A0A096MWB3_PAPAN Loading...

Solute carrier family 25 member 14

AlphaFold DB (F6SL11), UniProt , Accession A0A096MWB3, Species PAPAN (Papio anubis, Olive baboon), Gene SLC25A14, Length 290 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
1M36.2Very low64.3Low246 Ų246106.9 Ų106.9100%1.21258%0.578SS**  092.80-65.5169.7106.400108G3M1-G3 PolarHBondContact O-N 3.01Å
2S41.9Very low65.7Low122 Ų12299.3 Ų99.385%0.85354%0.542SS*.  trans-69.7114.9-179.746.90000109.7L4S2-L4 PolarHBondContact O-N 3.4Å
3G48Very low67Low65 Ų6593.8 Ų93.867%0.6752%0.523SS*.  trans-52125.5175.900000110.3M1 N5M1-G3 PolarHBondContact O-N 3.01Å; G3-N5 PolarHBondContact O-N 2.81Å
4L56.4Low68.2Low133 Ų13392.9 Ų92.970%0.69652%0.516SS*.  trans-61.2105.9179-157.779.1000107.7S2 W6S2-L4 PolarHBondContact O-N 3.4Å; L4-W6 VanDerWaalsContact C-N 3.32Å; L4-W6 PolarHBondContact O-N 3.34Å
5N65.3Low69.3Low136 Ų13686.7 Ų86.773%0.72748%0.482SS*.  trans-63.297.5173.1-81.2-40.6000107.6G3 K7 P8G3-N5 PolarHBondContact O-N 2.81Å; N5-K7 VanDerWaalsContact C-N 3.3Å; N5-P8 VanDerWaalsContact O-CD 3.28Å; N5-P8 WeakPolarHBondContact O-CD 3.49Å
6W71.4Confident70.2Confident158 Ų15882.1 Ų82.160%0.59846%0.457SS*.  trans-77.8-18.9179.656.7-97.1000112L4 F9 V10L4-W6 VanDerWaalsContact C-N 3.32Å; L4-W6 PolarHBondContact O-N 3.34Å; W6-F9 WeakPolarHBondContact O-CB 3.21Å; W6-F9 PolarHBondContact O-N 3.49Å; W6-V10 HydrophobicContact CE3-CB 4.31Å; W6-V10 HydrophobicContact CE3-CG2 3.65Å; W6-V10 HydrophobicContact CZ3-CB 4.45Å; W6-V10 HydrophobicContact CZ3-CG2 4.06Å; W6-V10 PolarHBondContact O-N 3.03Å
7K75.1Confident71.2Confident68 Ų6880.8 Ų80.830%0.29645%0.448SS..Hα-helixtrans-54.2-50.1-179.1-66-168.4176.2-157.10112.6N5 F9 V10 Y11 I290N5-K7 VanDerWaalsContact C-N 3.3Å; K7-F9 VanDerWaalsContact C-N 3.26Å; K7-F9 PolarHBondContact O-N 3.1Å; K7-V10 PolarHBondContact O-N 3.33Å; K7-Y11 HydrophobicContact CB-CD2 4.38Å; K7-Y11 HydrophobicContact CB-CE2 3.74Å; K7-Y11 WeakPolarHBondContact O-CD2 3.4Å; K7-Y11 PolarHBondContact O-N 2.83Å; K7-I290 PolarHBondContact NZ-O 3.1Å
8P75.6Confident72Confident63 Ų6380.1 Ų80.141%0.40945%0.446SS..Hα-helixtrans-60-32.3175.1-23.134.3000114.2N5 G12N5-P8 VanDerWaalsContact O-CD 3.28Å; N5-P8 WeakPolarHBondContact O-CD 3.49Å; P8-G12 PolarHBondContact O-N 2.87Å
9F74.6Confident72.7Confident93 Ų9375.8 Ų75.841%0.40842%0.423SS..Hα-helixtrans-69.6-44.4177.6179.6-95.4000111.3W6 K7 G13 T84 I87W6-F9 WeakPolarHBondContact O-CB 3.21Å; W6-F9 PolarHBondContact O-N 3.49Å; K7-F9 VanDerWaalsContact C-N 3.26Å; K7-F9 PolarHBondContact O-N 3.1Å; F9-G13 PolarHBondContact O-N 3.41Å; F9-T84 HydrophobicContact CZ-CG2 4.49Å; F9-T84 WeakPolarHBondContact CZ-OG1 3.41Å; F9-I87 HydrophobicContact CD2-CD1 3.85Å; F9-I87 HydrophobicContact CE2-CD1 3.95Å
10V79.8Confident73.3Confident57 Ų5772.2 Ų72.235%0.34540%0.402SS..Hα-helixtrans-65.9-45.3176.3174.40000111W6 K7 G13 L14W6-V10 HydrophobicContact CE3-CB 4.31Å; W6-V10 HydrophobicContact CE3-CG2 3.65Å; W6-V10 HydrophobicContact CZ3-CB 4.45Å; W6-V10 HydrophobicContact CZ3-CG2 4.06Å; W6-V10 PolarHBondContact O-N 3.03Å; K7-V10 PolarHBondContact O-N 3.33Å; V10-G13 PolarHBondContact O-N 3.41Å; V10-L14 HydrophobicContact CG1-CD1 3.87Å; V10-L14 HydrophobicContact CG1-CG 4.38Å; V10-L14 WeakPolarHBondContact O-CB 3.18Å; V10-L14 WeakPolarHBondContact O-CG 3.45Å; V10-L14 PolarHBondContact O-N 3.3Å
11Y82.6Confident73.9Confident35 Ų3573.9 Ų73.914%0.13741%0.405CS..Hα-helixtrans-64.2-43177.9-57-29.1000112K7 A15 L285K7-Y11 HydrophobicContact CB-CD2 4.38Å; K7-Y11 HydrophobicContact CB-CE2 3.74Å; K7-Y11 WeakPolarHBondContact O-CD2 3.4Å; K7-Y11 PolarHBondContact O-N 2.83Å; Y11-A15 WeakPolarHBondContact O-CB 3.39Å; Y11-A15 PolarHBondContact O-N 3.06Å; Y11-L285 HydrophobicContact CD1-CB 3.9Å; Y11-L285 HydrophobicContact CG-CB 4.08Å
12G81.4Confident76.2Confident15 Ų1564.1 Ų64.116%0.15537%0.368CS..Hα-helixtrans-64.4-39.7175.400000112.6P8 S16P8-G12 PolarHBondContact O-N 2.87Å; G12-S16 VanDerWaalsContact O-CB 3.32Å; G12-S16 WeakPolarHBondContact O-CB 3.27Å; G12-S16 PolarHBondContact O-N 3.37Å; G12-S16 PolarHBondContact O-OG 3.07Å
13G82.6Confident78.3Confident28 Ų2858.4 Ų58.429%0.28933%0.328SS..Hα-helixtrans-64.2-50.617600000112.5F9 V10 S16 I17F9-G13 PolarHBondContact O-N 3.41Å; V10-G13 PolarHBondContact O-N 3.41Å; G13-S16 WeakPolarHBondContact O-CB 3.43Å; G13-S16 PolarHBondContact O-N 3.02Å; G13-I17 WeakPolarHBondContact O-CG1 3.35Å; G13-I17 PolarHBondContact O-N 2.92Å
14L84.2Confident80Confident82 Ų8255.3 Ų55.343%0.42930%0.296SS..Hα-helixtrans-62.9-46177.7-71.4173.1000111.8V10 S16 I17 V18 L285V10-L14 HydrophobicContact CG1-CD1 3.87Å; V10-L14 HydrophobicContact CG1-CG 4.38Å; V10-L14 WeakPolarHBondContact O-CB 3.18Å; V10-L14 WeakPolarHBondContact O-CG 3.45Å; V10-L14 PolarHBondContact O-N 3.3Å; L14-S16 VanDerWaalsContact C-N 3.26Å; L14-S16 PolarHBondContact O-N 2.97Å; L14-I17 PolarHBondContact O-N 3.4Å; L14-I17 VanDerWaalsContact O-N 3.15Å; L14-V18 WeakPolarHBondContact O-CG2 3.47Å; L14-V18 PolarHBondContact O-N 2.89Å; L14-L285 HydrophobicContact CB-CD1 3.77Å; L14-L285 HydrophobicContact CD1-CD1 4.44Å
15A84.6Confident81.4Confident0 Ų050 Ų500%027%0.269CS..Hα-helixtrans-59.5-39.1175.900000112Y11 A19 F278 T281Y11-A15 WeakPolarHBondContact O-CB 3.39Å; Y11-A15 PolarHBondContact O-N 3.06Å; A15-A19 VanDerWaalsContact O-CB 3.31Å; A15-A19 WeakPolarHBondContact O-CB 3.27Å; A15-A19 PolarHBondContact O-N 3.5Å; A15-F278 HydrophobicContact CB-CD2 3.85Å; A15-F278 HydrophobicContact CB-CE2 3.89Å; A15-T281 HydrophobicContact CB-CG2 4Å
16S83.9Confident82.3Confident12 Ų1244.7 Ų44.78%0.08424%0.242CC..Hα-helixtrans-65.8-39.5175.7-59.90000113G12 G13 L14 A19 E20 Q79 F278G12-S16 VanDerWaalsContact O-CB 3.32Å; G12-S16 WeakPolarHBondContact O-CB 3.27Å; G12-S16 PolarHBondContact O-N 3.37Å; G12-S16 PolarHBondContact O-OG 3.07Å; G13-S16 WeakPolarHBondContact O-CB 3.43Å; G13-S16 PolarHBondContact O-N 3.02Å; L14-S16 VanDerWaalsContact C-N 3.26Å; L14-S16 PolarHBondContact O-N 2.97Å; S16-A19 PolarHBondContact O-N 3.46Å; S16-E20 WeakPolarHBondContact O-CB 3.28Å; S16-E20 PolarHBondContact O-N 3.49Å; S16-Q79 PolarHBondContact OG-NE2 3.49Å; S16-F278 WeakPolarHBondContact OG-CE2 3.14Å
17I86Confident82.8Confident60 Ų6037.7 Ų37.731%0.30822%0.216SC..Hα-helixtrans-64.7-44.9178.2-74.6166.6000110.4G13 L14 E20 F21 L76 Q79G13-I17 WeakPolarHBondContact O-CG1 3.35Å; G13-I17 PolarHBondContact O-N 2.92Å; L14-I17 PolarHBondContact O-N 3.4Å; L14-I17 VanDerWaalsContact O-N 3.15Å; I17-E20 PolarHBondContact O-N 2.94Å; I17-F21 WeakPolarHBondContact O-CB 3.24Å; I17-F21 PolarHBondContact O-N 2.82Å; I17-L76 HydrophobicContact CB-CD2 4.26Å; I17-L76 HydrophobicContact CG1-CD2 4.12Å; I17-L76 HydrophobicContact CG2-CD2 3.63Å; I17-Q79 HydrophobicContact CG1-CG 4.45Å
18V86.9Confident83.2Confident68 Ų6834.4 Ų34.441%0.41220%0.202SC..Hα-helixtrans-64.4-42.6177.5176.40000110.9L14 F21 G22 I277 T281L14-V18 WeakPolarHBondContact O-CG2 3.47Å; L14-V18 PolarHBondContact O-N 2.89Å; V18-F21 PolarHBondContact O-N 2.85Å; V18-G22 PolarHBondContact O-N 3.15Å; V18-I277 HydrophobicContact CG1-CG2 3.97Å; V18-T281 HydrophobicContact CB-CG2 4.14Å; V18-T281 HydrophobicContact CG1-CG2 4.33Å; V18-T281 HydrophobicContact CG2-CG2 4.17Å
19A85.3Confident83.5Confident0 Ų031.4 Ų31.40%018%0.183CC..Hα-helixtrans-63.5-42.9175.600000112.7A15 S16 F21 G22 T23 W274 I277 F278A15-A19 VanDerWaalsContact O-CB 3.31Å; A15-A19 WeakPolarHBondContact O-CB 3.27Å; A15-A19 PolarHBondContact O-N 3.5Å; S16-A19 PolarHBondContact O-N 3.46Å; A19-F21 VanDerWaalsContact C-N 3.35Å; A19-G22 PolarHBondContact O-N 3.35Å; A19-T23 WeakPolarHBondContact O-CB 3.18Å; A19-T23 WeakPolarHBondContact O-CG2 3.25Å; A19-T23 PolarHBondContact O-N 3.24Å; A19-T23 PolarHBondContact O-OG1 3.3Å; A19-W274 HydrophobicContact CB-CG 4.38Å; A19-I277 HydrophobicContact CB-CB 4.17Å; A19-I277 HydrophobicContact CB-CG2 4.05Å; A19-F278 HydrophobicContact CB-CB 3.96Å
20E84.6Confident83.9Confident2 Ų228.2 Ų28.21%0.00917%0.168CC..Hα-helixtrans-61.8-44.1175.3-170.677.1176.500110.4S16 I17 G22 T23 F24 A75 K131S16-E20 WeakPolarHBondContact O-CB 3.28Å; S16-E20 PolarHBondContact O-N 3.49Å; I17-E20 PolarHBondContact O-N 2.94Å; E20-G22 PolarHBondContact O-N 3.3Å; E20-T23 PolarHBondContact O-N 2.91Å; E20-T23 PolarHBondContact O-OG1 2.94Å; E20-F24 HydrophobicContact CG-CD2 4.49Å; E20-F24 WeakPolarHBondContact O-CA 3.32Å; E20-F24 VanDerWaalsContact O-CB 3.28Å; E20-F24 WeakPolarHBondContact O-CB 3.33Å; E20-F24 PolarHBondContact O-N 3.42Å; E20-A75 HydrophobicContact CG-CB 4.35Å; E20-K131 IonicContact OE1-NZ 3.8Å; E20-K131 PolarHBondContact OE1-NZ 2.86Å
21F86.5Confident83.9Confident108 Ų10825.8 Ų25.847%0.47415%0.154SC..Hα-helixtrans-60.5-47.4178.6-169.5-93.3000112.2I17 V18 A19 T23 F24 Y69 I72I17-F21 WeakPolarHBondContact O-CB 3.24Å; I17-F21 PolarHBondContact O-N 2.82Å; V18-F21 PolarHBondContact O-N 2.85Å; A19-F21 VanDerWaalsContact C-N 3.35Å; F21-T23 VanDerWaalsContact C-N 3.31Å; F21-T23 PolarHBondContact O-N 3.34Å; F21-F24 WeakPolarHBondContact O-CB 3.31Å; F21-F24 PolarHBondContact O-N 3.1Å; F21-Y69 HydrophobicContact CD1-CE1 4.25Å; F21-Y69 HydrophobicContact CD2-CD1 4.32Å; F21-Y69 AromaticContact CD2-CE1 4Å; F21-Y69 HydrophobicContact CD2-CE1 4Å; F21-Y69 AromaticContact CE1-CE1 3.91Å; F21-Y69 HydrophobicContact CE1-CE1 3.91Å; F21-Y69 AromaticContact CE2-CD1 3.9Å; F21-Y69 HydrophobicContact CE2-CD1 3.9Å; F21-Y69 AromaticContact CE2-CE1 3.63Å; F21-Y69 HydrophobicContact CE2-CE1 3.63Å; F21-Y69 HydrophobicContact CG-CE1 4.29Å; F21-Y69 HydrophobicContact CZ-CD1 4.22Å; F21-Y69 AromaticContact CZ-CE1 3.59Å; F21-Y69 HydrophobicContact CZ-CE1 3.59Å; F21-I72 HydrophobicContact CD2-CD1 4.06Å; F21-I72 HydrophobicContact CD2-CG1 4.41Å
22G84.4Confident83.8Confident42 Ų4224.7 Ų24.743%0.43315%0.15SC..Hα-helixtrans-68.2-28.3-179.900000114V18 A19 E20V18-G22 PolarHBondContact O-N 3.15Å; A19-G22 PolarHBondContact O-N 3.35Å; E20-G22 PolarHBondContact O-N 3.3Å
23T85Confident83.6Confident2 Ų224.8 Ų24.81%0.01215%0.146CC..Hα-helixtrans-98.6-2.7179.759.10000114A19 E20 F21 P25 V26 D27 P273 W274 I277A19-T23 WeakPolarHBondContact O-CB 3.18Å; A19-T23 WeakPolarHBondContact O-CG2 3.25Å; A19-T23 PolarHBondContact O-N 3.24Å; A19-T23 PolarHBondContact O-OG1 3.3Å; E20-T23 PolarHBondContact O-N 2.91Å; E20-T23 PolarHBondContact O-OG1 2.94Å; F21-T23 VanDerWaalsContact C-N 3.31Å; F21-T23 PolarHBondContact O-N 3.34Å; T23-P25 VanDerWaalsContact C-CD 3.48Å; T23-V26 WeakPolarHBondContact O-CB 3.34Å; T23-V26 PolarHBondContact O-N 3.28Å; T23-D27 PolarHBondContact O-N 2.81Å; T23-P273 HydrophobicContact CG2-CB 4.11Å; T23-W274 HydrophobicContact CG2-CB 3.89Å; T23-I277 HydrophobicContact CG2-CD1 4.15Å
24F84.4Confident83.1Confident0 Ų023.5 Ų23.50%013%0.133CC..Hα-helixtrans-56.4-41-176.9-157.8-94.3000114.1E20 F21 V26 D27 L28 L68 Y69 S70 I72 A75 Q135E20-F24 HydrophobicContact CG-CD2 4.49Å; E20-F24 WeakPolarHBondContact O-CA 3.32Å; E20-F24 VanDerWaalsContact O-CB 3.28Å; E20-F24 WeakPolarHBondContact O-CB 3.33Å; E20-F24 PolarHBondContact O-N 3.42Å; F21-F24 WeakPolarHBondContact O-CB 3.31Å; F21-F24 PolarHBondContact O-N 3.1Å; F24-V26 VanDerWaalsContact C-N 3.27Å; F24-V26 PolarHBondContact O-N 3.09Å; F24-D27 WeakPolarHBondContact O-CB 3.33Å; F24-D27 PolarHBondContact O-N 3.32Å; F24-L28 PolarHBondContact O-N 3.12Å; F24-L68 WeakPolarHBondContact CD1-O 3.49Å; F24-L68 VanDerWaalsContact CE1-O 3.29Å; F24-L68 WeakPolarHBondContact CE1-O 3.29Å; F24-Y69 HydrophobicContact CB-CD1 4.33Å; F24-Y69 HydrophobicContact CB-CE1 4.33Å; F24-Y69 HydrophobicContact CD1-CD1 4.09Å; F24-Y69 HydrophobicContact CD1-CG 4.49Å; F24-Y69 VanDerWaalsContact CE1-C 3.5Å; F24-Y69 HydrophobicContact CG-CD1 4.46Å; F24-S70 VanDerWaalsContact CE1-O 3.31Å; F24-S70 WeakPolarHBondContact CE1-O 3.4Å; F24-S70 WeakPolarHBondContact CZ-O 3.14Å; F24-I72 HydrophobicContact CB-CD1 4.11Å; F24-I72 HydrophobicContact CD1-CD1 4.2Å; F24-I72 HydrophobicContact CD2-CD1 3.43Å; F24-I72 VanDerWaalsContact CD2-CD1 3.43Å; F24-I72 HydrophobicContact CE1-CB 4.32Å; F24-I72 HydrophobicContact CE2-CB 4.29Å; F24-I72 HydrophobicContact CE2-CD1 3.88Å; F24-I72 HydrophobicContact CG-CD1 3.62Å; F24-I72 HydrophobicContact CZ-CB 4.15Å; F24-I72 HydrophobicContact CZ-CD1 4.45Å; F24-A75 HydrophobicContact CD2-CB 4.33Å; F24-A75 HydrophobicContact CE2-CB 3.65Å; F24-Q135 HydrophobicContact CZ-CG 4.34Å; F24-Q135 VanDerWaalsContact CZ-NE2 3.26Å
25P84.8Confident82.5Confident20 Ų2019.7 Ų19.713%0.1311%0.113CC..Hα-helixtrans-60.3-35.2175.6-26.436.8000113.8T23 T29 L56 L68T23-P25 VanDerWaalsContact C-CD 3.48Å; P25-T29 WeakPolarHBondContact O-CB 3.37Å; P25-T29 PolarHBondContact O-N 3.21Å; P25-T29 VanDerWaalsContact O-N 3.12Å; P25-T29 PolarHBondContact O-OG1 3.39Å; P25-L56 HydrophobicContact CB-CD1 4.34Å; P25-L68 HydrophobicContact CB-CB 4.35Å; P25-L68 HydrophobicContact CB-CD1 4.17Å; P25-L68 HydrophobicContact CB-CD2 4.38Å; P25-L68 HydrophobicContact CG-CB 4.43Å; P25-L68 HydrophobicContact CG-CD1 4.45Å
26V84.9Confident81.8Confident26 Ų2620.7 Ų20.716%0.15812%0.118CC..Hα-helixtrans-71.8-41.9177.6-177.70000110T23 F24 T29 K30 M52 R270T23-V26 WeakPolarHBondContact O-CB 3.34Å; T23-V26 PolarHBondContact O-N 3.28Å; F24-V26 VanDerWaalsContact C-N 3.27Å; F24-V26 PolarHBondContact O-N 3.09Å; V26-T29 PolarHBondContact O-N 3.32Å; V26-K30 WeakPolarHBondContact O-CB 3.4Å; V26-K30 PolarHBondContact O-N 2.86Å; V26-M52 HydrophobicContact CG1-SD 4.03Å; V26-R270 HydrophobicContact CB-CG 4.42Å; V26-R270 HydrophobicContact CG1-CB 3.86Å; V26-R270 HydrophobicContact CG1-CG 4.02Å
27D81.9Confident80.7Confident10 Ų1020.5 Ų20.55%0.05312%0.118CC..Hα-helixtrans-57.8-50175-110.218.4000111.8T23 F24 T29 K30 T31 K131 R270T23-D27 PolarHBondContact O-N 2.81Å; F24-D27 WeakPolarHBondContact O-CB 3.33Å; F24-D27 PolarHBondContact O-N 3.32Å; D27-T29 VanDerWaalsContact C-N 3.33Å; D27-T29 PolarHBondContact O-N 3.12Å; D27-K30 WeakPolarHBondContact O-CB 2.76Å; D27-K30 PolarHBondContact O-N 2.69Å; D27-T31 PolarHBondContact O-N 3.37Å; D27-T31 PolarHBondContact O-OG1 2.95Å; D27-K131 IonicContact OD2-NZ 2.74Å; D27-K131 PolarHBondContact OD2-NZ 3.38Å; D27-R270 WeakPolarHBondContact OD1-CD 3.46Å; D27-R270 IonicContact OD1-CZ 3.65Å; D27-R270 VanDerWaalsContact OD1-CZ 3.31Å; D27-R270 IonicContact OD1-NE 3.54Å; D27-R270 PolarHBondContact OD1-NE 3.43Å; D27-R270 IonicContact OD1-NH1 2.67Å; D27-R270 PolarHBondContact OD1-NH1 2.9Å; D27-R270 IonicContact OD2-NH1 3.57Å
28L82.7Confident79.5Confident0 Ų017.8 Ų17.80%010%0.103CC..Hα-helixtrans-61.8-43.2178.5-179.3139.3000111.3F24 K30 T31 R32 I59 A67 L68 Q135F24-L28 PolarHBondContact O-N 3.12Å; L28-K30 PolarHBondContact O-N 3.37Å; L28-T31 PolarHBondContact O-N 2.66Å; L28-R32 WeakPolarHBondContact O-CG 3.04Å; L28-R32 PolarHBondContact O-N 3.35Å; L28-I59 HydrophobicContact CD2-CD1 3.73Å; L28-I59 HydrophobicContact CD2-CG2 4.36Å; L28-A67 WeakPolarHBondContact CD1-O 3.36Å; L28-L68 WeakPolarHBondContact CD1-O 3.5Å; L28-L68 HydrophobicContact CD2-CD2 4.3Å; L28-Q135 HydrophobicContact CB-CG 4.46Å; L28-Q135 HydrophobicContact CD1-CG 4.28Å; L28-Q135 HydrophobicContact CG-CB 4.48Å; L28-Q135 HydrophobicContact CG-CG 4.47Å
29T82.2Confident77.7Confident0 Ų017.1 Ų17.10%010%0.102CC..Hα-helixtrans-61.9-43.6177.6-58.80000111.7P25 V26 D27 R32 L33 M52 A55P25-T29 WeakPolarHBondContact O-CB 3.37Å; P25-T29 PolarHBondContact O-N 3.21Å; P25-T29 VanDerWaalsContact O-N 3.12Å; P25-T29 PolarHBondContact O-OG1 3.39Å; V26-T29 PolarHBondContact O-N 3.32Å; D27-T29 VanDerWaalsContact C-N 3.33Å; D27-T29 PolarHBondContact O-N 3.12Å; T29-R32 PolarHBondContact O-N 3.07Å; T29-L33 HydrophobicContact CG2-CD1 4.2Å; T29-L33 WeakPolarHBondContact O-CB 3.34Å; T29-L33 VanDerWaalsContact O-CG 3.3Å; T29-L33 WeakPolarHBondContact O-CG 3.23Å; T29-L33 PolarHBondContact O-N 2.93Å; T29-M52 HydrophobicContact CG2-CB 4.29Å; T29-M52 HydrophobicContact CG2-CG 3.64Å; T29-M52 WeakPolarHBondContact CG2-O 3.39Å; T29-A55 HydrophobicContact CG2-CB 3.47Å; T29-A55 VanDerWaalsContact CG2-CB 3.47Å
30K82.5Confident76.1Confident25 Ų2520.1 Ų20.111%0.10912%0.118CC..Hα-helixtrans-59-50.1174.8175.2-166.8167.9-171.80111.1V26 D27 L28 R32 L33 Q34 P266 N267V26-K30 WeakPolarHBondContact O-CB 3.4Å; V26-K30 PolarHBondContact O-N 2.86Å; D27-K30 WeakPolarHBondContact O-CB 2.76Å; D27-K30 PolarHBondContact O-N 2.69Å; L28-K30 PolarHBondContact O-N 3.37Å; K30-R32 VanDerWaalsContact C-N 3.31Å; K30-R32 PolarHBondContact O-N 2.95Å; K30-L33 PolarHBondContact O-N 3.37Å; K30-Q34 HydrophobicContact CG-CG 4.46Å; K30-Q34 WeakPolarHBondContact O-CG 3.3Å; K30-Q34 PolarHBondContact O-N 3.29Å; K30-P266 HydrophobicContact CB-CB 4.05Å; K30-P266 HydrophobicContact CG-CB 4.24Å; K30-N267 HydrophobicContact CD-CB 4.15Å; K30-N267 VanDerWaalsContact NZ-CG 3.29Å; K30-N267 PolarHBondContact NZ-OD1 3.28Å
31T79.8Confident74.8Confident7 Ų720.9 Ų20.94%0.04312%0.122CC..Hα-helixtrans-58.6-44.6-178.2-60.70000111D27 L28 L33 Q34 V35 I132 Q135 A136D27-T31 PolarHBondContact O-N 3.37Å; D27-T31 PolarHBondContact O-OG1 2.95Å; L28-T31 PolarHBondContact O-N 2.66Å; T31-L33 PolarHBondContact O-N 3.01Å; T31-Q34 PolarHBondContact O-N 2.9Å; T31-V35 HydrophobicContact CG2-CG2 4.46Å; T31-V35 WeakPolarHBondContact O-CB 3.29Å; T31-V35 VanDerWaalsContact O-CG2 3.31Å; T31-V35 WeakPolarHBondContact O-CG2 3.27Å; T31-V35 PolarHBondContact O-N 2.66Å; T31-I132 HydrophobicContact CG2-CD1 3.97Å; T31-I132 HydrophobicContact CG2-CG2 4.26Å; T31-Q135 HydrophobicContact CG2-CB 3.84Å; T31-Q135 PolarHBondContact OG1-OE1 3.11Å; T31-A136 HydrophobicContact CG2-CB 4.49Å
32R80.2Confident73.4Confident12 Ų1220 Ų205%0.04513%0.134CC..Hα-helixtrans-65.6-39176.9-68.6-171-177.4-163.614.4113.3L28 T29 K30 Q34 V35 Q36 Y49 E63 Q135L28-R32 WeakPolarHBondContact O-CG 3.04Å; L28-R32 PolarHBondContact O-N 3.35Å; T29-R32 PolarHBondContact O-N 3.07Å; K30-R32 VanDerWaalsContact C-N 3.31Å; K30-R32 PolarHBondContact O-N 2.95Å; R32-Q34 VanDerWaalsContact C-N 3.31Å; R32-Q34 PolarHBondContact O-N 2.84Å; R32-V35 PolarHBondContact O-N 2.77Å; R32-Q36 WeakPolarHBondContact O-CB 3.09Å; R32-Q36 WeakPolarHBondContact O-CG 3.23Å; R32-Q36 PolarHBondContact O-N 3.25Å; R32-Y49 HydrophobicContact CB-CE2 4.06Å; R32-Y49 PolarHBondContact NH1-OH 2.87Å; R32-E63 IonicContact CZ-OE1 3.32Å; R32-E63 IonicContact CZ-OE2 3.72Å; R32-E63 VanDerWaalsContact CZ-OE2 3.32Å; R32-E63 IonicContact NH1-OE1 3.04Å; R32-E63 PolarHBondContact NH1-OE1 2.94Å; R32-E63 IonicContact NH1-OE2 3.01Å; R32-E63 PolarHBondContact NH1-OE2 3.47Å; R32-E63 IonicContact NH2-OE1 2.7Å; R32-E63 IonicContact NH2-OE2 2.73Å; R32-E63 PolarHBondContact NH2-OE2 3.26Å; R32-Q135 WeakPolarHBondContact CG-O 3.38Å; R32-Q135 PolarHBondContact NE-O 3.42Å
33L78.8Confident72.2Confident16 Ų1624.1 Ų24.18%0.08414%0.137CC..Hα-helixtrans-64-33.7174.4-74.4175.4000113T29 K30 T31 Q36 Y49 M52 A55 P266T29-L33 HydrophobicContact CG2-CD1 4.2Å; T29-L33 WeakPolarHBondContact O-CB 3.34Å; T29-L33 VanDerWaalsContact O-CG 3.3Å; T29-L33 WeakPolarHBondContact O-CG 3.23Å; T29-L33 PolarHBondContact O-N 2.93Å; K30-L33 PolarHBondContact O-N 3.37Å; T31-L33 PolarHBondContact O-N 3.01Å; L33-Q36 VanDerWaalsContact CD2-NE2 3.28Å; L33-Q36 WeakPolarHBondContact O-CG 3.3Å; L33-Y49 HydrophobicContact CD2-CG 4.48Å; L33-M52 HydrophobicContact CD1-CB 4.22Å; L33-A55 HydrophobicContact CD2-CB 4.45Å; L33-P266 HydrophobicContact CD1-CG 3.87Å
34Q70.6Confident71Confident2 Ų225.9 Ų25.91%0.00914%0.144CC..Hα-helixtrans-77.7-32178.7-73.1-174.1-27.500113K30 T31 R32 T226 R227K30-Q34 HydrophobicContact CG-CG 4.46Å; K30-Q34 WeakPolarHBondContact O-CG 3.3Å; K30-Q34 PolarHBondContact O-N 3.29Å; T31-Q34 PolarHBondContact O-N 2.9Å; R32-Q34 VanDerWaalsContact C-N 3.31Å; R32-Q34 PolarHBondContact O-N 2.84Å; Q34-T226 PolarHBondContact OE1-OG1 3.01Å; Q34-R227 PolarHBondContact O-NE 3.15Å; Q34-R227 VanDerWaalsContact O-NE 3.15Å
35V71.9Confident69.7Low1 Ų132.5 Ų32.51%0.00617%0.173CC..Hα-helixtrans-82.2-32.2179.7172.30000112.4T31 R32 Q38 F44 A136 N230T31-V35 HydrophobicContact CG2-CG2 4.46Å; T31-V35 WeakPolarHBondContact O-CB 3.29Å; T31-V35 VanDerWaalsContact O-CG2 3.31Å; T31-V35 WeakPolarHBondContact O-CG2 3.27Å; T31-V35 PolarHBondContact O-N 2.66Å; R32-V35 PolarHBondContact O-N 2.77Å; V35-Q38 WeakPolarHBondContact O-CG 3.22Å; V35-Q38 PolarHBondContact O-NE2 3.45Å; V35-F44 HydrophobicContact CG1-CB 4.45Å; V35-F44 HydrophobicContact CG1-CD1 3.56Å; V35-F44 HydrophobicContact CG1-CD2 3.87Å; V35-F44 HydrophobicContact CG1-CE1 3.58Å; V35-F44 HydrophobicContact CG1-CE2 3.9Å; V35-F44 HydrophobicContact CG1-CG 3.7Å; V35-F44 HydrophobicContact CG1-CZ 3.75Å; V35-A136 HydrophobicContact CB-CB 4.49Å; V35-A136 HydrophobicContact CG1-CB 4.27Å; V35-A136 HydrophobicContact CG2-CB 4.09Å; V35-N230 WeakPolarHBondContact CG1-ND2 3.39Å; V35-N230 HydrophobicContact CG2-CB 4.02Å
36Q70.8Confident68.6Low22 Ų2239.3 Ų39.310%0.10320%0.203CC..THydrogen-bonded Turntrans-68.4158.8178.969.21673.200113.9R32 L33 Q38 Y49R32-Q36 WeakPolarHBondContact O-CB 3.09Å; R32-Q36 WeakPolarHBondContact O-CG 3.23Å; R32-Q36 PolarHBondContact O-N 3.25Å; L33-Q36 VanDerWaalsContact CD2-NE2 3.28Å; L33-Q36 WeakPolarHBondContact O-CG 3.3Å; Q36-Q38 VanDerWaalsContact C-N 3.25Å; Q36-Q38 PolarHBondContact O-N 2.91Å; Q36-Y49 PolarHBondContact NE2-O 2.84Å
37G60.2Low67.8Low8 Ų844.3 Ų44.38%0.08223%0.228CC..THydrogen-bonded Turntrans69.921.7-178.700000113.3S39 F44G37-S39 PolarHBondContact O-N 3.31Å; G37-F44 CarbonylContact C-O 3.6Å; G37-F44 VanDerWaalsContact CA-O 3.29Å; G37-F44 WeakPolarHBondContact CA-O 3.48Å; G37-F44 PolarHBondContact N-O 2.99Å
38Q60.6Low67Low2 Ų247.3 Ų47.31%0.00924%0.24CC..  trans-73.2112.6171.4-78176.517.400109V35 Q36 I40 D41 F44 K45 R227 E255V35-Q38 WeakPolarHBondContact O-CG 3.22Å; V35-Q38 PolarHBondContact O-NE2 3.45Å; Q36-Q38 VanDerWaalsContact C-N 3.25Å; Q36-Q38 PolarHBondContact O-N 2.91Å; Q38-I40 PolarHBondContact O-N 2.81Å; Q38-D41 HydrophobicContact CB-CB 4.48Å; Q38-F44 HydrophobicContact CB-CB 4.17Å; Q38-F44 PolarHBondContact N-O 2.88Å; Q38-F44 VanDerWaalsContact N-O 3.13Å; Q38-K45 WeakPolarHBondContact O-CA 3.28Å; Q38-R227 VanDerWaalsContact NE2-CG 3.29Å; Q38-E255 WeakPolarHBondContact CA-OE1 3.38Å
39S48.6Very low66.5Low55 Ų5548 Ų4839%0.38524%0.243SC..SBendtrans-69.4-18.9179.7-50.50000113.1G37G37-S39 PolarHBondContact O-N 3.31Å
40I52.3Low66Low63 Ų6359.3 Ų59.332%0.32329%0.286SS..SBendtrans-95.1-28.1-171.8-41.7177.7000111.9Q38 L240 Y241 K250Q38-I40 PolarHBondContact O-N 2.81Å; I40-L240 HydrophobicContact CB-CD2 3.57Å; I40-L240 HydrophobicContact CB-CG 4.29Å; I40-L240 HydrophobicContact CG2-CB 4.36Å; I40-L240 HydrophobicContact CG2-CD2 3.29Å; I40-L240 HydrophobicContact CG2-CG 3.47Å; I40-L240 VanDerWaalsContact CG2-CG 3.47Å; I40-Y241 HydrophobicContact CD1-CE1 4.21Å; I40-K250 HydrophobicContact CD1-CB 4.26Å; I40-K250 HydrophobicContact CD1-CD 4.43Å
41D58Low65.8Low18 Ų1859.5 Ų59.510%0.09629%0.294CS..SBendtrans-101.2109.7171.2-167.3-23.2000108.9Q38 R43 F44 K45 L240Q38-D41 HydrophobicContact CB-CB 4.48Å; D41-R43 PolarHBondContact O-N 2.86Å; D41-R43 WeakPolarHBondContact OD1-CB 3.29Å; D41-R43 IonicContact OD1-CZ 2.82Å; D41-R43 PolarHBondContact OD1-N 2.9Å; D41-R43 VanDerWaalsContact OD1-N 3.13Å; D41-R43 IonicContact OD1-NE 3.69Å; D41-R43 PolarHBondContact OD1-NE 3.42Å; D41-R43 VanDerWaalsContact OD1-NE 3.11Å; D41-R43 IonicContact OD1-NH2 3.69Å; D41-R43 IonicContact OD2-CZ 3.31Å; D41-R43 IonicContact OD2-NE 3.56Å; D41-R43 PolarHBondContact OD2-NE 3.06Å; D41-R43 IonicContact OD2-NH2 2.73Å; D41-R43 PolarHBondContact OD2-NH2 3.12Å; D41-F44 HydrophobicContact CB-CD2 4.23Å; D41-F44 PolarHBondContact O-N 2.92Å; D41-K45 PolarHBondContact O-N 2.96Å; D41-L240 HydrophobicContact CB-CD2 4.39Å
42A55.9Low65.7Low89 Ų8960.3 Ų60.374%0.73630%0.298SS*.G310 helixtrans-55.3-25.7-178.200000113F44A42-F44 VanDerWaalsContact C-N 3.29Å; A42-F44 PolarHBondContact O-N 2.91Å
43R60.3Low65.8Low129 Ų12967.4 Ų67.449%0.48733%0.329SS..G310 helixtrans-70.7-22178.5-64177.6-67.4-163.7-0.2113.8D41D41-R43 PolarHBondContact O-N 2.86Å; D41-R43 WeakPolarHBondContact OD1-CB 3.29Å; D41-R43 IonicContact OD1-CZ 2.82Å; D41-R43 PolarHBondContact OD1-N 2.9Å; D41-R43 VanDerWaalsContact OD1-N 3.13Å; D41-R43 IonicContact OD1-NE 3.69Å; D41-R43 PolarHBondContact OD1-NE 3.42Å; D41-R43 VanDerWaalsContact OD1-NE 3.11Å; D41-R43 IonicContact OD1-NH2 3.69Å; D41-R43 IonicContact OD2-CZ 3.31Å; D41-R43 IonicContact OD2-NE 3.56Å; D41-R43 PolarHBondContact OD2-NE 3.06Å; D41-R43 IonicContact OD2-NH2 2.73Å; D41-R43 PolarHBondContact OD2-NH2 3.12Å
44F59.6Low66Low39 Ų3970.7 Ų70.717%0.17134%0.344CS..G310 helixtrans-12112.5-176.3-62.2-72000112.6V35 G37 Q38 D41 A42 E46 N230V35-F44 HydrophobicContact CG1-CB 4.45Å; V35-F44 HydrophobicContact CG1-CD1 3.56Å; V35-F44 HydrophobicContact CG1-CD2 3.87Å; V35-F44 HydrophobicContact CG1-CE1 3.58Å; V35-F44 HydrophobicContact CG1-CE2 3.9Å; V35-F44 HydrophobicContact CG1-CG 3.7Å; V35-F44 HydrophobicContact CG1-CZ 3.75Å; G37-F44 CarbonylContact C-O 3.6Å; G37-F44 VanDerWaalsContact CA-O 3.29Å; G37-F44 WeakPolarHBondContact CA-O 3.48Å; G37-F44 PolarHBondContact N-O 2.99Å; Q38-F44 HydrophobicContact CB-CB 4.17Å; Q38-F44 PolarHBondContact N-O 2.88Å; Q38-F44 VanDerWaalsContact N-O 3.13Å; D41-F44 HydrophobicContact CB-CD2 4.23Å; D41-F44 PolarHBondContact O-N 2.92Å; A42-F44 VanDerWaalsContact C-N 3.29Å; A42-F44 PolarHBondContact O-N 2.91Å; F44-E46 VanDerWaalsContact C-N 3.31Å; F44-E46 PolarHBondContact O-N 3.24Å; F44-N230 WeakPolarHBondContact CE2-ND2 3.44Å
45K57Low66.5Low138 Ų13870.6 Ų70.660%0.634%0.344SS*.  trans-66.7-31.2-178.2-169.2175.2-179.6-178.70112.9Q38 D41Q38-K45 WeakPolarHBondContact O-CA 3.28Å; D41-K45 PolarHBondContact O-N 2.96Å
46E62.5Low67.1Low164 Ų16473.4 Ų73.477%0.76636%0.358SS*.SBendtrans-77.8133.7179-68.4-171.5171.900112.5F44 K48F44-E46 VanDerWaalsContact C-N 3.31Å; F44-E46 PolarHBondContact O-N 3.24Å; E46-K48 PolarHBondContact O-N 3.41Å
47I67.3Low67.7Low131 Ų13178.9 Ų78.967%0.67238%0.382SS*.  trans-79.288.1173.3-55.9174.4000108
48K65.8Low68.8Low73 Ų7382.2 Ų82.232%0.31739%0.392SS..  trans-77.1-25.3-178.5-162.3174.4179.7-173.10112.6E46 R58 E62E46-K48 PolarHBondContact O-N 3.41Å; K48-R58 PolarHBondContact O-NH1 3.16Å; K48-E62 WeakPolarHBondContact CE-OE2 3.31Å; K48-E62 IonicContact NZ-OE2 3.18Å; K48-E62 PolarHBondContact NZ-OE2 3.49Å
49Y71.3Confident69.8Low15 Ų1582.1 Ų82.16%0.05939%0.392CS..  trans-127.9124.2-172.8-51.8-67.2000112.4R32 L33 Q36 A55 R58 I59R32-Y49 HydrophobicContact CB-CE2 4.06Å; R32-Y49 PolarHBondContact NH1-OH 2.87Å; L33-Y49 HydrophobicContact CD2-CG 4.48Å; Q36-Y49 PolarHBondContact NE2-O 2.84Å; Y49-A55 VanDerWaalsContact CD1-CA 3.43Å; Y49-A55 HydrophobicContact CD1-CB 3.55Å; Y49-A55 HydrophobicContact CD2-CB 4.42Å; Y49-A55 HydrophobicContact CE1-CB 4.12Å; Y49-A55 HydrophobicContact CG-CB 3.69Å; Y49-R58 HydrophobicContact CD1-CB 4.45Å; Y49-R58 HydrophobicContact CE1-CB 4.15Å; Y49-R58 HydrophobicContact CE1-CG 4.24Å; Y49-I59 HydrophobicContact CE1-CG1 4.18Å
50R72Confident71.5Confident237 Ų23781.5 Ų81.589%0.89439%0.387SS*.SBendtrans-82-16.5177.6-67.2-176.3173.7-174.4-1.9114.1
51G77.3Confident73Confident28 Ų2886.4 Ų86.429%0.28941%0.406SS..SBendtrans179.4177.4-178.300000112.3H54 A55G51-H54 PolarHBondContact O-N 2.97Å; G51-A55 VanDerWaalsContact O-CB 3.31Å; G51-A55 WeakPolarHBondContact O-CB 3.32Å; G51-A55 PolarHBondContact O-N 3.2Å
52M79.7Confident74.2Confident25 Ų2590 Ų9012%0.12342%0.422CS..Hα-helixtrans-64.4-50.2-174.1-168.7-178.581.100113V26 T29 L33 H54 A55 L56 P266 L269V26-M52 HydrophobicContact CG1-SD 4.03Å; T29-M52 HydrophobicContact CG2-CB 4.29Å; T29-M52 HydrophobicContact CG2-CG 3.64Å; T29-M52 WeakPolarHBondContact CG2-O 3.39Å; L33-M52 HydrophobicContact CD1-CB 4.22Å; M52-H54 VanDerWaalsContact C-N 3.32Å; M52-H54 PolarHBondContact O-N 2.68Å; M52-A55 PolarHBondContact O-N 2.9Å; M52-L56 WeakPolarHBondContact O-CB 3.39Å; M52-L56 PolarHBondContact O-N 3.48Å; M52-P266 HydrophobicContact CB-CG 4.34Å; M52-P266 HydrophobicContact SD-CB 3.94Å; M52-P266 HydrophobicContact SD-CG 4.28Å; M52-L269 HydrophobicContact CE-CD1 4.12Å; M52-L269 HydrophobicContact CE-CD2 3.7Å; M52-L269 HydrophobicContact CE-CG 4.5Å; M52-L269 HydrophobicContact SD-CD2 4.38Å
53F81.7Confident75.3Confident160 Ų16087.6 Ų87.670%0.70240%0.396SS*.Hα-helixtrans-63.3-39.9178.7-67-75.8000112.3A55 L56 F57F53-A55 VanDerWaalsContact C-N 3.35Å; F53-L56 PolarHBondContact O-N 3.13Å; F53-F57 WeakPolarHBondContact O-CB 3.41Å; F53-F57 PolarHBondContact O-N 3.07Å
54H83.1Confident76.3Confident86 Ų8682.8 Ų82.840%0.39839%0.386SS..Hα-helixtrans-64.9-40.2175.7-176-93000111.7G51 M52 R58G51-H54 PolarHBondContact O-N 2.97Å; M52-H54 VanDerWaalsContact C-N 3.32Å; M52-H54 PolarHBondContact O-N 2.68Å; H54-R58 WeakPolarHBondContact O-CB 3.42Å; H54-R58 PolarHBondContact O-N 2.92Å
55A80.6Confident77.3Confident0 Ų085.5 Ų85.50%041%0.406CS..Hα-helixtrans-64.4-47.8175.200000112T29 L33 Y49 G51 M52 F53 F57 R58 I59T29-A55 HydrophobicContact CG2-CB 3.47Å; T29-A55 VanDerWaalsContact CG2-CB 3.47Å; L33-A55 HydrophobicContact CD2-CB 4.45Å; Y49-A55 VanDerWaalsContact CD1-CA 3.43Å; Y49-A55 HydrophobicContact CD1-CB 3.55Å; Y49-A55 HydrophobicContact CD2-CB 4.42Å; Y49-A55 HydrophobicContact CE1-CB 4.12Å; Y49-A55 HydrophobicContact CG-CB 3.69Å; G51-A55 VanDerWaalsContact O-CB 3.31Å; G51-A55 WeakPolarHBondContact O-CB 3.32Å; G51-A55 PolarHBondContact O-N 3.2Å; M52-A55 PolarHBondContact O-N 2.9Å; F53-A55 VanDerWaalsContact C-N 3.35Å; A55-F57 PolarHBondContact O-N 2.87Å; A55-R58 PolarHBondContact O-N 3.31Å; A55-I59 WeakPolarHBondContact O-CB 3.49Å; A55-I59 VanDerWaalsContact O-CD1 3.3Å; A55-I59 WeakPolarHBondContact O-CD1 3.19Å; A55-I59 WeakPolarHBondContact O-CG1 3.28Å; A55-I59 PolarHBondContact O-N 2.89Å
56L83.9Confident78.4Confident59 Ų5986.3 Ų86.331%0.30942%0.416SS..Hα-helixtrans-59.4-48178.8-169.8146.2000111.5P25 M52 F53 R58 I59 C60P25-L56 HydrophobicContact CB-CD1 4.34Å; M52-L56 WeakPolarHBondContact O-CB 3.39Å; M52-L56 PolarHBondContact O-N 3.48Å; F53-L56 PolarHBondContact O-N 3.13Å; L56-R58 PolarHBondContact O-N 3.46Å; L56-I59 PolarHBondContact O-N 2.87Å; L56-C60 PolarHBondContact O-N 2.95Å; L56-C60 PolarHBondContact O-SG 2.75Å; L56-C60 VanDerWaalsContact O-SG 3.36Å
57F84.6Confident79.2Confident138 Ų13879.4 Ų79.461%0.60539%0.387SS*.Hα-helixtrans-61.4-45177.2-177.5-99.8000112.4F53 A55 I59 C60 K61F53-F57 WeakPolarHBondContact O-CB 3.41Å; F53-F57 PolarHBondContact O-N 3.07Å; A55-F57 PolarHBondContact O-N 2.87Å; F57-I59 PolarHBondContact O-N 3.07Å; F57-C60 PolarHBondContact O-N 3.32Å; F57-K61 HydrophobicContact CE1-CD 4.21Å; F57-K61 WeakPolarHBondContact O-CB 3.22Å; F57-K61 PolarHBondContact O-N 2.97Å
58R82.8Confident79.8Confident77 Ų7773.7 Ų73.729%0.29136%0.357SS..Hα-helixtrans-65.7-39-179.1-170174.8-172.3170.78.8112K48 Y49 H54 A55 L56 K61 E62K48-R58 PolarHBondContact O-NH1 3.16Å; Y49-R58 HydrophobicContact CD1-CB 4.45Å; Y49-R58 HydrophobicContact CE1-CB 4.15Å; Y49-R58 HydrophobicContact CE1-CG 4.24Å; H54-R58 WeakPolarHBondContact O-CB 3.42Å; H54-R58 PolarHBondContact O-N 2.92Å; A55-R58 PolarHBondContact O-N 3.31Å; L56-R58 PolarHBondContact O-N 3.46Å; R58-K61 PolarHBondContact O-N 3.16Å; R58-E62 HydrophobicContact CG-CG 4.13Å; R58-E62 WeakPolarHBondContact CG-OE1 3.37Å; R58-E62 IonicContact CZ-OE1 3.36Å; R58-E62 IonicContact NE-OE1 2.72Å; R58-E62 PolarHBondContact NE-OE1 3.26Å; R58-E62 IonicContact NE-OE2 3.53Å; R58-E62 IonicContact NH2-OE1 3.08Å; R58-E62 PolarHBondContact NH2-OE1 3.41Å; R58-E62 VanDerWaalsContact NH2-OE1 3.08Å; R58-E62 VanDerWaalsContact O-CB 3.31Å; R58-E62 WeakPolarHBondContact O-CB 3.41Å; R58-E62 WeakPolarHBondContact O-CG 3.38Å; R58-E62 PolarHBondContact O-N 3.43Å
59I82.5Confident80.6Confident0 Ų073.5 Ų73.50%036%0.355CS..Hα-helixtrans-66-46.4176.8-65.2160.9000110.3L28 Y49 A55 L56 F57 K61 E62 E63 G64 A67 L68L28-I59 HydrophobicContact CD2-CD1 3.73Å; L28-I59 HydrophobicContact CD2-CG2 4.36Å; Y49-I59 HydrophobicContact CE1-CG1 4.18Å; A55-I59 WeakPolarHBondContact O-CB 3.49Å; A55-I59 VanDerWaalsContact O-CD1 3.3Å; A55-I59 WeakPolarHBondContact O-CD1 3.19Å; A55-I59 WeakPolarHBondContact O-CG1 3.28Å; A55-I59 PolarHBondContact O-N 2.89Å; L56-I59 PolarHBondContact O-N 2.87Å; F57-I59 PolarHBondContact O-N 3.07Å; I59-K61 PolarHBondContact O-N 3.4Å; I59-E62 PolarHBondContact O-N 3.26Å; I59-E63 HydrophobicContact CG2-CB 4.45Å; I59-E63 WeakPolarHBondContact O-CA 3.09Å; I59-E63 PolarHBondContact O-N 3.43Å; I59-G64 PolarHBondContact O-N 3.31Å; I59-A67 HydrophobicContact CG2-CB 4.38Å; I59-L68 HydrophobicContact CB-CD2 4.25Å; I59-L68 HydrophobicContact CG2-CD2 3.78Å; I59-L68 HydrophobicContact CG2-CG 4.43Å
60C84.3Confident80.9Confident42 Ų4274 Ų7428%0.28436%0.361SS..Hα-helixtrans-57.4-39.2175.2-72.20000112.5L56 F57 G64 L68L56-C60 PolarHBondContact O-N 2.95Å; L56-C60 PolarHBondContact O-SG 2.75Å; L56-C60 VanDerWaalsContact O-SG 3.36Å; F57-C60 PolarHBondContact O-N 3.32Å; C60-G64 VanDerWaalsContact O-CA 3.27Å; C60-G64 WeakPolarHBondContact O-CA 3.34Å; C60-G64 PolarHBondContact O-N 3.49Å; C60-L68 VanDerWaalsContact SG-CD1 3.55Å
61K83.6Confident81.3Confident166 Ų16662.9 Ų62.972%0.72232%0.32SS*.Hα-helixtrans-78.5-40.9-177.8-171.7176.9179.21800113.5F57 R58 I59F57-K61 HydrophobicContact CE1-CD 4.21Å; F57-K61 WeakPolarHBondContact O-CB 3.22Å; F57-K61 PolarHBondContact O-N 2.97Å; R58-K61 PolarHBondContact O-N 3.16Å; I59-K61 PolarHBondContact O-N 3.4Å
62E82.4Confident81.6Confident94 Ų9463.3 Ų63.344%0.43932%0.315SS..Hα-helixtrans-89.6-33.8-174.6-68-178178.500113.3K48 R58 I59K48-E62 WeakPolarHBondContact CE-OE2 3.31Å; K48-E62 IonicContact NZ-OE2 3.18Å; K48-E62 PolarHBondContact NZ-OE2 3.49Å; R58-E62 HydrophobicContact CG-CG 4.13Å; R58-E62 WeakPolarHBondContact CG-OE1 3.37Å; R58-E62 IonicContact CZ-OE1 3.36Å; R58-E62 IonicContact NE-OE1 2.72Å; R58-E62 PolarHBondContact NE-OE1 3.26Å; R58-E62 IonicContact NE-OE2 3.53Å; R58-E62 IonicContact NH2-OE1 3.08Å; R58-E62 PolarHBondContact NH2-OE1 3.41Å; R58-E62 VanDerWaalsContact NH2-OE1 3.08Å; R58-E62 VanDerWaalsContact O-CB 3.31Å; R58-E62 WeakPolarHBondContact O-CB 3.41Å; R58-E62 WeakPolarHBondContact O-CG 3.38Å; R58-E62 PolarHBondContact O-N 3.43Å; I59-E62 PolarHBondContact O-N 3.26Å
63E78.7Confident81.8Confident39 Ų3964.4 Ų64.418%0.18233%0.328CS..THydrogen-bonded Turntrans-119.5-10.9-172-58.8178.8-155.700113.1R32 I59 A67 G138 S139R32-E63 IonicContact CZ-OE1 3.32Å; R32-E63 IonicContact CZ-OE2 3.72Å; R32-E63 VanDerWaalsContact CZ-OE2 3.32Å; R32-E63 IonicContact NH1-OE1 3.04Å; R32-E63 PolarHBondContact NH1-OE1 2.94Å; R32-E63 IonicContact NH1-OE2 3.01Å; R32-E63 PolarHBondContact NH1-OE2 3.47Å; R32-E63 IonicContact NH2-OE1 2.7Å; R32-E63 IonicContact NH2-OE2 2.73Å; R32-E63 PolarHBondContact NH2-OE2 3.26Å; I59-E63 HydrophobicContact CG2-CB 4.45Å; I59-E63 WeakPolarHBondContact O-CA 3.09Å; I59-E63 PolarHBondContact O-N 3.43Å; E63-A67 HydrophobicContact CB-CB 3.51Å; E63-G138 VanDerWaalsContact OE2-CA 3.24Å; E63-G138 WeakPolarHBondContact OE2-CA 3.35Å; E63-S139 PolarHBondContact OE2-N 2.67Å
64G81.2Confident81.9Confident28 Ų2856.8 Ų56.829%0.28930%0.295SS..  trans87.5166.3-179.300000114I59 C60 L66 A67I59-G64 PolarHBondContact O-N 3.31Å; C60-G64 VanDerWaalsContact O-CA 3.27Å; C60-G64 WeakPolarHBondContact O-CA 3.34Å; C60-G64 PolarHBondContact O-N 3.49Å; G64-L66 VanDerWaalsContact C-N 3.3Å; G64-L66 PolarHBondContact O-N 2.92Å; G64-A67 WeakPolarHBondContact O-CB 3.48Å; G64-A67 PolarHBondContact O-N 3.33Å
65V81.4Confident82Confident96 Ų9652.7 Ų52.758%0.58228%0.276SS*.G310 helixtrans-66.4-32.6-176.5-177.90000112A67 L68V65-A67 VanDerWaalsContact C-N 3.26Å; V65-A67 PolarHBondContact O-N 3.45Å; V65-L68 WeakPolarHBondContact O-CB 3.17Å; V65-L68 PolarHBondContact O-N 3.39Å
66L80.3Confident82.2Confident155 Ų15555.4 Ų55.481%0.81229%0.29SS*.G310 helixtrans-66.3-28.3178.1-67.4174.1000112.5G64 L68 Y69G64-L66 VanDerWaalsContact C-N 3.3Å; G64-L66 PolarHBondContact O-N 2.92Å; L66-L68 PolarHBondContact O-N 2.68Å; L66-Y69 PolarHBondContact O-N 3.35Å
67A78.2Confident82.3Confident18 Ų1856.7 Ų56.715%0.14930%0.297CS..G310 helixtrans-65.1-24.3176.900000112.6L28 I59 E63 G64 V65 Y69 S70L28-A67 WeakPolarHBondContact CD1-O 3.36Å; I59-A67 HydrophobicContact CG2-CB 4.38Å; E63-A67 HydrophobicContact CB-CB 3.51Å; G64-A67 WeakPolarHBondContact O-CB 3.48Å; G64-A67 PolarHBondContact O-N 3.33Å; V65-A67 VanDerWaalsContact C-N 3.26Å; V65-A67 PolarHBondContact O-N 3.45Å; A67-Y69 PolarHBondContact O-N 2.83Å; A67-S70 WeakPolarHBondContact O-CB 3.45Å; A67-S70 PolarHBondContact O-N 2.96Å; A67-S70 VanDerWaalsContact O-N 3.13Å
68L81.3Confident82.2Confident11 Ų1152.2 Ų52.26%0.05828%0.276CS..G310 helixtrans-61.9-23.1173-66.4175.3000112.6F24 P25 L28 I59 C60 V65 L66F24-L68 WeakPolarHBondContact CD1-O 3.49Å; F24-L68 VanDerWaalsContact CE1-O 3.29Å; F24-L68 WeakPolarHBondContact CE1-O 3.29Å; P25-L68 HydrophobicContact CB-CB 4.35Å; P25-L68 HydrophobicContact CB-CD1 4.17Å; P25-L68 HydrophobicContact CB-CD2 4.38Å; P25-L68 HydrophobicContact CG-CB 4.43Å; P25-L68 HydrophobicContact CG-CD1 4.45Å; L28-L68 WeakPolarHBondContact CD1-O 3.5Å; L28-L68 HydrophobicContact CD2-CD2 4.3Å; I59-L68 HydrophobicContact CB-CD2 4.25Å; I59-L68 HydrophobicContact CG2-CD2 3.78Å; I59-L68 HydrophobicContact CG2-CG 4.43Å; C60-L68 VanDerWaalsContact SG-CD1 3.55Å; V65-L68 WeakPolarHBondContact O-CB 3.17Å; V65-L68 PolarHBondContact O-N 3.39Å; L66-L68 PolarHBondContact O-N 2.68Å
69Y82.3Confident82.1Confident70 Ų7050.2 Ų50.228%0.27527%0.27SS..G310 helixtrans-99.411.3179.3-65.8-88.7000113.3F21 F24 L66 A67 G71 I72F21-Y69 HydrophobicContact CD1-CE1 4.25Å; F21-Y69 HydrophobicContact CD2-CD1 4.32Å; F21-Y69 AromaticContact CD2-CE1 4Å; F21-Y69 HydrophobicContact CD2-CE1 4Å; F21-Y69 AromaticContact CE1-CE1 3.91Å; F21-Y69 HydrophobicContact CE1-CE1 3.91Å; F21-Y69 AromaticContact CE2-CD1 3.9Å; F21-Y69 HydrophobicContact CE2-CD1 3.9Å; F21-Y69 AromaticContact CE2-CE1 3.63Å; F21-Y69 HydrophobicContact CE2-CE1 3.63Å; F21-Y69 HydrophobicContact CG-CE1 4.29Å; F21-Y69 HydrophobicContact CZ-CD1 4.22Å; F21-Y69 AromaticContact CZ-CE1 3.59Å; F21-Y69 HydrophobicContact CZ-CE1 3.59Å; F24-Y69 HydrophobicContact CB-CD1 4.33Å; F24-Y69 HydrophobicContact CB-CE1 4.33Å; F24-Y69 HydrophobicContact CD1-CD1 4.09Å; F24-Y69 HydrophobicContact CD1-CG 4.49Å; F24-Y69 VanDerWaalsContact CE1-C 3.5Å; F24-Y69 HydrophobicContact CG-CD1 4.46Å; L66-Y69 PolarHBondContact O-N 3.35Å; A67-Y69 PolarHBondContact O-N 2.83Å; Y69-G71 PolarHBondContact O-N 3.32Å; Y69-I72 HydrophobicContact CD1-CD1 4.35Å; Y69-I72 WeakPolarHBondContact O-CB 3.34Å; Y69-I72 VanDerWaalsContact O-CG2 3.29Å; Y69-I72 WeakPolarHBondContact O-CG2 3.48Å; Y69-I72 PolarHBondContact O-N 3.47Å; Y69-I72 VanDerWaalsContact O-N 3.09Å
70S78.2Confident82Confident25 Ų2552.9 Ų52.918%0.17529%0.292CS..THydrogen-bonded Turntrans-62.4121.4173.3-173.10000110.9F24 A67 M134 Q135F24-S70 VanDerWaalsContact CE1-O 3.31Å; F24-S70 WeakPolarHBondContact CE1-O 3.4Å; F24-S70 WeakPolarHBondContact CZ-O 3.14Å; A67-S70 WeakPolarHBondContact O-CB 3.45Å; A67-S70 PolarHBondContact O-N 2.96Å; A67-S70 VanDerWaalsContact O-N 3.13Å; S70-M134 PolarHBondContact OG-O 3.33Å; S70-Q135 WeakPolarHBondContact O-CG 3.01Å
71G79.2Confident82Confident4 Ų452.3 Ų52.34%0.04129%0.289CS..THydrogen-bonded Turntrans90.59.7-175.400000115.1Y69 A73 P74 A75Y69-G71 PolarHBondContact O-N 3.32Å; G71-A73 VanDerWaalsContact C-N 3.31Å; G71-A73 PolarHBondContact O-N 2.99Å; G71-P74 VanDerWaalsContact O-CD 3.27Å; G71-P74 WeakPolarHBondContact O-CD 3.48Å; G71-P74 VanDerWaalsContact O-CG 3.26Å; G71-P74 WeakPolarHBondContact O-CG 3.34Å; G71-A75 WeakPolarHBondContact O-CB 3.37Å; G71-A75 PolarHBondContact O-N 2.94Å
72I83.7Confident81.8Confident37 Ų3747.5 Ų47.519%0.1927%0.266CS..Hα-helixtrans-62.2-39175.2-168.172.3000111.6F21 F24 Y69 A75 L76F21-I72 HydrophobicContact CD2-CD1 4.06Å; F21-I72 HydrophobicContact CD2-CG1 4.41Å; F24-I72 HydrophobicContact CB-CD1 4.11Å; F24-I72 HydrophobicContact CD1-CD1 4.2Å; F24-I72 HydrophobicContact CD2-CD1 3.43Å; F24-I72 VanDerWaalsContact CD2-CD1 3.43Å; F24-I72 HydrophobicContact CE1-CB 4.32Å; F24-I72 HydrophobicContact CE2-CB 4.29Å; F24-I72 HydrophobicContact CE2-CD1 3.88Å; F24-I72 HydrophobicContact CG-CD1 3.62Å; F24-I72 HydrophobicContact CZ-CB 4.15Å; F24-I72 HydrophobicContact CZ-CD1 4.45Å; Y69-I72 HydrophobicContact CD1-CD1 4.35Å; Y69-I72 WeakPolarHBondContact O-CB 3.34Å; Y69-I72 VanDerWaalsContact O-CG2 3.29Å; Y69-I72 WeakPolarHBondContact O-CG2 3.48Å; Y69-I72 PolarHBondContact O-N 3.47Å; Y69-I72 VanDerWaalsContact O-N 3.09Å; I72-A75 WeakPolarHBondContact O-CB 3.31Å; I72-A75 PolarHBondContact O-N 3.42Å; I72-A75 VanDerWaalsContact O-N 3.13Å; I72-L76 HydrophobicContact CG1-CD1 4.09Å; I72-L76 HydrophobicContact CG1-CG 4.2Å; I72-L76 WeakPolarHBondContact O-CG 3.42Å; I72-L76 PolarHBondContact O-N 2.93Å
73A84.8Confident81.4Confident48 Ų4844.1 Ų44.140%0.39726%0.257SS..Hα-helixtrans-58.8-53.2179.800000113.2G71 A75 L76 L77 M145G71-A73 VanDerWaalsContact C-N 3.31Å; G71-A73 PolarHBondContact O-N 2.99Å; A73-A75 VanDerWaalsContact C-N 3.29Å; A73-A75 PolarHBondContact O-N 3.44Å; A73-L76 PolarHBondContact O-N 2.98Å; A73-L77 PolarHBondContact O-N 3.19Å; A73-M145 HydrophobicContact CB-CB 4.49Å; A73-M145 HydrophobicContact CB-SD 3.92Å
74P84.1Confident81.5Confident0 Ų045.9 Ų45.90%027%0.27CS..Hα-helixtrans-63.5-34.917322.1-30.9000112G71 L76 L77 R78 T127 L130 K131 M134 M145G71-P74 VanDerWaalsContact O-CD 3.27Å; G71-P74 WeakPolarHBondContact O-CD 3.48Å; G71-P74 VanDerWaalsContact O-CG 3.26Å; G71-P74 WeakPolarHBondContact O-CG 3.34Å; P74-L76 PolarHBondContact O-N 3.42Å; P74-L77 PolarHBondContact O-N 3.46Å; P74-R78 WeakPolarHBondContact O-CB 3.34Å; P74-R78 PolarHBondContact O-N 2.84Å; P74-T127 HydrophobicContact CB-CG2 3.76Å; P74-T127 WeakPolarHBondContact O-CG2 3.45Å; P74-L130 HydrophobicContact CB-CB 3.99Å; P74-L130 HydrophobicContact CG-CB 4.36Å; P74-K131 HydrophobicContact CB-CB 4.24Å; P74-K131 HydrophobicContact CG-CB 4.2Å; P74-M134 HydrophobicContact CG-SD 3.87Å; P74-M145 HydrophobicContact CB-CE 3.94Å; P74-M145 HydrophobicContact CB-SD 4.26Å
75A84.3Confident81.6Confident0 Ų046.5 Ų46.50%027%0.267CS..Hα-helixtrans-62.2-42.4177.100000113.3E20 F24 G71 I72 A73 R78 Q79 K131E20-A75 HydrophobicContact CG-CB 4.35Å; F24-A75 HydrophobicContact CD2-CB 4.33Å; F24-A75 HydrophobicContact CE2-CB 3.65Å; G71-A75 WeakPolarHBondContact O-CB 3.37Å; G71-A75 PolarHBondContact O-N 2.94Å; I72-A75 WeakPolarHBondContact O-CB 3.31Å; I72-A75 PolarHBondContact O-N 3.42Å; I72-A75 VanDerWaalsContact O-N 3.13Å; A73-A75 VanDerWaalsContact C-N 3.29Å; A73-A75 PolarHBondContact O-N 3.44Å; A75-R78 WeakPolarHBondContact O-CB 3.39Å; A75-R78 PolarHBondContact O-N 3.35Å; A75-Q79 PolarHBondContact O-N 2.65Å; A75-K131 HydrophobicContact CB-CD 3.82Å; A75-K131 HydrophobicContact CB-CG 4.39Å
76L84.7Confident81.6Confident57 Ų5746 Ų4630%0.29826%0.257SS..Hα-helixtrans-67.3-43.5175.6-68.1177.8000111.7I17 I72 A73 P74 R78 Q79 A80I17-L76 HydrophobicContact CB-CD2 4.26Å; I17-L76 HydrophobicContact CG1-CD2 4.12Å; I17-L76 HydrophobicContact CG2-CD2 3.63Å; I72-L76 HydrophobicContact CG1-CD1 4.09Å; I72-L76 HydrophobicContact CG1-CG 4.2Å; I72-L76 WeakPolarHBondContact O-CG 3.42Å; I72-L76 PolarHBondContact O-N 2.93Å; A73-L76 PolarHBondContact O-N 2.98Å; P74-L76 PolarHBondContact O-N 3.42Å; L76-R78 VanDerWaalsContact C-N 3.26Å; L76-R78 PolarHBondContact O-N 2.96Å; L76-Q79 PolarHBondContact O-N 2.94Å; L76-Q79 VanDerWaalsContact O-N 3.14Å; L76-A80 WeakPolarHBondContact O-CB 3.18Å; L76-A80 PolarHBondContact O-N 2.87Å
77L85.3Confident81.6Confident85 Ų8542.2 Ų42.245%0.44524%0.237SC..Hα-helixtrans-59.2-41175.4-176.565.8000111.1A73 P74 A80 S81 T127 M145A73-L77 PolarHBondContact O-N 3.19Å; P74-L77 PolarHBondContact O-N 3.46Å; L77-A80 PolarHBondContact O-N 3.48Å; L77-S81 WeakPolarHBondContact O-CB 3.06Å; L77-S81 PolarHBondContact O-N 3.39Å; L77-S81 PolarHBondContact O-OG 3.25Å; L77-T127 HydrophobicContact CB-CG2 4.14Å; L77-T127 HydrophobicContact CD2-CG2 4.28Å; L77-T127 HydrophobicContact CG-CG2 4.39Å; L77-M145 HydrophobicContact CB-CE 4.36Å; L77-M145 HydrophobicContact CD2-CE 3.44Å; L77-M145 VanDerWaalsContact CD2-CE 3.44Å
78R83.6Confident81.8Confident45 Ų4542.9 Ų42.917%0.1725%0.245CC..Hα-helixtrans-61.2-47.7174.8-171.3-163.372.376.42110.6P74 A75 L76 A80 S81 Y82 T127 D128P74-R78 WeakPolarHBondContact O-CB 3.34Å; P74-R78 PolarHBondContact O-N 2.84Å; A75-R78 WeakPolarHBondContact O-CB 3.39Å; A75-R78 PolarHBondContact O-N 3.35Å; L76-R78 VanDerWaalsContact C-N 3.26Å; L76-R78 PolarHBondContact O-N 2.96Å; R78-A80 VanDerWaalsContact C-N 3.34Å; R78-A80 PolarHBondContact O-N 3.47Å; R78-S81 PolarHBondContact O-N 3.07Å; R78-S81 PolarHBondContact O-OG 2.87Å; R78-Y82 WeakPolarHBondContact O-CB 3.27Å; R78-Y82 PolarHBondContact O-N 3.39Å; R78-T127 HydrophobicContact CB-CG2 3.87Å; R78-D128 WeakPolarHBondContact CD-OD1 3.22Å
79Q81.1Confident81.9Confident34 Ų3443.9 Ų43.916%0.15925%0.25CS..Hα-helixtrans-65.2-39.3-177.4-162.362.822.600112S16 I17 A75 L76S16-Q79 PolarHBondContact OG-NE2 3.49Å; I17-Q79 HydrophobicContact CG1-CG 4.45Å; A75-Q79 PolarHBondContact O-N 2.65Å; L76-Q79 PolarHBondContact O-N 2.94Å; L76-Q79 VanDerWaalsContact O-N 3.14Å
80A80.5Confident81.9Confident56 Ų5643.6 Ų43.646%0.46325%0.249SC..Hα-helixtrans-67.2-42.317700000112.8L76 L77 R78 T84L76-A80 WeakPolarHBondContact O-CB 3.18Å; L76-A80 PolarHBondContact O-N 2.87Å; L77-A80 PolarHBondContact O-N 3.48Å; R78-A80 VanDerWaalsContact C-N 3.34Å; R78-A80 PolarHBondContact O-N 3.47Å; A80-T84 PolarHBondContact O-OG1 3.04Å
81S82.8Confident82.1Confident31 Ų3145.9 Ų45.922%0.21726%0.257CS..Hα-helixtrans-80.6-46.2-177.156.40000112.9L77 R78 G83 T84 I85L77-S81 WeakPolarHBondContact O-CB 3.06Å; L77-S81 PolarHBondContact O-N 3.39Å; L77-S81 PolarHBondContact O-OG 3.25Å; R78-S81 PolarHBondContact O-N 3.07Å; R78-S81 PolarHBondContact O-OG 2.87Å; S81-G83 PolarHBondContact O-N 3.19Å; S81-T84 PolarHBondContact O-N 2.95Å; S81-I85 WeakPolarHBondContact O-CB 3.42Å; S81-I85 WeakPolarHBondContact O-CD1 3.33Å; S81-I85 WeakPolarHBondContact O-CG1 3.27Å; S81-I85 PolarHBondContact O-N 2.61Å
82Y80.6Confident82.3Confident64 Ų6449 Ų4925%0.25128%0.278SS..Hα-helixtrans-61.1-43.9-171.1-178.4-99.9000112.7R78 K86 S120 A124R78-Y82 WeakPolarHBondContact O-CB 3.27Å; R78-Y82 PolarHBondContact O-N 3.39Å; Y82-K86 HydrophobicContact CE1-CD 4.09Å; Y82-K86 WeakPolarHBondContact O-CB 3.49Å; Y82-K86 PolarHBondContact O-N 3.48Å; Y82-S120 WeakPolarHBondContact CE2-OG 3.46Å; Y82-A124 HydrophobicContact CD2-CB 4.15Å
83G73.5Confident82.3Confident24 Ų2448.6 Ų48.625%0.24728%0.276CS..Hα-helixtrans-60.9-47.4178.900000112.2S81 I87S81-G83 PolarHBondContact O-N 3.19Å; G83-I87 WeakPolarHBondContact O-CG1 3.49Å; G83-I87 PolarHBondContact O-N 2.93Å; G83-I87 VanDerWaalsContact O-N 3.09Å
84T80.1Confident82Confident75 Ų7548.4 Ų48.446%0.4627%0.266SS..Hα-helixtrans-62.1-49.3179.2-44.80000111.4F9 A80 S81 I87 G88F9-T84 HydrophobicContact CZ-CG2 4.49Å; F9-T84 WeakPolarHBondContact CZ-OG1 3.41Å; A80-T84 PolarHBondContact O-OG1 3.04Å; S81-T84 PolarHBondContact O-N 2.95Å; T84-I87 PolarHBondContact O-N 3.42Å; T84-G88 PolarHBondContact O-N 2.94Å
85I84.5Confident81.8Confident42 Ų4257.9 Ų57.922%0.21530%0.302CS..Hα-helixtrans-65.4-45.1-176.9-65.3164.3000110.3S81 G88 I89 I123S81-I85 WeakPolarHBondContact O-CB 3.42Å; S81-I85 WeakPolarHBondContact O-CD1 3.33Å; S81-I85 WeakPolarHBondContact O-CG1 3.27Å; S81-I85 PolarHBondContact O-N 2.61Å; I85-G88 PolarHBondContact O-N 3.48Å; I85-I89 HydrophobicContact CG2-CD1 3.47Å; I85-I89 VanDerWaalsContact CG2-CD1 3.47Å; I85-I89 HydrophobicContact CG2-CG1 4.32Å; I85-I89 WeakPolarHBondContact O-CB 3.28Å; I85-I89 WeakPolarHBondContact O-CD1 3.29Å; I85-I89 WeakPolarHBondContact O-CG1 3.35Å; I85-I89 PolarHBondContact O-N 3.44Å; I85-I123 HydrophobicContact CD1-CB 4.44Å; I85-I123 HydrophobicContact CD1-CG2 3.77Å; I85-I123 HydrophobicContact CG2-CD1 3.85Å
86K80.3Confident81.6Confident86 Ų8664.1 Ų64.137%0.37434%0.335SS..Hα-helixtrans-61.5-47.7179.6-175.7-178.9177.2-175.30111.5Y82 Y90Y82-K86 HydrophobicContact CE1-CD 4.09Å; Y82-K86 WeakPolarHBondContact O-CB 3.49Å; Y82-K86 PolarHBondContact O-N 3.48Å; K86-Y90 WeakPolarHBondContact O-CB 3.41Å; K86-Y90 PolarHBondContact O-N 2.95Å
87I79.7Confident81.1Confident75 Ų7567.6 Ų67.639%0.38535%0.348SS..Hα-helixtrans-65.6-44.2179.6-67.6172000110.7F9 G83 T84 I89 Y90 Q91F9-I87 HydrophobicContact CD2-CD1 3.85Å; F9-I87 HydrophobicContact CE2-CD1 3.95Å; G83-I87 WeakPolarHBondContact O-CG1 3.49Å; G83-I87 PolarHBondContact O-N 2.93Å; G83-I87 VanDerWaalsContact O-N 3.09Å; T84-I87 PolarHBondContact O-N 3.42Å; I87-I89 PolarHBondContact O-N 3.24Å; I87-Y90 PolarHBondContact O-N 3.2Å; I87-Q91 HydrophobicContact CG2-CG 4.27Å; I87-Q91 WeakPolarHBondContact O-CB 3.39Å; I87-Q91 WeakPolarHBondContact O-CG 3.5Å; I87-Q91 PolarHBondContact O-N 3.12Å
88G83.1Confident80.4Confident32 Ų3264.7 Ų64.733%0.3333%0.334SS..Hα-helixtrans-58.3-49.2177.800000112T84 I85 Q91 S92T84-G88 PolarHBondContact O-N 2.94Å; I85-G88 PolarHBondContact O-N 3.48Å; G88-Q91 PolarHBondContact O-N 3.44Å; G88-S92 WeakPolarHBondContact O-CB 3.33Å; G88-S92 PolarHBondContact O-N 2.91Å; G88-S92 PolarHBondContact O-OG 3.09Å; G88-S92 VanDerWaalsContact O-OG 3.07Å
89I84Confident79.4Confident31 Ų3171.2 Ų71.216%0.15937%0.366CS..Hα-helixtrans-66.5-41.7178.1-62.6165.1000110.9I85 I87 Q91 S92 L93 I119 I123I85-I89 HydrophobicContact CG2-CD1 3.47Å; I85-I89 VanDerWaalsContact CG2-CD1 3.47Å; I85-I89 HydrophobicContact CG2-CG1 4.32Å; I85-I89 WeakPolarHBondContact O-CB 3.28Å; I85-I89 WeakPolarHBondContact O-CD1 3.29Å; I85-I89 WeakPolarHBondContact O-CG1 3.35Å; I85-I89 PolarHBondContact O-N 3.44Å; I87-I89 PolarHBondContact O-N 3.24Å; I89-Q91 VanDerWaalsContact C-N 3.35Å; I89-Q91 PolarHBondContact O-N 2.64Å; I89-S92 PolarHBondContact O-N 3.43Å; I89-L93 HydrophobicContact CG2-CD1 3.81Å; I89-L93 HydrophobicContact CG2-CG 4.15Å; I89-L93 WeakPolarHBondContact O-CB 3.48Å; I89-L93 VanDerWaalsContact O-CG 3.29Å; I89-L93 WeakPolarHBondContact O-CG 3.19Å; I89-L93 PolarHBondContact O-N 2.81Å; I89-I119 HydrophobicContact CD1-CB 3.86Å; I89-I119 HydrophobicContact CD1-CG2 3.49Å; I89-I119 VanDerWaalsContact CD1-CG2 3.49Å; I89-I119 HydrophobicContact CG2-CD1 4.06Å; I89-I123 HydrophobicContact CD1-CD1 4.37Å
90Y81.7Confident78.5Confident65 Ų6578.2 Ų78.226%0.25539%0.391SS..Hα-helixtrans-59.8-44.8177.7179.9-99.2000111.9K86 I87 L93 K94 C112K86-Y90 WeakPolarHBondContact O-CB 3.41Å; K86-Y90 PolarHBondContact O-N 2.95Å; I87-Y90 PolarHBondContact O-N 3.2Å; Y90-L93 PolarHBondContact O-N 2.89Å; Y90-K94 HydrophobicContact CD1-CD 4.21Å; Y90-K94 HydrophobicContact CE1-CD 3.52Å; Y90-K94 HydrophobicContact CE1-CG 4.17Å; Y90-K94 VanDerWaalsContact CZ-CE 3.45Å; Y90-K94 WeakPolarHBondContact O-CB 3.16Å; Y90-K94 PolarHBondContact O-N 3.26Å; Y90-K94 WeakPolarHBondContact OH-CE 3.42Å; Y90-K94 PolarHBondContact OH-NZ 2.93Å; Y90-K94 VanDerWaalsContact OH-NZ 3.13Å; Y90-C112 HydrophobicContact CD2-CB 4.06Å; Y90-C112 HydrophobicContact CE2-CB 3.97Å
91Q82.1Confident77.6Confident73 Ų7383.1 Ų83.134%0.34141%0.408SS..Hα-helixtrans-66.9-41.5177.1-73-179.7-2.400112I87 G88 I89 K94 R95I87-Q91 HydrophobicContact CG2-CG 4.27Å; I87-Q91 WeakPolarHBondContact O-CB 3.39Å; I87-Q91 WeakPolarHBondContact O-CG 3.5Å; I87-Q91 PolarHBondContact O-N 3.12Å; G88-Q91 PolarHBondContact O-N 3.44Å; I89-Q91 VanDerWaalsContact C-N 3.35Å; I89-Q91 PolarHBondContact O-N 2.64Å; Q91-K94 PolarHBondContact O-N 3.12Å; Q91-R95 WeakPolarHBondContact O-CG 3.45Å; Q91-R95 PolarHBondContact O-N 2.77Å
92S84.4Confident76.6Confident70 Ų7090 Ų9049%0.4944%0.437SS..Hα-helixtrans-62.5-44.3175.5-64.60000111.8G88 I89 R95 L96G88-S92 WeakPolarHBondContact O-CB 3.33Å; G88-S92 PolarHBondContact O-N 2.91Å; G88-S92 PolarHBondContact O-OG 3.09Å; G88-S92 VanDerWaalsContact O-OG 3.07Å; I89-S92 PolarHBondContact O-N 3.43Å; S92-R95 PolarHBondContact O-N 3.23Å; S92-L96 WeakPolarHBondContact O-CG 3.45Å; S92-L96 PolarHBondContact O-N 3.18Å
93L83.6Confident75.8Confident27 Ų2791.1 Ų91.114%0.14145%0.448CS..Hα-helixtrans-64-44.1175.5-71.3173.1000111.4I89 Y90 R95 L96 F97 C112 V115I89-L93 HydrophobicContact CG2-CD1 3.81Å; I89-L93 HydrophobicContact CG2-CG 4.15Å; I89-L93 WeakPolarHBondContact O-CB 3.48Å; I89-L93 VanDerWaalsContact O-CG 3.29Å; I89-L93 WeakPolarHBondContact O-CG 3.19Å; I89-L93 PolarHBondContact O-N 2.81Å; Y90-L93 PolarHBondContact O-N 2.89Å; L93-R95 VanDerWaalsContact C-N 3.32Å; L93-R95 PolarHBondContact O-N 3.48Å; L93-L96 PolarHBondContact O-N 3.35Å; L93-L96 VanDerWaalsContact O-N 3.12Å; L93-F97 HydrophobicContact CD2-CE2 4.39Å; L93-F97 WeakPolarHBondContact O-CD2 3.19Å; L93-F97 PolarHBondContact O-N 3.38Å; L93-C112 HydrophobicContact CB-CB 4.26Å; L93-V115 HydrophobicContact CD1-CB 3.87Å; L93-V115 HydrophobicContact CD1-CG1 3.69Å; L93-V115 HydrophobicContact CD2-CG1 4.47Å
94K78.5Confident75.6Confident45 Ų4593.9 Ų93.920%0.19645%0.454CS..Hα-helixtrans-58-43.8175.6-90.2-164.6155-174.40112.5Y90 Q91 L96 F97 V98 E104 N109Y90-K94 HydrophobicContact CD1-CD 4.21Å; Y90-K94 HydrophobicContact CE1-CD 3.52Å; Y90-K94 HydrophobicContact CE1-CG 4.17Å; Y90-K94 VanDerWaalsContact CZ-CE 3.45Å; Y90-K94 WeakPolarHBondContact O-CB 3.16Å; Y90-K94 PolarHBondContact O-N 3.26Å; Y90-K94 WeakPolarHBondContact OH-CE 3.42Å; Y90-K94 PolarHBondContact OH-NZ 2.93Å; Y90-K94 VanDerWaalsContact OH-NZ 3.13Å; Q91-K94 PolarHBondContact O-N 3.12Å; K94-L96 PolarHBondContact O-N 2.88Å; K94-F97 PolarHBondContact O-N 3Å; K94-V98 WeakPolarHBondContact O-CA 3.47Å; K94-V98 WeakPolarHBondContact O-CB 3.2Å; K94-V98 PolarHBondContact O-N 2.89Å; K94-E104 IonicContact NZ-OE1 2.74Å; K94-E104 PolarHBondContact NZ-OE1 3.48Å; K94-N109 WeakPolarHBondContact CE-OD1 3.33Å; K94-N109 PolarHBondContact NZ-OD1 3.09Å; K94-N109 VanDerWaalsContact NZ-OD1 3.12Å
95R80.3Confident75.3Confident198 Ų19894 Ų9475%0.74746%0.455SS*.Hα-helixtrans-64.9-25.6177.9-73.8177.6-175.9-175.33113.6Q91 S92 L93Q91-R95 WeakPolarHBondContact O-CG 3.45Å; Q91-R95 PolarHBondContact O-N 2.77Å; S92-R95 PolarHBondContact O-N 3.23Å; L93-R95 VanDerWaalsContact C-N 3.32Å; L93-R95 PolarHBondContact O-N 3.48Å
96L79.9Confident74.7Confident132 Ų13299.1 Ų99.169%0.69148%0.482SS*.Hα-helixtrans-83.8-32.4177.1-70.4171000112.9S92 L93 K94S92-L96 WeakPolarHBondContact O-CG 3.45Å; S92-L96 PolarHBondContact O-N 3.18Å; L93-L96 PolarHBondContact O-N 3.35Å; L93-L96 VanDerWaalsContact O-N 3.12Å; K94-L96 PolarHBondContact O-N 2.88Å
97F72.5Confident74.4Confident129 Ų129100.2 Ų100.257%0.56649%0.491SS*.Hα-helixtrans-102.3-18-174.5-79.2-81.4000114.5L93 K94 I108L93-F97 HydrophobicContact CD2-CE2 4.39Å; L93-F97 WeakPolarHBondContact O-CD2 3.19Å; L93-F97 PolarHBondContact O-N 3.38Å; K94-F97 PolarHBondContact O-N 3Å; F97-I108 HydrophobicContact CB-CG2 4.03Å
98V70.7Confident74.3Confident25 Ų2598.6 Ų98.615%0.15248%0.483CS..  trans-12795-177.7-175.40000108.5K94 R100 E104 I108K94-V98 WeakPolarHBondContact O-CA 3.47Å; K94-V98 WeakPolarHBondContact O-CB 3.2Å; K94-V98 PolarHBondContact O-N 2.89Å; V98-R100 WeakPolarHBondContact CG1-O 3.33Å; V98-E104 HydrophobicContact CG1-CB 4.17Å; V98-I108 HydrophobicContact CG2-CG2 3.88Å
99E64.4Low74.1Confident182 Ų18298.6 Ų98.685%0.8548%0.475SS*.SBendtrans-83.1-28176.1-71.8-172.7157.900112.4
100R62Low73.6Confident181 Ų181100.8 Ų100.868%0.68349%0.486SS*.SBendtrans-128.6146.5175.1-74.4-180170.1-178.2-2.2111V98 E102 D103V98-R100 WeakPolarHBondContact CG1-O 3.33Å; R100-E102 PolarHBondContact O-N 3.08Å; R100-E102 VanDerWaalsContact O-N 3.1Å; R100-D103 PolarHBondContact O-N 2.67Å; R100-D103 VanDerWaalsContact O-N 3.1Å
101L60.6Low73.5Confident158 Ų158101.9 Ų101.983%0.82750%0.495SS*.G310 helixtrans-57.9-24.7179.2-102.797.7000113.5D103 E104L101-D103 VanDerWaalsContact C-N 3.31Å; L101-D103 PolarHBondContact O-N 2.92Å; L101-E104 WeakPolarHBondContact O-CB 3.22Å; L101-E104 PolarHBondContact O-N 3.09Å
102E61.7Low73.4Confident177 Ų17798.6 Ų98.683%0.82748%0.48SS*.G310 helixtrans-73-21.4-179.7-65.2179.1168.400113.1R100 E104R100-E102 PolarHBondContact O-N 3.08Å; R100-E102 VanDerWaalsContact O-N 3.1Å; E102-E104 VanDerWaalsContact C-N 3.3Å
103D64Low73.2Confident87 Ų8796.3 Ų96.347%0.46547%0.468SS..G310 helixtrans-85.2-3.9176.1-63-47.8000112.5R100 L101 T105 I108R100-D103 PolarHBondContact O-N 2.67Å; R100-D103 VanDerWaalsContact O-N 3.1Å; L101-D103 VanDerWaalsContact C-N 3.31Å; L101-D103 PolarHBondContact O-N 2.92Å; D103-T105 VanDerWaalsContact C-N 3.34Å; D103-T105 PolarHBondContact O-N 2.93Å; D103-T105 PolarHBondContact O-OG1 3.49Å; D103-I108 WeakPolarHBondContact O-CD1 3.24Å
104E68.6Low73Confident82 Ų8297.1 Ų97.138%0.38347%0.474SS..  trans-70.387.4-178.1-167.3174.6177.100111.4K94 V98 L101 E102 N109K94-E104 IonicContact NZ-OE1 2.74Å; K94-E104 PolarHBondContact NZ-OE1 3.48Å; V98-E104 HydrophobicContact CG1-CB 4.17Å; L101-E104 WeakPolarHBondContact O-CB 3.22Å; L101-E104 PolarHBondContact O-N 3.09Å; E102-E104 VanDerWaalsContact C-N 3.3Å; E104-N109 PolarHBondContact OE1-ND2 3.39Å; E104-N109 PolarHBondContact OE1-OD1 3.26Å
105T75.1Confident73.3Confident77 Ų7797.7 Ų97.747%0.47248%0.481SS..  trans-90.1144.2175-49.10000110.5D103 L107 I108 N109D103-T105 VanDerWaalsContact C-N 3.34Å; D103-T105 PolarHBondContact O-N 2.93Å; D103-T105 PolarHBondContact O-OG1 3.49Å; T105-L107 HydrophobicContact CG2-CB 4.1Å; T105-L107 PolarHBondContact O-N 3.41Å; T105-L107 VanDerWaalsContact O-N 3.09Å; T105-I108 PolarHBondContact O-N 2.92Å; T105-N109 PolarHBondContact O-N 3.49Å; T105-N109 VanDerWaalsContact O-N 3.1Å
106L71.6Confident73.4Confident149 Ų14988.2 Ų88.278%0.7845%0.445SS*.Hα-helixtrans-50.7-35.2172.9-69.7174000112.5N109 M110L106-N109 PolarHBondContact O-N 2.91Å; L106-M110 WeakPolarHBondContact O-CB 3.34Å; L106-M110 PolarHBondContact O-N 2.92Å
107L73.4Confident73.5Confident109 Ų10982.4 Ų82.457%0.57142%0.417SS*.Hα-helixtrans-66.7-42.7178.8-158.7157000112T105 M110 I111T105-L107 HydrophobicContact CG2-CB 4.1Å; T105-L107 PolarHBondContact O-N 3.41Å; T105-L107 VanDerWaalsContact O-N 3.09Å; L107-M110 WeakPolarHBondContact O-CB 3.3Å; L107-M110 PolarHBondContact O-N 3.43Å; L107-I111 HydrophobicContact CD2-CD1 3.4Å; L107-I111 HydrophobicContact CD2-CG1 4.06Å; L107-I111 WeakPolarHBondContact O-CG1 3.31Å; L107-I111 PolarHBondContact O-N 2.97Å
108I78.3Confident74Confident42 Ų4278.3 Ų78.322%0.21540%0.403CS..Hα-helixtrans-64.6-44.3175.4-63176.7000109.8F97 V98 D103 T105 M110 I111 C112F97-I108 HydrophobicContact CB-CG2 4.03Å; V98-I108 HydrophobicContact CG2-CG2 3.88Å; D103-I108 WeakPolarHBondContact O-CD1 3.24Å; T105-I108 PolarHBondContact O-N 2.92Å; I108-M110 VanDerWaalsContact C-N 3.28Å; I108-M110 PolarHBondContact O-N 2.9Å; I108-I111 PolarHBondContact O-N 3.16Å; I108-C112 WeakPolarHBondContact O-CB 3.3Å; I108-C112 PolarHBondContact O-N 2.98Å; I108-C112 PolarHBondContact O-SG 2.94Å
109N78Confident74.8Confident31 Ų3180.4 Ų80.417%0.16641%0.412CS..Hα-helixtrans-59.2-39.8176.3-76.8-15.1000112.8K94 E104 T105 L106 G113K94-N109 WeakPolarHBondContact CE-OD1 3.33Å; K94-N109 PolarHBondContact NZ-OD1 3.09Å; K94-N109 VanDerWaalsContact NZ-OD1 3.12Å; E104-N109 PolarHBondContact OE1-ND2 3.39Å; E104-N109 PolarHBondContact OE1-OD1 3.26Å; T105-N109 PolarHBondContact O-N 3.49Å; T105-N109 VanDerWaalsContact O-N 3.1Å; L106-N109 PolarHBondContact O-N 2.91Å; N109-G113 PolarHBondContact O-N 3.42Å
110M73.9Confident75.7Confident77 Ų7771.7 Ų71.738%0.37937%0.372SS..Hα-helixtrans-66.9-46.8176-177.6-176.3161.800111.4L106 L107 I108 G113 V114 V176 L180L106-M110 WeakPolarHBondContact O-CB 3.34Å; L106-M110 PolarHBondContact O-N 2.92Å; L107-M110 WeakPolarHBondContact O-CB 3.3Å; L107-M110 PolarHBondContact O-N 3.43Å; I108-M110 VanDerWaalsContact C-N 3.28Å; I108-M110 PolarHBondContact O-N 2.9Å; M110-G113 PolarHBondContact O-N 3.36Å; M110-V114 WeakPolarHBondContact O-CG2 3.25Å; M110-V114 PolarHBondContact O-N 3.15Å; M110-V176 HydrophobicContact CE-CG1 3.14Å; M110-V176 HydrophobicContact CG-CG1 3.92Å; M110-V176 HydrophobicContact SD-CG1 4.24Å; M110-L180 HydrophobicContact CE-CD1 3.57Å; M110-L180 HydrophobicContact CG-CD1 4.01Å; M110-L180 HydrophobicContact SD-CD1 3.31Å; M110-L180 WeakPolarHBondContact SD-CD1 3.42Å
111I80.2Confident76.6Confident89 Ų8963.5 Ų63.546%0.45634%0.342SS..Hα-helixtrans-61.6-49.8176.4-69175.5000110.7L107 I108 G113 V114 V115L107-I111 HydrophobicContact CD2-CD1 3.4Å; L107-I111 HydrophobicContact CD2-CG1 4.06Å; L107-I111 WeakPolarHBondContact O-CG1 3.31Å; L107-I111 PolarHBondContact O-N 2.97Å; I108-I111 PolarHBondContact O-N 3.16Å; I111-G113 PolarHBondContact O-N 3.13Å; I111-V114 PolarHBondContact O-N 2.75Å; I111-V114 VanDerWaalsContact O-N 3.15Å; I111-V115 HydrophobicContact CG2-CG2 4.14Å; I111-V115 WeakPolarHBondContact O-CB 3.33Å; I111-V115 WeakPolarHBondContact O-CG2 3.49Å; I111-V115 PolarHBondContact O-N 2.75Å
112C80.3Confident77.8Confident3 Ų357.9 Ų57.92%0.0231%0.314CS..Hα-helixtrans-58.1-38.8175.8-68.60000111.3Y90 L93 I108 S116Y90-C112 HydrophobicContact CD2-CB 4.06Å; Y90-C112 HydrophobicContact CE2-CB 3.97Å; L93-C112 HydrophobicContact CB-CB 4.26Å; I108-C112 WeakPolarHBondContact O-CB 3.3Å; I108-C112 PolarHBondContact O-N 2.98Å; I108-C112 PolarHBondContact O-SG 2.94Å; C112-S116 WeakPolarHBondContact O-CB 3.46Å; C112-S116 PolarHBondContact O-N 2.91Å; C112-S116 PolarHBondContact O-OG 3.05Å
113G79.6Confident79Confident23 Ų2353.9 Ų53.924%0.23730%0.298CS..Hα-helixtrans-62.9-44.7174.900000113.2N109 M110 I111 S116 G117N109-G113 PolarHBondContact O-N 3.42Å; M110-G113 PolarHBondContact O-N 3.36Å; I111-G113 PolarHBondContact O-N 3.13Å; G113-S116 PolarHBondContact O-OG 3.42Å; G113-S116 VanDerWaalsContact O-OG 3.07Å; G113-G117 PolarHBondContact O-N 3.32Å
114V79.8Confident80Confident43 Ų4349.9 Ų49.926%0.26128%0.276SS..Hα-helixtrans-67-50.9177.4172.20000110.7M110 I111 S116 G117 V118 V176M110-V114 WeakPolarHBondContact O-CG2 3.25Å; M110-V114 PolarHBondContact O-N 3.15Å; I111-V114 PolarHBondContact O-N 2.75Å; I111-V114 VanDerWaalsContact O-N 3.15Å; V114-S116 PolarHBondContact O-N 3.08Å; V114-G117 CarbonylContact O-C 3.59Å; V114-G117 WeakPolarHBondContact O-CA 3.45Å; V114-G117 PolarHBondContact O-N 2.92Å; V114-G117 VanDerWaalsContact O-N 3.16Å; V114-V118 HydrophobicContact CG1-CG2 4.41Å; V114-V118 WeakPolarHBondContact O-CG2 3.29Å; V114-V118 PolarHBondContact O-N 2.94Å; V114-V176 HydrophobicContact CG2-CB 4.24Å; V114-V176 HydrophobicContact CG2-CG1 3.91Å; V114-V176 HydrophobicContact CG2-CG2 3.89Å
115V84Confident80.8Confident57 Ų5746 Ų4635%0.34526%0.258SS..Hα-helixtrans-63.3-45.8-177.6176.90000110.7L93 I111 G117 V118 I119L93-V115 HydrophobicContact CD1-CB 3.87Å; L93-V115 HydrophobicContact CD1-CG1 3.69Å; L93-V115 HydrophobicContact CD2-CG1 4.47Å; I111-V115 HydrophobicContact CG2-CG2 4.14Å; I111-V115 WeakPolarHBondContact O-CB 3.33Å; I111-V115 WeakPolarHBondContact O-CG2 3.49Å; I111-V115 PolarHBondContact O-N 2.75Å; V115-G117 VanDerWaalsContact C-N 3.31Å; V115-G117 PolarHBondContact O-N 2.93Å; V115-V118 PolarHBondContact O-N 3.49Å; V115-I119 HydrophobicContact CG1-CD1 3.74Å; V115-I119 HydrophobicContact CG1-CG1 4.42Å; V115-I119 VanDerWaalsContact O-CG1 3.31Å; V115-I119 WeakPolarHBondContact O-CG1 3.15Å; V115-I119 PolarHBondContact O-N 2.86Å
116S83.6Confident81.3Confident0 Ų043.2 Ų43.20%024%0.241CC..Hα-helixtrans-62-38.6174.361.10000112.4C112 G113 V114 S120C112-S116 WeakPolarHBondContact O-CB 3.46Å; C112-S116 PolarHBondContact O-N 2.91Å; C112-S116 PolarHBondContact O-OG 3.05Å; G113-S116 PolarHBondContact O-OG 3.42Å; G113-S116 VanDerWaalsContact O-OG 3.07Å; V114-S116 PolarHBondContact O-N 3.08Å; S116-S120 WeakPolarHBondContact O-CB 2.82Å; S116-S120 PolarHBondContact O-N 3.35Å; S116-S120 PolarHBondContact O-OG 2.95Å
117G81.4Confident82Confident10 Ų1036.8 Ų36.810%0.10321%0.209CC..Hα-helixtrans-60-46.4172.900000112.8G113 V114 V115 S120 S121G113-G117 PolarHBondContact O-N 3.32Å; V114-G117 CarbonylContact O-C 3.59Å; V114-G117 WeakPolarHBondContact O-CA 3.45Å; V114-G117 PolarHBondContact O-N 2.92Å; V114-G117 VanDerWaalsContact O-N 3.16Å; V115-G117 VanDerWaalsContact C-N 3.31Å; V115-G117 PolarHBondContact O-N 2.93Å; G117-S120 WeakPolarHBondContact CA-OG 3.42Å; G117-S120 PolarHBondContact O-OG 2.91Å; G117-S121 WeakPolarHBondContact O-CB 3.43Å; G117-S121 PolarHBondContact O-N 2.98Å; G117-S121 PolarHBondContact O-OG 3.46Å
118V83.9Confident82.6Confident43 Ų4332.6 Ų32.626%0.26119%0.187SC..Hα-helixtrans-65.5-47.8179.4172.90000110.9V114 V115 S121 T122 A169V114-V118 HydrophobicContact CG1-CG2 4.41Å; V114-V118 WeakPolarHBondContact O-CG2 3.29Å; V114-V118 PolarHBondContact O-N 2.94Å; V115-V118 PolarHBondContact O-N 3.49Å; V118-S121 PolarHBondContact O-N 3.25Å; V118-S121 PolarHBondContact O-OG 2.84Å; V118-T122 PolarHBondContact O-N 3.43Å; V118-T122 PolarHBondContact O-OG1 2.73Å; V118-A169 HydrophobicContact CG1-CB 4.25Å; V118-A169 HydrophobicContact CG2-CB 4.12Å
119I86.3Confident82.8Confident68 Ų6830.6 Ų30.635%0.34918%0.176SC..Hα-helixtrans-66-46.6-179.5-59.5166.4000110.5I89 V115 S121 T122 I123I89-I119 HydrophobicContact CD1-CB 3.86Å; I89-I119 HydrophobicContact CD1-CG2 3.49Å; I89-I119 VanDerWaalsContact CD1-CG2 3.49Å; I89-I119 HydrophobicContact CG2-CD1 4.06Å; V115-I119 HydrophobicContact CG1-CD1 3.74Å; V115-I119 HydrophobicContact CG1-CG1 4.42Å; V115-I119 VanDerWaalsContact O-CG1 3.31Å; V115-I119 WeakPolarHBondContact O-CG1 3.15Å; V115-I119 PolarHBondContact O-N 2.86Å; I119-S121 VanDerWaalsContact C-N 3.31Å; I119-S121 PolarHBondContact O-N 2.83Å; I119-T122 WeakPolarHBondContact O-CB 3.26Å; I119-T122 PolarHBondContact O-N 3.45Å; I119-T122 VanDerWaalsContact O-N 3.12Å; I119-I123 HydrophobicContact CG2-CD1 4.08Å; I119-I123 WeakPolarHBondContact O-CG1 3.28Å; I119-I123 PolarHBondContact O-N 3.42Å; I119-I123 VanDerWaalsContact O-N 3.08Å
120S83.6Confident83.2Confident0 Ų029.4 Ų29.40%017%0.17CC..Hα-helixtrans-60.4-40.3176.357.40000112.3Y82 S116 G117 T122 I123 A124Y82-S120 WeakPolarHBondContact CE2-OG 3.46Å; S116-S120 WeakPolarHBondContact O-CB 2.82Å; S116-S120 PolarHBondContact O-N 3.35Å; S116-S120 PolarHBondContact O-OG 2.95Å; G117-S120 WeakPolarHBondContact CA-OG 3.42Å; G117-S120 PolarHBondContact O-OG 2.91Å; S120-T122 VanDerWaalsContact C-N 3.33Å; S120-T122 PolarHBondContact O-N 3.49Å; S120-I123 PolarHBondContact O-N 2.66Å; S120-A124 WeakPolarHBondContact O-CB 3.4Å; S120-A124 PolarHBondContact O-N 3.38Å
121S81.9Confident83.7Confident9 Ų926.6 Ų26.66%0.06316%0.156CC..Hα-helixtrans-66.2-34.1175.575.30000112.9G117 V118 I119 A124 N125G117-S121 WeakPolarHBondContact O-CB 3.43Å; G117-S121 PolarHBondContact O-N 2.98Å; G117-S121 PolarHBondContact O-OG 3.46Å; V118-S121 PolarHBondContact O-N 3.25Å; V118-S121 PolarHBondContact O-OG 2.84Å; I119-S121 VanDerWaalsContact C-N 3.31Å; I119-S121 PolarHBondContact O-N 2.83Å; S121-A124 CarbonylContact O-C 3.58Å; S121-A124 PolarHBondContact O-N 3.26Å; S121-N125 WeakPolarHBondContact O-CA 3.4Å; S121-N125 WeakPolarHBondContact O-CB 3.16Å; S121-N125 PolarHBondContact O-N 2.77Å
122T85.1Confident83.8Confident40 Ų4023 Ų2325%0.24514%0.137CC..Hα-helixtrans-66.9-39.3177-57.40000111.2V118 I119 S120 W162 V165V118-T122 PolarHBondContact O-N 3.43Å; V118-T122 PolarHBondContact O-OG1 2.73Å; I119-T122 WeakPolarHBondContact O-CB 3.26Å; I119-T122 PolarHBondContact O-N 3.45Å; I119-T122 VanDerWaalsContact O-N 3.12Å; S120-T122 VanDerWaalsContact C-N 3.33Å; S120-T122 PolarHBondContact O-N 3.49Å; T122-W162 PolarHBondContact O-NE1 3.18Å; T122-V165 HydrophobicContact CG2-CG1 4.23Å; T122-V165 HydrophobicContact CG2-CG2 4.4Å; T122-V165 WeakPolarHBondContact OG1-CG1 3.41Å
123I86.1Confident83.9Confident93 Ų9323.1 Ų23.148%0.47714%0.137SC..Hα-helixtrans-72.1-37.6176.5-61.8166.1000110.9I85 I89 I119 S120 N125 P126I85-I123 HydrophobicContact CD1-CB 4.44Å; I85-I123 HydrophobicContact CD1-CG2 3.77Å; I85-I123 HydrophobicContact CG2-CD1 3.85Å; I89-I123 HydrophobicContact CD1-CD1 4.37Å; I119-I123 HydrophobicContact CG2-CD1 4.08Å; I119-I123 WeakPolarHBondContact O-CG1 3.28Å; I119-I123 PolarHBondContact O-N 3.42Å; I119-I123 VanDerWaalsContact O-N 3.08Å; S120-I123 PolarHBondContact O-N 2.66Å; I123-N125 VanDerWaalsContact C-N 3.34Å; I123-P126 WeakPolarHBondContact O-CD 3.35Å
124A85Confident83.9Confident2 Ų223 Ų232%0.01713%0.131CC..Hα-helixtrans-81.8-8.5178.900000114.1Y82 S120 S121 P126 T127 D128Y82-A124 HydrophobicContact CD2-CB 4.15Å; S120-A124 WeakPolarHBondContact O-CB 3.4Å; S120-A124 PolarHBondContact O-N 3.38Å; S121-A124 CarbonylContact O-C 3.58Å; S121-A124 PolarHBondContact O-N 3.26Å; A124-P126 VanDerWaalsContact C-CD 3.45Å; A124-T127 WeakPolarHBondContact O-CB 3.31Å; A124-T127 PolarHBondContact O-N 2.88Å; A124-D128 PolarHBondContact O-N 3.45Å; A124-D128 VanDerWaalsContact O-N 3.14Å
125N85.6Confident83.9Confident0 Ų021 Ų210%012%0.118CC..Hα-helixtrans-58.3-39.6-174.3-160.980.6000114.3S121 I123 T127 D128 V129 L161 W162 R163 V165 M229S121-N125 WeakPolarHBondContact O-CA 3.4Å; S121-N125 WeakPolarHBondContact O-CB 3.16Å; S121-N125 PolarHBondContact O-N 2.77Å; I123-N125 VanDerWaalsContact C-N 3.34Å; N125-T127 PolarHBondContact O-N 2.64Å; N125-D128 WeakPolarHBondContact O-CB 3.48Å; N125-D128 PolarHBondContact O-N 2.74Å; N125-D128 VanDerWaalsContact O-N 3.11Å; N125-V129 WeakPolarHBondContact O-CG2 3.39Å; N125-V129 PolarHBondContact O-N 3.5Å; N125-L161 PolarHBondContact ND2-O 2.95Å; N125-W162 VanDerWaalsContact ND2-C 3.33Å; N125-W162 WeakPolarHBondContact ND2-CA 3.45Å; N125-R163 PolarHBondContact ND2-O 3.06Å; N125-V165 HydrophobicContact CB-CG2 3.72Å; N125-V165 VanDerWaalsContact CG-CG2 3.42Å; N125-M229 VanDerWaalsContact OD1-CE 3.22Å; N125-M229 WeakPolarHBondContact OD1-CE 3.39Å
126P86Confident83.4Confident19 Ų1918.6 Ų18.612%0.12311%0.105CC..Hα-helixtrans-56.4-38.5175.5-26.836.6000112.5I123 A124 L130 L161 W162I123-P126 WeakPolarHBondContact O-CD 3.35Å; A124-P126 VanDerWaalsContact C-CD 3.45Å; P126-L130 WeakPolarHBondContact O-CG 2.95Å; P126-L130 PolarHBondContact O-N 3.09Å; P126-L161 HydrophobicContact CB-CB 4.26Å; P126-L161 HydrophobicContact CB-CD2 4.22Å; P126-L161 HydrophobicContact CG-CB 4.32Å; P126-W162 HydrophobicContact CG-CH2 4.5Å; P126-W162 HydrophobicContact CG-CZ2 4.4Å
127T86.3Confident82.7Confident15 Ų1520 Ų209%0.09211%0.112CC..Hα-helixtrans-72.3-36.3178.5-45.60000112P74 L77 R78 A124 N125 L130 K131P74-T127 HydrophobicContact CB-CG2 3.76Å; P74-T127 WeakPolarHBondContact O-CG2 3.45Å; L77-T127 HydrophobicContact CB-CG2 4.14Å; L77-T127 HydrophobicContact CD2-CG2 4.28Å; L77-T127 HydrophobicContact CG-CG2 4.39Å; R78-T127 HydrophobicContact CB-CG2 3.87Å; A124-T127 WeakPolarHBondContact O-CB 3.31Å; A124-T127 PolarHBondContact O-N 2.88Å; N125-T127 PolarHBondContact O-N 2.64Å; T127-L130 PolarHBondContact O-N 3.35Å; T127-K131 WeakPolarHBondContact O-CB 3.47Å; T127-K131 PolarHBondContact O-N 3.36Å
128D85.1Confident81.7Confident20 Ų2020.4 Ų20.411%0.10712%0.115CC..Hα-helixtrans-62.8-45172.8-81.6-8.9000111.8R78 A124 N125 K131 I132 R225 M229R78-D128 WeakPolarHBondContact CD-OD1 3.22Å; A124-D128 PolarHBondContact O-N 3.45Å; A124-D128 VanDerWaalsContact O-N 3.14Å; N125-D128 WeakPolarHBondContact O-CB 3.48Å; N125-D128 PolarHBondContact O-N 2.74Å; N125-D128 VanDerWaalsContact O-N 3.11Å; D128-K131 PolarHBondContact O-N 3.27Å; D128-I132 WeakPolarHBondContact O-CG1 3.42Å; D128-I132 PolarHBondContact O-N 3.32Å; D128-R225 IonicContact OD2-CZ 2.92Å; D128-R225 IonicContact OD2-NH2 2.91Å; D128-R225 PolarHBondContact OD2-NH2 3.19Å; D128-M229 HydrophobicContact CB-CE 4.26Å; D128-M229 HydrophobicContact CB-SD 4.45Å
129V84.1Confident80.2Confident0 Ų022.6 Ų22.60%013%0.132CC..Hα-helixtrans-62.1-45.1177.8173.40000110.6N125 I132 R133 I152 R163 M229N125-V129 WeakPolarHBondContact O-CG2 3.39Å; N125-V129 PolarHBondContact O-N 3.5Å; V129-I132 PolarHBondContact O-N 2.94Å; V129-R133 HydrophobicContact CG1-CG 4.45Å; V129-R133 WeakPolarHBondContact O-CB 3.36Å; V129-R133 WeakPolarHBondContact O-CG 3.33Å; V129-R133 PolarHBondContact O-N 3.03Å; V129-I152 HydrophobicContact CG1-CD1 4.43Å; V129-R163 WeakPolarHBondContact CG2-O 3.4Å; V129-M229 HydrophobicContact CG2-CB 4.46Å; V129-M229 HydrophobicContact CG2-CG 4.2Å
130L85.1Confident78.5Confident6 Ų627.1 Ų27.13%0.03116%0.156CC..Hα-helixtrans-58.2-49.8174.5-78.4165.3000111.8P74 P126 T127 I132 R133 M134 M145 F149 I152P74-L130 HydrophobicContact CB-CB 3.99Å; P74-L130 HydrophobicContact CG-CB 4.36Å; P126-L130 WeakPolarHBondContact O-CG 2.95Å; P126-L130 PolarHBondContact O-N 3.09Å; T127-L130 PolarHBondContact O-N 3.35Å; L130-I132 PolarHBondContact O-N 3.37Å; L130-R133 PolarHBondContact O-N 3.28Å; L130-M134 WeakPolarHBondContact O-CB 3.35Å; L130-M134 VanDerWaalsContact O-CG 3.26Å; L130-M134 WeakPolarHBondContact O-CG 3.36Å; L130-M134 PolarHBondContact O-N 2.84Å; L130-M145 HydrophobicContact CD1-CE 4.11Å; L130-F149 HydrophobicContact CD1-CB 4.28Å; L130-F149 HydrophobicContact CD1-CD2 4.04Å; L130-F149 HydrophobicContact CD2-CB 4.08Å; L130-I152 HydrophobicContact CD2-CD1 3.81Å; L130-I152 HydrophobicContact CG-CD1 4.42Å
131K85.8Confident77Confident19 Ų1929 Ų298%0.08317%0.165CC..Hα-helixtrans-55.8-51.6178.4-179.9-177.8175.7177.60110.8E20 D27 P74 A75 T127 D128 R133 M134 Q135E20-K131 IonicContact OE1-NZ 3.8Å; E20-K131 PolarHBondContact OE1-NZ 2.86Å; D27-K131 IonicContact OD2-NZ 2.74Å; D27-K131 PolarHBondContact OD2-NZ 3.38Å; P74-K131 HydrophobicContact CB-CB 4.24Å; P74-K131 HydrophobicContact CG-CB 4.2Å; A75-K131 HydrophobicContact CB-CD 3.82Å; A75-K131 HydrophobicContact CB-CG 4.39Å; T127-K131 WeakPolarHBondContact O-CB 3.47Å; T127-K131 PolarHBondContact O-N 3.36Å; D128-K131 PolarHBondContact O-N 3.27Å; K131-R133 PolarHBondContact O-N 3.03Å; K131-M134 PolarHBondContact O-N 3.38Å; K131-Q135 HydrophobicContact CG-CG 4.44Å; K131-Q135 WeakPolarHBondContact O-CB 3.35Å; K131-Q135 VanDerWaalsContact O-CG 3.26Å; K131-Q135 WeakPolarHBondContact O-CG 3.46Å; K131-Q135 PolarHBondContact O-N 2.82Å
132I82.3Confident75.5Confident14 Ų1438.1 Ų38.17%0.07221%0.206CC..Hα-helixtrans-63.2-44.2-176.8-67.8-64000111.4T31 D128 V129 L130 Q135 A136 T226 M229 N230T31-I132 HydrophobicContact CG2-CD1 3.97Å; T31-I132 HydrophobicContact CG2-CG2 4.26Å; D128-I132 WeakPolarHBondContact O-CG1 3.42Å; D128-I132 PolarHBondContact O-N 3.32Å; V129-I132 PolarHBondContact O-N 2.94Å; L130-I132 PolarHBondContact O-N 3.37Å; I132-Q135 PolarHBondContact O-N 3.36Å; I132-A136 WeakPolarHBondContact O-CB 3.41Å; I132-A136 PolarHBondContact O-N 2.98Å; I132-T226 HydrophobicContact CD1-CG2 4.12Å; I132-M229 HydrophobicContact CB-CB 4.4Å; I132-M229 HydrophobicContact CG1-SD 4.39Å; I132-M229 HydrophobicContact CG2-CB 4.17Å; I132-N230 HydrophobicContact CG2-CB 4Å
133R81.8Confident74.3Confident5 Ų537.7 Ų37.72%0.01921%0.21CC..Hα-helixtrans-66.8-43.2-179.9-71.6177.6-179.5-150.13.3112.3V129 L130 K131 Q135 A136 Q137 E156 M229 Q231V129-R133 HydrophobicContact CG1-CG 4.45Å; V129-R133 WeakPolarHBondContact O-CB 3.36Å; V129-R133 WeakPolarHBondContact O-CG 3.33Å; V129-R133 PolarHBondContact O-N 3.03Å; L130-R133 PolarHBondContact O-N 3.28Å; K131-R133 PolarHBondContact O-N 3.03Å; R133-Q135 VanDerWaalsContact C-N 3.32Å; R133-Q135 PolarHBondContact O-N 3.27Å; R133-A136 PolarHBondContact O-N 2.84Å; R133-Q137 WeakPolarHBondContact O-CB 3.47Å; R133-Q137 VanDerWaalsContact O-CG 3.29Å; R133-Q137 WeakPolarHBondContact O-CG 3.35Å; R133-Q137 PolarHBondContact O-N 3.13Å; R133-E156 IonicContact CZ-OE1 2.7Å; R133-E156 IonicContact CZ-OE2 2.66Å; R133-E156 VanDerWaalsContact NH1-CD 3.28Å; R133-E156 IonicContact NH1-OE1 3.82Å; R133-E156 PolarHBondContact NH1-OE1 2.98Å; R133-E156 IonicContact NH1-OE2 3.35Å; R133-E156 PolarHBondContact NH1-OE2 3.44Å; R133-E156 VanDerWaalsContact NH2-CD 3.32Å; R133-E156 IonicContact NH2-OE1 3.49Å; R133-E156 PolarHBondContact NH2-OE1 2.9Å; R133-E156 IonicContact NH2-OE2 3.83Å; R133-E156 PolarHBondContact NH2-OE2 3.21Å; R133-M229 PolarHBondContact NE-O 3.34Å; R133-Q231 PolarHBondContact NH2-O 2.98Å
134M80.1Confident73.6Confident19 Ų1936.7 Ų36.79%0.09421%0.211CC..Hα-helixtrans-66.3-33176.6-68.8-177.878.500112.6S70 P74 L130 K131S70-M134 PolarHBondContact OG-O 3.33Å; P74-M134 HydrophobicContact CG-SD 3.87Å; L130-M134 WeakPolarHBondContact O-CB 3.35Å; L130-M134 VanDerWaalsContact O-CG 3.26Å; L130-M134 WeakPolarHBondContact O-CG 3.36Å; L130-M134 PolarHBondContact O-N 2.84Å; K131-M134 PolarHBondContact O-N 3.38Å
135Q78.5Confident73.2Confident1 Ų138.7 Ų38.71%0.00522%0.221CC..Hα-helixtrans-75.9-35.3176.2-75.8-177-19.200112.9F24 L28 T31 R32 S70 K131 I132 R133F24-Q135 HydrophobicContact CZ-CG 4.34Å; F24-Q135 VanDerWaalsContact CZ-NE2 3.26Å; L28-Q135 HydrophobicContact CB-CG 4.46Å; L28-Q135 HydrophobicContact CD1-CG 4.28Å; L28-Q135 HydrophobicContact CG-CB 4.48Å; L28-Q135 HydrophobicContact CG-CG 4.47Å; T31-Q135 HydrophobicContact CG2-CB 3.84Å; T31-Q135 PolarHBondContact OG1-OE1 3.11Å; R32-Q135 WeakPolarHBondContact CG-O 3.38Å; R32-Q135 PolarHBondContact NE-O 3.42Å; S70-Q135 WeakPolarHBondContact O-CG 3.01Å; K131-Q135 HydrophobicContact CG-CG 4.44Å; K131-Q135 WeakPolarHBondContact O-CB 3.35Å; K131-Q135 VanDerWaalsContact O-CG 3.26Å; K131-Q135 WeakPolarHBondContact O-CG 3.46Å; K131-Q135 PolarHBondContact O-N 2.82Å; I132-Q135 PolarHBondContact O-N 3.36Å; R133-Q135 VanDerWaalsContact C-N 3.32Å; R133-Q135 PolarHBondContact O-N 3.27Å
136A73.4Confident72.9Confident8 Ų844.2 Ų44.27%0.06625%0.249CC..Hα-helixtrans-74.3-32.518000000112.8T31 V35 I132 R133 N230T31-A136 HydrophobicContact CG2-CB 4.49Å; V35-A136 HydrophobicContact CB-CB 4.49Å; V35-A136 HydrophobicContact CG1-CB 4.27Å; V35-A136 HydrophobicContact CG2-CB 4.09Å; I132-A136 WeakPolarHBondContact O-CB 3.41Å; I132-A136 PolarHBondContact O-N 2.98Å; R133-A136 PolarHBondContact O-N 2.84Å; A136-N230 WeakPolarHBondContact CB-OD1 3.21Å
137Q68.8Low72.6Confident30 Ų3044.6 Ų44.614%0.1426%0.256CS..SBendtrans-89.7109.9177.5-64.1-175.4-40.900108.3R133 F141 R232R133-Q137 WeakPolarHBondContact O-CB 3.47Å; R133-Q137 VanDerWaalsContact O-CG 3.29Å; R133-Q137 WeakPolarHBondContact O-CG 3.35Å; R133-Q137 PolarHBondContact O-N 3.13Å; Q137-F141 HydrophobicContact CB-CB 4.24Å; Q137-F141 HydrophobicContact CB-CD2 4.41Å; Q137-R232 VanDerWaalsContact NE2-NE 3.1Å
138G62.3Low72.2Confident17 Ų1744.1 Ų44.118%0.17525%0.254CS..  trans-68.4-138.4176.600000113.2E63 L140 F141E63-G138 VanDerWaalsContact OE2-CA 3.24Å; E63-G138 WeakPolarHBondContact OE2-CA 3.35Å; G138-L140 PolarHBondContact O-N 3.39Å; G138-F141 PolarHBondContact O-N 3.21Å; G138-F141 VanDerWaalsContact O-N 3.12Å
139S51.1Low72.1Confident89 Ų8947.1 Ų47.162%0.62227%0.266SS*.THydrogen-bonded Turntrans-55-8.9-176.958.70000116.5E63 F141E63-S139 PolarHBondContact OE2-N 2.67Å; S139-F141 VanDerWaalsContact C-N 3.28Å; S139-F141 PolarHBondContact O-N 3.3Å
140L50.5Low72.1Confident163 Ų16350.6 Ų50.685%0.85328%0.284SS*.THydrogen-bonded Turntrans-70.4-16.1174.3-82.7151.3000114.2G138G138-L140 PolarHBondContact O-N 3.39Å
141F52.1Low71.9Confident41 Ų4153.2 Ų53.218%0.1830%0.298CS..  trans-110.289.5176.9-122.9-95000111.6Q137 G138 S139 S148Q137-F141 HydrophobicContact CB-CB 4.24Å; Q137-F141 HydrophobicContact CB-CD2 4.41Å; G138-F141 PolarHBondContact O-N 3.21Å; G138-F141 VanDerWaalsContact O-N 3.12Å; S139-F141 VanDerWaalsContact C-N 3.28Å; S139-F141 PolarHBondContact O-N 3.3Å; F141-S148 WeakPolarHBondContact CE1-OG 3.4Å
142Q51.1Low71.6Confident199 Ų19952.7 Ų52.793%0.9330%0.296SS*.  trans-86.716.6161.9-84-177.8-27.700112.2
143G58.8Low71.7Confident31 Ų3158 Ų5832%0.3232%0.316SS..  trans-81.4140.9-179.600000112.7
144S71.4Confident71.7Confident72 Ų7264.8 Ų64.850%0.50335%0.348SS..  trans-58.1155166143.20000110.9I146 G147 S148S144-I146 PolarHBondContact O-N 3.44Å; S144-I146 VanDerWaalsContact O-N 3.16Å; S144-I146 PolarHBondContact OG-N 3.25Å; S144-G147 PolarHBondContact O-N 3.06Å; S144-S148 PolarHBondContact O-N 3.27Å; S144-S148 PolarHBondContact O-OG 3.15Å; S144-S148 VanDerWaalsContact O-OG 3.13Å
145M76.8Confident71.6Confident44 Ų4468.9 Ų68.922%0.21737%0.366CS..Hα-helixtrans-50.6-37.7171.7176.1179.8174.400111.8A73 P74 L77 L130 F149A73-M145 HydrophobicContact CB-CB 4.49Å; A73-M145 HydrophobicContact CB-SD 3.92Å; P74-M145 HydrophobicContact CB-CE 3.94Å; P74-M145 HydrophobicContact CB-SD 4.26Å; L77-M145 HydrophobicContact CB-CE 4.36Å; L77-M145 HydrophobicContact CD2-CE 3.44Å; L77-M145 VanDerWaalsContact CD2-CE 3.44Å; L130-M145 HydrophobicContact CD1-CE 4.11Å; M145-F149 PolarHBondContact O-N 3.07Å
146I80.3Confident71.5Confident116 Ų11669.7 Ų69.760%0.59537%0.37SS*.Hα-helixtrans-71.4-41.4179.3-60.9172.3000110.5S144 S148 F149 I150S144-I146 PolarHBondContact O-N 3.44Å; S144-I146 VanDerWaalsContact O-N 3.16Å; S144-I146 PolarHBondContact OG-N 3.25Å; I146-S148 VanDerWaalsContact C-N 3.35Å; I146-S148 PolarHBondContact O-N 3.17Å; I146-F149 WeakPolarHBondContact O-CB 3.26Å; I146-F149 PolarHBondContact O-N 2.89Å; I146-I150 HydrophobicContact CG2-CD1 3.82Å; I146-I150 HydrophobicContact CG2-CG1 4.39Å; I146-I150 VanDerWaalsContact O-CG1 3.3Å; I146-I150 WeakPolarHBondContact O-CG1 3.28Å; I146-I150 PolarHBondContact O-N 3.23Å
147G79.8Confident71.9Confident27 Ų2770.6 Ų70.628%0.27838%0.381SS..Hα-helixtrans-60.1-45.8174.400000111.5S144 F149 I150 D151S144-G147 PolarHBondContact O-N 3.06Å; G147-F149 VanDerWaalsContact C-N 3.29Å; G147-F149 PolarHBondContact O-N 3.09Å; G147-I150 PolarHBondContact O-N 3.36Å; G147-D151 WeakPolarHBondContact O-CB 3.48Å; G147-D151 PolarHBondContact O-N 3.06Å
148S77.6Confident72.5Confident5 Ų572.9 Ų72.94%0.03540%0.397CS..Hα-helixtrans-58.6-40.8174.6-51.90000112.1F141 S144 I146 I152F141-S148 WeakPolarHBondContact CE1-OG 3.4Å; S144-S148 PolarHBondContact O-N 3.27Å; S144-S148 PolarHBondContact O-OG 3.15Å; S144-S148 VanDerWaalsContact O-OG 3.13Å; I146-S148 VanDerWaalsContact C-N 3.35Å; I146-S148 PolarHBondContact O-N 3.17Å; S148-I152 WeakPolarHBondContact O-CD1 3.36Å; S148-I152 WeakPolarHBondContact O-CG1 3.4Å; S148-I152 PolarHBondContact O-N 3.42Å; S148-I152 VanDerWaalsContact O-N 3.09Å
149F82.9Confident73.3Confident83 Ų8382.3 Ų82.336%0.36443%0.427SS..Hα-helixtrans-66.4-45.7178.2178.3-96.5000112L130 M145 I146 G147 D151 I152 Y153 L161L130-F149 HydrophobicContact CD1-CB 4.28Å; L130-F149 HydrophobicContact CD1-CD2 4.04Å; L130-F149 HydrophobicContact CD2-CB 4.08Å; M145-F149 PolarHBondContact O-N 3.07Å; I146-F149 WeakPolarHBondContact O-CB 3.26Å; I146-F149 PolarHBondContact O-N 2.89Å; G147-F149 VanDerWaalsContact C-N 3.29Å; G147-F149 PolarHBondContact O-N 3.09Å; F149-D151 VanDerWaalsContact C-N 3.35Å; F149-I152 PolarHBondContact O-N 2.92Å; F149-Y153 WeakPolarHBondContact O-CB 3.31Å; F149-Y153 PolarHBondContact O-N 3.34Å; F149-L161 HydrophobicContact CD2-CD1 4.41Å; F149-L161 HydrophobicContact CD2-CD2 3.86Å; F149-L161 HydrophobicContact CE2-CD1 3.59Å; F149-L161 HydrophobicContact CE2-CD2 3.77Å; F149-L161 HydrophobicContact CE2-CG 4.36Å; F149-L161 HydrophobicContact CZ-CD1 3.95Å
150I82.9Confident74.5Confident74 Ų7478.1 Ų78.138%0.37940%0.397SS..Hα-helixtrans-62.1-44.6177.5-67.4168.3000110.2I146 G147 I152 Y153 Q154I146-I150 HydrophobicContact CG2-CD1 3.82Å; I146-I150 HydrophobicContact CG2-CG1 4.39Å; I146-I150 VanDerWaalsContact O-CG1 3.3Å; I146-I150 WeakPolarHBondContact O-CG1 3.28Å; I146-I150 PolarHBondContact O-N 3.23Å; G147-I150 PolarHBondContact O-N 3.36Å; I150-I152 VanDerWaalsContact C-N 3.35Å; I150-I152 PolarHBondContact O-N 3.34Å; I150-Y153 PolarHBondContact O-N 3.4Å; I150-Q154 HydrophobicContact CG2-CG 4.16Å; I150-Q154 WeakPolarHBondContact O-CB 3.49Å; I150-Q154 WeakPolarHBondContact O-CG 3.22Å; I150-Q154 PolarHBondContact O-N 3.14Å
151D80.9Confident76.1Confident60 Ų6070.5 Ų70.532%0.32136%0.358SS..Hα-helixtrans-58.9-45.7178.1-72.9-12.3000111.7G147 F149 Y153 Q154 Q155G147-D151 WeakPolarHBondContact O-CB 3.48Å; G147-D151 PolarHBondContact O-N 3.06Å; F149-D151 VanDerWaalsContact C-N 3.35Å; D151-Y153 VanDerWaalsContact C-N 3.35Å; D151-Q154 PolarHBondContact O-N 3.1Å; D151-Q155 VanDerWaalsContact O-CB 3.32Å; D151-Q155 WeakPolarHBondContact O-CB 3.4Å; D151-Q155 WeakPolarHBondContact O-CG 3.29Å; D151-Q155 PolarHBondContact O-N 3.08Å
152I80.9Confident77.6Confident8 Ų874.4 Ų74.44%0.04137%0.371CS..Hα-helixtrans-64.3-44.4178-64.4167.8000110.1V129 L130 S148 F149 I150 E156 G157 L161V129-I152 HydrophobicContact CG1-CD1 4.43Å; L130-I152 HydrophobicContact CD2-CD1 3.81Å; L130-I152 HydrophobicContact CG-CD1 4.42Å; S148-I152 WeakPolarHBondContact O-CD1 3.36Å; S148-I152 WeakPolarHBondContact O-CG1 3.4Å; S148-I152 PolarHBondContact O-N 3.42Å; S148-I152 VanDerWaalsContact O-N 3.09Å; F149-I152 PolarHBondContact O-N 2.92Å; I150-I152 VanDerWaalsContact C-N 3.35Å; I150-I152 PolarHBondContact O-N 3.34Å; I152-E156 WeakPolarHBondContact O-CA 3.36Å; I152-E156 WeakPolarHBondContact O-CB 3.31Å; I152-E156 PolarHBondContact O-N 3.23Å; I152-G157 PolarHBondContact O-N 3.04Å; I152-L161 HydrophobicContact CB-CD2 4.39Å; I152-L161 HydrophobicContact CG2-CD2 3.8Å; I152-L161 HydrophobicContact CG2-CG 4.14Å
153Y82.9Confident79Confident127 Ų12766.8 Ų66.850%0.49833%0.334SS..Hα-helixtrans-64.7-40.3-179.3-172.9-99.1000112.1F149 I150 D151 G157 T158 L161F149-Y153 WeakPolarHBondContact O-CB 3.31Å; F149-Y153 PolarHBondContact O-N 3.34Å; I150-Y153 PolarHBondContact O-N 3.4Å; D151-Y153 VanDerWaalsContact C-N 3.35Å; Y153-G157 WeakPolarHBondContact O-CA 3.46Å; Y153-G157 PolarHBondContact O-N 2.91Å; Y153-T158 HydrophobicContact CE2-CG2 3.8Å; Y153-L161 HydrophobicContact CD2-CD1 4.12Å
154Q82.4Confident79.9Confident146 Ų14665.5 Ų65.568%0.68232%0.321SS*.Hα-helixtrans-74.1-39.1179-71.8-177.3-200112.9I150 D151I150-Q154 HydrophobicContact CG2-CG 4.16Å; I150-Q154 WeakPolarHBondContact O-CB 3.49Å; I150-Q154 WeakPolarHBondContact O-CG 3.22Å; I150-Q154 PolarHBondContact O-N 3.14Å; D151-Q154 PolarHBondContact O-N 3.1Å
155Q79.2Confident80.6Confident105 Ų10563.2 Ų63.249%0.49130%0.304SS..Hα-helixtrans-84.6-34.4-176.7-66.5-172.96.300113.6D151D151-Q155 VanDerWaalsContact O-CB 3.32Å; D151-Q155 WeakPolarHBondContact O-CB 3.4Å; D151-Q155 WeakPolarHBondContact O-CG 3.29Å; D151-Q155 PolarHBondContact O-N 3.08Å
156E74.7Confident80.9Confident19 Ų1965.6 Ų65.69%0.08932%0.32CS..Hα-helixtrans-122.3-6.5-170.3-52.7-172.5-160.100113.6R133 I152 G160 R163 R232 A233R133-E156 IonicContact CZ-OE1 2.7Å; R133-E156 IonicContact CZ-OE2 2.66Å; R133-E156 VanDerWaalsContact NH1-CD 3.28Å; R133-E156 IonicContact NH1-OE1 3.82Å; R133-E156 PolarHBondContact NH1-OE1 2.98Å; R133-E156 IonicContact NH1-OE2 3.35Å; R133-E156 PolarHBondContact NH1-OE2 3.44Å; R133-E156 VanDerWaalsContact NH2-CD 3.32Å; R133-E156 IonicContact NH2-OE1 3.49Å; R133-E156 PolarHBondContact NH2-OE1 2.9Å; R133-E156 IonicContact NH2-OE2 3.83Å; R133-E156 PolarHBondContact NH2-OE2 3.21Å; I152-E156 WeakPolarHBondContact O-CA 3.36Å; I152-E156 WeakPolarHBondContact O-CB 3.31Å; I152-E156 PolarHBondContact O-N 3.23Å; E156-G160 PolarHBondContact O-N 3.26Å; E156-R163 IonicContact OE2-CZ 3.16Å; E156-R163 IonicContact OE2-NH1 2.75Å; E156-R163 PolarHBondContact OE2-NH1 3.05Å; E156-R232 WeakPolarHBondContact OE1-CA 3.24Å; E156-R232 WeakPolarHBondContact OE1-CB 3.39Å; E156-A233 HydrophobicContact CB-CB 4.25Å; E156-A233 HydrophobicContact CG-CB 3.7Å; E156-A233 PolarHBondContact OE1-N 3.13Å; E156-A233 VanDerWaalsContact OE1-N 3.08Å
157G81.8Confident81.1Confident27 Ų2760.2 Ų60.228%0.27829%0.293SS..Hα-helixtrans64.6-163.8-176.200000113.3I152 Y153 R159 G160I152-G157 PolarHBondContact O-N 3.04Å; Y153-G157 WeakPolarHBondContact O-CA 3.46Å; Y153-G157 PolarHBondContact O-N 2.91Å; G157-R159 VanDerWaalsContact C-N 3.25Å; G157-R159 PolarHBondContact O-N 2.75Å; G157-G160 PolarHBondContact O-N 3.11Å
158T81.7Confident81.2Confident78 Ų7859.4 Ų59.448%0.47928%0.283SS..Hα-helixtrans-62.2-33.317653.10000111.8Y153 G160 L161 W162Y153-T158 HydrophobicContact CE2-CG2 3.8Å; T158-G160 VanDerWaalsContact C-N 3.26Å; T158-G160 PolarHBondContact O-N 3.08Å; T158-L161 PolarHBondContact O-N 2.9Å; T158-L161 VanDerWaalsContact O-N 3.12Å; T158-W162 PolarHBondContact O-N 3.01Å
159R79.5Confident81.5Confident215 Ų21560.5 Ų60.581%0.81129%0.292SS*.Hα-helixtrans-58.5-35.3178.5-77.5-177.3161.9-174.4-3.8113.1G157 W162 R163G157-R159 VanDerWaalsContact C-N 3.25Å; G157-R159 PolarHBondContact O-N 2.75Å; R159-W162 PolarHBondContact O-N 3.08Å; R159-R163 WeakPolarHBondContact O-CG 3.39Å; R159-R163 PolarHBondContact O-N 3.15Å
160G77.4Confident81.6Confident0 Ų060.1 Ų60.10%029%0.291CS..Hα-helixtrans-62.2-39.9176.200000113.6E156 G157 T158 R163E156-G160 PolarHBondContact O-N 3.26Å; G157-G160 PolarHBondContact O-N 3.11Å; T158-G160 VanDerWaalsContact C-N 3.26Å; T158-G160 PolarHBondContact O-N 3.08Å; G160-R163 WeakPolarHBondContact O-CB 3.26Å; G160-R163 PolarHBondContact O-N 2.74Å
161L82.4Confident81.7Confident4 Ų461 Ų612%0.02129%0.29CS..Hα-helixtrans-72.4-28.6-178.1-66.4169.9000113.4N125 P126 F149 I152 Y153 T158N125-L161 PolarHBondContact ND2-O 2.95Å; P126-L161 HydrophobicContact CB-CB 4.26Å; P126-L161 HydrophobicContact CB-CD2 4.22Å; P126-L161 HydrophobicContact CG-CB 4.32Å; F149-L161 HydrophobicContact CD2-CD1 4.41Å; F149-L161 HydrophobicContact CD2-CD2 3.86Å; F149-L161 HydrophobicContact CE2-CD1 3.59Å; F149-L161 HydrophobicContact CE2-CD2 3.77Å; F149-L161 HydrophobicContact CE2-CG 4.36Å; F149-L161 HydrophobicContact CZ-CD1 3.95Å; I152-L161 HydrophobicContact CB-CD2 4.39Å; I152-L161 HydrophobicContact CG2-CD2 3.8Å; I152-L161 HydrophobicContact CG2-CG 4.14Å; Y153-L161 HydrophobicContact CD2-CD1 4.12Å; T158-L161 PolarHBondContact O-N 2.9Å; T158-L161 VanDerWaalsContact O-N 3.12Å
162W85.3Confident81.7Confident122 Ų12259.6 Ų59.646%0.46229%0.287SS..THydrogen-bonded Turntrans-96.79.4176.2-80-98.1000113.3T122 N125 P126 T158 R159 G164 V165T122-W162 PolarHBondContact O-NE1 3.18Å; N125-W162 VanDerWaalsContact ND2-C 3.33Å; N125-W162 WeakPolarHBondContact ND2-CA 3.45Å; P126-W162 HydrophobicContact CG-CH2 4.5Å; P126-W162 HydrophobicContact CG-CZ2 4.4Å; T158-W162 PolarHBondContact O-N 3.01Å; R159-W162 PolarHBondContact O-N 3.08Å; W162-G164 PolarHBondContact O-N 3.45Å; W162-V165 HydrophobicContact CB-CG2 4.3Å; W162-V165 HydrophobicContact CG-CG2 4.49Å; W162-V165 WeakPolarHBondContact O-CG2 3.27Å; W162-V165 PolarHBondContact O-N 3.41Å
163R79.9Confident81.7Confident39 Ų3962 Ų6215%0.14731%0.308CS..THydrogen-bonded Turntrans-62.8132.4170.7-82.7-168.7-179.2146.38110.3N125 V129 E156 R159 G160 Q231 D239N125-R163 PolarHBondContact ND2-O 3.06Å; V129-R163 WeakPolarHBondContact CG2-O 3.4Å; E156-R163 IonicContact OE2-CZ 3.16Å; E156-R163 IonicContact OE2-NH1 2.75Å; E156-R163 PolarHBondContact OE2-NH1 3.05Å; R159-R163 WeakPolarHBondContact O-CG 3.39Å; R159-R163 PolarHBondContact O-N 3.15Å; G160-R163 WeakPolarHBondContact O-CB 3.26Å; G160-R163 PolarHBondContact O-N 2.74Å; R163-Q231 PolarHBondContact NH1-O 3.49Å; R163-D239 IonicContact CZ-OD1 3.61Å; R163-D239 IonicContact NH2-OD1 3.43Å; R163-D239 PolarHBondContact NH2-OD1 2.91Å
164G78.1Confident81.8Confident4 Ų458.2 Ų58.24%0.04130%0.296CS..THydrogen-bonded Turntrans95.4-4177.300000115.3W162 V166 P167 T168W162-G164 PolarHBondContact O-N 3.45Å; G164-V166 PolarHBondContact O-N 2.89Å; G164-P167 WeakPolarHBondContact O-CD 3.42Å; G164-T168 WeakPolarHBondContact O-CB 3.36Å; G164-T168 PolarHBondContact O-N 3.22Å; G164-T168 PolarHBondContact O-OG1 3.32Å
165V84.4Confident81.7Confident25 Ų2552.7 Ų52.715%0.15227%0.272CS..Hα-helixtrans-58.5-46.1175.21740000111.6T122 N125 W162 T168 A169T122-V165 HydrophobicContact CG2-CG1 4.23Å; T122-V165 HydrophobicContact CG2-CG2 4.4Å; T122-V165 WeakPolarHBondContact OG1-CG1 3.41Å; N125-V165 HydrophobicContact CB-CG2 3.72Å; N125-V165 VanDerWaalsContact CG-CG2 3.42Å; W162-V165 HydrophobicContact CB-CG2 4.3Å; W162-V165 HydrophobicContact CG-CG2 4.49Å; W162-V165 WeakPolarHBondContact O-CG2 3.27Å; W162-V165 PolarHBondContact O-N 3.41Å; V165-T168 WeakPolarHBondContact O-CA 3.45Å; V165-T168 WeakPolarHBondContact O-CB 3.19Å; V165-T168 PolarHBondContact O-N 3.49Å; V165-T168 VanDerWaalsContact O-N 3.12Å; V165-A169 PolarHBondContact O-N 3.14Å
166V85Confident81.6Confident93 Ų9349.5 Ų49.556%0.56426%0.26SS*.Hα-helixtrans-61.6-52.3178.7173.50000112G164 T168 A169 Q170G164-V166 PolarHBondContact O-N 2.89Å; V166-T168 PolarHBondContact O-N 2.93Å; V166-A169 PolarHBondContact O-N 3.07Å; V166-Q170 WeakPolarHBondContact O-CG 3.4Å; V166-Q170 PolarHBondContact O-N 3.25Å
167P83.4Confident81.9Confident3 Ų350.8 Ų50.82%0.01928%0.278CS..Hα-helixtrans-54.5-36.4170.7-25.428.1000113.8G164 Q170 R171 V221 R225 M228 T244G164-P167 WeakPolarHBondContact O-CD 3.42Å; P167-Q170 PolarHBondContact O-N 3.12Å; P167-R171 WeakPolarHBondContact O-CB 3.48Å; P167-R171 PolarHBondContact O-N 3.3Å; P167-V221 HydrophobicContact CB-CG1 4.37Å; P167-V221 VanDerWaalsContact O-CG1 3.28Å; P167-V221 WeakPolarHBondContact O-CG1 3.31Å; P167-R225 HydrophobicContact CB-CB 3.75Å; P167-R225 HydrophobicContact CB-CG 4.06Å; P167-M228 HydrophobicContact CG-CE 4.41Å; P167-M228 HydrophobicContact CG-SD 3.72Å; P167-T244 WeakPolarHBondContact CG-OG1 3.47Å
168T82.4Confident82Confident11 Ų1151.4 Ų51.47%0.06728%0.276CS..Hα-helixtrans-65.7-44.7178.1-52.50000111.7G164 V165 V166 R171 A172 R225G164-T168 WeakPolarHBondContact O-CB 3.36Å; G164-T168 PolarHBondContact O-N 3.22Å; G164-T168 PolarHBondContact O-OG1 3.32Å; V165-T168 WeakPolarHBondContact O-CA 3.45Å; V165-T168 WeakPolarHBondContact O-CB 3.19Å; V165-T168 PolarHBondContact O-N 3.49Å; V165-T168 VanDerWaalsContact O-N 3.12Å; V166-T168 PolarHBondContact O-N 2.93Å; T168-R171 PolarHBondContact O-N 2.68Å; T168-A172 PolarHBondContact O-N 3.4Å; T168-A172 VanDerWaalsContact O-N 3.09Å; T168-R225 PolarHBondContact OG1-NE 2.91Å; T168-R225 PolarHBondContact OG1-NH2 3.11Å; T168-R225 VanDerWaalsContact OG1-NH2 3.09Å
169A83.8Confident82.1Confident28 Ų2850.9 Ų50.923%0.23127%0.268CS..Hα-helixtrans-65-42.8176.700000111.6V118 V165 V166 R171 A172 A173V118-A169 HydrophobicContact CG1-CB 4.25Å; V118-A169 HydrophobicContact CG2-CB 4.12Å; V165-A169 PolarHBondContact O-N 3.14Å; V166-A169 PolarHBondContact O-N 3.07Å; A169-R171 PolarHBondContact O-N 3.28Å; A169-A172 PolarHBondContact O-N 2.98Å; A169-A173 PolarHBondContact O-N 3.5Å
170Q85.3Confident82.2Confident74 Ų7444.5 Ų44.535%0.34625%0.25SC..Hα-helixtrans-61.8-43.5176.3-74177-36.900112.1V166 P167 A172 A173 I174 V221 T244V166-Q170 WeakPolarHBondContact O-CG 3.4Å; V166-Q170 PolarHBondContact O-N 3.25Å; P167-Q170 PolarHBondContact O-N 3.12Å; Q170-A172 VanDerWaalsContact C-N 3.33Å; Q170-A172 PolarHBondContact O-N 3.06Å; Q170-A173 PolarHBondContact O-N 3.21Å; Q170-I174 VanDerWaalsContact O-CG1 3.32Å; Q170-I174 WeakPolarHBondContact O-CG1 3.46Å; Q170-I174 PolarHBondContact O-N 2.82Å; Q170-V221 HydrophobicContact CB-CG1 4.3Å; Q170-T244 VanDerWaalsContact OE1-CG2 3.3Å; Q170-T244 PolarHBondContact OE1-OG1 2.87Å
171R84Confident82.5Confident92 Ų9247.3 Ų47.335%0.34727%0.268SS..Hα-helixtrans-56.7-47.8174-177.1-154.5-176.9-142.6-6.7111.1P167 T168 A169 A173 I174 V175 V221 D222P167-R171 WeakPolarHBondContact O-CB 3.48Å; P167-R171 PolarHBondContact O-N 3.3Å; T168-R171 PolarHBondContact O-N 2.68Å; A169-R171 PolarHBondContact O-N 3.28Å; R171-A173 VanDerWaalsContact C-N 3.31Å; R171-A173 PolarHBondContact O-N 2.87Å; R171-I174 PolarHBondContact O-N 3.45Å; R171-V175 HydrophobicContact CG-CG2 4.46Å; R171-V175 VanDerWaalsContact O-CG2 3.29Å; R171-V175 WeakPolarHBondContact O-CG2 2.84Å; R171-V175 PolarHBondContact O-N 3.36Å; R171-V221 HydrophobicContact CB-CG1 4Å; R171-D222 WeakPolarHBondContact CD-OD1 3.24Å; R171-D222 WeakPolarHBondContact CG-OD1 3.23Å; R171-D222 IonicContact CZ-OD1 3.75Å; R171-D222 IonicContact NE-OD1 2.89Å; R171-D222 PolarHBondContact NE-OD1 2.88Å; R171-D222 IonicContact NE-OD2 3.06Å; R171-D222 PolarHBondContact NE-OD2 2.83Å; R171-D222 IonicContact NH2-OD2 2.93Å
172A80.4Confident82.7Confident32 Ų3248.8 Ų48.826%0.26428%0.277SS..Hα-helixtrans-60-42.4178.600000111.8T168 A169 Q170 V176T168-A172 PolarHBondContact O-N 3.4Å; T168-A172 VanDerWaalsContact O-N 3.09Å; A169-A172 PolarHBondContact O-N 2.98Å; Q170-A172 VanDerWaalsContact C-N 3.33Å; Q170-A172 PolarHBondContact O-N 3.06Å; A172-V176 WeakPolarHBondContact O-CB 3.44Å; A172-V176 WeakPolarHBondContact O-CG2 3.34Å; A172-V176 PolarHBondContact O-N 2.94Å
173A81.5Confident82.7Confident57 Ų5745.7 Ų45.747%0.47127%0.266SS..Hα-helixtrans-63.8-41.5176.100000112.6A169 Q170 R171 G177A169-A173 PolarHBondContact O-N 3.5Å; Q170-A173 PolarHBondContact O-N 3.21Å; R171-A173 VanDerWaalsContact C-N 3.31Å; R171-A173 PolarHBondContact O-N 2.87Å; A173-G177 WeakPolarHBondContact O-CA 3.44Å; A173-G177 PolarHBondContact O-N 3Å
174I85.1Confident82.8Confident49 Ų4947.7 Ų47.725%0.25128%0.279SS..Hα-helixtrans-65.5-47.3177.7-69.5165.5000110.9Q170 R171 V176 G177 V178 A217 V221Q170-I174 VanDerWaalsContact O-CG1 3.32Å; Q170-I174 WeakPolarHBondContact O-CG1 3.46Å; Q170-I174 PolarHBondContact O-N 2.82Å; R171-I174 PolarHBondContact O-N 3.45Å; I174-V176 VanDerWaalsContact C-N 3.32Å; I174-V176 PolarHBondContact O-N 3.14Å; I174-G177 PolarHBondContact O-N 3.41Å; I174-V178 HydrophobicContact CG2-CG2 4.18Å; I174-V178 VanDerWaalsContact O-CB 3.29Å; I174-V178 WeakPolarHBondContact O-CB 3.14Å; I174-V178 VanDerWaalsContact O-CG2 3.3Å; I174-V178 WeakPolarHBondContact O-CG2 3.36Å; I174-V178 PolarHBondContact O-N 2.68Å; I174-A217 HydrophobicContact CG2-CB 3.64Å; I174-V221 HydrophobicContact CD1-CB 4.4Å; I174-V221 HydrophobicContact CD1-CG2 3.51Å
175V80.1Confident83.3Confident30 Ų3052.9 Ų52.918%0.18231%0.305CS..Hα-helixtrans-56.3-50.8178.5167.90000109.7R171 V178 E179R171-V175 HydrophobicContact CG-CG2 4.46Å; R171-V175 VanDerWaalsContact O-CG2 3.29Å; R171-V175 WeakPolarHBondContact O-CG2 2.84Å; R171-V175 PolarHBondContact O-N 3.36Å; V175-V178 PolarHBondContact O-N 3.32Å; V175-E179 HydrophobicContact CG1-CG 4.27Å; V175-E179 WeakPolarHBondContact CG1-OE2 3.37Å; V175-E179 WeakPolarHBondContact O-CB 3.36Å; V175-E179 VanDerWaalsContact O-CG 3.28Å; V175-E179 WeakPolarHBondContact O-CG 3.14Å; V175-E179 PolarHBondContact O-N 2.96Å
176V77.5Confident83.3Confident38 Ų3852.8 Ų52.823%0.2331%0.305CS..Hα-helixtrans-67.9-39.4-179169.70000112.4M110 V114 A172 I174 L180M110-V176 HydrophobicContact CE-CG1 3.14Å; M110-V176 HydrophobicContact CG-CG1 3.92Å; M110-V176 HydrophobicContact SD-CG1 4.24Å; V114-V176 HydrophobicContact CG2-CB 4.24Å; V114-V176 HydrophobicContact CG2-CG1 3.91Å; V114-V176 HydrophobicContact CG2-CG2 3.89Å; A172-V176 WeakPolarHBondContact O-CB 3.44Å; A172-V176 WeakPolarHBondContact O-CG2 3.34Å; A172-V176 PolarHBondContact O-N 2.94Å; I174-V176 VanDerWaalsContact C-N 3.32Å; I174-V176 PolarHBondContact O-N 3.14Å; V176-L180 HydrophobicContact CG1-CD1 4.33Å
177G80.5Confident83.3Confident45 Ų4550.5 Ų50.546%0.46429%0.287SS..Hα-helixtrans-75.3-18.9-179.600000114.7A173 I174 P181A173-G177 WeakPolarHBondContact O-CA 3.44Å; A173-G177 PolarHBondContact O-N 3Å; I174-G177 PolarHBondContact O-N 3.41Å; G177-P181 VanDerWaalsContact O-CD 3.27Å; G177-P181 WeakPolarHBondContact O-CD 3.32Å; G177-P181 VanDerWaalsContact O-CG 3.24Å; G177-P181 WeakPolarHBondContact O-CG 3.18Å
178V85.3Confident83.4Confident41 Ų4156.7 Ų56.725%0.24831%0.314CS..Hα-helixtrans-105.1-45.9179.4176.10000111.4I174 V175 L180 P181 V182 A213 A217I174-V178 HydrophobicContact CG2-CG2 4.18Å; I174-V178 VanDerWaalsContact O-CB 3.29Å; I174-V178 WeakPolarHBondContact O-CB 3.14Å; I174-V178 VanDerWaalsContact O-CG2 3.3Å; I174-V178 WeakPolarHBondContact O-CG2 3.36Å; I174-V178 PolarHBondContact O-N 2.68Å; V175-V178 PolarHBondContact O-N 3.32Å; V178-L180 PolarHBondContact O-N 2.88Å; V178-P181 WeakPolarHBondContact O-CD 3.38Å; V178-V182 HydrophobicContact CG1-CG2 4.02Å; V178-V182 VanDerWaalsContact O-CB 3.23Å; V178-V182 WeakPolarHBondContact O-CB 3.49Å; V178-V182 WeakPolarHBondContact O-CG2 3.2Å; V178-V182 PolarHBondContact O-N 2.91Å; V178-V182 VanDerWaalsContact O-N 3.07Å; V178-A213 HydrophobicContact CG1-CB 4.06Å; V178-A217 HydrophobicContact CB-CB 4.41Å; V178-A217 HydrophobicContact CG1-CB 4.22Å; V178-A217 HydrophobicContact CG2-CB 3.91Å
179E82.7Confident83.5Confident67 Ų6762.6 Ų62.631%0.31334%0.34SS..Hα-helixtrans-64.9-43.8-174.6-69.5-176.417200112.1V175 Y183 C210V175-E179 HydrophobicContact CG1-CG 4.27Å; V175-E179 WeakPolarHBondContact CG1-OE2 3.37Å; V175-E179 WeakPolarHBondContact O-CB 3.36Å; V175-E179 VanDerWaalsContact O-CG 3.28Å; V175-E179 WeakPolarHBondContact O-CG 3.14Å; V175-E179 PolarHBondContact O-N 2.96Å; E179-Y183 WeakPolarHBondContact O-CB 3.32Å; E179-Y183 PolarHBondContact O-N 3.24Å; E179-C210 WeakPolarHBondContact O-CB 3.24Å
180L81.5Confident83.5Confident80 Ų8062.4 Ų62.442%0.41934%0.335SS..Hα-helixtrans-67.5-50.1-177.8-62.5179.6000112.6M110 V176 V178 V182 Y183 D184M110-L180 HydrophobicContact CE-CD1 3.57Å; M110-L180 HydrophobicContact CG-CD1 4.01Å; M110-L180 HydrophobicContact SD-CD1 3.31Å; M110-L180 WeakPolarHBondContact SD-CD1 3.42Å; V176-L180 HydrophobicContact CG1-CD1 4.33Å; V178-L180 PolarHBondContact O-N 2.88Å; L180-V182 VanDerWaalsContact C-N 3.34Å; L180-V182 PolarHBondContact O-N 3.02Å; L180-Y183 PolarHBondContact O-N 2.84Å; L180-D184 PolarHBondContact O-N 2.72Å
181P85Confident83.3Confident60 Ų6062.4 Ų62.439%0.3934%0.337SS..Hα-helixtrans-64.4-38.9178-25.138.5000112.6G177 V178 Y183 D184 I185G177-P181 VanDerWaalsContact O-CD 3.27Å; G177-P181 WeakPolarHBondContact O-CD 3.32Å; G177-P181 VanDerWaalsContact O-CG 3.24Å; G177-P181 WeakPolarHBondContact O-CG 3.18Å; V178-P181 WeakPolarHBondContact O-CD 3.38Å; P181-Y183 VanDerWaalsContact C-N 3.33Å; P181-Y183 PolarHBondContact O-N 2.89Å; P181-D184 PolarHBondContact O-N 2.89Å; P181-I185 WeakPolarHBondContact O-CB 3.4Å; P181-I185 WeakPolarHBondContact O-CD1 3.18Å; P181-I185 WeakPolarHBondContact O-CG1 3.41Å; P181-I185 PolarHBondContact O-N 3.06Å
182V86.6Confident83.1Confident35 Ų3565.1 Ų65.121%0.21236%0.357CS..Hα-helixtrans-65.8-39178.3174.70000110.8V178 L180 T186 T209 C210 A213V178-V182 HydrophobicContact CG1-CG2 4.02Å; V178-V182 VanDerWaalsContact O-CB 3.23Å; V178-V182 WeakPolarHBondContact O-CB 3.49Å; V178-V182 WeakPolarHBondContact O-CG2 3.2Å; V178-V182 PolarHBondContact O-N 2.91Å; V178-V182 VanDerWaalsContact O-N 3.07Å; L180-V182 VanDerWaalsContact C-N 3.34Å; L180-V182 PolarHBondContact O-N 3.02Å; V182-T186 WeakPolarHBondContact O-CB 3.29Å; V182-T186 PolarHBondContact O-N 3.35Å; V182-T186 PolarHBondContact O-OG1 2.98Å; V182-T209 HydrophobicContact CG1-CG2 4.28Å; V182-C210 HydrophobicContact CB-CB 4.19Å; V182-C210 HydrophobicContact CG1-CB 4.02Å; V182-A213 HydrophobicContact CB-CB 4.34Å; V182-A213 HydrophobicContact CG1-CB 3.91Å; V182-A213 HydrophobicContact CG2-CB 3.97Å
183Y83.8Confident82.9Confident56 Ų5666.1 Ų66.122%0.2236%0.362CS..Hα-helixtrans-60.8-49.6174.2-179.2-93.1000111.4E179 L180 P181 I185 T186 K187 H203 S206E179-Y183 WeakPolarHBondContact O-CB 3.32Å; E179-Y183 PolarHBondContact O-N 3.24Å; L180-Y183 PolarHBondContact O-N 2.84Å; P181-Y183 VanDerWaalsContact C-N 3.33Å; P181-Y183 PolarHBondContact O-N 2.89Å; Y183-I185 PolarHBondContact O-N 2.93Å; Y183-T186 PolarHBondContact O-N 3.13Å; Y183-K187 HydrophobicContact CE1-CD 4.31Å; Y183-K187 VanDerWaalsContact O-CB 3.28Å; Y183-K187 WeakPolarHBondContact O-CB 3.4Å; Y183-K187 PolarHBondContact O-N 3.43Å; Y183-H203 PolarHBondContact OH-ND1 3.34Å; Y183-S206 VanDerWaalsContact CE2-OG 3.27Å; Y183-S206 WeakPolarHBondContact CE2-OG 3.26Å
184D83.7Confident82.2Confident81 Ų8166.5 Ų66.543%0.43337%0.372SS..Hα-helixtrans-64.7-42.5-178.8-77-13.2000112.6L180 P181 K188L180-D184 PolarHBondContact O-N 2.72Å; P181-D184 PolarHBondContact O-N 2.89Å; D184-K188 VanDerWaalsContact O-CB 3.32Å; D184-K188 WeakPolarHBondContact O-CB 3.15Å; D184-K188 VanDerWaalsContact O-CG 3.25Å; D184-K188 WeakPolarHBondContact O-CG 3.49Å; D184-K188 PolarHBondContact O-N 3.02Å
185I87.8Confident81.1Confident114 Ų11471.4 Ų71.459%0.58540%0.396SS*.Hα-helixtrans-63.9-47.8176.9-69.3165.6000109.9P181 Y183 K188 H189P181-I185 WeakPolarHBondContact O-CB 3.4Å; P181-I185 WeakPolarHBondContact O-CD1 3.18Å; P181-I185 WeakPolarHBondContact O-CG1 3.41Å; P181-I185 PolarHBondContact O-N 3.06Å; Y183-I185 PolarHBondContact O-N 2.93Å; I185-K188 PolarHBondContact O-N 3.27Å; I185-H189 VanDerWaalsContact O-CB 3.27Å; I185-H189 WeakPolarHBondContact O-CB 3.31Å; I185-H189 PolarHBondContact O-N 3.46Å
186T84.8Confident80Confident23 Ų2373.2 Ų73.214%0.14140%0.403CS..Hα-helixtrans-65.5-42.9-178.3-530000110.9V182 Y183 H189 L190 T209V182-T186 WeakPolarHBondContact O-CB 3.29Å; V182-T186 PolarHBondContact O-N 3.35Å; V182-T186 PolarHBondContact O-OG1 2.98Å; Y183-T186 PolarHBondContact O-N 3.13Å; T186-H189 PolarHBondContact O-N 3.24Å; T186-L190 HydrophobicContact CG2-CD1 3.67Å; T186-L190 VanDerWaalsContact O-CD1 3.3Å; T186-L190 WeakPolarHBondContact O-CD1 3.49Å; T186-L190 PolarHBondContact O-N 3.48Å; T186-T209 HydrophobicContact CG2-CG2 4.29Å
187K83.7Confident79.5Confident44 Ų4473.4 Ų73.419%0.19141%0.413CS..Hα-helixtrans-61.3-49.7176.1-176.7176.1179172.20111.1Y183 H189 L190 I191 D198Y183-K187 HydrophobicContact CE1-CD 4.31Å; Y183-K187 VanDerWaalsContact O-CB 3.28Å; Y183-K187 WeakPolarHBondContact O-CB 3.4Å; Y183-K187 PolarHBondContact O-N 3.43Å; K187-H189 VanDerWaalsContact C-N 3.31Å; K187-H189 PolarHBondContact O-N 2.95Å; K187-L190 PolarHBondContact O-N 3.42Å; K187-I191 HydrophobicContact CD-CD1 4.34Å; K187-I191 HydrophobicContact CG-CD1 3.77Å; K187-I191 WeakPolarHBondContact O-CG1 3.48Å; K187-I191 PolarHBondContact O-N 2.85Å; K187-D198 WeakPolarHBondContact CE-OD1 2.89Å; K187-D198 VanDerWaalsContact NZ-CG 3.32Å; K187-D198 IonicContact NZ-OD1 2.72Å; K187-D198 PolarHBondContact NZ-OD1 3.38Å; K187-D198 IonicContact NZ-OD2 3.49Å; K187-D198 PolarHBondContact NZ-OD2 3.28Å
188K85.2Confident79.1Confident134 Ų13476 Ų7658%0.58342%0.416SS*.Hα-helixtrans-59.9-42.7177.7-76.1174.5-177.7172.90111.5D184 I185 I191 L192D184-K188 VanDerWaalsContact O-CB 3.32Å; D184-K188 WeakPolarHBondContact O-CB 3.15Å; D184-K188 VanDerWaalsContact O-CG 3.25Å; D184-K188 WeakPolarHBondContact O-CG 3.49Å; D184-K188 PolarHBondContact O-N 3.02Å; I185-K188 PolarHBondContact O-N 3.27Å; K188-I191 PolarHBondContact O-N 2.89Å; K188-L192 VanDerWaalsContact O-CB 3.28Å; K188-L192 WeakPolarHBondContact O-CB 3.44Å; K188-L192 WeakPolarHBondContact O-CD1 3.29Å; K188-L192 WeakPolarHBondContact O-CG 2.75Å; K188-L192 PolarHBondContact O-N 3.43Å
189H85.8Confident78.8Confident134 Ų13477.8 Ų77.862%0.6243%0.427SS*.Hα-helixtrans-65.6-41.5-179.9-164.875.9000112.4I185 T186 K187 S193I185-H189 VanDerWaalsContact O-CB 3.27Å; I185-H189 WeakPolarHBondContact O-CB 3.31Å; I185-H189 PolarHBondContact O-N 3.46Å; T186-H189 PolarHBondContact O-N 3.24Å; K187-H189 VanDerWaalsContact C-N 3.31Å; K187-H189 PolarHBondContact O-N 2.95Å; H189-S193 VanDerWaalsContact O-CB 3.27Å; H189-S193 WeakPolarHBondContact O-CB 3.38Å; H189-S193 PolarHBondContact O-N 3.15Å; H189-S193 PolarHBondContact O-OG 2.93Å
190L82.4Confident78.7Confident25 Ų2581.8 Ų81.813%0.13145%0.449CS..Hα-helixtrans-66.7-38.3176.7-99.5100.9000113.4T186 K187 S193 M196 T202 V205T186-L190 HydrophobicContact CG2-CD1 3.67Å; T186-L190 VanDerWaalsContact O-CD1 3.3Å; T186-L190 WeakPolarHBondContact O-CD1 3.49Å; T186-L190 PolarHBondContact O-N 3.48Å; K187-L190 PolarHBondContact O-N 3.42Å; L190-S193 PolarHBondContact O-OG 2.97Å; L190-S193 VanDerWaalsContact O-OG 3.11Å; L190-M196 HydrophobicContact CD2-CB 4.37Å; L190-M196 HydrophobicContact CD2-SD 3.82Å; L190-T202 HydrophobicContact CB-CG2 3.91Å; L190-T202 HydrophobicContact CD2-CG2 4.12Å; L190-V205 HydrophobicContact CD1-CG1 4.02Å; L190-V205 HydrophobicContact CD2-CB 4.35Å; L190-V205 HydrophobicContact CD2-CG1 4.28Å
191I82.4Confident78.6Confident73 Ų7382.3 Ų82.337%0.37445%0.452SS..Hα-helixtrans-71.9-42.4179.5-66.6172000110.4K187 K188 G194 T202K187-I191 HydrophobicContact CD-CD1 4.34Å; K187-I191 HydrophobicContact CG-CD1 3.77Å; K187-I191 WeakPolarHBondContact O-CG1 3.48Å; K187-I191 PolarHBondContact O-N 2.85Å; K188-I191 PolarHBondContact O-N 2.89Å; I191-G194 PolarHBondContact O-N 3.31Å; I191-T202 HydrophobicContact CG1-CG2 4.39Å
192L79.4Confident78.5Confident149 Ų14979.4 Ų79.478%0.7843%0.433SS*.Hα-helixtrans-73.2-28.9-178.6-71.4170.6000113.4K188 G194K188-L192 VanDerWaalsContact O-CB 3.28Å; K188-L192 WeakPolarHBondContact O-CB 3.44Å; K188-L192 WeakPolarHBondContact O-CD1 3.29Å; K188-L192 WeakPolarHBondContact O-CG 2.75Å; K188-L192 PolarHBondContact O-N 3.43Å; L192-G194 PolarHBondContact O-N 3.11Å
193S75.6Confident78.3Confident53 Ų5380.9 Ų80.937%0.37144%0.437SS..THydrogen-bonded Turntrans-74.4-4.8176.860.60000113.4H189 L190 M195H189-S193 VanDerWaalsContact O-CB 3.27Å; H189-S193 WeakPolarHBondContact O-CB 3.38Å; H189-S193 PolarHBondContact O-N 3.15Å; H189-S193 PolarHBondContact O-OG 2.93Å; L190-S193 PolarHBondContact O-OG 2.97Å; L190-S193 VanDerWaalsContact O-OG 3.11Å; S193-M195 PolarHBondContact O-N 2.8Å
194G67.4Low78.3Confident66 Ų6684.8 Ų84.868%0.6846%0.456SS*.THydrogen-bonded Turntrans67.44.3177.400000114.4I191 L192I191-G194 PolarHBondContact O-N 3.31Å; L192-G194 PolarHBondContact O-N 3.11Å
195M61Low78.4Confident151 Ų15183.2 Ų83.274%0.74445%0.449SS*.SBendtrans-72.6-32.8-177.8-66.4-175.46900111.9S193S193-M195 PolarHBondContact O-N 2.8Å
196M58.3Low78.1Confident69 Ų6977.8 Ų77.834%0.3442%0.421SS..  trans-152135.3-178.9-62.5174179.500110.4L190 L201 T202L190-M196 HydrophobicContact CD2-CB 4.37Å; L190-M196 HydrophobicContact CD2-SD 3.82Å; M196-L201 HydrophobicContact CE-CD2 3.26Å; M196-L201 HydrophobicContact SD-CB 4.49Å; M196-L201 HydrophobicContact SD-CD2 3.18Å; M196-L201 WeakPolarHBondContact SD-CD2 3.49Å; M196-L201 HydrophobicContact SD-CG 4.41Å; M196-T202 VanDerWaalsContact CB-OG1 3.23Å; M196-T202 WeakPolarHBondContact CB-OG1 3.43Å
197G65.9Low78.1Confident42 Ų4279.6 Ų79.643%0.43344%0.435SS..  trans-71.1-165.5172.200000112.7T199 T202G197-T199 PolarHBondContact O-N 3.43Å; G197-T202 WeakPolarHBondContact O-CB 3.16Å; G197-T202 PolarHBondContact O-OG1 3.12Å
198D73.2Confident78.2Confident100 Ų10082 Ų8254%0.53545%0.446SS..SBendtrans-75.366.1171.2-14710.9000110.1K187 H203K187-D198 WeakPolarHBondContact CE-OD1 2.89Å; K187-D198 VanDerWaalsContact NZ-CG 3.32Å; K187-D198 IonicContact NZ-OD1 2.72Å; K187-D198 PolarHBondContact NZ-OD1 3.38Å; K187-D198 IonicContact NZ-OD2 3.49Å; K187-D198 PolarHBondContact NZ-OD2 3.28Å; D198-H203 IonicContact OD1-CD2 3.67Å; D198-H203 IonicContact OD1-CE1 3.12Å; D198-H203 IonicContact OD1-NE2 2.69Å; D198-H203 PolarHBondContact OD1-NE2 3.28Å; D198-H203 VanDerWaalsContact OD1-NE2 3.12Å
199T79.5Confident78.2Confident77 Ų7778.3 Ų78.347%0.47243%0.434SS..  trans-102.1159-176.7-47.90000109.7G197 L201 T202 H203G197-T199 PolarHBondContact O-N 3.43Å; T199-L201 PolarHBondContact O-N 3.19Å; T199-T202 WeakPolarHBondContact O-CB 3.33Å; T199-T202 PolarHBondContact O-N 3.07Å; T199-H203 PolarHBondContact O-N 3.33Å
200I79.8Confident78.1Confident152 Ų15272.6 Ų72.678%0.77941%0.409SS*.Hα-helixtrans-48.9-35.9174.2-60.5172000111.4H203 F204I200-H203 PolarHBondContact O-N 3.21Å; I200-F204 WeakPolarHBondContact O-CB 3.44Å; I200-F204 PolarHBondContact O-N 2.98Å
201L79.4Confident78.2Confident90 Ų9072.8 Ų72.847%0.47142%0.417SS..Hα-helixtrans-70.2-35.3-179.7-154.7140.1000112.9M196 T199 F204 V205M196-L201 HydrophobicContact CE-CD2 3.26Å; M196-L201 HydrophobicContact SD-CB 4.49Å; M196-L201 HydrophobicContact SD-CD2 3.18Å; M196-L201 WeakPolarHBondContact SD-CD2 3.49Å; M196-L201 HydrophobicContact SD-CG 4.41Å; T199-L201 PolarHBondContact O-N 3.19Å; L201-F204 WeakPolarHBondContact O-CB 3.3Å; L201-F204 PolarHBondContact O-N 3.23Å; L201-V205 HydrophobicContact CD2-CG2 3.95Å; L201-V205 VanDerWaalsContact O-CG2 3.31Å; L201-V205 WeakPolarHBondContact O-CG2 3.35Å; L201-V205 PolarHBondContact O-N 2.69Å
202T82Confident78.3Confident0 Ų071.9 Ų71.90%041%0.412CS..Hα-helixtrans-64.4-44.2172.6-57.10000111.1L190 I191 M196 G197 T199 F204 V205 S206L190-T202 HydrophobicContact CB-CG2 3.91Å; L190-T202 HydrophobicContact CD2-CG2 4.12Å; I191-T202 HydrophobicContact CG1-CG2 4.39Å; M196-T202 VanDerWaalsContact CB-OG1 3.23Å; M196-T202 WeakPolarHBondContact CB-OG1 3.43Å; G197-T202 WeakPolarHBondContact O-CB 3.16Å; G197-T202 PolarHBondContact O-OG1 3.12Å; T199-T202 WeakPolarHBondContact O-CB 3.33Å; T199-T202 PolarHBondContact O-N 3.07Å; T202-F204 VanDerWaalsContact C-N 3.31Å; T202-F204 PolarHBondContact O-N 3.18Å; T202-V205 PolarHBondContact O-N 3.48Å; T202-S206 VanDerWaalsContact O-CB 3.29Å; T202-S206 WeakPolarHBondContact O-CB 3.35Å; T202-S206 PolarHBondContact O-N 3.39Å; T202-S206 PolarHBondContact O-OG 3.38Å
203H82.8Confident78.6Confident65 Ų6566 Ų6630%0.30139%0.385SS..Hα-helixtrans-62.8-37.8173.3-75.5-70.6000112.3Y183 D198 T199 I200 S206 S207Y183-H203 PolarHBondContact OH-ND1 3.34Å; D198-H203 IonicContact OD1-CD2 3.67Å; D198-H203 IonicContact OD1-CE1 3.12Å; D198-H203 IonicContact OD1-NE2 2.69Å; D198-H203 PolarHBondContact OD1-NE2 3.28Å; D198-H203 VanDerWaalsContact OD1-NE2 3.12Å; T199-H203 PolarHBondContact O-N 3.33Å; I200-H203 PolarHBondContact O-N 3.21Å; H203-S206 WeakPolarHBondContact CA-OG 3.34Å; H203-S206 PolarHBondContact O-OG 3.44Å; H203-S206 VanDerWaalsContact O-OG 3.07Å; H203-S207 WeakPolarHBondContact O-CB 3.47Å; H203-S207 PolarHBondContact O-N 2.96Å; H203-S207 PolarHBondContact O-OG 3.46Å
204F84Confident79.1Confident139 Ų13963.4 Ų63.461%0.6137%0.367SS*.Hα-helixtrans-66.4-49.8176.5-176.2-96.6000112.2I200 L201 T202 S207 F208I200-F204 WeakPolarHBondContact O-CB 3.44Å; I200-F204 PolarHBondContact O-N 2.98Å; L201-F204 WeakPolarHBondContact O-CB 3.3Å; L201-F204 PolarHBondContact O-N 3.23Å; T202-F204 VanDerWaalsContact C-N 3.31Å; T202-F204 PolarHBondContact O-N 3.18Å; F204-S207 PolarHBondContact O-N 3.44Å; F204-F208 VanDerWaalsContact O-CB 3.28Å; F204-F208 WeakPolarHBondContact O-CB 3.26Å; F204-F208 PolarHBondContact O-N 2.69Å
205V84.9Confident79.8Confident48 Ų4860.9 Ų60.929%0.29134%0.34SS..Hα-helixtrans-65.4-42.5-179.5173.20000111.4L190 L201 T202 F208 T209L190-V205 HydrophobicContact CD1-CG1 4.02Å; L190-V205 HydrophobicContact CD2-CB 4.35Å; L190-V205 HydrophobicContact CD2-CG1 4.28Å; L201-V205 HydrophobicContact CD2-CG2 3.95Å; L201-V205 VanDerWaalsContact O-CG2 3.31Å; L201-V205 WeakPolarHBondContact O-CG2 3.35Å; L201-V205 PolarHBondContact O-N 2.69Å; T202-V205 PolarHBondContact O-N 3.48Å; V205-F208 PolarHBondContact O-N 2.76Å; V205-T209 WeakPolarHBondContact O-CB 3.27Å; V205-T209 PolarHBondContact O-N 2.82Å; V205-T209 PolarHBondContact O-OG1 3.47Å
206S82.8Confident81Confident0 Ų057.5 Ų57.50%032%0.324CS..Hα-helixtrans-64-43.6175.353.10000111.9Y183 T202 H203 F208 T209 C210Y183-S206 VanDerWaalsContact CE2-OG 3.27Å; Y183-S206 WeakPolarHBondContact CE2-OG 3.26Å; T202-S206 VanDerWaalsContact O-CB 3.29Å; T202-S206 WeakPolarHBondContact O-CB 3.35Å; T202-S206 PolarHBondContact O-N 3.39Å; T202-S206 PolarHBondContact O-OG 3.38Å; H203-S206 WeakPolarHBondContact CA-OG 3.34Å; H203-S206 PolarHBondContact O-OG 3.44Å; H203-S206 VanDerWaalsContact O-OG 3.07Å; S206-F208 VanDerWaalsContact C-N 3.35Å; S206-F208 PolarHBondContact O-N 3Å; S206-T209 PolarHBondContact O-N 3.49Å; S206-C210 WeakPolarHBondContact O-CB 3.39Å; S206-C210 PolarHBondContact O-N 3.01Å; S206-C210 PolarHBondContact O-SG 2.92Å
207S84.6Confident82.3Confident60 Ų6056 Ų5642%0.4232%0.323SS..Hα-helixtrans-64.6-38.1176-59.50000112.5H203 F204 C210 G211H203-S207 WeakPolarHBondContact O-CB 3.47Å; H203-S207 PolarHBondContact O-N 2.96Å; H203-S207 PolarHBondContact O-OG 3.46Å; F204-S207 PolarHBondContact O-N 3.44Å; S207-C210 VanDerWaalsContact CA-SG 3.59Å; S207-C210 PolarHBondContact O-SG 2.95Å; S207-G211 PolarHBondContact O-N 3.48Å
208F85.1Confident83.2Confident96 Ų9654.3 Ų54.342%0.42130%0.304SS..Hα-helixtrans-67.9-45.1178.1-174.1-99.4000111.6F204 V205 S206 G211 L212 W268F204-F208 VanDerWaalsContact O-CB 3.28Å; F204-F208 WeakPolarHBondContact O-CB 3.26Å; F204-F208 PolarHBondContact O-N 2.69Å; V205-F208 PolarHBondContact O-N 2.76Å; S206-F208 VanDerWaalsContact C-N 3.35Å; S206-F208 PolarHBondContact O-N 3Å; F208-G211 PolarHBondContact O-N 3.41Å; F208-L212 HydrophobicContact CD1-CD1 3.73Å; F208-L212 HydrophobicContact CE1-CD1 3.24Å; F208-L212 HydrophobicContact CE1-CG 4.33Å; F208-L212 HydrophobicContact CZ-CD1 3.73Å; F208-L212 HydrophobicContact CZ-CG 4.49Å; F208-L212 PolarHBondContact O-N 3.02Å; F208-W268 AromaticContact CE2-CZ2 3.87Å; F208-W268 HydrophobicContact CE2-CZ2 3.87Å; F208-W268 HydrophobicContact CZ-CH2 4.47Å; F208-W268 AromaticContact CZ-CZ2 3.98Å; F208-W268 HydrophobicContact CZ-CZ2 3.98Å
209T85.9Confident83.8Confident55 Ų5549.6 Ų49.634%0.33728%0.279SS..Hα-helixtrans-65.7-43.8179.2-52.80000111.2V182 T186 V205 S206 L212 A213V182-T209 HydrophobicContact CG1-CG2 4.28Å; T186-T209 HydrophobicContact CG2-CG2 4.29Å; V205-T209 WeakPolarHBondContact O-CB 3.27Å; V205-T209 PolarHBondContact O-N 2.82Å; V205-T209 PolarHBondContact O-OG1 3.47Å; S206-T209 PolarHBondContact O-N 3.49Å; T209-L212 PolarHBondContact O-N 2.75Å; T209-A213 WeakPolarHBondContact O-CB 3.34Å; T209-A213 PolarHBondContact O-N 3.47Å
210C84.2Confident84.1Confident15 Ų1546.9 Ų46.910%0.10126%0.263CS..Hα-helixtrans-66.9-40.2177.2800000111.9E179 V182 S206 S207 L212 A213 G214E179-C210 WeakPolarHBondContact O-CB 3.24Å; V182-C210 HydrophobicContact CB-CB 4.19Å; V182-C210 HydrophobicContact CG1-CB 4.02Å; S206-C210 WeakPolarHBondContact O-CB 3.39Å; S206-C210 PolarHBondContact O-N 3.01Å; S206-C210 PolarHBondContact O-SG 2.92Å; S207-C210 VanDerWaalsContact CA-SG 3.59Å; S207-C210 PolarHBondContact O-SG 2.95Å; C210-L212 PolarHBondContact O-N 2.97Å; C210-A213 PolarHBondContact O-N 3.43Å; C210-G214 PolarHBondContact O-N 3.35Å
211G83.3Confident84.4Confident28 Ų2840.1 Ų40.129%0.28923%0.229SC..Hα-helixtrans-63.5-38.9176.100000113S207 F208 A215S207-G211 PolarHBondContact O-N 3.48Å; F208-G211 PolarHBondContact O-N 3.41Å; G211-A215 VanDerWaalsContact O-CB 3.26Å; G211-A215 WeakPolarHBondContact O-CB 3.12Å; G211-A215 PolarHBondContact O-N 3.48Å
212L85.5Confident84.6Confident54 Ų5436.2 Ų36.228%0.28321%0.208SC..Hα-helixtrans-65.1-47.5173.1-88.7166.5000112F208 T209 C210 A215 L216F208-L212 HydrophobicContact CD1-CD1 3.73Å; F208-L212 HydrophobicContact CE1-CD1 3.24Å; F208-L212 HydrophobicContact CE1-CG 4.33Å; F208-L212 HydrophobicContact CZ-CD1 3.73Å; F208-L212 HydrophobicContact CZ-CG 4.49Å; F208-L212 PolarHBondContact O-N 3.02Å; T209-L212 PolarHBondContact O-N 2.75Å; C210-L212 PolarHBondContact O-N 2.97Å; L212-A215 PolarHBondContact O-N 2.93Å; L212-L216 WeakPolarHBondContact O-CB 3.37Å; L212-L216 VanDerWaalsContact O-CG 3.31Å; L212-L216 WeakPolarHBondContact O-CG 3.26Å; L212-L216 PolarHBondContact O-N 3.19Å
213A86.3Confident84.5Confident25 Ų2536.2 Ų36.221%0.20721%0.209CC..Hα-helixtrans-62.5-44.2178.600000111.8V178 V182 T209 C210 L216 A217V178-A213 HydrophobicContact CG1-CB 4.06Å; V182-A213 HydrophobicContact CB-CB 4.34Å; V182-A213 HydrophobicContact CG1-CB 3.91Å; V182-A213 HydrophobicContact CG2-CB 3.97Å; T209-A213 WeakPolarHBondContact O-CB 3.34Å; T209-A213 PolarHBondContact O-N 3.47Å; C210-A213 PolarHBondContact O-N 3.43Å; A213-L216 PolarHBondContact O-N 2.89Å; A213-A217 WeakPolarHBondContact O-CB 3.38Å; A213-A217 PolarHBondContact O-N 3.13Å
214G84.8Confident84.6Confident0 Ų033.2 Ų33.20%019%0.194CC..Hα-helixtrans-61.1-44.2175.400000112.2C210 A217 S218C210-G214 PolarHBondContact O-N 3.35Å; G214-A217 PolarHBondContact O-N 3.41Å; G214-S218 VanDerWaalsContact O-CB 3.27Å; G214-S218 WeakPolarHBondContact O-CB 3.32Å; G214-S218 PolarHBondContact O-N 3.38Å; G214-S218 PolarHBondContact O-OG 2.94Å
215A82.1Confident84.6Confident13 Ų1328.1 Ų28.111%0.10717%0.171CC..Hα-helixtrans-63.3-46.7175.700000111.6G211 L212 A217 S218 N219 F264G211-A215 VanDerWaalsContact O-CB 3.26Å; G211-A215 WeakPolarHBondContact O-CB 3.12Å; G211-A215 PolarHBondContact O-N 3.48Å; L212-A215 PolarHBondContact O-N 2.93Å; A215-A217 VanDerWaalsContact C-N 3.32Å; A215-A217 PolarHBondContact O-N 2.88Å; A215-S218 PolarHBondContact O-N 3.47Å; A215-S218 PolarHBondContact O-OG 3.47Å; A215-N219 WeakPolarHBondContact O-CB 3.45Å; A215-N219 PolarHBondContact O-N 2.96Å; A215-N219 PolarHBondContact O-ND2 3Å; A215-N219 PolarHBondContact O-OD1 3.47Å; A215-F264 HydrophobicContact CB-CE2 3.95Å
216L86.3Confident84.3Confident79 Ų7926.3 Ų26.341%0.41416%0.16SC..Hα-helixtrans-59.8-41178.2-74172.2000112.6L212 A213 Y261 F264L212-L216 WeakPolarHBondContact O-CB 3.37Å; L212-L216 VanDerWaalsContact O-CG 3.31Å; L212-L216 WeakPolarHBondContact O-CG 3.26Å; L212-L216 PolarHBondContact O-N 3.19Å; A213-L216 PolarHBondContact O-N 2.89Å; L216-Y261 HydrophobicContact CD2-CE1 4.15Å; L216-F264 HydrophobicContact CD2-CZ 4.27Å
217A86.4Confident84.1Confident37 Ų3726.3 Ų26.331%0.30616%0.16SC..Hα-helixtrans-73.9-35.6179.300000112.9I174 V178 A213 G214 A215I174-A217 HydrophobicContact CG2-CB 3.64Å; V178-A217 HydrophobicContact CB-CB 4.41Å; V178-A217 HydrophobicContact CG1-CB 4.22Å; V178-A217 HydrophobicContact CG2-CB 3.91Å; A213-A217 WeakPolarHBondContact O-CB 3.38Å; A213-A217 PolarHBondContact O-N 3.13Å; G214-A217 PolarHBondContact O-N 3.41Å; A215-A217 VanDerWaalsContact C-N 3.32Å; A215-A217 PolarHBondContact O-N 2.88Å
218S85Confident83.9Confident7 Ų724.4 Ų24.45%0.04915%0.145CC..Hα-helixtrans-87.1-22.5-176.260.40000114.4G214 A215 V221 D222G214-S218 VanDerWaalsContact O-CB 3.27Å; G214-S218 WeakPolarHBondContact O-CB 3.32Å; G214-S218 PolarHBondContact O-N 3.38Å; G214-S218 PolarHBondContact O-OG 2.94Å; A215-S218 PolarHBondContact O-N 3.47Å; A215-S218 PolarHBondContact O-OG 3.47Å; S218-V221 PolarHBondContact O-N 3.37Å; S218-V221 VanDerWaalsContact O-N 3.15Å; S218-D222 PolarHBondContact O-N 3.47Å
219N84.7Confident83.5Confident2 Ų219.8 Ų19.81%0.01113%0.125CC..Hα-helixtrans-54-45.7-178.1-77.8-41.5000114.9A215 V221 D222 V223 Y261 F264A215-N219 WeakPolarHBondContact O-CB 3.45Å; A215-N219 PolarHBondContact O-N 2.96Å; A215-N219 PolarHBondContact O-ND2 3Å; A215-N219 PolarHBondContact O-OD1 3.47Å; N219-V221 VanDerWaalsContact C-N 3.25Å; N219-V221 PolarHBondContact O-N 3.36Å; N219-D222 WeakPolarHBondContact O-CB 3.26Å; N219-D222 PolarHBondContact O-N 3.45Å; N219-D222 VanDerWaalsContact O-N 3.08Å; N219-V223 WeakPolarHBondContact O-CG2 3.47Å; N219-V223 PolarHBondContact O-N 3.32Å; N219-Y261 HydrophobicContact CB-CD1 4.29Å; N219-Y261 HydrophobicContact CB-CE1 4.45Å; N219-F264 WeakPolarHBondContact ND2-CD2 3.43Å; N219-F264 VanDerWaalsContact ND2-CE2 3.29Å; N219-F264 WeakPolarHBondContact ND2-CE2 3.34Å
220P85.5Confident83.1Confident20 Ų2017.4 Ų17.413%0.1311%0.11CC..Hα-helixtrans-59.2-41.4-179.6-24.535.5000111.3V223 V224 L260P220-V223 PolarHBondContact O-N 2.97Å; P220-V224 WeakPolarHBondContact O-CG2 3.5Å; P220-V224 PolarHBondContact O-N 2.71Å; P220-L260 HydrophobicContact CB-CB 4.26Å; P220-L260 HydrophobicContact CB-CD2 4.42Å
221V86.2Confident82.5Confident9 Ų917 Ų176%0.05511%0.107CC..Hα-helixtrans-68.5-36.7177-178.40000111.2P167 Q170 R171 I174 S218 N219 V224 R225 T244P167-V221 HydrophobicContact CB-CG1 4.37Å; P167-V221 VanDerWaalsContact O-CG1 3.28Å; P167-V221 WeakPolarHBondContact O-CG1 3.31Å; Q170-V221 HydrophobicContact CB-CG1 4.3Å; R171-V221 HydrophobicContact CB-CG1 4Å; I174-V221 HydrophobicContact CD1-CB 4.4Å; I174-V221 HydrophobicContact CD1-CG2 3.51Å; S218-V221 PolarHBondContact O-N 3.37Å; S218-V221 VanDerWaalsContact O-N 3.15Å; N219-V221 VanDerWaalsContact C-N 3.25Å; N219-V221 PolarHBondContact O-N 3.36Å; V221-V224 PolarHBondContact O-N 2.82Å; V221-R225 WeakPolarHBondContact O-CB 3.4Å; V221-R225 PolarHBondContact O-N 3.37Å; V221-T244 HydrophobicContact CG1-CG2 4.27Å; V221-T244 HydrophobicContact CG2-CG2 4.43Å
222D83.5Confident81.5Confident8 Ų817.7 Ų17.74%0.04310%0.101CC..Hα-helixtrans-61.9-43.5174.9-80.1-13000112.3R171 S218 N219 R225 T226R171-D222 WeakPolarHBondContact CD-OD1 3.24Å; R171-D222 WeakPolarHBondContact CG-OD1 3.23Å; R171-D222 IonicContact CZ-OD1 3.75Å; R171-D222 IonicContact NE-OD1 2.89Å; R171-D222 PolarHBondContact NE-OD1 2.88Å; R171-D222 IonicContact NE-OD2 3.06Å; R171-D222 PolarHBondContact NE-OD2 2.83Å; R171-D222 IonicContact NH2-OD2 2.93Å; S218-D222 PolarHBondContact O-N 3.47Å; N219-D222 WeakPolarHBondContact O-CB 3.26Å; N219-D222 PolarHBondContact O-N 3.45Å; N219-D222 VanDerWaalsContact O-N 3.08Å; D222-R225 PolarHBondContact O-N 3.09Å; D222-T226 WeakPolarHBondContact O-CG2 3.35Å; D222-T226 PolarHBondContact O-N 3.03Å; D222-T226 PolarHBondContact O-OG1 3.44Å
223V80.8Confident80Confident1 Ų116.2 Ų16.21%0.00610%0.096CC..Hα-helixtrans-67.3-44.4177.4177.90000110.7N219 P220 R225 T226 R227 M251 L260 K262N219-V223 WeakPolarHBondContact O-CG2 3.47Å; N219-V223 PolarHBondContact O-N 3.32Å; P220-V223 PolarHBondContact O-N 2.97Å; V223-R225 VanDerWaalsContact C-N 3.32Å; V223-R225 PolarHBondContact O-N 2.87Å; V223-T226 PolarHBondContact O-N 3.33Å; V223-T226 PolarHBondContact O-OG1 3.37Å; V223-T226 VanDerWaalsContact O-OG1 3.08Å; V223-R227 WeakPolarHBondContact O-CG 3.49Å; V223-R227 PolarHBondContact O-N 2.85Å; V223-R227 VanDerWaalsContact O-N 3.14Å; V223-M251 HydrophobicContact CG1-CE 4.3Å; V223-M251 HydrophobicContact CG1-SD 3.86Å; V223-L260 VanDerWaalsContact CG2-O 3.29Å; V223-L260 WeakPolarHBondContact CG2-O 3.06Å; V223-K262 WeakPolarHBondContact CG2-O 3.28Å
224V84.3Confident78.3Confident1 Ų119.8 Ų19.81%0.00611%0.111CC..Hα-helixtrans-60.6-45.5176-176.90000110.6P220 V221 T226 R227 M228 T244 I248 M251P220-V224 WeakPolarHBondContact O-CG2 3.5Å; P220-V224 PolarHBondContact O-N 2.71Å; V221-V224 PolarHBondContact O-N 2.82Å; V224-T226 PolarHBondContact O-N 3.21Å; V224-R227 PolarHBondContact O-N 2.93Å; V224-M228 HydrophobicContact CG1-CG 3.96Å; V224-M228 HydrophobicContact CG1-SD 3.68Å; V224-M228 WeakPolarHBondContact O-CB 2.9Å; V224-M228 VanDerWaalsContact O-CG 3.31Å; V224-M228 WeakPolarHBondContact O-CG 3.49Å; V224-M228 PolarHBondContact O-N 3.42Å; V224-T244 HydrophobicContact CB-CG2 4.29Å; V224-T244 HydrophobicContact CG1-CG2 4.12Å; V224-T244 HydrophobicContact CG2-CG2 4.41Å; V224-I248 HydrophobicContact CG2-CB 4.49Å; V224-I248 HydrophobicContact CG2-CD1 4.34Å; V224-I248 HydrophobicContact CG2-CG1 3.41Å; V224-I248 VanDerWaalsContact CG2-CG1 3.41Å; V224-M251 HydrophobicContact CB-CE 3.96Å; V224-M251 HydrophobicContact CG2-CE 3.14Å
225R84.1Confident76.3Confident32 Ų3226.1 Ų26.112%0.12115%0.149CC..Hα-helixtrans-55.7-51.6179.5178.5-172.1-171.2-116.4-1.2111D128 P167 T168 V221 D222 V223 R227 M228 M229D128-R225 IonicContact OD2-CZ 2.92Å; D128-R225 IonicContact OD2-NH2 2.91Å; D128-R225 PolarHBondContact OD2-NH2 3.19Å; P167-R225 HydrophobicContact CB-CB 3.75Å; P167-R225 HydrophobicContact CB-CG 4.06Å; T168-R225 PolarHBondContact OG1-NE 2.91Å; T168-R225 PolarHBondContact OG1-NH2 3.11Å; T168-R225 VanDerWaalsContact OG1-NH2 3.09Å; V221-R225 WeakPolarHBondContact O-CB 3.4Å; V221-R225 PolarHBondContact O-N 3.37Å; D222-R225 PolarHBondContact O-N 3.09Å; V223-R225 VanDerWaalsContact C-N 3.32Å; V223-R225 PolarHBondContact O-N 2.87Å; R225-R227 VanDerWaalsContact C-N 3.3Å; R225-R227 PolarHBondContact O-N 3.01Å; R225-M228 PolarHBondContact O-N 3.26Å; R225-M229 HydrophobicContact CG-CE 3.94Å; R225-M229 HydrophobicContact CG-CG 4.49Å; R225-M229 HydrophobicContact CG-SD 3.85Å; R225-M229 WeakPolarHBondContact O-CB 3.22Å; R225-M229 VanDerWaalsContact O-CG 3.26Å; R225-M229 WeakPolarHBondContact O-CG 3.36Å; R225-M229 PolarHBondContact O-N 3.25Å
226T79.8Confident74.5Confident10 Ų1029.1 Ų29.16%0.06118%0.181CC..Hα-helixtrans-64.8-36.3-178.153.50000112Q34 I132 D222 V223 V224 N230Q34-T226 PolarHBondContact OE1-OG1 3.01Å; I132-T226 HydrophobicContact CD1-CG2 4.12Å; D222-T226 WeakPolarHBondContact O-CG2 3.35Å; D222-T226 PolarHBondContact O-N 3.03Å; D222-T226 PolarHBondContact O-OG1 3.44Å; V223-T226 PolarHBondContact O-N 3.33Å; V223-T226 PolarHBondContact O-OG1 3.37Å; V223-T226 VanDerWaalsContact O-OG1 3.08Å; V224-T226 PolarHBondContact O-N 3.21Å; T226-N230 VanDerWaalsContact O-CB 3.27Å; T226-N230 WeakPolarHBondContact O-CB 3.41Å; T226-N230 PolarHBondContact O-N 3.35Å
227R78.9Confident72.7Confident1 Ų132.4 Ų32.40%0.00419%0.194CC..Hα-helixtrans-69.8-42.2175.8-64-176169.6-156.5-3.9113.1Q34 Q38 V223 V224 R225 N230 Q231 Y241 M251 E255Q34-R227 PolarHBondContact O-NE 3.15Å; Q34-R227 VanDerWaalsContact O-NE 3.15Å; Q38-R227 VanDerWaalsContact NE2-CG 3.29Å; V223-R227 WeakPolarHBondContact O-CG 3.49Å; V223-R227 PolarHBondContact O-N 2.85Å; V223-R227 VanDerWaalsContact O-N 3.14Å; V224-R227 PolarHBondContact O-N 2.93Å; R225-R227 VanDerWaalsContact C-N 3.3Å; R225-R227 PolarHBondContact O-N 3.01Å; R227-N230 PolarHBondContact O-N 3Å; R227-Q231 PolarHBondContact O-N 2.91Å; R227-Y241 HydrophobicContact CB-CE2 4.22Å; R227-M251 WeakPolarHBondContact CD-SD 3.05Å; R227-M251 VanDerWaalsContact CZ-SD 3.56Å; R227-M251 VanDerWaalsContact NH1-CG 3.3Å; R227-M251 PolarHBondContact NH1-SD 2.74Å; R227-E255 IonicContact CZ-OE1 3.11Å; R227-E255 IonicContact CZ-OE2 3.57Å; R227-E255 IonicContact NH1-OE1 3.19Å; R227-E255 PolarHBondContact NH1-OE1 2.94Å; R227-E255 IonicContact NH1-OE2 2.69Å; R227-E255 PolarHBondContact NH1-OE2 2.92Å; R227-E255 IonicContact NH2-OE1 3.88Å; R227-E255 IonicContact NH2-OE2 2.69Å; R227-E255 PolarHBondContact NH2-OE2 3.4Å
228M79.8Confident71.2Confident19 Ų1935.8 Ų35.89%0.09421%0.211CC..Hα-helixtrans-64.3-38.7175.1-73.9-175.273.500112.2P167 V224 R225 Y241P167-M228 HydrophobicContact CG-CE 4.41Å; P167-M228 HydrophobicContact CG-SD 3.72Å; V224-M228 HydrophobicContact CG1-CG 3.96Å; V224-M228 HydrophobicContact CG1-SD 3.68Å; V224-M228 WeakPolarHBondContact O-CB 2.9Å; V224-M228 VanDerWaalsContact O-CG 3.31Å; V224-M228 WeakPolarHBondContact O-CG 3.49Å; V224-M228 PolarHBondContact O-N 3.42Å; R225-M228 PolarHBondContact O-N 3.26Å; M228-Y241 HydrophobicContact CG-CD2 4.49Å; M228-Y241 HydrophobicContact CG-CG 4.26Å
229M77.2Confident70Confident0 Ų038.7 Ų38.70%023%0.225CC..Hα-helixtrans-69.8-35.6176.2-72.9178.3163.400112.3N125 D128 V129 I132 R133 R225N125-M229 VanDerWaalsContact OD1-CE 3.22Å; N125-M229 WeakPolarHBondContact OD1-CE 3.39Å; D128-M229 HydrophobicContact CB-CE 4.26Å; D128-M229 HydrophobicContact CB-SD 4.45Å; V129-M229 HydrophobicContact CG2-CB 4.46Å; V129-M229 HydrophobicContact CG2-CG 4.2Å; I132-M229 HydrophobicContact CB-CB 4.4Å; I132-M229 HydrophobicContact CG1-SD 4.39Å; I132-M229 HydrophobicContact CG2-CB 4.17Å; R133-M229 PolarHBondContact NE-O 3.34Å; R225-M229 HydrophobicContact CG-CE 3.94Å; R225-M229 HydrophobicContact CG-CG 4.49Å; R225-M229 HydrophobicContact CG-SD 3.85Å; R225-M229 WeakPolarHBondContact O-CB 3.22Å; R225-M229 VanDerWaalsContact O-CG 3.26Å; R225-M229 WeakPolarHBondContact O-CG 3.36Å; R225-M229 PolarHBondContact O-N 3.25Å
230N77.2Confident69.1Low4 Ų440.5 Ų40.52%0.02124%0.235CC..Hα-helixtrans-76.7-26177.2-171.959.6000113.6V35 F44 I132 A136 T226 R227 R232V35-N230 WeakPolarHBondContact CG1-ND2 3.39Å; V35-N230 HydrophobicContact CG2-CB 4.02Å; F44-N230 WeakPolarHBondContact CE2-ND2 3.44Å; I132-N230 HydrophobicContact CG2-CB 4Å; A136-N230 WeakPolarHBondContact CB-OD1 3.21Å; T226-N230 VanDerWaalsContact O-CB 3.27Å; T226-N230 WeakPolarHBondContact O-CB 3.41Å; T226-N230 PolarHBondContact O-N 3.35Å; R227-N230 PolarHBondContact O-N 3Å; N230-R232 PolarHBondContact O-N 3.41Å
231Q71.8Confident68.2Low7 Ų740 Ų403%0.03323%0.23CC..  trans-58.2122.7179.3-176-166.3-42.900110.2R133 R163 R227 D239 L240R133-Q231 PolarHBondContact NH2-O 2.98Å; R163-Q231 PolarHBondContact NH1-O 3.49Å; R227-Q231 PolarHBondContact O-N 2.91Å; Q231-D239 VanDerWaalsContact NE2-CA 3.34Å; Q231-D239 PolarHBondContact NE2-OD1 2.93Å; Q231-L240 HydrophobicContact CG-CB 4.19Å
232R61.8Low67.4Low43 Ų4347 Ų4716%0.16226%0.26CS..  trans-86.1135.5169-68.7-173.2175.1-153.6-7.5110.3Q137 E156 N230 I234Q137-R232 VanDerWaalsContact NE2-NE 3.1Å; E156-R232 WeakPolarHBondContact OE1-CA 3.24Å; E156-R232 WeakPolarHBondContact OE1-CB 3.39Å; N230-R232 PolarHBondContact O-N 3.41Å; R232-I234 PolarHBondContact O-N 2.94Å
233A54Low67.2Low22 Ų2247.7 Ų47.718%0.18227%0.269CS..  trans-75.1106.616700000106.7E156E156-A233 HydrophobicContact CB-CB 4.25Å; E156-A233 HydrophobicContact CG-CB 3.7Å; E156-A233 PolarHBondContact OE1-N 3.13Å; E156-A233 VanDerWaalsContact OE1-N 3.08Å
234I50.7Low67.2Low101 Ų10148 Ų4852%0.51827%0.272SS..  trans-83.9125.3168.9-59.8172.6000106R232 G236 H237R232-I234 PolarHBondContact O-N 2.94Å; I234-G236 PolarHBondContact O-N 3.38Å; I234-G236 VanDerWaalsContact O-N 3.11Å; I234-H237 PolarHBondContact O-N 3.3Å
235V41.5Very low67.1Low132 Ų13252.6 Ų52.680%0.830%0.299SS*.THydrogen-bonded Turntrans-50.5118.6177.8179.10000109.1
236G44.9Very low67.1Low76 Ų7653.2 Ų53.278%0.78431%0.305SS*.THydrogen-bonded Turntrans94.54.9178.900000116.6I234I234-G236 PolarHBondContact O-N 3.38Å; I234-G236 VanDerWaalsContact O-N 3.11Å
237H48.3Very low67.1Low148 Ų14852.7 Ų52.769%0.68530%0.302SS*.SBendtrans-117.3139.4169.7-84.831.9000112I234I234-H237 PolarHBondContact O-N 3.3Å
238V54.8Low67.3Low109 Ų10954.8 Ų54.866%0.66131%0.313SS*.  trans-59.2138.8175.5-178.10000109.1L240V238-L240 PolarHBondContact O-N 2.8Å; V238-L240 VanDerWaalsContact O-N 3.1Å
239D61Low67.4Low67 Ų6758.6 Ų58.636%0.35833%0.333SS..  trans-46.8120.8173-75.8-39.6000110.7R163 Q231 Y241R163-D239 IonicContact CZ-OD1 3.61Å; R163-D239 IonicContact NH2-OD1 3.43Å; R163-D239 PolarHBondContact NH2-OD1 2.91Å; Q231-D239 VanDerWaalsContact NE2-CA 3.34Å; Q231-D239 PolarHBondContact NE2-OD1 2.93Å; D239-Y241 PolarHBondContact O-N 2.94Å
240L64Low67.6Low41 Ų4161.2 Ų61.222%0.21534%0.344CS..SBendtrans-54.9-39.9178.3-92.176.1000110.8I40 D41 Q231 V238 K250I40-L240 HydrophobicContact CB-CD2 3.57Å; I40-L240 HydrophobicContact CB-CG 4.29Å; I40-L240 HydrophobicContact CG2-CB 4.36Å; I40-L240 HydrophobicContact CG2-CD2 3.29Å; I40-L240 HydrophobicContact CG2-CG 3.47Å; I40-L240 VanDerWaalsContact CG2-CG 3.47Å; D41-L240 HydrophobicContact CB-CD2 4.39Å; Q231-L240 HydrophobicContact CG-CB 4.19Å; V238-L240 PolarHBondContact O-N 2.8Å; V238-L240 VanDerWaalsContact O-N 3.1Å; L240-K250 PolarHBondContact O-NZ 3.47Å
241Y66.5Low67.8Low8 Ų861 Ų613%0.03134%0.343CS..  trans-123.8111.3178.3-60.3-67.8000110.3I40 R227 M228 D239 G247 K250I40-Y241 HydrophobicContact CD1-CE1 4.21Å; R227-Y241 HydrophobicContact CB-CE2 4.22Å; M228-Y241 HydrophobicContact CG-CD2 4.49Å; M228-Y241 HydrophobicContact CG-CG 4.26Å; D239-Y241 PolarHBondContact O-N 2.94Å; Y241-G247 VanDerWaalsContact CD1-CA 3.44Å; Y241-K250 HydrophobicContact CD1-CD 4.32Å; Y241-K250 HydrophobicContact CE1-CB 4.24Å; Y241-K250 HydrophobicContact CE1-CD 4.45Å
242K71Confident68.3Low156 Ų15667.8 Ų67.868%0.67837%0.368SS*.SBendtrans-82-18.8179.4-67.3-175.7177.7-178.50113.1D246K242-D246 PolarHBondContact N-OD2 2.73Å
243G79.2Confident69.2Low23 Ų2374.2 Ų74.224%0.23740%0.398CS..SBendtrans-176.5175.9-179.400000112.3V245 D246 G247G243-V245 PolarHBondContact O-N 3.28Å; G243-D246 PolarHBondContact O-N 3.03Å; G243-G247 PolarHBondContact O-N 3.01Å
244T79.8Confident70.3Confident9 Ų978.7 Ų78.76%0.05542%0.415CS..Hα-helixtrans-61.3-45.2-175.3-43.30000112.2P167 Q170 V221 V224 G247 I248P167-T244 WeakPolarHBondContact CG-OG1 3.47Å; Q170-T244 VanDerWaalsContact OE1-CG2 3.3Å; Q170-T244 PolarHBondContact OE1-OG1 2.87Å; V221-T244 HydrophobicContact CG1-CG2 4.27Å; V221-T244 HydrophobicContact CG2-CG2 4.43Å; V224-T244 HydrophobicContact CB-CG2 4.29Å; V224-T244 HydrophobicContact CG1-CG2 4.12Å; V224-T244 HydrophobicContact CG2-CG2 4.41Å; T244-G247 PolarHBondContact O-N 3.02Å; T244-I248 HydrophobicContact CG2-CD1 4.33Å; T244-I248 WeakPolarHBondContact O-CG1 3.37Å; T244-I248 PolarHBondContact O-N 3.43Å
245V82.9Confident71.5Confident97 Ų9775.6 Ų75.659%0.58840%0.398SS*.Hα-helixtrans-66.6-43.7-179-178.90000111.3G243 G247 I248 L249G243-V245 PolarHBondContact O-N 3.28Å; V245-G247 VanDerWaalsContact C-N 3.29Å; V245-G247 PolarHBondContact O-N 3.41Å; V245-I248 PolarHBondContact O-N 2.97Å; V245-L249 HydrophobicContact CG1-CD1 3.98Å; V245-L249 HydrophobicContact CG1-CG 4.43Å; V245-L249 WeakPolarHBondContact O-CB 3.4Å; V245-L249 WeakPolarHBondContact O-CG 3.44Å; V245-L249 PolarHBondContact O-N 3.18Å
246D83.2Confident73.4Confident44 Ų4470.8 Ų70.824%0.23538%0.375CS..Hα-helixtrans-59.8-40.7174.1179.250.3000111.2K242 G243 L249 K250K242-D246 PolarHBondContact N-OD2 2.73Å; G243-D246 PolarHBondContact O-N 3.03Å; D246-L249 PolarHBondContact O-N 3.49Å; D246-K250 VanDerWaalsContact CG-NZ 3.33Å; D246-K250 VanDerWaalsContact O-CB 3.3Å; D246-K250 WeakPolarHBondContact O-CB 3.3Å; D246-K250 WeakPolarHBondContact O-CG 3.44Å; D246-K250 PolarHBondContact O-N 3.46Å; D246-K250 WeakPolarHBondContact OD1-CE 3.36Å; D246-K250 IonicContact OD1-NZ 3.34Å; D246-K250 PolarHBondContact OD1-NZ 3.13Å; D246-K250 VanDerWaalsContact OD1-NZ 3.16Å; D246-K250 IonicContact OD2-NZ 3.79Å; D246-K250 PolarHBondContact OD2-NZ 2.89Å
247G79.6Confident75Confident0 Ų072.1 Ų72.10%036%0.359CS..Hα-helixtrans-62.9-44.6174.100000114.1Y241 G243 T244 V245 M251Y241-G247 VanDerWaalsContact CD1-CA 3.44Å; G243-G247 PolarHBondContact O-N 3.01Å; T244-G247 PolarHBondContact O-N 3.02Å; V245-G247 VanDerWaalsContact C-N 3.29Å; V245-G247 PolarHBondContact O-N 3.41Å; G247-M251 WeakPolarHBondContact O-CB 3.21Å; G247-M251 WeakPolarHBondContact O-CE 3.35Å; G247-M251 VanDerWaalsContact O-CG 3.25Å; G247-M251 WeakPolarHBondContact O-CG 3.36Å; G247-M251 PolarHBondContact O-N 3.34Å
248I83.4Confident76.6Confident44 Ų4473.5 Ų73.523%0.22636%0.363CS..Hα-helixtrans-62.2-49.1176.5-65.9170.9000110.3V224 T244 V245 M251 W252 L260V224-I248 HydrophobicContact CG2-CB 4.49Å; V224-I248 HydrophobicContact CG2-CD1 4.34Å; V224-I248 HydrophobicContact CG2-CG1 3.41Å; V224-I248 VanDerWaalsContact CG2-CG1 3.41Å; T244-I248 HydrophobicContact CG2-CD1 4.33Å; T244-I248 WeakPolarHBondContact O-CG1 3.37Å; T244-I248 PolarHBondContact O-N 3.43Å; V245-I248 PolarHBondContact O-N 2.97Å; I248-M251 PolarHBondContact O-N 3.12Å; I248-W252 WeakPolarHBondContact O-CB 3.49Å; I248-W252 PolarHBondContact O-N 3.18Å; I248-L260 HydrophobicContact CG1-CD2 4.49Å; I248-L260 HydrophobicContact CG2-CD1 4.13Å; I248-L260 HydrophobicContact CG2-CD2 4.23Å
249L83.3Confident77.6Confident100 Ų10068.3 Ų68.352%0.52433%0.332SS..Hα-helixtrans-62.9-45.2-178-71.8171.7000111.9V245 D246 W252 K253V245-L249 HydrophobicContact CG1-CD1 3.98Å; V245-L249 HydrophobicContact CG1-CG 4.43Å; V245-L249 WeakPolarHBondContact O-CB 3.4Å; V245-L249 WeakPolarHBondContact O-CG 3.44Å; V245-L249 PolarHBondContact O-N 3.18Å; D246-L249 PolarHBondContact O-N 3.49Å; L249-W252 PolarHBondContact O-N 3.06Å; L249-K253 VanDerWaalsContact O-CB 3.3Å; L249-K253 WeakPolarHBondContact O-CB 3.42Å; L249-K253 PolarHBondContact O-N 3.03Å
250K81.1Confident78.5Confident55 Ų5565.5 Ų65.524%0.23932%0.317CS..Hα-helixtrans-64-43.6176.9-77.9172.1174.6163.10111.9I40 L240 Y241 D246 K253 H254I40-K250 HydrophobicContact CD1-CB 4.26Å; I40-K250 HydrophobicContact CD1-CD 4.43Å; L240-K250 PolarHBondContact O-NZ 3.47Å; Y241-K250 HydrophobicContact CD1-CD 4.32Å; Y241-K250 HydrophobicContact CE1-CB 4.24Å; Y241-K250 HydrophobicContact CE1-CD 4.45Å; D246-K250 VanDerWaalsContact CG-NZ 3.33Å; D246-K250 VanDerWaalsContact O-CB 3.3Å; D246-K250 WeakPolarHBondContact O-CB 3.3Å; D246-K250 WeakPolarHBondContact O-CG 3.44Å; D246-K250 PolarHBondContact O-N 3.46Å; D246-K250 WeakPolarHBondContact OD1-CE 3.36Å; D246-K250 IonicContact OD1-NZ 3.34Å; D246-K250 PolarHBondContact OD1-NZ 3.13Å; D246-K250 VanDerWaalsContact OD1-NZ 3.16Å; D246-K250 IonicContact OD2-NZ 3.79Å; D246-K250 PolarHBondContact OD2-NZ 2.89Å; K250-K253 PolarHBondContact O-N 3.02Å; K250-H254 WeakPolarHBondContact O-CB 3.47Å; K250-H254 PolarHBondContact O-CD2 3.06Å; K250-H254 VanDerWaalsContact O-CD2 3.26Å; K250-H254 PolarHBondContact O-N 3.47Å
251M79.9Confident79.3Confident0 Ų067.2 Ų67.20%032%0.321CS..Hα-helixtrans-62.4-45.4176.8-78.2-166-75.300112V223 V224 R227 G247 I248 K253 E255 G256 L260V223-M251 HydrophobicContact CG1-CE 4.3Å; V223-M251 HydrophobicContact CG1-SD 3.86Å; V224-M251 HydrophobicContact CB-CE 3.96Å; V224-M251 HydrophobicContact CG2-CE 3.14Å; R227-M251 WeakPolarHBondContact CD-SD 3.05Å; R227-M251 VanDerWaalsContact CZ-SD 3.56Å; R227-M251 VanDerWaalsContact NH1-CG 3.3Å; R227-M251 PolarHBondContact NH1-SD 2.74Å; G247-M251 WeakPolarHBondContact O-CB 3.21Å; G247-M251 WeakPolarHBondContact O-CE 3.35Å; G247-M251 VanDerWaalsContact O-CG 3.25Å; G247-M251 WeakPolarHBondContact O-CG 3.36Å; G247-M251 PolarHBondContact O-N 3.34Å; I248-M251 PolarHBondContact O-N 3.12Å; M251-K253 PolarHBondContact O-N 3.4Å; M251-E255 WeakPolarHBondContact O-CA 3.29Å; M251-E255 WeakPolarHBondContact O-CB 3.37Å; M251-E255 PolarHBondContact O-N 3Å; M251-G256 PolarHBondContact O-N 3.4Å; M251-L260 HydrophobicContact CB-CD2 4.11Å; M251-L260 HydrophobicContact CE-CD2 3.55Å; M251-L260 HydrophobicContact SD-CD2 4.26Å
252W83.4Confident79.6Confident148 Ų14869.9 Ų69.956%0.56133%0.333SS*.Hα-helixtrans-62-46.5177.8-172.81.4000110.9I248 L249 G256I248-W252 WeakPolarHBondContact O-CB 3.49Å; I248-W252 PolarHBondContact O-N 3.18Å; L249-W252 PolarHBondContact O-N 3.06Å; W252-G256 VanDerWaalsContact O-CA 3.24Å; W252-G256 WeakPolarHBondContact O-CA 3.39Å; W252-G256 PolarHBondContact O-N 3.3Å; W252-G256 VanDerWaalsContact O-N 3.09Å
253K80.8Confident79.5Confident178 Ų17863 Ų6377%0.77431%0.306SS*.Hα-helixtrans-67.9-37.3-177.7-169175.7-178.3179.30113.7L249 K250 M251L249-K253 VanDerWaalsContact O-CB 3.3Å; L249-K253 WeakPolarHBondContact O-CB 3.42Å; L249-K253 PolarHBondContact O-N 3.03Å; K250-K253 PolarHBondContact O-N 3.02Å; M251-K253 PolarHBondContact O-N 3.4Å
254H77.7Confident79.3Confident116 Ų11663.7 Ų63.754%0.53730%0.303SS..Hα-helixtrans-99.6-29.3-173.1-70.3-75.9000114.5K250K250-H254 WeakPolarHBondContact O-CB 3.47Å; K250-H254 PolarHBondContact O-CD2 3.06Å; K250-H254 VanDerWaalsContact O-CD2 3.26Å; K250-H254 PolarHBondContact O-N 3.47Å
255E75Confident79.1Confident37 Ų3771 Ų7117%0.17333%0.33CS..Hα-helixtrans-119.9-8.1-175.5-63.5179-140.300113.7Q38 R227 M251 A259 K262Q38-E255 WeakPolarHBondContact CA-OE1 3.38Å; R227-E255 IonicContact CZ-OE1 3.11Å; R227-E255 IonicContact CZ-OE2 3.57Å; R227-E255 IonicContact NH1-OE1 3.19Å; R227-E255 PolarHBondContact NH1-OE1 2.94Å; R227-E255 IonicContact NH1-OE2 2.69Å; R227-E255 PolarHBondContact NH1-OE2 2.92Å; R227-E255 IonicContact NH2-OE1 3.88Å; R227-E255 IonicContact NH2-OE2 2.69Å; R227-E255 PolarHBondContact NH2-OE2 3.4Å; M251-E255 WeakPolarHBondContact O-CA 3.29Å; M251-E255 WeakPolarHBondContact O-CB 3.37Å; M251-E255 PolarHBondContact O-N 3Å; E255-A259 HydrophobicContact CB-CB 3.52Å; E255-K262 IonicContact OE2-NZ 2.76Å; E255-K262 PolarHBondContact OE2-NZ 2.87Å
256G80.9Confident78.5Confident30 Ų3067 Ų6731%0.30931%0.306SS..  trans86168-178.800000114.1M251 W252 F258 A259M251-G256 PolarHBondContact O-N 3.4Å; W252-G256 VanDerWaalsContact O-CA 3.24Å; W252-G256 WeakPolarHBondContact O-CA 3.39Å; W252-G256 PolarHBondContact O-N 3.3Å; W252-G256 VanDerWaalsContact O-N 3.09Å; G256-F258 VanDerWaalsContact C-N 3.31Å; G256-F258 PolarHBondContact O-N 3.09Å; G256-A259 VanDerWaalsContact O-CB 3.26Å; G256-A259 WeakPolarHBondContact O-CB 3.49Å; G256-A259 PolarHBondContact O-N 3.33Å; G256-A259 VanDerWaalsContact O-N 3.13Å
257F79.9Confident77.9Confident105 Ų10565.6 Ų65.646%0.46130%0.298SS..G310 helixtrans-60-37.9-176.3-179.4-101.1000113.3A259 L260 Y261F257-A259 PolarHBondContact O-N 3.06Å; F257-A259 VanDerWaalsContact O-N 3.13Å; F257-L260 HydrophobicContact CD2-CD1 4.4Å; F257-L260 PolarHBondContact O-N 3.13Å; F257-L260 VanDerWaalsContact O-N 3.16Å; F257-Y261 HydrophobicContact CE1-CD2 4.22Å; F257-Y261 AromaticContact CE1-CE2 3.75Å; F257-Y261 HydrophobicContact CE1-CE2 3.75Å; F257-Y261 HydrophobicContact CE2-CE2 4.34Å; F257-Y261 HydrophobicContact CZ-CD2 4.49Å; F257-Y261 AromaticContact CZ-CE2 3.63Å; F257-Y261 HydrophobicContact CZ-CE2 3.63Å
258F80.4Confident77.6Confident176 Ų17669.9 Ų69.977%0.77231%0.314SS*.G310 helixtrans-64.3-17.4179.2-70.5-75.1000113.7G256 L260 Y261 K262G256-F258 VanDerWaalsContact C-N 3.31Å; G256-F258 PolarHBondContact O-N 3.09Å; F258-L260 VanDerWaalsContact C-N 3.27Å; F258-L260 PolarHBondContact O-N 3.49Å; F258-Y261 PolarHBondContact O-N 3.02Å; F258-K262 PolarHBondContact O-N 3.49Å
259A76.9Confident77.1Confident1 Ų170.7 Ų70.71%0.00832%0.319CS..G310 helixtrans-64.1-31.9175.200000112.7E255 G256 F257 Y261 K262E255-A259 HydrophobicContact CB-CB 3.52Å; G256-A259 VanDerWaalsContact O-CB 3.26Å; G256-A259 WeakPolarHBondContact O-CB 3.49Å; G256-A259 PolarHBondContact O-N 3.33Å; G256-A259 VanDerWaalsContact O-N 3.13Å; F257-A259 PolarHBondContact O-N 3.06Å; F257-A259 VanDerWaalsContact O-N 3.13Å; A259-Y261 PolarHBondContact O-N 3.47Å; A259-K262 HydrophobicContact CB-CD 4.3Å; A259-K262 WeakPolarHBondContact O-CB 3.21Å; A259-K262 PolarHBondContact O-N 3.23Å
260L80Confident76.8Confident8 Ų867.9 Ų67.94%0.04230%0.301CS..G310 helixtrans-68.5-19.9179.1-62.8173.3000113.3P220 V223 I248 M251 F257 F258P220-L260 HydrophobicContact CB-CB 4.26Å; P220-L260 HydrophobicContact CB-CD2 4.42Å; V223-L260 VanDerWaalsContact CG2-O 3.29Å; V223-L260 WeakPolarHBondContact CG2-O 3.06Å; I248-L260 HydrophobicContact CG1-CD2 4.49Å; I248-L260 HydrophobicContact CG2-CD1 4.13Å; I248-L260 HydrophobicContact CG2-CD2 4.23Å; M251-L260 HydrophobicContact CB-CD2 4.11Å; M251-L260 HydrophobicContact CE-CD2 3.55Å; M251-L260 HydrophobicContact SD-CD2 4.26Å; F257-L260 HydrophobicContact CD2-CD1 4.4Å; F257-L260 PolarHBondContact O-N 3.13Å; F257-L260 VanDerWaalsContact O-N 3.16Å; F258-L260 VanDerWaalsContact C-N 3.27Å; F258-L260 PolarHBondContact O-N 3.49Å
261Y80.9Confident76.5Confident76 Ų7668.7 Ų68.730%0.29831%0.308SS..G310 helixtrans-106.28178.3-66.7-88.3000112.5L216 N219 F257 F258 A259 G263 F264L216-Y261 HydrophobicContact CD2-CE1 4.15Å; N219-Y261 HydrophobicContact CB-CD1 4.29Å; N219-Y261 HydrophobicContact CB-CE1 4.45Å; F257-Y261 HydrophobicContact CE1-CD2 4.22Å; F257-Y261 AromaticContact CE1-CE2 3.75Å; F257-Y261 HydrophobicContact CE1-CE2 3.75Å; F257-Y261 HydrophobicContact CE2-CE2 4.34Å; F257-Y261 HydrophobicContact CZ-CD2 4.49Å; F257-Y261 AromaticContact CZ-CE2 3.63Å; F257-Y261 HydrophobicContact CZ-CE2 3.63Å; F258-Y261 PolarHBondContact O-N 3.02Å; A259-Y261 PolarHBondContact O-N 3.47Å; Y261-G263 PolarHBondContact O-N 3.33Å; Y261-F264 VanDerWaalsContact O-CB 3.31Å; Y261-F264 WeakPolarHBondContact O-CB 3.44Å; Y261-F264 PolarHBondContact O-N 2.93Å
262K72.8Confident76.4Confident64 Ų6470.2 Ų70.228%0.27832%0.324SS..THydrogen-bonded Turntrans-58.2126.8173.1-79.2173.5-178.4173.60109.7V223 E255 F258 A259 F264V223-K262 WeakPolarHBondContact CG2-O 3.28Å; E255-K262 IonicContact OE2-NZ 2.76Å; E255-K262 PolarHBondContact OE2-NZ 2.87Å; F258-K262 PolarHBondContact O-N 3.49Å; A259-K262 HydrophobicContact CB-CD 4.3Å; A259-K262 WeakPolarHBondContact O-CB 3.21Å; A259-K262 PolarHBondContact O-N 3.23Å; K262-F264 VanDerWaalsContact C-N 3.33Å
263G68.8Low76.4Confident11 Ų1165.7 Ų65.711%0.11331%0.314CS..THydrogen-bonded Turntrans81.75.6-179.800000115.1Y261 P266 N267Y261-G263 PolarHBondContact O-N 3.33Å; G263-P266 WeakPolarHBondContact O-CD 3.48Å; G263-N267 VanDerWaalsContact O-CB 3.31Å; G263-N267 WeakPolarHBondContact O-CB 3.44Å; G263-N267 PolarHBondContact O-N 3.06Å
264F75.5Confident76.6Confident38 Ų3859.8 Ų59.817%0.16729%0.287CS..Hα-helixtrans-56.6-53.8172.7171-123000112.1A215 L216 N219 Y261 K262 N267 W268A215-F264 HydrophobicContact CB-CE2 3.95Å; L216-F264 HydrophobicContact CD2-CZ 4.27Å; N219-F264 WeakPolarHBondContact ND2-CD2 3.43Å; N219-F264 VanDerWaalsContact ND2-CE2 3.29Å; N219-F264 WeakPolarHBondContact ND2-CE2 3.34Å; Y261-F264 VanDerWaalsContact O-CB 3.31Å; Y261-F264 WeakPolarHBondContact O-CB 3.44Å; Y261-F264 PolarHBondContact O-N 2.93Å; K262-F264 VanDerWaalsContact C-N 3.33Å; F264-N267 WeakPolarHBondContact O-CB 3.07Å; F264-N267 PolarHBondContact O-N 2.92Å; F264-N267 VanDerWaalsContact O-N 3.07Å; F264-W268 HydrophobicContact CE2-CB 4.48Å; F264-W268 PolarHBondContact O-N 3.02Å
265W75.1Confident76.9Confident163 Ų16357.3 Ų57.362%0.61728%0.277SS*.Hα-helixtrans-61.5-45.3-178.6-160.2-98000112.6N267 W268 L269W265-N267 VanDerWaalsContact C-N 3.34Å; W265-N267 PolarHBondContact O-N 2.73Å; W265-W268 HydrophobicContact CH2-CE3 4.37Å; W265-W268 HydrophobicContact CH2-CZ3 4.07Å; W265-W268 HydrophobicContact CZ2-CZ3 4.47Å; W265-W268 HydrophobicContact CZ3-CE3 4.29Å; W265-W268 HydrophobicContact CZ3-CZ3 4.33Å; W265-W268 PolarHBondContact O-N 2.89Å; W265-L269 WeakPolarHBondContact O-CB 3.33Å; W265-L269 PolarHBondContact O-N 3.21Å
266P70.3Confident77.3Confident13 Ų1360.5 Ų60.58%0.08429%0.294CS..Hα-helixtrans-56.6-41.6168.9-27.533.5000114.3K30 L33 M52 G263 R270K30-P266 HydrophobicContact CB-CB 4.05Å; K30-P266 HydrophobicContact CG-CB 4.24Å; L33-P266 HydrophobicContact CD1-CG 3.87Å; M52-P266 HydrophobicContact CB-CG 4.34Å; M52-P266 HydrophobicContact SD-CB 3.94Å; M52-P266 HydrophobicContact SD-CG 4.28Å; G263-P266 WeakPolarHBondContact O-CD 3.48Å; P266-R270 VanDerWaalsContact O-CB 3.29Å; P266-R270 WeakPolarHBondContact O-CB 3.43Å; P266-R270 PolarHBondContact O-N 3.16Å
267N71.3Confident77.6Confident15 Ų1561.4 Ų61.48%0.0829%0.291CS..Hα-helixtrans-63.2-45.5179-170.138000111.6K30 G263 F264 W265K30-N267 HydrophobicContact CD-CB 4.15Å; K30-N267 VanDerWaalsContact NZ-CG 3.29Å; K30-N267 PolarHBondContact NZ-OD1 3.28Å; G263-N267 VanDerWaalsContact O-CB 3.31Å; G263-N267 WeakPolarHBondContact O-CB 3.44Å; G263-N267 PolarHBondContact O-N 3.06Å; F264-N267 WeakPolarHBondContact O-CB 3.07Å; F264-N267 PolarHBondContact O-N 2.92Å; F264-N267 VanDerWaalsContact O-N 3.07Å; W265-N267 VanDerWaalsContact C-N 3.34Å; W265-N267 PolarHBondContact O-N 2.73Å
268W72.4Confident77.9Confident89 Ų8958.1 Ų58.134%0.33728%0.277SS..Hα-helixtrans-70.3-45.6-179.3-167.166.3000111.7F208 F264 W265 R270 L271F208-W268 AromaticContact CE2-CZ2 3.87Å; F208-W268 HydrophobicContact CE2-CZ2 3.87Å; F208-W268 HydrophobicContact CZ-CH2 4.47Å; F208-W268 AromaticContact CZ-CZ2 3.98Å; F208-W268 HydrophobicContact CZ-CZ2 3.98Å; F264-W268 HydrophobicContact CE2-CB 4.48Å; F264-W268 PolarHBondContact O-N 3.02Å; W265-W268 HydrophobicContact CH2-CE3 4.37Å; W265-W268 HydrophobicContact CH2-CZ3 4.07Å; W265-W268 HydrophobicContact CZ2-CZ3 4.47Å; W265-W268 HydrophobicContact CZ3-CE3 4.29Å; W265-W268 HydrophobicContact CZ3-CZ3 4.33Å; W265-W268 PolarHBondContact O-N 2.89Å; W268-R270 PolarHBondContact O-N 3.46Å; W268-L271 WeakPolarHBondContact O-CB 3.29Å; W268-L271 PolarHBondContact O-N 2.89Å; W268-L271 VanDerWaalsContact O-N 3.09Å
269L73.3Confident78.2Confident62 Ų6255.1 Ų55.133%0.32526%0.264SS..Hα-helixtrans-60.8-31.7177.7-172.4149.5000112M52 W265 P273M52-L269 HydrophobicContact CE-CD1 4.12Å; M52-L269 HydrophobicContact CE-CD2 3.7Å; M52-L269 HydrophobicContact CE-CG 4.5Å; M52-L269 HydrophobicContact SD-CD2 4.38Å; W265-L269 WeakPolarHBondContact O-CB 3.33Å; W265-L269 PolarHBondContact O-N 3.21Å; L269-P273 WeakPolarHBondContact O-CD 3.27Å
270R76.3Confident78.8Confident40 Ų4059.7 Ų59.715%0.15129%0.287CS..Hα-helixtrans-67.6-32.1176.2-172-169.869.3111.314.8114V26 D27 P266 W268 G272 P273 W274V26-R270 HydrophobicContact CB-CG 4.42Å; V26-R270 HydrophobicContact CG1-CB 3.86Å; V26-R270 HydrophobicContact CG1-CG 4.02Å; D27-R270 WeakPolarHBondContact OD1-CD 3.46Å; D27-R270 IonicContact OD1-CZ 3.65Å; D27-R270 VanDerWaalsContact OD1-CZ 3.31Å; D27-R270 IonicContact OD1-NE 3.54Å; D27-R270 PolarHBondContact OD1-NE 3.43Å; D27-R270 IonicContact OD1-NH1 2.67Å; D27-R270 PolarHBondContact OD1-NH1 2.9Å; D27-R270 IonicContact OD2-NH1 3.57Å; P266-R270 VanDerWaalsContact O-CB 3.29Å; P266-R270 WeakPolarHBondContact O-CB 3.43Å; P266-R270 PolarHBondContact O-N 3.16Å; W268-R270 PolarHBondContact O-N 3.46Å; R270-G272 VanDerWaalsContact C-N 3.27Å; R270-G272 PolarHBondContact O-N 2.97Å; R270-P273 WeakPolarHBondContact O-CD 3.34Å; R270-W274 WeakPolarHBondContact O-CB 3.31Å; R270-W274 PolarHBondContact O-N 3.48Å; R270-W274 VanDerWaalsContact O-N 3.12Å
271L74.6Confident79.1Confident72 Ų7260.5 Ų60.538%0.37729%0.293SS..Hα-helixtrans-61.4-37.3-175.6-70170.5000112.1W268 N275W268-L271 WeakPolarHBondContact O-CB 3.29Å; W268-L271 PolarHBondContact O-N 2.89Å; W268-L271 VanDerWaalsContact O-N 3.09Å; L271-N275 WeakPolarHBondContact O-CB 3.3Å; L271-N275 PolarHBondContact O-N 3.42Å; L271-N275 VanDerWaalsContact O-N 3.08Å; L271-N275 PolarHBondContact O-ND2 2.97Å; L271-N275 VanDerWaalsContact O-ND2 3.15Å
272G79.3Confident79.3Confident33 Ų3360 Ų6034%0.3429%0.291SS..Hα-helixtrans-60.7-64.3178.100000112.7R270 W274 N275 I276R270-G272 VanDerWaalsContact C-N 3.27Å; R270-G272 PolarHBondContact O-N 2.97Å; G272-W274 VanDerWaalsContact C-N 3.28Å; G272-W274 PolarHBondContact O-N 2.7Å; G272-N275 PolarHBondContact O-N 3.29Å; G272-I276 VanDerWaalsContact O-CG1 3.3Å; G272-I276 WeakPolarHBondContact O-CG1 3.35Å; G272-I276 PolarHBondContact O-N 3.04Å
273P81.9Confident80Confident53 Ų5361.8 Ų61.834%0.34430%0.3SS..Hα-helixtrans-55.9-39.4178.7-26.835.3000113.4T23 L269 R270 I276 I277T23-P273 HydrophobicContact CG2-CB 4.11Å; L269-P273 WeakPolarHBondContact O-CD 3.27Å; R270-P273 WeakPolarHBondContact O-CD 3.34Å; P273-I276 PolarHBondContact O-N 3.04Å; P273-I277 VanDerWaalsContact O-CG1 3.27Å; P273-I277 WeakPolarHBondContact O-CG1 3.3Å; P273-I277 PolarHBondContact O-N 3.26Å
274W84.9Confident80.8Confident54 Ų5465.8 Ų65.821%0.20532%0.316CS..Hα-helixtrans-61.7-49.1178.4-174.189.6000111.4A19 T23 R270 G272 I276 I277 F278A19-W274 HydrophobicContact CB-CG 4.38Å; T23-W274 HydrophobicContact CG2-CB 3.89Å; R270-W274 WeakPolarHBondContact O-CB 3.31Å; R270-W274 PolarHBondContact O-N 3.48Å; R270-W274 VanDerWaalsContact O-N 3.12Å; G272-W274 VanDerWaalsContact C-N 3.28Å; G272-W274 PolarHBondContact O-N 2.7Å; W274-I276 PolarHBondContact O-N 3.12Å; W274-I277 PolarHBondContact O-N 3.2Å; W274-F278 HydrophobicContact CH2-CD2 4.24Å; W274-F278 HydrophobicContact CH2-CG 4.31Å; W274-F278 HydrophobicContact CZ2-CD2 4.45Å; W274-F278 HydrophobicContact CZ3-CB 4.45Å; W274-F278 HydrophobicContact CZ3-CG 4.47Å; W274-F278 VanDerWaalsContact O-CB 3.26Å; W274-F278 WeakPolarHBondContact O-CB 3.12Å; W274-F278 PolarHBondContact O-N 3.44Å
275N83.6Confident81.2Confident64 Ų6465.8 Ų65.834%0.34232%0.317SS..Hα-helixtrans-62.7-43178.2-79.1-33.6000111.6L271 G272 F278 F279L271-N275 WeakPolarHBondContact O-CB 3.3Å; L271-N275 PolarHBondContact O-N 3.42Å; L271-N275 VanDerWaalsContact O-N 3.08Å; L271-N275 PolarHBondContact O-ND2 2.97Å; L271-N275 VanDerWaalsContact O-ND2 3.15Å; G272-N275 PolarHBondContact O-N 3.29Å; N275-F278 PolarHBondContact O-N 2.79Å; N275-F279 HydrophobicContact CB-CD2 4.36Å; N275-F279 HydrophobicContact CB-CE2 4.46Å; N275-F279 WeakPolarHBondContact O-CD2 3.5Å; N275-F279 PolarHBondContact O-N 3.35Å
276I84.8Confident81.6Confident103 Ų10364 Ų6453%0.52831%0.314SS..Hα-helixtrans-59.7-51.3179.7-68.1165.7000110.5G272 P273 W274 F278 F279 I280G272-I276 VanDerWaalsContact O-CG1 3.3Å; G272-I276 WeakPolarHBondContact O-CG1 3.35Å; G272-I276 PolarHBondContact O-N 3.04Å; P273-I276 PolarHBondContact O-N 3.04Å; W274-I276 PolarHBondContact O-N 3.12Å; I276-F278 VanDerWaalsContact C-N 3.32Å; I276-F278 PolarHBondContact O-N 2.7Å; I276-F279 PolarHBondContact O-N 3.21Å; I276-I280 HydrophobicContact CG2-CD1 3.62Å; I276-I280 HydrophobicContact CG2-CG1 4.47Å; I276-I280 WeakPolarHBondContact O-CB 3.44Å; I276-I280 VanDerWaalsContact O-CG1 3.24Å; I276-I280 WeakPolarHBondContact O-CG1 3.29Å; I276-I280 PolarHBondContact O-N 3.03Å
277I86.9Confident82.1Confident49 Ų4972.2 Ų72.225%0.25134%0.343SS..Hα-helixtrans-64.4-40.6-179.2-62.2164.7000110.6V18 A19 T23 P273 W274 T281V18-I277 HydrophobicContact CG1-CG2 3.97Å; A19-I277 HydrophobicContact CB-CB 4.17Å; A19-I277 HydrophobicContact CB-CG2 4.05Å; T23-I277 HydrophobicContact CG2-CD1 4.15Å; P273-I277 VanDerWaalsContact O-CG1 3.27Å; P273-I277 WeakPolarHBondContact O-CG1 3.3Å; P273-I277 PolarHBondContact O-N 3.26Å; W274-I277 PolarHBondContact O-N 3.2Å; I277-T281 VanDerWaalsContact O-CB 3.23Å; I277-T281 WeakPolarHBondContact O-CB 3.32Å; I277-T281 PolarHBondContact O-N 3.49Å; I277-T281 PolarHBondContact O-OG1 3.13Å
278F86.9Confident82.3Confident37 Ų3777.3 Ų77.316%0.16237%0.37CS..Hα-helixtrans-60.1-54.9177.6175.9-93.5000111.6A15 S16 A19 W274 N275 I276 T281 Y282A15-F278 HydrophobicContact CB-CD2 3.85Å; A15-F278 HydrophobicContact CB-CE2 3.89Å; S16-F278 WeakPolarHBondContact OG-CE2 3.14Å; A19-F278 HydrophobicContact CB-CB 3.96Å; W274-F278 HydrophobicContact CH2-CD2 4.24Å; W274-F278 HydrophobicContact CH2-CG 4.31Å; W274-F278 HydrophobicContact CZ2-CD2 4.45Å; W274-F278 HydrophobicContact CZ3-CB 4.45Å; W274-F278 HydrophobicContact CZ3-CG 4.47Å; W274-F278 VanDerWaalsContact O-CB 3.26Å; W274-F278 WeakPolarHBondContact O-CB 3.12Å; W274-F278 PolarHBondContact O-N 3.44Å; N275-F278 PolarHBondContact O-N 2.79Å; I276-F278 VanDerWaalsContact C-N 3.32Å; I276-F278 PolarHBondContact O-N 2.7Å; F278-T281 PolarHBondContact O-N 2.88Å; F278-Y282 VanDerWaalsContact O-CB 3.22Å; F278-Y282 WeakPolarHBondContact O-CB 3.31Å; F278-Y282 PolarHBondContact O-N 2.73Å
279F86.1Confident81.6Confident112 Ų11280.5 Ų80.549%0.49139%0.388SS..Hα-helixtrans-66.3-42.1-176.1-79.8-66.4000112.3N275 I276 T281 Y282 E283N275-F279 HydrophobicContact CB-CD2 4.36Å; N275-F279 HydrophobicContact CB-CE2 4.46Å; N275-F279 WeakPolarHBondContact O-CD2 3.5Å; N275-F279 PolarHBondContact O-N 3.35Å; I276-F279 PolarHBondContact O-N 3.21Å; F279-T281 VanDerWaalsContact C-N 3.34Å; F279-T281 PolarHBondContact O-N 3.29Å; F279-Y282 PolarHBondContact O-N 3.08Å; F279-E283 WeakPolarHBondContact O-CB 3.4Å; F279-E283 WeakPolarHBondContact O-CG 3.45Å; F279-E283 PolarHBondContact O-N 2.72Å
280I88.9Confident80.5Confident97 Ų9786.9 Ų86.950%0.49742%0.421SS..Hα-helixtrans-58.7-49.4175.2-69.5172000109.9I276 Y282 E283 Q284I276-I280 HydrophobicContact CG2-CD1 3.62Å; I276-I280 HydrophobicContact CG2-CG1 4.47Å; I276-I280 WeakPolarHBondContact O-CB 3.44Å; I276-I280 VanDerWaalsContact O-CG1 3.24Å; I276-I280 WeakPolarHBondContact O-CG1 3.29Å; I276-I280 PolarHBondContact O-N 3.03Å; I280-Y282 PolarHBondContact O-N 3.48Å; I280-E283 PolarHBondContact O-N 3.02Å; I280-Q284 HydrophobicContact CG2-CG 4.42Å; I280-Q284 WeakPolarHBondContact O-CB 3.24Å; I280-Q284 VanDerWaalsContact O-CG 3.24Å; I280-Q284 WeakPolarHBondContact O-CG 3.36Å; I280-Q284 PolarHBondContact O-N 3.4Å
281T86.3Confident80.7Confident26 Ų2689.3 Ų89.316%0.1643%0.434CS..Hα-helixtrans-65.4-41.7-177.9-55.60000111.3A15 V18 I277 F278 F279 Q284 L285A15-T281 HydrophobicContact CB-CG2 4Å; V18-T281 HydrophobicContact CB-CG2 4.14Å; V18-T281 HydrophobicContact CG1-CG2 4.33Å; V18-T281 HydrophobicContact CG2-CG2 4.17Å; I277-T281 VanDerWaalsContact O-CB 3.23Å; I277-T281 WeakPolarHBondContact O-CB 3.32Å; I277-T281 PolarHBondContact O-N 3.49Å; I277-T281 PolarHBondContact O-OG1 3.13Å; F278-T281 PolarHBondContact O-N 2.88Å; F279-T281 VanDerWaalsContact C-N 3.34Å; F279-T281 PolarHBondContact O-N 3.29Å; T281-Q284 PolarHBondContact O-N 3.35Å; T281-L285 HydrophobicContact CG2-CD1 3.97Å; T281-L285 HydrophobicContact CG2-CG 4.36Å; T281-L285 WeakPolarHBondContact O-CB 3.31Å; T281-L285 VanDerWaalsContact O-CG 3.24Å; T281-L285 WeakPolarHBondContact O-CG 3.47Å; T281-L285 PolarHBondContact O-N 3.05Å
282Y85.8Confident81.1Confident65 Ų6590.2 Ų90.226%0.25544%0.438SS..Hα-helixtrans-62.4-44.2177.4-176.8-100.8000112F278 F279 I280 L285 K286F278-Y282 VanDerWaalsContact O-CB 3.22Å; F278-Y282 WeakPolarHBondContact O-CB 3.31Å; F278-Y282 PolarHBondContact O-N 2.73Å; F279-Y282 PolarHBondContact O-N 3.08Å; I280-Y282 PolarHBondContact O-N 3.48Å; Y282-L285 PolarHBondContact O-N 3.47Å; Y282-K286 WeakPolarHBondContact O-CB 3.41Å; Y282-K286 PolarHBondContact O-N 3.2Å
283E86.8Confident81.2Confident101 Ų10193.3 Ų93.347%0.47244%0.443SS..Hα-helixtrans-65.9-41.5177.1-75.4-175.4-175.500112.4F279 I280 K286 R287F279-E283 WeakPolarHBondContact O-CB 3.4Å; F279-E283 WeakPolarHBondContact O-CG 3.45Å; F279-E283 PolarHBondContact O-N 2.72Å; I280-E283 PolarHBondContact O-N 3.02Å; E283-K286 PolarHBondContact O-N 2.85Å; E283-R287 WeakPolarHBondContact O-CG 3.09Å; E283-R287 PolarHBondContact O-N 3.24Å
284Q87Confident81.1Confident96 Ų9695.7 Ų95.745%0.44945%0.449SS..Hα-helixtrans-64.8-43.7176.6-68.1-60.2-33.200111.6I280 T281 K286 R287 L288I280-Q284 HydrophobicContact CG2-CG 4.42Å; I280-Q284 WeakPolarHBondContact O-CB 3.24Å; I280-Q284 VanDerWaalsContact O-CG 3.24Å; I280-Q284 WeakPolarHBondContact O-CG 3.36Å; I280-Q284 PolarHBondContact O-N 3.4Å; T281-Q284 PolarHBondContact O-N 3.35Å; Q284-K286 VanDerWaalsContact C-N 3.27Å; Q284-K286 PolarHBondContact O-N 3.36Å; Q284-R287 PolarHBondContact O-N 3.36Å; Q284-R287 VanDerWaalsContact O-N 3.13Å; Q284-L288 WeakPolarHBondContact O-CB 3.42Å; Q284-L288 WeakPolarHBondContact O-CG 3.43Å; Q284-L288 PolarHBondContact O-N 3.42Å
285L83.4Confident80.9Confident37 Ų3798.3 Ų98.319%0.19446%0.464CS..Hα-helixtrans-62.3-35.4174.9-73172.6000112.4Y11 L14 T281 Y282Y11-L285 HydrophobicContact CD1-CB 3.9Å; Y11-L285 HydrophobicContact CG-CB 4.08Å; L14-L285 HydrophobicContact CB-CD1 3.77Å; L14-L285 HydrophobicContact CD1-CD1 4.44Å; T281-L285 HydrophobicContact CG2-CD1 3.97Å; T281-L285 HydrophobicContact CG2-CG 4.36Å; T281-L285 WeakPolarHBondContact O-CB 3.31Å; T281-L285 VanDerWaalsContact O-CG 3.24Å; T281-L285 WeakPolarHBondContact O-CG 3.47Å; T281-L285 PolarHBondContact O-N 3.05Å; Y282-L285 PolarHBondContact O-N 3.47Å
286K82Confident80.7Confident126 Ų126100.6 Ų100.655%0.54847%0.472SS..Hα-helixtrans-71.5-31.6175-167.9179.9178.6-173.40112.5Y282 E283 Q284 Q289Y282-K286 WeakPolarHBondContact O-CB 3.41Å; Y282-K286 PolarHBondContact O-N 3.2Å; E283-K286 PolarHBondContact O-N 2.85Å; Q284-K286 VanDerWaalsContact C-N 3.27Å; Q284-K286 PolarHBondContact O-N 3.36Å; K286-Q289 WeakPolarHBondContact O-CG 3.27Å
287R81.5Confident80.4Confident186 Ų186100.4 Ų100.470%0.70247%0.468SS*.Hα-helixtrans-75.4-33.1175.6-75.2179.6-172.5-154.44.2112.8E283 Q284 Q289E283-R287 WeakPolarHBondContact O-CG 3.09Å; E283-R287 PolarHBondContact O-N 3.24Å; Q284-R287 PolarHBondContact O-N 3.36Å; Q284-R287 VanDerWaalsContact O-N 3.13Å; R287-Q289 PolarHBondContact O-N 3.3Å
288L76.3Confident79.9Confident121 Ų121104.4 Ų104.463%0.63449%0.485SS*.SBendtrans-71.828.7178-77.2162.8000113.8Q284 I290Q284-L288 WeakPolarHBondContact O-CB 3.42Å; Q284-L288 WeakPolarHBondContact O-CG 3.43Å; Q284-L288 PolarHBondContact O-N 3.42Å; L288-I290 PolarHBondContact O-N 3.39Å
289Q57.5Low79.3Confident156 Ų156110 Ų11073%0.72951%0.512SS*.  trans-4799.8-178.1-93.3178.6-28.300112.6K286 R287K286-Q289 WeakPolarHBondContact O-CG 3.27Å; R287-Q289 PolarHBondContact O-N 3.3Å
290I50.1Low78.7Confident197 Ų197109.8 Ų109.8100%1.0151%0.514SS*.  trans-99.30146.6-51.9175.5000106.7K7 L288K7-I290 PolarHBondContact NZ-O 3.1Å; L288-I290 PolarHBondContact O-N 3.39Å

Retrieved 290 of 290 residues in 1726.8 ms (Link to these results)

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