolarHBondContact O-N 3.34Å; A222-I226 VanDerWaalsContact O-CG1 3.28Å; A222-I226 WeakPolarHBondContact O-CG1 3.45Å; A222-I226 PolarHBondContact O-N 3.46Å; A222-V278 HydrophobicContact CB-CG1 4.06Å; A222-V278 HydrophobicContact CB-CG2 4.24Å
223A94.5Very high92.3Very high32 Ų3236.6 Ų36.626%0.26421%0.21SC..Hα-helixtrans-59.7-50.8177.800000111.7V194 S219 V220 G225 I226 I227V194-A223 HydrophobicContact CG1-CB 4.38Å; V194-A223 HydrophobicContact CG2-CB 4.5Å; S219-A223 WeakPolarHBondContact O-CB 3.39Å; S219-A223 PolarHBondContact O-N 2.86Å; V220-A223 PolarHBondContact O-N 2.82Å; A223-G225 VanDerWaalsContact C-N 3.28Å; A223-G225 PolarHBondContact O-N 3Å; A223-I226 PolarHBondContact O-N 3.23Å; A223-I226 VanDerWaalsContact O-N 3.16Å; A223-I227 WeakPolarHBondContact O-CG1 3.25Å; A223-I227 PolarHBondContact O-N 3.02Å
224A94.8Very high93.1Very high0 Ų034.1 Ų34.10%019%0.193CC..Hα-helixtrans-60.6-39.3176.200000112.1Y187 A190 Y191 V220 S228Y187-A224 HydrophobicContact CD2-CB 3.87Å; Y187-A224 HydrophobicContact CE2-CB 3.75Å; A190-A224 HydrophobicContact CB-CB 3.95Å; Y191-A224 HydrophobicContact CD2-CB 4.46Å; V220-A224 WeakPolarHBondContact O-CB 3.18Å; V220-A224 PolarHBondContact O-N 3.02Å; A224-S228 WeakPolarHBondContact O-CB 3.44Å; A224-S228 PolarHBondContact O-N 2.79Å; A224-S228 VanDerWaalsContact O-N 3.08Å; A224-S228 PolarHBondContact O-OG 3Å
225G94.8Very high93.8Very high9 Ų931.4 Ų31.49%0.09318%0.182CC..Hα-helixtrans-62.9-39175.400000113.1T221 A222 A223 S228 Y229T221-G225 PolarHBondContact O-N 2.88Å; A222-G225 CarbonylContact O-C 3.59Å; A222-G225 PolarHBondContact O-N 3.34Å; A223-G225 VanDerWaalsContact C-N 3.28Å; A223-G225 PolarHBondContact O-N 3Å; G225-S228 PolarHBondContact O-OG 3.28Å; G225-Y229 VanDerWaalsContact O-CB 3.28Å; G225-Y229 WeakPolarHBondContact O-CB 3.12Å; G225-Y229 PolarHBondContact O-N 3.17Å; G225-Y229 VanDerWaalsContact O-N 3.12Å
226I96Very high94.4Very high72 Ų7227.5 Ų27.537%0.36916%0.162SC..Hα-helixtrans-70.8-46.7176.8-69.9164.5000110.6A222 A223 S228 Y229 F271 V278A222-I226 VanDerWaalsContact O-CG1 3.28Å; A222-I226 WeakPolarHBondContact O-CG1 3.45Å; A222-I226 PolarHBondContact O-N 3.46Å; A223-I226 PolarHBondContact O-N 3.23Å; A223-I226 VanDerWaalsContact O-N 3.16Å; I226-S228 VanDerWaalsContact C-N 3.31Å; I226-S228 PolarHBondContact O-N 3.32Å; I226-Y229 WeakPolarHBondContact O-CB 3.21Å; I226-Y229 PolarHBondContact O-N 3.48Å; I226-Y229 VanDerWaalsContact O-N 3.07Å; I226-F271 HydrophobicContact CG2-CD1 4.44Å; I226-F271 HydrophobicContact CG2-CE1 4.11Å; I226-V278 HydrophobicContact CD1-CG2 4.18Å; I226-V278 HydrophobicContact CG1-CG2 4.23Å
227I96.4Very high94.9Very high89 Ų8925.8 Ų25.846%0.45615%0.154SC..Hα-helixtrans-60.1-41.6-179-69.3162.9000111.3I186 A190 A223I186-I227 HydrophobicContact CG2-CG2 4.02Å; A190-I227 HydrophobicContact CB-CB 4.13Å; A190-I227 HydrophobicContact CB-CD1 3.82Å; A190-I227 HydrophobicContact CB-CG2 4.03Å; A223-I227 WeakPolarHBondContact O-CG1 3.25Å; A223-I227 PolarHBondContact O-N 3.02Å
228S96.7Very high95.5Very high14 Ų1424.6 Ų24.610%0.09814%0.143CC..THydrogen-bonded Turntrans-84.1-7.117859.90000114.1A224 G225 I226 P230 F231 D232A224-S228 WeakPolarHBondContact O-CB 3.44Å; A224-S228 PolarHBondContact O-N 2.79Å; A224-S228 VanDerWaalsContact O-N 3.08Å; A224-S228 PolarHBondContact O-OG 3Å; G225-S228 PolarHBondContact O-OG 3.28Å; I226-S228 VanDerWaalsContact C-N 3.31Å; I226-S228 PolarHBondContact O-N 3.32Å; S228-P230 VanDerWaalsContact C-CD 3.5Å; S228-F231 WeakPolarHBondContact O-CB 3.28Å; S228-F231 PolarHBondContact O-N 3.04Å; S228-F231 VanDerWaalsContact O-N 3.1Å; S228-D232 PolarHBondContact O-N 3.44Å
229Y97.1Very high95.8Very high3 Ų323.6 Ų23.61%0.01214%0.138CC..Hα-helixtrans-59.3-39.3-172.2-157.9-96.1000114.7K33 Q37 G225 I226 F231 D232 T233 F270 F271 K272 G273 A274 N277K33-Y229 VanDerWaalsContact CE-OH 3.25Å; K33-Y229 WeakPolarHBondContact CE-OH 3.38Å; Q37-Y229 PolarHBondContact NE2-OH 3.33Å; G225-Y229 VanDerWaalsContact O-CB 3.28Å; G225-Y229 WeakPolarHBondContact O-CB 3.12Å; G225-Y229 PolarHBondContact O-N 3.17Å; G225-Y229 VanDerWaalsContact O-N 3.12Å; I226-Y229 WeakPolarHBondContact O-CB 3.21Å; I226-Y229 PolarHBondContact O-N 3.48Å; I226-Y229 VanDerWaalsContact O-N 3.07Å; Y229-F231 PolarHBondContact O-N 2.69Å; Y229-D232 PolarHBondContact O-N 3.31Å; Y229-T233 WeakPolarHBondContact CE1-OG1 3.49Å; Y229-T233 PolarHBondContact O-N 2.64Å; Y229-T233 PolarHBondContact O-OG1 2.92Å; Y229-F270 WeakPolarHBondContact CD1-O 3.07Å; Y229-F271 HydrophobicContact CD1-CD1 4.47Å; Y229-K272 VanDerWaalsContact CE1-O 3.31Å; Y229-K272 WeakPolarHBondContact CE1-O 3.31Å; Y229-K272 PolarHBondContact OH-O 3.35Å; Y229-G273 WeakPolarHBondContact OH-CA 3.2Å; Y229-G273 PolarHBondContact OH-O 3.03Å; Y229-A274 HydrophobicContact CD1-CB 3.81Å; Y229-A274 HydrophobicContact CD2-CB 4.25Å; Y229-A274 HydrophobicContact CE1-CB 3.87Å; Y229-A274 HydrophobicContact CE2-CB 4.3Å; Y229-A274 HydrophobicContact CG-CB 4Å; Y229-A274 PolarHBondContact OH-N 2.97Å; Y229-N277 HydrophobicContact CD2-CB 4.31Å; Y229-N277 HydrophobicContact CE2-CB 3.58Å
230P97.9Very high96.1Very high16 Ų1620.1 Ų20.110%0.10411%0.114CC..Hα-helixtrans-54.3-36.8175.4-31.240.2000113.7S228 T233 V234 W258 F270 F271S228-P230 VanDerWaalsContact C-CD 3.5Å; P230-T233 PolarHBondContact O-N 3.3Å; P230-V234 WeakPolarHBondContact O-CG2 3.09Å; P230-V234 PolarHBondContact O-N 3.28Å; P230-W258 HydrophobicContact CB-CH2 3.48Å; P230-W258 VanDerWaalsContact CB-CH2 3.48Å; P230-W258 HydrophobicContact CB-CZ3 3.75Å; P230-F270 HydrophobicContact CB-CB 3.87Å; P230-F270 HydrophobicContact CB-CD1 4.15Å; P230-F270 HydrophobicContact CB-CG 4.17Å; P230-F270 HydrophobicContact CG-CB 4.01Å; P230-F271 HydrophobicContact CG-CE1 3.87Å; P230-F271 HydrophobicContact CG-CE2 4.14Å; P230-F271 HydrophobicContact CG-CZ 3.6Å
231F97.8Very high96.3Very high42 Ų4220.4 Ų20.418%0.18412%0.115CC..Hα-helixtrans-68-39.3176.1-65.1-99.8000112V179 Q182 I186 S228 Y229 T233 R235 W258V179-F231 HydrophobicContact CG2-CB 4.15Å; V179-F231 HydrophobicContact CG2-CD1 3.82Å; V179-F231 HydrophobicContact CG2-CG 4.43Å; Q182-F231 HydrophobicContact CB-CD1 3.88Å; Q182-F231 HydrophobicContact CB-CE1 3.89Å; I186-F231 HydrophobicContact CB-CE2 4.44Å; I186-F231 HydrophobicContact CG1-CE1 4.45Å; I186-F231 HydrophobicContact CG1-CE2 3.98Å; I186-F231 HydrophobicContact CG1-CZ 3.92Å; I186-F231 HydrophobicContact CG2-CE2 4.28Å; S228-F231 WeakPolarHBondContact O-CB 3.28Å; S228-F231 PolarHBondContact O-N 3.04Å; S228-F231 VanDerWaalsContact O-N 3.1Å; Y229-F231 PolarHBondContact O-N 2.69Å; F231-T233 VanDerWaalsContact C-N 3.35Å; F231-R235 VanDerWaalsContact O-CB 3.23Å; F231-R235 WeakPolarHBondContact O-CB 3.49Å; F231-R235 PolarHBondContact O-N 2.92Å; F231-W258 HydrophobicContact CD1-CZ2 4.02Å; F231-W258 HydrophobicContact CD2-CH2 4.39Å; F231-W258 HydrophobicContact CD2-CZ2 4.48Å; F231-W258 HydrophobicContact CE1-CZ2 4.19Å; F231-W258 HydrophobicContact CG-CH2 4.47Å; F231-W258 HydrophobicContact CG-CZ2 4.15Å; F231-W258 HydrophobicContact CZ-CZ2 4.5Å
232D96.9Very high96.4Very high30 Ų3018.4 Ų18.416%0.1610%0.103CC..Hα-helixtrans-64.5-40.8173-174.658.3000110.4K33 Q37 S228 Y229 R235 R236K33-D232 IonicContact NZ-OD2 3.49Å; K33-D232 PolarHBondContact NZ-OD2 2.92Å; Q37-D232 PolarHBondContact NE2-OD2 2.91Å; Q37-D232 PolarHBondContact OE1-OD2 3.36Å; S228-D232 PolarHBondContact O-N 3.44Å; Y229-D232 PolarHBondContact O-N 3.31Å; D232-R235 WeakPolarHBondContact O-CB 3.49Å; D232-R235 PolarHBondContact O-N 3.26Å; D232-R236 WeakPolarHBondContact O-CG 3.39Å; D232-R236 PolarHBondContact O-N 3.38Å; D232-R236 IonicContact OD1-CZ 2.65Å; D232-R236 IonicContact OD1-NE 3.95Å; D232-R236 PolarHBondContact OD1-NE 2.92Å; D232-R236 VanDerWaalsContact OD1-NE 3.16Å; D232-R236 IonicContact OD1-NH2 3.41Å; D232-R236 PolarHBondContact OD1-NH2 3.35Å
233T97.4Very high96.3Very high0 Ų019 Ų190%011%0.111CC..Hα-helixtrans-60.8-51177-63.50000111.7Q37 Y229 P230 F231 R235 R236 R237 F270Q37-T233 HydrophobicContact CG-CG2 4.2Å; Q37-T233 VanDerWaalsContact NE2-CA 3.29Å; Q37-T233 PolarHBondContact NE2-OG1 2.95Å; Y229-T233 WeakPolarHBondContact CE1-OG1 3.49Å; Y229-T233 PolarHBondContact O-N 2.64Å; Y229-T233 PolarHBondContact O-OG1 2.92Å; P230-T233 PolarHBondContact O-N 3.3Å; F231-T233 VanDerWaalsContact C-N 3.35Å; T233-R235 VanDerWaalsContact C-N 3.33Å; T233-R235 PolarHBondContact O-N 3.35Å; T233-R236 PolarHBondContact O-N 3.49Å; T233-R237 HydrophobicContact CG2-CG 4.36Å; T233-R237 VanDerWaalsContact O-CG 3.22Å; T233-R237 WeakPolarHBondContact O-CG 3.3Å; T233-R237 PolarHBondContact O-N 3.25Å; T233-F270 WeakPolarHBondContact CB-O 3.49Å; T233-F270 PolarHBondContact OG1-O 3.42Å
234V97.7Very high96.2Very high0 Ų018.7 Ų18.70%010%0.103CC..Hα-helixtrans-61.2-42176.9176.30000111.5V179 P230 R236 R237 M238 T254 C257 W258 I261 F270V179-V234 HydrophobicContact CG1-CG1 4.37Å; V179-V234 HydrophobicContact CG2-CB 4.2Å; V179-V234 HydrophobicContact CG2-CG1 4.16Å; P230-V234 WeakPolarHBondContact O-CG2 3.09Å; P230-V234 PolarHBondContact O-N 3.28Å; V234-R236 PolarHBondContact O-N 2.91Å; V234-R237 PolarHBondContact O-N 3.22Å; V234-M238 HydrophobicContact CG1-CG 4.38Å; V234-M238 WeakPolarHBondContact O-CG 3.14Å; V234-M238 PolarHBondContact O-N 3.44Å; V234-T254 HydrophobicContact CG1-CG2 3.98Å; V234-C257 HydrophobicContact CG1-CB 3.93Å; V234-W258 HydrophobicContact CB-CZ2 4.32Å; V234-W258 HydrophobicContact CG1-CG 4.49Å; V234-W258 HydrophobicContact CG2-CD2 3.5Å; V234-W258 VanDerWaalsContact CG2-CD2 3.5Å; V234-W258 VanDerWaalsContact CG2-CE2 3.44Å; V234-W258 HydrophobicContact CG2-CE3 3.87Å; V234-W258 HydrophobicContact CG2-CG 3.98Å; V234-W258 HydrophobicContact CG2-CH2 4.13Å; V234-W258 HydrophobicContact CG2-CZ2 3.78Å; V234-W258 HydrophobicContact CG2-CZ3 4.16Å; V234-I261 HydrophobicContact CG2-CD1 4.05Å; V234-F270 HydrophobicContact CG2-CD1 4.18Å; V234-F270 HydrophobicContact CG2-CE1 3.79Å
235R97.9Very high95.7Very high23 Ų2326.6 Ų26.69%0.08714%0.137CC..Hα-helixtrans-52-53.4174179.5-169.4-179-179.2-3.7111.2D135 V179 S180 F231 D232 T233 M238 M239D135-R235 IonicContact OD2-CZ 3.73Å; D135-R235 IonicContact OD2-NH1 3.9Å; D135-R235 IonicContact OD2-NH2 2.75Å; D135-R235 PolarHBondContact OD2-NH2 2.98Å; V179-R235 HydrophobicContact CG1-CB 3.83Å; V179-R235 HydrophobicContact CG1-CG 4.5Å; S180-R235 VanDerWaalsContact CB-CD 3.43Å; F231-R235 VanDerWaalsContact O-CB 3.23Å; F231-R235 WeakPolarHBondContact O-CB 3.49Å; F231-R235 PolarHBondContact O-N 2.92Å; D232-R235 WeakPolarHBondContact O-CB 3.49Å; D232-R235 PolarHBondContact O-N 3.26Å; T233-R235 VanDerWaalsContact C-N 3.33Å; T233-R235 PolarHBondContact O-N 3.35Å; R235-M238 PolarHBondContact O-N 3.31Å; R235-M239 HydrophobicContact CG-CE 4.05Å; R235-M239 WeakPolarHBondContact O-CG 3.47Å; R235-M239 PolarHBondContact O-N 3.17Å; R235-M239 VanDerWaalsContact O-N 3.1Å
236R97.6Very high95Very high18 Ų1831.3 Ų31.37%0.06817%0.169CC..Hα-helixtrans-68.4-37.1-175.7-59.1-65.8170.1-170.7-2.2111.7L34 V38 D135 T139 D232 T233 V234 M238 M239 M240L34-R236 HydrophobicContact CD2-CG 4.41Å; V38-R236 HydrophobicContact CG1-CB 3.45Å; V38-R236 VanDerWaalsContact CG1-CB 3.45Å; D135-R236 PolarHBondContact O-NH1 3.12Å; T139-R236 HydrophobicContact CG2-CB 4.32Å; T139-R236 VanDerWaalsContact OG1-CD 3.24Å; T139-R236 WeakPolarHBondContact OG1-CD 3.39Å; T139-R236 PolarHBondContact OG1-NH1 3.24Å; D232-R236 WeakPolarHBondContact O-CG 3.39Å; D232-R236 PolarHBondContact O-N 3.38Å; D232-R236 IonicContact OD1-CZ 2.65Å; D232-R236 IonicContact OD1-NE 3.95Å; D232-R236 PolarHBondContact OD1-NE 2.92Å; D232-R236 VanDerWaalsContact OD1-NE 3.16Å; D232-R236 IonicContact OD1-NH2 3.41Å; D232-R236 PolarHBondContact OD1-NH2 3.35Å; T233-R236 PolarHBondContact O-N 3.49Å; V234-R236 PolarHBondContact O-N 2.91Å; R236-M238 VanDerWaalsContact C-N 3.34Å; R236-M238 PolarHBondContact O-N 3.2Å; R236-M239 WeakPolarHBondContact O-CB 3.24Å; R236-M239 PolarHBondContact O-N 3.03Å; R236-M240 WeakPolarHBondContact O-CG 3.3Å; R236-M240 PolarHBondContact O-N 3.46Å
237R96.6Very high94.3Very high0 Ų032.7 Ų32.70%019%0.191CC..Hα-helixtrans-63.9-37.3175-67.4-63.3-171.889.35.4112.7Q37 T233 V234 M240 Q241 Y251 I261 E265Q37-R237 PolarHBondContact O-NE 3.16Å; Q37-R237 PolarHBondContact O-NH2 3.11Å; T233-R237 HydrophobicContact CG2-CG 4.36Å; T233-R237 VanDerWaalsContact O-CG 3.22Å; T233-R237 WeakPolarHBondContact O-CG 3.3Å; T233-R237 PolarHBondContact O-N 3.25Å; V234-R237 PolarHBondContact O-N 3.22Å; R237-M240 PolarHBondContact O-N 3.06Å; R237-Q241 PolarHBondContact O-NE2 2.92Å; R237-Y251 HydrophobicContact CB-CD2 4.25Å; R237-Y251 HydrophobicContact CB-CE2 3.79Å; R237-Y251 HydrophobicContact CG-CE2 4.44Å; R237-Y251 PolarHBondContact NH1-OH 3.07Å; R237-I261 HydrophobicContact CG-CD1 4.07Å; R237-E265 IonicContact CZ-OE1 2.74Å; R237-E265 IonicContact CZ-OE2 3.91Å; R237-E265 IonicContact NH1-OE1 2.83Å; R237-E265 PolarHBondContact NH1-OE1 3.44Å; R237-E265 IonicContact NH1-OE2 2.76Å; R237-E265 IonicContact NH2-OE1 3.23Å; R237-E265 PolarHBondContact NH2-OE1 3.19Å; R237-E265 IonicContact NH2-OE2 3.94Å; R237-E265 PolarHBondContact NH2-OE2 3.35Å
238M97.6Very high93.9Very high3 Ų332 Ų322%0.01519%0.188CC..Hα-helixtrans-65.1-42.6172.1-70.6-59.9-58.400112V234 R235 R236 M240 Q241 C257V234-M238 HydrophobicContact CG1-CG 4.38Å; V234-M238 WeakPolarHBondContact O-CG 3.14Å; V234-M238 PolarHBondContact O-N 3.44Å; R235-M238 PolarHBondContact O-N 3.31Å; R236-M238 VanDerWaalsContact C-N 3.34Å; R236-M238 PolarHBondContact O-N 3.2Å; M238-M240 PolarHBondContact O-N 2.9Å; M238-Q241 WeakPolarHBondContact O-CB 3.49Å; M238-Q241 PolarHBondContact O-N 3.43Å; M238-C257 HydrophobicContact CG-CB 4.38Å; M238-C257 HydrophobicContact SD-CB 3.77Å
239M97.3Very high93.6Very high0 Ų034.6 Ų34.60%020%0.2CC..Hα-helixtrans-58.7-31.3175.4-65.5174.8166.800112.8Y132 D135 F136 T139 R140 Q175 R235 R236 Q241Y132-M239 HydrophobicContact CD1-CE 4.41Å; Y132-M239 HydrophobicContact CE1-CE 3.54Å; Y132-M239 HydrophobicContact CE2-CE 4.11Å; Y132-M239 WeakPolarHBondContact OH-CE 3.35Å; D135-M239 HydrophobicContact CB-CE 4.36Å; F136-M239 HydrophobicContact CB-CE 4.49Å; F136-M239 HydrophobicContact CD2-CB 3.84Å; F136-M239 HydrophobicContact CD2-CG 3.92Å; F136-M239 HydrophobicContact CE2-CB 4.09Å; F136-M239 VanDerWaalsContact CE2-O 3.22Å; F136-M239 WeakPolarHBondContact CE2-O 3.06Å; T139-M239 HydrophobicContact CG2-SD 4.1Å; R140-M239 PolarHBondContact NH1-O 3.41Å; Q175-M239 WeakPolarHBondContact O-CG 3.34Å; R235-M239 HydrophobicContact CG-CE 4.05Å; R235-M239 WeakPolarHBondContact O-CG 3.47Å; R235-M239 PolarHBondContact O-N 3.17Å; R235-M239 VanDerWaalsContact O-N 3.1Å; R236-M239 WeakPolarHBondContact O-CB 3.24Å; R236-M239 PolarHBondContact O-N 3.03Å; M239-Q241 PolarHBondContact O-N 3.44Å
240M96.4Very high93.4Very high5 Ų537.1 Ų37.13%0.02521%0.213CC..THydrogen-bonded Turntrans-70-11.4177.2-64-51.7-64.900113.9V38 A41 T139 A143 R236 R237 M238 R244V38-M240 HydrophobicContact CB-CG 3.9Å; V38-M240 HydrophobicContact CB-SD 4.32Å; V38-M240 HydrophobicContact CG1-CG 4.18Å; V38-M240 HydrophobicContact CG2-CG 4.32Å; V38-M240 HydrophobicContact CG2-SD 4.09Å; A41-M240 HydrophobicContact CB-CB 4.24Å; A41-M240 HydrophobicContact CB-CG 4.44Å; T139-M240 HydrophobicContact CG2-SD 4.43Å; A143-M240 HydrophobicContact CB-CE 3.64Å; A143-M240 HydrophobicContact CB-SD 3.78Å; R236-M240 WeakPolarHBondContact O-CG 3.3Å; R236-M240 PolarHBondContact O-N 3.46Å; R237-M240 PolarHBondContact O-N 3.06Å; M238-M240 PolarHBondContact O-N 2.9Å; M240-R244 PolarHBondContact O-NE 3.15Å; M240-R244 PolarHBondContact O-NH2 3.42Å
241Q95.4Very high93.2Very high8 Ų836.9 Ų36.94%0.03721%0.21CC..THydrogen-bonded Turntrans-83.1-24-178.5-55.1-45.1-67.900113.3R237 M238 M239 R244 Y251R237-Q241 PolarHBondContact O-NE2 2.92Å; M238-Q241 WeakPolarHBondContact O-CB 3.49Å; M238-Q241 PolarHBondContact O-N 3.43Å; M239-Q241 PolarHBondContact O-N 3.44Å; Q241-R244 VanDerWaalsContact O-CB 3.31Å; Q241-R244 WeakPolarHBondContact O-CB 3.28Å; Q241-R244 VanDerWaalsContact O-CG 3.29Å; Q241-R244 WeakPolarHBondContact O-CG 3.14Å; Q241-R244 PolarHBondContact O-N 3.26Å; Q241-Y251 HydrophobicContact CG-CD2 4.02Å; Q241-Y251 VanDerWaalsContact NE2-CD2 3.33Å
242S94.3Very high93Very high1 Ų140.4 Ų40.41%0.00724%0.235CC..THydrogen-bonded Turntrans-66.5140.8-175.7-38.30000112.2F136 R140 D168 G172 Q175 R244F136-S242 WeakPolarHBondContact CE2-OG 3.43Å; R140-S242 VanDerWaalsContact CZ-O 3.31Å; R140-S242 PolarHBondContact NH1-O 3.12Å; R140-S242 PolarHBondContact NH2-O 3.38Å; D168-S242 WeakPolarHBondContact OD2-CA 3.11Å; D168-S242 WeakPolarHBondContact OD2-CB 3.45Å; G172-S242 WeakPolarHBondContact O-CB 3.44Å; G172-S242 PolarHBondContact O-OG 3.24Å; Q175-S242 VanDerWaalsContact CG-OG 3.28Å; Q175-S242 WeakPolarHBondContact CG-OG 3.41Å; S242-R244 PolarHBondContact O-N 3.09Å
243G91.1Very high92.8Very high34 Ų3440 Ų4035%0.35124%0.238SC..THydrogen-bonded Turntrans76.86.6-177.500000114.2D168D168-G243 PolarHBondContact OD2-N 3.06Å
244R91.9Very high92.8Very high25 Ų2541.6 Ų41.69%0.09425%0.248CC..  trans-85.4146172.7-65.5-172.6-173-137.9-12.5111.2A41 M240 Q241 S242 D248 I249A41-R244 PolarHBondContact O-NH2 2.91Å; M240-R244 PolarHBondContact O-NE 3.15Å; M240-R244 PolarHBondContact O-NH2 3.42Å; Q241-R244 VanDerWaalsContact O-CB 3.31Å; Q241-R244 WeakPolarHBondContact O-CB 3.28Å; Q241-R244 VanDerWaalsContact O-CG 3.29Å; Q241-R244 WeakPolarHBondContact O-CG 3.14Å; Q241-R244 PolarHBondContact O-N 3.26Å; S242-R244 PolarHBondContact O-N 3.09Å; R244-D248 HydrophobicContact CB-CB 4.33Å; R244-D248 VanDerWaalsContact CD-O 3.28Å; R244-D248 WeakPolarHBondContact CD-O 3.45Å; R244-D248 PolarHBondContact NH1-O 2.62Å; R244-D248 VanDerWaalsContact NH1-O 3.1Å; R244-I249 HydrophobicContact CB-CG1 4.15Å
245K85.3Confident92.7Very high166 Ų16647.4 Ų47.472%0.72228%0.278SS*.  trans-71.4152.9167.9-62.5-176.9-178.8-179.90109.7A247 D248 I249K245-A247 PolarHBondContact O-N 3.12Å; K245-D248 PolarHBondContact O-N 3.04Å; K245-I249 PolarHBondContact O-N 3.31Å
246S78.9Confident92.7Very high109 Ų10948.1 Ų48.176%0.76228%0.283SS*.G310 helixtrans-52.8-32.4-174.3-55.40000114.6D248S246-D248 VanDerWaalsContact C-N 3.31Å; S246-D248 PolarHBondContact O-N 3.08Å
247A82.7Confident92.6Very high100 Ų10047.2 Ų47.283%0.82628%0.28SS*.G310 helixtrans-68.2-26.5177.100000114K245K245-A247 PolarHBondContact O-N 3.12Å
248D87.6Confident92.7Very high76 Ų7650.5 Ų50.541%0.40629%0.292SS..G310 helixtrans-99.5-0.5-175.7-59.2-40.6000113.2Q43 R244 K245 S246 M250Q43-D248 PolarHBondContact NE2-OD2 3.26Å; R244-D248 HydrophobicContact CB-CB 4.33Å; R244-D248 VanDerWaalsContact CD-O 3.28Å; R244-D248 WeakPolarHBondContact CD-O 3.45Å; R244-D248 PolarHBondContact NH1-O 2.62Å; R244-D248 VanDerWaalsContact NH1-O 3.1Å; K245-D248 PolarHBondContact O-N 3.04Å; S246-D248 VanDerWaalsContact C-N 3.31Å; S246-D248 PolarHBondContact O-N 3.08Å; D248-M250 PolarHBondContact O-N 3.04Å
249I90.9Very high92.7Very high68 Ų6857.2 Ų57.235%0.34932%0.322SS..  trans-71.8113.3178.3-63.8178.5000108.6R244 K245 Y251R244-I249 HydrophobicContact CB-CG1 4.15Å; K245-I249 PolarHBondContact O-N 3.31Å; I249-Y251 WeakPolarHBondContact CG2-O 3.35Å
250M92.3Very high92.7Very high55 Ų5560.2 Ų60.227%0.27134%0.335SS..SBendtrans-85.1-29.4177.5-63.2174.1-59.600112.1A41 D248 K260A41-M250 HydrophobicContact CB-CE 3.27Å; A41-M250 HydrophobicContact CB-SD 4.45Å; D248-M250 PolarHBondContact O-N 3.04Å; M250-K260 WeakPolarHBondContact O-CD 3.09Å; M250-K260 WeakPolarHBondContact O-CE 3.42Å; M250-K260 PolarHBondContact O-NZ 2.89Å
251Y94.1Very high92.6Very high11 Ų1160 Ų604%0.04333%0.333CS..  trans-129.9118.4-176.1-46.4-62.7000110.7A41 R237 Q241 I249 D256 C257 K260 I261A41-Y251 HydrophobicContact CB-CE2 4.24Å; R237-Y251 HydrophobicContact CB-CD2 4.25Å; R237-Y251 HydrophobicContact CB-CE2 3.79Å; R237-Y251 HydrophobicContact CG-CE2 4.44Å; R237-Y251 PolarHBondContact NH1-OH 3.07Å; Q241-Y251 HydrophobicContact CG-CD2 4.02Å; Q241-Y251 VanDerWaalsContact NE2-CD2 3.33Å; I249-Y251 WeakPolarHBondContact CG2-O 3.35Å; Y251-D256 WeakPolarHBondContact CA-OD2 3.22Å; Y251-C257 HydrophobicContact CD1-CB 3.94Å; Y251-C257 HydrophobicContact CD2-CB 4.45Å; Y251-C257 HydrophobicContact CG-CB 3.85Å; Y251-K260 HydrophobicContact CD1-CB 4.04Å; Y251-K260 HydrophobicContact CD1-CD 3.88Å; Y251-K260 HydrophobicContact CE1-CB 3.78Å; Y251-K260 HydrophobicContact CE1-CD 4.27Å; Y251-I261 HydrophobicContact CE1-CG1 4.45Å
252T92.4Very high92.7Very high116 Ų11662 Ų6271%0.71235%0.351SS*.SBendtrans-80.7-21.3-179.658.70000112.6D256T252-D256 PolarHBondContact N-OD2 3.08Å; T252-D256 WeakPolarHBondContact OG1-CB 3.27Å; T252-D256 PolarHBondContact OG1-OD2 3.35Å
253G94.4Very high92.7Very high22 Ų2270.8 Ų70.823%0.22739%0.389CS..SBendtrans-169.8175.4179.900000112.1I255 D256 C257G253-I255 PolarHBondContact O-N 3.27Å; G253-D256 PolarHBondContact O-N 3.15Å; G253-C257 WeakPolarHBondContact O-CB 3.42Å; G253-C257 PolarHBondContact O-N 2.9Å
254T95.8Very high92.8Very high34 Ų3474.5 Ų74.521%0.20940%0.401CS..Hα-helixtrans-58.5-45.7-177.4-59.50000112.6V179 V234 C257 W258V179-T254 HydrophobicContact CB-CG2 3.76Å; V179-T254 HydrophobicContact CG1-CG2 4.35Å; V179-T254 HydrophobicContact CG2-CG2 4.08Å; V234-T254 HydrophobicContact CG1-CG2 3.98Å; T254-C257 WeakPolarHBondContact O-CB 3.41Å; T254-C257 PolarHBondContact O-N 3.36Å; T254-W258 PolarHBondContact O-N 3.1Å
255I96.6Very high92.9Very high122 Ų12275 Ų7563%0.62641%0.405SS*.Hα-helixtrans-65.6-41.8-179.7-61.1173.5000110.8G253 C257 W258 K259G253-I255 PolarHBondContact O-N 3.27Å; I255-C257 VanDerWaalsContact C-N 3.3Å; I255-C257 PolarHBondContact O-N 2.73Å; I255-W258 PolarHBondContact O-N 3.25Å; I255-K259 HydrophobicContact CG2-CD 4.34Å; I255-K259 WeakPolarHBondContact O-CG 3.33Å; I255-K259 PolarHBondContact O-N 3.44Å
256D97.1Very high93.3Very high37 Ų3768.5 Ų68.520%0.19838%0.384CS..Hα-helixtrans-61.2-40.7174.5-178.149.6000111.2Y251 T252 G253 K259 K260Y251-D256 WeakPolarHBondContact CA-OD2 3.22Å; T252-D256 PolarHBondContact N-OD2 3.08Å; T252-D256 WeakPolarHBondContact OG1-CB 3.27Å; T252-D256 PolarHBondContact OG1-OD2 3.35Å; G253-D256 PolarHBondContact O-N 3.15Å; D256-K259 PolarHBondContact O-N 3.39Å; D256-K260 WeakPolarHBondContact O-CB 3.48Å; D256-K260 WeakPolarHBondContact O-CG 3.2Å; D256-K260 PolarHBondContact O-N 3.46Å; D256-K260 WeakPolarHBondContact OD1-CD 3.39Å; D256-K260 WeakPolarHBondContact OD1-CE 3.18Å; D256-K260 IonicContact OD1-NZ 3.11Å; D256-K260 PolarHBondContact OD1-NZ 3.47Å; D256-K260 WeakPolarHBondContact OD2-CE 3.45Å; D256-K260 IonicContact OD2-NZ 3.43Å; D256-K260 PolarHBondContact OD2-NZ 3.45Å
257C97Very high93.9Very high0 Ų065.7 Ų65.70%037%0.373CS..Hα-helixtrans-60.9-47.4175.3-166.40000112.4V234 M238 Y251 G253 T254 I255 K259 K260 I261V234-C257 HydrophobicContact CG1-CB 3.93Å; M238-C257 HydrophobicContact CG-CB 4.38Å; M238-C257 HydrophobicContact SD-CB 3.77Å; Y251-C257 HydrophobicContact CD1-CB 3.94Å; Y251-C257 HydrophobicContact CD2-CB 4.45Å; Y251-C257 HydrophobicContact CG-CB 3.85Å; G253-C257 WeakPolarHBondContact O-CB 3.42Å; G253-C257 PolarHBondContact O-N 2.9Å; T254-C257 WeakPolarHBondContact O-CB 3.41Å; T254-C257 PolarHBondContact O-N 3.36Å; I255-C257 VanDerWaalsContact C-N 3.3Å; I255-C257 PolarHBondContact O-N 2.73Å; C257-K259 PolarHBondContact O-N 3.06Å; C257-K260 PolarHBondContact O-N 2.86Å; C257-I261 WeakPolarHBondContact O-CB 3.47Å; C257-I261 WeakPolarHBondContact O-CG1 3.34Å; C257-I261 PolarHBondContact O-N 3.32Å
258W97.6Very high94.5Very high68 Ų6870 Ų7026%0.25837%0.373SS..Hα-helixtrans-56.1-50.4173.6-78.6107.3000112V179 P230 F231 V234 T254 I255 A262 F270V179-W258 HydrophobicContact CG2-CZ2 4.41Å; P230-W258 HydrophobicContact CB-CH2 3.48Å; P230-W258 VanDerWaalsContact CB-CH2 3.48Å; P230-W258 HydrophobicContact CB-CZ3 3.75Å; F231-W258 HydrophobicContact CD1-CZ2 4.02Å; F231-W258 HydrophobicContact CD2-CH2 4.39Å; F231-W258 HydrophobicContact CD2-CZ2 4.48Å; F231-W258 HydrophobicContact CE1-CZ2 4.19Å; F231-W258 HydrophobicContact CG-CH2 4.47Å; F231-W258 HydrophobicContact CG-CZ2 4.15Å; F231-W258 HydrophobicContact CZ-CZ2 4.5Å; V234-W258 HydrophobicContact CB-CZ2 4.32Å; V234-W258 HydrophobicContact CG1-CG 4.49Å; V234-W258 HydrophobicContact CG2-CD2 3.5Å; V234-W258 VanDerWaalsContact CG2-CD2 3.5Å; V234-W258 VanDerWaalsContact CG2-CE2 3.44Å; V234-W258 HydrophobicContact CG2-CE3 3.87Å; V234-W258 HydrophobicContact CG2-CG 3.98Å; V234-W258 HydrophobicContact CG2-CH2 4.13Å; V234-W258 HydrophobicContact CG2-CZ2 3.78Å; V234-W258 HydrophobicContact CG2-CZ3 4.16Å; T254-W258 PolarHBondContact O-N 3.1Å; I255-W258 PolarHBondContact O-N 3.25Å; W258-A262 WeakPolarHBondContact O-CB 3.46Å; W258-A262 PolarHBondContact O-N 2.58Å; W258-F270 HydrophobicContact CD2-CE1 4.08Å; W258-F270 HydrophobicContact CD2-CZ 4.48Å; W258-F270 AromaticContact CE3-CD1 3.93Å; W258-F270 HydrophobicContact CE3-CD1 3.93Å; W258-F270 AromaticContact CE3-CE1 3.17Å; W258-F270 HydrophobicContact CE3-CE1 3.17Å; W258-F270 HydrophobicContact CE3-CE2 4.36Å; W258-F270 AromaticContact CE3-CZ 3.44Å; W258-F270 HydrophobicContact CE3-CZ 3.44Å; W258-F270 VanDerWaalsContact CE3-CZ 3.44Å; W258-F270 HydrophobicContact CH2-CD1 4.49Å; W258-F270 HydrophobicContact CH2-CE1 4.46Å; W258-F270 AromaticContact CZ3-CD1 3.65Å; W258-F270 HydrophobicContact CZ3-CD1 3.65Å; W258-F270 AromaticContact CZ3-CE1 3.41Å; W258-F270 HydrophobicContact CZ3-CE1 3.41Å; W258-F270 VanDerWaalsContact CZ3-CE1 3.41Å; W258-F270 HydrophobicContact CZ3-CG 4.32Å; W258-F270 AromaticContact CZ3-CZ 3.89Å; W258-F270 HydrophobicContact CZ3-CZ 3.89Å
259K97.2Very high94.8Very high145 Ų14566.4 Ų66.463%0.6335%0.354SS*.Hα-helixtrans-61.3-47.7-179-72.5-179.6179.2-176.40111.9I255 D256 C257 A262 K263I255-K259 HydrophobicContact CG2-CD 4.34Å; I255-K259 WeakPolarHBondContact O-CG 3.33Å; I255-K259 PolarHBondContact O-N 3.44Å; D256-K259 PolarHBondContact O-N 3.39Å; C257-K259 PolarHBondContact O-N 3.06Å; K259-A262 PolarHBondContact O-N 2.99Å; K259-K263 VanDerWaalsContact O-CB 3.27Å; K259-K263 WeakPolarHBondContact O-CB 3.47Å; K259-K263 PolarHBondContact O-N 2.97Å
260K96.8Very high95Very high63 Ų6364.1 Ų64.127%0.27434%0.342SS..Hα-helixtrans-68.1-39.1-178-77.1175.2173.7164.50112.7M250 Y251 D256 C257 N264M250-K260 WeakPolarHBondContact O-CD 3.09Å; M250-K260 WeakPolarHBondContact O-CE 3.42Å; M250-K260 PolarHBondContact O-NZ 2.89Å; Y251-K260 HydrophobicContact CD1-CB 4.04Å; Y251-K260 HydrophobicContact CD1-CD 3.88Å; Y251-K260 HydrophobicContact CE1-CB 3.78Å; Y251-K260 HydrophobicContact CE1-CD 4.27Å; D256-K260 WeakPolarHBondContact O-CB 3.48Å; D256-K260 WeakPolarHBondContact O-CG 3.2Å; D256-K260 PolarHBondContact O-N 3.46Å; D256-K260 WeakPolarHBondContact OD1-CD 3.39Å; D256-K260 WeakPolarHBondContact OD1-CE 3.18Å; D256-K260 IonicContact OD1-NZ 3.11Å; D256-K260 PolarHBondContact OD1-NZ 3.47Å; D256-K260 WeakPolarHBondContact OD2-CE 3.45Å; D256-K260 IonicContact OD2-NZ 3.43Å; D256-K260 PolarHBondContact OD2-NZ 3.45Å; C257-K260 PolarHBondContact O-N 2.86Å; K260-N264 WeakPolarHBondContact O-CB 3.28Å; K260-N264 PolarHBondContact O-N 2.65Å
261I95.8Very high95.2Very high0 Ų065.7 Ų65.70%035%0.347CS..Hα-helixtrans-62.5-48.9174.1-66.8168.1000109.8V234 R237 Y251 C257 K263 E265 G266 A269 F270V234-I261 HydrophobicContact CG2-CD1 4.05Å; R237-I261 HydrophobicContact CG-CD1 4.07Å; Y251-I261 HydrophobicContact CE1-CG1 4.45Å; C257-I261 WeakPolarHBondContact O-CB 3.47Å; C257-I261 WeakPolarHBondContact O-CG1 3.34Å; C257-I261 PolarHBondContact O-N 3.32Å; I261-K263 PolarHBondContact O-N 3.43Å; I261-E265 WeakPolarHBondContact O-CA 3.46Å; I261-E265 WeakPolarHBondContact O-CB 3.34Å; I261-E265 PolarHBondContact O-N 3.16Å; I261-G266 PolarHBondContact O-N 3.28Å; I261-G266 VanDerWaalsContact O-N 3.14Å; I261-A269 HydrophobicContact CG2-CB 3.78Å; I261-F270 HydrophobicContact CB-CE1 3.82Å; I261-F270 HydrophobicContact CB-CZ 3.77Å; I261-F270 HydrophobicContact CD1-CE1 4.03Å; I261-F270 HydrophobicContact CG2-CD1 3.92Å; I261-F270 HydrophobicContact CG2-CD2 4.26Å; I261-F270 HydrophobicContact CG2-CE1 3.57Å; I261-F270 HydrophobicContact CG2-CE2 3.94Å; I261-F270 HydrophobicContact CG2-CG 4.24Å; I261-F270 HydrophobicContact CG2-CZ 3.58Å
262A96.4Very high95.1Very high50 Ų5068.2 Ų68.241%0.41336%0.358SS..Hα-helixtrans-61.1-43.2-179.800000112.3W258 K259 G266 F270W258-A262 WeakPolarHBondContact O-CB 3.46Å; W258-A262 PolarHBondContact O-N 2.58Å; K259-A262 PolarHBondContact O-N 2.99Å; A262-G266 VanDerWaalsContact O-CA 3.32Å; A262-G266 WeakPolarHBondContact O-CA 3.18Å; A262-G266 PolarHBondContact O-N 3.24Å; A262-F270 HydrophobicContact CB-CE2 4.09Å; A262-F270 HydrophobicContact CB-CZ 4.25Å
263K95.4Very high95.1Very high185 Ų18563.1 Ų63.180%0.80433%0.329SS*.Hα-helixtrans-74.4-44.1-178.2-172.1179179.5-179.40113.3K259 I261K259-K263 VanDerWaalsContact O-CB 3.27Å; K259-K263 WeakPolarHBondContact O-CB 3.47Å; K259-K263 PolarHBondContact O-N 2.97Å; I261-K263 PolarHBondContact O-N 3.43Å
264N93.7Very high95Very high113 Ų11362.6 Ų62.660%0.60432%0.323SS*.Hα-helixtrans-96-27.9-168.4-58.2-11.7000113.3K260K260-N264 WeakPolarHBondContact O-CB 3.28Å; K260-N264 PolarHBondContact O-N 2.65Å
265E92.3Very high94.9Very high36 Ų3669.3 Ų69.317%0.16834%0.344CS..THydrogen-bonded Turntrans-117.5-12.7-177.9-59.6175.3-106.100113.4H40 R237 I261 A269 K272H40-E265 IonicContact CD2-OE1 3.64Å; H40-E265 PolarHBondContact CD2-OE1 3.02Å; H40-E265 VanDerWaalsContact CD2-OE1 3.24Å; H40-E265 IonicContact CD2-OE2 2.64Å; H40-E265 IonicContact CG-OE1 3.45Å; H40-E265 IonicContact CG-OE2 3.29Å; H40-E265 IonicContact NE2-OE1 3.58Å; R237-E265 IonicContact CZ-OE1 2.74Å; R237-E265 IonicContact CZ-OE2 3.91Å; R237-E265 IonicContact NH1-OE1 2.83Å; R237-E265 PolarHBondContact NH1-OE1 3.44Å; R237-E265 IonicContact NH1-OE2 2.76Å; R237-E265 IonicContact NH2-OE1 3.23Å; R237-E265 PolarHBondContact NH2-OE1 3.19Å; R237-E265 IonicContact NH2-OE2 3.94Å; R237-E265 PolarHBondContact NH2-OE2 3.35Å; I261-E265 WeakPolarHBondContact O-CA 3.46Å; I261-E265 WeakPolarHBondContact O-CB 3.34Å; I261-E265 PolarHBondContact O-N 3.16Å; E265-A269 HydrophobicContact CB-CB 3.31Å; E265-A269 HydrophobicContact CG-CB 4.34Å; E265-K272 IonicContact OE2-NZ 3.78Å; E265-K272 PolarHBondContact OE2-NZ 3.05Å
266G94.3Very high94.6Very high28 Ų2863.6 Ų63.629%0.28932%0.315SS..  trans80.8167.4-178.500000114.5I261 A262 K268 A269I261-G266 PolarHBondContact O-N 3.28Å; I261-G266 VanDerWaalsContact O-N 3.14Å; A262-G266 VanDerWaalsContact O-CA 3.32Å; A262-G266 WeakPolarHBondContact O-CA 3.18Å; A262-G266 PolarHBondContact O-N 3.24Å; G266-K268 VanDerWaalsContact C-N 3.26Å; G266-K268 PolarHBondContact O-N 2.81Å; G266-K268 VanDerWaalsContact O-N 3.17Å; G266-A269 WeakPolarHBondContact O-CB 3.17Å; G266-A269 PolarHBondContact O-N 3.17Å
267G92.7Very high94.3Very high51 Ų5162.9 Ų62.953%0.52631%0.311SS..G310 helixtrans-60.5-28.1-174.800000115.1A269 F270G267-A269 PolarHBondContact O-N 2.9Å; G267-F270 WeakPolarHBondContact O-CD2 3.06Å
268K94.1Very high94.1Very high189 Ų18963.5 Ų63.582%0.82232%0.315SS*.G310 helixtrans-67.5-21.7176.2-66.9-178.4-179.5178.20112.7G266 F270 F271G266-K268 VanDerWaalsContact C-N 3.26Å; G266-K268 PolarHBondContact O-N 2.81Å; G266-K268 VanDerWaalsContact O-N 3.17Å; K268-F270 PolarHBondContact O-N 3.18Å; K268-F271 PolarHBondContact O-N 3.15Å
269A93.9Very high93.9Very high2 Ų263.4 Ų63.42%0.01732%0.319CS..G310 helixtrans-64.9-29.1-177.900000113.3I261 E265 G266 G267 F271 K272I261-A269 HydrophobicContact CG2-CB 3.78Å; E265-A269 HydrophobicContact CB-CB 3.31Å; E265-A269 HydrophobicContact CG-CB 4.34Å; G266-A269 WeakPolarHBondContact O-CB 3.17Å; G266-A269 PolarHBondContact O-N 3.17Å; G267-A269 PolarHBondContact O-N 2.9Å; A269-F271 PolarHBondContact O-N 2.81Å; A269-F271 VanDerWaalsContact O-N 3.15Å; A269-K272 HydrophobicContact CB-CD 4.4Å; A269-K272 WeakPolarHBondContact O-CB 3.26Å; A269-K272 WeakPolarHBondContact O-CG 3.08Å; A269-K272 PolarHBondContact O-N 3.11Å
270F95.9Very high93.6Very high19 Ų1959.5 Ų59.58%0.08330%0.3CS..G310 helixtrans-59.9-23.8174.1-69.1-68.6000112.9Y229 P230 T233 V234 W258 I261 A262 G267 K268Y229-F270 WeakPolarHBondContact CD1-O 3.07Å; P230-F270 HydrophobicContact CB-CB 3.87Å; P230-F270 HydrophobicContact CB-CD1 4.15Å; P230-F270 HydrophobicContact CB-CG 4.17Å; P230-F270 HydrophobicContact CG-CB 4.01Å; T233-F270 WeakPolarHBondContact CB-O 3.49Å; T233-F270 PolarHBondContact OG1-O 3.42Å; V234-F270 HydrophobicContact CG2-CD1 4.18Å; V234-F270 HydrophobicContact CG2-CE1 3.79Å; W258-F270 HydrophobicContact CD2-CE1 4.08Å; W258-F270 HydrophobicContact CD2-CZ 4.48Å; W258-F270 AromaticContact CE3-CD1 3.93Å; W258-F270 HydrophobicContact CE3-CD1 3.93Å; W258-F270 AromaticContact CE3-CE1 3.17Å; W258-F270 HydrophobicContact CE3-CE1 3.17Å; W258-F270 HydrophobicContact CE3-CE2 4.36Å; W258-F270 AromaticContact CE3-CZ 3.44Å; W258-F270 HydrophobicContact CE3-CZ 3.44Å; W258-F270 VanDerWaalsContact CE3-CZ 3.44Å; W258-F270 HydrophobicContact CH2-CD1 4.49Å; W258-F270 HydrophobicContact CH2-CE1 4.46Å; W258-F270 AromaticContact CZ3-CD1 3.65Å; W258-F270 HydrophobicContact CZ3-CD1 3.65Å; W258-F270 AromaticContact CZ3-CE1 3.41Å; W258-F270 HydrophobicContact CZ3-CE1 3.41Å; W258-F270 VanDerWaalsContact CZ3-CE1 3.41Å; W258-F270 HydrophobicContact CZ3-CG 4.32Å; W258-F270 AromaticContact CZ3-CZ 3.89Å; W258-F270 HydrophobicContact CZ3-CZ 3.89Å; I261-F270 HydrophobicContact CB-CE1 3.82Å; I261-F270 HydrophobicContact CB-CZ 3.77Å; I261-F270 HydrophobicContact CD1-CE1 4.03Å; I261-F270 HydrophobicContact CG2-CD1 3.92Å; I261-F270 HydrophobicContact CG2-CD2 4.26Å; I261-F270 HydrophobicContact CG2-CE1 3.57Å; I261-F270 HydrophobicContact CG2-CE2 3.94Å; I261-F270 HydrophobicContact CG2-CG 4.24Å; I261-F270 HydrophobicContact CG2-CZ 3.58Å; A262-F270 HydrophobicContact CB-CE2 4.09Å; A262-F270 HydrophobicContact CB-CZ 4.25Å; G267-F270 WeakPolarHBondContact O-CD2 3.06Å; K268-F270 PolarHBondContact O-N 3.18Å
271F96.4Very high93.2Very high89 Ų8957.4 Ų57.439%0.3930%0.297SS..G310 helixtrans-103.312.2-177.5-59.6-85.8000113.6I226 Y229 P230 K268 A269 G273 A274I226-F271 HydrophobicContact CG2-CD1 4.44Å; I226-F271 HydrophobicContact CG2-CE1 4.11Å; Y229-F271 HydrophobicContact CD1-CD1 4.47Å; P230-F271 HydrophobicContact CG-CE1 3.87Å; P230-F271 HydrophobicContact CG-CE2 4.14Å; P230-F271 HydrophobicContact CG-CZ 3.6Å; K268-F271 PolarHBondContact O-N 3.15Å; A269-F271 PolarHBondContact O-N 2.81Å; A269-F271 VanDerWaalsContact O-N 3.15Å; F271-G273 PolarHBondContact O-N 3.3Å; F271-G273 VanDerWaalsContact O-N 3.1Å; F271-A274 HydrophobicContact CB-CB 4.07Å; F271-A274 HydrophobicContact CD1-CB 4.37Å; F271-A274 WeakPolarHBondContact O-CB 3.43Å; F271-A274 PolarHBondContact O-N 3.3Å
272K92.1Very high92.9Very high63 Ų6361.2 Ų61.227%0.27432%0.316SS..THydrogen-bonded Turntrans-59.3116.6174.1-77.1176.3178.5178.60110.4Q37 Y229 E265 A269Q37-K272 WeakPolarHBondContact CB-O 3.41Å; Y229-K272 VanDerWaalsContact CE1-O 3.31Å; Y229-K272 WeakPolarHBondContact CE1-O 3.31Å; Y229-K272 PolarHBondContact OH-O 3.35Å; E265-K272 IonicContact OE2-NZ 3.78Å; E265-K272 PolarHBondContact OE2-NZ 3.05Å; A269-K272 HydrophobicContact CB-CD 4.4Å; A269-K272 WeakPolarHBondContact O-CB 3.26Å; A269-K272 WeakPolarHBondContact O-CG 3.08Å; A269-K272 PolarHBondContact O-N 3.11Å
273G91.1Very high92.4Very high10 Ų1060 Ų6010%0.10331%0.308CS..THydrogen-bonded Turntrans85.51.7-175.800000115.3Y229 F271 W275 S276 N277Y229-G273 WeakPolarHBondContact OH-CA 3.2Å; Y229-G273 PolarHBondContact OH-O 3.03Å; F271-G273 PolarHBondContact O-N 3.3Å; F271-G273 VanDerWaalsContact O-N 3.1Å; G273-W275 VanDerWaalsContact C-N 3.29Å; G273-W275 PolarHBondContact O-N 3.44Å; G273-S276 WeakPolarHBondContact O-CB 3.37Å; G273-S276 PolarHBondContact O-N 3.45Å; G273-S276 VanDerWaalsContact O-N 3.12Å; G273-N277 PolarHBondContact O-N 2.85Å
274A92.8Very high91.8Very high11 Ų1151.7 Ų51.79%0.09127%0.274CS..Hα-helixtrans-57.5-42.4-179.500000111.9Y229 F271 N277 V278Y229-A274 HydrophobicContact CD1-CB 3.81Å; Y229-A274 HydrophobicContact CD2-CB 4.25Å; Y229-A274 HydrophobicContact CE1-CB 3.87Å; Y229-A274 HydrophobicContact CE2-CB 4.3Å; Y229-A274 HydrophobicContact CG-CB 4Å; Y229-A274 PolarHBondContact OH-N 2.97Å; F271-A274 HydrophobicContact CB-CB 4.07Å; F271-A274 HydrophobicContact CD1-CB 4.37Å; F271-A274 WeakPolarHBondContact O-CB 3.43Å; F271-A274 PolarHBondContact O-N 3.3Å; A274-N277 VanDerWaalsContact O-CB 3.3Å; A274-N277 WeakPolarHBondContact O-CB 3.34Å; A274-N277 PolarHBondContact O-N 3.35Å; A274-N277 VanDerWaalsContact O-N 3.15Å; A274-V278 PolarHBondContact O-N 3.1Å
275W93.1Very high91.5Very high175 Ų17547.3 Ų47.366%0.66325%0.254SS*.Hα-helixtrans-63.3-44.4175.5-173.3-121.5000112.7G273 N277 V278 I279G273-W275 VanDerWaalsContact C-N 3.29Å; G273-W275 PolarHBondContact O-N 3.44Å; W275-N277 PolarHBondContact O-N 3.26Å; W275-V278 HydrophobicContact CE3-CB 4.34Å; W275-V278 HydrophobicContact CZ3-CG1 4.27Å; W275-V278 WeakPolarHBondContact O-CB 3.2Å; W275-V278 PolarHBondContact O-N 3.05Å; W275-V278 VanDerWaalsContact O-N 3.09Å; W275-I279 PolarHBondContact O-N 3Å
276S90.9Very high91.1Very high1 Ų150.8 Ų50.81%0.00727%0.269CS..Hα-helixtrans-58.6-35.3173.5-47.40000111.9I54 G273 R280I54-S276 WeakPolarHBondContact CD1-OG 3.31Å; I54-S276 VanDerWaalsContact CG1-OG 3.26Å; I54-S276 WeakPolarHBondContact CG1-OG 3.47Å; G273-S276 WeakPolarHBondContact O-CB 3.37Å; G273-S276 PolarHBondContact O-N 3.45Å; G273-S276 VanDerWaalsContact O-N 3.12Å; S276-R280 VanDerWaalsContact O-CB 3.24Å; S276-R280 WeakPolarHBondContact O-CB 3.07Å; S276-R280 PolarHBondContact O-N 3.2Å
277N91.8Very high90.5Very high22 Ų2250.9 Ų50.912%0.11826%0.264CS..Hα-helixtrans-68-36.4176.5-174.873.5000112.9K33 Y229 G273 A274 W275 G281K33-N277 HydrophobicContact CD-CB 3.78Å; K33-N277 WeakPolarHBondContact CE-OD1 3.41Å; K33-N277 HydrophobicContact CG-CB 4.09Å; K33-N277 PolarHBondContact NZ-OD1 2.87Å; Y229-N277 HydrophobicContact CD2-CB 4.31Å; Y229-N277 HydrophobicContact CE2-CB 3.58Å; G273-N277 PolarHBondContact O-N 2.85Å; A274-N277 VanDerWaalsContact O-CB 3.3Å; A274-N277 WeakPolarHBondContact O-CB 3.34Å; A274-N277 PolarHBondContact O-N 3.35Å; A274-N277 VanDerWaalsContact O-N 3.15Å; W275-N277 PolarHBondContact O-N 3.26Å; N277-G281 PolarHBondContact O-N 3Å
278V92.8Very high89.9Confident13 Ų1351.6 Ų51.68%0.07926%0.255CS..Hα-helixtrans-65.1-51.4173.9174.20000110.1A222 I226 A274 W275 R280 G281 M282A222-V278 HydrophobicContact CB-CG1 4.06Å; A222-V278 HydrophobicContact CB-CG2 4.24Å; I226-V278 HydrophobicContact CD1-CG2 4.18Å; I226-V278 HydrophobicContact CG1-CG2 4.23Å; A274-V278 PolarHBondContact O-N 3.1Å; W275-V278 HydrophobicContact CE3-CB 4.34Å; W275-V278 HydrophobicContact CZ3-CG1 4.27Å; W275-V278 WeakPolarHBondContact O-CB 3.2Å; W275-V278 PolarHBondContact O-N 3.05Å; W275-V278 VanDerWaalsContact O-N 3.09Å; V278-R280 VanDerWaalsContact C-N 3.28Å; V278-R280 PolarHBondContact O-N 2.67Å; V278-G281 WeakPolarHBondContact O-CA 3.32Å; V278-G281 PolarHBondContact O-N 3.38Å; V278-M282 HydrophobicContact CG1-CG 4.45Å; V278-M282 HydrophobicContact CG1-SD 3.95Å; V278-M282 WeakPolarHBondContact O-CG 3.15Å; V278-M282 PolarHBondContact O-N 2.89Å
279I92.3Very high89.3Confident67 Ų6746.1 Ų46.134%0.34424%0.237SC..Hα-helixtrans-55.3-46.9176.8-63.2170.6000110.6I29 I54 W275 G281 M282 G283I29-I279 HydrophobicContact CG1-CB 4.32Å; I29-I279 HydrophobicContact CG1-CG2 4.06Å; I54-I279 HydrophobicContact CD1-CD1 4.26Å; W275-I279 PolarHBondContact O-N 3Å; I279-G281 VanDerWaalsContact C-N 3.33Å; I279-G281 PolarHBondContact O-N 2.93Å; I279-M282 PolarHBondContact O-N 3.22Å; I279-G283 PolarHBondContact O-N 3.13Å
280R91.9Very high88.6Confident62 Ų6249.8 Ų49.823%0.23426%0.256CS..Hα-helixtrans-59.1-43.2176.4-179-144.862.411211.3112.2V26 I29 E30 S276 V278 G284V26-R280 HydrophobicContact CB-CG 4.05Å; V26-R280 HydrophobicContact CG2-CG 3.87Å; I29-R280 HydrophobicContact CG2-CB 3.9Å; I29-R280 HydrophobicContact CG2-CG 4.19Å; E30-R280 HydrophobicContact CB-CG 3.96Å; E30-R280 VanDerWaalsContact CG-CD 3.41Å; E30-R280 HydrophobicContact CG-CG 4.24Å; E30-R280 WeakPolarHBondContact OE1-CD 3.19Å; E30-R280 IonicContact OE1-CZ 2.83Å; E30-R280 IonicContact OE1-NE 2.65Å; E30-R280 IonicContact OE1-NH1 3.56Å; E30-R280 PolarHBondContact OE1-NH1 3.35Å; E30-R280 VanDerWaalsContact OE1-NH1 3.16Å; S276-R280 VanDerWaalsContact O-CB 3.24Å; S276-R280 WeakPolarHBondContact O-CB 3.07Å; S276-R280 PolarHBondContact O-N 3.2Å; V278-R280 VanDerWaalsContact C-N 3.28Å; V278-R280 PolarHBondContact O-N 2.67Å; R280-G284 PolarHBondContact O-N 2.87Å
281G87.8Confident87.6Confident20 Ų2051.6 Ų51.621%0.20626%0.263CS..Hα-helixtrans-61.7-50.9178.500000112.1N277 V278 I279 G284 A285N277-G281 PolarHBondContact O-N 3Å; V278-G281 WeakPolarHBondContact O-CA 3.32Å; V278-G281 PolarHBondContact O-N 3.38Å; I279-G281 VanDerWaalsContact C-N 3.33Å; I279-G281 PolarHBondContact O-N 2.93Å; G281-G284 PolarHBondContact O-N 3.31Å; G281-A285 PolarHBondContact O-N 3.37Å; G281-A285 VanDerWaalsContact O-N 3.1Å
282M89.8Confident86.6Confident80 Ų8051.7 Ų51.739%0.39427%0.268SS..Hα-helixtrans-64.4-45179.4-64.7178.174.600111.8Q218 V278 I279 G284 A285 F286Q218-M282 HydrophobicContact CB-CG 4.45Å; V278-M282 HydrophobicContact CG1-CG 4.45Å; V278-M282 HydrophobicContact CG1-SD 3.95Å; V278-M282 WeakPolarHBondContact O-CG 3.15Å; V278-M282 PolarHBondContact O-N 2.89Å; I279-M282 PolarHBondContact O-N 3.22Å; M282-G284 VanDerWaalsContact C-N 3.32Å; M282-G284 PolarHBondContact O-N 3.44Å; M282-A285 PolarHBondContact O-N 2.99Å; M282-F286 WeakPolarHBondContact O-CB 3.5Å; M282-F286 PolarHBondContact O-N 3.43Å
283G86.4Confident85.8Confident24 Ų2452.2 Ų52.225%0.24727%0.271CS..Hα-helixtrans-61.9-39.5176.600000112.4I279 F286 V287I279-G283 PolarHBondContact O-N 3.13Å; G283-F286 PolarHBondContact O-N 3.34Å; G283-V287 VanDerWaalsContact O-CG2 3.28Å; G283-V287 WeakPolarHBondContact O-CG2 3.49Å; G283-V287 PolarHBondContact O-N 2.97Å
284G82.6Confident85Confident10 Ų1056.9 Ų56.910%0.10329%0.292CS..Hα-helixtrans-65.4-41.1178.200000112.1S22 R280 G281 M282 L288S22-G284 WeakPolarHBondContact OG-CA 3.43Å; S22-G284 PolarHBondContact OG-O 2.92Å; R280-G284 PolarHBondContact O-N 2.87Å; G281-G284 PolarHBondContact O-N 3.31Å; M282-G284 VanDerWaalsContact C-N 3.32Å; M282-G284 PolarHBondContact O-N 3.44Å; G284-L288 WeakPolarHBondContact O-CG 3.18Å; G284-L288 PolarHBondContact O-N 3.14Å
285A85.8Confident83.8Confident22 Ų2261.7 Ų61.718%0.18231%0.311CS..Hα-helixtrans-66-41.9174.200000112Q218 G281 M282 L288 V289Q218-A285 VanDerWaalsContact NE2-CB 3.31Å; G281-A285 PolarHBondContact O-N 3.37Å; G281-A285 VanDerWaalsContact O-N 3.1Å; M282-A285 PolarHBondContact O-N 2.99Å; A285-L288 PolarHBondContact O-N 3.17Å; A285-V289 WeakPolarHBondContact O-CG2 3.37Å; A285-V289 PolarHBondContact O-N 2.86Å; A285-V289 VanDerWaalsContact O-N 3.08Å
286F85.6Confident82.9Confident108 Ų10860.4 Ų60.447%0.47431%0.311SS..Hα-helixtrans-61.7-43.4177.2-178-112.3000112.3M282 G283 L288 V289 L290M282-F286 WeakPolarHBondContact O-CB 3.5Å; M282-F286 PolarHBondContact O-N 3.43Å; G283-F286 PolarHBondContact O-N 3.34Å; F286-L288 VanDerWaalsContact C-N 3.29Å; F286-L288 PolarHBondContact O-N 3Å; F286-V289 PolarHBondContact O-N 2.74Å; F286-L290 HydrophobicContact CD1-CD1 3.81Å; F286-L290 HydrophobicContact CD1-CG 4.39Å; F286-L290 HydrophobicContact CE1-CD1 3.34Å; F286-L290 HydrophobicContact CE1-CG 4.05Å; F286-L290 HydrophobicContact CE2-CD1 4.44Å; F286-L290 HydrophobicContact CE2-CD2 4.43Å; F286-L290 HydrophobicContact CE2-CG 4.3Å; F286-L290 HydrophobicContact CZ-CD1 3.7Å; F286-L290 HydrophobicContact CZ-CD2 4.12Å; F286-L290 HydrophobicContact CZ-CG 3.99Å; F286-L290 WeakPolarHBondContact O-CG 3.47Å; F286-L290 PolarHBondContact O-N 2.88Å
287V81.3Confident81.7Confident31 Ų3169.2 Ų69.219%0.18835%0.345CS..Hα-helixtrans-63.1-35.91771740000112I21 A25 G283 Y291I21-V287 HydrophobicContact CG2-CG1 4.17Å; A25-V287 HydrophobicContact CB-CG1 4.17Å; A25-V287 HydrophobicContact CB-CG2 3.86Å; G283-V287 VanDerWaalsContact O-CG2 3.28Å; G283-V287 WeakPolarHBondContact O-CG2 3.49Å; G283-V287 PolarHBondContact O-N 2.97Å; V287-Y291 WeakPolarHBondContact O-CB 3.36Å; V287-Y291 PolarHBondContact O-N 3.22Å
288L79.9Confident79.8Confident65 Ų6576 Ų7634%0.3439%0.387SS..Hα-helixtrans-66.4-44175.1-70.8172.2000111.7A18 G284 A285 F286 L290 Y291 D292A18-L288 HydrophobicContact CB-CD2 4.14Å; G284-L288 WeakPolarHBondContact O-CG 3.18Å; G284-L288 PolarHBondContact O-N 3.14Å; A285-L288 PolarHBondContact O-N 3.17Å; F286-L288 VanDerWaalsContact C-N 3.29Å; F286-L288 PolarHBondContact O-N 3Å; L288-L290 VanDerWaalsContact C-N 3.34Å; L288-L290 PolarHBondContact O-N 2.83Å; L288-Y291 PolarHBondContact O-N 3.44Å; L288-D292 PolarHBondContact O-N 2.81Å
289V81.8Confident79.2Confident74 Ų7479.2 Ų79.245%0.44840%0.403SS..Hα-helixtrans-60.3-44.8176173.60000111.1A285 F286 Y291 D292 E293A285-V289 WeakPolarHBondContact O-CG2 3.37Å; A285-V289 PolarHBondContact O-N 2.86Å; A285-V289 VanDerWaalsContact O-N 3.08Å; F286-V289 PolarHBondContact O-N 2.74Å; V289-Y291 PolarHBondContact O-N 2.96Å; V289-D292 PolarHBondContact O-N 2.76Å; V289-E293 WeakPolarHBondContact O-CB 3.18Å; V289-E293 PolarHBondContact O-N 3.14Å
290L77.9Confident78.5Confident79 Ų7979.8 Ų79.841%0.41441%0.406SS..Hα-helixtrans-62.5-42176.2-73178.5000112.3F286 L288 E293 I294F286-L290 HydrophobicContact CD1-CD1 3.81Å; F286-L290 HydrophobicContact CD1-CG 4.39Å; F286-L290 HydrophobicContact CE1-CD1 3.34Å; F286-L290 HydrophobicContact CE1-CG 4.05Å; F286-L290 HydrophobicContact CE2-CD1 4.44Å; F286-L290 HydrophobicContact CE2-CD2 4.43Å; F286-L290 HydrophobicContact CE2-CG 4.3Å; F286-L290 HydrophobicContact CZ-CD1 3.7Å; F286-L290 HydrophobicContact CZ-CD2 4.12Å; F286-L290 HydrophobicContact CZ-CG 3.99Å; F286-L290 WeakPolarHBondContact O-CG 3.47Å; F286-L290 PolarHBondContact O-N 2.88Å; L288-L290 VanDerWaalsContact C-N 3.34Å; L288-L290 PolarHBondContact O-N 2.83Å; L290-E293 PolarHBondContact O-N 3.05Å; L290-I294 WeakPolarHBondContact O-CD1 3.28Å; L290-I294 VanDerWaalsContact O-CG1 3.24Å; L290-I294 WeakPolarHBondContact O-CG1 3.26Å; L290-I294 PolarHBondContact O-N 3Å
291Y75.7Confident77.7Confident57 Ų5780.8 Ų80.822%0.22442%0.415CS..Hα-helixtrans-61.7-45.3177.6177.3-97.9000111.8A18 I21 V287 L288 V289 E293 I294 K295A18-Y291 HydrophobicContact CB-CD1 3.76Å; A18-Y291 HydrophobicContact CB-CE1 3.6Å; I21-Y291 HydrophobicContact CD1-CD2 3.93Å; I21-Y291 HydrophobicContact CD1-CE2 3.68Å; V287-Y291 WeakPolarHBondContact O-CB 3.36Å; V287-Y291 PolarHBondContact O-N 3.22Å; L288-Y291 PolarHBondContact O-N 3.44Å; V289-Y291 PolarHBondContact O-N 2.96Å; Y291-E293 VanDerWaalsContact C-N 3.31Å; Y291-E293 PolarHBondContact O-N 3.16Å; Y291-I294 PolarHBondContact O-N 3.46Å; Y291-K295 WeakPolarHBondContact O-CB 3.39Å; Y291-K295 PolarHBondContact O-N 3.42Å
292D75.4Confident77.1Confident92 Ų9284.4 Ų84.449%0.49243%0.428SS..Hα-helixtrans-64.6-36.8177.6-70.6-20.3000111.7L288 V289 K296L288-D292 PolarHBondContact O-N 2.81Å; V289-D292 PolarHBondContact O-N 2.76Å; D292-K296 PolarHBondContact O-N 3.35Å
293E75.4Confident76.4Confident73 Ų7384.6 Ų84.634%0.34143%0.43SS..Hα-helixtrans-68.4-45.9176.8-166.460.1-154.400111.7V289 L290 Y291 K295 K296 Y297V289-E293 WeakPolarHBondContact O-CB 3.18Å; V289-E293 PolarHBondContact O-N 3.14Å; L290-E293 PolarHBondContact O-N 3.05Å; Y291-E293 VanDerWaalsContact C-N 3.31Å; Y291-E293 PolarHBondContact O-N 3.16Å; E293-K295 VanDerWaalsContact C-N 3.27Å; E293-K295 PolarHBondContact O-N 3.06Å; E293-K296 WeakPolarHBondContact O-CB 3.43Å; E293-K296 PolarHBondContact O-N 3.1Å; E293-K296 IonicContact OE1-NZ 3.98Å; E293-K296 WeakPolarHBondContact OE2-CE 3.21Å; E293-K296 IonicContact OE2-NZ 2.71Å; E293-K296 PolarHBondContact OE2-NZ 3.43Å; E293-Y297 HydrophobicContact CG-CE2 4.2Å; E293-Y297 WeakPolarHBondContact O-CD2 3.15Å; E293-Y297 WeakPolarHBondContact O-CE2 3.28Å; E293-Y297 PolarHBondContact OE1-OH 2.93Å
294I73.3Confident75.7Confident108 Ų10888.7 Ų88.755%0.55444%0.442SS*.Hα-helixtrans-59.3-40.5176.6-68.9165000110.8L290 Y291 K296 Y297 T298L290-I294 WeakPolarHBondContact O-CD1 3.28Å; L290-I294 VanDerWaalsContact O-CG1 3.24Å; L290-I294 WeakPolarHBondContact O-CG1 3.26Å; L290-I294 PolarHBondContact O-N 3Å; Y291-I294 PolarHBondContact O-N 3.46Å; I294-K296 PolarHBondContact O-N 3.22Å; I294-Y297 PolarHBondContact O-N 3.35Å; I294-T298 PolarHBondContact O-OG1 3.47Å; I294-T298 VanDerWaalsContact O-OG1 3.04Å
295K69.3Low75.2Confident112 Ų11294.3 Ų94.349%0.48747%0.466SS..Hα-helixtrans-61.8-22.7177.9-171.9178.2175.9-172.50113.4Y291 E293 Y297 T298Y291-K295 WeakPolarHBondContact O-CB 3.39Å; Y291-K295 PolarHBondContact O-N 3.42Å; E293-K295 VanDerWaalsContact C-N 3.27Å; E293-K295 PolarHBondContact O-N 3.06Å; K295-Y297 PolarHBondContact O-N 2.8Å; K295-T298 VanDerWaalsContact O-OXT 3.14Å
296K72.9Confident74.4Confident149 Ų14999.8 Ų99.865%0.64849%0.488SS*.THydrogen-bonded Turntrans-70.5-21.9174.7-64.9172.9-173.91680113D292 E293 I294D292-K296 PolarHBondContact O-N 3.35Å; E293-K296 WeakPolarHBondContact O-CB 3.43Å; E293-K296 PolarHBondContact O-N 3.1Å; E293-K296 IonicContact OE1-NZ 3.98Å; E293-K296 WeakPolarHBondContact OE2-CE 3.21Å; E293-K296 IonicContact OE2-NZ 2.71Å; E293-K296 PolarHBondContact OE2-NZ 3.43Å; I294-K296 PolarHBondContact O-N 3.22Å
297Y67.1Low73.4Confident186 Ų18699.2 Ų99.273%0.72949%0.489SS*.THydrogen-bonded Turntrans-103.15.5-177.8-58.6-84.3000113.3E293 I294 K295E293-Y297 HydrophobicContact CG-CE2 4.2Å; E293-Y297 WeakPolarHBondContact O-CD2 3.15Å; E293-Y297 WeakPolarHBondContact O-CE2 3.28Å; E293-Y297 PolarHBondContact OE1-OH 2.93Å; I294-Y297 PolarHBondContact O-N 3.35Å; K295-Y297 PolarHBondContact O-N 2.8Å
298T51.6Low72.7Confident164 Ų164105.4 Ų105.4100%1.00652%0.517SS*.  trans-124.10179.1-20.50000110.3I294 K295I294-T298 PolarHBondContact O-OG1 3.47Å; I294-T298 VanDerWaalsContact O-OG1 3.04Å; K295-T298 VanDerWaalsContact O-OXT 3.14Å

Retrieved 298 of 298 residues in 396.8 ms (Link to these results)

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