A0A060WEJ1_ONCMY Loading...

Solute carrier family 35 member A1

AlphaFold DB , UniProt , Accession A0A060WEJ1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110522111, Length 338 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
1M38.8Very low63.8Low235 Ų235117.6 Ų117.6100%1.15865%0.652SS**  028.40-95.3-175.5-90.400113
2A32.8Very low65.4Low99 Ų99113.7 Ų113.782%0.81863%0.633SS**  trans-96.14.2-168.900000115.8
3N36.8Very low67.2Low159 Ų159114.1 Ų114.185%0.8562%0.62SS**  trans-142.419.1-171.3-91.5-10.8000115.3
4E48.3Very low68.4Low162 Ų162106.1 Ų106.176%0.75758%0.577SS**  trans-76.6129.5168.6-79.4-175167.400109.8V6E4-V6 PolarHBondContact O-N 3.12Å
5P59.3Low69.3Low127 Ų127101.9 Ų101.983%0.82555%0.554SS**  trans-63.8109.117725.9-32.1000109S7P5-S7 PolarHBondContact O-N 3.22Å
6V71.3Confident70.4Confident46 Ų4698.9 Ų98.928%0.27954%0.543SS..  trans-56.7125.6177.1-179.80000109.3E4 V8 F10 K11E4-V6 PolarHBondContact O-N 3.12Å; V6-V8 PolarHBondContact O-N 3Å; V6-F10 HydrophobicContact CG1-CB 4.05Å; V6-F10 HydrophobicContact CG1-CD1 3.26Å; V6-F10 HydrophobicContact CG1-CE1 4Å; V6-F10 HydrophobicContact CG1-CG 4Å; V6-K11 HydrophobicContact CG1-CG 4.12Å; V6-K11 WeakPolarHBondContact O-CE 3.35Å
7S83.6Confident71.5Confident71 Ų7194.8 Ų94.850%0.49752%0.521SS..  trans-53137.8-177.6174.50000111.7P5 M9 F10 K11P5-S7 PolarHBondContact O-N 3.22Å; S7-M9 PolarHBondContact O-N 3.29Å; S7-M9 VanDerWaalsContact O-N 3.16Å; S7-M9 PolarHBondContact OG-N 3.39Å; S7-F10 WeakPolarHBondContact O-CB 3.4Å; S7-F10 PolarHBondContact O-N 3.24Å; S7-K11 PolarHBondContact O-N 3.29Å; S7-K11 VanDerWaalsContact O-N 3.1Å
8V80.6Confident72.3Confident105 Ų10590.8 Ų90.864%0.63650%0.498SS*.Hα-helixtrans-52.7-37.7175.7177.50000110.8V6 F10 K11 V12V6-V8 PolarHBondContact O-N 3Å; V8-F10 VanDerWaalsContact C-N 3.34Å; V8-F10 PolarHBondContact O-N 3.09Å; V8-K11 PolarHBondContact O-N 3.33Å; V8-V12 HydrophobicContact CG1-CG2 4.28Å; V8-V12 WeakPolarHBondContact O-CG2 3.36Å; V8-V12 PolarHBondContact O-N 2.95Å
9M84.9Confident73Confident148 Ų14886.7 Ų86.773%0.72948%0.476SS*.Hα-helixtrans-61.7-40.5177.5-67.6-61.4166.800112.5S7 V12 Y13S7-M9 PolarHBondContact O-N 3.29Å; S7-M9 VanDerWaalsContact O-N 3.16Å; S7-M9 PolarHBondContact OG-N 3.39Å; M9-V12 PolarHBondContact O-N 2.98Å; M9-Y13 VanDerWaalsContact O-CB 3.31Å; M9-Y13 WeakPolarHBondContact O-CB 3.48Å; M9-Y13 PolarHBondContact O-N 3.07Å
10F84.8Confident73.9Confident81 Ų8187.6 Ų87.636%0.35548%0.479SS..Hα-helixtrans-68-39175.9-179.4-94.8000111.7V6 S7 V8 Y13 C14 V261V6-F10 HydrophobicContact CG1-CB 4.05Å; V6-F10 HydrophobicContact CG1-CD1 3.26Å; V6-F10 HydrophobicContact CG1-CE1 4Å; V6-F10 HydrophobicContact CG1-CG 4Å; S7-F10 WeakPolarHBondContact O-CB 3.4Å; S7-F10 PolarHBondContact O-N 3.24Å; V8-F10 VanDerWaalsContact C-N 3.34Å; V8-F10 PolarHBondContact O-N 3.09Å; F10-Y13 PolarHBondContact O-N 3.24Å; F10-C14 WeakPolarHBondContact CE1-SG 3.47Å; F10-C14 VanDerWaalsContact CZ-SG 3.54Å; F10-C14 PolarHBondContact O-N 2.86Å; F10-C14 PolarHBondContact O-SG 3.33Å; F10-V261 HydrophobicContact CZ-CG1 4.11Å
11K80.4Confident74.7Confident61 Ų6184.2 Ų84.227%0.26546%0.462SS..Hα-helixtrans-63.2-45.1176.3-63-170.1179.3-170.90111.5V6 S7 V8 C14 L15 T266 D267 M270V6-K11 HydrophobicContact CG1-CG 4.12Å; V6-K11 WeakPolarHBondContact O-CE 3.35Å; S7-K11 PolarHBondContact O-N 3.29Å; S7-K11 VanDerWaalsContact O-N 3.1Å; V8-K11 PolarHBondContact O-N 3.33Å; K11-C14 PolarHBondContact O-N 3.27Å; K11-L15 WeakPolarHBondContact O-CB 3.39Å; K11-L15 PolarHBondContact O-N 2.84Å; K11-T266 HydrophobicContact CG-CG2 4.25Å; K11-D267 IonicContact NZ-OD2 3.94Å; K11-M270 HydrophobicContact CB-CE 3.97Å; K11-M270 WeakPolarHBondContact O-CE 3.32Å
12V83.5Confident77Confident70 Ų7074.7 Ų74.742%0.42442%0.421SS..Hα-helixtrans-63.7-43.4175.9172.60000110.9V8 M9 C14 L15 S16V8-V12 HydrophobicContact CG1-CG2 4.28Å; V8-V12 WeakPolarHBondContact O-CG2 3.36Å; V8-V12 PolarHBondContact O-N 2.95Å; M9-V12 PolarHBondContact O-N 2.98Å; V12-C14 PolarHBondContact O-N 3.42Å; V12-L15 WeakPolarHBondContact O-CB 3.22Å; V12-L15 PolarHBondContact O-N 3.45Å; V12-S16 WeakPolarHBondContact O-CB 3.5Å; V12-S16 PolarHBondContact O-N 3.2Å; V12-S16 PolarHBondContact O-OG 2.85Å
13Y88.6Confident79.6Confident119 Ų11970.4 Ų70.447%0.46739%0.385SS..Hα-helixtrans-57.5-51.2175.3170.6-101.5000112.3M9 F10 L15 S16 V17 Y258M9-Y13 VanDerWaalsContact O-CB 3.31Å; M9-Y13 WeakPolarHBondContact O-CB 3.48Å; M9-Y13 PolarHBondContact O-N 3.07Å; F10-Y13 PolarHBondContact O-N 3.24Å; Y13-L15 VanDerWaalsContact C-N 3.3Å; Y13-L15 PolarHBondContact O-N 3.09Å; Y13-S16 PolarHBondContact O-N 2.68Å; Y13-V17 HydrophobicContact CD2-CG2 4.12Å; Y13-V17 HydrophobicContact CE1-CG2 4.33Å; Y13-V17 HydrophobicContact CE2-CG2 3.72Å; Y13-V17 WeakPolarHBondContact O-CG2 3.32Å; Y13-V17 PolarHBondContact O-N 3.45Å; Y13-Y258 AromaticContact CE1-CE1 3.88Å; Y13-Y258 HydrophobicContact CE1-CE1 3.88Å; Y13-Y258 PolarHBondContact OH-OH 3.48Å
14C83.8Confident82.2Confident2 Ų265.2 Ų65.21%0.01436%0.359CS..Hα-helixtrans-60.9-41.9179.1-66.30000111.7F10 K11 V12 M18 V262F10-C14 WeakPolarHBondContact CE1-SG 3.47Å; F10-C14 VanDerWaalsContact CZ-SG 3.54Å; F10-C14 PolarHBondContact O-N 2.86Å; F10-C14 PolarHBondContact O-SG 3.33Å; K11-C14 PolarHBondContact O-N 3.27Å; V12-C14 PolarHBondContact O-N 3.42Å; C14-M18 WeakPolarHBondContact O-CB 3.43Å; C14-M18 WeakPolarHBondContact O-CG 3.29Å; C14-M18 PolarHBondContact O-N 2.92Å; C14-V262 HydrophobicContact CB-CG2 3.81Å
15L82.5Confident84.2Confident44 Ų4459.4 Ų59.423%0.2333%0.33CS..Hα-helixtrans-59.7-51.4176.9-171.482.9000111K11 V12 Y13 M18 T19 M270 F273 S274K11-L15 WeakPolarHBondContact O-CB 3.39Å; K11-L15 PolarHBondContact O-N 2.84Å; V12-L15 WeakPolarHBondContact O-CB 3.22Å; V12-L15 PolarHBondContact O-N 3.45Å; Y13-L15 VanDerWaalsContact C-N 3.3Å; Y13-L15 PolarHBondContact O-N 3.09Å; L15-M18 PolarHBondContact O-N 3.1Å; L15-T19 WeakPolarHBondContact O-CB 3.41Å; L15-T19 PolarHBondContact O-N 3.45Å; L15-T19 PolarHBondContact O-OG1 3.46Å; L15-M270 HydrophobicContact CB-CE 3.81Å; L15-M270 HydrophobicContact CD1-CB 4.2Å; L15-M270 HydrophobicContact CD1-CE 3.85Å; L15-M270 WeakPolarHBondContact CD1-O 3.11Å; L15-M270 HydrophobicContact CD1-SD 4.25Å; L15-M270 HydrophobicContact CD2-CE 4.08Å; L15-M270 HydrophobicContact CG-CE 4.14Å; L15-F273 HydrophobicContact CD1-CB 3.84Å; L15-S274 WeakPolarHBondContact CD1-OG 3.34Å; L15-S274 PolarHBondContact O-OG 3.01Å
16S85.8Confident85.4Confident54 Ų5453.5 Ų53.538%0.37829%0.292SS..Hα-helixtrans-61.3-47.1-178.4-63.70000111.7V12 Y13 T19 L20V12-S16 WeakPolarHBondContact O-CB 3.5Å; V12-S16 PolarHBondContact O-N 3.2Å; V12-S16 PolarHBondContact O-OG 2.85Å; Y13-S16 PolarHBondContact O-N 2.68Å; S16-T19 PolarHBondContact O-N 2.96Å; S16-L20 WeakPolarHBondContact O-CB 3.4Å; S16-L20 WeakPolarHBondContact O-CG 3.42Å; S16-L20 PolarHBondContact O-N 2.95Å
17V89.8Confident86.2Confident29 Ų2952.1 Ų52.118%0.17628%0.284CS..Hα-helixtrans-62.6-47.1178.5175.20000110.7Y13 T19 L20 V21 Y258Y13-V17 HydrophobicContact CD2-CG2 4.12Å; Y13-V17 HydrophobicContact CE1-CG2 4.33Å; Y13-V17 HydrophobicContact CE2-CG2 3.72Å; Y13-V17 WeakPolarHBondContact O-CG2 3.32Å; Y13-V17 PolarHBondContact O-N 3.45Å; V17-T19 VanDerWaalsContact C-N 3.34Å; V17-T19 PolarHBondContact O-N 3.34Å; V17-L20 PolarHBondContact O-N 3.47Å; V17-V21 HydrophobicContact CG1-CG2 4.03Å; V17-V21 VanDerWaalsContact O-CB 3.28Å; V17-V21 WeakPolarHBondContact O-CB 3.26Å; V17-V21 WeakPolarHBondContact O-CG2 3.44Å; V17-V21 PolarHBondContact O-N 2.9Å; V17-Y258 HydrophobicContact CB-CD1 4.15Å; V17-Y258 HydrophobicContact CB-CE1 3.86Å; V17-Y258 HydrophobicContact CG1-CD1 3.87Å; V17-Y258 HydrophobicContact CG1-CD2 4.1Å; V17-Y258 HydrophobicContact CG1-CE1 3.65Å; V17-Y258 HydrophobicContact CG1-CE2 3.89Å; V17-Y258 HydrophobicContact CG1-CG 4.08Å; V17-Y258 HydrophobicContact CG2-CE1 4.24Å
18M85.9Confident86.5Confident22 Ų2249.4 Ų49.411%0.10826%0.264CS..Hα-helixtrans-60-44.5178.6-84.7-158.963.200112.6C14 L15 A22 V262C14-M18 WeakPolarHBondContact O-CB 3.43Å; C14-M18 WeakPolarHBondContact O-CG 3.29Å; C14-M18 PolarHBondContact O-N 2.92Å; L15-M18 PolarHBondContact O-N 3.1Å; M18-A22 WeakPolarHBondContact O-CB 3.5Å; M18-A22 PolarHBondContact O-N 3.27Å; M18-V262 HydrophobicContact CG-CG2 4.22Å; M18-V262 HydrophobicContact SD-CB 3.71Å; M18-V262 HydrophobicContact SD-CG1 3.91Å; M18-V262 HydrophobicContact SD-CG2 3.38Å; M18-V262 WeakPolarHBondContact SD-CG2 3.43Å
19T86.6Confident86.9Confident13 Ų1344.4 Ų44.48%0.0823%0.234CC..Hα-helixtrans-62.4-50.5179.9-56.80000111.1L15 S16 V17 A22 A23 S274 A277 L281L15-T19 WeakPolarHBondContact O-CB 3.41Å; L15-T19 PolarHBondContact O-N 3.45Å; L15-T19 PolarHBondContact O-OG1 3.46Å; S16-T19 PolarHBondContact O-N 2.96Å; V17-T19 VanDerWaalsContact C-N 3.34Å; V17-T19 PolarHBondContact O-N 3.34Å; T19-A22 PolarHBondContact O-N 3.44Å; T19-A23 WeakPolarHBondContact O-CB 3.47Å; T19-A23 PolarHBondContact O-N 2.99Å; T19-S274 VanDerWaalsContact OG1-CA 3.24Å; T19-S274 WeakPolarHBondContact OG1-CA 3.49Å; T19-S274 WeakPolarHBondContact OG1-CB 3.38Å; T19-S274 PolarHBondContact OG1-OG 2.77Å; T19-A277 HydrophobicContact CG2-CB 3.46Å; T19-A277 VanDerWaalsContact CG2-CB 3.46Å; T19-L281 HydrophobicContact CG2-CD1 3.75Å
20L89.6Confident86.8Confident104 Ų10437.6 Ų37.655%0.54520%0.2SC..Hα-helixtrans-64.1-45.2-179-72.5171.6000111.3S16 V17 T24S16-L20 WeakPolarHBondContact O-CB 3.4Å; S16-L20 WeakPolarHBondContact O-CG 3.42Å; S16-L20 PolarHBondContact O-N 2.95Å; V17-L20 PolarHBondContact O-N 3.47Å; L20-T24 WeakPolarHBondContact O-CB 3.06Å; L20-T24 PolarHBondContact O-N 2.96Å; L20-T24 PolarHBondContact O-OG1 3.2Å
21V91.6Very high86.8Confident17 Ų1737.5 Ų37.510%0.10320%0.198CC..Hα-helixtrans-62.9-45.4177.9170.80000110.6V17 Y25 L251 V254V17-V21 HydrophobicContact CG1-CG2 4.03Å; V17-V21 VanDerWaalsContact O-CB 3.28Å; V17-V21 WeakPolarHBondContact O-CB 3.26Å; V17-V21 WeakPolarHBondContact O-CG2 3.44Å; V17-V21 PolarHBondContact O-N 2.9Å; V21-Y25 WeakPolarHBondContact O-CB 3.23Å; V21-Y25 PolarHBondContact O-N 2.89Å; V21-L251 HydrophobicContact CG1-CB 4.39Å; V21-L251 HydrophobicContact CG1-CD2 4.25Å; V21-L251 VanDerWaalsContact CG1-O 3.25Å; V21-L251 WeakPolarHBondContact CG1-O 3.46Å; V21-L251 HydrophobicContact CG2-CD2 4.29Å; V21-V254 HydrophobicContact CG2-CG1 4.08Å
22A87.2Confident87.2Confident36 Ų3634.7 Ų34.730%0.29819%0.186SC..Hα-helixtrans-64.2-46.8-17900000112.4M18 T19 T26 A278M18-A22 WeakPolarHBondContact O-CB 3.5Å; M18-A22 PolarHBondContact O-N 3.27Å; T19-A22 PolarHBondContact O-N 3.44Å; A22-T26 PolarHBondContact O-N 3.37Å; A22-T26 PolarHBondContact O-OG1 3.19Å; A22-A278 HydrophobicContact CB-CB 3.85Å
23A86.8Confident87.2Confident8 Ų833 Ų337%0.06617%0.172CC..Hα-helixtrans-63.2-51.4177.600000111.1T19 Y25 T26 V27 A278 L281T19-A23 WeakPolarHBondContact O-CB 3.47Å; T19-A23 PolarHBondContact O-N 2.99Å; A23-Y25 PolarHBondContact O-N 3.45Å; A23-T26 PolarHBondContact O-N 2.88Å; A23-T26 PolarHBondContact O-OG1 2.88Å; A23-V27 WeakPolarHBondContact O-CG2 3.39Å; A23-V27 PolarHBondContact O-N 3.29Å; A23-V27 VanDerWaalsContact O-N 3.15Å; A23-A278 HydrophobicContact CB-CB 4.37Å; A23-L281 HydrophobicContact CB-CB 3.82Å; A23-L281 HydrophobicContact CB-CD1 4.37Å
24T90.6Very high86.6Confident51 Ų5128 Ų2831%0.31315%0.154SC..Hα-helixtrans-61.6-44.6-178.9-50.90000111.1L20 T26 V27 V28 F247 L251L20-T24 WeakPolarHBondContact O-CB 3.06Å; L20-T24 PolarHBondContact O-N 2.96Å; L20-T24 PolarHBondContact O-OG1 3.2Å; T24-T26 VanDerWaalsContact C-N 3.33Å; T24-T26 PolarHBondContact O-N 3.25Å; T24-V27 PolarHBondContact O-N 3.48Å; T24-V28 HydrophobicContact CG2-CG2 3.83Å; T24-V28 WeakPolarHBondContact O-CB 3.43Å; T24-V28 VanDerWaalsContact O-CG2 3.26Å; T24-V28 WeakPolarHBondContact O-CG2 3.38Å; T24-V28 PolarHBondContact O-N 3.19Å; T24-F247 HydrophobicContact CG2-CE1 3.96Å; T24-F247 HydrophobicContact CG2-CZ 4.26Å; T24-L251 HydrophobicContact CG2-CD1 3.7Å
25Y90.9Very high85.9Confident39 Ų3932.1 Ų32.115%0.15318%0.179CC..Hα-helixtrans-54.3-49.5177168.4-103.2000111.1V21 A23 V27 L29 V248 L251 A252V21-Y25 WeakPolarHBondContact O-CB 3.23Å; V21-Y25 PolarHBondContact O-N 2.89Å; A23-Y25 PolarHBondContact O-N 3.45Å; Y25-V27 PolarHBondContact O-N 3.35Å; Y25-L29 HydrophobicContact CE1-CD2 4Å; Y25-L29 HydrophobicContact CE2-CD2 4.04Å; Y25-L29 WeakPolarHBondContact O-CB 3.47Å; Y25-L29 PolarHBondContact O-N 3.37Å; Y25-L29 VanDerWaalsContact OH-CD2 3.32Å; Y25-L29 WeakPolarHBondContact OH-CD2 3.38Å; Y25-V248 HydrophobicContact CD2-CG1 4.06Å; Y25-V248 HydrophobicContact CE2-CG1 3.72Å; Y25-L251 HydrophobicContact CD2-CB 4.32Å; Y25-A252 HydrophobicContact CD2-CB 4.14Å; Y25-A252 HydrophobicContact CE2-CB 3.73Å
26T85.7Confident84.9Confident4 Ų431.6 Ų31.63%0.02518%0.179CC..Hα-helixtrans-65.8-40.1-177.848.20000113.6A22 A23 T24 R30 Y116 Q117A22-T26 PolarHBondContact O-N 3.37Å; A22-T26 PolarHBondContact O-OG1 3.19Å; A23-T26 PolarHBondContact O-N 2.88Å; A23-T26 PolarHBondContact O-OG1 2.88Å; T24-T26 VanDerWaalsContact C-N 3.33Å; T24-T26 PolarHBondContact O-N 3.25Å; T26-R30 WeakPolarHBondContact O-CB 3.49Å; T26-R30 PolarHBondContact O-N 2.92Å; T26-Y116 HydrophobicContact CG2-CD1 4.42Å; T26-Y116 HydrophobicContact CG2-CE1 4.29Å; T26-Q117 HydrophobicContact CG2-CG 4.04Å; T26-Q117 PolarHBondContact OG1-NE2 3.45Å
27V86.3Confident83.5Confident16 Ų1630.9 Ų30.910%0.09717%0.174CC..Hα-helixtrans-69.8-48.1180173.60000110.9A23 T24 Y25 R30 Y31 A285 L289 F290A23-V27 WeakPolarHBondContact O-CG2 3.39Å; A23-V27 PolarHBondContact O-N 3.29Å; A23-V27 VanDerWaalsContact O-N 3.15Å; T24-V27 PolarHBondContact O-N 3.48Å; Y25-V27 PolarHBondContact O-N 3.35Å; V27-R30 PolarHBondContact O-N 3.47Å; V27-Y31 WeakPolarHBondContact O-CB 3.42Å; V27-Y31 PolarHBondContact O-N 3.33Å; V27-A285 HydrophobicContact CG1-CB 4.39Å; V27-A285 HydrophobicContact CG2-CB 3.72Å; V27-L289 HydrophobicContact CG1-CD1 3.74Å; V27-F290 HydrophobicContact CG1-CE2 4.09Å; V27-F290 HydrophobicContact CG1-CZ 4.35Å
28V90.4Very high82.3Confident15 Ų1537.3 Ų37.39%0.09121%0.213CC..Hα-helixtrans-68.2-40.1-179.5-177.50000110.5T24 R30 Y31 T32 W244 F247 V248T24-V28 HydrophobicContact CG2-CG2 3.83Å; T24-V28 WeakPolarHBondContact O-CB 3.43Å; T24-V28 VanDerWaalsContact O-CG2 3.26Å; T24-V28 WeakPolarHBondContact O-CG2 3.38Å; T24-V28 PolarHBondContact O-N 3.19Å; V28-R30 VanDerWaalsContact C-N 3.35Å; V28-R30 PolarHBondContact O-N 2.99Å; V28-Y31 WeakPolarHBondContact O-CB 3.42Å; V28-Y31 PolarHBondContact O-N 2.81Å; V28-T32 HydrophobicContact CG1-CG2 4.38Å; V28-T32 WeakPolarHBondContact O-CG2 3.28Å; V28-T32 PolarHBondContact O-N 2.98Å; V28-W244 HydrophobicContact CG1-CE3 3.97Å; V28-F247 HydrophobicContact CG1-CD1 4.1Å; V28-F247 HydrophobicContact CG2-CD1 4.21Å; V28-F247 HydrophobicContact CG2-CE1 4.14Å; V28-V248 HydrophobicContact CB-CG2 4.07Å; V28-V248 HydrophobicContact CG1-CG2 3.55Å
29L88.8Confident81.7Confident0 Ų037.8 Ų37.80%022%0.221CC..Hα-helixtrans-58.8-48.3174.8174.851.8000110.3Y25 Y31 T32 R33 Y41 F105 L108 V248Y25-L29 HydrophobicContact CE1-CD2 4Å; Y25-L29 HydrophobicContact CE2-CD2 4.04Å; Y25-L29 WeakPolarHBondContact O-CB 3.47Å; Y25-L29 PolarHBondContact O-N 3.37Å; Y25-L29 VanDerWaalsContact OH-CD2 3.32Å; Y25-L29 WeakPolarHBondContact OH-CD2 3.38Å; L29-Y31 VanDerWaalsContact C-N 3.35Å; L29-Y31 PolarHBondContact O-N 3.02Å; L29-T32 PolarHBondContact O-N 2.54Å; L29-T32 PolarHBondContact O-OG1 2.74Å; L29-R33 HydrophobicContact CD1-CG 3.95Å; L29-R33 WeakPolarHBondContact O-CG 3.21Å; L29-R33 PolarHBondContact O-N 3.41Å; L29-R33 VanDerWaalsContact O-N 3.15Å; L29-Y41 WeakPolarHBondContact CD1-OH 3.31Å; L29-F105 HydrophobicContact CD1-CD1 3.66Å; L29-F105 HydrophobicContact CD1-CE1 3.39Å; L29-F105 HydrophobicContact CD1-CZ 4.09Å; L29-F105 HydrophobicContact CD2-CD1 4.41Å; L29-F105 HydrophobicContact CD2-CE1 4.29Å; L29-F105 HydrophobicContact CD2-CZ 4.35Å; L29-L108 HydrophobicContact CB-CD1 4.5Å; L29-L108 HydrophobicContact CD2-CB 4.48Å; L29-L108 HydrophobicContact CD2-CD1 3.34Å; L29-L108 HydrophobicContact CG-CB 4.47Å; L29-L108 HydrophobicContact CG-CD1 3.91Å; L29-V248 HydrophobicContact CB-CG1 4.12Å; L29-V248 HydrophobicContact CB-CG2 4.28Å; L29-V248 HydrophobicContact CD1-CG1 4.07Å
30R83.6Confident81.6Confident5 Ų542.3 Ų42.32%0.01924%0.242CC..Hα-helixtrans-55.8-49.9174.7-17862.8174.2165.94111.3T26 V27 V28 T32 R33 T34 L108 S109 L111 A113 F290T26-R30 WeakPolarHBondContact O-CB 3.49Å; T26-R30 PolarHBondContact O-N 2.92Å; V27-R30 PolarHBondContact O-N 3.47Å; V28-R30 VanDerWaalsContact C-N 3.35Å; V28-R30 PolarHBondContact O-N 2.99Å; R30-T32 VanDerWaalsContact C-N 3.32Å; R30-T32 PolarHBondContact O-N 3.07Å; R30-R33 PolarHBondContact O-N 3.22Å; R30-T34 VanDerWaalsContact NH1-CG2 3.32Å; R30-T34 PolarHBondContact O-N 3.05Å; R30-T34 PolarHBondContact O-OG1 3.34Å; R30-L108 VanDerWaalsContact CD-O 3.28Å; R30-L108 WeakPolarHBondContact CD-O 3.28Å; R30-L108 PolarHBondContact NH1-O 3.04Å; R30-S109 PolarHBondContact NH1-O 3.43Å; R30-L111 VanDerWaalsContact CZ-O 3.24Å; R30-L111 PolarHBondContact NH1-O 3.37Å; R30-L111 VanDerWaalsContact NH1-O 3.1Å; R30-A113 HydrophobicContact CB-CB 4.23Å; R30-A113 HydrophobicContact CG-CB 4.39Å; R30-F290 HydrophobicContact CG-CE2 4.31Å; R30-F290 HydrophobicContact CG-CZ 4.39Å
31Y85.1Confident81.6Confident79 Ų7937.6 Ų37.631%0.3122%0.217SC..Hα-helixtrans-54-44.7177.2178.3-98.3000113V27 V28 L29 R33 T34 V35 S36 W244 F290V27-Y31 WeakPolarHBondContact O-CB 3.42Å; V27-Y31 PolarHBondContact O-N 3.33Å; V28-Y31 WeakPolarHBondContact O-CB 3.42Å; V28-Y31 PolarHBondContact O-N 2.81Å; L29-Y31 VanDerWaalsContact C-N 3.35Å; L29-Y31 PolarHBondContact O-N 3.02Å; Y31-R33 PolarHBondContact O-N 3.1Å; Y31-T34 PolarHBondContact O-N 3.3Å; Y31-V35 HydrophobicContact CD2-CB 3.77Å; Y31-V35 HydrophobicContact CD2-CG1 4.13Å; Y31-V35 HydrophobicContact CD2-CG2 4.2Å; Y31-V35 HydrophobicContact CE2-CB 3.74Å; Y31-V35 HydrophobicContact CE2-CG1 3.6Å; Y31-V35 HydrophobicContact CE2-CG2 4.49Å; Y31-V35 PolarHBondContact O-N 3.38Å; Y31-S36 PolarHBondContact O-N 2.78Å; Y31-S36 VanDerWaalsContact O-N 3.12Å; Y31-W244 HydrophobicContact CD1-CG 4.4Å; Y31-W244 AromaticContact CE1-CD1 3.86Å; Y31-W244 HydrophobicContact CE1-CD2 4.32Å; Y31-W244 HydrophobicContact CE1-CG 4.11Å; Y31-W244 AromaticContact CE1-NE1 3.92Å; Y31-F290 HydrophobicContact CD2-CE1 4.34Å
32T87.8Confident81.5Confident2 Ų237.1 Ų37.11%0.01221%0.214CC..Hα-helixtrans-66.3-24.1178640000113.6V28 L29 R30 Y41 W244 V245 V248V28-T32 HydrophobicContact CG1-CG2 4.38Å; V28-T32 WeakPolarHBondContact O-CG2 3.28Å; V28-T32 PolarHBondContact O-N 2.98Å; L29-T32 PolarHBondContact O-N 2.54Å; L29-T32 PolarHBondContact O-OG1 2.74Å; R30-T32 VanDerWaalsContact C-N 3.32Å; R30-T32 PolarHBondContact O-N 3.07Å; T32-Y41 PolarHBondContact OG1-OH 3.35Å; T32-W244 HydrophobicContact CG2-CB 3.62Å; T32-V245 HydrophobicContact CG2-CG2 4.21Å; T32-V248 HydrophobicContact CG2-CG2 3.99Å
33R83.6Confident81.5Confident33 Ų3336.1 Ų36.113%0.12521%0.205CC..Hα-helixtrans-93.1-20.4-179.1-62.4-58.9-64.8170.5-0.6113.5L29 R30 Y31 Y41 S109L29-R33 HydrophobicContact CD1-CG 3.95Å; L29-R33 WeakPolarHBondContact O-CG 3.21Å; L29-R33 PolarHBondContact O-N 3.41Å; L29-R33 VanDerWaalsContact O-N 3.15Å; R30-R33 PolarHBondContact O-N 3.22Å; Y31-R33 PolarHBondContact O-N 3.1Å; R33-Y41 PolarHBondContact NH1-O 3.45Å; R33-S109 PolarHBondContact NE-OG 2.7Å; R33-S109 PolarHBondContact NH2-OG 3.3Å
34T76.6Confident81.7Confident16 Ų1636.2 Ų36.210%0.09820%0.204CC..Hα-helixtrans-121.5-30.1-172.754.90000116.6R30 Y31 V167R30-T34 VanDerWaalsContact NH1-CG2 3.32Å; R30-T34 PolarHBondContact O-N 3.05Å; R30-T34 PolarHBondContact O-OG1 3.34Å; Y31-T34 PolarHBondContact O-N 3.3Å; T34-V167 HydrophobicContact CG2-CG1 3.75Å
35V69.4Low81.8Confident87 Ų8733.8 Ų33.853%0.52719%0.189SC..THydrogen-bonded Turntrans-117.3-35.1-171.1-177.30000111.8Y31 F290Y31-V35 HydrophobicContact CD2-CB 3.77Å; Y31-V35 HydrophobicContact CD2-CG1 4.13Å; Y31-V35 HydrophobicContact CD2-CG2 4.2Å; Y31-V35 HydrophobicContact CE2-CB 3.74Å; Y31-V35 HydrophobicContact CE2-CG1 3.6Å; Y31-V35 HydrophobicContact CE2-CG2 4.49Å; Y31-V35 PolarHBondContact O-N 3.38Å; V35-F290 HydrophobicContact CG2-CE1 4.28Å
36S60.7Low81.9Confident33 Ų3332 Ų3223%0.23118%0.183CC..SBendtrans-87.6-2.9-164.9-169.10000116.2Y31Y31-S36 PolarHBondContact O-N 2.78Å; Y31-S36 VanDerWaalsContact O-N 3.12Å
37S57.3Low82.1Confident39 Ų3931.8 Ų31.827%0.27318%0.182SC..  trans-140.3116.6-167.6-94.50000115.6A39S37-A39 VanDerWaalsContact CB-O 3.31Å; S37-A39 WeakPolarHBondContact CB-O 3.05Å; S37-A39 PolarHBondContact O-N 2.99Å; S37-A39 PolarHBondContact OG-O 2.65Å
38T63Low82.5Confident164 Ų16431.3 Ų31.3100%1.00618%0.179SC*.SBendtrans-64.2-25.1162.2-34.60000111.7
39A74.6Confident82.8Confident32 Ų3232.3 Ų32.326%0.26418%0.183SC..SBendtrans-135.4123.5173.400000110.1S37 Y239 S240S37-A39 VanDerWaalsContact CB-O 3.31Å; S37-A39 WeakPolarHBondContact CB-O 3.05Å; S37-A39 PolarHBondContact O-N 2.99Å; S37-A39 PolarHBondContact OG-O 2.65Å; A39-Y239 HydrophobicContact CB-CE1 4.06Å; A39-S240 WeakPolarHBondContact CB-OG 3.31Å; A39-S240 WeakPolarHBondContact O-CB 3.17Å; A39-S240 PolarHBondContact O-OG 3.27Å
40M83.4Confident83Confident109 Ų10932.8 Ų32.854%0.53719%0.186SC..PPolyproline II helixtrans-71.8135.3-177.5-71-168.9-80.600112.1
41Y89.3Confident83.5Confident4 Ų433 Ų332%0.01619%0.187CC..PPolyproline II helixtrans-72.6155.2167.170.2-83000111L29 T32 R33 S43 A46 F105 V245L29-Y41 WeakPolarHBondContact CD1-OH 3.31Å; T32-Y41 PolarHBondContact OG1-OH 3.35Å; R33-Y41 PolarHBondContact NH1-O 3.45Å; Y41-S43 PolarHBondContact O-N 3.25Å; Y41-A46 HydrophobicContact CD2-CB 4.26Å; Y41-A46 HydrophobicContact CE2-CB 3.86Å; Y41-F105 HydrophobicContact CE2-CE1 4.06Å; Y41-F105 WeakPolarHBondContact OH-CE1 3.4Å; Y41-V245 HydrophobicContact CD1-CG1 4.38Å; Y41-V245 HydrophobicContact CD1-CG2 3.52Å; Y41-V245 HydrophobicContact CD2-CG1 3.89Å; Y41-V245 HydrophobicContact CD2-CG2 4.5Å; Y41-V245 HydrophobicContact CE1-CG1 4.42Å; Y41-V245 HydrophobicContact CE1-CG2 3.61Å; Y41-V245 HydrophobicContact CE2-CG1 3.94Å; Y41-V245 HydrophobicContact CG-CG1 4.12Å; Y41-V245 HydrophobicContact CG-CG2 4Å
42F89.8Confident84Confident8 Ų831 Ų314%0.03518%0.184CC..PPolyproline II helixtrans-71.3117.2174.3-59.4-59.7000110.2T44 T45 E228 Q231 V232 K235 Y239F42-T44 PolarHBondContact O-N 3.25Å; F42-T45 HydrophobicContact CB-CG2 3.86Å; F42-T45 PolarHBondContact O-N 3.31Å; F42-T45 PolarHBondContact O-OG1 3.45Å; F42-E228 WeakPolarHBondContact CB-OE2 3.39Å; F42-E228 HydrophobicContact CD1-CB 4.07Å; F42-E228 HydrophobicContact CD1-CG 4.12Å; F42-E228 HydrophobicContact CE1-CB 4.43Å; F42-Q231 HydrophobicContact CE1-CB 3.8Å; F42-Q231 HydrophobicContact CZ-CB 3.61Å; F42-V232 HydrophobicContact CD2-CG2 3.61Å; F42-V232 HydrophobicContact CE2-CG2 3.79Å; F42-V232 HydrophobicContact CG-CG2 4.01Å; F42-V232 HydrophobicContact CZ-CG2 4.33Å; F42-K235 HydrophobicContact CE2-CB 4.45Å; F42-K235 HydrophobicContact CZ-CD 4.22Å; F42-Y239 HydrophobicContact CE2-CD1 4.23Å; F42-Y239 HydrophobicContact CE2-CG 4.42Å; F42-Y239 HydrophobicContact CZ-CD1 4.5Å
43S88.4Confident84.4Confident14 Ų1433.4 Ų33.410%0.09820%0.195CC..Hα-helixtrans-66.7-29.7179.747.60000111.9Y41 T45 A46 V47 F105Y41-S43 PolarHBondContact O-N 3.25Å; S43-T45 PolarHBondContact O-N 2.87Å; S43-A46 PolarHBondContact O-N 3.22Å; S43-V47 WeakPolarHBondContact O-CG2 2.78Å; S43-V47 PolarHBondContact O-N 3.16Å; S43-V47 VanDerWaalsContact O-N 3.09Å; S43-F105 VanDerWaalsContact CB-CD1 3.48Å
44T89.9Confident84.9Confident10 Ų1032.7 Ų32.76%0.06119%0.193CC..Hα-helixtrans-66.3-38.4-178.362.60000111.8F42 V47 C48 N102 V224 T227 E228F42-T44 PolarHBondContact O-N 3.25Å; T44-V47 PolarHBondContact O-N 3Å; T44-C48 PolarHBondContact O-N 3.42Å; T44-N102 WeakPolarHBondContact CG2-OD1 3.41Å; T44-V224 WeakPolarHBondContact OG1-CG2 3.39Å; T44-T227 WeakPolarHBondContact CG2-OG1 3.04Å; T44-E228 WeakPolarHBondContact CB-OE2 3.44Å; T44-E228 VanDerWaalsContact CG2-OE2 3.23Å; T44-E228 WeakPolarHBondContact CG2-OE2 3.35Å; T44-E228 PolarHBondContact OG1-OE2 3.35Å
45T92.9Very high85.8Confident0 Ų032.9 Ų32.90%019%0.194CC..Hα-helixtrans-68.3-37176.962.20000110.8F42 S43 C48 I49 V224 V232 F237 Y241F42-T45 HydrophobicContact CB-CG2 3.86Å; F42-T45 PolarHBondContact O-N 3.31Å; F42-T45 PolarHBondContact O-OG1 3.45Å; S43-T45 PolarHBondContact O-N 2.87Å; T45-C48 WeakPolarHBondContact O-CB 3.28Å; T45-C48 PolarHBondContact O-N 2.68Å; T45-I49 WeakPolarHBondContact O-CG1 3.31Å; T45-I49 PolarHBondContact O-N 3.31Å; T45-V224 HydrophobicContact CG2-CG1 3.83Å; T45-V224 HydrophobicContact CG2-CG2 4.06Å; T45-V232 HydrophobicContact CG2-CG2 4.1Å; T45-F237 HydrophobicContact CG2-CD1 4.25Å; T45-F237 HydrophobicContact CG2-CD2 3.85Å; T45-F237 HydrophobicContact CG2-CE1 4.11Å; T45-F237 HydrophobicContact CG2-CE2 3.72Å; T45-F237 HydrophobicContact CG2-CG 4.12Å; T45-F237 HydrophobicContact CG2-CZ 3.86Å; T45-Y241 WeakPolarHBondContact CB-OH 3.44Å; T45-Y241 PolarHBondContact O-OH 3.26Å; T45-Y241 PolarHBondContact OG1-OH 3.14Å
46A92.5Very high87Confident1 Ų135.4 Ų35.41%0.00820%0.198CC..Hα-helixtrans-65.1-40.8176.300000111.8Y41 S43 T50 F105 Y241 V249Y41-A46 HydrophobicContact CD2-CB 4.26Å; Y41-A46 HydrophobicContact CE2-CB 3.86Å; S43-A46 PolarHBondContact O-N 3.22Å; A46-T50 PolarHBondContact O-N 2.91Å; A46-T50 PolarHBondContact O-OG1 3.16Å; A46-F105 HydrophobicContact CB-CE1 4.36Å; A46-F105 HydrophobicContact CB-CZ 4.23Å; A46-Y241 VanDerWaalsContact CA-OH 3.29Å; A46-Y241 WeakPolarHBondContact CA-OH 3.48Å; A46-Y241 PolarHBondContact N-OH 3.45Å; A46-V249 HydrophobicContact CB-CG2 3.87Å
47V91.6Very high88.6Confident1 Ų137.1 Ų37.11%0.00620%0.204CC..Hα-helixtrans-63.2-43.8173.2176.30000110.8S43 T44 I49 T50 E51 N101 F105 T220S43-V47 WeakPolarHBondContact O-CG2 2.78Å; S43-V47 PolarHBondContact O-N 3.16Å; S43-V47 VanDerWaalsContact O-N 3.09Å; T44-V47 PolarHBondContact O-N 3Å; V47-I49 PolarHBondContact O-N 3.41Å; V47-T50 VanDerWaalsContact O-CB 3.32Å; V47-T50 WeakPolarHBondContact O-CB 3.26Å; V47-T50 PolarHBondContact O-N 2.96Å; V47-E51 PolarHBondContact O-N 3.2Å; V47-N101 HydrophobicContact CG1-CB 3.7Å; V47-N101 HydrophobicContact CG2-CB 3.99Å; V47-F105 HydrophobicContact CG2-CD2 3.83Å; V47-F105 HydrophobicContact CG2-CE2 3.58Å; V47-F105 HydrophobicContact CG2-CZ 4.36Å; V47-T220 HydrophobicContact CG1-CG2 3.81Å
48C94Very high90.3Very high5 Ų535.2 Ų35.23%0.03419%0.191CC..Hα-helixtrans-59.6-48.2177.4-174.90000112.4T44 T45 T50 E51 V52 V224 F237T44-C48 PolarHBondContact O-N 3.42Å; T45-C48 WeakPolarHBondContact O-CB 3.28Å; T45-C48 PolarHBondContact O-N 2.68Å; C48-T50 VanDerWaalsContact C-N 3.25Å; C48-T50 PolarHBondContact O-N 3.21Å; C48-E51 PolarHBondContact O-N 3.48Å; C48-E51 VanDerWaalsContact O-N 3.16Å; C48-V52 WeakPolarHBondContact O-CG2 3.27Å; C48-V52 PolarHBondContact O-N 3.44Å; C48-V224 HydrophobicContact CB-CG2 4.28Å; C48-F237 HydrophobicContact CB-CZ 4.29Å
49I95.4Very high91.7Very high37 Ų3729.7 Ų29.719%0.1916%0.155CC..Hα-helixtrans-64.7-32.2178.4-62.5-63.6000111.5T45 V47 E51 V52 I53 F237 F238 V249T45-I49 WeakPolarHBondContact O-CG1 3.31Å; T45-I49 PolarHBondContact O-N 3.31Å; V47-I49 PolarHBondContact O-N 3.41Å; I49-E51 VanDerWaalsContact C-N 3.32Å; I49-E51 PolarHBondContact O-N 2.81Å; I49-V52 WeakPolarHBondContact O-CB 3.45Å; I49-V52 PolarHBondContact O-N 3.4Å; I49-I53 HydrophobicContact CG2-CD1 4.03Å; I49-I53 HydrophobicContact CG2-CG1 4.2Å; I49-I53 WeakPolarHBondContact O-CG1 3.4Å; I49-I53 PolarHBondContact O-N 3.09Å; I49-F237 HydrophobicContact CD1-CE1 3.79Å; I49-F237 HydrophobicContact CD1-CZ 4.38Å; I49-F237 HydrophobicContact CG1-CE1 3.82Å; I49-F237 HydrophobicContact CG1-CZ 4.45Å; I49-F238 HydrophobicContact CD1-CE1 3.92Å; I49-F238 HydrophobicContact CD1-CZ 4Å; I49-F238 HydrophobicContact CG1-CE1 4.03Å; I49-V249 HydrophobicContact CB-CG1 4.1Å; I49-V249 HydrophobicContact CG2-CG1 3.68Å
50T93.8Very high92.5Very high9 Ų930.1 Ų30.16%0.05516%0.163CC..Hα-helixtrans-59.7-42.6174.2-57.90000111.4A46 V47 C48 I53 K54 A252 S253A46-T50 PolarHBondContact O-N 2.91Å; A46-T50 PolarHBondContact O-OG1 3.16Å; V47-T50 VanDerWaalsContact O-CB 3.32Å; V47-T50 WeakPolarHBondContact O-CB 3.26Å; V47-T50 PolarHBondContact O-N 2.96Å; C48-T50 VanDerWaalsContact C-N 3.25Å; C48-T50 PolarHBondContact O-N 3.21Å; T50-I53 PolarHBondContact O-N 3.35Å; T50-K54 HydrophobicContact CG2-CD 4.45Å; T50-K54 WeakPolarHBondContact O-CB 3.5Å; T50-K54 VanDerWaalsContact O-CG 3.31Å; T50-K54 WeakPolarHBondContact O-CG 3.49Å; T50-K54 PolarHBondContact O-N 3.32Å; T50-A252 HydrophobicContact CG2-CB 3.64Å; T50-S253 PolarHBondContact O-OG 3.24Å
51E94.1Very high92.8Very high9 Ų928.6 Ų28.64%0.04216%0.155CC..Hα-helixtrans-65.1-39.8175.4-60.9-55.1141.700112V47 C48 I49 K54 L55 Y213 I217 T220V47-E51 PolarHBondContact O-N 3.2Å; C48-E51 PolarHBondContact O-N 3.48Å; C48-E51 VanDerWaalsContact O-N 3.16Å; I49-E51 VanDerWaalsContact C-N 3.32Å; I49-E51 PolarHBondContact O-N 2.81Å; E51-K54 VanDerWaalsContact CD-CE 3.46Å; E51-K54 PolarHBondContact O-N 3.01Å; E51-K54 WeakPolarHBondContact OE1-CE 3.44Å; E51-K54 IonicContact OE1-NZ 3.28Å; E51-K54 PolarHBondContact OE1-NZ 3.11Å; E51-K54 WeakPolarHBondContact OE2-CE 3.3Å; E51-K54 IonicContact OE2-NZ 2.96Å; E51-K54 PolarHBondContact OE2-NZ 3.32Å; E51-L55 PolarHBondContact O-N 2.75Å; E51-Y213 WeakPolarHBondContact OE2-CD1 3.3Å; E51-I217 HydrophobicContact CB-CG1 3.75Å; E51-T220 HydrophobicContact CG-CG2 4.06Å
52V96.1Very high92.9Very high39 Ų3928.5 Ų28.524%0.23616%0.155CC..Hα-helixtrans-60.9-48.2176.1175.50000111.4C48 I49 K54 L55 F56 I217C48-V52 WeakPolarHBondContact O-CG2 3.27Å; C48-V52 PolarHBondContact O-N 3.44Å; I49-V52 WeakPolarHBondContact O-CB 3.45Å; I49-V52 PolarHBondContact O-N 3.4Å; V52-K54 PolarHBondContact O-N 3.42Å; V52-L55 WeakPolarHBondContact O-CB 3.39Å; V52-L55 PolarHBondContact O-N 3.22Å; V52-F56 HydrophobicContact CG1-CD2 3.85Å; V52-F56 HydrophobicContact CG1-CE2 3.52Å; V52-F56 WeakPolarHBondContact O-CD2 3.33Å; V52-F56 PolarHBondContact O-N 3.27Å; V52-F56 VanDerWaalsContact O-N 3.14Å; V52-I217 HydrophobicContact CG2-CD1 3.98Å; V52-I217 HydrophobicContact CG2-CG1 3.91Å; V52-I217 HydrophobicContact CG2-CG2 4.3Å
53I95.8Very high93Very high51 Ų5129.6 Ų29.626%0.26216%0.162SC..Hα-helixtrans-64.7-42.8179.1-66.1178.8000110.8I49 T50 L55 F56 L57 V249 S253I49-I53 HydrophobicContact CG2-CD1 4.03Å; I49-I53 HydrophobicContact CG2-CG1 4.2Å; I49-I53 WeakPolarHBondContact O-CG1 3.4Å; I49-I53 PolarHBondContact O-N 3.09Å; T50-I53 PolarHBondContact O-N 3.35Å; I53-L55 VanDerWaalsContact C-N 3.27Å; I53-L55 PolarHBondContact O-N 3.41Å; I53-F56 PolarHBondContact O-N 2.95Å; I53-L57 HydrophobicContact CG2-CD1 3.79Å; I53-L57 HydrophobicContact CG2-CG 4.18Å; I53-L57 WeakPolarHBondContact O-CB 3.33Å; I53-L57 WeakPolarHBondContact O-CG 3.18Å; I53-L57 PolarHBondContact O-N 3.3Å; I53-V249 HydrophobicContact CD1-CG1 3.8Å; I53-S253 WeakPolarHBondContact CB-OG 3.38Å
54K94.2Very high93Very high18 Ų1837 Ų378%0.07819%0.193CC..Hα-helixtrans-60.3-36.4176.1-75.5-174.8-57179.70112.5T50 E51 V52 S58 Y213 L257T50-K54 HydrophobicContact CG2-CD 4.45Å; T50-K54 WeakPolarHBondContact O-CB 3.5Å; T50-K54 VanDerWaalsContact O-CG 3.31Å; T50-K54 WeakPolarHBondContact O-CG 3.49Å; T50-K54 PolarHBondContact O-N 3.32Å; E51-K54 VanDerWaalsContact CD-CE 3.46Å; E51-K54 PolarHBondContact O-N 3.01Å; E51-K54 WeakPolarHBondContact OE1-CE 3.44Å; E51-K54 IonicContact OE1-NZ 3.28Å; E51-K54 PolarHBondContact OE1-NZ 3.11Å; E51-K54 WeakPolarHBondContact OE2-CE 3.3Å; E51-K54 IonicContact OE2-NZ 2.96Å; E51-K54 PolarHBondContact OE2-NZ 3.32Å; V52-K54 PolarHBondContact O-N 3.42Å; K54-S58 VanDerWaalsContact O-CB 3.28Å; K54-S58 WeakPolarHBondContact O-CB 3.35Å; K54-S58 PolarHBondContact O-N 2.85Å; K54-S58 PolarHBondContact O-OG 3.45Å; K54-Y213 HydrophobicContact CB-CD1 4.32Å; K54-Y213 HydrophobicContact CB-CD2 3.79Å; K54-Y213 HydrophobicContact CB-CE1 4.19Å; K54-Y213 HydrophobicContact CB-CE2 3.65Å; K54-Y213 HydrophobicContact CB-CG 4.14Å; K54-Y213 HydrophobicContact CD-CE1 3.89Å; K54-L257 HydrophobicContact CG-CG 4.42Å
55L94.9Very high93Very high20 Ų2041 Ų4111%0.10521%0.211CC..Hα-helixtrans-61.6-51.5173.8177.165.1000111E51 V52 I53 L57 S58 L59 I210 L214 I217E51-L55 PolarHBondContact O-N 2.75Å; V52-L55 WeakPolarHBondContact O-CB 3.39Å; V52-L55 PolarHBondContact O-N 3.22Å; I53-L55 VanDerWaalsContact C-N 3.27Å; I53-L55 PolarHBondContact O-N 3.41Å; L55-L57 PolarHBondContact O-N 2.94Å; L55-S58 PolarHBondContact O-N 2.83Å; L55-L59 HydrophobicContact CD1-CD1 4.32Å; L55-L59 HydrophobicContact CD1-CG 4.44Å; L55-L59 HydrophobicContact CG-CD1 4.13Å; L55-L59 WeakPolarHBondContact O-CG 3.38Å; L55-L59 PolarHBondContact O-N 3.42Å; L55-I210 HydrophobicContact CD1-CB 4.19Å; L55-I210 HydrophobicContact CD1-CG1 4.07Å; L55-I210 HydrophobicContact CD1-CG2 3.86Å; L55-L214 HydrophobicContact CD1-CD2 4.29Å; L55-L214 HydrophobicContact CD1-CG 4.11Å; L55-L214 HydrophobicContact CD2-CD2 3.82Å; L55-L214 HydrophobicContact CD2-CG 4.45Å; L55-I217 HydrophobicContact CB-CD1 4.18Å; L55-I217 HydrophobicContact CD2-CD1 3.56Å; L55-I217 HydrophobicContact CG-CD1 4.49Å
56F95.1Very high92.7Very high141 Ų14142 Ų4262%0.61822%0.217SC*.Hα-helixtrans-61-43.6179.2-76.9-66.4000112.8V52 I53 S58 L59 G60V52-F56 HydrophobicContact CG1-CD2 3.85Å; V52-F56 HydrophobicContact CG1-CE2 3.52Å; V52-F56 WeakPolarHBondContact O-CD2 3.33Å; V52-F56 PolarHBondContact O-N 3.27Å; V52-F56 VanDerWaalsContact O-N 3.14Å; I53-F56 PolarHBondContact O-N 2.95Å; F56-S58 VanDerWaalsContact C-N 3.33Å; F56-S58 PolarHBondContact O-N 3.38Å; F56-L59 PolarHBondContact O-N 3.36Å; F56-G60 PolarHBondContact O-N 3.38Å
57L94.1Very high92.4Very high68 Ų6844.9 Ų44.936%0.35625%0.247SC..Hα-helixtrans-64-38.7176.1-69.6175.7000111.7I53 L55 G60 M61 L257I53-L57 HydrophobicContact CG2-CD1 3.79Å; I53-L57 HydrophobicContact CG2-CG 4.18Å; I53-L57 WeakPolarHBondContact O-CB 3.33Å; I53-L57 WeakPolarHBondContact O-CG 3.18Å; I53-L57 PolarHBondContact O-N 3.3Å; L55-L57 PolarHBondContact O-N 2.94Å; L57-G60 PolarHBondContact O-N 2.95Å; L57-M61 WeakPolarHBondContact O-CG 3.44Å; L57-M61 PolarHBondContact O-N 3.14Å; L57-L257 HydrophobicContact CB-CD1 3.37Å; L57-L257 HydrophobicContact CD1-CD1 3.47Å; L57-L257 VanDerWaalsContact CD1-CD1 3.47Å; L57-L257 HydrophobicContact CG-CD1 4.06Å
58S92.7Very high92.2Very high0 Ų047.2 Ų47.20%026%0.263CS..Hα-helixtrans-68.2-37.2176.5-59.30000112.5K54 L55 F56 M61 L62 Y213 L257K54-S58 VanDerWaalsContact O-CB 3.28Å; K54-S58 WeakPolarHBondContact O-CB 3.35Å; K54-S58 PolarHBondContact O-N 2.85Å; K54-S58 PolarHBondContact O-OG 3.45Å; L55-S58 PolarHBondContact O-N 2.83Å; F56-S58 VanDerWaalsContact C-N 3.33Å; F56-S58 PolarHBondContact O-N 3.38Å; S58-M61 PolarHBondContact O-N 3.2Å; S58-L62 WeakPolarHBondContact O-CB 3.4Å; S58-L62 PolarHBondContact O-N 3.15Å; S58-Y213 VanDerWaalsContact OG-CE2 3.29Å; S58-Y213 WeakPolarHBondContact OG-CE2 3.18Å; S58-L257 WeakPolarHBondContact OG-CD2 3.5Å
59L92.4Very high91.7Very high47 Ų4754 Ų5425%0.24629%0.293CS..Hα-helixtrans-62.8-42.9172-74167.2000111.4L55 F56 M61 L62 T63 I76 I210L55-L59 HydrophobicContact CD1-CD1 4.32Å; L55-L59 HydrophobicContact CD1-CG 4.44Å; L55-L59 HydrophobicContact CG-CD1 4.13Å; L55-L59 WeakPolarHBondContact O-CG 3.38Å; L55-L59 PolarHBondContact O-N 3.42Å; F56-L59 PolarHBondContact O-N 3.36Å; L59-M61 VanDerWaalsContact C-N 3.35Å; L59-M61 PolarHBondContact O-N 3.5Å; L59-L62 PolarHBondContact O-N 3.07Å; L59-T63 WeakPolarHBondContact O-CB 3.4Å; L59-T63 PolarHBondContact O-N 3.27Å; L59-T63 PolarHBondContact O-OG1 3.27Å; L59-I76 HydrophobicContact CD2-CD1 3.72Å; L59-I210 HydrophobicContact CD2-CD1 3.65Å; L59-I210 HydrophobicContact CD2-CG1 4.19Å; L59-I210 HydrophobicContact CG-CD1 4.13Å; L59-I210 HydrophobicContact CG-CG1 4.28Å
60G91.9Very high91.2Very high42 Ų4254.6 Ų54.643%0.43331%0.307SS..Hα-helixtrans-59.8-44.3174.300000112.4F56 L57 T63 K64F56-G60 PolarHBondContact O-N 3.38Å; L57-G60 PolarHBondContact O-N 2.95Å; G60-T63 WeakPolarHBondContact O-CB 3.41Å; G60-T63 PolarHBondContact O-N 3.02Å; G60-K64 PolarHBondContact O-N 3.49Å
61M91Very high90.7Very high76 Ų7661.6 Ų61.637%0.37433%0.333SS..Hα-helixtrans-67.6-38.6177.3-69.2-60.2-70.100113L57 S58 L59 T63 K64 E65 W206L57-M61 WeakPolarHBondContact O-CG 3.44Å; L57-M61 PolarHBondContact O-N 3.14Å; S58-M61 PolarHBondContact O-N 3.2Å; L59-M61 VanDerWaalsContact C-N 3.35Å; L59-M61 PolarHBondContact O-N 3.5Å; M61-T63 VanDerWaalsContact C-N 3.32Å; M61-K64 PolarHBondContact O-N 3.34Å; M61-E65 PolarHBondContact O-N 3.15Å; M61-W206 HydrophobicContact CB-CD2 3.43Å; M61-W206 VanDerWaalsContact CB-CD2 3.43Å; M61-W206 HydrophobicContact CB-CE3 3.62Å; M61-W206 HydrophobicContact CB-CG 3.95Å; M61-W206 HydrophobicContact CB-CH2 4.01Å; M61-W206 HydrophobicContact CB-CZ2 3.85Å; M61-W206 HydrophobicContact CB-CZ3 3.9Å; M61-W206 HydrophobicContact CE-CH2 3.76Å; M61-W206 HydrophobicContact CE-CZ2 3.34Å; M61-W206 HydrophobicContact CG-CD2 4.29Å; M61-W206 HydrophobicContact CG-CE3 4.1Å; M61-W206 HydrophobicContact CG-CH2 3.79Å; M61-W206 HydrophobicContact CG-CZ2 3.99Å; M61-W206 HydrophobicContact CG-CZ3 3.85Å
62L90.9Very high90.3Very high2 Ų262 Ų621%0.0134%0.335CS..Hα-helixtrans-65.6-36.6173.8-175.760.8000111.8S58 L59 K64 E65 T66 L72 I76 W206 V207 I210S58-L62 WeakPolarHBondContact O-CB 3.4Å; S58-L62 PolarHBondContact O-N 3.15Å; L59-L62 PolarHBondContact O-N 3.07Å; L62-K64 VanDerWaalsContact C-N 3.32Å; L62-K64 PolarHBondContact O-N 2.91Å; L62-E65 PolarHBondContact O-N 3.17Å; L62-T66 HydrophobicContact CD1-CG2 4.08Å; L62-T66 HydrophobicContact CG-CG2 4.37Å; L62-T66 WeakPolarHBondContact O-CB 3.23Å; L62-T66 WeakPolarHBondContact O-CG2 3.26Å; L62-T66 PolarHBondContact O-N 3.07Å; L62-T66 PolarHBondContact O-OG1 3.02Å; L62-L72 HydrophobicContact CB-CD1 4.06Å; L62-L72 HydrophobicContact CD2-CD1 3.7Å; L62-L72 HydrophobicContact CG-CD1 3.66Å; L62-I76 HydrophobicContact CD2-CG1 4.34Å; L62-W206 HydrophobicContact CB-CB 3.89Å; L62-W206 HydrophobicContact CD1-CB 4.26Å; L62-V207 HydrophobicContact CD1-CG2 3.81Å; L62-V207 HydrophobicContact CD2-CG2 3.83Å; L62-I210 HydrophobicContact CB-CD1 4.24Å; L62-I210 HydrophobicContact CD2-CD1 3.57Å
63T90.6Very high89.9Confident32 Ų3267.4 Ų67.420%0.19636%0.355CS..Hα-helixtrans-62.1-43174.2-53.10000110.5L59 G60 M61 T66 G67 F69 L72L59-T63 WeakPolarHBondContact O-CB 3.4Å; L59-T63 PolarHBondContact O-N 3.27Å; L59-T63 PolarHBondContact O-OG1 3.27Å; G60-T63 WeakPolarHBondContact O-CB 3.41Å; G60-T63 PolarHBondContact O-N 3.02Å; M61-T63 VanDerWaalsContact C-N 3.32Å; T63-T66 PolarHBondContact O-OG1 2.99Å; T63-G67 PolarHBondContact O-N 3.4Å; T63-F69 HydrophobicContact CG2-CD1 4.37Å; T63-F69 HydrophobicContact CG2-CE1 4.01Å; T63-F69 HydrophobicContact CG2-CZ 4.1Å; T63-L72 HydrophobicContact CG2-CD2 4.37Å; T63-L72 VanDerWaalsContact OG1-CD2 3.3Å; T63-L72 WeakPolarHBondContact OG1-CD2 3.29Å
64K90.1Very high89.4Confident169 Ų16967.6 Ų67.674%0.73536%0.364SS*.Hα-helixtrans-65.5-39.4175.7-172.2178.7177.5179.10112.5G60 M61 L62G60-K64 PolarHBondContact O-N 3.49Å; M61-K64 PolarHBondContact O-N 3.34Å; L62-K64 VanDerWaalsContact C-N 3.32Å; L62-K64 PolarHBondContact O-N 2.91Å
65E88.4Confident89Confident94 Ų9467.6 Ų67.644%0.43937%0.367SS..Hα-helixtrans-68.5-40.9177.9-174.6179.4-145.400112.3M61 L62 S204 W206M61-E65 PolarHBondContact O-N 3.15Å; L62-E65 PolarHBondContact O-N 3.17Å; E65-S204 PolarHBondContact OE1-OG 3.46Å; E65-S204 WeakPolarHBondContact OE2-CB 3.31Å; E65-S204 PolarHBondContact OE2-OG 3.28Å; E65-W206 VanDerWaalsContact OE2-CD1 3.27Å
66T86.8Confident88.7Confident21 Ų2168.4 Ų68.413%0.12937%0.37CS..Hα-helixtrans-78.8-23.2-17952.40000113.3L62 T63 S68 R71L62-T66 HydrophobicContact CD1-CG2 4.08Å; L62-T66 HydrophobicContact CG-CG2 4.37Å; L62-T66 WeakPolarHBondContact O-CB 3.23Å; L62-T66 WeakPolarHBondContact O-CG2 3.26Å; L62-T66 PolarHBondContact O-N 3.07Å; L62-T66 PolarHBondContact O-OG1 3.02Å; T63-T66 PolarHBondContact O-OG1 2.99Å; T66-S68 PolarHBondContact O-N 2.91Å; T66-S68 VanDerWaalsContact O-N 3.09Å; T66-R71 PolarHBondContact O-NE 3.49Å; T66-R71 PolarHBondContact O-NH1 2.99Å; T66-R71 VanDerWaalsContact O-NH1 3.12Å; T66-R71 PolarHBondContact O-NH2 2.9Å
67G85.7Confident88.3Confident62 Ų6264.8 Ų64.864%0.63936%0.36SS*.  trans67.54.6176.200000115.1T63T63-G67 PolarHBondContact O-N 3.4Å
68S88.2Confident87.9Confident50 Ų5067 Ų6735%0.3537%0.369SS..SBendtrans-158.1135.7178.3175.20000111.4T66 G70 R71 L72T66-S68 PolarHBondContact O-N 2.91Å; T66-S68 VanDerWaalsContact O-N 3.09Å; S68-G70 PolarHBondContact O-N 3.36Å; S68-G70 PolarHBondContact OG-N 3.09Å; S68-R71 PolarHBondContact O-N 3.29Å; S68-L72 PolarHBondContact O-N 3.32Å
69F83.7Confident87.6Confident148 Ų14869.4 Ų69.465%0.64938%0.38SS*.Hα-helixtrans-60.7-28.3175.9-77.2-80.3000113.7T63 L72 K73T63-F69 HydrophobicContact CG2-CD1 4.37Å; T63-F69 HydrophobicContact CG2-CE1 4.01Å; T63-F69 HydrophobicContact CG2-CZ 4.1Å; F69-L72 HydrophobicContact CD1-CD2 4.1Å; F69-K73 WeakPolarHBondContact O-CG 3.43Å; F69-K73 PolarHBondContact O-N 3.35Å; F69-K73 VanDerWaalsContact O-N 3.09Å
70G83.9Confident87.1Confident48 Ų4867.8 Ų67.850%0.49537%0.371SS..Hα-helixtrans-68-45175.500000112.1S68 K73 A74S68-G70 PolarHBondContact O-N 3.36Å; S68-G70 PolarHBondContact OG-N 3.09Å; G70-K73 PolarHBondContact O-N 2.85Å; G70-A74 PolarHBondContact O-N 2.84Å
71R84.7Confident86.7Confident157 Ų15772.9 Ų72.959%0.59238%0.382SS*.Hα-helixtrans-68.4-33.9176-74.6-172.4-87.4157.9-3.9112.3T66 S68 A74 S75T66-R71 PolarHBondContact O-NE 3.49Å; T66-R71 PolarHBondContact O-NH1 2.99Å; T66-R71 VanDerWaalsContact O-NH1 3.12Å; T66-R71 PolarHBondContact O-NH2 2.9Å; S68-R71 PolarHBondContact O-N 3.29Å; R71-A74 PolarHBondContact O-N 2.84Å; R71-S75 VanDerWaalsContact O-CB 3.3Å; R71-S75 WeakPolarHBondContact O-CB 3.36Å; R71-S75 PolarHBondContact O-N 3.48Å
72L85.9Confident86.4Confident16 Ų1678.8 Ų78.88%0.08440%0.4CS..Hα-helixtrans-58.2-52.6170.2176.371.4000111.5L62 T63 S68 F69 A74 S75 I76L62-L72 HydrophobicContact CB-CD1 4.06Å; L62-L72 HydrophobicContact CD2-CD1 3.7Å; L62-L72 HydrophobicContact CG-CD1 3.66Å; T63-L72 HydrophobicContact CG2-CD2 4.37Å; T63-L72 VanDerWaalsContact OG1-CD2 3.3Å; T63-L72 WeakPolarHBondContact OG1-CD2 3.29Å; S68-L72 PolarHBondContact O-N 3.32Å; F69-L72 HydrophobicContact CD1-CD2 4.1Å; L72-A74 VanDerWaalsContact C-N 3.33Å; L72-A74 PolarHBondContact O-N 2.97Å; L72-S75 PolarHBondContact O-N 3.14Å; L72-I76 HydrophobicContact CD1-CD1 3.9Å; L72-I76 HydrophobicContact CD1-CG1 4.34Å; L72-I76 HydrophobicContact CG-CD1 3.91Å; L72-I76 WeakPolarHBondContact O-CG1 3.32Å; L72-I76 PolarHBondContact O-N 3.01Å
73K86.3Confident86.1Confident154 Ų15480.3 Ų80.367%0.6741%0.411SS*.Hα-helixtrans-59.6-44.9179.6-75.8-175.8-179.4-175.80111.3F69 G70 S75 I76 V77F69-K73 WeakPolarHBondContact O-CG 3.43Å; F69-K73 PolarHBondContact O-N 3.35Å; F69-K73 VanDerWaalsContact O-N 3.09Å; G70-K73 PolarHBondContact O-N 2.85Å; K73-S75 PolarHBondContact O-N 3.31Å; K73-I76 PolarHBondContact O-N 2.99Å; K73-V77 WeakPolarHBondContact O-CB 3.38Å; K73-V77 VanDerWaalsContact O-CG2 3.25Å; K73-V77 WeakPolarHBondContact O-CG2 3.39Å; K73-V77 PolarHBondContact O-N 2.9Å
74A86.7Confident85.9Confident54 Ų5482.7 Ų82.745%0.44643%0.427SS..Hα-helixtrans-58.8-48176.400000111.6G70 R71 L72 I76 V77 E78G70-A74 PolarHBondContact O-N 2.84Å; R71-A74 PolarHBondContact O-N 2.84Å; L72-A74 VanDerWaalsContact C-N 3.33Å; L72-A74 PolarHBondContact O-N 2.97Å; A74-I76 PolarHBondContact O-N 3.44Å; A74-V77 PolarHBondContact O-N 3.06Å; A74-E78 VanDerWaalsContact O-CB 3.27Å; A74-E78 WeakPolarHBondContact O-CB 3.35Å; A74-E78 PolarHBondContact O-N 3.35Å
75S86.1Confident85.7Confident19 Ų1982.6 Ų82.613%0.13343%0.427CS..Hα-helixtrans-62.8-40179.5-169.90000113R71 L72 K73 H79R71-S75 VanDerWaalsContact O-CB 3.3Å; R71-S75 WeakPolarHBondContact O-CB 3.36Å; R71-S75 PolarHBondContact O-N 3.48Å; L72-S75 PolarHBondContact O-N 3.14Å; K73-S75 PolarHBondContact O-N 3.31Å; S75-H79 WeakPolarHBondContact O-CB 3.43Å; S75-H79 PolarHBondContact O-CD2 3.2Å; S75-H79 PolarHBondContact O-N 3.45Å; S75-H79 PolarHBondContact OG-CD2 3.4Å
76I87.1Confident85.5Confident36 Ų3679.9 Ų79.919%0.18541%0.414CS..Hα-helixtrans-66.6-45.9174.9-68.4171.7000110.5L59 L62 L72 K73 A74 V80 F81L59-I76 HydrophobicContact CD2-CD1 3.72Å; L62-I76 HydrophobicContact CD2-CG1 4.34Å; L72-I76 HydrophobicContact CD1-CD1 3.9Å; L72-I76 HydrophobicContact CD1-CG1 4.34Å; L72-I76 HydrophobicContact CG-CD1 3.91Å; L72-I76 WeakPolarHBondContact O-CG1 3.32Å; L72-I76 PolarHBondContact O-N 3.01Å; K73-I76 PolarHBondContact O-N 2.99Å; A74-I76 PolarHBondContact O-N 3.44Å; I76-V80 HydrophobicContact CG2-CB 4.25Å; I76-V80 HydrophobicContact CG2-CG2 4.21Å; I76-V80 VanDerWaalsContact O-CA 3.32Å; I76-V80 WeakPolarHBondContact O-CA 3.35Å; I76-V80 WeakPolarHBondContact O-CB 3.4Å; I76-V80 PolarHBondContact O-N 2.98Å; I76-F81 HydrophobicContact CG2-CD2 4.05Å; I76-F81 HydrophobicContact CG2-CE2 3.86Å; I76-F81 PolarHBondContact O-N 3.15Å
77V87.1Confident85.4Confident65 Ų6581.5 Ų81.539%0.39442%0.422SS..Iπ-helixtrans-62-49.8-179.9169.50000110.4K73 A74 F81 W82K73-V77 WeakPolarHBondContact O-CB 3.38Å; K73-V77 VanDerWaalsContact O-CG2 3.25Å; K73-V77 WeakPolarHBondContact O-CG2 3.39Å; K73-V77 PolarHBondContact O-N 2.9Å; A74-V77 PolarHBondContact O-N 3.06Å; V77-F81 WeakPolarHBondContact O-CB 3.46Å; V77-F81 PolarHBondContact O-N 2.75Å; V77-W82 VanDerWaalsContact CG1-CD1 3.42Å; V77-W82 PolarHBondContact O-N 3.06Å
78E86.8Confident85.5Confident116 Ų11684.4 Ų84.454%0.54242%0.422SS..Iπ-helixtrans-64.5-51.1-179-174.3177.2-178.700112.7A74 W82 S83A74-E78 VanDerWaalsContact O-CB 3.27Å; A74-E78 WeakPolarHBondContact O-CB 3.35Å; A74-E78 PolarHBondContact O-N 3.35Å; E78-W82 WeakPolarHBondContact O-CB 3.36Å; E78-S83 PolarHBondContact O-OG 3.33Å
79H84.7Confident85.6Confident50 Ų5086.2 Ų86.223%0.23142%0.423CS..Iπ-helixtrans-92.7-19.9-172.3-60.7-52.6000114.4S75 S83 V207 Q211S75-H79 WeakPolarHBondContact O-CB 3.43Å; S75-H79 PolarHBondContact O-CD2 3.2Å; S75-H79 PolarHBondContact O-N 3.45Å; S75-H79 PolarHBondContact OG-CD2 3.4Å; H79-S83 WeakPolarHBondContact O-CB 3.42Å; H79-V207 HydrophobicContact CB-CG1 3.43Å; H79-V207 VanDerWaalsContact CB-CG1 3.43Å; H79-Q211 PolarHBondContact O-NE2 3.36Å
80V83.1Confident85.8Confident12 Ų1279.2 Ų79.27%0.07339%0.392CS..Iπ-helixtrans-102.2-55178.5-173.50000110.6I76 I210 Q211 L214I76-V80 HydrophobicContact CG2-CB 4.25Å; I76-V80 HydrophobicContact CG2-CG2 4.21Å; I76-V80 VanDerWaalsContact O-CA 3.32Å; I76-V80 WeakPolarHBondContact O-CA 3.35Å; I76-V80 WeakPolarHBondContact O-CB 3.4Å; I76-V80 PolarHBondContact O-N 2.98Å; V80-I210 HydrophobicContact CG2-CG2 4.05Å; V80-Q211 HydrophobicContact CG2-CG 4.33Å; V80-L214 HydrophobicContact CG1-CD1 3.49Å; V80-L214 VanDerWaalsContact CG1-CD1 3.49Å
81F82.5Confident86Confident149 Ų14978.3 Ų78.365%0.65438%0.379SS*.Iπ-helixtrans-78.7-41.6-174.2-72.4-81.9000113.1I76 V77 S83I76-F81 HydrophobicContact CG2-CD2 4.05Å; I76-F81 HydrophobicContact CG2-CE2 3.86Å; I76-F81 PolarHBondContact O-N 3.15Å; V77-F81 WeakPolarHBondContact O-CB 3.46Å; V77-F81 PolarHBondContact O-N 2.75Å; F81-S83 VanDerWaalsContact C-N 3.34Å
82W85.6Confident86.4Confident201 Ų20173.5 Ų73.576%0.76137%0.367SS*.SBendtrans-86.7-0.7-179.8-68.5113000114.5V77 E78 P84V77-W82 VanDerWaalsContact CG1-CD1 3.42Å; V77-W82 PolarHBondContact O-N 3.06Å; E78-W82 WeakPolarHBondContact O-CB 3.36Å; W82-P84 VanDerWaalsContact O-CD 3.29Å; W82-P84 WeakPolarHBondContact O-CD 3.49Å
83S84.9Confident86.5Confident33 Ų3372.7 Ų72.723%0.23136%0.363CS..  trans-12058.1-179.7-590000113.2E78 H79 F81 K85 E86 L87E78-S83 PolarHBondContact O-OG 3.33Å; H79-S83 WeakPolarHBondContact O-CB 3.42Å; F81-S83 VanDerWaalsContact C-N 3.34Å; S83-K85 PolarHBondContact O-N 3.21Å; S83-K85 VanDerWaalsContact O-N 3.17Å; S83-E86 PolarHBondContact O-N 3.12Å; S83-L87 PolarHBondContact O-N 2.88Å
84P85.5Confident86.6Confident83 Ų8365.6 Ų65.654%0.53933%0.332SS..Hα-helixtrans-62.7-27.3-176.526.2-35.3000113.2W82 E86 L87 L88W82-P84 VanDerWaalsContact O-CD 3.29Å; W82-P84 WeakPolarHBondContact O-CD 3.49Å; P84-E86 VanDerWaalsContact C-N 3.31Å; P84-E86 PolarHBondContact O-N 3.21Å; P84-L87 PolarHBondContact O-N 3.29Å; P84-L88 WeakPolarHBondContact O-CB 3.47Å; P84-L88 PolarHBondContact O-N 3.05Å
85K86.3Confident86.8Confident167 Ų16766 Ų6673%0.72633%0.329SS*.Hα-helixtrans-63.8-37.1174.7-65.8-178.7-179.2176.70112.1S83 K89S83-K85 PolarHBondContact O-N 3.21Å; S83-K85 VanDerWaalsContact O-N 3.17Å; K85-K89 VanDerWaalsContact O-CG 3.3Å; K85-K89 WeakPolarHBondContact O-CG 3.19Å; K85-K89 PolarHBondContact O-N 2.88Å
86E84.2Confident87.1Confident36 Ų3666.4 Ų66.417%0.16833%0.331CS..Hα-helixtrans-74.1-37.9178.7-64.2-58.3122.100111.1S83 P84 L88 K89 L90 R208S83-E86 PolarHBondContact O-N 3.12Å; P84-E86 VanDerWaalsContact C-N 3.31Å; P84-E86 PolarHBondContact O-N 3.21Å; E86-L88 VanDerWaalsContact C-N 3.34Å; E86-K89 PolarHBondContact O-N 3.4Å; E86-K89 IonicContact OE1-NZ 2.9Å; E86-K89 PolarHBondContact OE1-NZ 3.49Å; E86-L90 PolarHBondContact O-N 2.96Å; E86-R208 IonicContact OE2-CZ 2.7Å; E86-R208 VanDerWaalsContact OE2-CZ 3.28Å; E86-R208 IonicContact OE2-NH1 2.72Å; E86-R208 PolarHBondContact OE2-NH1 2.93Å; E86-R208 IonicContact OE2-NH2 3.92Å; E86-R208 PolarHBondContact OE2-NH2 2.93Å
87L84.8Confident87.2Confident56 Ų5667.3 Ų67.329%0.29333%0.332SS..Hα-helixtrans-60-44.3171.6-168.371.3000111.4S83 P84 L90 S91 Q211 L214S83-L87 PolarHBondContact O-N 2.88Å; P84-L87 PolarHBondContact O-N 3.29Å; L87-L90 CarbonylContact O-C 3.58Å; L87-L90 PolarHBondContact O-N 3.08Å; L87-S91 PolarHBondContact O-N 3.41Å; L87-Q211 HydrophobicContact CD1-CB 4.21Å; L87-Q211 VanDerWaalsContact CD1-O 3.28Å; L87-Q211 WeakPolarHBondContact CD1-O 3.18Å; L87-L214 HydrophobicContact CD1-CB 4.43Å
88L88.3Confident87.3Confident122 Ų12264.5 Ų64.564%0.63932%0.316SS*.Hα-helixtrans-67.6-37.4177.7-173.866.1000112.7P84 E86 L90 S91P84-L88 WeakPolarHBondContact O-CB 3.47Å; P84-L88 PolarHBondContact O-N 3.05Å; E86-L88 VanDerWaalsContact C-N 3.34Å; L88-L90 VanDerWaalsContact C-N 3.31Å; L88-L90 PolarHBondContact O-N 3.19Å; L88-S91 PolarHBondContact O-N 3.11Å; L88-S91 PolarHBondContact O-OG 3.47Å
89K88.9Confident87.4Confident89 Ų8961.7 Ų61.739%0.38731%0.307SS..Hα-helixtrans-62.3-41.6173.2-73.8170-172.9171.80111.2K85 E86 P93 Y193 V197K85-K89 VanDerWaalsContact O-CG 3.3Å; K85-K89 WeakPolarHBondContact O-CG 3.19Å; K85-K89 PolarHBondContact O-N 2.88Å; E86-K89 PolarHBondContact O-N 3.4Å; E86-K89 IonicContact OE1-NZ 2.9Å; E86-K89 PolarHBondContact OE1-NZ 3.49Å; K89-P93 WeakPolarHBondContact O-CD 3.19Å; K89-Y193 WeakPolarHBondContact O-CE1 3.41Å; K89-V197 HydrophobicContact CB-CG2 4.48Å
90L87.7Confident87.7Confident0 Ų059.9 Ų59.90%030%0.298CS..Hα-helixtrans-82.1-12-178.8-70.8170000114E86 L87 L88 V92 P93 S94 F194 V197 Q211 M212E86-L90 PolarHBondContact O-N 2.96Å; L87-L90 CarbonylContact O-C 3.58Å; L87-L90 PolarHBondContact O-N 3.08Å; L88-L90 VanDerWaalsContact C-N 3.31Å; L88-L90 PolarHBondContact O-N 3.19Å; L90-V92 VanDerWaalsContact C-N 3.3Å; L90-P93 HydrophobicContact CD2-CG 4.27Å; L90-P93 VanDerWaalsContact O-CD 3.3Å; L90-P93 WeakPolarHBondContact O-CD 3.23Å; L90-P93 VanDerWaalsContact O-CG 3.31Å; L90-P93 WeakPolarHBondContact O-CG 3.31Å; L90-S94 WeakPolarHBondContact O-CB 3.49Å; L90-S94 PolarHBondContact O-N 3.39Å; L90-S94 PolarHBondContact O-OG 3.44Å; L90-F194 HydrophobicContact CD2-CD2 3.83Å; L90-F194 HydrophobicContact CD2-CE2 4.14Å; L90-V197 HydrophobicContact CD1-CG1 4.41Å; L90-V197 HydrophobicContact CD2-CB 4.04Å; L90-V197 HydrophobicContact CD2-CG1 3.75Å; L90-V197 HydrophobicContact CD2-CG2 4.42Å; L90-V197 HydrophobicContact CG-CG1 4Å; L90-Q211 HydrophobicContact CD1-CB 3.47Å; L90-Q211 VanDerWaalsContact CD1-CB 3.47Å; L90-Q211 HydrophobicContact CD1-CG 4.31Å; L90-M212 HydrophobicContact CB-CB 4.37Å
91S89.6Confident88Confident29 Ų2961.2 Ų61.220%0.20331%0.305CS..Hα-helixtrans-68-32.2170.173.50000112L87 L88 S94 V95 S215L87-S91 PolarHBondContact O-N 3.41Å; L88-S91 PolarHBondContact O-N 3.11Å; L88-S91 PolarHBondContact O-OG 3.47Å; S91-S94 WeakPolarHBondContact O-CB 3.4Å; S91-S94 PolarHBondContact O-N 3.24Å; S91-V95 WeakPolarHBondContact O-CG2 3.29Å; S91-V95 PolarHBondContact O-N 2.92Å; S91-S215 WeakPolarHBondContact CA-OG 3.37Å
92V91.6Very high88.2Confident56 Ų5655.6 Ų55.634%0.33928%0.281SS..Hα-helixtrans-57.2-58.7176.4178.40000112.2L90 S94 V95 V96 F189 Y193L90-V92 VanDerWaalsContact C-N 3.3Å; V92-S94 PolarHBondContact O-N 3.08Å; V92-V95 PolarHBondContact O-N 3.35Å; V92-V96 WeakPolarHBondContact O-CG2 3.45Å; V92-V96 PolarHBondContact O-N 3.36Å; V92-F189 HydrophobicContact CG1-CE1 4Å; V92-F189 HydrophobicContact CG1-CZ 4.33Å; V92-Y193 HydrophobicContact CB-CE1 4.49Å; V92-Y193 HydrophobicContact CB-CE2 4.41Å; V92-Y193 HydrophobicContact CG1-CD2 4.3Å; V92-Y193 HydrophobicContact CG1-CE2 4.03Å
93P89.2Confident88.4Confident0 Ų048.5 Ų48.50%026%0.258CS..Hα-helixtrans-63.7-29.4176.624.9-33.4000112.2K89 L90 V96 Y97 A190 Y193K89-P93 WeakPolarHBondContact O-CD 3.19Å; L90-P93 HydrophobicContact CD2-CG 4.27Å; L90-P93 VanDerWaalsContact O-CD 3.3Å; L90-P93 WeakPolarHBondContact O-CD 3.23Å; L90-P93 VanDerWaalsContact O-CG 3.31Å; L90-P93 WeakPolarHBondContact O-CG 3.31Å; P93-V96 PolarHBondContact O-N 3.36Å; P93-Y97 HydrophobicContact CB-CD2 4.34Å; P93-Y97 HydrophobicContact CB-CE2 4.27Å; P93-Y97 WeakPolarHBondContact O-CB 3.32Å; P93-Y97 WeakPolarHBondContact O-CD2 3.18Å; P93-Y97 PolarHBondContact O-N 3.34Å; P93-A190 HydrophobicContact CB-CB 4.19Å; P93-Y193 HydrophobicContact CB-CD1 4.43Å; P93-Y193 HydrophobicContact CG-CD1 3.93Å; P93-Y193 HydrophobicContact CG-CE1 4.46Å
94S88.3Confident88.5Confident5 Ų547.2 Ų47.24%0.03525%0.249CC..Hα-helixtrans-64.6-43176.6-57.10000113L90 S91 V92 V96 Y97 A98 M212 S215L90-S94 WeakPolarHBondContact O-CB 3.49Å; L90-S94 PolarHBondContact O-N 3.39Å; L90-S94 PolarHBondContact O-OG 3.44Å; S91-S94 WeakPolarHBondContact O-CB 3.4Å; S91-S94 PolarHBondContact O-N 3.24Å; V92-S94 PolarHBondContact O-N 3.08Å; S94-V96 VanDerWaalsContact C-N 3.33Å; S94-Y97 PolarHBondContact O-N 3.23Å; S94-A98 WeakPolarHBondContact O-CB 3.34Å; S94-A98 PolarHBondContact O-N 3.39Å; S94-M212 WeakPolarHBondContact OG-CG 3.34Å; S94-M212 PolarHBondContact OG-O 3.32Å; S94-S215 WeakPolarHBondContact CB-OG 3.45Å; S94-S215 PolarHBondContact OG-OG 3.38Å
95V91.4Very high88.5Confident63 Ų6343.5 Ų43.538%0.38222%0.224SC..Hα-helixtrans-60.9-46.4174.1173.80000110.5S91 V92 Y97 A98 V99 V219S91-V95 WeakPolarHBondContact O-CG2 3.29Å; S91-V95 PolarHBondContact O-N 2.92Å; V92-V95 PolarHBondContact O-N 3.35Å; V95-Y97 VanDerWaalsContact C-N 3.34Å; V95-Y97 PolarHBondContact O-N 3.19Å; V95-A98 WeakPolarHBondContact O-CB 3.44Å; V95-A98 PolarHBondContact O-N 2.91Å; V95-V99 PolarHBondContact O-N 3.02Å; V95-V219 HydrophobicContact CB-CG1 4.36Å; V95-V219 HydrophobicContact CG1-CG1 4.47Å; V95-V219 HydrophobicContact CG2-CB 4.38Å; V95-V219 HydrophobicContact CG2-CG1 4Å; V95-V219 HydrophobicContact CG2-CG2 3.55Å
96V92.6Very high88.5Confident27 Ų2738.3 Ų38.316%0.16420%0.204CC..Hα-helixtrans-65.9-38.8-179179.70000111.2V92 P93 S94 V99 Q100 C186 F189 A190V92-V96 WeakPolarHBondContact O-CG2 3.45Å; V92-V96 PolarHBondContact O-N 3.36Å; P93-V96 PolarHBondContact O-N 3.36Å; S94-V96 VanDerWaalsContact C-N 3.33Å; V96-V99 PolarHBondContact O-N 3.06Å; V96-Q100 WeakPolarHBondContact O-CB 3.37Å; V96-Q100 PolarHBondContact O-N 2.92Å; V96-C186 VanDerWaalsContact CG1-CA 3.44Å; V96-C186 HydrophobicContact CG1-CB 3.45Å; V96-C186 VanDerWaalsContact CG1-CB 3.45Å; V96-C186 VanDerWaalsContact CG1-O 3.31Å; V96-C186 WeakPolarHBondContact CG1-O 3.35Å; V96-F189 HydrophobicContact CB-CD1 4.41Å; V96-F189 HydrophobicContact CG1-CD1 4.13Å; V96-F189 HydrophobicContact CG2-CD1 3.89Å; V96-F189 HydrophobicContact CG2-CE1 3.99Å; V96-A190 HydrophobicContact CB-CB 3.97Å; V96-A190 HydrophobicContact CG1-CB 3.76Å
97Y89.4Confident88.7Confident54 Ų5436.6 Ų36.621%0.21220%0.196CC..Hα-helixtrans-65.7-37173-80.3-50.9000112.7P93 S94 V95 Q100 N101 A190 G191 M212P93-Y97 HydrophobicContact CB-CD2 4.34Å; P93-Y97 HydrophobicContact CB-CE2 4.27Å; P93-Y97 WeakPolarHBondContact O-CB 3.32Å; P93-Y97 WeakPolarHBondContact O-CD2 3.18Å; P93-Y97 PolarHBondContact O-N 3.34Å; S94-Y97 PolarHBondContact O-N 3.23Å; V95-Y97 VanDerWaalsContact C-N 3.34Å; V95-Y97 PolarHBondContact O-N 3.19Å; Y97-Q100 WeakPolarHBondContact O-CB 3.5Å; Y97-Q100 PolarHBondContact O-N 2.89Å; Y97-N101 WeakPolarHBondContact O-CB 3.49Å; Y97-N101 PolarHBondContact O-N 2.91Å; Y97-N101 PolarHBondContact O-ND2 2.8Å; Y97-A190 HydrophobicContact CD1-CB 3.93Å; Y97-A190 HydrophobicContact CD2-CB 3.94Å; Y97-A190 HydrophobicContact CE1-CB 3.67Å; Y97-A190 HydrophobicContact CE2-CB 3.72Å; Y97-A190 HydrophobicContact CG-CB 4.03Å; Y97-G191 WeakPolarHBondContact OH-CA 3.42Å; Y97-G191 PolarHBondContact OH-N 3.41Å; Y97-M212 HydrophobicContact CD2-SD 4.09Å; Y97-M212 HydrophobicContact CE2-SD 4.01Å
98A87.3Confident88.7Confident6 Ų633.9 Ų33.95%0.0518%0.182CC..Hα-helixtrans-62.2-44.5175.200000111.2S94 V95 N101 N102 V219 T220S94-A98 WeakPolarHBondContact O-CB 3.34Å; S94-A98 PolarHBondContact O-N 3.39Å; V95-A98 WeakPolarHBondContact O-CB 3.44Å; V95-A98 PolarHBondContact O-N 2.91Å; A98-N101 PolarHBondContact O-N 3.2Å; A98-N102 PolarHBondContact O-N 2.85Å; A98-N102 VanDerWaalsContact O-N 3.14Å; A98-N102 PolarHBondContact O-ND2 3.1Å; A98-V219 HydrophobicContact CB-CG1 3.92Å; A98-T220 HydrophobicContact CB-CG2 3.68Å
99V90Very high88.5Confident58 Ų5829.1 Ų29.135%0.35216%0.158SC..Hα-helixtrans-62.1-49173.9175.30000110.5V95 V96 N101 N102 M103 V182V95-V99 PolarHBondContact O-N 3.02Å; V96-V99 PolarHBondContact O-N 3.06Å; V99-N101 VanDerWaalsContact C-N 3.34Å; V99-N101 PolarHBondContact O-N 3.46Å; V99-N102 PolarHBondContact O-N 3.15Å; V99-M103 HydrophobicContact CG1-CG 4.23Å; V99-M103 WeakPolarHBondContact O-CB 3.45Å; V99-M103 VanDerWaalsContact O-CG 3.26Å; V99-M103 WeakPolarHBondContact O-CG 3.49Å; V99-M103 PolarHBondContact O-N 3.14Å; V99-V182 HydrophobicContact CG1-CG1 4.12Å
100Q91.6Very high88.2Confident11 Ų1126 Ų265%0.05115%0.146CC..Hα-helixtrans-55.1-47.4178.4-177-173.6-18.200112.4V96 Y97 M103 A104 Y120 A183 C186 S187V96-Q100 WeakPolarHBondContact O-CB 3.37Å; V96-Q100 PolarHBondContact O-N 2.92Å; Y97-Q100 WeakPolarHBondContact O-CB 3.5Å; Y97-Q100 PolarHBondContact O-N 2.89Å; Q100-M103 PolarHBondContact O-N 3.35Å; Q100-A104 PolarHBondContact O-N 2.93Å; Q100-Y120 PolarHBondContact NE2-OH 3.39Å; Q100-A183 HydrophobicContact CG-CB 4.23Å; Q100-A183 WeakPolarHBondContact CG-O 3.48Å; Q100-C186 HydrophobicContact CB-CB 3.71Å; Q100-C186 HydrophobicContact CG-CB 4.26Å; Q100-S187 PolarHBondContact NE2-OG 2.73Å; Q100-S187 VanDerWaalsContact OE1-CA 3.25Å
101N88.1Confident87.9Confident40 Ų4026.4 Ų26.421%0.21415%0.148CC..Hα-helixtrans-63.7-47.3-178.3-72.6-21.7000110.4V47 Y97 A98 V99 M103 A104 F105V47-N101 HydrophobicContact CG1-CB 3.7Å; V47-N101 HydrophobicContact CG2-CB 3.99Å; Y97-N101 WeakPolarHBondContact O-CB 3.49Å; Y97-N101 PolarHBondContact O-N 2.91Å; Y97-N101 PolarHBondContact O-ND2 2.8Å; A98-N101 PolarHBondContact O-N 3.2Å; V99-N101 VanDerWaalsContact C-N 3.34Å; V99-N101 PolarHBondContact O-N 3.46Å; N101-M103 VanDerWaalsContact C-N 3.35Å; N101-M103 PolarHBondContact O-N 2.85Å; N101-A104 WeakPolarHBondContact O-CB 3.24Å; N101-A104 PolarHBondContact O-N 3.34Å; N101-A104 VanDerWaalsContact O-N 3.15Å; N101-F105 WeakPolarHBondContact O-CD2 3.33Å; N101-F105 PolarHBondContact O-N 3.4Å
102N87.5Confident87.4Confident31 Ų3126 Ų2617%0.16614%0.144CC..Hα-helixtrans-61.3-42.1177-77.3-69.7000112.5T44 A98 V99 A104 F105 I106T44-N102 WeakPolarHBondContact CG2-OD1 3.41Å; A98-N102 PolarHBondContact O-N 2.85Å; A98-N102 VanDerWaalsContact O-N 3.14Å; A98-N102 PolarHBondContact O-ND2 3.1Å; V99-N102 PolarHBondContact O-N 3.15Å; N102-A104 VanDerWaalsContact C-N 3.29Å; N102-A104 PolarHBondContact O-N 3.27Å; N102-F105 WeakPolarHBondContact O-CB 3.42Å; N102-F105 PolarHBondContact O-N 3.26Å; N102-F105 VanDerWaalsContact O-N 3.15Å; N102-I106 WeakPolarHBondContact O-CG1 3.33Å; N102-I106 PolarHBondContact O-N 3.08Å
103M90.3Very high86.7Confident53 Ų5323.4 Ų23.426%0.26113%0.128SC..Hα-helixtrans-63.3-34.6176-67.6-61.7147.600112.4V99 Q100 N101 F105 I106 A107 A179 V182 A183V99-M103 HydrophobicContact CG1-CG 4.23Å; V99-M103 WeakPolarHBondContact O-CB 3.45Å; V99-M103 VanDerWaalsContact O-CG 3.26Å; V99-M103 WeakPolarHBondContact O-CG 3.49Å; V99-M103 PolarHBondContact O-N 3.14Å; Q100-M103 PolarHBondContact O-N 3.35Å; N101-M103 VanDerWaalsContact C-N 3.35Å; N101-M103 PolarHBondContact O-N 2.85Å; M103-F105 PolarHBondContact O-N 3.34Å; M103-I106 HydrophobicContact CE-CD1 4.29Å; M103-I106 PolarHBondContact O-N 3Å; M103-I106 HydrophobicContact SD-CD1 4.11Å; M103-A107 WeakPolarHBondContact O-CB 3.37Å; M103-A107 PolarHBondContact O-N 2.83Å; M103-A179 HydrophobicContact CB-CB 4.35Å; M103-A179 WeakPolarHBondContact O-CB 3.1Å; M103-A179 HydrophobicContact SD-CB 4.18Å; M103-V182 HydrophobicContact CG-CB 4.21Å; M103-V182 HydrophobicContact CG-CG1 3.92Å; M103-A183 HydrophobicContact CB-CB 3.95Å
104A87.1Confident86Confident5 Ų523.4 Ų23.44%0.04113%0.128CC..Hα-helixtrans-63.3-39173.700000112.5Q100 N101 N102 A107 L108 Y116Q100-A104 PolarHBondContact O-N 2.93Å; N101-A104 WeakPolarHBondContact O-CB 3.24Å; N101-A104 PolarHBondContact O-N 3.34Å; N101-A104 VanDerWaalsContact O-N 3.15Å; N102-A104 VanDerWaalsContact C-N 3.29Å; N102-A104 PolarHBondContact O-N 3.27Å; A104-A107 PolarHBondContact O-N 3.45Å; A104-L108 WeakPolarHBondContact O-CB 3.39Å; A104-L108 PolarHBondContact O-N 3.46Å; A104-Y116 HydrophobicContact CB-CE2 4.41Å; A104-Y116 WeakPolarHBondContact CB-OH 3.49Å
105F84.8Confident85.7Confident6 Ų623.4 Ų23.43%0.02613%0.128CC..Hα-helixtrans-65.4-43.2174.3-86-100.2000112L29 Y41 S43 A46 V47 N101 N102 M103 A107 L108 S109L29-F105 HydrophobicContact CD1-CD1 3.66Å; L29-F105 HydrophobicContact CD1-CE1 3.39Å; L29-F105 HydrophobicContact CD1-CZ 4.09Å; L29-F105 HydrophobicContact CD2-CD1 4.41Å; L29-F105 HydrophobicContact CD2-CE1 4.29Å; L29-F105 HydrophobicContact CD2-CZ 4.35Å; Y41-F105 HydrophobicContact CE2-CE1 4.06Å; Y41-F105 WeakPolarHBondContact OH-CE1 3.4Å; S43-F105 VanDerWaalsContact CB-CD1 3.48Å; A46-F105 HydrophobicContact CB-CE1 4.36Å; A46-F105 HydrophobicContact CB-CZ 4.23Å; V47-F105 HydrophobicContact CG2-CD2 3.83Å; V47-F105 HydrophobicContact CG2-CE2 3.58Å; V47-F105 HydrophobicContact CG2-CZ 4.36Å; N101-F105 WeakPolarHBondContact O-CD2 3.33Å; N101-F105 PolarHBondContact O-N 3.4Å; N102-F105 WeakPolarHBondContact O-CB 3.42Å; N102-F105 PolarHBondContact O-N 3.26Å; N102-F105 VanDerWaalsContact O-N 3.15Å; M103-F105 PolarHBondContact O-N 3.34Å; F105-A107 VanDerWaalsContact C-N 3.33Å; F105-L108 PolarHBondContact O-N 3.29Å; F105-S109 WeakPolarHBondContact O-CB 3.31Å; F105-S109 PolarHBondContact O-N 2.94Å; F105-S109 PolarHBondContact O-OG 2.84Å
106I87.1Confident85.4Confident57 Ų5720.9 Ų20.929%0.29211%0.111SC..Hα-helixtrans-61.8-44.7176.4-65.1169000110N102 M103 S109 N110 L175 A179N102-I106 WeakPolarHBondContact O-CG1 3.33Å; N102-I106 PolarHBondContact O-N 3.08Å; M103-I106 HydrophobicContact CE-CD1 4.29Å; M103-I106 PolarHBondContact O-N 3Å; M103-I106 HydrophobicContact SD-CD1 4.11Å; I106-S109 PolarHBondContact O-N 3.44Å; I106-N110 PolarHBondContact O-N 3.32Å; I106-N110 PolarHBondContact O-ND2 2.93Å; I106-L175 HydrophobicContact CG2-CD2 4.28Å; I106-L175 HydrophobicContact CG2-CG 4.12Å; I106-A179 HydrophobicContact CB-CB 4.19Å; I106-A179 HydrophobicContact CG2-CB 3.96Å
107A88.2Confident84.7Confident0 Ų020.2 Ų20.20%011%0.107CC..Hα-helixtrans-60.6-50177.900000112.3M103 A104 F105 S109 N110 L111 Y116 A179 I180M103-A107 WeakPolarHBondContact O-CB 3.37Å; M103-A107 PolarHBondContact O-N 2.83Å; A104-A107 PolarHBondContact O-N 3.45Å; F105-A107 VanDerWaalsContact C-N 3.33Å; A107-S109 VanDerWaalsContact C-N 3.26Å; A107-S109 PolarHBondContact O-N 3.34Å; A107-N110 CarbonylContact O-C 3.4Å; A107-N110 PolarHBondContact O-N 3.1Å; A107-N110 VanDerWaalsContact O-N 3.07Å; A107-L111 WeakPolarHBondContact O-CB 3.34Å; A107-L111 PolarHBondContact O-N 3.36Å; A107-Y116 HydrophobicContact CB-CD2 3.73Å; A107-Y116 HydrophobicContact CB-CE2 3.84Å; A107-A179 HydrophobicContact CB-CB 4.12Å; A107-I180 HydrophobicContact CB-CD1 4.33Å; A107-I180 HydrophobicContact CB-CG1 3.61Å
108L83.9Confident84.3Confident0 Ų017.7 Ų17.70%010%0.097CC..Hα-helixtrans-70.8-19-180-78.8166.1000114L29 R30 A104 F105 A113 Y116L29-L108 HydrophobicContact CB-CD1 4.5Å; L29-L108 HydrophobicContact CD2-CB 4.48Å; L29-L108 HydrophobicContact CD2-CD1 3.34Å; L29-L108 HydrophobicContact CG-CB 4.47Å; L29-L108 HydrophobicContact CG-CD1 3.91Å; R30-L108 VanDerWaalsContact CD-O 3.28Å; R30-L108 WeakPolarHBondContact CD-O 3.28Å; R30-L108 PolarHBondContact NH1-O 3.04Å; A104-L108 WeakPolarHBondContact O-CB 3.39Å; A104-L108 PolarHBondContact O-N 3.46Å; F105-L108 PolarHBondContact O-N 3.29Å; L108-A113 HydrophobicContact CD2-CB 4.41Å; L108-Y116 HydrophobicContact CD1-CD1 4.11Å; L108-Y116 HydrophobicContact CD1-CE1 3.95Å; L108-Y116 HydrophobicContact CD1-CG 4.48Å; L108-Y116 HydrophobicContact CD2-CD1 3.62Å; L108-Y116 HydrophobicContact CD2-CD2 4.23Å; L108-Y116 HydrophobicContact CD2-CE1 4.3Å; L108-Y116 HydrophobicContact CD2-CG 3.58Å; L108-Y116 HydrophobicContact CG-CD1 3.89Å; L108-Y116 HydrophobicContact CG-CD2 3.94Å; L108-Y116 HydrophobicContact CG-CE1 4.15Å; L108-Y116 HydrophobicContact CG-CE2 4.2Å; L108-Y116 HydrophobicContact CG-CG 3.78Å
109S83.7Confident84.2Confident22 Ų2217.6 Ų17.615%0.15410%0.096CC..Hα-helixtrans-73.6-33.1169.9-570000111.1R30 R33 F105 I106 A107R30-S109 PolarHBondContact NH1-O 3.43Å; R33-S109 PolarHBondContact NE-OG 2.7Å; R33-S109 PolarHBondContact NH2-OG 3.3Å; F105-S109 WeakPolarHBondContact O-CB 3.31Å; F105-S109 PolarHBondContact O-N 2.94Å; F105-S109 PolarHBondContact O-OG 2.84Å; I106-S109 PolarHBondContact O-N 3.44Å; A107-S109 VanDerWaalsContact C-N 3.26Å; A107-S109 PolarHBondContact O-N 3.34Å
110N83.9Confident84.1Confident23 Ų2316.1 Ų16.112%0.1238%0.084CC..Hα-helixtrans-102-20.3-173-74.6-77000114.7I106 A107 Q171 N172I106-N110 PolarHBondContact O-N 3.32Å; I106-N110 PolarHBondContact O-ND2 2.93Å; A107-N110 CarbonylContact O-C 3.4Å; A107-N110 PolarHBondContact O-N 3.1Å; A107-N110 VanDerWaalsContact O-N 3.07Å; N110-Q171 PolarHBondContact O-NE2 3.26Å; N110-N172 WeakPolarHBondContact CB-O 3.19Å; N110-N172 PolarHBondContact OD1-N 3.42Å; N110-N172 VanDerWaalsContact OD1-N 3.07Å
111L80.4Confident83.8Confident9 Ų915.7 Ų15.75%0.0478%0.082CC..SBendtrans-120.7157.4-177.7-65.9171000111.8R30 A107 P173 G176 F177 I180R30-L111 VanDerWaalsContact CZ-O 3.24Å; R30-L111 PolarHBondContact NH1-O 3.37Å; R30-L111 VanDerWaalsContact NH1-O 3.1Å; A107-L111 WeakPolarHBondContact O-CB 3.34Å; A107-L111 PolarHBondContact O-N 3.36Å; L111-P173 HydrophobicContact CD2-CB 4.02Å; L111-G176 VanDerWaalsContact CD1-C 3.44Å; L111-F177 HydrophobicContact CD1-CD1 4.02Å; L111-F177 HydrophobicContact CD1-CE1 4.16Å; L111-F177 HydrophobicContact CD1-CG 4.3Å; L111-F177 HydrophobicContact CD2-CD2 4.24Å; L111-F177 HydrophobicContact CD2-CE1 4.41Å; L111-F177 HydrophobicContact CD2-CE2 3.89Å; L111-F177 HydrophobicContact CD2-CZ 3.99Å; L111-I180 HydrophobicContact CD1-CD1 3.44Å; L111-I180 VanDerWaalsContact CD1-CD1 3.44Å; L111-I180 HydrophobicContact CD1-CG1 4.29Å
112D79.3Confident83.6Confident21 Ų2116.1 Ų16.111%0.1128%0.084CC..  trans-64.3148169.4-176.3-98.8000111.7A114 V115 Y116D112-A114 VanDerWaalsContact C-N 3.29Å; D112-A114 PolarHBondContact O-N 2.84Å; D112-A114 VanDerWaalsContact OD1-CB 3.23Å; D112-A114 WeakPolarHBondContact OD1-CB 3.36Å; D112-A114 PolarHBondContact OD1-N 3.45Å; D112-V115 HydrophobicContact CB-CB 4.4Å; D112-V115 HydrophobicContact CB-CG2 4.16Å; D112-V115 PolarHBondContact O-N 3.44Å; D112-Y116 WeakPolarHBondContact O-CB 3.1Å; D112-Y116 PolarHBondContact O-N 2.98Å
113A76.9Confident83.6Confident0 Ų016.7 Ų16.70%09%0.085CC..Hα-helixtrans-61.9-36.4-177.300000112.5R30 L108 Q117R30-A113 HydrophobicContact CB-CB 4.23Å; R30-A113 HydrophobicContact CG-CB 4.39Å; L108-A113 HydrophobicContact CD2-CB 4.41Å; A113-Q117 WeakPolarHBondContact O-CB 3.46Å; A113-Q117 VanDerWaalsContact O-CG 3.28Å; A113-Q117 WeakPolarHBondContact O-CG 3.35Å; A113-Q117 PolarHBondContact O-N 3.02Å
114A75.1Confident83.2Confident0 Ų015.3 Ų15.30%08%0.078CC..Hα-helixtrans-71.4-42.4179.700000111.2D112 Q117 V118 L292 F298D112-A114 VanDerWaalsContact C-N 3.29Å; D112-A114 PolarHBondContact O-N 2.84Å; D112-A114 VanDerWaalsContact OD1-CB 3.23Å; D112-A114 WeakPolarHBondContact OD1-CB 3.36Å; D112-A114 PolarHBondContact OD1-N 3.45Å; A114-Q117 PolarHBondContact O-N 3.41Å; A114-V118 WeakPolarHBondContact O-CG2 3.47Å; A114-V118 PolarHBondContact O-N 3.18Å; A114-V118 VanDerWaalsContact O-N 3.1Å; A114-L292 HydrophobicContact CB-CD2 3.92Å; A114-F298 HydrophobicContact CB-CE2 4.09Å; A114-F298 HydrophobicContact CB-CZ 3.7Å
115V81.4Confident83Confident6 Ų616.3 Ų16.34%0.0368%0.084CC..Hα-helixtrans-62.9-43.7174.6177.60000111D112 T119 P161 F177D112-V115 HydrophobicContact CB-CB 4.4Å; D112-V115 HydrophobicContact CB-CG2 4.16Å; D112-V115 PolarHBondContact O-N 3.44Å; V115-T119 VanDerWaalsContact O-CB 3.27Å; V115-T119 WeakPolarHBondContact O-CB 3.49Å; V115-T119 PolarHBondContact O-N 3.23Å; V115-T119 PolarHBondContact O-OG1 3.5Å; V115-P161 HydrophobicContact CG2-CB 4.47Å; V115-F177 HydrophobicContact CG1-CE1 3.94Å; V115-F177 HydrophobicContact CG1-CZ 3.94Å
116Y84.9Confident83Confident9 Ų916.7 Ų16.74%0.0359%0.088CC..Hα-helixtrans-59.1-51.9174.5171-93.1000111.3T26 A104 A107 L108 D112 V118 T119 Y120 I180T26-Y116 HydrophobicContact CG2-CD1 4.42Å; T26-Y116 HydrophobicContact CG2-CE1 4.29Å; A104-Y116 HydrophobicContact CB-CE2 4.41Å; A104-Y116 WeakPolarHBondContact CB-OH 3.49Å; A107-Y116 HydrophobicContact CB-CD2 3.73Å; A107-Y116 HydrophobicContact CB-CE2 3.84Å; L108-Y116 HydrophobicContact CD1-CD1 4.11Å; L108-Y116 HydrophobicContact CD1-CE1 3.95Å; L108-Y116 HydrophobicContact CD1-CG 4.48Å; L108-Y116 HydrophobicContact CD2-CD1 3.62Å; L108-Y116 HydrophobicContact CD2-CD2 4.23Å; L108-Y116 HydrophobicContact CD2-CE1 4.3Å; L108-Y116 HydrophobicContact CD2-CG 3.58Å; L108-Y116 HydrophobicContact CG-CD1 3.89Å; L108-Y116 HydrophobicContact CG-CD2 3.94Å; L108-Y116 HydrophobicContact CG-CE1 4.15Å; L108-Y116 HydrophobicContact CG-CE2 4.2Å; L108-Y116 HydrophobicContact CG-CG 3.78Å; D112-Y116 WeakPolarHBondContact O-CB 3.1Å; D112-Y116 PolarHBondContact O-N 2.98Å; Y116-V118 VanDerWaalsContact C-N 3.31Å; Y116-V118 PolarHBondContact O-N 3.28Å; Y116-T119 PolarHBondContact O-N 3.21Å; Y116-Y120 HydrophobicContact CE1-CG 4.42Å; Y116-Y120 HydrophobicContact CE2-CD2 4.29Å; Y116-Y120 HydrophobicContact CE2-CG 4.46Å; Y116-Y120 WeakPolarHBondContact O-CB 3.32Å; Y116-Y120 PolarHBondContact O-N 3Å; Y116-I180 HydrophobicContact CD2-CD1 3.78Å; Y116-I180 HydrophobicContact CD2-CG1 3.88Å; Y116-I180 HydrophobicContact CE2-CG1 4.18Å
117Q78.7Confident82.8Confident14 Ų1415.4 Ų15.47%0.0658%0.083CC..Hα-helixtrans-58-42.7-176.7-83.5-80.623.800112.2T26 A113 A114 Q121 I279T26-Q117 HydrophobicContact CG2-CG 4.04Å; T26-Q117 PolarHBondContact OG1-NE2 3.45Å; A113-Q117 WeakPolarHBondContact O-CB 3.46Å; A113-Q117 VanDerWaalsContact O-CG 3.28Å; A113-Q117 WeakPolarHBondContact O-CG 3.35Å; A113-Q117 PolarHBondContact O-N 3.02Å; A114-Q117 PolarHBondContact O-N 3.41Å; Q117-Q121 WeakPolarHBondContact O-CG 3.28Å; Q117-I279 HydrophobicContact CB-CG1 4.24Å
118V80Confident82.4Confident0 Ų015.5 Ų15.50%08%0.083CC..Hα-helixtrans-70.7-50.6178.3174.50000111.6A114 Y116 Y120 Q121 V154 V157 I279 F298 V305A114-V118 WeakPolarHBondContact O-CG2 3.47Å; A114-V118 PolarHBondContact O-N 3.18Å; A114-V118 VanDerWaalsContact O-N 3.1Å; Y116-V118 VanDerWaalsContact C-N 3.31Å; Y116-V118 PolarHBondContact O-N 3.28Å; V118-Y120 VanDerWaalsContact C-N 3.29Å; V118-Y120 PolarHBondContact O-N 2.85Å; V118-Q121 WeakPolarHBondContact O-CB 3.38Å; V118-Q121 PolarHBondContact O-N 3.34Å; V118-Q121 VanDerWaalsContact O-N 3.14Å; V118-V154 HydrophobicContact CG1-CG2 4.1Å; V118-V157 HydrophobicContact CB-CB 4.39Å; V118-V157 HydrophobicContact CB-CG1 3.9Å; V118-V157 HydrophobicContact CB-CG2 4.32Å; V118-V157 HydrophobicContact CG1-CB 3.79Å; V118-V157 HydrophobicContact CG1-CG1 3.84Å; V118-V157 HydrophobicContact CG1-CG2 3.66Å; V118-V157 HydrophobicContact CG2-CG1 4.22Å; V118-V157 HydrophobicContact CG2-CG2 4.22Å; V118-I279 HydrophobicContact CG2-CG2 3.77Å; V118-F298 HydrophobicContact CG2-CZ 4.38Å; V118-V305 HydrophobicContact CG1-CB 4.5Å; V118-V305 HydrophobicContact CG1-CG2 3.86Å
119T85.6Confident82.4Confident5 Ų520.1 Ų20.13%0.03111%0.107CC..Hα-helixtrans-63-37.3-176.7-53.80000111.6V115 Y116 Q121 L122 V154 F177 I180V115-T119 VanDerWaalsContact O-CB 3.27Å; V115-T119 WeakPolarHBondContact O-CB 3.49Å; V115-T119 PolarHBondContact O-N 3.23Å; V115-T119 PolarHBondContact O-OG1 3.5Å; Y116-T119 PolarHBondContact O-N 3.21Å; T119-Q121 PolarHBondContact O-N 3.06Å; T119-Q121 VanDerWaalsContact O-N 3.1Å; T119-L122 HydrophobicContact CG2-CD1 4.25Å; T119-L122 WeakPolarHBondContact O-CB 3.35Å; T119-L122 VanDerWaalsContact O-CG 3.23Å; T119-L122 WeakPolarHBondContact O-CG 3.38Å; T119-L122 PolarHBondContact O-N 3.17Å; T119-L122 VanDerWaalsContact O-N 3.08Å; T119-V154 HydrophobicContact CG2-CG1 4.4Å; T119-F177 HydrophobicContact CG2-CD1 4.21Å; T119-F177 HydrophobicContact CG2-CE1 4.35Å; T119-I180 HydrophobicContact CG2-CB 4.37Å; T119-I180 HydrophobicContact CG2-CD1 3.95Å; T119-I180 HydrophobicContact CG2-CG2 3.65Å
120Y87.3Confident82.4Confident27 Ų2719.8 Ų19.811%0.10611%0.105CC..G310 helixtrans-65-15.7-180-170.4-116000113.5Q100 Y116 V118 L122 K123 I180 A183 V184Q100-Y120 PolarHBondContact NE2-OH 3.39Å; Y116-Y120 HydrophobicContact CE1-CG 4.42Å; Y116-Y120 HydrophobicContact CE2-CD2 4.29Å; Y116-Y120 HydrophobicContact CE2-CG 4.46Å; Y116-Y120 WeakPolarHBondContact O-CB 3.32Å; Y116-Y120 PolarHBondContact O-N 3Å; V118-Y120 VanDerWaalsContact C-N 3.29Å; V118-Y120 PolarHBondContact O-N 2.85Å; Y120-L122 PolarHBondContact O-N 3.14Å; Y120-K123 HydrophobicContact CD1-CD 4.13Å; Y120-K123 HydrophobicContact CE1-CD 3.95Å; Y120-K123 WeakPolarHBondContact O-CB 3.32Å; Y120-K123 WeakPolarHBondContact O-CG 3.23Å; Y120-K123 PolarHBondContact O-N 2.7Å; Y120-K123 VanDerWaalsContact O-N 3.15Å; Y120-I180 HydrophobicContact CD2-CG2 4.45Å; Y120-A183 HydrophobicContact CE2-CB 3.94Å; Y120-V184 HydrophobicContact CD2-CG2 4.08Å
121Q85.3Confident82.2Confident2 Ų219.9 Ų19.91%0.00911%0.105CC..G310 helixtrans-68.9-14.2174.2-58.3-63.569.900113.2Q117 V118 T119 K123 I124 L150 A275 I279 V305 I309Q117-Q121 WeakPolarHBondContact O-CG 3.28Å; V118-Q121 WeakPolarHBondContact O-CB 3.38Å; V118-Q121 PolarHBondContact O-N 3.34Å; V118-Q121 VanDerWaalsContact O-N 3.14Å; T119-Q121 PolarHBondContact O-N 3.06Å; T119-Q121 VanDerWaalsContact O-N 3.1Å; Q121-K123 PolarHBondContact O-N 3.36Å; Q121-K123 VanDerWaalsContact OE1-CE 3.24Å; Q121-K123 VanDerWaalsContact OE1-NZ 3.08Å; Q121-I124 HydrophobicContact CB-CD1 4.4Å; Q121-I124 WeakPolarHBondContact O-CB 3.42Å; Q121-I124 WeakPolarHBondContact O-CG1 3.46Å; Q121-I124 PolarHBondContact O-N 3.25Å; Q121-L150 HydrophobicContact CB-CD1 3.84Å; Q121-L150 WeakPolarHBondContact O-CD2 3.31Å; Q121-A275 VanDerWaalsContact NE2-CB 3.33Å; Q121-I279 HydrophobicContact CG-CD1 3.79Å; Q121-V305 HydrophobicContact CB-CG1 4.24Å; Q121-V305 HydrophobicContact CG-CG1 4.06Å; Q121-I309 HydrophobicContact CG-CD1 4.29Å
122L85.3Confident82.2Confident49 Ų4921.9 Ų21.926%0.25712%0.118SC..G310 helixtrans-54.3-13.3166.9-66.8175.6000113.1T119 Y120 I124 P125 C126 V154 V184T119-L122 HydrophobicContact CG2-CD1 4.25Å; T119-L122 WeakPolarHBondContact O-CB 3.35Å; T119-L122 VanDerWaalsContact O-CG 3.23Å; T119-L122 WeakPolarHBondContact O-CG 3.38Å; T119-L122 PolarHBondContact O-N 3.17Å; T119-L122 VanDerWaalsContact O-N 3.08Å; Y120-L122 PolarHBondContact O-N 3.14Å; L122-I124 PolarHBondContact O-N 2.78Å; L122-P125 WeakPolarHBondContact O-CD 3.49Å; L122-P125 WeakPolarHBondContact O-CG 3.28Å; L122-C126 PolarHBondContact O-N 2.85Å; L122-V154 HydrophobicContact CD1-CG1 4.05Å; L122-V154 HydrophobicContact CD2-CB 4.25Å; L122-V154 HydrophobicContact CD2-CG1 4.23Å; L122-V154 HydrophobicContact CD2-CG2 4.05Å; L122-V154 HydrophobicContact CG-CG1 4.11Å; L122-V154 HydrophobicContact CG-CG2 4.18Å; L122-V184 VanDerWaalsContact C-CG1 3.46Å; L122-V184 HydrophobicContact CB-CG1 4.03Å; L122-V184 HydrophobicContact CB-CG2 4.11Å; L122-V184 WeakPolarHBondContact O-CG1 3.45Å
123K85.6Confident82.4Confident42 Ų4226.7 Ų26.718%0.18314%0.143CC..Hα-helixtrans-55.2-28.6164.976.7-170.4178.6-156.10113.6Y120 Q121 C126 T127 V184Y120-K123 HydrophobicContact CD1-CD 4.13Å; Y120-K123 HydrophobicContact CE1-CD 3.95Å; Y120-K123 WeakPolarHBondContact O-CB 3.32Å; Y120-K123 WeakPolarHBondContact O-CG 3.23Å; Y120-K123 PolarHBondContact O-N 2.7Å; Y120-K123 VanDerWaalsContact O-N 3.15Å; Q121-K123 PolarHBondContact O-N 3.36Å; Q121-K123 VanDerWaalsContact OE1-CE 3.24Å; Q121-K123 VanDerWaalsContact OE1-NZ 3.08Å; K123-C126 PolarHBondContact O-N 3.3Å; K123-T127 WeakPolarHBondContact O-CB 3.08Å; K123-T127 PolarHBondContact O-N 2.89Å; K123-T127 PolarHBondContact O-OG1 3.39Å; K123-V184 HydrophobicContact CB-CG2 4.39Å
124I83Confident82.6Confident24 Ų2428.6 Ų28.612%0.12315%0.152CC..Hα-helixtrans-62.6-57.6-179-64.9167.6000110.7Q121 L122 C126 T127 A128 L150 I309 Y312Q121-I124 HydrophobicContact CB-CD1 4.4Å; Q121-I124 WeakPolarHBondContact O-CB 3.42Å; Q121-I124 WeakPolarHBondContact O-CG1 3.46Å; Q121-I124 PolarHBondContact O-N 3.25Å; L122-I124 PolarHBondContact O-N 2.78Å; I124-C126 VanDerWaalsContact C-N 3.31Å; I124-C126 PolarHBondContact O-N 2.7Å; I124-T127 PolarHBondContact O-N 3.38Å; I124-A128 WeakPolarHBondContact O-CB 3.47Å; I124-A128 PolarHBondContact O-N 2.9Å; I124-L150 HydrophobicContact CB-CD2 3.8Å; I124-L150 HydrophobicContact CD1-CD1 4.34Å; I124-L150 HydrophobicContact CD1-CD2 4.12Å; I124-L150 HydrophobicContact CG1-CD2 4.44Å; I124-L150 HydrophobicContact CG2-CD2 4.36Å; I124-I309 HydrophobicContact CD1-CG1 3.66Å; I124-Y312 HydrophobicContact CG2-CD1 3.88Å; I124-Y312 HydrophobicContact CG2-CD2 3.94Å; I124-Y312 HydrophobicContact CG2-CE1 4.02Å; I124-Y312 HydrophobicContact CG2-CE2 4.07Å; I124-Y312 HydrophobicContact CG2-CG 3.84Å
125P82.1Confident82.7Confident26 Ų2630.6 Ų30.617%0.16916%0.163CC..Hα-helixtrans-61.6-38.6176.116-27.5000112.7L122 T127 A128 L129 V147 L150L122-P125 WeakPolarHBondContact O-CD 3.49Å; L122-P125 WeakPolarHBondContact O-CG 3.28Å; P125-T127 PolarHBondContact O-N 3.48Å; P125-A128 WeakPolarHBondContact O-CB 3.49Å; P125-A128 PolarHBondContact O-N 3.15Å; P125-L129 WeakPolarHBondContact O-CB 3.3Å; P125-L129 PolarHBondContact O-N 3.39Å; P125-V147 HydrophobicContact CB-CB 4.45Å; P125-V147 HydrophobicContact CB-CG1 3.66Å; P125-V147 HydrophobicContact CB-CG2 4.07Å; P125-V147 HydrophobicContact CG-CG1 4.48Å; P125-L150 HydrophobicContact CG-CD2 4.03Å
126C85.3Confident82.5Confident15 Ų1537.5 Ų37.510%0.10120%0.199CC..Hα-helixtrans-60.9-45.6175.6-174.50000111.9L122 K123 I124 A128 L129 C130 V184L122-C126 PolarHBondContact O-N 2.85Å; K123-C126 PolarHBondContact O-N 3.3Å; I124-C126 VanDerWaalsContact C-N 3.31Å; I124-C126 PolarHBondContact O-N 2.7Å; C126-A128 VanDerWaalsContact C-N 3.32Å; C126-A128 PolarHBondContact O-N 3.05Å; C126-L129 PolarHBondContact O-N 2.96Å; C126-C130 WeakPolarHBondContact O-CB 3.32Å; C126-C130 PolarHBondContact O-N 3.08Å; C126-C130 PolarHBondContact O-SG 3.01Å; C126-V184 HydrophobicContact CB-CG1 3.91Å
127T83.8Confident82.1Confident30 Ų3041.6 Ų41.618%0.18422%0.215CC..Hα-helixtrans-62.7-42.6176.5-56.30000110.3K123 I124 P125 L129 C130 M131 G188 V192K123-T127 WeakPolarHBondContact O-CB 3.08Å; K123-T127 PolarHBondContact O-N 2.89Å; K123-T127 PolarHBondContact O-OG1 3.39Å; I124-T127 PolarHBondContact O-N 3.38Å; P125-T127 PolarHBondContact O-N 3.48Å; T127-L129 PolarHBondContact O-N 2.97Å; T127-C130 PolarHBondContact O-N 3.18Å; T127-M131 HydrophobicContact CG2-CE 3.88Å; T127-M131 HydrophobicContact CG2-CG 4.42Å; T127-M131 WeakPolarHBondContact O-CB 3.49Å; T127-M131 WeakPolarHBondContact O-CG 3.47Å; T127-M131 PolarHBondContact O-N 3.38Å; T127-G188 WeakPolarHBondContact OG1-CA 3.45Å; T127-V192 HydrophobicContact CG2-CG2 3.76Å
128A79.9Confident81.9Confident2 Ų245 Ų452%0.01724%0.24CC..Hα-helixtrans-60.1-45.7178.100000111.2I124 P125 C126 M131 V132 L139 Y312I124-A128 WeakPolarHBondContact O-CB 3.47Å; I124-A128 PolarHBondContact O-N 2.9Å; P125-A128 WeakPolarHBondContact O-CB 3.49Å; P125-A128 PolarHBondContact O-N 3.15Å; C126-A128 VanDerWaalsContact C-N 3.32Å; C126-A128 PolarHBondContact O-N 3.05Å; A128-M131 PolarHBondContact O-N 3.1Å; A128-V132 WeakPolarHBondContact O-CG2 3.44Å; A128-V132 PolarHBondContact O-N 3.35Å; A128-L139 HydrophobicContact CB-CD1 3.72Å; A128-L139 HydrophobicContact CB-CD2 4.17Å; A128-Y312 HydrophobicContact CB-CE2 4.09Å; A128-Y312 WeakPolarHBondContact CB-OH 3.37Å
129L82.4Confident81.7Confident96 Ų9646.3 Ų46.350%0.50325%0.247SC..Hα-helixtrans-59.7-50.1173.5-171.585.1000111P125 C126 T127 M131 V132 L133P125-L129 WeakPolarHBondContact O-CB 3.3Å; P125-L129 PolarHBondContact O-N 3.39Å; C126-L129 PolarHBondContact O-N 2.96Å; T127-L129 PolarHBondContact O-N 2.97Å; L129-M131 VanDerWaalsContact C-N 3.29Å; L129-M131 PolarHBondContact O-N 3.5Å; L129-V132 PolarHBondContact O-N 3.33Å; L129-L133 HydrophobicContact CD2-CD1 4.2Å; L129-L133 HydrophobicContact CG-CD1 3.92Å; L129-L133 VanDerWaalsContact O-CG 3.32Å; L129-L133 WeakPolarHBondContact O-CG 3.17Å; L129-L133 PolarHBondContact O-N 3.29Å
130C84.1Confident81.6Confident16 Ų1647.7 Ų47.711%0.10826%0.257CS..Hα-helixtrans-59.7-38177.3-680000112C126 T127 L133 M134 V192C126-C130 WeakPolarHBondContact O-CB 3.32Å; C126-C130 PolarHBondContact O-N 3.08Å; C126-C130 PolarHBondContact O-SG 3.01Å; T127-C130 PolarHBondContact O-N 3.18Å; C130-L133 PolarHBondContact O-N 3.25Å; C130-M134 HydrophobicContact CB-SD 4.21Å; C130-M134 WeakPolarHBondContact O-CB 3.3Å; C130-M134 WeakPolarHBondContact O-CG 3.33Å; C130-M134 PolarHBondContact O-N 2.93Å; C130-V192 HydrophobicContact CB-CB 4.03Å; C130-V192 HydrophobicContact CB-CG1 4.32Å; C130-V192 HydrophobicContact CB-CG2 3.76Å
131M79.9Confident81.5Confident24 Ų2457.6 Ų57.612%0.11829%0.294CS..Hα-helixtrans-65.1-41.2176.5-77.7-168.6-176.600112.3T127 A128 L129 L135 N136 R137 V192 E195T127-M131 HydrophobicContact CG2-CE 3.88Å; T127-M131 HydrophobicContact CG2-CG 4.42Å; T127-M131 WeakPolarHBondContact O-CB 3.49Å; T127-M131 WeakPolarHBondContact O-CG 3.47Å; T127-M131 PolarHBondContact O-N 3.38Å; A128-M131 PolarHBondContact O-N 3.1Å; L129-M131 VanDerWaalsContact C-N 3.29Å; L129-M131 PolarHBondContact O-N 3.5Å; M131-L135 WeakPolarHBondContact O-CB 3.45Å; M131-L135 PolarHBondContact O-N 3.39Å; M131-L135 VanDerWaalsContact O-N 3.15Å; M131-N136 PolarHBondContact O-N 3.43Å; M131-R137 PolarHBondContact O-N 3.18Å; M131-V192 HydrophobicContact CE-CG2 4.49Å; M131-V192 HydrophobicContact CG-CG1 4.3Å; M131-V192 HydrophobicContact CG-CG2 3.6Å; M131-E195 WeakPolarHBondContact CE-OE2 3.45Å
132V80.3Confident81.4Confident52 Ų5261.1 Ų61.132%0.31531%0.312SS..Hα-helixtrans-63.3-48175.3177.80000109.8A128 L129 N136 R137 L139A128-V132 WeakPolarHBondContact O-CG2 3.44Å; A128-V132 PolarHBondContact O-N 3.35Å; L129-V132 PolarHBondContact O-N 3.33Å; V132-N136 WeakPolarHBondContact O-CA 3.48Å; V132-N136 PolarHBondContact O-N 2.93Å; V132-R137 WeakPolarHBondContact CA-O 3.4Å; V132-R137 VanDerWaalsContact CG2-O 3.31Å; V132-R137 WeakPolarHBondContact CG2-O 3.44Å; V132-L139 HydrophobicContact CG2-CD1 3.84Å; V132-L139 HydrophobicContact CG2-CG 3.92Å
133L83.1Confident81.2Confident122 Ų12259.9 Ų59.964%0.63931%0.305SS*.Hα-helixtrans-72.9-39-174.7-65.1175000114L129 C130L129-L133 HydrophobicContact CD2-CD1 4.2Å; L129-L133 HydrophobicContact CG-CD1 3.92Å; L129-L133 VanDerWaalsContact O-CG 3.32Å; L129-L133 WeakPolarHBondContact O-CG 3.17Å; L129-L133 PolarHBondContact O-N 3.29Å; C130-L133 PolarHBondContact O-N 3.25Å
134M80.9Confident81.1Confident40 Ų4064.9 Ų64.920%0.19732%0.323CS..Hα-helixtrans-99.2-26.6-170.2-61.6174.566.500114.4C130 F189 V192 Y193 K196C130-M134 HydrophobicContact CB-SD 4.21Å; C130-M134 WeakPolarHBondContact O-CB 3.3Å; C130-M134 WeakPolarHBondContact O-CG 3.33Å; C130-M134 PolarHBondContact O-N 2.93Å; M134-F189 HydrophobicContact CE-CD2 4.18Å; M134-F189 HydrophobicContact CE-CE2 3.91Å; M134-F189 HydrophobicContact SD-CD2 3.85Å; M134-F189 HydrophobicContact SD-CE2 4.08Å; M134-V192 HydrophobicContact CB-CG1 3.92Å; M134-V192 HydrophobicContact CE-CG1 4.5Å; M134-V192 HydrophobicContact CG-CG1 4.45Å; M134-V192 HydrophobicContact SD-CB 4.26Å; M134-V192 HydrophobicContact SD-CG1 3.93Å; M134-Y193 HydrophobicContact CE-CD2 3.8Å; M134-Y193 HydrophobicContact CE-CG 4.25Å; M134-K196 PolarHBondContact O-NZ 2.81Å; M134-K196 VanDerWaalsContact O-NZ 3.08Å
135L77.9Confident81.3Confident42 Ų4269.3 Ų69.322%0.2234%0.341CS..Hα-helixtrans-117.21.5-176.6-82.367.3000112.8M131 R137 V192 E195 K196M131-L135 WeakPolarHBondContact O-CB 3.45Å; M131-L135 PolarHBondContact O-N 3.39Å; M131-L135 VanDerWaalsContact O-N 3.15Å; L135-R137 HydrophobicContact CB-CG 4.21Å; L135-R137 PolarHBondContact O-N 2.94Å; L135-R137 VanDerWaalsContact O-N 3.15Å; L135-V192 HydrophobicContact CD1-CG1 3.23Å; L135-V192 HydrophobicContact CG-CG1 4.45Å; L135-E195 HydrophobicContact CD2-CG 4.45Å; L135-K196 HydrophobicContact CD1-CB 4Å; L135-K196 HydrophobicContact CD1-CD 4.27Å; L135-K196 HydrophobicContact CD1-CG 4.41Å
136N77.5Confident81.4Confident151 Ų15168.1 Ų68.181%0.80733%0.334SS*.  trans51.434.4-176.9-73.4-23.6000113.4M131 V132M131-N136 PolarHBondContact O-N 3.43Å; V132-N136 WeakPolarHBondContact O-CA 3.48Å; V132-N136 PolarHBondContact O-N 2.93Å
137R75.9Confident81.3Confident95 Ų9568.1 Ų68.136%0.35833%0.333SS..  trans-85.1137.9174.6-73-171.1179.316010.5110.2M131 V132 L135 E195M131-R137 PolarHBondContact O-N 3.18Å; V132-R137 WeakPolarHBondContact CA-O 3.4Å; V132-R137 VanDerWaalsContact CG2-O 3.31Å; V132-R137 WeakPolarHBondContact CG2-O 3.44Å; L135-R137 HydrophobicContact CB-CG 4.21Å; L135-R137 PolarHBondContact O-N 2.94Å; L135-R137 VanDerWaalsContact O-N 3.15Å; R137-E195 IonicContact CZ-OE1 2.68Å; R137-E195 VanDerWaalsContact CZ-OE1 3.27Å; R137-E195 IonicContact NH1-OE1 3.27Å; R137-E195 PolarHBondContact NH1-OE1 3.28Å; R137-E195 IonicContact NH1-OE2 2.73Å; R137-E195 IonicContact NH2-OE1 2.87Å; R137-E195 PolarHBondContact NH2-OE1 3.45Å
138S74.6Confident81.3Confident84 Ų8473 Ų7359%0.58735%0.352SS*.  trans-78.4157.6168.759.20000110.9K316S138-K316 WeakPolarHBondContact O-CE 3.23Å; S138-K316 PolarHBondContact O-NZ 2.97Å; S138-K316 PolarHBondContact OG-NZ 3.2Å
139L75.6Confident81.7Confident29 Ų2974.3 Ų74.315%0.15236%0.358CS..  trans-110.1144.1168.2-67.9167.8000109.2A128 V132 Q143 W144 Y312A128-L139 HydrophobicContact CB-CD1 3.72Å; A128-L139 HydrophobicContact CB-CD2 4.17Å; V132-L139 HydrophobicContact CG2-CD1 3.84Å; V132-L139 HydrophobicContact CG2-CG 3.92Å; L139-Q143 HydrophobicContact CB-CB 4.24Å; L139-Q143 HydrophobicContact CD2-CB 4.28Å; L139-W144 HydrophobicContact CD1-CZ2 4.17Å; L139-Y312 HydrophobicContact CD2-CE2 4.37Å
140S83.2Confident81.8Confident34 Ų3469.8 Ų69.824%0.23834%0.335CS..  trans-73.1160.7174.6740000111.2L142 Q143 W144S140-L142 PolarHBondContact O-N 3.34Å; S140-Q143 WeakPolarHBondContact O-CB 3.22Å; S140-Q143 PolarHBondContact O-N 3.25Å; S140-Q143 WeakPolarHBondContact OG-CG 3.37Å; S140-Q143 PolarHBondContact OG-N 3.48Å; S140-Q143 VanDerWaalsContact OG-N 3.08Å; S140-W144 PolarHBondContact O-N 3.26Å
141R85.1Confident81.7Confident235 Ų23571.4 Ų71.489%0.88735%0.346SS*.Hα-helixtrans-57.7-35.8173.6-64.9-176.3-176.8173.20.9111.8W144 F145R141-W144 PolarHBondContact O-N 2.91Å; R141-F145 WeakPolarHBondContact O-CB 3.41Å; R141-F145 PolarHBondContact O-N 3.36Å
142L84.2Confident82.1Confident75 Ų7573.9 Ų73.939%0.39336%0.359SS..Hα-helixtrans-67.8-36.7175.5-170.466.3000112.3S140 F145 S146 L311 L314S140-L142 PolarHBondContact O-N 3.34Å; L142-F145 PolarHBondContact O-N 3.26Å; L142-S146 WeakPolarHBondContact O-CB 3.48Å; L142-S146 PolarHBondContact O-N 3.47Å; L142-S146 PolarHBondContact O-OG 2.88Å; L142-L311 HydrophobicContact CD1-CD2 4.39Å; L142-L314 HydrophobicContact CD2-CB 4.45Å; L142-L314 HydrophobicContact CD2-CD1 4.05Å
143Q81.6Confident82.3Confident23 Ų2371.4 Ų71.411%0.10734%0.344CS..Hα-helixtrans-67.4-37174.4-75.5174.3-34.300112.1L139 S140 S146 V147 Y312L139-Q143 HydrophobicContact CB-CB 4.24Å; L139-Q143 HydrophobicContact CD2-CB 4.28Å; S140-Q143 WeakPolarHBondContact O-CB 3.22Å; S140-Q143 PolarHBondContact O-N 3.25Å; S140-Q143 WeakPolarHBondContact OG-CG 3.37Å; S140-Q143 PolarHBondContact OG-N 3.48Å; S140-Q143 VanDerWaalsContact OG-N 3.08Å; Q143-S146 VanDerWaalsContact C-OG 3.32Å; Q143-S146 VanDerWaalsContact CA-OG 3.24Å; Q143-S146 WeakPolarHBondContact CA-OG 3.22Å; Q143-S146 PolarHBondContact O-OG 3.48Å; Q143-V147 WeakPolarHBondContact O-CG2 3.33Å; Q143-V147 PolarHBondContact O-N 3.35Å; Q143-Y312 HydrophobicContact CB-CD2 4.05Å; Q143-Y312 HydrophobicContact CB-CE2 4.06Å; Q143-Y312 HydrophobicContact CG-CD2 4.09Å; Q143-Y312 HydrophobicContact CG-CE2 4.21Å
144W82Confident82.2Confident148 Ų14865.7 Ų65.756%0.56131%0.314SS*.Hα-helixtrans-67.6-41.9172-85.8109.2000112.6L139 S140 R141 V147 F148L139-W144 HydrophobicContact CD1-CZ2 4.17Å; S140-W144 PolarHBondContact O-N 3.26Å; R141-W144 PolarHBondContact O-N 2.91Å; W144-V147 WeakPolarHBondContact O-CB 3.46Å; W144-V147 PolarHBondContact O-N 3.36Å; W144-F148 PolarHBondContact O-N 3.07Å
145F87.1Confident82.3Confident116 Ų11667.4 Ų67.451%0.50933%0.327SS..Hα-helixtrans-61.8-44175.7179.2-102.5000112.1R141 L142 V147 F148 M149 L311R141-F145 WeakPolarHBondContact O-CB 3.41Å; R141-F145 PolarHBondContact O-N 3.36Å; L142-F145 PolarHBondContact O-N 3.26Å; F145-V147 VanDerWaalsContact C-N 3.34Å; F145-V147 PolarHBondContact O-N 2.99Å; F145-F148 PolarHBondContact O-N 3.48Å; F145-M149 HydrophobicContact CE1-SD 4.25Å; F145-M149 WeakPolarHBondContact O-CB 3.41Å; F145-M149 PolarHBondContact O-N 3.42Å; F145-L311 HydrophobicContact CD1-CD1 4.24Å; F145-L311 HydrophobicContact CE1-CD1 4.19Å
146S85.6Confident82.5Confident1 Ų167.5 Ų67.51%0.00733%0.327CS..Hα-helixtrans-63.6-37.7175.447.40000112.7L142 Q143 F148 M149 L150 S308 Y312L142-S146 WeakPolarHBondContact O-CB 3.48Å; L142-S146 PolarHBondContact O-N 3.47Å; L142-S146 PolarHBondContact O-OG 2.88Å; Q143-S146 VanDerWaalsContact C-OG 3.32Å; Q143-S146 VanDerWaalsContact CA-OG 3.24Å; Q143-S146 WeakPolarHBondContact CA-OG 3.22Å; Q143-S146 PolarHBondContact O-OG 3.48Å; S146-F148 PolarHBondContact O-N 3.36Å; S146-M149 PolarHBondContact O-N 3.31Å; S146-L150 WeakPolarHBondContact O-CB 3.02Å; S146-L150 PolarHBondContact O-N 3.23Å; S146-S308 VanDerWaalsContact CB-O 3.29Å; S146-S308 WeakPolarHBondContact CB-O 3.5Å; S146-S308 WeakPolarHBondContact O-CB 3.34Å; S146-Y312 WeakPolarHBondContact OG-CA 3.35Å; S146-Y312 WeakPolarHBondContact OG-CB 3.5Å; S146-Y312 PolarHBondContact OG-N 2.91Å
147V82Confident82.5Confident15 Ų1560.3 Ų60.39%0.09129%0.289CS..Hα-helixtrans-58.3-46.4171.5157.20000111.7P125 Q143 W144 F145 L150 C151 Y312P125-V147 HydrophobicContact CB-CB 4.45Å; P125-V147 HydrophobicContact CB-CG1 3.66Å; P125-V147 HydrophobicContact CB-CG2 4.07Å; P125-V147 HydrophobicContact CG-CG1 4.48Å; Q143-V147 WeakPolarHBondContact O-CG2 3.33Å; Q143-V147 PolarHBondContact O-N 3.35Å; W144-V147 WeakPolarHBondContact O-CB 3.46Å; W144-V147 PolarHBondContact O-N 3.36Å; F145-V147 VanDerWaalsContact C-N 3.34Å; F145-V147 PolarHBondContact O-N 2.99Å; V147-L150 WeakPolarHBondContact O-CB 3.37Å; V147-L150 PolarHBondContact O-N 3.19Å; V147-C151 PolarHBondContact O-N 3.21Å; V147-C151 VanDerWaalsContact O-N 3.11Å; V147-C151 PolarHBondContact O-SG 3.11Å; V147-C151 VanDerWaalsContact O-SG 3.4Å; V147-Y312 HydrophobicContact CG2-CD2 4.26Å; V147-Y312 HydrophobicContact CG2-CE2 4.2Å
148F83.8Confident82.3Confident134 Ų13458.9 Ų58.959%0.58829%0.286SS*.Hα-helixtrans-62.8-45.7177.1176.6-97000112W144 F145 S146 L150 C151 L152W144-F148 PolarHBondContact O-N 3.07Å; F145-F148 PolarHBondContact O-N 3.48Å; S146-F148 PolarHBondContact O-N 3.36Å; F148-L150 VanDerWaalsContact C-N 3.28Å; F148-L150 PolarHBondContact O-N 3.11Å; F148-C151 PolarHBondContact O-N 3.48Å; F148-L152 PolarHBondContact O-N 2.83Å
149M88.4Confident82.1Confident29 Ų2964.2 Ų64.214%0.14329%0.294CS..Hα-helixtrans-60.1-38177.8-171.3179.3-171.300112.3F145 S146 L152 G153 L304 V307 L311F145-M149 HydrophobicContact CE1-SD 4.25Å; F145-M149 WeakPolarHBondContact O-CB 3.41Å; F145-M149 PolarHBondContact O-N 3.42Å; S146-M149 PolarHBondContact O-N 3.31Å; M149-L152 PolarHBondContact O-N 2.87Å; M149-G153 PolarHBondContact O-N 3.21Å; M149-L304 HydrophobicContact CE-CD2 3.43Å; M149-L304 VanDerWaalsContact CE-CD2 3.43Å; M149-L304 HydrophobicContact CG-CD2 3.99Å; M149-V307 HydrophobicContact CE-CB 3.68Å; M149-V307 HydrophobicContact CE-CG1 3.47Å; M149-V307 VanDerWaalsContact CE-CG1 3.47Å; M149-V307 HydrophobicContact SD-CB 4.4Å; M149-V307 HydrophobicContact SD-CG1 3.99Å; M149-L311 HydrophobicContact SD-CD1 3.9Å
150L85.7Confident81.4Confident1 Ų169.3 Ų69.31%0.00532%0.315CS..Hα-helixtrans-63.2-48.8174.6-179.478.1000111.3Q121 I124 P125 S146 V147 F148 L152 G153 V154 V305 S308 I309Q121-L150 HydrophobicContact CB-CD1 3.84Å; Q121-L150 WeakPolarHBondContact O-CD2 3.31Å; I124-L150 HydrophobicContact CB-CD2 3.8Å; I124-L150 HydrophobicContact CD1-CD1 4.34Å; I124-L150 HydrophobicContact CD1-CD2 4.12Å; I124-L150 HydrophobicContact CG1-CD2 4.44Å; I124-L150 HydrophobicContact CG2-CD2 4.36Å; P125-L150 HydrophobicContact CG-CD2 4.03Å; S146-L150 WeakPolarHBondContact O-CB 3.02Å; S146-L150 PolarHBondContact O-N 3.23Å; V147-L150 WeakPolarHBondContact O-CB 3.37Å; V147-L150 PolarHBondContact O-N 3.19Å; F148-L150 VanDerWaalsContact C-N 3.28Å; F148-L150 PolarHBondContact O-N 3.11Å; L150-L152 VanDerWaalsContact C-N 3.28Å; L150-L152 PolarHBondContact O-N 2.88Å; L150-G153 PolarHBondContact O-N 3.32Å; L150-V154 WeakPolarHBondContact O-CG2 3.49Å; L150-V154 PolarHBondContact O-N 3.41Å; L150-V305 HydrophobicContact CD1-CB 4.22Å; L150-V305 HydrophobicContact CD1-CG1 3.73Å; L150-V305 HydrophobicContact CD1-CG2 4.03Å; L150-S308 WeakPolarHBondContact CA-OG 3.33Å; L150-S308 WeakPolarHBondContact CB-OG 3.43Å; L150-S308 WeakPolarHBondContact CD1-OG 3.3Å; L150-I309 HydrophobicContact CD1-CG1 4.44Å
151C82.2Confident80.2Confident50 Ų5071 Ų7134%0.33833%0.325SS..Hα-helixtrans-57.4-44.6177.4-68.50000110.9V147 F148 V154 T155V147-C151 PolarHBondContact O-N 3.21Å; V147-C151 VanDerWaalsContact O-N 3.11Å; V147-C151 PolarHBondContact O-SG 3.11Å; V147-C151 VanDerWaalsContact O-SG 3.4Å; F148-C151 PolarHBondContact O-N 3.48Å; C151-V154 PolarHBondContact O-N 3.24Å; C151-T155 WeakPolarHBondContact O-CG2 3.36Å; C151-T155 PolarHBondContact O-N 3.4Å; C151-T155 PolarHBondContact O-OG1 2.82Å
152L86.6Confident78.8Confident75 Ų7560.4 Ų60.439%0.39329%0.287SS..Hα-helixtrans-60.1-47.7175.4-175.666.8000111.8F148 M149 L150 V154 T155 L156F148-L152 PolarHBondContact O-N 2.83Å; M149-L152 PolarHBondContact O-N 2.87Å; L150-L152 VanDerWaalsContact C-N 3.28Å; L150-L152 PolarHBondContact O-N 2.88Å; L152-V154 VanDerWaalsContact C-N 3.31Å; L152-V154 PolarHBondContact O-N 3.34Å; L152-T155 WeakPolarHBondContact CA-OG1 3.1Å; L152-T155 PolarHBondContact O-N 3.48Å; L152-T155 PolarHBondContact O-OG1 2.87Å; L152-L156 HydrophobicContact CG-CD1 4.29Å; L152-L156 WeakPolarHBondContact O-CG 3.36Å; L152-L156 PolarHBondContact O-N 3.44Å
153G84.9Confident77.5Confident0 Ų063 Ų630%030%0.298CS..Hα-helixtrans-58.8-41.4177.600000112.8M149 L150 L156 V157 G301M149-G153 PolarHBondContact O-N 3.21Å; L150-G153 PolarHBondContact O-N 3.32Å; G153-L156 PolarHBondContact O-N 2.89Å; G153-V157 PolarHBondContact O-N 3.48Å; G153-V157 VanDerWaalsContact O-N 3.09Å; G153-G301 WeakPolarHBondContact CA-O 3.32Å; G153-G301 VanDerWaalsContact O-CA 3.31Å; G153-G301 WeakPolarHBondContact O-CA 3.49Å
154V81.6Confident76.1Confident3 Ų365.9 Ų65.92%0.01833%0.325CS..Hα-helixtrans-65-43175.9173.20000111.6V118 T119 L122 L150 C151 L152 L156 V157 Q158 V305V118-V154 HydrophobicContact CG1-CG2 4.1Å; T119-V154 HydrophobicContact CG2-CG1 4.4Å; L122-V154 HydrophobicContact CD1-CG1 4.05Å; L122-V154 HydrophobicContact CD2-CB 4.25Å; L122-V154 HydrophobicContact CD2-CG1 4.23Å; L122-V154 HydrophobicContact CD2-CG2 4.05Å; L122-V154 HydrophobicContact CG-CG1 4.11Å; L122-V154 HydrophobicContact CG-CG2 4.18Å; L150-V154 WeakPolarHBondContact O-CG2 3.49Å; L150-V154 PolarHBondContact O-N 3.41Å; C151-V154 PolarHBondContact O-N 3.24Å; L152-V154 VanDerWaalsContact C-N 3.31Å; L152-V154 PolarHBondContact O-N 3.34Å; V154-L156 VanDerWaalsContact C-N 3.3Å; V154-L156 PolarHBondContact O-N 2.63Å; V154-V157 PolarHBondContact O-N 3.23Å; V154-Q158 WeakPolarHBondContact O-CG 3.43Å; V154-Q158 PolarHBondContact O-N 2.78Å; V154-Q158 VanDerWaalsContact O-N 3.11Å; V154-V305 HydrophobicContact CG2-CG2 4Å
155T82.1Confident74.7Confident75 Ų7560.2 Ų60.246%0.4631%0.307SS..Hα-helixtrans-62-37.3176.257.50000112.6C151 L152 Q158 W159C151-T155 WeakPolarHBondContact O-CG2 3.36Å; C151-T155 PolarHBondContact O-N 3.4Å; C151-T155 PolarHBondContact O-OG1 2.82Å; L152-T155 WeakPolarHBondContact CA-OG1 3.1Å; L152-T155 PolarHBondContact O-N 3.48Å; L152-T155 PolarHBondContact O-OG1 2.87Å; T155-Q158 PolarHBondContact O-N 2.73Å; T155-W159 PolarHBondContact O-N 2.92Å
156L83.1Confident72.8Confident44 Ų4464.8 Ų64.823%0.2333%0.326CS..Hα-helixtrans-69-38.4178-73169.3000112.7L152 G153 V154 Q158 W159 L304L152-L156 HydrophobicContact CG-CD1 4.29Å; L152-L156 WeakPolarHBondContact O-CG 3.36Å; L152-L156 PolarHBondContact O-N 3.44Å; G153-L156 PolarHBondContact O-N 2.89Å; V154-L156 VanDerWaalsContact C-N 3.3Å; V154-L156 PolarHBondContact O-N 2.63Å; L156-Q158 PolarHBondContact O-N 2.72Å; L156-W159 PolarHBondContact O-N 3.22Å; L156-L304 HydrophobicContact CD1-CD1 3.26Å
157V76.8Confident71.2Confident0 Ų066.4 Ų66.40%034%0.336CS..Hα-helixtrans-64.1-32.7173.3164.60000112.1V118 G153 V154 F298V118-V157 HydrophobicContact CB-CB 4.39Å; V118-V157 HydrophobicContact CB-CG1 3.9Å; V118-V157 HydrophobicContact CB-CG2 4.32Å; V118-V157 HydrophobicContact CG1-CB 3.79Å; V118-V157 HydrophobicContact CG1-CG1 3.84Å; V118-V157 HydrophobicContact CG1-CG2 3.66Å; V118-V157 HydrophobicContact CG2-CG1 4.22Å; V118-V157 HydrophobicContact CG2-CG2 4.22Å; G153-V157 PolarHBondContact O-N 3.48Å; G153-V157 VanDerWaalsContact O-N 3.09Å; V154-V157 PolarHBondContact O-N 3.23Å; V157-F298 HydrophobicContact CB-CD2 4.33Å; V157-F298 HydrophobicContact CG1-CD2 3.62Å; V157-F298 HydrophobicContact CG1-CE2 3.55Å; V157-F298 HydrophobicContact CG2-CD2 4.23Å; V157-F298 HydrophobicContact CG2-CE2 4.42Å
158Q71.6Confident69.8Low65 Ų6575.3 Ų75.330%0.30438%0.377SS..Hα-helixtrans-85.6-15.4179.1-68-179.340.500114.3V154 T155 L156 K160 P161 F177V154-Q158 WeakPolarHBondContact O-CG 3.43Å; V154-Q158 PolarHBondContact O-N 2.78Å; V154-Q158 VanDerWaalsContact O-N 3.11Å; T155-Q158 PolarHBondContact O-N 2.73Å; L156-Q158 PolarHBondContact O-N 2.72Å; Q158-K160 PolarHBondContact O-N 2.89Å; Q158-P161 WeakPolarHBondContact O-CD 3.36Å; Q158-F177 HydrophobicContact CG-CE1 4.11Å; Q158-F177 HydrophobicContact CG-CZ 4.31Å
159W70.2Confident68.7Low197 Ų19771.9 Ų71.975%0.74637%0.367SS*.Hα-helixtrans-61.8-44.9-172.8-171.5-85.1000113.5T155 L156T155-W159 PolarHBondContact O-N 2.92Å; L156-W159 PolarHBondContact O-N 3.22Å
160K61.8Low67.7Low136 Ų13679.8 Ų79.859%0.59140%0.403SS*.SBendtrans-131.893.3163.7-79.5-171.8176.7-170.70105.7Q158 A162 T295Q158-K160 PolarHBondContact O-N 2.89Å; K160-A162 PolarHBondContact O-N 3.29Å; K160-T295 PolarHBondContact O-OG1 3.05Å
161P58.2Low67Low70 Ų7082.5 Ų82.546%0.45542%0.416SS..PPolyproline II helixtrans-56.9144.4176.423.3-26.6000107.7V115 Q158 E163V115-P161 HydrophobicContact CG2-CB 4.47Å; Q158-P161 WeakPolarHBondContact O-CD 3.36Å; P161-E163 PolarHBondContact O-N 2.77Å
162A56.2Low67.1Low11 Ų1183.8 Ų83.89%0.09142%0.419CS..PPolyproline II helixtrans-49.3132.2177.900000109.8K160 A164 L292 Q293K160-A162 PolarHBondContact O-N 3.29Å; A162-A164 PolarHBondContact O-N 2.91Å; A162-L292 HydrophobicContact CB-CD1 3.45Å; A162-L292 VanDerWaalsContact CB-CD1 3.45Å; A162-L292 HydrophobicContact CB-CD2 4.02Å; A162-L292 HydrophobicContact CB-CG 3.67Å; A162-Q293 VanDerWaalsContact CB-O 3.26Å; A162-Q293 WeakPolarHBondContact CB-O 2.8Å
163E56.6Low66.9Low131 Ų13183.5 Ų83.561%0.61242%0.422SS*.BIsolated β-bridgetrans-58.4130.9-176-77.7-176.2172.500109.6P161 T165P161-E163 PolarHBondContact O-N 2.77Å; E163-T165 PolarHBondContact O-N 2.65Å
164A51.7Low67Low82 Ų8290.6 Ų90.668%0.67845%0.453SS*.PPolyproline II helixtrans-60.1125.4-169.200000111.3A162A162-A164 PolarHBondContact O-N 2.91Å
165T51.9Low67.3Low30 Ų3094.4 Ų94.418%0.18447%0.473CS..PPolyproline II helixtrans-46.9150.3160.5-60.30000111.6E163 V167 F290E163-T165 PolarHBondContact O-N 2.65Å; T165-V167 HydrophobicContact CG2-CG2 3.98Å; T165-V167 PolarHBondContact O-N 3.38Å; T165-F290 WeakPolarHBondContact CB-O 3.16Å; T165-F290 HydrophobicContact CG2-CB 4Å; T165-F290 WeakPolarHBondContact CG2-O 3.44Å; T165-F290 PolarHBondContact OG1-O 2.93Å
166K47.5Very low67.6Low212 Ų21290.8 Ų90.892%0.92245%0.451SS*.  trans-54.165.6166-60.3179.1179.4179.70113.4
167V53.2Low67.9Low35 Ų3591.5 Ų91.521%0.21245%0.452CS..  trans-92.6123.9176-177.30000107.9T34 T165 V169T34-V167 HydrophobicContact CG2-CG1 3.75Å; T165-V167 HydrophobicContact CG2-CG2 3.98Å; T165-V167 PolarHBondContact O-N 3.38Å; V167-V169 HydrophobicContact CG1-CB 4.14Å; V167-V169 HydrophobicContact CG1-CG2 4.43Å; V167-V169 PolarHBondContact O-N 3.17Å
168Q52.5Low68.6Low202 Ų20296.2 Ų96.294%0.94448%0.476SS*.SBendtrans-741-177.6-70.4-174.4-30.900114
169V59.8Low69.6Low62 Ų6293.3 Ų93.338%0.37646%0.463SS..SBendtrans-108.2132.6-174.6-175.10000109.7V167 Q171V167-V169 HydrophobicContact CG1-CB 4.14Å; V167-V169 HydrophobicContact CG1-CG2 4.43Å; V167-V169 PolarHBondContact O-N 3.17Å; V169-Q171 WeakPolarHBondContact O-CG 3.36Å; V169-Q171 PolarHBondContact O-N 3.01Å
170E66.6Low70.6Confident194 Ų19484 Ų8491%0.90743%0.427SS*.  trans-60.3119.2175.8-164.8179.2178.200110.4
171Q72.3Confident72.1Confident58 Ų5879.8 Ų79.827%0.27142%0.418SS..  trans-104.3137.3-177.4-63.4-170-103.900110.8N110 V169 P173N110-Q171 PolarHBondContact O-NE2 3.26Å; V169-Q171 WeakPolarHBondContact O-CG 3.36Å; V169-Q171 PolarHBondContact O-N 3.01Å; Q171-P173 WeakPolarHBondContact O-CD 3.5Å
172N83.8Confident73.8Confident77 Ų7779 Ų7941%0.41241%0.412SS..  trans-11391.7171-173.3-24.2000111.2N110 F174 L175 G176N110-N172 WeakPolarHBondContact CB-O 3.19Å; N110-N172 PolarHBondContact OD1-N 3.42Å; N110-N172 VanDerWaalsContact OD1-N 3.07Å; N172-F174 VanDerWaalsContact C-N 3.26Å; N172-F174 PolarHBondContact O-N 3.38Å; N172-F174 PolarHBondContact OD1-N 2.86Å; N172-L175 HydrophobicContact CB-CB 4.03Å; N172-L175 PolarHBondContact O-N 3.35Å; N172-L175 PolarHBondContact OD1-N 3.49Å; N172-L175 VanDerWaalsContact OD1-N 3.12Å; N172-G176 PolarHBondContact O-N 3.32Å; N172-G176 VanDerWaalsContact O-N 3.09Å
173P83.6Confident75.5Confident69 Ų6978.5 Ų78.545%0.44841%0.408SS..Hα-helixtrans-57.1-36.6-178.1-2735000113.7L111 Q171 G176 F177L111-P173 HydrophobicContact CD2-CB 4.02Å; Q171-P173 WeakPolarHBondContact O-CD 3.5Å; P173-G176 PolarHBondContact O-N 2.82Å; P173-F177 HydrophobicContact CB-CD2 4.47Å; P173-F177 HydrophobicContact CB-CE2 4.26Å; P173-F177 WeakPolarHBondContact O-CD2 3.26Å; P173-F177 PolarHBondContact O-N 3.21Å
174F85.3Confident77.1Confident149 Ų14972.9 Ų72.965%0.65438%0.382SS*.Hα-helixtrans-62.7-47179.4-179.9-100.8000111.6N172 G176 F177 M178N172-F174 VanDerWaalsContact C-N 3.26Å; N172-F174 PolarHBondContact O-N 3.38Å; N172-F174 PolarHBondContact OD1-N 2.86Å; F174-G176 VanDerWaalsContact C-N 3.27Å; F174-G176 PolarHBondContact O-N 3.42Å; F174-F177 PolarHBondContact O-N 2.99Å; F174-M178 HydrophobicContact CD1-CG 4.37Å; F174-M178 HydrophobicContact CE1-CG 3.98Å; F174-M178 HydrophobicContact CE2-CG 4.38Å; F174-M178 HydrophobicContact CZ-CG 3.98Å; F174-M178 HydrophobicContact CZ-SD 4.31Å; F174-M178 WeakPolarHBondContact O-CG 3.4Å; F174-M178 PolarHBondContact O-N 2.93Å
175L88.3Confident79Confident83 Ų8374.2 Ų74.244%0.43538%0.377SS..Hα-helixtrans-59.4-41.2174-179.563.7000111.3I106 N172 M178 A179I106-L175 HydrophobicContact CG2-CD2 4.28Å; I106-L175 HydrophobicContact CG2-CG 4.12Å; N172-L175 HydrophobicContact CB-CB 4.03Å; N172-L175 PolarHBondContact O-N 3.35Å; N172-L175 PolarHBondContact OD1-N 3.49Å; N172-L175 VanDerWaalsContact OD1-N 3.12Å; L175-M178 PolarHBondContact O-N 3.31Å; L175-A179 WeakPolarHBondContact O-CB 3.34Å; L175-A179 PolarHBondContact O-N 3.32Å
176G89.3Confident80.9Confident0 Ų073.7 Ų73.70%037%0.374CS..Hα-helixtrans-61.2-45.3176.900000113.4L111 N172 P173 F174 A179 I180L111-G176 VanDerWaalsContact CD1-C 3.44Å; N172-G176 PolarHBondContact O-N 3.32Å; N172-G176 VanDerWaalsContact O-N 3.09Å; P173-G176 PolarHBondContact O-N 2.82Å; F174-G176 VanDerWaalsContact C-N 3.27Å; F174-G176 PolarHBondContact O-N 3.42Å; G176-A179 PolarHBondContact O-N 2.84Å; G176-I180 WeakPolarHBondContact O-CG1 3.47Å; G176-I180 PolarHBondContact O-N 2.97Å
177F88.3Confident82.8Confident58 Ų5864.5 Ų64.525%0.25434%0.337SS..Hα-helixtrans-67.8-39.9178-73.7-61.6000112.5L111 V115 T119 Q158 P173 F174 A179 I180 A181L111-F177 HydrophobicContact CD1-CD1 4.02Å; L111-F177 HydrophobicContact CD1-CE1 4.16Å; L111-F177 HydrophobicContact CD1-CG 4.3Å; L111-F177 HydrophobicContact CD2-CD2 4.24Å; L111-F177 HydrophobicContact CD2-CE1 4.41Å; L111-F177 HydrophobicContact CD2-CE2 3.89Å; L111-F177 HydrophobicContact CD2-CZ 3.99Å; V115-F177 HydrophobicContact CG1-CE1 3.94Å; V115-F177 HydrophobicContact CG1-CZ 3.94Å; T119-F177 HydrophobicContact CG2-CD1 4.21Å; T119-F177 HydrophobicContact CG2-CE1 4.35Å; Q158-F177 HydrophobicContact CG-CE1 4.11Å; Q158-F177 HydrophobicContact CG-CZ 4.31Å; P173-F177 HydrophobicContact CB-CD2 4.47Å; P173-F177 HydrophobicContact CB-CE2 4.26Å; P173-F177 WeakPolarHBondContact O-CD2 3.26Å; P173-F177 PolarHBondContact O-N 3.21Å; F174-F177 PolarHBondContact O-N 2.99Å; F177-A179 VanDerWaalsContact C-N 3.3Å; F177-A179 PolarHBondContact O-N 2.9Å; F177-I180 PolarHBondContact O-N 3.12Å; F177-A181 PolarHBondContact O-N 3.42Å
178M91.9Very high84.3Confident100 Ų10062.8 Ų62.849%0.49333%0.327SS..Hα-helixtrans-60.5-41.7173.5-72.5-58.8-64.600111.6F174 L175 A181 V182F174-M178 HydrophobicContact CD1-CG 4.37Å; F174-M178 HydrophobicContact CE1-CG 3.98Å; F174-M178 HydrophobicContact CE2-CG 4.38Å; F174-M178 HydrophobicContact CZ-CG 3.98Å; F174-M178 HydrophobicContact CZ-SD 4.31Å; F174-M178 WeakPolarHBondContact O-CG 3.4Å; F174-M178 PolarHBondContact O-N 2.93Å; L175-M178 PolarHBondContact O-N 3.31Å; M178-A181 PolarHBondContact O-N 2.91Å; M178-V182 PolarHBondContact O-N 3.02Å; M178-V182 VanDerWaalsContact O-N 3.14Å
179A92.6Very high86.1Confident4 Ų456.7 Ų56.73%0.03330%0.297CS..Hα-helixtrans-63-41.117500000112M103 I106 A107 L175 G176 F177 A181 V182 A183M103-A179 HydrophobicContact CB-CB 4.35Å; M103-A179 WeakPolarHBondContact O-CB 3.1Å; M103-A179 HydrophobicContact SD-CB 4.18Å; I106-A179 HydrophobicContact CB-CB 4.19Å; I106-A179 HydrophobicContact CG2-CB 3.96Å; A107-A179 HydrophobicContact CB-CB 4.12Å; L175-A179 WeakPolarHBondContact O-CB 3.34Å; L175-A179 PolarHBondContact O-N 3.32Å; G176-A179 PolarHBondContact O-N 2.84Å; F177-A179 VanDerWaalsContact C-N 3.3Å; F177-A179 PolarHBondContact O-N 2.9Å; A179-A181 PolarHBondContact O-N 2.68Å; A179-V182 PolarHBondContact O-N 3.22Å; A179-A183 VanDerWaalsContact O-CB 3.31Å; A179-A183 WeakPolarHBondContact O-CB 3.17Å; A179-A183 PolarHBondContact O-N 3.29Å
180I92.1Very high87.5Confident1 Ų153.7 Ų53.71%0.00528%0.279CS..Hα-helixtrans-61.9-43174.2-66.7175.8000111.3A107 L111 Y116 T119 Y120 G176 F177 V182 A183 V184A107-I180 HydrophobicContact CB-CD1 4.33Å; A107-I180 HydrophobicContact CB-CG1 3.61Å; L111-I180 HydrophobicContact CD1-CD1 3.44Å; L111-I180 VanDerWaalsContact CD1-CD1 3.44Å; L111-I180 HydrophobicContact CD1-CG1 4.29Å; Y116-I180 HydrophobicContact CD2-CD1 3.78Å; Y116-I180 HydrophobicContact CD2-CG1 3.88Å; Y116-I180 HydrophobicContact CE2-CG1 4.18Å; T119-I180 HydrophobicContact CG2-CB 4.37Å; T119-I180 HydrophobicContact CG2-CD1 3.95Å; T119-I180 HydrophobicContact CG2-CG2 3.65Å; Y120-I180 HydrophobicContact CD2-CG2 4.45Å; G176-I180 WeakPolarHBondContact O-CG1 3.47Å; G176-I180 PolarHBondContact O-N 2.97Å; F177-I180 PolarHBondContact O-N 3.12Å; I180-V182 PolarHBondContact O-N 2.69Å; I180-A183 PolarHBondContact O-N 3.23Å; I180-V184 HydrophobicContact CG2-CG2 3.95Å; I180-V184 VanDerWaalsContact O-CB 3.32Å; I180-V184 WeakPolarHBondContact O-CB 3.43Å; I180-V184 VanDerWaalsContact O-CG2 3.28Å; I180-V184 WeakPolarHBondContact O-CG2 3.42Å; I180-V184 PolarHBondContact O-N 3.4Å
181A91.5Very high88.3Confident47 Ų4745.6 Ų45.639%0.38825%0.247SC..Hα-helixtrans-59.1-47.1179.800000111.6F177 M178 A179 V184 L185F177-A181 PolarHBondContact O-N 3.42Å; M178-A181 PolarHBondContact O-N 2.91Å; A179-A181 PolarHBondContact O-N 2.68Å; A181-V184 PolarHBondContact O-N 3.43Å; A181-L185 WeakPolarHBondContact O-CG 3.16Å; A181-L185 PolarHBondContact O-N 3.16Å; A181-L185 VanDerWaalsContact O-N 3.16Å
182V94Very high88.9Confident55 Ų5542.8 Ų42.833%0.33323%0.234SC..Hα-helixtrans-62-47.4174.5177.50000110.7V99 M103 M178 A179 I180 V184 L185 C186V99-V182 HydrophobicContact CG1-CG1 4.12Å; M103-V182 HydrophobicContact CG-CB 4.21Å; M103-V182 HydrophobicContact CG-CG1 3.92Å; M178-V182 PolarHBondContact O-N 3.02Å; M178-V182 VanDerWaalsContact O-N 3.14Å; A179-V182 PolarHBondContact O-N 3.22Å; I180-V182 PolarHBondContact O-N 2.69Å; V182-V184 VanDerWaalsContact C-N 3.29Å; V182-V184 PolarHBondContact O-N 3.07Å; V182-L185 PolarHBondContact O-N 3.27Å; V182-C186 WeakPolarHBondContact O-CB 3.25Å; V182-C186 PolarHBondContact O-N 2.91Å; V182-C186 PolarHBondContact O-SG 2.89Å
183A92.4Very high89.1Confident0 Ų041.8 Ų41.80%023%0.225CC..Hα-helixtrans-60.3-38.9-179.600000112.4Q100 M103 Y120 A179 I180 C186 S187Q100-A183 HydrophobicContact CG-CB 4.23Å; Q100-A183 WeakPolarHBondContact CG-O 3.48Å; M103-A183 HydrophobicContact CB-CB 3.95Å; Y120-A183 HydrophobicContact CE2-CB 3.94Å; A179-A183 VanDerWaalsContact O-CB 3.31Å; A179-A183 WeakPolarHBondContact O-CB 3.17Å; A179-A183 PolarHBondContact O-N 3.29Å; I180-A183 PolarHBondContact O-N 3.23Å; A183-C186 PolarHBondContact O-N 3.19Å; A183-S187 VanDerWaalsContact O-CB 3.24Å; A183-S187 WeakPolarHBondContact O-CB 3.45Å; A183-S187 PolarHBondContact O-N 3.44Å
184V90.9Very high89.2Confident12 Ų1239.2 Ų39.27%0.07321%0.207CC..Hα-helixtrans-63.9-45177.5156.30000111.5Y120 L122 K123 C126 I180 A181 V182 S187 G188Y120-V184 HydrophobicContact CD2-CG2 4.08Å; L122-V184 VanDerWaalsContact C-CG1 3.46Å; L122-V184 HydrophobicContact CB-CG1 4.03Å; L122-V184 HydrophobicContact CB-CG2 4.11Å; L122-V184 WeakPolarHBondContact O-CG1 3.45Å; K123-V184 HydrophobicContact CB-CG2 4.39Å; C126-V184 HydrophobicContact CB-CG1 3.91Å; I180-V184 HydrophobicContact CG2-CG2 3.95Å; I180-V184 VanDerWaalsContact O-CB 3.32Å; I180-V184 WeakPolarHBondContact O-CB 3.43Å; I180-V184 VanDerWaalsContact O-CG2 3.28Å; I180-V184 WeakPolarHBondContact O-CG2 3.42Å; I180-V184 PolarHBondContact O-N 3.4Å; A181-V184 PolarHBondContact O-N 3.43Å; V182-V184 VanDerWaalsContact C-N 3.29Å; V182-V184 PolarHBondContact O-N 3.07Å; V184-S187 WeakPolarHBondContact O-CB 3.42Å; V184-S187 PolarHBondContact O-N 2.96Å; V184-G188 PolarHBondContact O-N 3.46Å; V184-G188 VanDerWaalsContact O-N 3.08Å
185L90.9Very high89Confident110 Ų11032.8 Ų32.858%0.57618%0.179SC*.Hα-helixtrans-63.1-47.5176.3-68.7173.5000111.5A181 V182 S187 G188 F189A181-L185 WeakPolarHBondContact O-CG 3.16Å; A181-L185 PolarHBondContact O-N 3.16Å; A181-L185 VanDerWaalsContact O-N 3.16Å; V182-L185 PolarHBondContact O-N 3.27Å; L185-S187 VanDerWaalsContact C-N 3.31Å; L185-S187 PolarHBondContact O-N 3.14Å; L185-G188 PolarHBondContact O-N 3.5Å; L185-F189 PolarHBondContact O-N 3.5Å; L185-F189 VanDerWaalsContact O-N 3.08Å
186C91.6Very high88.8Confident19 Ų1934.1 Ų34.113%0.12818%0.181CC..Hα-helixtrans-59.5-42.5176-67.10000111.7V96 Q100 V182 A183 F189 A190V96-C186 VanDerWaalsContact CG1-CA 3.44Å; V96-C186 HydrophobicContact CG1-CB 3.45Å; V96-C186 VanDerWaalsContact CG1-CB 3.45Å; V96-C186 VanDerWaalsContact CG1-O 3.31Å; V96-C186 WeakPolarHBondContact CG1-O 3.35Å; Q100-C186 HydrophobicContact CB-CB 3.71Å; Q100-C186 HydrophobicContact CG-CB 4.26Å; V182-C186 WeakPolarHBondContact O-CB 3.25Å; V182-C186 PolarHBondContact O-N 2.91Å; V182-C186 PolarHBondContact O-SG 2.89Å; A183-C186 PolarHBondContact O-N 3.19Å; C186-F189 PolarHBondContact O-N 3.03Å; C186-A190 VanDerWaalsContact O-CB 3.23Å; C186-A190 WeakPolarHBondContact O-CB 3.36Å; C186-A190 PolarHBondContact O-N 2.95Å
187S88.3Confident88.6Confident19 Ų1934.5 Ų34.513%0.13318%0.184CC..Hα-helixtrans-60.5-47.2179.5-158.90000112.5Q100 A183 V184 L185 G191Q100-S187 PolarHBondContact NE2-OG 2.73Å; Q100-S187 VanDerWaalsContact OE1-CA 3.25Å; A183-S187 VanDerWaalsContact O-CB 3.24Å; A183-S187 WeakPolarHBondContact O-CB 3.45Å; A183-S187 PolarHBondContact O-N 3.44Å; V184-S187 WeakPolarHBondContact O-CB 3.42Å; V184-S187 PolarHBondContact O-N 2.96Å; L185-S187 VanDerWaalsContact C-N 3.31Å; L185-S187 PolarHBondContact O-N 3.14Å; S187-G191 PolarHBondContact O-N 2.86Å; S187-G191 VanDerWaalsContact O-N 3.11Å
188G85.2Confident88.2Confident0 Ų032.9 Ų32.90%018%0.178CC..Hα-helixtrans-63.4-48.7178.400000111.9T127 V184 L185 V192T127-G188 WeakPolarHBondContact OG1-CA 3.45Å; V184-G188 PolarHBondContact O-N 3.46Å; V184-G188 VanDerWaalsContact O-N 3.08Å; L185-G188 PolarHBondContact O-N 3.5Å; G188-V192 WeakPolarHBondContact O-CB 3.25Å; G188-V192 WeakPolarHBondContact O-CG2 3.48Å; G188-V192 PolarHBondContact O-N 3.13Å
189F89.8Confident87.7Confident73 Ų7334.1 Ų34.132%0.3218%0.18SC..Hα-helixtrans-65.3-53.7-179.3177.9-94.2000112.5V92 V96 M134 L185 C186 G191 V192 Y193V92-F189 HydrophobicContact CG1-CE1 4Å; V92-F189 HydrophobicContact CG1-CZ 4.33Å; V96-F189 HydrophobicContact CB-CD1 4.41Å; V96-F189 HydrophobicContact CG1-CD1 4.13Å; V96-F189 HydrophobicContact CG2-CD1 3.89Å; V96-F189 HydrophobicContact CG2-CE1 3.99Å; M134-F189 HydrophobicContact CE-CD2 4.18Å; M134-F189 HydrophobicContact CE-CE2 3.91Å; M134-F189 HydrophobicContact SD-CD2 3.85Å; M134-F189 HydrophobicContact SD-CE2 4.08Å; L185-F189 PolarHBondContact O-N 3.5Å; L185-F189 VanDerWaalsContact O-N 3.08Å; C186-F189 PolarHBondContact O-N 3.03Å; F189-G191 VanDerWaalsContact C-N 3.34Å; F189-G191 PolarHBondContact O-N 2.83Å; F189-V192 PolarHBondContact O-N 3.04Å; F189-Y193 HydrophobicContact CE1-CD2 4.21Å; F189-Y193 AromaticContact CZ-CD2 3.88Å; F189-Y193 HydrophobicContact CZ-CD2 3.88Å; F189-Y193 WeakPolarHBondContact O-CB 3.05Å; F189-Y193 PolarHBondContact O-N 3.44Å
190A88.8Confident87.1Confident0 Ų037.9 Ų37.90%021%0.206CC..Hα-helixtrans-63.6-40.6-175.500000111.9P93 V96 Y97 C186 Y193 F194P93-A190 HydrophobicContact CB-CB 4.19Å; V96-A190 HydrophobicContact CB-CB 3.97Å; V96-A190 HydrophobicContact CG1-CB 3.76Å; Y97-A190 HydrophobicContact CD1-CB 3.93Å; Y97-A190 HydrophobicContact CD2-CB 3.94Å; Y97-A190 HydrophobicContact CE1-CB 3.67Å; Y97-A190 HydrophobicContact CE2-CB 3.72Å; Y97-A190 HydrophobicContact CG-CB 4.03Å; C186-A190 VanDerWaalsContact O-CB 3.23Å; C186-A190 WeakPolarHBondContact O-CB 3.36Å; C186-A190 PolarHBondContact O-N 2.95Å; A190-Y193 PolarHBondContact O-N 3.45Å; A190-F194 VanDerWaalsContact O-CB 3.28Å; A190-F194 WeakPolarHBondContact O-CB 3.26Å; A190-F194 PolarHBondContact O-N 2.92Å
191G83.9Confident86.6Confident23 Ų2339.6 Ų39.624%0.23722%0.218CC..Hα-helixtrans-62.3-46177.600000112.8Y97 S187 F189 F194 E195Y97-G191 WeakPolarHBondContact OH-CA 3.42Å; Y97-G191 PolarHBondContact OH-N 3.41Å; S187-G191 PolarHBondContact O-N 2.86Å; S187-G191 VanDerWaalsContact O-N 3.11Å; F189-G191 VanDerWaalsContact C-N 3.34Å; F189-G191 PolarHBondContact O-N 2.83Å; G191-F194 PolarHBondContact O-N 2.97Å; G191-E195 PolarHBondContact O-N 3.47Å
192V84.5Confident86.2Confident0 Ų045.8 Ų45.80%025%0.245CC..Hα-helixtrans-71.5-37.9-180176.10000111.5T127 C130 M131 M134 L135 G188 F189 E195 K196T127-V192 HydrophobicContact CG2-CG2 3.76Å; C130-V192 HydrophobicContact CB-CB 4.03Å; C130-V192 HydrophobicContact CB-CG1 4.32Å; C130-V192 HydrophobicContact CB-CG2 3.76Å; M131-V192 HydrophobicContact CE-CG2 4.49Å; M131-V192 HydrophobicContact CG-CG1 4.3Å; M131-V192 HydrophobicContact CG-CG2 3.6Å; M134-V192 HydrophobicContact CB-CG1 3.92Å; M134-V192 HydrophobicContact CE-CG1 4.5Å; M134-V192 HydrophobicContact CG-CG1 4.45Å; M134-V192 HydrophobicContact SD-CB 4.26Å; M134-V192 HydrophobicContact SD-CG1 3.93Å; L135-V192 HydrophobicContact CD1-CG1 3.23Å; L135-V192 HydrophobicContact CG-CG1 4.45Å; G188-V192 WeakPolarHBondContact O-CB 3.25Å; G188-V192 WeakPolarHBondContact O-CG2 3.48Å; G188-V192 PolarHBondContact O-N 3.13Å; F189-V192 PolarHBondContact O-N 3.04Å; V192-E195 PolarHBondContact O-N 3.29Å; V192-K196 WeakPolarHBondContact O-CB 3.34Å; V192-K196 PolarHBondContact O-N 2.88Å
193Y88.4Confident85.8Confident55 Ų5544.7 Ų44.722%0.21624%0.238CC..Hα-helixtrans-60.9-48.5172.9-164-69.4000111K89 V92 P93 M134 F189 A190 E195 K196 V197K89-Y193 WeakPolarHBondContact O-CE1 3.41Å; V92-Y193 HydrophobicContact CB-CE1 4.49Å; V92-Y193 HydrophobicContact CB-CE2 4.41Å; V92-Y193 HydrophobicContact CG1-CD2 4.3Å; V92-Y193 HydrophobicContact CG1-CE2 4.03Å; P93-Y193 HydrophobicContact CB-CD1 4.43Å; P93-Y193 HydrophobicContact CG-CD1 3.93Å; P93-Y193 HydrophobicContact CG-CE1 4.46Å; M134-Y193 HydrophobicContact CE-CD2 3.8Å; M134-Y193 HydrophobicContact CE-CG 4.25Å; F189-Y193 HydrophobicContact CE1-CD2 4.21Å; F189-Y193 AromaticContact CZ-CD2 3.88Å; F189-Y193 HydrophobicContact CZ-CD2 3.88Å; F189-Y193 WeakPolarHBondContact O-CB 3.05Å; F189-Y193 PolarHBondContact O-N 3.44Å; A190-Y193 PolarHBondContact O-N 3.45Å; Y193-E195 PolarHBondContact O-N 2.81Å; Y193-K196 WeakPolarHBondContact O-CB 3.36Å; Y193-K196 PolarHBondContact O-N 3.44Å; Y193-K196 VanDerWaalsContact O-N 3.17Å; Y193-V197 HydrophobicContact CD1-CG2 3.8Å; Y193-V197 HydrophobicContact CE1-CG2 3.52Å; Y193-V197 PolarHBondContact O-N 2.88Å
194F84.8Confident85.5Confident16 Ų1645.8 Ų45.87%0.0725%0.246CC..Hα-helixtrans-61.3-43.4178.2-178.9-101.5000111.5L90 A190 G191 K196 V197 L198 R208 N209 M212L90-F194 HydrophobicContact CD2-CD2 3.83Å; L90-F194 HydrophobicContact CD2-CE2 4.14Å; A190-F194 VanDerWaalsContact O-CB 3.28Å; A190-F194 WeakPolarHBondContact O-CB 3.26Å; A190-F194 PolarHBondContact O-N 2.92Å; G191-F194 PolarHBondContact O-N 2.97Å; F194-K196 VanDerWaalsContact C-N 3.3Å; F194-K196 PolarHBondContact O-N 2.94Å; F194-V197 PolarHBondContact O-N 3.4Å; F194-L198 HydrophobicContact CE1-CB 4.45Å; F194-L198 HydrophobicContact CE1-CD2 4.05Å; F194-L198 VanDerWaalsContact O-CB 3.23Å; F194-L198 WeakPolarHBondContact O-CB 3.42Å; F194-L198 PolarHBondContact O-N 3.45Å; F194-R208 HydrophobicContact CE2-CB 4.37Å; F194-R208 HydrophobicContact CZ-CB 4.44Å; F194-N209 WeakPolarHBondContact CZ-OD1 3.33Å; F194-M212 HydrophobicContact CD2-CE 4.36Å; F194-M212 HydrophobicContact CD2-SD 3.46Å; F194-M212 WeakPolarHBondContact CD2-SD 3.49Å; F194-M212 HydrophobicContact CE2-CE 4.11Å; F194-M212 HydrophobicContact CE2-SD 3.68Å; F194-M212 HydrophobicContact CG-SD 4.28Å
195E82.4Confident85.4Confident13 Ų1345.2 Ų45.26%0.06124%0.243CC..Hα-helixtrans-58.1-43.1174.3-177.1178.7167.900111.5M131 L135 R137 G191 V192 Y193 L198 K199M131-E195 WeakPolarHBondContact CE-OE2 3.45Å; L135-E195 HydrophobicContact CD2-CG 4.45Å; R137-E195 IonicContact CZ-OE1 2.68Å; R137-E195 VanDerWaalsContact CZ-OE1 3.27Å; R137-E195 IonicContact NH1-OE1 3.27Å; R137-E195 PolarHBondContact NH1-OE1 3.28Å; R137-E195 IonicContact NH1-OE2 2.73Å; R137-E195 IonicContact NH2-OE1 2.87Å; R137-E195 PolarHBondContact NH2-OE1 3.45Å; G191-E195 PolarHBondContact O-N 3.47Å; V192-E195 PolarHBondContact O-N 3.29Å; Y193-E195 PolarHBondContact O-N 2.81Å; E195-L198 PolarHBondContact O-N 3.46Å; E195-K199 HydrophobicContact CG-CD 3.77Å; E195-K199 HydrophobicContact CG-CG 4.27Å; E195-K199 WeakPolarHBondContact O-CB 3.35Å; E195-K199 WeakPolarHBondContact O-CG 3.47Å; E195-K199 PolarHBondContact O-N 3.33Å; E195-K199 WeakPolarHBondContact OE1-CE 3.31Å; E195-K199 IonicContact OE1-NZ 2.81Å; E195-K199 PolarHBondContact OE1-NZ 3.08Å
196K83.3Confident85.4Confident111 Ų11140.8 Ų40.848%0.48322%0.218SC..Hα-helixtrans-60.6-45.3178.2-173.1174-176.9164.20111.8M134 L135 V192 Y193 F194 S200M134-K196 PolarHBondContact O-NZ 2.81Å; M134-K196 VanDerWaalsContact O-NZ 3.08Å; L135-K196 HydrophobicContact CD1-CB 4Å; L135-K196 HydrophobicContact CD1-CD 4.27Å; L135-K196 HydrophobicContact CD1-CG 4.41Å; V192-K196 WeakPolarHBondContact O-CB 3.34Å; V192-K196 PolarHBondContact O-N 2.88Å; Y193-K196 WeakPolarHBondContact O-CB 3.36Å; Y193-K196 PolarHBondContact O-N 3.44Å; Y193-K196 VanDerWaalsContact O-N 3.17Å; F194-K196 VanDerWaalsContact C-N 3.3Å; F194-K196 PolarHBondContact O-N 2.94Å; K196-S200 WeakPolarHBondContact O-CB 3.42Å; K196-S200 PolarHBondContact O-N 3.15Å
197V84.4Confident85.3Confident9 Ų940 Ų406%0.05521%0.213CC..Hα-helixtrans-69.7-46.1178.4179.10000110.9K89 L90 Y193 F194 K199 S200K89-V197 HydrophobicContact CB-CG2 4.48Å; L90-V197 HydrophobicContact CD1-CG1 4.41Å; L90-V197 HydrophobicContact CD2-CB 4.04Å; L90-V197 HydrophobicContact CD2-CG1 3.75Å; L90-V197 HydrophobicContact CD2-CG2 4.42Å; L90-V197 HydrophobicContact CG-CG1 4Å; Y193-V197 HydrophobicContact CD1-CG2 3.8Å; Y193-V197 HydrophobicContact CE1-CG2 3.52Å; Y193-V197 PolarHBondContact O-N 2.88Å; F194-V197 PolarHBondContact O-N 3.4Å; V197-K199 VanDerWaalsContact C-N 3.32Å; V197-K199 PolarHBondContact O-N 3.25Å; V197-S200 PolarHBondContact O-N 3.05Å; V197-S200 PolarHBondContact O-OG 2.94Å
198L81.3Confident85.4Confident24 Ų2439.4 Ų39.413%0.12621%0.208CC..Hα-helixtrans-57.6-43.8179.3179.566.3000111.8F194 E195 S200 L205 R208F194-L198 HydrophobicContact CE1-CB 4.45Å; F194-L198 HydrophobicContact CE1-CD2 4.05Å; F194-L198 VanDerWaalsContact O-CB 3.23Å; F194-L198 WeakPolarHBondContact O-CB 3.42Å; F194-L198 PolarHBondContact O-N 3.45Å; E195-L198 PolarHBondContact O-N 3.46Å; L198-S200 VanDerWaalsContact C-N 3.33Å; L198-L205 HydrophobicContact CD1-CB 4.46Å; L198-L205 HydrophobicContact CD1-CD1 4.24Å; L198-L205 HydrophobicContact CD2-CD1 3.96Å; L198-R208 HydrophobicContact CD1-CB 4.14Å; L198-R208 HydrophobicContact CD1-CG 3.85Å
199K80.4Confident85.6Confident125 Ų12539.4 Ų39.454%0.54321%0.208SC..THydrogen-bonded Turntrans-84.5-2.6-177.8-66.6-174.7176.5176.90114.2E195 V197 S201E195-K199 HydrophobicContact CG-CD 3.77Å; E195-K199 HydrophobicContact CG-CG 4.27Å; E195-K199 WeakPolarHBondContact O-CB 3.35Å; E195-K199 WeakPolarHBondContact O-CG 3.47Å; E195-K199 PolarHBondContact O-N 3.33Å; E195-K199 WeakPolarHBondContact OE1-CE 3.31Å; E195-K199 IonicContact OE1-NZ 2.81Å; E195-K199 PolarHBondContact OE1-NZ 3.08Å; V197-K199 VanDerWaalsContact C-N 3.32Å; V197-K199 PolarHBondContact O-N 3.25Å; K199-S201 VanDerWaalsContact C-N 3.32Å
200S81.3Confident85.7Confident84 Ų8436.1 Ų36.159%0.58719%0.193SC*.THydrogen-bonded Turntrans-83.5-5.7178.568.10000114.3K196 V197 L198K196-S200 WeakPolarHBondContact O-CB 3.42Å; K196-S200 PolarHBondContact O-N 3.15Å; V197-S200 PolarHBondContact O-N 3.05Å; V197-S200 PolarHBondContact O-OG 2.94Å; L198-S200 VanDerWaalsContact C-N 3.33Å
201S80.7Confident85.9Confident36 Ų3636.2 Ų36.225%0.25219%0.194SC..SBendtrans-153.4157-174.4640000111.6K199 T203 R208K199-S201 VanDerWaalsContact C-N 3.32Å; S201-T203 PolarHBondContact O-N 3.38Å; S201-T203 PolarHBondContact OG-OG1 2.79Å; S201-R208 PolarHBondContact OG-NE 3.3Å; S201-R208 PolarHBondContact OG-NH2 3.46Å
202D82.5Confident86.2Confident178 Ų17835.7 Ų35.795%0.95219%0.185SC*.  trans-79.28.6172.6-65.1-44.8000114.3
203T85.6Confident86.6Confident31 Ų3135.9 Ų35.919%0.1919%0.186CC..  trans-58.5139.4178.2-51.90000111.5S201 V207 R208S201-T203 PolarHBondContact O-N 3.38Å; S201-T203 PolarHBondContact OG-OG1 2.79Å; T203-V207 HydrophobicContact CG2-CB 3.79Å; T203-V207 HydrophobicContact CG2-CG1 3.55Å; T203-R208 HydrophobicContact CG2-CG 4.29Å
204S87.1Confident86.8Confident23 Ų2336.2 Ų36.216%0.16119%0.191CC..  trans-54.6142.9177.4170.50000112.3E65 W206 V207 R208E65-S204 PolarHBondContact OE1-OG 3.46Å; E65-S204 WeakPolarHBondContact OE2-CB 3.31Å; E65-S204 PolarHBondContact OE2-OG 3.28Å; S204-W206 PolarHBondContact O-N 2.86Å; S204-W206 PolarHBondContact OG-N 3.07Å; S204-V207 WeakPolarHBondContact O-CB 3.21Å; S204-V207 PolarHBondContact O-N 3.4Å; S204-R208 PolarHBondContact O-N 2.91Å; S204-R208 VanDerWaalsContact O-N 3.08Å
205L87.6Confident87.1Confident1 Ų136.1 Ų36.11%0.00519%0.192CC..Hα-helixtrans-56.8-38.3174.2178.7117000111.2L198 R208 N209 K264L198-L205 HydrophobicContact CD1-CB 4.46Å; L198-L205 HydrophobicContact CD1-CD1 4.24Å; L198-L205 HydrophobicContact CD2-CD1 3.96Å; L205-R208 PolarHBondContact O-N 3.17Å; L205-N209 WeakPolarHBondContact O-CB 3.35Å; L205-N209 PolarHBondContact O-N 3.02Å; L205-K264 HydrophobicContact CB-CD 3.8Å; L205-K264 HydrophobicContact CD1-CB 3.9Å; L205-K264 HydrophobicContact CD1-CD 3.72Å; L205-K264 HydrophobicContact CD1-CG 4.4Å; L205-K264 HydrophobicContact CG-CD 4.25Å
206W90.9Very high87.6Confident17 Ų1735.5 Ų35.56%0.06419%0.19CC..Hα-helixtrans-70.1-35.1-178.4-52.4115.6000111.7M61 L62 E65 S204 N209 I210 L257 V261M61-W206 HydrophobicContact CB-CD2 3.43Å; M61-W206 VanDerWaalsContact CB-CD2 3.43Å; M61-W206 HydrophobicContact CB-CE3 3.62Å; M61-W206 HydrophobicContact CB-CG 3.95Å; M61-W206 HydrophobicContact CB-CH2 4.01Å; M61-W206 HydrophobicContact CB-CZ2 3.85Å; M61-W206 HydrophobicContact CB-CZ3 3.9Å; M61-W206 HydrophobicContact CE-CH2 3.76Å; M61-W206 HydrophobicContact CE-CZ2 3.34Å; M61-W206 HydrophobicContact CG-CD2 4.29Å; M61-W206 HydrophobicContact CG-CE3 4.1Å; M61-W206 HydrophobicContact CG-CH2 3.79Å; M61-W206 HydrophobicContact CG-CZ2 3.99Å; M61-W206 HydrophobicContact CG-CZ3 3.85Å; L62-W206 HydrophobicContact CB-CB 3.89Å; L62-W206 HydrophobicContact CD1-CB 4.26Å; E65-W206 VanDerWaalsContact OE2-CD1 3.27Å; S204-W206 PolarHBondContact O-N 2.86Å; S204-W206 PolarHBondContact OG-N 3.07Å; W206-N209 PolarHBondContact O-N 2.9Å; W206-I210 WeakPolarHBondContact O-CB 3.34Å; W206-I210 WeakPolarHBondContact O-CD1 3.35Å; W206-I210 WeakPolarHBondContact O-CG1 3.49Å; W206-I210 PolarHBondContact O-N 3.01Å; W206-L257 HydrophobicContact CZ3-CD2 4.23Å; W206-V261 HydrophobicContact CH2-CG2 3.72Å; W206-V261 HydrophobicContact CZ2-CG2 4.26Å
207V90.9Very high88.1Confident3 Ų331.9 Ų31.92%0.01818%0.175CC..Hα-helixtrans-64.2-46.2172.6172.60000110.6L62 H79 T203 S204 N209 I210 Q211L62-V207 HydrophobicContact CD1-CG2 3.81Å; L62-V207 HydrophobicContact CD2-CG2 3.83Å; H79-V207 HydrophobicContact CB-CG1 3.43Å; H79-V207 VanDerWaalsContact CB-CG1 3.43Å; T203-V207 HydrophobicContact CG2-CB 3.79Å; T203-V207 HydrophobicContact CG2-CG1 3.55Å; S204-V207 WeakPolarHBondContact O-CB 3.21Å; S204-V207 PolarHBondContact O-N 3.4Å; V207-N209 VanDerWaalsContact C-N 3.31Å; V207-N209 PolarHBondContact O-N 2.84Å; V207-I210 PolarHBondContact O-N 3.39Å; V207-Q211 WeakPolarHBondContact O-CG 3.43Å; V207-Q211 PolarHBondContact O-N 3.03Å
208R89.3Confident88.5Confident6 Ų636.3 Ų36.32%0.02320%0.202CC..Hα-helixtrans-60.5-41.1175.8-63.7-52.5-169.6170.34.5112.1E86 F194 L198 S201 T203 S204 L205 Q211 M212E86-R208 IonicContact OE2-CZ 2.7Å; E86-R208 VanDerWaalsContact OE2-CZ 3.28Å; E86-R208 IonicContact OE2-NH1 2.72Å; E86-R208 PolarHBondContact OE2-NH1 2.93Å; E86-R208 IonicContact OE2-NH2 3.92Å; E86-R208 PolarHBondContact OE2-NH2 2.93Å; F194-R208 HydrophobicContact CE2-CB 4.37Å; F194-R208 HydrophobicContact CZ-CB 4.44Å; L198-R208 HydrophobicContact CD1-CB 4.14Å; L198-R208 HydrophobicContact CD1-CG 3.85Å; S201-R208 PolarHBondContact OG-NE 3.3Å; S201-R208 PolarHBondContact OG-NH2 3.46Å; T203-R208 HydrophobicContact CG2-CG 4.29Å; S204-R208 PolarHBondContact O-N 2.91Å; S204-R208 VanDerWaalsContact O-N 3.08Å; L205-R208 PolarHBondContact O-N 3.17Å; R208-Q211 PolarHBondContact O-N 3.3Å; R208-M212 WeakPolarHBondContact O-CB 3.24Å; R208-M212 PolarHBondContact O-N 3.03Å
209N90.4Very high89.1Confident0 Ų037.1 Ų37.10%021%0.208CC..Hα-helixtrans-62.2-45.5173.7-82.84.5000112.1F194 L205 W206 V207 M212 Y213F194-N209 WeakPolarHBondContact CZ-OD1 3.33Å; L205-N209 WeakPolarHBondContact O-CB 3.35Å; L205-N209 PolarHBondContact O-N 3.02Å; W206-N209 PolarHBondContact O-N 2.9Å; V207-N209 VanDerWaalsContact C-N 3.31Å; V207-N209 PolarHBondContact O-N 2.84Å; N209-M212 PolarHBondContact O-N 3.17Å; N209-Y213 HydrophobicContact CB-CD2 4.1Å; N209-Y213 HydrophobicContact CB-CE2 3.55Å; N209-Y213 WeakPolarHBondContact O-CB 3.46Å; N209-Y213 WeakPolarHBondContact O-CD2 3.34Å; N209-Y213 PolarHBondContact O-N 3.46Å
210I92.4Very high89.6Confident3 Ų331.4 Ų31.42%0.01518%0.184CC..Hα-helixtrans-60.6-48.4177.3-72.3158.4000111L55 L59 L62 V80 W206 V207 M212 Y213 L214L55-I210 HydrophobicContact CD1-CB 4.19Å; L55-I210 HydrophobicContact CD1-CG1 4.07Å; L55-I210 HydrophobicContact CD1-CG2 3.86Å; L59-I210 HydrophobicContact CD2-CD1 3.65Å; L59-I210 HydrophobicContact CD2-CG1 4.19Å; L59-I210 HydrophobicContact CG-CD1 4.13Å; L59-I210 HydrophobicContact CG-CG1 4.28Å; L62-I210 HydrophobicContact CB-CD1 4.24Å; L62-I210 HydrophobicContact CD2-CD1 3.57Å; V80-I210 HydrophobicContact CG2-CG2 4.05Å; W206-I210 WeakPolarHBondContact O-CB 3.34Å; W206-I210 WeakPolarHBondContact O-CD1 3.35Å; W206-I210 WeakPolarHBondContact O-CG1 3.49Å; W206-I210 PolarHBondContact O-N 3.01Å; V207-I210 PolarHBondContact O-N 3.39Å; I210-M212 VanDerWaalsContact C-N 3.29Å; I210-M212 PolarHBondContact O-N 3.47Å; I210-Y213 PolarHBondContact O-N 2.86Å; I210-L214 HydrophobicContact CG2-CD1 3.81Å; I210-L214 HydrophobicContact CG2-CG 4.31Å; I210-L214 WeakPolarHBondContact O-CB 3.28Å; I210-L214 VanDerWaalsContact O-CG 3.26Å; I210-L214 WeakPolarHBondContact O-CG 3.38Å; I210-L214 PolarHBondContact O-N 3.47Å
211Q91.2Very high90.2Very high2 Ų231.6 Ų31.61%0.00918%0.178CC..Hα-helixtrans-55.5-46.6176.6-71.2169.2-22.900111.1H79 V80 L87 L90 V207 R208 S215H79-Q211 PolarHBondContact O-NE2 3.36Å; V80-Q211 HydrophobicContact CG2-CG 4.33Å; L87-Q211 HydrophobicContact CD1-CB 4.21Å; L87-Q211 VanDerWaalsContact CD1-O 3.28Å; L87-Q211 WeakPolarHBondContact CD1-O 3.18Å; L90-Q211 HydrophobicContact CD1-CB 3.47Å; L90-Q211 VanDerWaalsContact CD1-CB 3.47Å; L90-Q211 HydrophobicContact CD1-CG 4.31Å; V207-Q211 WeakPolarHBondContact O-CG 3.43Å; V207-Q211 PolarHBondContact O-N 3.03Å; R208-Q211 PolarHBondContact O-N 3.3Å; Q211-S215 PolarHBondContact O-N 2.95Å; Q211-S215 PolarHBondContact O-OG 3.46Å
212M90.4Very high90.8Very high13 Ų1332 Ų326%0.06418%0.183CC..Hα-helixtrans-63.5-54.3178.1-166.9176.666.500111.4L90 S94 Y97 F194 R208 N209 I210 L214 S215 G216L90-M212 HydrophobicContact CB-CB 4.37Å; S94-M212 WeakPolarHBondContact OG-CG 3.34Å; S94-M212 PolarHBondContact OG-O 3.32Å; Y97-M212 HydrophobicContact CD2-SD 4.09Å; Y97-M212 HydrophobicContact CE2-SD 4.01Å; F194-M212 HydrophobicContact CD2-CE 4.36Å; F194-M212 HydrophobicContact CD2-SD 3.46Å; F194-M212 WeakPolarHBondContact CD2-SD 3.49Å; F194-M212 HydrophobicContact CE2-CE 4.11Å; F194-M212 HydrophobicContact CE2-SD 3.68Å; F194-M212 HydrophobicContact CG-SD 4.28Å; R208-M212 WeakPolarHBondContact O-CB 3.24Å; R208-M212 PolarHBondContact O-N 3.03Å; N209-M212 PolarHBondContact O-N 3.17Å; I210-M212 VanDerWaalsContact C-N 3.29Å; I210-M212 PolarHBondContact O-N 3.47Å; M212-L214 VanDerWaalsContact C-N 3.32Å; M212-L214 PolarHBondContact O-N 2.98Å; M212-S215 PolarHBondContact O-N 2.92Å; M212-S215 VanDerWaalsContact O-N 3.12Å; M212-S215 PolarHBondContact O-OG 3.5Å; M212-G216 PolarHBondContact O-N 3.26Å
213Y92.7Very high91.1Very high4 Ų424.5 Ų24.52%0.01615%0.148CC..Hα-helixtrans-64.8-32.3-176.4-57.7-34.8000113.2E51 K54 S58 N209 I210 G216 I217 L257E51-Y213 WeakPolarHBondContact OE2-CD1 3.3Å; K54-Y213 HydrophobicContact CB-CD1 4.32Å; K54-Y213 HydrophobicContact CB-CD2 3.79Å; K54-Y213 HydrophobicContact CB-CE1 4.19Å; K54-Y213 HydrophobicContact CB-CE2 3.65Å; K54-Y213 HydrophobicContact CB-CG 4.14Å; K54-Y213 HydrophobicContact CD-CE1 3.89Å; S58-Y213 VanDerWaalsContact OG-CE2 3.29Å; S58-Y213 WeakPolarHBondContact OG-CE2 3.18Å; N209-Y213 HydrophobicContact CB-CD2 4.1Å; N209-Y213 HydrophobicContact CB-CE2 3.55Å; N209-Y213 WeakPolarHBondContact O-CB 3.46Å; N209-Y213 WeakPolarHBondContact O-CD2 3.34Å; N209-Y213 PolarHBondContact O-N 3.46Å; I210-Y213 PolarHBondContact O-N 2.86Å; Y213-G216 PolarHBondContact O-N 3.15Å; Y213-I217 VanDerWaalsContact O-CG1 3.26Å; Y213-I217 WeakPolarHBondContact O-CG1 3.38Å; Y213-I217 PolarHBondContact O-N 3.39Å; Y213-L257 HydrophobicContact CE2-CD2 4.02Å
214L93.3Very high91.4Very high62 Ų6223.3 Ų23.333%0.32514%0.141SC..Hα-helixtrans-59.1-48.9172.1-77.4169.7000111.5L55 V80 L87 I210 M212 G216 I217 V218L55-L214 HydrophobicContact CD1-CD2 4.29Å; L55-L214 HydrophobicContact CD1-CG 4.11Å; L55-L214 HydrophobicContact CD2-CD2 3.82Å; L55-L214 HydrophobicContact CD2-CG 4.45Å; V80-L214 HydrophobicContact CG1-CD1 3.49Å; V80-L214 VanDerWaalsContact CG1-CD1 3.49Å; L87-L214 HydrophobicContact CD1-CB 4.43Å; I210-L214 HydrophobicContact CG2-CD1 3.81Å; I210-L214 HydrophobicContact CG2-CG 4.31Å; I210-L214 WeakPolarHBondContact O-CB 3.28Å; I210-L214 VanDerWaalsContact O-CG 3.26Å; I210-L214 WeakPolarHBondContact O-CG 3.38Å; I210-L214 PolarHBondContact O-N 3.47Å; M212-L214 VanDerWaalsContact C-N 3.32Å; M212-L214 PolarHBondContact O-N 2.98Å; L214-G216 VanDerWaalsContact C-N 3.33Å; L214-I217 PolarHBondContact O-N 3.43Å; L214-V218 PolarHBondContact O-N 3.4Å
215S91.6Very high91.6Very high13 Ų1330.6 Ų30.69%0.09117%0.166CC..Hα-helixtrans-67.7-34.4174.8650000112.4S91 S94 Q211 M212 V218 V219S91-S215 WeakPolarHBondContact CA-OG 3.37Å; S94-S215 WeakPolarHBondContact CB-OG 3.45Å; S94-S215 PolarHBondContact OG-OG 3.38Å; Q211-S215 PolarHBondContact O-N 2.95Å; Q211-S215 PolarHBondContact O-OG 3.46Å; M212-S215 PolarHBondContact O-N 2.92Å; M212-S215 VanDerWaalsContact O-N 3.12Å; M212-S215 PolarHBondContact O-OG 3.5Å; S215-V218 PolarHBondContact O-N 3.37Å; S215-V219 VanDerWaalsContact O-CG2 3.29Å; S215-V219 WeakPolarHBondContact O-CG2 3.29Å; S215-V219 PolarHBondContact O-N 2.82Å
216G91.6Very high91.8Very high1 Ų138.1 Ų38.11%0.0120%0.203CC..Hα-helixtrans-61.7-41.8175.600000113.2M212 Y213 L214 V219 T220M212-G216 PolarHBondContact O-N 3.26Å; Y213-G216 PolarHBondContact O-N 3.15Å; L214-G216 VanDerWaalsContact C-N 3.33Å; G216-V219 PolarHBondContact O-N 3.37Å; G216-T220 WeakPolarHBondContact O-CB 3.29Å; G216-T220 VanDerWaalsContact O-CG2 3.28Å; G216-T220 WeakPolarHBondContact O-CG2 3.3Å; G216-T220 PolarHBondContact O-N 3.03Å; G216-T220 PolarHBondContact O-OG1 3.2Å
217I94.5Very high91.5Very high34 Ų3441.7 Ų41.717%0.17423%0.227CC..Hα-helixtrans-61.3-46.7176.1-69162.1000110.3E51 V52 L55 Y213 L214 V219 T220 L221E51-I217 HydrophobicContact CB-CG1 3.75Å; V52-I217 HydrophobicContact CG2-CD1 3.98Å; V52-I217 HydrophobicContact CG2-CG1 3.91Å; V52-I217 HydrophobicContact CG2-CG2 4.3Å; L55-I217 HydrophobicContact CB-CD1 4.18Å; L55-I217 HydrophobicContact CD2-CD1 3.56Å; L55-I217 HydrophobicContact CG-CD1 4.49Å; Y213-I217 VanDerWaalsContact O-CG1 3.26Å; Y213-I217 WeakPolarHBondContact O-CG1 3.38Å; Y213-I217 PolarHBondContact O-N 3.39Å; L214-I217 PolarHBondContact O-N 3.43Å; I217-V219 VanDerWaalsContact C-N 3.35Å; I217-V219 PolarHBondContact O-N 3.29Å; I217-T220 WeakPolarHBondContact CA-OG1 3.28Å; I217-T220 PolarHBondContact O-N 3.5Å; I217-T220 PolarHBondContact O-OG1 2.94Å; I217-L221 WeakPolarHBondContact O-CB 3.46Å; I217-L221 PolarHBondContact O-N 2.73Å
218V93.9Very high91.4Very high102 Ų10243.6 Ų43.662%0.61824%0.236SC*.Hα-helixtrans-60.1-46.7178.7176.50000110.8L214 S215 A222L214-V218 PolarHBondContact O-N 3.4Å; S215-V218 PolarHBondContact O-N 3.37Å; V218-A222 WeakPolarHBondContact O-CB 3.18Å; V218-A222 PolarHBondContact O-N 2.9Å
219V92.4Very high91.4Very high41 Ų4143.6 Ų43.625%0.24824%0.238CC..Hα-helixtrans-68.5-42.7-178.2175.70000112V95 A98 S215 G216 I217 A222 G223V95-V219 HydrophobicContact CB-CG1 4.36Å; V95-V219 HydrophobicContact CG1-CG1 4.47Å; V95-V219 HydrophobicContact CG2-CB 4.38Å; V95-V219 HydrophobicContact CG2-CG1 4Å; V95-V219 HydrophobicContact CG2-CG2 3.55Å; A98-V219 HydrophobicContact CB-CG1 3.92Å; S215-V219 VanDerWaalsContact O-CG2 3.29Å; S215-V219 WeakPolarHBondContact O-CG2 3.29Å; S215-V219 PolarHBondContact O-N 2.82Å; G216-V219 PolarHBondContact O-N 3.37Å; I217-V219 VanDerWaalsContact C-N 3.35Å; I217-V219 PolarHBondContact O-N 3.29Å; V219-A222 PolarHBondContact O-N 3.35Å; V219-G223 PolarHBondContact O-N 3.02Å
220T92.3Very high91.4Very high5 Ų547.4 Ų47.43%0.03127%0.269CS..Hα-helixtrans-69.3-37.3-179.850.80000111.6V47 E51 A98 G216 I217 G223 V224V47-T220 HydrophobicContact CG1-CG2 3.81Å; E51-T220 HydrophobicContact CG-CG2 4.06Å; A98-T220 HydrophobicContact CB-CG2 3.68Å; G216-T220 WeakPolarHBondContact O-CB 3.29Å; G216-T220 VanDerWaalsContact O-CG2 3.28Å; G216-T220 WeakPolarHBondContact O-CG2 3.3Å; G216-T220 PolarHBondContact O-N 3.03Å; G216-T220 PolarHBondContact O-OG1 3.2Å; I217-T220 WeakPolarHBondContact CA-OG1 3.28Å; I217-T220 PolarHBondContact O-N 3.5Å; I217-T220 PolarHBondContact O-OG1 2.94Å; T220-G223 WeakPolarHBondContact O-CA 3.1Å; T220-G223 PolarHBondContact O-N 3.08Å; T220-V224 WeakPolarHBondContact O-CG2 3.39Å; T220-V224 PolarHBondContact O-N 2.91Å
221L93.6Very high91.2Very high88 Ų8851.7 Ų51.746%0.46129%0.289SS..Hα-helixtrans-67.1-40.9173.4-171.865.5000112.1I217 G223 V224 Y225 F237I217-L221 WeakPolarHBondContact O-CB 3.46Å; I217-L221 PolarHBondContact O-N 2.73Å; L221-G223 VanDerWaalsContact C-N 3.27Å; L221-G223 PolarHBondContact O-N 3.09Å; L221-V224 WeakPolarHBondContact O-CB 3.43Å; L221-V224 PolarHBondContact O-N 3.35Å; L221-Y225 PolarHBondContact O-N 3.25Å; L221-F237 HydrophobicContact CD1-CE2 4.17Å
222A92.3Very high91.3Very high44 Ų4452.3 Ų52.336%0.36429%0.293SS..Hα-helixtrans-60.4-40.3170.700000111V218 V219 Y225 M226V218-A222 WeakPolarHBondContact O-CB 3.18Å; V218-A222 PolarHBondContact O-N 2.9Å; V219-A222 PolarHBondContact O-N 3.35Å; A222-Y225 PolarHBondContact O-N 3.28Å; A222-M226 WeakPolarHBondContact O-CB 3.26Å; A222-M226 VanDerWaalsContact O-CG 3.26Å; A222-M226 WeakPolarHBondContact O-CG 3.42Å; A222-M226 PolarHBondContact O-N 2.73Å
223G89.5Confident91.4Very high22 Ų2258.1 Ų58.123%0.22732%0.323CS..Hα-helixtrans-56.2-51.1172.400000112.3V219 T220 L221 Y225 M226 T227V219-G223 PolarHBondContact O-N 3.02Å; T220-G223 WeakPolarHBondContact O-CA 3.1Å; T220-G223 PolarHBondContact O-N 3.08Å; L221-G223 VanDerWaalsContact C-N 3.27Å; L221-G223 PolarHBondContact O-N 3.09Å; G223-Y225 VanDerWaalsContact C-N 3.3Å; G223-Y225 PolarHBondContact O-N 3.38Å; G223-M226 PolarHBondContact O-N 2.92Å; G223-T227 PolarHBondContact O-N 3.23Å; G223-T227 PolarHBondContact O-OG1 3.36Å
224V92.4Very high91.4Very high5 Ų565.2 Ų65.23%0.0336%0.356CS..Hα-helixtrans-52.6-50.2174.9173.80000110.6T44 T45 C48 T220 L221 M226 E228 G229 V232 F237T44-V224 WeakPolarHBondContact OG1-CG2 3.39Å; T45-V224 HydrophobicContact CG2-CG1 3.83Å; T45-V224 HydrophobicContact CG2-CG2 4.06Å; C48-V224 HydrophobicContact CB-CG2 4.28Å; T220-V224 WeakPolarHBondContact O-CG2 3.39Å; T220-V224 PolarHBondContact O-N 2.91Å; L221-V224 WeakPolarHBondContact O-CB 3.43Å; L221-V224 PolarHBondContact O-N 3.35Å; V224-M226 PolarHBondContact O-N 3.26Å; V224-E228 CarbonylContact O-C 3.18Å; V224-E228 PolarHBondContact O-N 3.49Å; V224-G229 PolarHBondContact O-N 3.4Å; V224-V232 HydrophobicContact CG1-CG1 4.32Å; V224-V232 HydrophobicContact CG1-CG2 4.01Å; V224-F237 HydrophobicContact CG1-CD2 4.45Å; V224-F237 HydrophobicContact CG1-CE2 4.12Å; V224-F237 HydrophobicContact CG2-CE2 4.38Å
225Y91.4Very high91.3Very high176 Ų17666.8 Ų66.869%0.6936%0.361SS*.Hα-helixtrans-62.1-41.8-178.8-175-99000112.4L221 A222 G223 G229L221-Y225 PolarHBondContact O-N 3.25Å; A222-Y225 PolarHBondContact O-N 3.28Å; G223-Y225 VanDerWaalsContact C-N 3.3Å; G223-Y225 PolarHBondContact O-N 3.38Å; Y225-G229 WeakPolarHBondContact O-CA 3.4Å; Y225-G229 PolarHBondContact O-N 2.99Å
226M90.3Very high91.3Very high159 Ų15967.6 Ų67.678%0.78337%0.371SS*.Hα-helixtrans-74.2-36.6-176.9-71.5179.971.900113.8A222 G223 V224A222-M226 WeakPolarHBondContact O-CB 3.26Å; A222-M226 VanDerWaalsContact O-CG 3.26Å; A222-M226 WeakPolarHBondContact O-CG 3.42Å; A222-M226 PolarHBondContact O-N 2.73Å; G223-M226 PolarHBondContact O-N 2.92Å; V224-M226 PolarHBondContact O-N 3.26Å
227T86.2Confident91.3Very high93 Ų9369.9 Ų69.957%0.57138%0.381SS*.Hα-helixtrans-95.9-41.1-174.454.70000113.2T44 G223T44-T227 WeakPolarHBondContact CG2-OG1 3.04Å; G223-T227 PolarHBondContact O-N 3.23Å; G223-T227 PolarHBondContact O-OG1 3.36Å
228E87.9Confident91.3Very high42 Ų4274.2 Ų74.220%0.19640%0.398CS..Hα-helixtrans-129.89.2-168.7-64.7175.7138.900111.9F42 T44 V224 A230 Q231 V232F42-E228 WeakPolarHBondContact CB-OE2 3.39Å; F42-E228 HydrophobicContact CD1-CB 4.07Å; F42-E228 HydrophobicContact CD1-CG 4.12Å; F42-E228 HydrophobicContact CE1-CB 4.43Å; T44-E228 WeakPolarHBondContact CB-OE2 3.44Å; T44-E228 VanDerWaalsContact CG2-OE2 3.23Å; T44-E228 WeakPolarHBondContact CG2-OE2 3.35Å; T44-E228 PolarHBondContact OG1-OE2 3.35Å; V224-E228 CarbonylContact O-C 3.18Å; V224-E228 PolarHBondContact O-N 3.49Å; E228-A230 PolarHBondContact O-N 2.9Å; E228-Q231 PolarHBondContact O-N 3.46Å; E228-Q231 VanDerWaalsContact O-N 3.09Å; E228-V232 HydrophobicContact CB-CG2 4.16Å; E228-V232 WeakPolarHBondContact O-CB 3.14Å; E228-V232 WeakPolarHBondContact O-CG2 3.4Å; E228-V232 PolarHBondContact O-N 3.4Å
229G88.9Confident91.2Very high7 Ų773 Ų737%0.07238%0.383CS..Hα-helixtrans-56.4-45.5-170.300000114.3V224 Y225 Q231 V232 I233V224-G229 PolarHBondContact O-N 3.4Å; Y225-G229 WeakPolarHBondContact O-CA 3.4Å; Y225-G229 PolarHBondContact O-N 2.99Å; G229-Q231 PolarHBondContact O-N 2.95Å; G229-V232 PolarHBondContact O-N 3.41Å; G229-I233 WeakPolarHBondContact O-CB 3.31Å; G229-I233 WeakPolarHBondContact O-CD1 3.47Å; G229-I233 VanDerWaalsContact O-CG1 3.22Å; G229-I233 WeakPolarHBondContact O-CG1 3.28Å; G229-I233 PolarHBondContact O-N 2.95Å
230A90.3Very high91.1Very high80 Ų8072.7 Ų72.766%0.66138%0.383SS*.Hα-helixtrans-60.7-44.6177.900000111.9E228 I233 E234E228-A230 PolarHBondContact O-N 2.9Å; A230-I233 PolarHBondContact O-N 3.22Å; A230-E234 PolarHBondContact O-N 2.9Å; A230-E234 VanDerWaalsContact O-N 3.1Å
231Q89.1Confident91Very high92 Ų9274.6 Ų74.643%0.4339%0.39SS..Hα-helixtrans-72.1-33.5-179.9-57.3-175.331.400112F42 E228 G229 E234 K235F42-Q231 HydrophobicContact CE1-CB 3.8Å; F42-Q231 HydrophobicContact CZ-CB 3.61Å; E228-Q231 PolarHBondContact O-N 3.46Å; E228-Q231 VanDerWaalsContact O-N 3.09Å; G229-Q231 PolarHBondContact O-N 2.95Å; Q231-E234 PolarHBondContact O-N 2.89Å; Q231-K235 VanDerWaalsContact O-CB 3.29Å; Q231-K235 WeakPolarHBondContact O-CB 3.29Å; Q231-K235 PolarHBondContact O-N 3.19Å
232V92.4Very high90.9Very high16 Ų1672 Ų7210%0.09738%0.378CS..Hα-helixtrans-68.4-37.1175.5164.20000111.4F42 T45 V224 E228 G229 G236 F237F42-V232 HydrophobicContact CD2-CG2 3.61Å; F42-V232 HydrophobicContact CE2-CG2 3.79Å; F42-V232 HydrophobicContact CG-CG2 4.01Å; F42-V232 HydrophobicContact CZ-CG2 4.33Å; T45-V232 HydrophobicContact CG2-CG2 4.1Å; V224-V232 HydrophobicContact CG1-CG1 4.32Å; V224-V232 HydrophobicContact CG1-CG2 4.01Å; E228-V232 HydrophobicContact CB-CG2 4.16Å; E228-V232 WeakPolarHBondContact O-CB 3.14Å; E228-V232 WeakPolarHBondContact O-CG2 3.4Å; E228-V232 PolarHBondContact O-N 3.4Å; G229-V232 PolarHBondContact O-N 3.41Å; V232-G236 CarbonylContact O-C 3.45Å; V232-G236 WeakPolarHBondContact O-CA 3.39Å; V232-G236 PolarHBondContact O-N 3.44Å; V232-F237 HydrophobicContact CG1-CB 4.18Å; V232-F237 HydrophobicContact CG1-CD2 4.04Å
233I92.3Very high91Very high134 Ų13475.1 Ų75.169%0.68739%0.394SS*.Hα-helixtrans-67.8-41.6174.9-69.6164.6000110.3G229 A230G229-I233 WeakPolarHBondContact O-CB 3.31Å; G229-I233 WeakPolarHBondContact O-CD1 3.47Å; G229-I233 VanDerWaalsContact O-CG1 3.22Å; G229-I233 WeakPolarHBondContact O-CG1 3.28Å; G229-I233 PolarHBondContact O-N 2.95Å; A230-I233 PolarHBondContact O-N 3.22Å
234E92.6Very high91.1Very high154 Ų15479.9 Ų79.972%0.7241%0.406SS*.Hα-helixtrans-72-47.2-178.9-172.2-174.1175.300112.9A230 Q231A230-E234 PolarHBondContact O-N 2.9Å; A230-E234 VanDerWaalsContact O-N 3.1Å; Q231-E234 PolarHBondContact O-N 2.89Å
235K91.1Very high91.1Very high95 Ų9579.7 Ų79.741%0.41340%0.404SS..Hα-helixtrans-97.8-14.5-172.4-61.5-178179.6174.20114F42 Q231 Y239F42-K235 HydrophobicContact CE2-CB 4.45Å; F42-K235 HydrophobicContact CZ-CD 4.22Å; Q231-K235 VanDerWaalsContact O-CB 3.29Å; Q231-K235 WeakPolarHBondContact O-CB 3.29Å; Q231-K235 PolarHBondContact O-N 3.19Å; K235-Y239 HydrophobicContact CB-CD1 4.23Å; K235-Y239 HydrophobicContact CB-CD2 3.66Å; K235-Y239 HydrophobicContact CB-CE2 4.17Å; K235-Y239 HydrophobicContact CB-CG 3.68Å; K235-Y239 HydrophobicContact CD-CD1 3.99Å; K235-Y239 HydrophobicContact CD-CD2 4.4Å; K235-Y239 HydrophobicContact CD-CE1 3.81Å; K235-Y239 HydrophobicContact CD-CE2 4.24Å; K235-Y239 HydrophobicContact CD-CG 4.27Å; K235-Y239 HydrophobicContact CG-CD2 4.43Å; K235-Y239 HydrophobicContact CG-CE2 4.47Å
236G92.6Very high91.2Very high30 Ų3074.6 Ų74.631%0.30939%0.394SS..  trans93.7152.4-174.500000113.8V232 F238 Y239V232-G236 CarbonylContact O-C 3.45Å; V232-G236 WeakPolarHBondContact O-CA 3.39Å; V232-G236 PolarHBondContact O-N 3.44Å; G236-F238 VanDerWaalsContact C-N 3.31Å; G236-F238 PolarHBondContact O-N 2.93Å; G236-Y239 VanDerWaalsContact O-CB 3.31Å; G236-Y239 WeakPolarHBondContact O-CB 3.38Å; G236-Y239 PolarHBondContact O-N 3.39Å
237F92.6Very high91.5Very high49 Ų4970.7 Ų70.722%0.21537%0.372CS..THydrogen-bonded Turntrans-62.9-33.4-178.6-170.8-84.4000113.9T45 C48 I49 L221 V224 V232T45-F237 HydrophobicContact CG2-CD1 4.25Å; T45-F237 HydrophobicContact CG2-CD2 3.85Å; T45-F237 HydrophobicContact CG2-CE1 4.11Å; T45-F237 HydrophobicContact CG2-CE2 3.72Å; T45-F237 HydrophobicContact CG2-CG 4.12Å; T45-F237 HydrophobicContact CG2-CZ 3.86Å; C48-F237 HydrophobicContact CB-CZ 4.29Å; I49-F237 HydrophobicContact CD1-CE1 3.79Å; I49-F237 HydrophobicContact CD1-CZ 4.38Å; I49-F237 HydrophobicContact CG1-CE1 3.82Å; I49-F237 HydrophobicContact CG1-CZ 4.45Å; L221-F237 HydrophobicContact CD1-CE2 4.17Å; V224-F237 HydrophobicContact CG1-CD2 4.45Å; V224-F237 HydrophobicContact CG1-CE2 4.12Å; V224-F237 HydrophobicContact CG2-CE2 4.38Å; V232-F237 HydrophobicContact CG1-CB 4.18Å; V232-F237 HydrophobicContact CG1-CD2 4.04Å
238F93.4Very high91.8Very high124 Ų12466.3 Ų66.354%0.54435%0.346SS..THydrogen-bonded Turntrans-101.125.3-179.8-60.7-76000112.6I49 G236 S240 Y241I49-F238 HydrophobicContact CD1-CE1 3.92Å; I49-F238 HydrophobicContact CD1-CZ 4Å; I49-F238 HydrophobicContact CG1-CE1 4.03Å; G236-F238 VanDerWaalsContact C-N 3.31Å; G236-F238 PolarHBondContact O-N 2.93Å; F238-S240 PolarHBondContact O-N 3.42Å; F238-Y241 HydrophobicContact CB-CD2 4.23Å; F238-Y241 HydrophobicContact CB-CG 4.25Å; F238-Y241 AromaticContact CD1-CD1 3.97Å; F238-Y241 HydrophobicContact CD1-CD1 3.97Å; F238-Y241 HydrophobicContact CD1-CD2 4.49Å; F238-Y241 AromaticContact CD1-CE1 3.88Å; F238-Y241 HydrophobicContact CD1-CE1 3.88Å; F238-Y241 HydrophobicContact CD1-CE2 4.42Å; F238-Y241 HydrophobicContact CD1-CG 4.26Å; F238-Y241 HydrophobicContact CE1-CE1 4.41Å; F238-Y241 WeakPolarHBondContact O-CB 3.39Å; F238-Y241 WeakPolarHBondContact O-CD2 3.35Å; F238-Y241 PolarHBondContact O-N 2.88Å
239Y91.4Very high92.1Very high77 Ų7764.5 Ų64.530%0.30234%0.337SS..THydrogen-bonded Turntrans-56.8129.8179.6-178.3-106.5000111.6A39 F42 K235 G236 Y241A39-Y239 HydrophobicContact CB-CE1 4.06Å; F42-Y239 HydrophobicContact CE2-CD1 4.23Å; F42-Y239 HydrophobicContact CE2-CG 4.42Å; F42-Y239 HydrophobicContact CZ-CD1 4.5Å; K235-Y239 HydrophobicContact CB-CD1 4.23Å; K235-Y239 HydrophobicContact CB-CD2 3.66Å; K235-Y239 HydrophobicContact CB-CE2 4.17Å; K235-Y239 HydrophobicContact CB-CG 3.68Å; K235-Y239 HydrophobicContact CD-CD1 3.99Å; K235-Y239 HydrophobicContact CD-CD2 4.4Å; K235-Y239 HydrophobicContact CD-CE1 3.81Å; K235-Y239 HydrophobicContact CD-CE2 4.24Å; K235-Y239 HydrophobicContact CD-CG 4.27Å; K235-Y239 HydrophobicContact CG-CD2 4.43Å; K235-Y239 HydrophobicContact CG-CE2 4.47Å; G236-Y239 VanDerWaalsContact O-CB 3.31Å; G236-Y239 WeakPolarHBondContact O-CB 3.38Å; G236-Y239 PolarHBondContact O-N 3.39Å; Y239-Y241 PolarHBondContact O-N 2.66Å
240S89.9Confident92.4Very high34 Ų3469.1 Ų69.124%0.23836%0.356CS..THydrogen-bonded Turntrans57.226.4-178.7-60.90000115.6A39 F238 T242A39-S240 WeakPolarHBondContact CB-OG 3.31Å; A39-S240 WeakPolarHBondContact O-CB 3.17Å; A39-S240 PolarHBondContact O-OG 3.27Å; F238-S240 PolarHBondContact O-N 3.42Å; S240-T242 PolarHBondContact O-N 2.98Å
241Y91.9Very high92.6Very high46 Ų4665.9 Ų65.918%0.1833%0.327CS..  trans-72116171.3-88.7-125.1000110.5T45 A46 F238 Y239 V245T45-Y241 WeakPolarHBondContact CB-OH 3.44Å; T45-Y241 PolarHBondContact O-OH 3.26Å; T45-Y241 PolarHBondContact OG1-OH 3.14Å; A46-Y241 VanDerWaalsContact CA-OH 3.29Å; A46-Y241 WeakPolarHBondContact CA-OH 3.48Å; A46-Y241 PolarHBondContact N-OH 3.45Å; F238-Y241 HydrophobicContact CB-CD2 4.23Å; F238-Y241 HydrophobicContact CB-CG 4.25Å; F238-Y241 AromaticContact CD1-CD1 3.97Å; F238-Y241 HydrophobicContact CD1-CD1 3.97Å; F238-Y241 HydrophobicContact CD1-CD2 4.49Å; F238-Y241 AromaticContact CD1-CE1 3.88Å; F238-Y241 HydrophobicContact CD1-CE1 3.88Å; F238-Y241 HydrophobicContact CD1-CE2 4.42Å; F238-Y241 HydrophobicContact CD1-CG 4.26Å; F238-Y241 HydrophobicContact CE1-CE1 4.41Å; F238-Y241 WeakPolarHBondContact O-CB 3.39Å; F238-Y241 WeakPolarHBondContact O-CD2 3.35Å; F238-Y241 PolarHBondContact O-N 2.88Å; Y239-Y241 PolarHBondContact O-N 2.66Å; Y241-V245 HydrophobicContact CD1-CB 4.48Å; Y241-V245 HydrophobicContact CD1-CG1 3.83Å; Y241-V245 HydrophobicContact CD2-CG1 4.41Å; Y241-V245 HydrophobicContact CE1-CG1 3.91Å; Y241-V245 HydrophobicContact CE2-CG1 4.48Å; Y241-V245 HydrophobicContact CG-CG1 4.11Å
242T91.6Very high92.7Very high33 Ų3362.5 Ų62.520%0.20232%0.315CS..  trans-99.5164.7171.669.10000110.4S240 W244 V245 C246S240-T242 PolarHBondContact O-N 2.98Å; T242-W244 PolarHBondContact O-N 3.15Å; T242-W244 VanDerWaalsContact O-N 3.11Å; T242-W244 PolarHBondContact OG1-N 3.22Å; T242-V245 WeakPolarHBondContact O-CB 3.49Å; T242-V245 PolarHBondContact O-N 2.65Å; T242-V245 PolarHBondContact OG1-N 3.06Å; T242-C246 PolarHBondContact O-N 2.73Å; T242-C246 VanDerWaalsContact O-N 3.1Å
243P93.3Very high92.7Very high110 Ų11061.7 Ų61.771%0.71431%0.31SS*.Hα-helixtrans-53.1-32.1172.1-2836.2000113.1C246 F247P243-C246 PolarHBondContact O-N 2.87Å; P243-F247 WeakPolarHBondContact O-CB 3.2Å; P243-F247 PolarHBondContact O-N 3.08Å
244W92.1Very high92.7Very high122 Ų12256.5 Ų56.546%0.46228%0.284SS..Hα-helixtrans-67.1-39.3174.8-63.4114.9000112.7V28 Y31 T32 T242 F247 V248V28-W244 HydrophobicContact CG1-CE3 3.97Å; Y31-W244 HydrophobicContact CD1-CG 4.4Å; Y31-W244 AromaticContact CE1-CD1 3.86Å; Y31-W244 HydrophobicContact CE1-CD2 4.32Å; Y31-W244 HydrophobicContact CE1-CG 4.11Å; Y31-W244 AromaticContact CE1-NE1 3.92Å; T32-W244 HydrophobicContact CG2-CB 3.62Å; T242-W244 PolarHBondContact O-N 3.15Å; T242-W244 VanDerWaalsContact O-N 3.11Å; T242-W244 PolarHBondContact OG1-N 3.22Å; W244-F247 HydrophobicContact CE3-CD1 4.29Å; W244-F247 HydrophobicContact CZ3-CD1 4.38Å; W244-F247 PolarHBondContact O-N 2.96Å; W244-V248 WeakPolarHBondContact O-CG2 3.28Å; W244-V248 PolarHBondContact O-N 2.79Å
245V92.3Very high92.6Very high0 Ų050 Ų500%026%0.259CS..Hα-helixtrans-63.5-45.11741790000110.4T32 Y41 Y241 T242 F247 V248 V249T32-V245 HydrophobicContact CG2-CG2 4.21Å; Y41-V245 HydrophobicContact CD1-CG1 4.38Å; Y41-V245 HydrophobicContact CD1-CG2 3.52Å; Y41-V245 HydrophobicContact CD2-CG1 3.89Å; Y41-V245 HydrophobicContact CD2-CG2 4.5Å; Y41-V245 HydrophobicContact CE1-CG1 4.42Å; Y41-V245 HydrophobicContact CE1-CG2 3.61Å; Y41-V245 HydrophobicContact CE2-CG1 3.94Å; Y41-V245 HydrophobicContact CG-CG1 4.12Å; Y41-V245 HydrophobicContact CG-CG2 4Å; Y241-V245 HydrophobicContact CD1-CB 4.48Å; Y241-V245 HydrophobicContact CD1-CG1 3.83Å; Y241-V245 HydrophobicContact CD2-CG1 4.41Å; Y241-V245 HydrophobicContact CE1-CG1 3.91Å; Y241-V245 HydrophobicContact CE2-CG1 4.48Å; Y241-V245 HydrophobicContact CG-CG1 4.11Å; T242-V245 WeakPolarHBondContact O-CB 3.49Å; T242-V245 PolarHBondContact O-N 2.65Å; T242-V245 PolarHBondContact OG1-N 3.06Å; V245-F247 VanDerWaalsContact C-N 3.26Å; V245-F247 PolarHBondContact O-N 3.28Å; V245-V248 WeakPolarHBondContact O-CB 3.38Å; V245-V248 PolarHBondContact O-N 3.01Å; V245-V249 WeakPolarHBondContact O-CG2 3.18Å; V245-V249 PolarHBondContact O-N 2.7Å
246C94.4Very high92.4Very high70 Ų7046.5 Ų46.547%0.47325%0.25SC..Hα-helixtrans-59.1-39.6174.6-64.90000111.7T242 P243 V249 F250T242-C246 PolarHBondContact O-N 2.73Å; T242-C246 VanDerWaalsContact O-N 3.1Å; P243-C246 PolarHBondContact O-N 2.87Å; C246-V249 PolarHBondContact O-N 2.82Å; C246-F250 WeakPolarHBondContact O-CB 3.32Å; C246-F250 PolarHBondContact O-N 3.46Å
247F94.7Very high92.2Very high76 Ų7645.7 Ų45.733%0.33324%0.238SC..Hα-helixtrans-66.1-39.6176.3-172.8-132.2000112.6T24 V28 P243 W244 V245 F250 L251T24-F247 HydrophobicContact CG2-CE1 3.96Å; T24-F247 HydrophobicContact CG2-CZ 4.26Å; V28-F247 HydrophobicContact CG1-CD1 4.1Å; V28-F247 HydrophobicContact CG2-CD1 4.21Å; V28-F247 HydrophobicContact CG2-CE1 4.14Å; P243-F247 WeakPolarHBondContact O-CB 3.2Å; P243-F247 PolarHBondContact O-N 3.08Å; W244-F247 HydrophobicContact CE3-CD1 4.29Å; W244-F247 HydrophobicContact CZ3-CD1 4.38Å; W244-F247 PolarHBondContact O-N 2.96Å; V245-F247 VanDerWaalsContact C-N 3.26Å; V245-F247 PolarHBondContact O-N 3.28Å; F247-F250 HydrophobicContact CD2-CD1 4.26Å; F247-F250 HydrophobicContact CE2-CD1 4.31Å; F247-F250 PolarHBondContact O-N 3.19Å; F247-L251 HydrophobicContact CD1-CD1 3.96Å; F247-L251 HydrophobicContact CD2-CD1 4.44Å; F247-L251 HydrophobicContact CD2-CG 4.25Å; F247-L251 HydrophobicContact CE1-CD1 3.66Å; F247-L251 HydrophobicContact CE1-CG 4.37Å; F247-L251 HydrophobicContact CE2-CD1 4.16Å; F247-L251 HydrophobicContact CE2-CD2 4.1Å; F247-L251 HydrophobicContact CE2-CG 3.97Å; F247-L251 HydrophobicContact CG-CD1 4.34Å; F247-L251 HydrophobicContact CZ-CD1 3.77Å; F247-L251 HydrophobicContact CZ-CD2 4.06Å; F247-L251 HydrophobicContact CZ-CG 4.03Å; F247-L251 WeakPolarHBondContact O-CB 3.42Å; F247-L251 VanDerWaalsContact O-CG 3.31Å; F247-L251 WeakPolarHBondContact O-CG 3.38Å; F247-L251 PolarHBondContact O-N 3.26Å
248V92.6Very high91.9Very high1 Ų145.8 Ų45.81%0.00624%0.238CC..Hα-helixtrans-59.6-47.3173170.30000111.1Y25 V28 L29 T32 W244 V245 F250 L251 A252Y25-V248 HydrophobicContact CD2-CG1 4.06Å; Y25-V248 HydrophobicContact CE2-CG1 3.72Å; V28-V248 HydrophobicContact CB-CG2 4.07Å; V28-V248 HydrophobicContact CG1-CG2 3.55Å; L29-V248 HydrophobicContact CB-CG1 4.12Å; L29-V248 HydrophobicContact CB-CG2 4.28Å; L29-V248 HydrophobicContact CD1-CG1 4.07Å; T32-V248 HydrophobicContact CG2-CG2 3.99Å; W244-V248 WeakPolarHBondContact O-CG2 3.28Å; W244-V248 PolarHBondContact O-N 2.79Å; V245-V248 WeakPolarHBondContact O-CB 3.38Å; V245-V248 PolarHBondContact O-N 3.01Å; V248-F250 VanDerWaalsContact C-N 3.31Å; V248-F250 PolarHBondContact O-N 2.7Å; V248-L251 PolarHBondContact O-N 3.38Å; V248-A252 WeakPolarHBondContact O-CB 3.47Å; V248-A252 PolarHBondContact O-N 3.09Å
249V94.8Very high91.2Very high4 Ų442.1 Ų42.12%0.02423%0.225CC..Hα-helixtrans-62.2-40.6178.9172.60000111.1A46 I49 I53 V245 C246 S253A46-V249 HydrophobicContact CB-CG2 3.87Å; I49-V249 HydrophobicContact CB-CG1 4.1Å; I49-V249 HydrophobicContact CG2-CG1 3.68Å; I53-V249 HydrophobicContact CD1-CG1 3.8Å; V245-V249 WeakPolarHBondContact O-CG2 3.18Å; V245-V249 PolarHBondContact O-N 2.7Å; C246-V249 PolarHBondContact O-N 2.82Å; V249-S253 WeakPolarHBondContact O-CB 3.32Å; V249-S253 PolarHBondContact O-N 3.49Å; V249-S253 PolarHBondContact O-OG 2.91Å
250F95.3Very high90.6Very high105 Ų10539.1 Ų39.146%0.46122%0.216SC..Hα-helixtrans-62.2-50.2173.7174.4-102.3000112C246 F247 V248 A252 S253 V254C246-F250 WeakPolarHBondContact O-CB 3.32Å; C246-F250 PolarHBondContact O-N 3.46Å; F247-F250 HydrophobicContact CD2-CD1 4.26Å; F247-F250 HydrophobicContact CE2-CD1 4.31Å; F247-F250 PolarHBondContact O-N 3.19Å; V248-F250 VanDerWaalsContact C-N 3.31Å; V248-F250 PolarHBondContact O-N 2.7Å; F250-A252 VanDerWaalsContact C-N 3.33Å; F250-A252 PolarHBondContact O-N 3.36Å; F250-S253 WeakPolarHBondContact O-CB 3.23Å; F250-S253 PolarHBondContact O-N 3.23Å; F250-S253 VanDerWaalsContact O-N 3.13Å; F250-V254 HydrophobicContact CD1-CG2 4.44Å; F250-V254 HydrophobicContact CD2-CG2 4.29Å; F250-V254 HydrophobicContact CE1-CG2 4Å; F250-V254 HydrophobicContact CE2-CG2 3.84Å; F250-V254 HydrophobicContact CZ-CG2 3.67Å; F250-V254 WeakPolarHBondContact O-CG2 3.41Å; F250-V254 PolarHBondContact O-N 3.27Å
251L93.7Very high90.2Very high11 Ų1138.3 Ų38.36%0.05821%0.21CC..Hα-helixtrans-60.5-41.2178.2-72.2172.2000112V21 T24 Y25 F247 V248 S253 V254 G255V21-L251 HydrophobicContact CG1-CB 4.39Å; V21-L251 HydrophobicContact CG1-CD2 4.25Å; V21-L251 VanDerWaalsContact CG1-O 3.25Å; V21-L251 WeakPolarHBondContact CG1-O 3.46Å; V21-L251 HydrophobicContact CG2-CD2 4.29Å; T24-L251 HydrophobicContact CG2-CD1 3.7Å; Y25-L251 HydrophobicContact CD2-CB 4.32Å; F247-L251 HydrophobicContact CD1-CD1 3.96Å; F247-L251 HydrophobicContact CD2-CD1 4.44Å; F247-L251 HydrophobicContact CD2-CG 4.25Å; F247-L251 HydrophobicContact CE1-CD1 3.66Å; F247-L251 HydrophobicContact CE1-CG 4.37Å; F247-L251 HydrophobicContact CE2-CD1 4.16Å; F247-L251 HydrophobicContact CE2-CD2 4.1Å; F247-L251 HydrophobicContact CE2-CG 3.97Å; F247-L251 HydrophobicContact CG-CD1 4.34Å; F247-L251 HydrophobicContact CZ-CD1 3.77Å; F247-L251 HydrophobicContact CZ-CD2 4.06Å; F247-L251 HydrophobicContact CZ-CG 4.03Å; F247-L251 WeakPolarHBondContact O-CB 3.42Å; F247-L251 VanDerWaalsContact O-CG 3.31Å; F247-L251 WeakPolarHBondContact O-CG 3.38Å; F247-L251 PolarHBondContact O-N 3.26Å; V248-L251 PolarHBondContact O-N 3.38Å; L251-S253 VanDerWaalsContact C-N 3.3Å; L251-S253 PolarHBondContact O-N 3.36Å; L251-V254 PolarHBondContact O-N 2.92Å; L251-G255 PolarHBondContact O-N 2.72Å
252A91.5Very high89.4Confident21 Ų2136.4 Ų36.417%0.17420%0.202CC..Hα-helixtrans-60.9-41.2175.600000111.5Y25 T50 V248 F250 G256Y25-A252 HydrophobicContact CD2-CB 4.14Å; Y25-A252 HydrophobicContact CE2-CB 3.73Å; T50-A252 HydrophobicContact CG2-CB 3.64Å; V248-A252 WeakPolarHBondContact O-CB 3.47Å; V248-A252 PolarHBondContact O-N 3.09Å; F250-A252 VanDerWaalsContact C-N 3.33Å; F250-A252 PolarHBondContact O-N 3.36Å; A252-G256 PolarHBondContact O-N 3.09Å
253S93.1Very high88.3Confident0 Ų036.7 Ų36.70%020%0.204CC..Hα-helixtrans-66.2-49.3179.2-56.40000111.7T50 I53 V249 F250 L251 G256 L257T50-S253 PolarHBondContact O-OG 3.24Å; I53-S253 WeakPolarHBondContact CB-OG 3.38Å; V249-S253 WeakPolarHBondContact O-CB 3.32Å; V249-S253 PolarHBondContact O-N 3.49Å; V249-S253 PolarHBondContact O-OG 2.91Å; F250-S253 WeakPolarHBondContact O-CB 3.23Å; F250-S253 PolarHBondContact O-N 3.23Å; F250-S253 VanDerWaalsContact O-N 3.13Å; L251-S253 VanDerWaalsContact C-N 3.3Å; L251-S253 PolarHBondContact O-N 3.36Å; S253-G256 PolarHBondContact O-N 2.92Å; S253-L257 PolarHBondContact O-N 3.06Å
254V92.1Very high87.3Confident24 Ų2435.5 Ų35.515%0.14519%0.188CC..Hα-helixtrans-61.7-46.6176.7174.40000110.6V21 F250 L251 G256 L257 Y258V21-V254 HydrophobicContact CG2-CG1 4.08Å; F250-V254 HydrophobicContact CD1-CG2 4.44Å; F250-V254 HydrophobicContact CD2-CG2 4.29Å; F250-V254 HydrophobicContact CE1-CG2 4Å; F250-V254 HydrophobicContact CE2-CG2 3.84Å; F250-V254 HydrophobicContact CZ-CG2 3.67Å; F250-V254 WeakPolarHBondContact O-CG2 3.41Å; F250-V254 PolarHBondContact O-N 3.27Å; L251-V254 PolarHBondContact O-N 2.92Å; V254-G256 VanDerWaalsContact C-N 3.32Å; V254-G256 PolarHBondContact O-N 2.69Å; V254-L257 PolarHBondContact O-N 3.48Å; V254-Y258 HydrophobicContact CG1-CD2 3.66Å; V254-Y258 HydrophobicContact CG1-CE2 3.79Å; V254-Y258 WeakPolarHBondContact O-CD2 3.42Å; V254-Y258 PolarHBondContact O-N 3.12Å
255G89.5Confident86.2Confident17 Ų1733.9 Ų33.918%0.17518%0.182CC..Hα-helixtrans-59.1-40.5179.500000113.1L251 T259L251-G255 PolarHBondContact O-N 2.72Å; G255-T259 WeakPolarHBondContact O-CB 3.49Å; G255-T259 PolarHBondContact O-N 3.03Å; G255-T259 PolarHBondContact O-OG1 3.23Å
256G86.7Confident85Confident22 Ų2234.7 Ų34.723%0.22719%0.187CC..Hα-helixtrans-63.2-43.3176.200000113.4A252 S253 V254 T259 S260A252-G256 PolarHBondContact O-N 3.09Å; S253-G256 PolarHBondContact O-N 2.92Å; V254-G256 VanDerWaalsContact C-N 3.32Å; V254-G256 PolarHBondContact O-N 2.69Å; G256-T259 PolarHBondContact O-N 2.95Å; G256-S260 PolarHBondContact O-N 3.3Å; G256-S260 PolarHBondContact O-OG 3.33Å
257L88.5Confident83.6Confident14 Ų1435.4 Ų35.47%0.07319%0.186CC..Hα-helixtrans-68.8-46.2178.4-65.2171.6000112.1K54 L57 S58 W206 Y213 S253 V254 T259 S260 V261K54-L257 HydrophobicContact CG-CG 4.42Å; L57-L257 HydrophobicContact CB-CD1 3.37Å; L57-L257 HydrophobicContact CD1-CD1 3.47Å; L57-L257 VanDerWaalsContact CD1-CD1 3.47Å; L57-L257 HydrophobicContact CG-CD1 4.06Å; S58-L257 WeakPolarHBondContact OG-CD2 3.5Å; W206-L257 HydrophobicContact CZ3-CD2 4.23Å; Y213-L257 HydrophobicContact CE2-CD2 4.02Å; S253-L257 PolarHBondContact O-N 3.06Å; V254-L257 PolarHBondContact O-N 3.48Å; L257-T259 VanDerWaalsContact C-N 3.25Å; L257-T259 PolarHBondContact O-N 2.98Å; L257-S260 WeakPolarHBondContact O-CA 3.43Å; L257-S260 WeakPolarHBondContact O-CB 3.39Å; L257-S260 PolarHBondContact O-N 2.81Å; L257-V261 WeakPolarHBondContact O-CG2 3.34Å; L257-V261 PolarHBondContact O-N 3.42Å
258Y86.7Confident82.1Confident50 Ų5035.8 Ų35.820%0.19619%0.191CC..Hα-helixtrans-62.5-35.1177.5-89.2-96.4000111.9Y13 V17 V254 S260 V261 V262Y13-Y258 AromaticContact CE1-CE1 3.88Å; Y13-Y258 HydrophobicContact CE1-CE1 3.88Å; Y13-Y258 PolarHBondContact OH-OH 3.48Å; V17-Y258 HydrophobicContact CB-CD1 4.15Å; V17-Y258 HydrophobicContact CB-CE1 3.86Å; V17-Y258 HydrophobicContact CG1-CD1 3.87Å; V17-Y258 HydrophobicContact CG1-CD2 4.1Å; V17-Y258 HydrophobicContact CG1-CE1 3.65Å; V17-Y258 HydrophobicContact CG1-CE2 3.89Å; V17-Y258 HydrophobicContact CG1-CG 4.08Å; V17-Y258 HydrophobicContact CG2-CE1 4.24Å; V254-Y258 HydrophobicContact CG1-CD2 3.66Å; V254-Y258 HydrophobicContact CG1-CE2 3.79Å; V254-Y258 WeakPolarHBondContact O-CD2 3.42Å; V254-Y258 PolarHBondContact O-N 3.12Å; Y258-S260 VanDerWaalsContact C-N 3.26Å; Y258-S260 PolarHBondContact O-N 3.2Å; Y258-V261 PolarHBondContact O-N 3.4Å; Y258-V262 WeakPolarHBondContact O-CB 3.5Å; Y258-V262 WeakPolarHBondContact O-CG2 3.24Å; Y258-V262 PolarHBondContact O-N 2.88Å
259T79.8Confident80.8Confident47 Ų4737.4 Ų37.429%0.28820%0.2SC..Hα-helixtrans-58.3-41.6172.8-60.30000111.2G255 G256 L257 V263G255-T259 WeakPolarHBondContact O-CB 3.49Å; G255-T259 PolarHBondContact O-N 3.03Å; G255-T259 PolarHBondContact O-OG1 3.23Å; G256-T259 PolarHBondContact O-N 2.95Å; L257-T259 VanDerWaalsContact C-N 3.25Å; L257-T259 PolarHBondContact O-N 2.98Å; T259-V263 VanDerWaalsContact O-CG2 3.24Å; T259-V263 WeakPolarHBondContact O-CG2 3.39Å; T259-V263 PolarHBondContact O-N 3.25Å; T259-V263 VanDerWaalsContact O-N 3.09Å
260S77.8Confident79.4Confident14 Ų1438.8 Ų38.810%0.09821%0.207CC..Hα-helixtrans-68.2-40.5178.2-53.50000112.3G256 L257 Y258 V263 K264G256-S260 PolarHBondContact O-N 3.3Å; G256-S260 PolarHBondContact O-OG 3.33Å; L257-S260 WeakPolarHBondContact O-CA 3.43Å; L257-S260 WeakPolarHBondContact O-CB 3.39Å; L257-S260 PolarHBondContact O-N 2.81Å; Y258-S260 VanDerWaalsContact C-N 3.26Å; Y258-S260 PolarHBondContact O-N 3.2Å; S260-V263 PolarHBondContact O-N 2.88Å; S260-K264 PolarHBondContact O-N 3.08Å
261V82.3Confident78.3Confident18 Ų1837.3 Ų37.311%0.10920%0.2CC..Hα-helixtrans-63.8-46.9176.6172.20000110.8F10 W206 L257 Y258 V263 K264 Y265F10-V261 HydrophobicContact CZ-CG1 4.11Å; W206-V261 HydrophobicContact CH2-CG2 3.72Å; W206-V261 HydrophobicContact CZ2-CG2 4.26Å; L257-V261 WeakPolarHBondContact O-CG2 3.34Å; L257-V261 PolarHBondContact O-N 3.42Å; Y258-V261 PolarHBondContact O-N 3.4Å; V261-V263 PolarHBondContact O-N 3.14Å; V261-K264 PolarHBondContact O-N 3.2Å; V261-K264 VanDerWaalsContact O-N 3.11Å; V261-Y265 HydrophobicContact CG1-CD2 3.8Å; V261-Y265 HydrophobicContact CG1-CE2 4.45Å; V261-Y265 VanDerWaalsContact O-CD2 3.3Å; V261-Y265 WeakPolarHBondContact O-CD2 3.38Å; V261-Y265 PolarHBondContact O-N 3.09Å
262V74.8Confident77.2Confident5 Ų537.3 Ų37.33%0.0320%0.202CC..Hα-helixtrans-62.2-43178.6163.70000111C14 M18 Y258 K264 Y265 T266 K271C14-V262 HydrophobicContact CB-CG2 3.81Å; M18-V262 HydrophobicContact CG-CG2 4.22Å; M18-V262 HydrophobicContact SD-CB 3.71Å; M18-V262 HydrophobicContact SD-CG1 3.91Å; M18-V262 HydrophobicContact SD-CG2 3.38Å; M18-V262 WeakPolarHBondContact SD-CG2 3.43Å; Y258-V262 WeakPolarHBondContact O-CB 3.5Å; Y258-V262 WeakPolarHBondContact O-CG2 3.24Å; Y258-V262 PolarHBondContact O-N 2.88Å; V262-K264 PolarHBondContact O-N 3.49Å; V262-Y265 PolarHBondContact O-N 3.46Å; V262-T266 WeakPolarHBondContact CG1-OG1 3.33Å; V262-T266 CarbonylContact O-C 3.52Å; V262-T266 WeakPolarHBondContact O-CA 3.37Å; V262-T266 PolarHBondContact O-N 2.88Å; V262-T266 PolarHBondContact O-OG1 3Å; V262-K271 HydrophobicContact CG1-CB 4.07Å
263V68.3Low76.2Confident39 Ų3940.3 Ų40.324%0.23621%0.211CC..Hα-helixtrans-60.9-30.3175.7170.20000112.7T259 S260 V261T259-V263 VanDerWaalsContact O-CG2 3.24Å; T259-V263 WeakPolarHBondContact O-CG2 3.39Å; T259-V263 PolarHBondContact O-N 3.25Å; T259-V263 VanDerWaalsContact O-N 3.09Å; S260-V263 PolarHBondContact O-N 2.88Å; V261-V263 PolarHBondContact O-N 3.14Å
264K72.4Confident75.4Confident85 Ų8540.4 Ų40.437%0.3721%0.212SC..Hα-helixtrans-86-40.5179.9179.5169.7177.2-174.70113.7L205 S260 V261 V262L205-K264 HydrophobicContact CB-CD 3.8Å; L205-K264 HydrophobicContact CD1-CB 3.9Å; L205-K264 HydrophobicContact CD1-CD 3.72Å; L205-K264 HydrophobicContact CD1-CG 4.4Å; L205-K264 HydrophobicContact CG-CD 4.25Å; S260-K264 PolarHBondContact O-N 3.08Å; V261-K264 PolarHBondContact O-N 3.2Å; V261-K264 VanDerWaalsContact O-N 3.11Å; V262-K264 PolarHBondContact O-N 3.49Å
265Y68.9Low74.8Confident89 Ų8940.2 Ų40.235%0.34921%0.213SC..Hα-helixtrans-112.3-6-166.7-64.3-75.5000114.2V261 V262V261-Y265 HydrophobicContact CG1-CD2 3.8Å; V261-Y265 HydrophobicContact CG1-CE2 4.45Å; V261-Y265 VanDerWaalsContact O-CD2 3.3Å; V261-Y265 WeakPolarHBondContact O-CD2 3.38Å; V261-Y265 PolarHBondContact O-N 3.09Å; V262-Y265 PolarHBondContact O-N 3.46Å
266T66.6Low74.3Confident16 Ų1640 Ų4010%0.09821%0.209CC..SBendtrans-134178.5176.574.70000111.3K11 V262K11-T266 HydrophobicContact CG-CG2 4.25Å; V262-T266 WeakPolarHBondContact CG1-OG1 3.33Å; V262-T266 CarbonylContact O-C 3.52Å; V262-T266 WeakPolarHBondContact O-CA 3.37Å; V262-T266 PolarHBondContact O-N 2.88Å; V262-T266 PolarHBondContact O-OG1 3Å
267D65.2Low73.9Confident86 Ų8640.7 Ų40.746%0.4621%0.214SC..  trans-87.1151.8178.7-55.5-68.1000110.8K11 I269 M270K11-D267 IonicContact NZ-OD2 3.94Å; D267-I269 HydrophobicContact CB-CB 4.2Å; D267-I269 HydrophobicContact CB-CD1 4.16Å; D267-I269 HydrophobicContact CB-CG1 4.26Å; D267-I269 PolarHBondContact O-N 2.96Å; D267-M270 PolarHBondContact O-N 3.36Å
268N63.6Low73.6Confident83 Ų8340 Ų4044%0.44421%0.21SC..Hα-helixtrans-56.5-20.2173.3-73.9-42.9000112.9K271 G272N268-K271 PolarHBondContact O-N 3.02Å; N268-G272 PolarHBondContact O-N 3.3Å; N268-G272 VanDerWaalsContact O-N 3.12Å
269I64.7Low73.4Confident36 Ų3637.7 Ų37.719%0.18520%0.201CC..Hα-helixtrans-53.5-49.6169.2-61.4163.1000111.6D267 K271 G272 F273 G313D267-I269 HydrophobicContact CB-CB 4.2Å; D267-I269 HydrophobicContact CB-CD1 4.16Å; D267-I269 HydrophobicContact CB-CG1 4.26Å; D267-I269 PolarHBondContact O-N 2.96Å; I269-K271 PolarHBondContact O-N 3.27Å; I269-G272 WeakPolarHBondContact O-CA 3.35Å; I269-G272 PolarHBondContact O-N 3.35Å; I269-F273 HydrophobicContact CG2-CD2 3.61Å; I269-F273 HydrophobicContact CG2-CE2 3.4Å; I269-F273 WeakPolarHBondContact O-CD2 3.46Å; I269-F273 PolarHBondContact O-N 2.88Å; I269-G313 WeakPolarHBondContact CG1-O 3.37Å
270M66.5Low73.6Confident33 Ų3339.2 Ų39.216%0.16321%0.21CC..Hα-helixtrans-67.2-40-174.4-67.6-62.6-82.100110.9K11 L15 D267 G272 F273 S274K11-M270 HydrophobicContact CB-CE 3.97Å; K11-M270 WeakPolarHBondContact O-CE 3.32Å; L15-M270 HydrophobicContact CB-CE 3.81Å; L15-M270 HydrophobicContact CD1-CB 4.2Å; L15-M270 HydrophobicContact CD1-CE 3.85Å; L15-M270 WeakPolarHBondContact CD1-O 3.11Å; L15-M270 HydrophobicContact CD1-SD 4.25Å; L15-M270 HydrophobicContact CD2-CE 4.08Å; L15-M270 HydrophobicContact CG-CE 4.14Å; D267-M270 PolarHBondContact O-N 3.36Å; M270-G272 PolarHBondContact O-N 3.36Å; M270-F273 PolarHBondContact O-N 2.98Å; M270-S274 PolarHBondContact O-N 3.16Å
271K71.9Confident73.8Confident74 Ų7442.3 Ų42.332%0.32223%0.225SC..Hα-helixtrans-59.1-38.9172.1-175.1179.8177.6-179.10111.5V262 N268 I269 A275V262-K271 HydrophobicContact CG1-CB 4.07Å; N268-K271 PolarHBondContact O-N 3.02Å; I269-K271 PolarHBondContact O-N 3.27Å; K271-A275 WeakPolarHBondContact O-CB 3.49Å; K271-A275 PolarHBondContact O-N 3.39Å; K271-A275 VanDerWaalsContact O-N 3.09Å
272G70.6Confident73.8Confident10 Ų1041.5 Ų41.510%0.10322%0.22CC..Hα-helixtrans-60.7-53.4174.100000112.3N268 I269 M270 S274 A275 A276 I309N268-G272 PolarHBondContact O-N 3.3Å; N268-G272 VanDerWaalsContact O-N 3.12Å; I269-G272 WeakPolarHBondContact O-CA 3.35Å; I269-G272 PolarHBondContact O-N 3.35Å; M270-G272 PolarHBondContact O-N 3.36Å; G272-S274 VanDerWaalsContact C-N 3.33Å; G272-S274 PolarHBondContact O-N 3.35Å; G272-A275 PolarHBondContact O-N 2.96Å; G272-A275 VanDerWaalsContact O-N 3.08Å; G272-A276 PolarHBondContact O-N 2.97Å; G272-I309 WeakPolarHBondContact O-CG2 3.48Å
273F69.6Low74.1Confident84 Ų8441.8 Ų41.837%0.36822%0.222SC..Hα-helixtrans-57-43.9177.3-80.2-65.1000113L15 I269 M270 A275 A276 A277 Y310L15-F273 HydrophobicContact CD1-CB 3.84Å; I269-F273 HydrophobicContact CG2-CD2 3.61Å; I269-F273 HydrophobicContact CG2-CE2 3.4Å; I269-F273 WeakPolarHBondContact O-CD2 3.46Å; I269-F273 PolarHBondContact O-N 2.88Å; M270-F273 PolarHBondContact O-N 2.98Å; F273-A275 VanDerWaalsContact C-N 3.28Å; F273-A275 PolarHBondContact O-N 3.33Å; F273-A276 PolarHBondContact O-N 2.77Å; F273-A277 WeakPolarHBondContact O-CB 3.21Å; F273-A277 PolarHBondContact O-N 2.96Å; F273-Y310 AromaticContact CE1-CD2 3.57Å; F273-Y310 HydrophobicContact CE1-CD2 3.57Å; F273-Y310 HydrophobicContact CE1-CE2 4.08Å; F273-Y310 HydrophobicContact CE1-CG 4.47Å; F273-Y310 AromaticContact CE2-CD2 3.96Å; F273-Y310 HydrophobicContact CE2-CD2 3.96Å; F273-Y310 HydrophobicContact CE2-CE2 4.13Å; F273-Y310 AromaticContact CZ-CD2 3.21Å; F273-Y310 HydrophobicContact CZ-CD2 3.21Å; F273-Y310 AromaticContact CZ-CE2 3.37Å; F273-Y310 HydrophobicContact CZ-CE2 3.37Å; F273-Y310 HydrophobicContact CZ-CG 4.44Å
274S77.8Confident74.8Confident3 Ų343.8 Ų43.82%0.02123%0.234CC..Hα-helixtrans-60.5-40.2176.2-77.10000112.2L15 T19 M270 G272 A278L15-S274 WeakPolarHBondContact CD1-OG 3.34Å; L15-S274 PolarHBondContact O-OG 3.01Å; T19-S274 VanDerWaalsContact OG1-CA 3.24Å; T19-S274 WeakPolarHBondContact OG1-CA 3.49Å; T19-S274 WeakPolarHBondContact OG1-CB 3.38Å; T19-S274 PolarHBondContact OG1-OG 2.77Å; M270-S274 PolarHBondContact O-N 3.16Å; G272-S274 VanDerWaalsContact C-N 3.33Å; G272-S274 PolarHBondContact O-N 3.35Å; S274-A278 VanDerWaalsContact O-CB 3.25Å; S274-A278 WeakPolarHBondContact O-CB 3.38Å; S274-A278 PolarHBondContact O-N 2.89Å
275A79.3Confident75.2Confident19 Ų1940.8 Ų40.816%0.15723%0.225CC..Hα-helixtrans-69.9-42.5179.500000111.9Q121 K271 G272 F273 A278 I279Q121-A275 VanDerWaalsContact NE2-CB 3.33Å; K271-A275 WeakPolarHBondContact O-CB 3.49Å; K271-A275 PolarHBondContact O-N 3.39Å; K271-A275 VanDerWaalsContact O-N 3.09Å; G272-A275 PolarHBondContact O-N 2.96Å; G272-A275 VanDerWaalsContact O-N 3.08Å; F273-A275 VanDerWaalsContact C-N 3.28Å; F273-A275 PolarHBondContact O-N 3.33Å; A275-A278 PolarHBondContact O-N 3.33Å; A275-I279 WeakPolarHBondContact O-CG1 3.14Å; A275-I279 PolarHBondContact O-N 3.47Å
276A78.2Confident75.8Confident12 Ų1236.6 Ų36.610%0.09921%0.209CC..Hα-helixtrans-60.7-46.1174.900000111.6G272 F273 A278 I279 V280 C306 I309G272-A276 PolarHBondContact O-N 2.97Å; F273-A276 PolarHBondContact O-N 2.77Å; A276-A278 VanDerWaalsContact C-N 3.34Å; A276-A278 PolarHBondContact O-N 3.3Å; A276-I279 WeakPolarHBondContact O-CB 3.42Å; A276-I279 PolarHBondContact O-N 3.42Å; A276-V280 PolarHBondContact O-N 3.47Å; A276-C306 HydrophobicContact CB-CB 4.11Å; A276-I309 HydrophobicContact CB-CD1 4.16Å
277A78.7Confident76.5Confident38 Ų3838.3 Ų38.331%0.31422%0.219SC..Hα-helixtrans-64.3-37.8176.100000112.1T19 F273 I279 V280 L281T19-A277 HydrophobicContact CG2-CB 3.46Å; T19-A277 VanDerWaalsContact CG2-CB 3.46Å; F273-A277 WeakPolarHBondContact O-CB 3.21Å; F273-A277 PolarHBondContact O-N 2.96Å; A277-I279 VanDerWaalsContact C-N 3.34Å; A277-I279 PolarHBondContact O-N 3.02Å; A277-V280 PolarHBondContact O-N 3.24Å; A277-L281 WeakPolarHBondContact O-CG 3.43Å; A277-L281 PolarHBondContact O-N 2.97Å
278A82.3Confident77.2Confident0 Ų039.2 Ų39.20%023%0.228CC..Hα-helixtrans-64.7-35.6175.900000112.6A22 A23 S274 A275 A276 S282A22-A278 HydrophobicContact CB-CB 3.85Å; A23-A278 HydrophobicContact CB-CB 4.37Å; S274-A278 VanDerWaalsContact O-CB 3.25Å; S274-A278 WeakPolarHBondContact O-CB 3.38Å; S274-A278 PolarHBondContact O-N 2.89Å; A275-A278 PolarHBondContact O-N 3.33Å; A276-A278 VanDerWaalsContact C-N 3.34Å; A276-A278 PolarHBondContact O-N 3.3Å; A278-S282 VanDerWaalsContact O-CB 3.23Å; A278-S282 WeakPolarHBondContact O-CB 3.42Å; A278-S282 PolarHBondContact O-N 2.81Å; A278-S282 PolarHBondContact O-OG 2.91Å
279I83Confident77.8Confident1 Ų140.8 Ų40.81%0.00524%0.235CC..Hα-helixtrans-60.9-49.2173-67.6163.3000110.2Q117 V118 Q121 A275 A276 A277 S282 T283 V305 I309Q117-I279 HydrophobicContact CB-CG1 4.24Å; V118-I279 HydrophobicContact CG2-CG2 3.77Å; Q121-I279 HydrophobicContact CG-CD1 3.79Å; A275-I279 WeakPolarHBondContact O-CG1 3.14Å; A275-I279 PolarHBondContact O-N 3.47Å; A276-I279 WeakPolarHBondContact O-CB 3.42Å; A276-I279 PolarHBondContact O-N 3.42Å; A277-I279 VanDerWaalsContact C-N 3.34Å; A277-I279 PolarHBondContact O-N 3.02Å; I279-S282 PolarHBondContact O-OG 2.93Å; I279-S282 VanDerWaalsContact O-OG 3.07Å; I279-T283 VanDerWaalsContact O-CB 3.28Å; I279-T283 WeakPolarHBondContact O-CB 3.36Å; I279-T283 PolarHBondContact O-N 3.22Å; I279-T283 PolarHBondContact O-OG1 3.49Å; I279-V305 HydrophobicContact CD1-CG1 3.77Å; I279-I309 HydrophobicContact CD1-CD1 4Å
280V82.3Confident78.2Confident78 Ų7840.1 Ų40.147%0.47323%0.231SC..Hα-helixtrans-60.9-50.1179.8177.20000110.5A276 A277 T283 V284A276-V280 PolarHBondContact O-N 3.47Å; A277-V280 PolarHBondContact O-N 3.24Å; V280-T283 PolarHBondContact O-N 2.86Å; V280-V284 WeakPolarHBondContact O-CG2 3.08Å; V280-V284 PolarHBondContact O-N 2.93Å
281L82.3Confident78.4Confident80 Ų8041.1 Ų41.142%0.41925%0.25SC..Hα-helixtrans-64.3-43.9-178.3-69.8176.1000112.9T19 A23 A277 T283 V284 A285T19-L281 HydrophobicContact CG2-CD1 3.75Å; A23-L281 HydrophobicContact CB-CB 3.82Å; A23-L281 HydrophobicContact CB-CD1 4.37Å; A277-L281 WeakPolarHBondContact O-CG 3.43Å; A277-L281 PolarHBondContact O-N 2.97Å; L281-T283 VanDerWaalsContact C-N 3.33Å; L281-T283 PolarHBondContact O-N 3.25Å; L281-V284 PolarHBondContact O-N 3.25Å; L281-A285 WeakPolarHBondContact O-CB 3.38Å; L281-A285 PolarHBondContact O-N 3.44Å
282S81.8Confident78.4Confident0 Ų037.8 Ų37.80%024%0.235CC..Hα-helixtrans-66.9-34.8177.957.30000112.2A278 I279 S286A278-S282 VanDerWaalsContact O-CB 3.23Å; A278-S282 WeakPolarHBondContact O-CB 3.42Å; A278-S282 PolarHBondContact O-N 2.81Å; A278-S282 PolarHBondContact O-OG 2.91Å; I279-S282 PolarHBondContact O-OG 2.93Å; I279-S282 VanDerWaalsContact O-OG 3.07Å; S282-S286 WeakPolarHBondContact O-CB 3.33Å; S282-S286 PolarHBondContact O-N 3.17Å; S282-S286 PolarHBondContact O-OG 3.22Å
283T81.9Confident78.6Confident11 Ų1143.2 Ų43.27%0.06726%0.258CS..Hα-helixtrans-64-50.9173.2-58.50000110.4I279 V280 L281 A285 S286 V287 I294 F298I279-T283 VanDerWaalsContact O-CB 3.28Å; I279-T283 WeakPolarHBondContact O-CB 3.36Å; I279-T283 PolarHBondContact O-N 3.22Å; I279-T283 PolarHBondContact O-OG1 3.49Å; V280-T283 PolarHBondContact O-N 2.86Å; L281-T283 VanDerWaalsContact C-N 3.33Å; L281-T283 PolarHBondContact O-N 3.25Å; T283-A285 VanDerWaalsContact C-N 3.32Å; T283-A285 PolarHBondContact O-N 3.18Å; T283-S286 PolarHBondContact O-N 3.49Å; T283-V287 WeakPolarHBondContact O-CG2 3.48Å; T283-V287 PolarHBondContact O-N 2.91Å; T283-I294 HydrophobicContact CG2-CD1 3.62Å; T283-I294 HydrophobicContact CG2-CG1 4.29Å; T283-F298 HydrophobicContact CG2-CE1 3.55Å; T283-F298 HydrophobicContact CG2-CZ 4.07Å
284V83.2Confident79Confident81 Ų8143 Ų4349%0.49126%0.26SS..Hα-helixtrans-58-45.9177.71710000110.8V280 L281 S286 V287 T288V280-V284 WeakPolarHBondContact O-CG2 3.08Å; V280-V284 PolarHBondContact O-N 2.93Å; L281-V284 PolarHBondContact O-N 3.25Å; V284-S286 VanDerWaalsContact C-N 3.28Å; V284-S286 PolarHBondContact O-N 2.54Å; V284-V287 PolarHBondContact O-N 3.11Å; V284-T288 WeakPolarHBondContact O-CG2 3.43Å; V284-T288 PolarHBondContact O-N 3.44Å; V284-T288 VanDerWaalsContact O-N 3.08Å; V284-T288 PolarHBondContact O-OG1 3.5Å
285A81.9Confident79.2Confident23 Ų2344.6 Ų44.619%0.1927%0.27CS..Hα-helixtrans-61.5-36.4175.900000112.3V27 L281 T283 T288 L289V27-A285 HydrophobicContact CG1-CB 4.39Å; V27-A285 HydrophobicContact CG2-CB 3.72Å; L281-A285 WeakPolarHBondContact O-CB 3.38Å; L281-A285 PolarHBondContact O-N 3.44Å; T283-A285 VanDerWaalsContact C-N 3.32Å; T283-A285 PolarHBondContact O-N 3.18Å; A285-T288 PolarHBondContact O-N 3.29Å; A285-T288 PolarHBondContact O-OG1 2.9Å; A285-L289 HydrophobicContact CB-CD1 4.31Å; A285-L289 WeakPolarHBondContact O-CB 3.35Å; A285-L289 VanDerWaalsContact O-CG 3.3Å; A285-L289 WeakPolarHBondContact O-CG 3.36Å; A285-L289 PolarHBondContact O-N 3.06Å
286S79.8Confident79.5Confident0 Ų047.9 Ų47.90%030%0.297CS..Hα-helixtrans-71.3-35178.8-56.30000112.3S282 T283 V284 F290 G291 L292S282-S286 WeakPolarHBondContact O-CB 3.33Å; S282-S286 PolarHBondContact O-N 3.17Å; S282-S286 PolarHBondContact O-OG 3.22Å; T283-S286 PolarHBondContact O-N 3.49Å; V284-S286 VanDerWaalsContact C-N 3.28Å; V284-S286 PolarHBondContact O-N 2.54Å; S286-F290 CarbonylContact O-C 3.59Å; S286-F290 WeakPolarHBondContact O-CA 3.1Å; S286-F290 VanDerWaalsContact O-CB 3.32Å; S286-F290 WeakPolarHBondContact O-CB 3.4Å; S286-F290 PolarHBondContact O-N 2.91Å; S286-G291 PolarHBondContact O-N 3.47Å; S286-L292 WeakPolarHBondContact O-CB 3.24Å; S286-L292 PolarHBondContact O-N 2.86Å
287V81.2Confident79.7Confident53 Ų5349.6 Ų49.632%0.32131%0.306SS..Hα-helixtrans-62.6-48.4171.4176.10000111.1T283 V284 G291 L292 I294T283-V287 WeakPolarHBondContact O-CG2 3.48Å; T283-V287 PolarHBondContact O-N 2.91Å; V284-V287 PolarHBondContact O-N 3.11Å; V287-G291 WeakPolarHBondContact O-CA 3.36Å; V287-G291 PolarHBondContact O-N 3.49Å; V287-L292 HydrophobicContact CG2-CB 4.42Å; V287-I294 HydrophobicContact CG2-CD1 3.35Å; V287-I294 HydrophobicContact CG2-CG1 3.53Å
288T80.3Confident79.8Confident104 Ų10447.9 Ų47.964%0.63829%0.291SS*.Hα-helixtrans-78.1-39.4-172.256.70000113.2V284 A285V284-T288 WeakPolarHBondContact O-CG2 3.43Å; V284-T288 PolarHBondContact O-N 3.44Å; V284-T288 VanDerWaalsContact O-N 3.08Å; V284-T288 PolarHBondContact O-OG1 3.5Å; A285-T288 PolarHBondContact O-N 3.29Å; A285-T288 PolarHBondContact O-OG1 2.9Å
289L77.1Confident80Confident116 Ų11649.8 Ų49.861%0.60731%0.308SS*.Hα-helixtrans-90.4-34.3-175.1-60.5174000113.1V27 A285V27-L289 HydrophobicContact CG1-CD1 3.74Å; A285-L289 HydrophobicContact CB-CD1 4.31Å; A285-L289 WeakPolarHBondContact O-CB 3.35Å; A285-L289 VanDerWaalsContact O-CG 3.3Å; A285-L289 WeakPolarHBondContact O-CG 3.36Å; A285-L289 PolarHBondContact O-N 3.06Å
290F73.3Confident80.2Confident23 Ų2352.5 Ų52.510%0.10133%0.326CS..Hα-helixtrans-111.12.4-176.6-53.9-57.5000111.8V27 R30 Y31 V35 T165 S286 L292V27-F290 HydrophobicContact CG1-CE2 4.09Å; V27-F290 HydrophobicContact CG1-CZ 4.35Å; R30-F290 HydrophobicContact CG-CE2 4.31Å; R30-F290 HydrophobicContact CG-CZ 4.39Å; Y31-F290 HydrophobicContact CD2-CE1 4.34Å; V35-F290 HydrophobicContact CG2-CE1 4.28Å; T165-F290 WeakPolarHBondContact CB-O 3.16Å; T165-F290 HydrophobicContact CG2-CB 4Å; T165-F290 WeakPolarHBondContact CG2-O 3.44Å; T165-F290 PolarHBondContact OG1-O 2.93Å; S286-F290 CarbonylContact O-C 3.59Å; S286-F290 WeakPolarHBondContact O-CA 3.1Å; S286-F290 VanDerWaalsContact O-CB 3.32Å; S286-F290 WeakPolarHBondContact O-CB 3.4Å; S286-F290 PolarHBondContact O-N 2.91Å; F290-L292 PolarHBondContact O-N 3.39Å
291G70.8Confident80.4Confident53 Ų5348.8 Ų48.855%0.54630%0.303SS..  trans62.128178.600000113.5S286 V287 Q293S286-G291 PolarHBondContact O-N 3.47Å; V287-G291 WeakPolarHBondContact O-CA 3.36Å; V287-G291 PolarHBondContact O-N 3.49Å; G291-Q293 PolarHBondContact O-N 3.44Å
292L71.5Confident80.5Confident4 Ų445.6 Ų45.62%0.02129%0.288CS..  trans-61.7129.3179.1-171.672.1000110.4A114 A162 S286 V287 F290A114-L292 HydrophobicContact CB-CD2 3.92Å; A162-L292 HydrophobicContact CB-CD1 3.45Å; A162-L292 VanDerWaalsContact CB-CD1 3.45Å; A162-L292 HydrophobicContact CB-CD2 4.02Å; A162-L292 HydrophobicContact CB-CG 3.67Å; S286-L292 WeakPolarHBondContact O-CB 3.24Å; S286-L292 PolarHBondContact O-N 2.86Å; V287-L292 HydrophobicContact CG2-CB 4.42Å; F290-L292 PolarHBondContact O-N 3.39Å
293Q75.4Confident80.8Confident124 Ų12451.5 Ų51.558%0.57932%0.317SS*.BIsolated β-bridgetrans-90.7113.6174.3-63.6-167.116.100110.9A162 G291A162-Q293 VanDerWaalsContact CB-O 3.26Å; A162-Q293 WeakPolarHBondContact CB-O 2.8Å; G291-Q293 PolarHBondContact O-N 3.44Å
294I77.4Confident81.1Confident80 Ų8052.7 Ų52.741%0.4132%0.323SS..  trans-78.9127177.8-63.4177000110.1T283 V287 F298 A299T283-I294 HydrophobicContact CG2-CD1 3.62Å; T283-I294 HydrophobicContact CG2-CG1 4.29Å; V287-I294 HydrophobicContact CG2-CD1 3.35Å; V287-I294 HydrophobicContact CG2-CG1 3.53Å; I294-F298 HydrophobicContact CG2-CB 4.27Å; I294-F298 HydrophobicContact CG2-CD1 3.81Å; I294-F298 HydrophobicContact CG2-CG 4.38Å; I294-A299 HydrophobicContact CG2-CB 4.21Å
295T82.3Confident81.2Confident37 Ų3748.8 Ų48.823%0.22730%0.3CS..  trans-86.7154170.2610000111.3K160 T297 F298 A299K160-T295 PolarHBondContact O-OG1 3.05Å; T295-T297 PolarHBondContact O-N 3.09Å; T295-T297 PolarHBondContact OG1-OG1 2.92Å; T295-F298 WeakPolarHBondContact O-CB 3.27Å; T295-F298 PolarHBondContact O-N 2.91Å; T295-F298 VanDerWaalsContact O-N 3.07Å; T295-F298 VanDerWaalsContact OG1-CB 3.3Å; T295-F298 WeakPolarHBondContact OG1-CB 3.4Å; T295-F298 PolarHBondContact OG1-N 3.32Å; T295-A299 PolarHBondContact O-N 3.34Å
296A84.4Confident81.4Confident87 Ų8749 Ų4972%0.71930%0.3SS*.Hα-helixtrans-59.4-34175.100000112.3A299 C300A296-A299 PolarHBondContact O-N 2.78Å; A296-C300 WeakPolarHBondContact O-CB 3.3Å; A296-C300 PolarHBondContact O-N 3Å
297T83.6Confident81.8Confident48 Ų4852.2 Ų52.229%0.29432%0.319SS..Hα-helixtrans-65.3-40.1174.348.20000111.9T295 G301T295-T297 PolarHBondContact O-N 3.09Å; T295-T297 PolarHBondContact OG1-OG1 2.92Å; T297-G301 PolarHBondContact O-N 3.31Å
298F81.2Confident82Confident2 Ų249.7 Ų49.71%0.00930%0.304CS..Hα-helixtrans-62.2-48.8173.3-179.2-78.6000111.2A114 V118 V157 T283 I294 T295 C300 G301 A302A114-F298 HydrophobicContact CB-CE2 4.09Å; A114-F298 HydrophobicContact CB-CZ 3.7Å; V118-F298 HydrophobicContact CG2-CZ 4.38Å; V157-F298 HydrophobicContact CB-CD2 4.33Å; V157-F298 HydrophobicContact CG1-CD2 3.62Å; V157-F298 HydrophobicContact CG1-CE2 3.55Å; V157-F298 HydrophobicContact CG2-CD2 4.23Å; V157-F298 HydrophobicContact CG2-CE2 4.42Å; T283-F298 HydrophobicContact CG2-CE1 3.55Å; T283-F298 HydrophobicContact CG2-CZ 4.07Å; I294-F298 HydrophobicContact CG2-CB 4.27Å; I294-F298 HydrophobicContact CG2-CD1 3.81Å; I294-F298 HydrophobicContact CG2-CG 4.38Å; T295-F298 WeakPolarHBondContact O-CB 3.27Å; T295-F298 PolarHBondContact O-N 2.91Å; T295-F298 VanDerWaalsContact O-N 3.07Å; T295-F298 VanDerWaalsContact OG1-CB 3.3Å; T295-F298 WeakPolarHBondContact OG1-CB 3.4Å; T295-F298 PolarHBondContact OG1-N 3.32Å; F298-C300 PolarHBondContact O-N 3.5Å; F298-G301 PolarHBondContact O-N 3.22Å; F298-A302 HydrophobicContact CE1-CB 4.17Å; F298-A302 WeakPolarHBondContact O-CB 3.47Å; F298-A302 PolarHBondContact O-N 3.39Å
299A85Confident82.1Confident41 Ų4145 Ų4534%0.33928%0.275SS..Hα-helixtrans-60.8-45.6-179.500000111.9I294 T295 A296 A302 M303I294-A299 HydrophobicContact CG2-CB 4.21Å; T295-A299 PolarHBondContact O-N 3.34Å; A296-A299 PolarHBondContact O-N 2.78Å; A299-A302 PolarHBondContact O-N 2.89Å; A299-M303 WeakPolarHBondContact O-CG 3.32Å; A299-M303 PolarHBondContact O-N 3.36Å
300C88.6Confident82.4Confident57 Ų5744.6 Ų44.639%0.38527%0.266SS..Hα-helixtrans-61.1-46.5175.9-173.80000111.9A296 F298 M303 L304A296-C300 WeakPolarHBondContact O-CB 3.3Å; A296-C300 PolarHBondContact O-N 3Å; F298-C300 PolarHBondContact O-N 3.5Å; C300-M303 PolarHBondContact O-N 3.39Å; C300-L304 WeakPolarHBondContact O-CG 3.4Å; C300-L304 PolarHBondContact O-N 2.73Å
301G85.4Confident82.9Confident0 Ų045 Ų450%027%0.269CS..Hα-helixtrans-61.9-44.5177.300000112.9G153 T297 F298 M303 L304 V305G153-G301 WeakPolarHBondContact CA-O 3.32Å; G153-G301 VanDerWaalsContact O-CA 3.31Å; G153-G301 WeakPolarHBondContact O-CA 3.49Å; T297-G301 PolarHBondContact O-N 3.31Å; F298-G301 PolarHBondContact O-N 3.22Å; G301-M303 PolarHBondContact O-N 3.45Å; G301-L304 WeakPolarHBondContact O-CB 3.3Å; G301-L304 PolarHBondContact O-N 2.95Å; G301-V305 WeakPolarHBondContact O-CG2 3.47Å; G301-V305 PolarHBondContact O-N 3.5Å
302A84.1Confident83.4Confident13 Ų1344.2 Ų44.211%0.10725%0.25CC..Hα-helixtrans-62-41.7177.100000111.9F298 A299 V305 C306F298-A302 HydrophobicContact CE1-CB 4.17Å; F298-A302 WeakPolarHBondContact O-CB 3.47Å; F298-A302 PolarHBondContact O-N 3.39Å; A299-A302 PolarHBondContact O-N 2.89Å; A302-V305 PolarHBondContact O-N 3.03Å; A302-C306 PolarHBondContact O-N 3.04Å; A302-C306 PolarHBondContact O-SG 3.04Å; A302-C306 VanDerWaalsContact O-SG 3.32Å
303M88.6Confident83.6Confident124 Ų12444.6 Ų44.661%0.61126%0.255SS*.Hα-helixtrans-62.2-46.2174.2-74-166.9-61.700112.1A299 C300 G301 V305 C306 V307A299-M303 WeakPolarHBondContact O-CG 3.32Å; A299-M303 PolarHBondContact O-N 3.36Å; C300-M303 PolarHBondContact O-N 3.39Å; G301-M303 PolarHBondContact O-N 3.45Å; M303-V305 VanDerWaalsContact C-N 3.28Å; M303-V305 PolarHBondContact O-N 3.48Å; M303-C306 PolarHBondContact O-N 3.16Å; M303-C306 VanDerWaalsContact O-N 3.17Å; M303-V307 WeakPolarHBondContact O-CG2 3.25Å; M303-V307 PolarHBondContact O-N 3.49Å
304L88.6Confident83.8Confident36 Ų3641 Ų4119%0.18824%0.239CC..Hα-helixtrans-57.7-42.5175.7-80.1162.1000111.5M149 L156 C300 G301 V307 S308M149-L304 HydrophobicContact CE-CD2 3.43Å; M149-L304 VanDerWaalsContact CE-CD2 3.43Å; M149-L304 HydrophobicContact CG-CD2 3.99Å; L156-L304 HydrophobicContact CD1-CD1 3.26Å; C300-L304 WeakPolarHBondContact O-CG 3.4Å; C300-L304 PolarHBondContact O-N 2.73Å; G301-L304 WeakPolarHBondContact O-CB 3.3Å; G301-L304 PolarHBondContact O-N 2.95Å; L304-V307 PolarHBondContact O-N 3.31Å; L304-S308 VanDerWaalsContact O-CB 3.3Å; L304-S308 WeakPolarHBondContact O-CB 3.48Å; L304-S308 PolarHBondContact O-N 2.89Å; L304-S308 PolarHBondContact O-OG 3.26Å
305V84.4Confident83.4Confident0 Ų041.7 Ų41.70%025%0.249CC..Hα-helixtrans-62.4-46.71751680000111.1V118 Q121 L150 V154 I279 G301 A302 M303 V307 S308 I309V118-V305 HydrophobicContact CG1-CB 4.5Å; V118-V305 HydrophobicContact CG1-CG2 3.86Å; Q121-V305 HydrophobicContact CB-CG1 4.24Å; Q121-V305 HydrophobicContact CG-CG1 4.06Å; L150-V305 HydrophobicContact CD1-CB 4.22Å; L150-V305 HydrophobicContact CD1-CG1 3.73Å; L150-V305 HydrophobicContact CD1-CG2 4.03Å; V154-V305 HydrophobicContact CG2-CG2 4Å; I279-V305 HydrophobicContact CD1-CG1 3.77Å; G301-V305 WeakPolarHBondContact O-CG2 3.47Å; G301-V305 PolarHBondContact O-N 3.5Å; A302-V305 PolarHBondContact O-N 3.03Å; M303-V305 VanDerWaalsContact C-N 3.28Å; M303-V305 PolarHBondContact O-N 3.48Å; V305-V307 PolarHBondContact O-N 2.92Å; V305-S308 WeakPolarHBondContact CA-OG 3.42Å; V305-S308 PolarHBondContact O-N 3.27Å; V305-S308 PolarHBondContact O-OG 3.1Å; V305-I309 HydrophobicContact CG1-CD1 3.74Å; V305-I309 HydrophobicContact CG1-CG1 4.43Å; V305-I309 WeakPolarHBondContact O-CD1 3.47Å; V305-I309 WeakPolarHBondContact O-CG1 3.44Å; V305-I309 PolarHBondContact O-N 2.9Å
306C86.1Confident82.6Confident28 Ų2844 Ų4419%0.18926%0.256CS..Hα-helixtrans-58.4-45.9176.2-70.60000112.8A276 A302 M303 I309 Y310A276-C306 HydrophobicContact CB-CB 4.11Å; A302-C306 PolarHBondContact O-N 3.04Å; A302-C306 PolarHBondContact O-SG 3.04Å; A302-C306 VanDerWaalsContact O-SG 3.32Å; M303-C306 PolarHBondContact O-N 3.16Å; M303-C306 VanDerWaalsContact O-N 3.17Å; C306-I309 PolarHBondContact O-N 3.17Å; C306-Y310 PolarHBondContact O-N 3.41Å; C306-Y310 VanDerWaalsContact O-N 3.15Å
307V88.4Confident81.1Confident66 Ų6648.1 Ų48.140%0.426%0.26SS..Hα-helixtrans-65.7-41178.2177.50000111M149 M303 L304 V305 I309 Y310 L311M149-V307 HydrophobicContact CE-CB 3.68Å; M149-V307 HydrophobicContact CE-CG1 3.47Å; M149-V307 VanDerWaalsContact CE-CG1 3.47Å; M149-V307 HydrophobicContact SD-CB 4.4Å; M149-V307 HydrophobicContact SD-CG1 3.99Å; M303-V307 WeakPolarHBondContact O-CG2 3.25Å; M303-V307 PolarHBondContact O-N 3.49Å; L304-V307 PolarHBondContact O-N 3.31Å; V305-V307 PolarHBondContact O-N 2.92Å; V307-I309 VanDerWaalsContact C-N 3.32Å; V307-I309 PolarHBondContact O-N 2.96Å; V307-Y310 WeakPolarHBondContact O-CB 3.37Å; V307-Y310 PolarHBondContact O-N 3.16Å; V307-L311 HydrophobicContact CG1-CD1 4.04Å; V307-L311 HydrophobicContact CG1-CG 4.18Å; V307-L311 WeakPolarHBondContact O-CG 3.31Å; V307-L311 PolarHBondContact O-N 3.34Å
308S85.4Confident79.1Confident1 Ų150.5 Ų50.51%0.00727%0.271CS..Hα-helixtrans-61-41.3177.774.10000112.3S146 L150 L304 V305 Y310 L311 Y312S146-S308 VanDerWaalsContact CB-O 3.29Å; S146-S308 WeakPolarHBondContact CB-O 3.5Å; S146-S308 WeakPolarHBondContact O-CB 3.34Å; L150-S308 WeakPolarHBondContact CA-OG 3.33Å; L150-S308 WeakPolarHBondContact CB-OG 3.43Å; L150-S308 WeakPolarHBondContact CD1-OG 3.3Å; L304-S308 VanDerWaalsContact O-CB 3.3Å; L304-S308 WeakPolarHBondContact O-CB 3.48Å; L304-S308 PolarHBondContact O-N 2.89Å; L304-S308 PolarHBondContact O-OG 3.26Å; V305-S308 WeakPolarHBondContact CA-OG 3.42Å; V305-S308 PolarHBondContact O-N 3.27Å; V305-S308 PolarHBondContact O-OG 3.1Å; S308-Y310 VanDerWaalsContact C-N 3.32Å; S308-Y310 PolarHBondContact O-N 2.79Å; S308-L311 PolarHBondContact O-N 3.2Å; S308-Y312 WeakPolarHBondContact O-CB 3.44Å; S308-Y312 PolarHBondContact O-N 2.99Å
309I82.3Confident77.4Confident6 Ų656.4 Ų56.43%0.03131%0.308CS..Hα-helixtrans-63.2-42.3177.3-66.2160.4000110.5Q121 I124 L150 G272 A276 I279 V305 C306 V307 G313Q121-I309 HydrophobicContact CG-CD1 4.29Å; I124-I309 HydrophobicContact CD1-CG1 3.66Å; L150-I309 HydrophobicContact CD1-CG1 4.44Å; G272-I309 WeakPolarHBondContact O-CG2 3.48Å; A276-I309 HydrophobicContact CB-CD1 4.16Å; I279-I309 HydrophobicContact CD1-CD1 4Å; V305-I309 HydrophobicContact CG1-CD1 3.74Å; V305-I309 HydrophobicContact CG1-CG1 4.43Å; V305-I309 WeakPolarHBondContact O-CD1 3.47Å; V305-I309 WeakPolarHBondContact O-CG1 3.44Å; V305-I309 PolarHBondContact O-N 2.9Å; C306-I309 PolarHBondContact O-N 3.17Å; V307-I309 VanDerWaalsContact C-N 3.32Å; V307-I309 PolarHBondContact O-N 2.96Å; I309-G313 PolarHBondContact O-N 3.26Å; I309-G313 VanDerWaalsContact O-N 3.09Å
310Y83.8Confident75.2Confident106 Ų10660.7 Ų60.742%0.41633%0.33SS..Hα-helixtrans-61.6-51.7175.8171.7-111.6000111.9F273 C306 V307 S308 Y312 G313 L314F273-Y310 AromaticContact CE1-CD2 3.57Å; F273-Y310 HydrophobicContact CE1-CD2 3.57Å; F273-Y310 HydrophobicContact CE1-CE2 4.08Å; F273-Y310 HydrophobicContact CE1-CG 4.47Å; F273-Y310 AromaticContact CE2-CD2 3.96Å; F273-Y310 HydrophobicContact CE2-CD2 3.96Å; F273-Y310 HydrophobicContact CE2-CE2 4.13Å; F273-Y310 AromaticContact CZ-CD2 3.21Å; F273-Y310 HydrophobicContact CZ-CD2 3.21Å; F273-Y310 AromaticContact CZ-CE2 3.37Å; F273-Y310 HydrophobicContact CZ-CE2 3.37Å; F273-Y310 HydrophobicContact CZ-CG 4.44Å; C306-Y310 PolarHBondContact O-N 3.41Å; C306-Y310 VanDerWaalsContact O-N 3.15Å; V307-Y310 WeakPolarHBondContact O-CB 3.37Å; V307-Y310 PolarHBondContact O-N 3.16Å; S308-Y310 VanDerWaalsContact C-N 3.32Å; S308-Y310 PolarHBondContact O-N 2.79Å; Y310-Y312 VanDerWaalsContact C-N 3.3Å; Y310-Y312 PolarHBondContact O-N 3.36Å; Y310-G313 PolarHBondContact O-N 3Å; Y310-G313 VanDerWaalsContact O-N 3.09Å; Y310-L314 HydrophobicContact CE1-CD1 4.22Å; Y310-L314 HydrophobicContact CE2-CD2 4.11Å; Y310-L314 PolarHBondContact O-N 3.24Å
311L84.6Confident72.8Confident32 Ų3265.8 Ų65.817%0.16835%0.345CS..Hα-helixtrans-61.5-37.4-179.7-70.3-179.7000112.5L142 F145 M149 V307 S308 G313 L314L142-L311 HydrophobicContact CD1-CD2 4.39Å; F145-L311 HydrophobicContact CD1-CD1 4.24Å; F145-L311 HydrophobicContact CE1-CD1 4.19Å; M149-L311 HydrophobicContact SD-CD1 3.9Å; V307-L311 HydrophobicContact CG1-CD1 4.04Å; V307-L311 HydrophobicContact CG1-CG 4.18Å; V307-L311 WeakPolarHBondContact O-CG 3.31Å; V307-L311 PolarHBondContact O-N 3.34Å; S308-L311 PolarHBondContact O-N 3.2Å; L311-G313 VanDerWaalsContact C-N 3.31Å; L311-L314 HydrophobicContact CD2-CD1 4.03Å; L311-L314 PolarHBondContact O-N 3.3Å
312Y80.5Confident70.6Confident37 Ų3772.8 Ų72.815%0.14538%0.382CS..Hα-helixtrans-66.9-35.5176.2-173.7-93.3000112.1I124 A128 L139 Q143 S146 V147 S308 Y310I124-Y312 HydrophobicContact CG2-CD1 3.88Å; I124-Y312 HydrophobicContact CG2-CD2 3.94Å; I124-Y312 HydrophobicContact CG2-CE1 4.02Å; I124-Y312 HydrophobicContact CG2-CE2 4.07Å; I124-Y312 HydrophobicContact CG2-CG 3.84Å; A128-Y312 HydrophobicContact CB-CE2 4.09Å; A128-Y312 WeakPolarHBondContact CB-OH 3.37Å; L139-Y312 HydrophobicContact CD2-CE2 4.37Å; Q143-Y312 HydrophobicContact CB-CD2 4.05Å; Q143-Y312 HydrophobicContact CB-CE2 4.06Å; Q143-Y312 HydrophobicContact CG-CD2 4.09Å; Q143-Y312 HydrophobicContact CG-CE2 4.21Å; S146-Y312 WeakPolarHBondContact OG-CA 3.35Å; S146-Y312 WeakPolarHBondContact OG-CB 3.5Å; S146-Y312 PolarHBondContact OG-N 2.91Å; V147-Y312 HydrophobicContact CG2-CD2 4.26Å; V147-Y312 HydrophobicContact CG2-CE2 4.2Å; S308-Y312 WeakPolarHBondContact O-CB 3.44Å; S308-Y312 PolarHBondContact O-N 2.99Å; Y310-Y312 VanDerWaalsContact C-N 3.3Å; Y310-Y312 PolarHBondContact O-N 3.36Å
313G75.9Confident68.3Low12 Ų1277.7 Ų77.712%0.12441%0.413CS..Hα-helixtrans-62.2-43.5177.500000112.3I269 I309 Y310 L311I269-G313 WeakPolarHBondContact CG1-O 3.37Å; I309-G313 PolarHBondContact O-N 3.26Å; I309-G313 VanDerWaalsContact O-N 3.09Å; Y310-G313 PolarHBondContact O-N 3Å; Y310-G313 VanDerWaalsContact O-N 3.09Å; L311-G313 VanDerWaalsContact C-N 3.31Å
314L80.1Confident66Low49 Ų4983.4 Ų83.426%0.25743%0.427SS..SBendtrans-45.3138.9-168.3-75172.5000113.5L142 Y310 L311 K316L142-L314 HydrophobicContact CD2-CB 4.45Å; L142-L314 HydrophobicContact CD2-CD1 4.05Å; Y310-L314 HydrophobicContact CE1-CD1 4.22Å; Y310-L314 HydrophobicContact CE2-CD2 4.11Å; Y310-L314 PolarHBondContact O-N 3.24Å; L311-L314 HydrophobicContact CD2-CD1 4.03Å; L311-L314 PolarHBondContact O-N 3.3Å; L314-K316 PolarHBondContact O-N 2.98Å
315P67.9Low63.9Low94 Ų9484.5 Ų84.561%0.6144%0.442SS*.  trans-59.2139.9-178.525.4-30.7000109.5Q317P315-Q317 PolarHBondContact O-N 3.47Å
316K66.4Low62.2Low85 Ų8590.4 Ų90.437%0.3747%0.474SS..  trans-59.2115.9172.4-76.4-171.9179.4177.50108S138 L314 D318S138-K316 WeakPolarHBondContact O-CE 3.23Å; S138-K316 PolarHBondContact O-NZ 2.97Å; S138-K316 PolarHBondContact OG-NZ 3.2Å; L314-K316 PolarHBondContact O-N 2.98Å; K316-D318 PolarHBondContact O-N 3.25Å
317Q51.7Low60.5Low173 Ų17393.6 Ų93.681%0.80849%0.492SS*.  trans-66.5103.9160.8-75.4-178.1-19.800106.8P315 T319P315-Q317 PolarHBondContact O-N 3.47Å; Q317-T319 PolarHBondContact O-N 3.12Å
318D43Very low58.7Low98 Ų9895.9 Ų95.952%0.52450%0.502SS..  trans-63.283.4168.6-89.4-16000108.5K316 T320 K321K316-D318 PolarHBondContact O-N 3.25Å; D318-T320 PolarHBondContact O-N 3.47Å; D318-T320 VanDerWaalsContact O-N 3.16Å; D318-K321 PolarHBondContact O-N 3.09Å
319T43.8Very low57Low127 Ų127103.1 Ų103.178%0.77953%0.533SS*.THydrogen-bonded Turntrans-68.3-5.117333.20000112.3Q317Q317-T319 PolarHBondContact O-N 3.12Å
320T39.4Very low55.6Low131 Ų131108.9 Ų108.980%0.80456%0.56SS**THydrogen-bonded Turntrans-82.9-14.5174.4-220000113.1D318 L322D318-T320 PolarHBondContact O-N 3.47Å; D318-T320 VanDerWaalsContact O-N 3.16Å; T320-L322 PolarHBondContact O-N 3.43Å
321K37.5Very low54.1Low163 Ų163105.9 Ų105.971%0.70956%0.558SS**  trans-89.881.7165.8-67.2-176-175.6175.90107.9D318D318-K321 PolarHBondContact O-N 3.09Å
322L39.8Very low52.7Low148 Ų148113 Ų11378%0.77558%0.582SS**  trans-47.7131.1147.7-85153.1000106T320 R324T320-L322 PolarHBondContact O-N 3.43Å; L322-R324 PolarHBondContact O-N 2.8Å
323P37.1Very low51.5Low116 Ų116118 Ų11875%0.75361%0.607SS**  trans-54.7112.1165.122.6-27.4000104.8A325P323-A325 PolarHBondContact O-N 2.85Å
324R39.3Very low50.5Low243 Ų243124.4 Ų124.492%0.91763%0.631SS**  trans-58.1106.3168.2-100.7-177.1173.4165.4-2103.8L322 D326L322-R324 PolarHBondContact O-N 2.8Å; R324-D326 PolarHBondContact O-N 3.06Å
325A44.7Very low49.3Very low60 Ų60129 Ų12950%0.49666%0.655SS.*  trans-48.6101.1173.300000108.3P323 T327 D328P323-A325 PolarHBondContact O-N 2.85Å; A325-T327 VanDerWaalsContact CB-OG1 3.3Å; A325-T327 WeakPolarHBondContact CB-OG1 3.3Å; A325-T327 PolarHBondContact O-N 2.88Å; A325-D328 PolarHBondContact O-N 3.21Å
326D48.4Very low48.7Very low124 Ų124131.5 Ų131.566%0.66366%0.662SS**THydrogen-bonded Turntrans-57.9-6.4156.9-90.1-39.7000111.2R324 D328 K329 E330R324-D326 PolarHBondContact O-N 3.06Å; D326-D328 PolarHBondContact O-N 3.21Å; D326-K329 PolarHBondContact O-N 3.29Å; D326-E330 PolarHBondContact O-N 3.05Å
327T50.3Low48Very low95 Ų95133 Ų13358%0.58368%0.678SS**Hα-helixtrans-57.6-25.9170.4-22.90000113.4A325 A331A325-T327 VanDerWaalsContact CB-OG1 3.3Å; A325-T327 WeakPolarHBondContact CB-OG1 3.3Å; A325-T327 PolarHBondContact O-N 2.88Å; T327-A331 VanDerWaalsContact O-CB 3.25Å; T327-A331 WeakPolarHBondContact O-CB 3.39Å; T327-A331 PolarHBondContact O-N 3.39Å
328D50Low47.7Very low114 Ų114133.9 Ų133.961%0.6170%0.695SS**Hα-helixtrans-80.8-22.5-179.9-133.425.7000112.9A325 D326 R332A325-D328 PolarHBondContact O-N 3.21Å; D326-D328 PolarHBondContact O-N 3.21Å; D328-R332 WeakPolarHBondContact O-CB 3.43Å; D328-R332 WeakPolarHBondContact O-CG 3.42Å; D328-R332 PolarHBondContact O-N 3.24Å
329K51.5Low48Very low152 Ų152135.7 Ų135.766%0.66170%0.704SS**Hα-helixtrans-79-42.3171.9-82.7-176.8176.2178.20111.6D326 R332 Q333D326-K329 PolarHBondContact O-N 3.29Å; K329-R332 PolarHBondContact O-N 3.43Å; K329-Q333 VanDerWaalsContact O-CB 3.27Å; K329-Q333 WeakPolarHBondContact O-CB 3.27Å; K329-Q333 PolarHBondContact O-N 2.96Å
330E52.7Low48.2Very low127 Ų127136.1 Ų136.159%0.59370%0.7SS**Hα-helixtrans-65.8-37.8174.2-87.3-168.7139.500112.5D326 Q333 K334D326-E330 PolarHBondContact O-N 3.05Å; E330-Q333 PolarHBondContact O-N 3.49Å; E330-K334 WeakPolarHBondContact O-CG 3.49Å; E330-K334 PolarHBondContact O-N 3.44Å; E330-K334 VanDerWaalsContact O-N 3.09Å
331A52.4Low48.7Very low44 Ų44136.4 Ų136.436%0.36469%0.694SS.*Hα-helixtrans-67.7-42.2176.700000112.3T327 Q333 K334 L335T327-A331 VanDerWaalsContact O-CB 3.25Å; T327-A331 WeakPolarHBondContact O-CB 3.39Å; T327-A331 PolarHBondContact O-N 3.39Å; A331-Q333 VanDerWaalsContact C-N 3.33Å; A331-Q333 PolarHBondContact O-N 3.4Å; A331-K334 PolarHBondContact O-N 3.09Å; A331-L335 PolarHBondContact O-N 2.81Å
332R55.3Low49.3Very low181 Ų181134.8 Ų134.868%0.68369%0.693SS**Hα-helixtrans-65.8-34.5173.5-82.3-175.4173.7-162.5-2.1112.8D328 K329 L335 I336D328-R332 WeakPolarHBondContact O-CB 3.43Å; D328-R332 WeakPolarHBondContact O-CG 3.42Å; D328-R332 PolarHBondContact O-N 3.24Å; K329-R332 PolarHBondContact O-N 3.43Å; R332-L335 PolarHBondContact O-N 3.45Å; R332-I336 WeakPolarHBondContact O-CD1 3.33Å; R332-I336 WeakPolarHBondContact O-CG1 3.25Å; R332-I336 PolarHBondContact O-N 3.21Å
333Q54.2Low49.9Very low143 Ų143134 Ų13467%0.66869%0.688SS**Hα-helixtrans-74-28.2-179.5-159.2163.90.300112.5K329 E330 A331 T337K329-Q333 VanDerWaalsContact O-CB 3.27Å; K329-Q333 WeakPolarHBondContact O-CB 3.27Å; K329-Q333 PolarHBondContact O-N 2.96Å; E330-Q333 PolarHBondContact O-N 3.49Å; A331-Q333 VanDerWaalsContact C-N 3.33Å; A331-Q333 PolarHBondContact O-N 3.4Å; Q333-T337 PolarHBondContact O-OG1 3.49Å
334K54.3Low50.8Low146 Ų146135.2 Ų135.264%0.63568%0.684SS**Hα-helixtrans-78.8-24.6172.5-74.6-179.1179.3176.30114.4E330 A331E330-K334 WeakPolarHBondContact O-CG 3.49Å; E330-K334 PolarHBondContact O-N 3.44Å; E330-K334 VanDerWaalsContact O-N 3.09Å; A331-K334 PolarHBondContact O-N 3.09Å
335L54.9Low51.6Low144 Ų144127.5 Ų127.575%0.75467%0.667SS**Hα-helixtrans-81.4-15176.2-89.8154.9000113.8A331 R332A331-L335 PolarHBondContact O-N 2.81Å; R332-L335 PolarHBondContact O-N 3.45Å
336I56Low52.2Low147 Ų147132.7 Ų132.775%0.75468%0.68SS**SBendtrans-91.7-9.4176.3-62.8166.9000111.2R332R332-I336 WeakPolarHBondContact O-CD1 3.33Å; R332-I336 WeakPolarHBondContact O-CG1 3.25Å; R332-I336 PolarHBondContact O-N 3.21Å
337T51.4Low52.5Low116 Ų116133.4 Ų133.471%0.71268%0.682SS**  trans-104.916.2-179.513.30000115Q333Q333-T337 PolarHBondContact O-OG1 3.49Å
338V46.7Very low52.7Low192 Ų192136.9 Ų136.9100%1.16469%0.691SS**  trans-115.20172.2-177.40000110.8

Retrieved 338 of 338 residues in 1473 ms (Link to these results)

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