A0A077ZK67_TRITR Loading...

Nucleolar protein,Nop52 containing protein

AlphaFold DB , UniProt , Accession A0A077ZK67, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 305 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
1M37.3Very low77.6Confident230 Ų23087.8 Ų87.8100%1.13347%0.468SS*.  0107.80-74.5-176.7-120.600108.7F3M1-F3 PolarHBondContact O-N 3.45Å
2T47.7Very low79.2Confident144 Ų14490.3 Ų90.388%0.88348%0.475SS*.  trans-74.1112.6169.6430000108.1
3F49.7Very low80.7Confident184 Ų18489.2 Ų89.281%0.80746%0.464SS*.PPolyproline II helixtrans-57.1134.1174.4-68.9-80.5000109.4M1 I5M1-F3 PolarHBondContact O-N 3.45Å; F3-I5 PolarHBondContact O-N 3.43Å
4P64Low81.9Confident91 Ų9182.9 Ų82.959%0.59143%0.431SS*.PPolyproline II helixtrans-58.4119.6175.822-29.7000108.3T8P4-T8 HydrophobicContact CB-CG2 4.04Å
5I83.2Confident82.9Confident83 Ų8379.9 Ų79.943%0.42642%0.423SS..PPolyproline II helixtrans-60.3145.8176.6-43.9177.7000107.2F3 E7 T8F3-I5 PolarHBondContact O-N 3.43Å; I5-E7 WeakPolarHBondContact CG2-OE2 3.42Å; I5-E7 PolarHBondContact O-N 3.45Å; I5-T8 VanDerWaalsContact O-CB 3.32Å; I5-T8 WeakPolarHBondContact O-CB 3.47Å; I5-T8 PolarHBondContact O-N 3.03Å; I5-T8 PolarHBondContact O-OG1 3.48Å
6A92.4Very high83.8Confident41 Ų4177.7 Ų77.734%0.33941%0.412SS..Hα-helixtrans-46.3-33.7-172.900000114.4T8 F9 F10 Y32A6-T8 VanDerWaalsContact C-N 3.27Å; A6-T8 PolarHBondContact O-N 3.04Å; A6-F9 WeakPolarHBondContact O-CB 3.29Å; A6-F9 PolarHBondContact O-N 3.47Å; A6-F9 VanDerWaalsContact O-N 3.16Å; A6-F10 VanDerWaalsContact O-CD2 3.28Å; A6-F10 WeakPolarHBondContact O-CD2 3.49Å; A6-F10 PolarHBondContact O-N 2.72Å; A6-F10 VanDerWaalsContact O-N 3.1Å; A6-Y32 HydrophobicContact CB-CE2 4.09Å; A6-Y32 WeakPolarHBondContact CB-OH 3.25Å
7E94.4Very high84.5Confident0 Ų079.2 Ų79.20%043%0.43CS..Hα-helixtrans-53.8-40.2172.9-72.664.2-141.300113.4I5 F9 F10 A11 Y32 R36 F43 D47 I50 L51I5-E7 WeakPolarHBondContact CG2-OE2 3.42Å; I5-E7 PolarHBondContact O-N 3.45Å; E7-F9 VanDerWaalsContact C-N 3.33Å; E7-F9 PolarHBondContact O-N 3.15Å; E7-F10 PolarHBondContact O-N 3.01Å; E7-A11 WeakPolarHBondContact O-CB 3.5Å; E7-A11 PolarHBondContact O-N 2.96Å; E7-Y32 WeakPolarHBondContact OE1-CE1 3.39Å; E7-Y32 VanDerWaalsContact OE1-CZ 3.28Å; E7-Y32 PolarHBondContact OE1-OH 3.44Å; E7-R36 IonicContact OE1-CZ 3.06Å; E7-R36 IonicContact OE1-NE 3.6Å; E7-R36 IonicContact OE1-NH1 2.67Å; E7-R36 PolarHBondContact OE1-NH1 3.27Å; E7-R36 IonicContact OE1-NH2 3.65Å; E7-R36 IonicContact OE2-CZ 3.62Å; E7-R36 IonicContact OE2-NH1 2.83Å; E7-R36 PolarHBondContact OE2-NH1 3.43Å; E7-R36 IonicContact OE2-NH2 3.75Å; E7-F43 HydrophobicContact CG-CE1 4.25Å; E7-F43 WeakPolarHBondContact OE1-CE1 3.26Å; E7-D47 HydrophobicContact CG-CB 3.98Å; E7-I50 HydrophobicContact CB-CB 4.02Å; E7-I50 HydrophobicContact CB-CD1 4.38Å; E7-I50 HydrophobicContact CB-CG2 3.79Å; E7-L51 HydrophobicContact CB-CD2 4.01Å; E7-L51 HydrophobicContact CB-CG 4.26Å; E7-L51 HydrophobicContact CG-CD1 4.31Å; E7-L51 HydrophobicContact CG-CD2 3.99Å; E7-L51 HydrophobicContact CG-CG 3.91Å
8T95.2Very high85.2Confident41 Ų4178.8 Ų78.825%0.25243%0.427SS..Hα-helixtrans-65.6-39.9-179.9-53.20000110.6P4 I5 A6 A11 Q12P4-T8 HydrophobicContact CB-CG2 4.04Å; I5-T8 VanDerWaalsContact O-CB 3.32Å; I5-T8 WeakPolarHBondContact O-CB 3.47Å; I5-T8 PolarHBondContact O-N 3.03Å; I5-T8 PolarHBondContact O-OG1 3.48Å; A6-T8 VanDerWaalsContact C-N 3.27Å; A6-T8 PolarHBondContact O-N 3.04Å; T8-A11 PolarHBondContact O-N 2.98Å; T8-Q12 VanDerWaalsContact O-CG 3.3Å; T8-Q12 WeakPolarHBondContact O-CG 3.43Å; T8-Q12 PolarHBondContact O-N 3.5Å
9F95.7Very high85.7Confident114 Ų11477.4 Ų77.450%0.542%0.422SS..Hα-helixtrans-64-44.9175.3179.4-94.8000111.2A6 E7 A11 Q12 K13A6-F9 WeakPolarHBondContact O-CB 3.29Å; A6-F9 PolarHBondContact O-N 3.47Å; A6-F9 VanDerWaalsContact O-N 3.16Å; E7-F9 VanDerWaalsContact C-N 3.33Å; E7-F9 PolarHBondContact O-N 3.15Å; F9-A11 PolarHBondContact O-N 2.71Å; F9-Q12 PolarHBondContact O-N 3.01Å; F9-K13 HydrophobicContact CD1-CG 4.34Å; F9-K13 HydrophobicContact CE1-CG 3.99Å; F9-K13 HydrophobicContact CE2-CG 4.43Å; F9-K13 HydrophobicContact CZ-CD 4.4Å; F9-K13 HydrophobicContact CZ-CG 4.06Å; F9-K13 WeakPolarHBondContact O-CG 3.45Å; F9-K13 PolarHBondContact O-N 3.46Å
10F97.2Very high86.2Confident24 Ų2476.9 Ų76.911%0.10542%0.421CS..Hα-helixtrans-59.6-46.2173.8-80-69.8000111.7A6 E7 Q12 K13 L14 A28 L29 Y32 L51A6-F10 VanDerWaalsContact O-CD2 3.28Å; A6-F10 WeakPolarHBondContact O-CD2 3.49Å; A6-F10 PolarHBondContact O-N 2.72Å; A6-F10 VanDerWaalsContact O-N 3.1Å; E7-F10 PolarHBondContact O-N 3.01Å; F10-Q12 VanDerWaalsContact C-N 3.35Å; F10-Q12 PolarHBondContact O-N 2.97Å; F10-K13 PolarHBondContact O-N 3.26Å; F10-L14 WeakPolarHBondContact O-CB 3.44Å; F10-L14 VanDerWaalsContact O-CG 3.27Å; F10-L14 WeakPolarHBondContact O-CG 3.29Å; F10-L14 PolarHBondContact O-N 3.05Å; F10-A28 HydrophobicContact CE1-CB 3.82Å; F10-A28 HydrophobicContact CZ-CB 4.47Å; F10-L29 HydrophobicContact CB-CD1 4.3Å; F10-L29 HydrophobicContact CD1-CB 3.86Å; F10-L29 HydrophobicContact CD1-CD1 4.2Å; F10-L29 HydrophobicContact CD2-CD1 4.35Å; F10-L29 HydrophobicContact CE1-CB 4.11Å; F10-L29 HydrophobicContact CG-CD1 4.03Å; F10-Y32 AromaticContact CD2-CD1 3.85Å; F10-Y32 HydrophobicContact CD2-CD1 3.85Å; F10-Y32 HydrophobicContact CD2-CE1 4.11Å; F10-Y32 HydrophobicContact CD2-CG 4.22Å; F10-Y32 AromaticContact CE2-CD1 3.45Å; F10-Y32 HydrophobicContact CE2-CD1 3.45Å; F10-Y32 VanDerWaalsContact CE2-CD1 3.45Å; F10-Y32 AromaticContact CE2-CD2 3.79Å; F10-Y32 HydrophobicContact CE2-CD2 3.79Å; F10-Y32 AromaticContact CE2-CE1 3.95Å; F10-Y32 HydrophobicContact CE2-CE1 3.95Å; F10-Y32 HydrophobicContact CE2-CE2 4.26Å; F10-Y32 AromaticContact CE2-CG 3.34Å; F10-Y32 HydrophobicContact CE2-CG 3.34Å; F10-Y32 HydrophobicContact CZ-CD1 4.15Å; F10-Y32 HydrophobicContact CZ-CD2 4.31Å; F10-Y32 AromaticContact CZ-CG 3.75Å; F10-Y32 HydrophobicContact CZ-CG 3.75Å; F10-L51 HydrophobicContact CB-CD2 3.96Å
11A97.3Very high86.8Confident14 Ų1475.6 Ų75.612%0.11641%0.414CS..Hα-helixtrans-59.8-44.2-18000000112.2E7 T8 F9 K13 L14 A15 I50E7-A11 WeakPolarHBondContact O-CB 3.5Å; E7-A11 PolarHBondContact O-N 2.96Å; T8-A11 PolarHBondContact O-N 2.98Å; F9-A11 PolarHBondContact O-N 2.71Å; A11-K13 PolarHBondContact O-N 3.21Å; A11-L14 PolarHBondContact O-N 3.05Å; A11-A15 WeakPolarHBondContact O-CB 3.4Å; A11-A15 PolarHBondContact O-N 3.16Å; A11-I50 HydrophobicContact CB-CG2 3.83Å; A11-I50 WeakPolarHBondContact CB-O 3.44Å
12Q97Very high89.6Confident118 Ų11865.2 Ų65.255%0.55136%0.362SS*.Hα-helixtrans-61.9-41.1175.6-73.5172.6-1400112.6T8 F9 F10 A15 N16T8-Q12 VanDerWaalsContact O-CG 3.3Å; T8-Q12 WeakPolarHBondContact O-CG 3.43Å; T8-Q12 PolarHBondContact O-N 3.5Å; F9-Q12 PolarHBondContact O-N 3.01Å; F10-Q12 VanDerWaalsContact C-N 3.35Å; F10-Q12 PolarHBondContact O-N 2.97Å; Q12-A15 PolarHBondContact O-N 2.88Å; Q12-N16 PolarHBondContact O-N 3.25Å
13K97.7Very high91.9Very high76 Ų7664.4 Ų64.433%0.3335%0.346SS..Hα-helixtrans-72.9-33.3179.3-65.6-67.4-177.8-175.80112.6F9 F10 A11 A15 N16 I21 A25F9-K13 HydrophobicContact CD1-CG 4.34Å; F9-K13 HydrophobicContact CE1-CG 3.99Å; F9-K13 HydrophobicContact CE2-CG 4.43Å; F9-K13 HydrophobicContact CZ-CD 4.4Å; F9-K13 HydrophobicContact CZ-CG 4.06Å; F9-K13 WeakPolarHBondContact O-CG 3.45Å; F9-K13 PolarHBondContact O-N 3.46Å; F10-K13 PolarHBondContact O-N 3.26Å; A11-K13 PolarHBondContact O-N 3.21Å; K13-A15 VanDerWaalsContact C-N 3.32Å; K13-N16 VanDerWaalsContact O-CB 3.27Å; K13-N16 WeakPolarHBondContact O-CB 3.46Å; K13-N16 PolarHBondContact O-N 2.93Å; K13-I21 HydrophobicContact CB-CG2 4.32Å; K13-I21 HydrophobicContact CD-CG2 3.76Å; K13-A25 HydrophobicContact CB-CB 3.55Å
14L97.9Very high94.2Very high0 Ų064 Ų640%034%0.339CS..Hα-helixtrans-69.6-30172.6-71.5165.7000112.3F10 A11 N16 R22 A25 F26 L29 G54 L55 S58F10-L14 WeakPolarHBondContact O-CB 3.44Å; F10-L14 VanDerWaalsContact O-CG 3.27Å; F10-L14 WeakPolarHBondContact O-CG 3.29Å; F10-L14 PolarHBondContact O-N 3.05Å; A11-L14 PolarHBondContact O-N 3.05Å; L14-N16 VanDerWaalsContact C-N 3.3Å; L14-R22 WeakPolarHBondContact O-CD 3.44Å; L14-R22 WeakPolarHBondContact O-CG 3.44Å; L14-A25 HydrophobicContact CD2-CB 4.14Å; L14-A25 HydrophobicContact CG-CB 4.24Å; L14-F26 HydrophobicContact CD2-CB 4.09Å; L14-F26 HydrophobicContact CD2-CD2 4.15Å; L14-L29 HydrophobicContact CD1-CD2 3.82Å; L14-G54 WeakPolarHBondContact CB-O 3.39Å; L14-L55 HydrophobicContact CD1-CD2 3.96Å; L14-L55 HydrophobicContact CD1-CG 4.36Å; L14-L55 HydrophobicContact CD2-CD2 4.46Å; L14-S58 WeakPolarHBondContact O-CA 3.29Å; L14-S58 WeakPolarHBondContact O-CB 3.48Å
15A97.2Very high95.8Very high38 Ų3860.2 Ų60.231%0.31432%0.315SS..THydrogen-bonded Turntrans-88.110.6174.800000113.8A11 Q12 K13 Y57 L61A11-A15 WeakPolarHBondContact O-CB 3.4Å; A11-A15 PolarHBondContact O-N 3.16Å; Q12-A15 PolarHBondContact O-N 2.88Å; K13-A15 VanDerWaalsContact C-N 3.32Å; A15-Y57 HydrophobicContact CB-CD2 4.46Å; A15-Y57 HydrophobicContact CB-CG 4.31Å; A15-L61 WeakPolarHBondContact O-CD1 3.34Å
16N97.3Very high96.5Very high45 Ų4556.6 Ų56.624%0.24130%0.296CS..  trans-75.8142.8-178.7-166-82.2000111.6Q12 K13 L14 D18 I21 R22Q12-N16 PolarHBondContact O-N 3.25Å; K13-N16 VanDerWaalsContact O-CB 3.27Å; K13-N16 WeakPolarHBondContact O-CB 3.46Å; K13-N16 PolarHBondContact O-N 2.93Å; L14-N16 VanDerWaalsContact C-N 3.3Å; N16-D18 VanDerWaalsContact C-N 3.3Å; N16-D18 PolarHBondContact O-N 3.37Å; N16-D18 WeakPolarHBondContact OD1-CB 3.41Å; N16-D18 PolarHBondContact OD1-N 2.89Å; N16-I21 HydrophobicContact CB-CB 4.24Å; N16-I21 HydrophobicContact CB-CG2 3.8Å; N16-R22 HydrophobicContact CB-CG 4.45Å; N16-R22 WeakPolarHBondContact O-CD 2.96Å; N16-R22 WeakPolarHBondContact O-CG 3.34Å; N16-R22 PolarHBondContact O-NH1 2.99Å
17S95.9Very high96.6Very high103 Ų10360.5 Ų60.572%0.7231%0.311SS*.SBendtrans-65.9-29.3178.751.60000113.4T19 R22S17-T19 PolarHBondContact O-N 3.39Å; S17-R22 VanDerWaalsContact C-NH1 3.25Å; S17-R22 PolarHBondContact O-NH1 3.41Å
18D96.6Very high96.8Very high72 Ų7262.8 Ų62.839%0.38533%0.33SS..  trans-74.1117.5175.8-176.9-11.5000111.2N16 T20 I21 R22N16-D18 VanDerWaalsContact C-N 3.3Å; N16-D18 PolarHBondContact O-N 3.37Å; N16-D18 WeakPolarHBondContact OD1-CB 3.41Å; N16-D18 PolarHBondContact OD1-N 2.89Å; D18-T20 PolarHBondContact O-N 3.4Å; D18-T20 WeakPolarHBondContact OD1-CA 3.39Å; D18-T20 VanDerWaalsContact OD1-CB 3.25Å; D18-T20 WeakPolarHBondContact OD1-CB 3.12Å; D18-T20 PolarHBondContact OD1-N 3.41Å; D18-T20 PolarHBondContact OD1-OG1 3.35Å; D18-I21 HydrophobicContact CB-CB 4.17Å; D18-I21 HydrophobicContact CB-CD1 3.93Å; D18-I21 HydrophobicContact CB-CG1 3.95Å; D18-I21 PolarHBondContact O-N 3.27Å; D18-I21 VanDerWaalsContact O-N 3.16Å; D18-R22 PolarHBondContact O-N 3.48Å
19T94.9Very high96.9Very high53 Ų5360.8 Ų60.833%0.32532%0.318SS..Hα-helixtrans-58.1-35178.2-61.70000112.5S17 R22 K23S17-T19 PolarHBondContact O-N 3.39Å; T19-R22 PolarHBondContact O-N 3.13Å; T19-R22 PolarHBondContact OG1-NH2 3.25Å; T19-K23 HydrophobicContact CG2-CD 4.19Å; T19-K23 HydrophobicContact CG2-CG 4.41Å; T19-K23 WeakPolarHBondContact O-CB 3.08Å; T19-K23 WeakPolarHBondContact O-CG 3.45Å; T19-K23 PolarHBondContact O-N 2.99Å
20T96.4Very high96.9Very high66 Ų6658.6 Ų58.641%0.40531%0.308SS..Hα-helixtrans-66.6-42.8178.9-52.60000110.8D18 K23 R24D18-T20 PolarHBondContact O-N 3.4Å; D18-T20 WeakPolarHBondContact OD1-CA 3.39Å; D18-T20 VanDerWaalsContact OD1-CB 3.25Å; D18-T20 WeakPolarHBondContact OD1-CB 3.12Å; D18-T20 PolarHBondContact OD1-N 3.41Å; D18-T20 PolarHBondContact OD1-OG1 3.35Å; T20-K23 PolarHBondContact O-N 3.06Å; T20-R24 WeakPolarHBondContact O-CG 3.38Å; T20-R24 PolarHBondContact O-N 3.25Å
21I97.6Very high96.8Very high51 Ų5163.9 Ų63.926%0.26233%0.331SS..Hα-helixtrans-63.4-46.5176.2-65179.7000110K13 N16 D18 K23 R24 A25K13-I21 HydrophobicContact CB-CG2 4.32Å; K13-I21 HydrophobicContact CD-CG2 3.76Å; N16-I21 HydrophobicContact CB-CB 4.24Å; N16-I21 HydrophobicContact CB-CG2 3.8Å; D18-I21 HydrophobicContact CB-CB 4.17Å; D18-I21 HydrophobicContact CB-CD1 3.93Å; D18-I21 HydrophobicContact CB-CG1 3.95Å; D18-I21 PolarHBondContact O-N 3.27Å; D18-I21 VanDerWaalsContact O-N 3.16Å; I21-K23 PolarHBondContact O-N 3.05Å; I21-R24 PolarHBondContact O-N 2.75Å; I21-A25 VanDerWaalsContact O-CB 3.31Å; I21-A25 WeakPolarHBondContact O-CB 3.45Å; I21-A25 PolarHBondContact O-N 3.3Å
22R97.2Very high96.8Very high12 Ų1265 Ų655%0.04533%0.332CS..Hα-helixtrans-58.7-48.2177.6-64.9-159.1-62.4-75.47.6112.4L14 N16 S17 D18 T19 R24 A25 F26 L61L14-R22 WeakPolarHBondContact O-CD 3.44Å; L14-R22 WeakPolarHBondContact O-CG 3.44Å; N16-R22 HydrophobicContact CB-CG 4.45Å; N16-R22 WeakPolarHBondContact O-CD 2.96Å; N16-R22 WeakPolarHBondContact O-CG 3.34Å; N16-R22 PolarHBondContact O-NH1 2.99Å; S17-R22 VanDerWaalsContact C-NH1 3.25Å; S17-R22 PolarHBondContact O-NH1 3.41Å; D18-R22 PolarHBondContact O-N 3.48Å; T19-R22 PolarHBondContact O-N 3.13Å; T19-R22 PolarHBondContact OG1-NH2 3.25Å; R22-R24 PolarHBondContact O-N 3.09Å; R22-A25 WeakPolarHBondContact O-CB 3.3Å; R22-A25 PolarHBondContact O-N 3.02Å; R22-F26 PolarHBondContact O-N 3.37Å; R22-L61 PolarHBondContact NH2-O 3.38Å; R22-L61 VanDerWaalsContact NH2-O 3.12Å
23K95.9Very high96.7Very high126 Ų12659.4 Ų59.455%0.54831%0.306SS..Hα-helixtrans-59.2-46.5178.9-76.3179.5175.5-172.50112T19 T20 I21 A25 F26 L27T19-K23 HydrophobicContact CG2-CD 4.19Å; T19-K23 HydrophobicContact CG2-CG 4.41Å; T19-K23 WeakPolarHBondContact O-CB 3.08Å; T19-K23 WeakPolarHBondContact O-CG 3.45Å; T19-K23 PolarHBondContact O-N 2.99Å; T20-K23 PolarHBondContact O-N 3.06Å; I21-K23 PolarHBondContact O-N 3.05Å; K23-A25 VanDerWaalsContact C-N 3.35Å; K23-F26 PolarHBondContact O-N 2.92Å; K23-L27 PolarHBondContact O-N 3.38Å; K23-L27 VanDerWaalsContact O-N 3.15Å
24R97.3Very high96.6Very high177 Ų17761.7 Ų61.767%0.66831%0.313SS*.Hα-helixtrans-63.1-41.8176.6-71.7176.9-178.3165.62111.6T20 I21 R22 F26 L27 A28T20-R24 WeakPolarHBondContact O-CG 3.38Å; T20-R24 PolarHBondContact O-N 3.25Å; I21-R24 PolarHBondContact O-N 2.75Å; R22-R24 PolarHBondContact O-N 3.09Å; R24-F26 VanDerWaalsContact C-N 3.32Å; R24-F26 PolarHBondContact O-N 2.93Å; R24-L27 PolarHBondContact O-N 2.76Å; R24-A28 WeakPolarHBondContact O-CB 3.44Å; R24-A28 PolarHBondContact O-N 3.48Å
25A97.7Very high96.4Very high10 Ų1067.1 Ų67.18%0.08334%0.338CS..Hα-helixtrans-61.5-40.8176.900000111.9K13 L14 I21 R22 K23 A28 L29K13-A25 HydrophobicContact CB-CB 3.55Å; L14-A25 HydrophobicContact CD2-CB 4.14Å; L14-A25 HydrophobicContact CG-CB 4.24Å; I21-A25 VanDerWaalsContact O-CB 3.31Å; I21-A25 WeakPolarHBondContact O-CB 3.45Å; I21-A25 PolarHBondContact O-N 3.3Å; R22-A25 WeakPolarHBondContact O-CB 3.3Å; R22-A25 PolarHBondContact O-N 3.02Å; K23-A25 VanDerWaalsContact C-N 3.35Å; A25-A28 PolarHBondContact O-N 3.4Å; A25-L29 VanDerWaalsContact O-CB 3.29Å; A25-L29 WeakPolarHBondContact O-CB 3.04Å; A25-L29 PolarHBondContact O-N 3.14Å
26F97.1Very high96.2Very high8 Ų866.9 Ų66.94%0.03533%0.329CS..Hα-helixtrans-63.4-47.9177.7-168.1-86.5000112.4L14 R22 K23 R24 A28 L29 K30 L55 Q74 I75 L78L14-F26 HydrophobicContact CD2-CB 4.09Å; L14-F26 HydrophobicContact CD2-CD2 4.15Å; R22-F26 PolarHBondContact O-N 3.37Å; K23-F26 PolarHBondContact O-N 2.92Å; R24-F26 VanDerWaalsContact C-N 3.32Å; R24-F26 PolarHBondContact O-N 2.93Å; F26-A28 VanDerWaalsContact C-N 3.33Å; F26-A28 PolarHBondContact O-N 2.98Å; F26-L29 WeakPolarHBondContact O-CB 3.35Å; F26-L29 PolarHBondContact O-N 3.32Å; F26-K30 PolarHBondContact O-N 3.29Å; F26-K30 VanDerWaalsContact O-N 3.08Å; F26-L55 HydrophobicContact CD2-CD2 4.12Å; F26-L55 HydrophobicContact CE2-CD2 3.87Å; F26-Q74 VanDerWaalsContact CD1-OE1 3.31Å; F26-Q74 HydrophobicContact CE1-CB 3.71Å; F26-Q74 HydrophobicContact CE1-CG 4.27Å; F26-Q74 HydrophobicContact CE2-CB 4.45Å; F26-Q74 HydrophobicContact CZ-CB 3.64Å; F26-Q74 WeakPolarHBondContact CZ-O 3.21Å; F26-I75 HydrophobicContact CE2-CG1 3.93Å; F26-L78 HydrophobicContact CE1-CD2 4.31Å; F26-L78 HydrophobicContact CE2-CD1 3.75Å; F26-L78 HydrophobicContact CE2-CG 4.23Å; F26-L78 HydrophobicContact CZ-CD1 3.8Å; F26-L78 HydrophobicContact CZ-CD2 3.89Å; F26-L78 HydrophobicContact CZ-CG 3.74Å
27L95.9Very high95.9Very high122 Ų12265 Ų6564%0.63932%0.319SS*.Hα-helixtrans-60.4-43.6176.2-67.6174.6000111.8K23 R24 K30 K31K23-L27 PolarHBondContact O-N 3.38Å; K23-L27 VanDerWaalsContact O-N 3.15Å; R24-L27 PolarHBondContact O-N 2.76Å; L27-K30 PolarHBondContact O-N 3.3Å; L27-K31 PolarHBondContact O-N 3.02Å
28A97.2Very high95.6Very high48 Ų4865.2 Ų65.240%0.39731%0.312SS..Hα-helixtrans-65.7-38.3176.600000112.1F10 R24 A25 F26 K30 K31 Y32F10-A28 HydrophobicContact CE1-CB 3.82Å; F10-A28 HydrophobicContact CZ-CB 4.47Å; R24-A28 WeakPolarHBondContact O-CB 3.44Å; R24-A28 PolarHBondContact O-N 3.48Å; A25-A28 PolarHBondContact O-N 3.4Å; F26-A28 VanDerWaalsContact C-N 3.33Å; F26-A28 PolarHBondContact O-N 2.98Å; A28-K30 PolarHBondContact O-N 3.19Å; A28-K31 PolarHBondContact O-N 3.36Å; A28-Y32 WeakPolarHBondContact O-CB 3.31Å; A28-Y32 PolarHBondContact O-N 2.92Å
29L97.4Very high95.1Very high0 Ų064 Ų640%032%0.317CS..Hα-helixtrans-60.3-46.4176.8174.963.5000110.8F10 L14 A25 F26 K31 Y32 I33 L51 L55 L78F10-L29 HydrophobicContact CB-CD1 4.3Å; F10-L29 HydrophobicContact CD1-CB 3.86Å; F10-L29 HydrophobicContact CD1-CD1 4.2Å; F10-L29 HydrophobicContact CD2-CD1 4.35Å; F10-L29 HydrophobicContact CE1-CB 4.11Å; F10-L29 HydrophobicContact CG-CD1 4.03Å; L14-L29 HydrophobicContact CD1-CD2 3.82Å; A25-L29 VanDerWaalsContact O-CB 3.29Å; A25-L29 WeakPolarHBondContact O-CB 3.04Å; A25-L29 PolarHBondContact O-N 3.14Å; F26-L29 WeakPolarHBondContact O-CB 3.35Å; F26-L29 PolarHBondContact O-N 3.32Å; L29-K31 VanDerWaalsContact C-N 3.29Å; L29-K31 PolarHBondContact O-N 3.15Å; L29-Y32 HydrophobicContact CD1-CD1 4.17Å; L29-Y32 WeakPolarHBondContact O-CB 3.45Å; L29-Y32 PolarHBondContact O-N 3.15Å; L29-Y32 VanDerWaalsContact O-N 3.12Å; L29-I33 HydrophobicContact CD1-CD1 3.89Å; L29-I33 HydrophobicContact CD1-CG1 3.9Å; L29-I33 HydrophobicContact CD2-CD1 4.32Å; L29-I33 HydrophobicContact CG-CD1 3.8Å; L29-I33 HydrophobicContact CG-CG1 4.25Å; L29-I33 WeakPolarHBondContact O-CG1 3.31Å; L29-I33 PolarHBondContact O-N 3.16Å; L29-L51 HydrophobicContact CD1-CD1 4.09Å; L29-L51 HydrophobicContact CD1-CD2 3.62Å; L29-L51 HydrophobicContact CD1-CG 4.44Å; L29-L55 HydrophobicContact CD2-CD2 3.98Å; L29-L78 HydrophobicContact CD2-CD1 4.18Å
30K96.6Very high94.4Very high67 Ų6772.4 Ų72.429%0.29135%0.349SS..Hα-helixtrans-58.2-41.8178.7-171.1170.9-174.6168.30111.8F26 L27 A28 R34 L78 A81F26-K30 PolarHBondContact O-N 3.29Å; F26-K30 VanDerWaalsContact O-N 3.08Å; L27-K30 PolarHBondContact O-N 3.3Å; A28-K30 PolarHBondContact O-N 3.19Å; K30-R34 WeakPolarHBondContact O-CG 3.41Å; K30-R34 PolarHBondContact O-N 3.44Å; K30-L78 HydrophobicContact CB-CD2 4.02Å; K30-L78 HydrophobicContact CG-CD2 4.17Å; K30-A81 HydrophobicContact CG-CB 4.35Å
31K95.8Very high93.8Very high136 Ų13675.8 Ų75.859%0.59136%0.358SS*.Hα-helixtrans-66.1-44.2174.7-174.5178.1180179.90111.6L27 A28 L29 R34 Q35L27-K31 PolarHBondContact O-N 3.02Å; A28-K31 PolarHBondContact O-N 3.36Å; L29-K31 VanDerWaalsContact C-N 3.29Å; L29-K31 PolarHBondContact O-N 3.15Å; K31-R34 PolarHBondContact O-N 2.98Å; K31-Q35 WeakPolarHBondContact O-CG 3.4Å; K31-Q35 PolarHBondContact O-N 3.34Å
32Y95.7Very high93.2Very high37 Ų3776.7 Ų76.715%0.14537%0.369CS..Hα-helixtrans-61.6-45.2179.4171.4-105.6000112.7A6 E7 F10 A28 L29 R34 Q35 R36 F43A6-Y32 HydrophobicContact CB-CE2 4.09Å; A6-Y32 WeakPolarHBondContact CB-OH 3.25Å; E7-Y32 WeakPolarHBondContact OE1-CE1 3.39Å; E7-Y32 VanDerWaalsContact OE1-CZ 3.28Å; E7-Y32 PolarHBondContact OE1-OH 3.44Å; F10-Y32 AromaticContact CD2-CD1 3.85Å; F10-Y32 HydrophobicContact CD2-CD1 3.85Å; F10-Y32 HydrophobicContact CD2-CE1 4.11Å; F10-Y32 HydrophobicContact CD2-CG 4.22Å; F10-Y32 AromaticContact CE2-CD1 3.45Å; F10-Y32 HydrophobicContact CE2-CD1 3.45Å; F10-Y32 VanDerWaalsContact CE2-CD1 3.45Å; F10-Y32 AromaticContact CE2-CD2 3.79Å; F10-Y32 HydrophobicContact CE2-CD2 3.79Å; F10-Y32 AromaticContact CE2-CE1 3.95Å; F10-Y32 HydrophobicContact CE2-CE1 3.95Å; F10-Y32 HydrophobicContact CE2-CE2 4.26Å; F10-Y32 AromaticContact CE2-CG 3.34Å; F10-Y32 HydrophobicContact CE2-CG 3.34Å; F10-Y32 HydrophobicContact CZ-CD1 4.15Å; F10-Y32 HydrophobicContact CZ-CD2 4.31Å; F10-Y32 AromaticContact CZ-CG 3.75Å; F10-Y32 HydrophobicContact CZ-CG 3.75Å; A28-Y32 WeakPolarHBondContact O-CB 3.31Å; A28-Y32 PolarHBondContact O-N 2.92Å; L29-Y32 HydrophobicContact CD1-CD1 4.17Å; L29-Y32 WeakPolarHBondContact O-CB 3.45Å; L29-Y32 PolarHBondContact O-N 3.15Å; L29-Y32 VanDerWaalsContact O-N 3.12Å; Y32-R34 VanDerWaalsContact C-N 3.32Å; Y32-R34 PolarHBondContact O-N 3.46Å; Y32-Q35 PolarHBondContact O-N 2.84Å; Y32-R36 WeakPolarHBondContact O-CB 3.36Å; Y32-R36 PolarHBondContact O-N 3.36Å; Y32-R36 WeakPolarHBondContact OH-CD 3.29Å; Y32-R36 PolarHBondContact OH-NH1 3.42Å; Y32-F43 HydrophobicContact CD1-CZ 4.23Å; Y32-F43 AromaticContact CE1-CE1 3.95Å; Y32-F43 HydrophobicContact CE1-CE1 3.95Å; Y32-F43 AromaticContact CE1-CZ 3.77Å; Y32-F43 HydrophobicContact CE1-CZ 3.77Å
33I96.2Very high92.9Very high0 Ų076.7 Ų76.70%037%0.369CS..Hα-helixtrans-56.9-48176.8-68.7168000110.2L29 Q35 R36 C37 F43 L78 A81 F82L29-I33 HydrophobicContact CD1-CD1 3.89Å; L29-I33 HydrophobicContact CD1-CG1 3.9Å; L29-I33 HydrophobicContact CD2-CD1 4.32Å; L29-I33 HydrophobicContact CG-CD1 3.8Å; L29-I33 HydrophobicContact CG-CG1 4.25Å; L29-I33 WeakPolarHBondContact O-CG1 3.31Å; L29-I33 PolarHBondContact O-N 3.16Å; I33-Q35 PolarHBondContact O-N 3.3Å; I33-R36 PolarHBondContact O-N 2.9Å; I33-C37 VanDerWaalsContact O-CB 3.3Å; I33-C37 WeakPolarHBondContact O-CB 3.34Å; I33-C37 PolarHBondContact O-N 3.46Å; I33-C37 PolarHBondContact O-SG 3.05Å; I33-F43 HydrophobicContact CB-CE2 4.45Å; I33-F43 HydrophobicContact CG1-CE2 4.44Å; I33-F43 HydrophobicContact CG1-CZ 4.12Å; I33-F43 HydrophobicContact CG2-CE2 4.22Å; I33-L78 HydrophobicContact CD1-CD2 4.29Å; I33-A81 HydrophobicContact CB-CB 4.13Å; I33-A81 HydrophobicContact CG2-CB 3.74Å; I33-F82 HydrophobicContact CD1-CE2 4.33Å; I33-F82 HydrophobicContact CD1-CZ 4.21Å; I33-F82 HydrophobicContact CG2-CD1 3.86Å; I33-F82 HydrophobicContact CG2-CD2 4.06Å; I33-F82 HydrophobicContact CG2-CE1 3.83Å; I33-F82 HydrophobicContact CG2-CE2 4.01Å; I33-F82 HydrophobicContact CG2-CG 3.99Å; I33-F82 HydrophobicContact CG2-CZ 3.9Å
34R94.8Very high92.8Very high125 Ų12573 Ų7347%0.47236%0.359SS..Hα-helixtrans-59.8-43.9178.3-72.3174.9174.5162.2-5.1112.3K30 K31 Y32 N38 A81K30-R34 WeakPolarHBondContact O-CG 3.41Å; K30-R34 PolarHBondContact O-N 3.44Å; K31-R34 PolarHBondContact O-N 2.98Å; Y32-R34 VanDerWaalsContact C-N 3.32Å; Y32-R34 PolarHBondContact O-N 3.46Å; R34-N38 PolarHBondContact O-N 2.94Å; R34-N38 PolarHBondContact O-ND2 2.92Å; R34-N38 VanDerWaalsContact O-ND2 3.13Å; R34-A81 HydrophobicContact CG-CB 4.11Å; R34-A81 WeakPolarHBondContact CG-O 3.26Å
35Q93.6Very high92.6Very high114 Ų11467.2 Ų67.253%0.53335%0.349SS..Hα-helixtrans-65.1-48.6178.4-72.2176.5-16.300111.8K31 Y32 I33 C37 N38 G39K31-Q35 WeakPolarHBondContact O-CG 3.4Å; K31-Q35 PolarHBondContact O-N 3.34Å; Y32-Q35 PolarHBondContact O-N 2.84Å; I33-Q35 PolarHBondContact O-N 3.3Å; Q35-C37 PolarHBondContact O-N 3.37Å; Q35-N38 PolarHBondContact O-N 3.25Å; Q35-G39 PolarHBondContact O-N 3.32Å; Q35-G39 VanDerWaalsContact O-N 3.17Å
36R93.1Very high92.5Very high32 Ų3270.4 Ų70.412%0.12137%0.371CS..Hα-helixtrans-66-37.1-179.4-176.8157.4171.7167.1-16.1112.1E7 Y32 I33 N38 G39 F43 D47E7-R36 IonicContact OE1-CZ 3.06Å; E7-R36 IonicContact OE1-NE 3.6Å; E7-R36 IonicContact OE1-NH1 2.67Å; E7-R36 PolarHBondContact OE1-NH1 3.27Å; E7-R36 IonicContact OE1-NH2 3.65Å; E7-R36 IonicContact OE2-CZ 3.62Å; E7-R36 IonicContact OE2-NH1 2.83Å; E7-R36 PolarHBondContact OE2-NH1 3.43Å; E7-R36 IonicContact OE2-NH2 3.75Å; Y32-R36 WeakPolarHBondContact O-CB 3.36Å; Y32-R36 PolarHBondContact O-N 3.36Å; Y32-R36 WeakPolarHBondContact OH-CD 3.29Å; Y32-R36 PolarHBondContact OH-NH1 3.42Å; I33-R36 PolarHBondContact O-N 2.9Å; R36-N38 PolarHBondContact O-N 3.03Å; R36-G39 PolarHBondContact O-N 3.39Å; R36-G39 VanDerWaalsContact O-N 3.13Å; R36-F43 HydrophobicContact CB-CE2 3.71Å; R36-F43 HydrophobicContact CB-CZ 3.84Å; R36-F43 HydrophobicContact CG-CD2 4.16Å; R36-F43 HydrophobicContact CG-CE1 4.4Å; R36-F43 HydrophobicContact CG-CE2 3.71Å; R36-F43 HydrophobicContact CG-CZ 3.84Å; R36-D47 IonicContact NH2-OD1 3.2Å; R36-D47 PolarHBondContact NH2-OD1 3.19Å; R36-D47 VanDerWaalsContact NH2-OD1 3.16Å; R36-D47 IonicContact NH2-OD2 2.98Å; R36-D47 PolarHBondContact NH2-OD2 3.19Å
37C92Very high92.5Very high6 Ų670.4 Ų70.44%0.04137%0.371CS..Hα-helixtrans-68-22.3175.6-68.10000113.9I33 Q35 K83 Q87I33-C37 VanDerWaalsContact O-CB 3.3Å; I33-C37 WeakPolarHBondContact O-CB 3.34Å; I33-C37 PolarHBondContact O-N 3.46Å; I33-C37 PolarHBondContact O-SG 3.05Å; Q35-C37 PolarHBondContact O-N 3.37Å; C37-K83 HydrophobicContact CB-CB 3.95Å; C37-Q87 PolarHBondContact SG-OE1 2.67Å
38N88.3Confident92.5Very high108 Ų10864.6 Ų64.658%0.57834%0.341SS*.Hα-helixtrans-87.2-15.5172.6-78.6-37.6000113.5R34 Q35 R36 K83R34-N38 PolarHBondContact O-N 2.94Å; R34-N38 PolarHBondContact O-ND2 2.92Å; R34-N38 VanDerWaalsContact O-ND2 3.13Å; Q35-N38 PolarHBondContact O-N 3.25Å; R36-N38 PolarHBondContact O-N 3.03Å; N38-K83 WeakPolarHBondContact OD1-CD 3.2Å; N38-K83 PolarHBondContact OD1-NZ 3.44Å
39G85.8Confident92.5Very high47 Ų4763.3 Ų63.349%0.48533%0.329SS..SBendtrans-80.8-179.8178.100000113.6Q35 R36Q35-G39 PolarHBondContact O-N 3.32Å; Q35-G39 VanDerWaalsContact O-N 3.17Å; R36-G39 PolarHBondContact O-N 3.39Å; R36-G39 VanDerWaalsContact O-N 3.13Å
40K80.1Confident92.5Very high229 Ų22964.5 Ų64.5100%0.99634%0.335SS*.SBendtrans-70.8-29.3179.5-64.7-177.4178.7-179.10113.4
41K84.7Confident92.5Very high137 Ų13761.4 Ų61.460%0.59632%0.322SS*.SBendtrans-101100.9-176.3-170.3178.4-178.7-178.40110.8
42S84Confident92.6Very high69 Ų6955.2 Ų55.248%0.48330%0.295SS..PPolyproline II helixtrans-66.7157.6171.263.30000111.8S44S42-S44 PolarHBondContact O-N 2.96Å
43F91.6Very high92.6Very high12 Ų1259 Ų595%0.05331%0.309CS..PPolyproline II helixtrans-65.9130.4172.9-72.8-87.7000110.8E7 Y32 I33 R36 D47 V48 L51 F82E7-F43 HydrophobicContact CG-CE1 4.25Å; E7-F43 WeakPolarHBondContact OE1-CE1 3.26Å; Y32-F43 HydrophobicContact CD1-CZ 4.23Å; Y32-F43 AromaticContact CE1-CE1 3.95Å; Y32-F43 HydrophobicContact CE1-CE1 3.95Å; Y32-F43 AromaticContact CE1-CZ 3.77Å; Y32-F43 HydrophobicContact CE1-CZ 3.77Å; I33-F43 HydrophobicContact CB-CE2 4.45Å; I33-F43 HydrophobicContact CG1-CE2 4.44Å; I33-F43 HydrophobicContact CG1-CZ 4.12Å; I33-F43 HydrophobicContact CG2-CE2 4.22Å; R36-F43 HydrophobicContact CB-CE2 3.71Å; R36-F43 HydrophobicContact CB-CZ 3.84Å; R36-F43 HydrophobicContact CG-CD2 4.16Å; R36-F43 HydrophobicContact CG-CE1 4.4Å; R36-F43 HydrophobicContact CG-CE2 3.71Å; R36-F43 HydrophobicContact CG-CZ 3.84Å; F43-D47 HydrophobicContact CB-CB 4.46Å; F43-D47 HydrophobicContact CD1-CB 3.81Å; F43-V48 HydrophobicContact CB-CG2 3.69Å; F43-V48 HydrophobicContact CD1-CG2 4.31Å; F43-V48 HydrophobicContact CG-CG2 4.22Å; F43-L51 HydrophobicContact CD1-CD1 4.35Å; F43-L51 HydrophobicContact CE1-CD1 3.77Å; F43-L51 HydrophobicContact CZ-CD1 4.38Å; F43-F82 HydrophobicContact CD2-CD1 4.38Å; F43-F82 AromaticContact CD2-CE1 3.93Å; F43-F82 HydrophobicContact CD2-CE1 3.93Å; F43-F82 HydrophobicContact CE2-CE1 4.25Å; F43-F82 HydrophobicContact CG-CE1 4.42Å
44S93.2Very high92.7Very high48 Ų4859.1 Ų59.134%0.33631%0.31SS..PPolyproline II helixtrans-80.4165164.565.70000110.8S42 S46 D47 V48S42-S44 PolarHBondContact O-N 2.96Å; S44-S46 PolarHBondContact O-N 3.16Å; S44-S46 PolarHBondContact OG-OG 3.39Å; S44-D47 WeakPolarHBondContact CB-OD2 3.46Å; S44-D47 PolarHBondContact N-OD2 2.99Å; S44-D47 WeakPolarHBondContact O-CB 3.35Å; S44-D47 PolarHBondContact O-N 3.05Å; S44-D47 PolarHBondContact OG-N 3.45Å; S44-D47 PolarHBondContact OG-OD2 3.4Å; S44-V48 WeakPolarHBondContact O-CG2 3.42Å; S44-V48 PolarHBondContact O-N 3.25Å; S44-V48 VanDerWaalsContact O-N 3.11Å
45A94.8Very high92.8Very high56 Ų5653.2 Ų53.246%0.46329%0.288SS..Hα-helixtrans-60.6-32.917600000112.6V48 S49 V90 V94A45-V48 PolarHBondContact O-N 3.11Å; A45-S49 WeakPolarHBondContact O-CB 3.37Å; A45-S49 PolarHBondContact O-N 3.38Å; A45-V90 HydrophobicContact CB-CG1 4.3Å; A45-V94 HydrophobicContact CB-CG2 4.16Å
46S95.5Very high93Very high78 Ų7848.3 Ų48.355%0.54526%0.264SS..Hα-helixtrans-70.2-40.4176.451.70000112.2S44 V48 S49 I50S44-S46 PolarHBondContact O-N 3.16Å; S44-S46 PolarHBondContact OG-OG 3.39Å; S46-V48 VanDerWaalsContact C-N 3.3Å; S46-V48 PolarHBondContact O-N 3.45Å; S46-S49 PolarHBondContact O-N 3.49Å; S46-I50 WeakPolarHBondContact O-CG1 3.41Å; S46-I50 PolarHBondContact O-N 3.34Å; S46-I50 VanDerWaalsContact O-N 3.09Å
47D95.3Very high93.2Very high7 Ų752 Ų524%0.03728%0.279CS..Hα-helixtrans-57.3-47.2173-62.5-49.3000110.3E7 R36 F43 S44 S49 I50 L51E7-D47 HydrophobicContact CG-CB 3.98Å; R36-D47 IonicContact NH2-OD1 3.2Å; R36-D47 PolarHBondContact NH2-OD1 3.19Å; R36-D47 VanDerWaalsContact NH2-OD1 3.16Å; R36-D47 IonicContact NH2-OD2 2.98Å; R36-D47 PolarHBondContact NH2-OD2 3.19Å; F43-D47 HydrophobicContact CB-CB 4.46Å; F43-D47 HydrophobicContact CD1-CB 3.81Å; S44-D47 WeakPolarHBondContact CB-OD2 3.46Å; S44-D47 PolarHBondContact N-OD2 2.99Å; S44-D47 WeakPolarHBondContact O-CB 3.35Å; S44-D47 PolarHBondContact O-N 3.05Å; S44-D47 PolarHBondContact OG-N 3.45Å; S44-D47 PolarHBondContact OG-OD2 3.4Å; D47-S49 PolarHBondContact O-N 2.99Å; D47-I50 PolarHBondContact O-N 2.98Å; D47-L51 PolarHBondContact O-N 3.04Å
48V96.6Very high93.4Very high1 Ų151.9 Ų51.91%0.00628%0.278CS..Hα-helixtrans-67.3-35.1179.8176.70000112.2F43 S44 A45 S46 I50 L51 W52 V90 F91 V94F43-V48 HydrophobicContact CB-CG2 3.69Å; F43-V48 HydrophobicContact CD1-CG2 4.31Å; F43-V48 HydrophobicContact CG-CG2 4.22Å; S44-V48 WeakPolarHBondContact O-CG2 3.42Å; S44-V48 PolarHBondContact O-N 3.25Å; S44-V48 VanDerWaalsContact O-N 3.11Å; A45-V48 PolarHBondContact O-N 3.11Å; S46-V48 VanDerWaalsContact C-N 3.3Å; S46-V48 PolarHBondContact O-N 3.45Å; V48-I50 VanDerWaalsContact C-N 3.34Å; V48-I50 PolarHBondContact O-N 3.39Å; V48-L51 PolarHBondContact O-N 2.98Å; V48-W52 PolarHBondContact O-N 3.17Å; V48-V90 HydrophobicContact CB-CG1 4.32Å; V48-V90 HydrophobicContact CG2-CG1 3.95Å; V48-F91 HydrophobicContact CG1-CD2 3.77Å; V48-V94 HydrophobicContact CB-CG2 4.24Å; V48-V94 HydrophobicContact CG1-CB 3.83Å; V48-V94 HydrophobicContact CG1-CG1 4.04Å; V48-V94 HydrophobicContact CG1-CG2 4.03Å
49S97.3Very high93.8Very high20 Ų2046.7 Ų46.714%0.1425%0.251CS..Hα-helixtrans-64.8-36.8175.5170.80000111.9A45 S46 D47 W52 R53 E98A45-S49 WeakPolarHBondContact O-CB 3.37Å; A45-S49 PolarHBondContact O-N 3.38Å; S46-S49 PolarHBondContact O-N 3.49Å; D47-S49 PolarHBondContact O-N 2.99Å; S49-W52 PolarHBondContact O-N 3.46Å; S49-R53 WeakPolarHBondContact O-CG 3.21Å; S49-R53 PolarHBondContact O-N 3.31Å; S49-R53 VanDerWaalsContact O-N 3.09Å; S49-E98 PolarHBondContact OG-OE1 3.28Å
50I96.9Very high94.4Very high26 Ų2647.3 Ų47.313%0.13324%0.238CC..Hα-helixtrans-61-46.1172.2-64.2160.9000110.6E7 A11 S46 D47 V48 R53 G54E7-I50 HydrophobicContact CB-CB 4.02Å; E7-I50 HydrophobicContact CB-CD1 4.38Å; E7-I50 HydrophobicContact CB-CG2 3.79Å; A11-I50 HydrophobicContact CB-CG2 3.83Å; A11-I50 WeakPolarHBondContact CB-O 3.44Å; S46-I50 WeakPolarHBondContact O-CG1 3.41Å; S46-I50 PolarHBondContact O-N 3.34Å; S46-I50 VanDerWaalsContact O-N 3.09Å; D47-I50 PolarHBondContact O-N 2.98Å; V48-I50 VanDerWaalsContact C-N 3.34Å; V48-I50 PolarHBondContact O-N 3.39Å; I50-R53 VanDerWaalsContact CG1-NH2 3.31Å; I50-R53 PolarHBondContact O-N 2.97Å; I50-G54 PolarHBondContact O-N 2.85Å
51L97.3Very high95.1Very high1 Ų139 Ų391%0.00521%0.205CC..Hα-helixtrans-62.1-46.3178.3-65.4179.1000112E7 F10 L29 F43 D47 V48 R53 G54 L55E7-L51 HydrophobicContact CB-CD2 4.01Å; E7-L51 HydrophobicContact CB-CG 4.26Å; E7-L51 HydrophobicContact CG-CD1 4.31Å; E7-L51 HydrophobicContact CG-CD2 3.99Å; E7-L51 HydrophobicContact CG-CG 3.91Å; F10-L51 HydrophobicContact CB-CD2 3.96Å; L29-L51 HydrophobicContact CD1-CD1 4.09Å; L29-L51 HydrophobicContact CD1-CD2 3.62Å; L29-L51 HydrophobicContact CD1-CG 4.44Å; F43-L51 HydrophobicContact CD1-CD1 4.35Å; F43-L51 HydrophobicContact CE1-CD1 3.77Å; F43-L51 HydrophobicContact CZ-CD1 4.38Å; D47-L51 PolarHBondContact O-N 3.04Å; V48-L51 PolarHBondContact O-N 2.98Å; L51-R53 VanDerWaalsContact C-N 3.3Å; L51-R53 PolarHBondContact O-N 3.42Å; L51-G54 WeakPolarHBondContact O-CA 3.27Å; L51-G54 PolarHBondContact O-N 3.22Å; L51-L55 WeakPolarHBondContact O-CG 3.3Å; L51-L55 PolarHBondContact O-N 2.98Å
52W97.8Very high95.7Very high6 Ų633.5 Ų33.52%0.02318%0.181CC..Hα-helixtrans-59.9-37.8178.4-90.7118000113V48 S49 G54 L55 Y56 I75 F91 V94 F95 E98 F121V48-W52 PolarHBondContact O-N 3.17Å; S49-W52 PolarHBondContact O-N 3.46Å; W52-G54 VanDerWaalsContact C-N 3.31Å; W52-G54 PolarHBondContact O-N 3.42Å; W52-L55 HydrophobicContact CD2-CD1 4.2Å; W52-L55 HydrophobicContact CE3-CB 4.08Å; W52-L55 HydrophobicContact CE3-CD1 3.89Å; W52-L55 HydrophobicContact CZ3-CB 4.39Å; W52-L55 HydrophobicContact CZ3-CD1 4.08Å; W52-L55 PolarHBondContact O-N 3Å; W52-Y56 VanDerWaalsContact O-CB 3.29Å; W52-Y56 WeakPolarHBondContact O-CB 3.3Å; W52-Y56 PolarHBondContact O-N 3.34Å; W52-I75 HydrophobicContact CH2-CG2 3.72Å; W52-I75 HydrophobicContact CZ3-CG2 3.61Å; W52-F91 HydrophobicContact CD2-CE2 4.22Å; W52-F91 AromaticContact CE2-CD2 3.84Å; W52-F91 AromaticContact CE2-CE2 3.38Å; W52-F91 AromaticContact CE2-CZ 3.63Å; W52-F91 HydrophobicContact CH2-CE1 4.15Å; W52-F91 HydrophobicContact CH2-CE2 4.38Å; W52-F91 AromaticContact CH2-CZ 3.79Å; W52-F91 HydrophobicContact CH2-CZ 3.79Å; W52-F91 HydrophobicContact CZ2-CD1 4.03Å; W52-F91 HydrophobicContact CZ2-CD2 4.04Å; W52-F91 AromaticContact CZ2-CE1 3.5Å; W52-F91 HydrophobicContact CZ2-CE1 3.5Å; W52-F91 AromaticContact CZ2-CE2 3.48Å; W52-F91 HydrophobicContact CZ2-CE2 3.48Å; W52-F91 VanDerWaalsContact CZ2-CE2 3.48Å; W52-F91 HydrophobicContact CZ2-CG 4.28Å; W52-F91 AromaticContact CZ2-CZ 3.18Å; W52-F91 HydrophobicContact CZ2-CZ 3.18Å; W52-F91 AromaticContact NE1-CD2 3.36Å; W52-F91 AromaticContact NE1-CE2 3.36Å; W52-F91 PolarHBondContact NE1-O 3.33Å; W52-V94 HydrophobicContact CB-CG1 4.45Å; W52-V94 VanDerWaalsContact CD1-CG1 3.5Å; W52-V94 HydrophobicContact CG-CG1 4.27Å; W52-F95 HydrophobicContact CD2-CB 4.45Å; W52-F95 HydrophobicContact CD2-CD2 4.49Å; W52-F95 HydrophobicContact CE3-CD2 4.15Å; W52-F95 HydrophobicContact CH2-CB 4.12Å; W52-F95 AromaticContact CH2-CD2 3.39Å; W52-F95 HydrophobicContact CH2-CD2 3.39Å; W52-F95 HydrophobicContact CH2-CE2 4.19Å; W52-F95 HydrophobicContact CH2-CG 4.12Å; W52-F95 HydrophobicContact CZ2-CB 3.55Å; W52-F95 AromaticContact CZ2-CD2 3.76Å; W52-F95 HydrophobicContact CZ2-CD2 3.76Å; W52-F95 HydrophobicContact CZ2-CG 4.05Å; W52-F95 AromaticContact CZ3-CD2 3.6Å; W52-F95 HydrophobicContact CZ3-CD2 3.6Å; W52-F95 HydrophobicContact CZ3-CE2 4.23Å; W52-E98 HydrophobicContact CB-CB 4.26Å; W52-E98 HydrophobicContact CB-CG 3.81Å; W52-F121 AromaticContact CH2-CD2 3.85Å; W52-F121 HydrophobicContact CH2-CD2 3.85Å; W52-F121 AromaticContact CH2-CE2 3.52Å; W52-F121 HydrophobicContact CH2-CE2 3.52Å; W52-F121 HydrophobicContact CH2-CZ 4.03Å; W52-F121 HydrophobicContact CZ2-CD2 4.27Å; W52-F121 HydrophobicContact CZ2-CE1 4.44Å; W52-F121 AromaticContact CZ2-CE2 3.5Å; W52-F121 HydrophobicContact CZ2-CE2 3.5Å; W52-F121 AromaticContact CZ2-CZ 3.59Å; W52-F121 HydrophobicContact CZ2-CZ 3.59Å
53R96.6Very high96.2Very high117 Ų11735.8 Ų35.844%0.44219%0.188SC..Hα-helixtrans-61.1-40.4172.8-72.3-176.8-68.7167.4-3.1112S49 I50 L51 Y56 Y57 E98S49-R53 WeakPolarHBondContact O-CG 3.21Å; S49-R53 PolarHBondContact O-N 3.31Å; S49-R53 VanDerWaalsContact O-N 3.09Å; I50-R53 VanDerWaalsContact CG1-NH2 3.31Å; I50-R53 PolarHBondContact O-N 2.97Å; L51-R53 VanDerWaalsContact C-N 3.3Å; L51-R53 PolarHBondContact O-N 3.42Å; R53-Y56 PolarHBondContact O-N 3.39Å; R53-Y57 WeakPolarHBondContact O-CD2 3.15Å; R53-Y57 PolarHBondContact O-N 2.89Å; R53-Y57 VanDerWaalsContact O-N 3.12Å; R53-E98 WeakPolarHBondContact CG-OE2 3.21Å
54G97.3Very high96.3Very high2 Ų238.5 Ų38.52%0.02120%0.203CC..Hα-helixtrans-61.3-47.4172.200000113.1L14 I50 L51 W52 Y56 Y57 S58L14-G54 WeakPolarHBondContact CB-O 3.39Å; I50-G54 PolarHBondContact O-N 2.85Å; L51-G54 WeakPolarHBondContact O-CA 3.27Å; L51-G54 PolarHBondContact O-N 3.22Å; W52-G54 VanDerWaalsContact C-N 3.31Å; W52-G54 PolarHBondContact O-N 3.42Å; G54-Y56 VanDerWaalsContact C-N 3.34Å; G54-Y56 PolarHBondContact O-N 3.36Å; G54-Y57 PolarHBondContact O-N 3.49Å; G54-S58 PolarHBondContact O-N 3.25Å
55L98Very high96.4Very high1 Ų140 Ų401%0.00521%0.211CC..Hα-helixtrans-63.1-40.7178.3-63.1170.8000111.7L14 F26 L29 L51 W52 Y57 S58 M59 I75 L78 F91L14-L55 HydrophobicContact CD1-CD2 3.96Å; L14-L55 HydrophobicContact CD1-CG 4.36Å; L14-L55 HydrophobicContact CD2-CD2 4.46Å; F26-L55 HydrophobicContact CD2-CD2 4.12Å; F26-L55 HydrophobicContact CE2-CD2 3.87Å; L29-L55 HydrophobicContact CD2-CD2 3.98Å; L51-L55 WeakPolarHBondContact O-CG 3.3Å; L51-L55 PolarHBondContact O-N 2.98Å; W52-L55 HydrophobicContact CD2-CD1 4.2Å; W52-L55 HydrophobicContact CE3-CB 4.08Å; W52-L55 HydrophobicContact CE3-CD1 3.89Å; W52-L55 HydrophobicContact CZ3-CB 4.39Å; W52-L55 HydrophobicContact CZ3-CD1 4.08Å; W52-L55 PolarHBondContact O-N 3Å; L55-Y57 PolarHBondContact O-N 2.9Å; L55-S58 WeakPolarHBondContact O-CB 3.37Å; L55-S58 PolarHBondContact O-N 2.56Å; L55-M59 PolarHBondContact O-N 3.12Å; L55-I75 HydrophobicContact CB-CD1 4.44Å; L55-I75 HydrophobicContact CD1-CG2 4.4Å; L55-I75 HydrophobicContact CD2-CG1 4.23Å; L55-L78 HydrophobicContact CD1-CD1 3.86Å; L55-L78 HydrophobicContact CD2-CD1 3.85Å; L55-F91 HydrophobicContact CD1-CE2 4.29Å; L55-F91 HydrophobicContact CD1-CZ 4.21Å
56Y97.2Very high96.5Very high12 Ų1242.3 Ų42.35%0.04722%0.219CC..Hα-helixtrans-56.7-49.8174.6175.3-87.2000111W52 R53 G54 M59 W60 Q102 L106 Y114W52-Y56 VanDerWaalsContact O-CB 3.29Å; W52-Y56 WeakPolarHBondContact O-CB 3.3Å; W52-Y56 PolarHBondContact O-N 3.34Å; R53-Y56 PolarHBondContact O-N 3.39Å; G54-Y56 VanDerWaalsContact C-N 3.34Å; G54-Y56 PolarHBondContact O-N 3.36Å; Y56-M59 WeakPolarHBondContact O-CB 3.48Å; Y56-M59 PolarHBondContact O-N 3.41Å; Y56-W60 AromaticContact CE1-CE3 3.84Å; Y56-W60 HydrophobicContact CE1-CE3 3.84Å; Y56-W60 HydrophobicContact CE1-CZ3 4.4Å; Y56-W60 AromaticContact CZ-CE3 3.97Å; Y56-W60 PolarHBondContact O-N 3.41Å; Y56-W60 WeakPolarHBondContact OH-CZ3 3.44Å; Y56-Q102 HydrophobicContact CD2-CB 4.26Å; Y56-Q102 HydrophobicContact CD2-CG 4.24Å; Y56-Q102 HydrophobicContact CE1-CG 4.4Å; Y56-Q102 HydrophobicContact CE2-CB 3.52Å; Y56-Q102 HydrophobicContact CE2-CG 3.91Å; Y56-L106 HydrophobicContact CE2-CD2 4.24Å; Y56-L106 WeakPolarHBondContact OH-CD2 3.28Å; Y56-Y114 HydrophobicContact CD2-CD1 4.13Å; Y56-Y114 AromaticContact CD2-CE1 3.31Å; Y56-Y114 HydrophobicContact CD2-CE1 3.31Å; Y56-Y114 AromaticContact CD2-CZ 3.83Å; Y56-Y114 HydrophobicContact CE2-CD1 4.02Å; Y56-Y114 AromaticContact CE2-CE1 3.35Å; Y56-Y114 HydrophobicContact CE2-CE1 3.35Å; Y56-Y114 HydrophobicContact CE2-CE2 4.35Å; Y56-Y114 AromaticContact CE2-CZ 3.53Å; Y56-Y114 HydrophobicContact CG-CE1 4.07Å; Y56-Y114 AromaticContact CZ-CZ 3.82Å; Y56-Y114 PolarHBondContact O-OH 2.81Å
57Y96.4Very high96.6Very high108 Ų10843.4 Ų43.442%0.42422%0.215SC..Hα-helixtrans-72.5-28.6178.2-74.9-63.7000113.4A15 R53 G54 L55 M59 W60 L61A15-Y57 HydrophobicContact CB-CD2 4.46Å; A15-Y57 HydrophobicContact CB-CG 4.31Å; R53-Y57 WeakPolarHBondContact O-CD2 3.15Å; R53-Y57 PolarHBondContact O-N 2.89Å; R53-Y57 VanDerWaalsContact O-N 3.12Å; G54-Y57 PolarHBondContact O-N 3.49Å; L55-Y57 PolarHBondContact O-N 2.9Å; Y57-M59 VanDerWaalsContact C-N 3.26Å; Y57-M59 PolarHBondContact O-N 2.63Å; Y57-W60 HydrophobicContact CD1-CB 4.16Å; Y57-W60 HydrophobicContact CD1-CG 4.28Å; Y57-W60 WeakPolarHBondContact O-CB 3.39Å; Y57-W60 PolarHBondContact O-N 3.14Å; Y57-L61 WeakPolarHBondContact O-CB 3.36Å; Y57-L61 WeakPolarHBondContact O-CG 3.28Å; Y57-L61 PolarHBondContact O-N 2.9Å
58S97.3Very high96.7Very high4 Ų444.5 Ų44.53%0.02822%0.219CC..Hα-helixtrans-60.2-40.4169.9-176.80000111.2L14 G54 L55 L71L14-S58 WeakPolarHBondContact O-CA 3.29Å; L14-S58 WeakPolarHBondContact O-CB 3.48Å; G54-S58 PolarHBondContact O-N 3.25Å; L55-S58 WeakPolarHBondContact O-CB 3.37Å; L55-S58 PolarHBondContact O-N 2.56Å; S58-L71 WeakPolarHBondContact O-CD2 3.43Å
59M97.3Very high96.7Very high0 Ų048.8 Ų48.80%024%0.239CC..Hα-helixtrans-69.1-42.1173.4-163.368.6-169.300111.7L55 Y56 Y57 L61 Q62 Q68 L71 A72 K113 Y114 M116L55-M59 PolarHBondContact O-N 3.12Å; Y56-M59 WeakPolarHBondContact O-CB 3.48Å; Y56-M59 PolarHBondContact O-N 3.41Å; Y57-M59 VanDerWaalsContact C-N 3.26Å; Y57-M59 PolarHBondContact O-N 2.63Å; M59-L61 VanDerWaalsContact C-N 3.26Å; M59-L61 PolarHBondContact O-N 3.14Å; M59-Q62 PolarHBondContact O-N 2.68Å; M59-Q62 VanDerWaalsContact O-N 3.13Å; M59-Q68 HydrophobicContact CE-CB 3.69Å; M59-Q68 HydrophobicContact CE-CG 4.21Å; M59-Q68 WeakPolarHBondContact CE-O 3.35Å; M59-L71 HydrophobicContact SD-CB 4.29Å; M59-L71 HydrophobicContact SD-CD2 3.8Å; M59-L71 HydrophobicContact SD-CG 3.97Å; M59-A72 HydrophobicContact CE-CB 4.38Å; M59-K113 HydrophobicContact CE-CB 3.53Å; M59-K113 HydrophobicContact CE-CD 4.17Å; M59-K113 HydrophobicContact CE-CG 3.83Å; M59-K113 WeakPolarHBondContact CE-O 3.31Å; M59-K113 HydrophobicContact CG-CD 4.34Å; M59-K113 HydrophobicContact CG-CG 4.18Å; M59-K113 WeakPolarHBondContact O-CE 3.45Å; M59-K113 PolarHBondContact O-NZ 3.24Å; M59-Y114 HydrophobicContact CB-CE1 4.03Å; M59-Y114 HydrophobicContact CG-CE1 4.13Å; M59-M116 HydrophobicContact CE-CE 4.07Å
60W96.4Very high96.7Very high60 Ų6052.2 Ų52.223%0.22726%0.256CS..Hα-helixtrans-53.4-43.8178-175.7-81.1000112.2Y56 Y57 L106 K113 Y114Y56-W60 AromaticContact CE1-CE3 3.84Å; Y56-W60 HydrophobicContact CE1-CE3 3.84Å; Y56-W60 HydrophobicContact CE1-CZ3 4.4Å; Y56-W60 AromaticContact CZ-CE3 3.97Å; Y56-W60 PolarHBondContact O-N 3.41Å; Y56-W60 WeakPolarHBondContact OH-CZ3 3.44Å; Y57-W60 HydrophobicContact CD1-CB 4.16Å; Y57-W60 HydrophobicContact CD1-CG 4.28Å; Y57-W60 WeakPolarHBondContact O-CB 3.39Å; Y57-W60 PolarHBondContact O-N 3.14Å; W60-L106 HydrophobicContact CE3-CD2 4.34Å; W60-L106 HydrophobicContact CZ3-CD2 4.02Å; W60-K113 PolarHBondContact O-NZ 2.84Å; W60-Y114 VanDerWaalsContact CA-OH 3.28Å; W60-Y114 WeakPolarHBondContact CA-OH 3.45Å; W60-Y114 VanDerWaalsContact CB-OH 3.29Å; W60-Y114 WeakPolarHBondContact CB-OH 3.14Å; W60-Y114 HydrophobicContact CE3-CE2 4.39Å; W60-Y114 PolarHBondContact N-OH 3.24Å; W60-Y114 VanDerWaalsContact N-OH 3.15Å
61L96.2Very high96.7Very high55 Ų5551.7 Ų51.729%0.28825%0.254SS..THydrogen-bonded Turntrans-86.42.1-176.1-64.8169.6000114.1A15 R22 Y57 M59A15-L61 WeakPolarHBondContact O-CD1 3.34Å; R22-L61 PolarHBondContact NH2-O 3.38Å; R22-L61 VanDerWaalsContact NH2-O 3.12Å; Y57-L61 WeakPolarHBondContact O-CB 3.36Å; Y57-L61 WeakPolarHBondContact O-CG 3.28Å; Y57-L61 PolarHBondContact O-N 2.9Å; M59-L61 VanDerWaalsContact C-N 3.26Å; M59-L61 PolarHBondContact O-N 3.14Å
62Q96.2Very high96.8Very high20 Ų2051.7 Ų51.79%0.09325%0.253CS..  trans-95.6112.8174.4-173.359.6-109.300110M59 K67 Q68 L71 K113M59-Q62 PolarHBondContact O-N 2.68Å; M59-Q62 VanDerWaalsContact O-N 3.13Å; Q62-K67 VanDerWaalsContact CD-CB 3.4Å; Q62-K67 HydrophobicContact CG-CB 3.89Å; Q62-Q68 HydrophobicContact CB-CG 4.14Å; Q62-Q68 HydrophobicContact CG-CB 4.44Å; Q62-Q68 HydrophobicContact CG-CG 3.73Å; Q62-Q68 VanDerWaalsContact O-CG 3.32Å; Q62-Q68 WeakPolarHBondContact O-CG 3.35Å; Q62-Q68 PolarHBondContact O-NE2 3.34Å; Q62-L71 HydrophobicContact CB-CD2 4.02Å; Q62-L71 HydrophobicContact CG-CD2 4.45Å; Q62-K113 PolarHBondContact O-NZ 3.22Å
63D94.4Very high96.8Very high117 Ų11753.9 Ų53.963%0.62627%0.266SS*.  trans-103.2-21.6-174.6-61-37.3000113.5P65 Q68D63-P65 WeakPolarHBondContact O-CD 3.41Å; D63-Q68 PolarHBondContact O-NE2 3.39Å
64N94.8Very high96.8Very high70 Ų7051.7 Ų51.737%0.37426%0.261SS..SBendtrans-80.9121.7178.9178.2-84.4000110.7V66 K67 Q68N64-V66 PolarHBondContact O-N 3.07Å; N64-V66 PolarHBondContact OD1-N 3.02Å; N64-K67 HydrophobicContact CB-CB 4.16Å; N64-K67 HydrophobicContact CB-CD 3.98Å; N64-K67 HydrophobicContact CB-CG 4.18Å; N64-K67 CarbonylContact O-C 3.58Å; N64-K67 WeakPolarHBondContact O-CB 3.49Å; N64-K67 PolarHBondContact O-N 3.31Å; N64-K67 WeakPolarHBondContact OD1-CG 3.48Å; N64-K67 PolarHBondContact OD1-N 3.25Å; N64-Q68 WeakPolarHBondContact O-CG 3.34Å; N64-Q68 PolarHBondContact O-N 3.5Å
65P95.5Very high96.9Very high79 Ų7951.6 Ų51.651%0.51326%0.26SS..Hα-helixtrans-55.1-48-173.3-29.736.4000114.8D63 K67 Q68 E69D63-P65 WeakPolarHBondContact O-CD 3.41Å; P65-K67 PolarHBondContact O-N 3.3Å; P65-Q68 WeakPolarHBondContact O-CA 3.48Å; P65-Q68 VanDerWaalsContact O-CB 3.28Å; P65-Q68 WeakPolarHBondContact O-CB 3.17Å; P65-Q68 PolarHBondContact O-N 2.99Å; P65-E69 PolarHBondContact O-N 2.9Å
66V96.6Very high96.9Very high104 Ų10451.6 Ų51.663%0.6326%0.259SS*.Hα-helixtrans-60.4-36.8178.7179.70000111.5N64 N70N64-V66 PolarHBondContact O-N 3.07Å; N64-V66 PolarHBondContact OD1-N 3.02Å; V66-N70 PolarHBondContact O-N 3.01Å
67K96.7Very high96.9Very high102 Ų10254.3 Ų54.344%0.44328%0.275SS..Hα-helixtrans-74.9-26.6175.9-65.2178.4-169.7164.40112.6Q62 N64 P65 L71Q62-K67 VanDerWaalsContact CD-CB 3.4Å; Q62-K67 HydrophobicContact CG-CB 3.89Å; N64-K67 HydrophobicContact CB-CB 4.16Å; N64-K67 HydrophobicContact CB-CD 3.98Å; N64-K67 HydrophobicContact CB-CG 4.18Å; N64-K67 CarbonylContact O-C 3.58Å; N64-K67 WeakPolarHBondContact O-CB 3.49Å; N64-K67 PolarHBondContact O-N 3.31Å; N64-K67 WeakPolarHBondContact OD1-CG 3.48Å; N64-K67 PolarHBondContact OD1-N 3.25Å; P65-K67 PolarHBondContact O-N 3.3Å; K67-L71 WeakPolarHBondContact O-CB 3.4Å; K67-L71 PolarHBondContact O-N 3.34Å
68Q97.2Very high96.9Very high30 Ų3049.2 Ų49.214%0.1426%0.255CS..Hα-helixtrans-66.4-46.8173.3-68.3168.71.300110.2M59 Q62 D63 N64 P65 N70 L71 A72 K113 M116M59-Q68 HydrophobicContact CE-CB 3.69Å; M59-Q68 HydrophobicContact CE-CG 4.21Å; M59-Q68 WeakPolarHBondContact CE-O 3.35Å; Q62-Q68 HydrophobicContact CB-CG 4.14Å; Q62-Q68 HydrophobicContact CG-CB 4.44Å; Q62-Q68 HydrophobicContact CG-CG 3.73Å; Q62-Q68 VanDerWaalsContact O-CG 3.32Å; Q62-Q68 WeakPolarHBondContact O-CG 3.35Å; Q62-Q68 PolarHBondContact O-NE2 3.34Å; D63-Q68 PolarHBondContact O-NE2 3.39Å; N64-Q68 WeakPolarHBondContact O-CG 3.34Å; N64-Q68 PolarHBondContact O-N 3.5Å; P65-Q68 WeakPolarHBondContact O-CA 3.48Å; P65-Q68 VanDerWaalsContact O-CB 3.28Å; P65-Q68 WeakPolarHBondContact O-CB 3.17Å; P65-Q68 PolarHBondContact O-N 2.99Å; Q68-N70 PolarHBondContact O-N 2.79Å; Q68-L71 PolarHBondContact O-N 3.05Å; Q68-A72 WeakPolarHBondContact O-CB 3.25Å; Q68-A72 PolarHBondContact O-N 3.16Å; Q68-K113 HydrophobicContact CB-CB 4.36Å; Q68-K113 HydrophobicContact CG-CB 4.32Å; Q68-K113 HydrophobicContact CG-CD 4.1Å; Q68-M116 VanDerWaalsContact C-CE 3.48Å; Q68-M116 HydrophobicContact CB-CE 3.77Å
69E97.3Very high96.9Very high90 Ų9049.6 Ų49.642%0.42126%0.256SS..Hα-helixtrans-55.3-54.1175.8-77170.8-154.500111.1P65 L71 A72 D73 M116P65-E69 PolarHBondContact O-N 2.9Å; E69-L71 VanDerWaalsContact C-N 3.29Å; E69-L71 PolarHBondContact O-N 3.37Å; E69-A72 WeakPolarHBondContact O-CB 3.43Å; E69-A72 PolarHBondContact O-N 3.28Å; E69-A72 VanDerWaalsContact O-N 3.08Å; E69-D73 PolarHBondContact O-N 3.39Å; E69-M116 HydrophobicContact CB-CE 4.31Å; E69-M116 HydrophobicContact CB-SD 4.12Å; E69-M116 HydrophobicContact CG-CE 3.85Å; E69-M116 HydrophobicContact CG-SD 3.29Å; E69-M116 WeakPolarHBondContact CG-SD 3.28Å
70N97.3Very high96.8Very high93 Ų9351.9 Ų51.950%0.49728%0.28SS..Hα-helixtrans-61.1-38.4-179.7-169-64.3000112.2V66 Q68 Q74V66-N70 PolarHBondContact O-N 3.01Å; Q68-N70 PolarHBondContact O-N 2.79Å; N70-Q74 WeakPolarHBondContact O-CB 3.38Å; N70-Q74 VanDerWaalsContact O-CG 3.31Å; N70-Q74 WeakPolarHBondContact O-CG 3.43Å; N70-Q74 PolarHBondContact O-N 3.21Å; N70-Q74 PolarHBondContact OD1-NE2 3.16Å
71L97.7Very high96.8Very high15 Ų1549.3 Ų49.38%0.07927%0.272CS..Hα-helixtrans-67.1-39.9175.7179.559.6000111.7S58 M59 Q62 K67 Q68 E69 Q74 I75S58-L71 WeakPolarHBondContact O-CD2 3.43Å; M59-L71 HydrophobicContact SD-CB 4.29Å; M59-L71 HydrophobicContact SD-CD2 3.8Å; M59-L71 HydrophobicContact SD-CG 3.97Å; Q62-L71 HydrophobicContact CB-CD2 4.02Å; Q62-L71 HydrophobicContact CG-CD2 4.45Å; K67-L71 WeakPolarHBondContact O-CB 3.4Å; K67-L71 PolarHBondContact O-N 3.34Å; Q68-L71 PolarHBondContact O-N 3.05Å; E69-L71 VanDerWaalsContact C-N 3.29Å; E69-L71 PolarHBondContact O-N 3.37Å; L71-Q74 PolarHBondContact O-N 3.14Å; L71-I75 HydrophobicContact CD1-CD1 4.01Å; L71-I75 HydrophobicContact CD1-CG1 4.1Å; L71-I75 HydrophobicContact CG-CD1 3.85Å; L71-I75 HydrophobicContact CG-CG1 4.37Å; L71-I75 WeakPolarHBondContact O-CB 3.38Å; L71-I75 WeakPolarHBondContact O-CG1 3.4Å; L71-I75 PolarHBondContact O-N 2.73Å
72A98.3Very high96.8Very high0 Ų046.9 Ų46.90%026%0.259CS..Hα-helixtrans-62.1-44.3176.200000111.5M59 Q68 E69 I75 A76 M116 L117 R120M59-A72 HydrophobicContact CE-CB 4.38Å; Q68-A72 WeakPolarHBondContact O-CB 3.25Å; Q68-A72 PolarHBondContact O-N 3.16Å; E69-A72 WeakPolarHBondContact O-CB 3.43Å; E69-A72 PolarHBondContact O-N 3.28Å; E69-A72 VanDerWaalsContact O-N 3.08Å; A72-I75 PolarHBondContact O-N 3.48Å; A72-A76 WeakPolarHBondContact O-CB 3.17Å; A72-A76 PolarHBondContact O-N 2.94Å; A72-M116 HydrophobicContact CB-CE 4.35Å; A72-L117 HydrophobicContact CB-CB 4.46Å; A72-L117 HydrophobicContact CB-CD1 4.15Å; A72-R120 HydrophobicContact CB-CB 4.37Å; A72-R120 HydrophobicContact CB-CG 4.07Å
73D97.7Very high96.6Very high53 Ų5352.7 Ų52.728%0.28328%0.284SS..Hα-helixtrans-60.8-47.3174.6-68.6-33.6000111.4E69 I75 A76 D77 R120E69-D73 PolarHBondContact O-N 3.39Å; D73-I75 PolarHBondContact O-N 2.92Å; D73-A76 PolarHBondContact O-N 2.87Å; D73-D77 WeakPolarHBondContact O-CB 3.41Å; D73-D77 PolarHBondContact O-N 3.07Å; D73-R120 WeakPolarHBondContact OD1-CD 3.46Å; D73-R120 WeakPolarHBondContact OD1-CG 3.33Å; D73-R120 IonicContact OD1-NE 3.63Å; D73-R120 PolarHBondContact OD1-NE 3.05Å; D73-R120 VanDerWaalsContact OD1-NE 3.08Å
74Q97.6Very high96.6Very high71 Ų7149.4 Ų49.433%0.33227%0.27SS..Hα-helixtrans-57.8-46.7176.5-80.2-176.565.400112.2F26 N70 L71 D77 L78F26-Q74 VanDerWaalsContact CD1-OE1 3.31Å; F26-Q74 HydrophobicContact CE1-CB 3.71Å; F26-Q74 HydrophobicContact CE1-CG 4.27Å; F26-Q74 HydrophobicContact CE2-CB 4.45Å; F26-Q74 HydrophobicContact CZ-CB 3.64Å; F26-Q74 WeakPolarHBondContact CZ-O 3.21Å; N70-Q74 WeakPolarHBondContact O-CB 3.38Å; N70-Q74 VanDerWaalsContact O-CG 3.31Å; N70-Q74 WeakPolarHBondContact O-CG 3.43Å; N70-Q74 PolarHBondContact O-N 3.21Å; N70-Q74 PolarHBondContact OD1-NE2 3.16Å; L71-Q74 PolarHBondContact O-N 3.14Å; Q74-D77 PolarHBondContact O-N 3.49Å; Q74-L78 PolarHBondContact O-N 3.43Å
75I98.5Very high96.5Very high0 Ų048 Ų480%027%0.268CS..Hα-helixtrans-61.5-45.3178.4-70.7169.6000110.2F26 W52 L55 L71 A72 D73 D77 L78 L117F26-I75 HydrophobicContact CE2-CG1 3.93Å; W52-I75 HydrophobicContact CH2-CG2 3.72Å; W52-I75 HydrophobicContact CZ3-CG2 3.61Å; L55-I75 HydrophobicContact CB-CD1 4.44Å; L55-I75 HydrophobicContact CD1-CG2 4.4Å; L55-I75 HydrophobicContact CD2-CG1 4.23Å; L71-I75 HydrophobicContact CD1-CD1 4.01Å; L71-I75 HydrophobicContact CD1-CG1 4.1Å; L71-I75 HydrophobicContact CG-CD1 3.85Å; L71-I75 HydrophobicContact CG-CG1 4.37Å; L71-I75 WeakPolarHBondContact O-CB 3.38Å; L71-I75 WeakPolarHBondContact O-CG1 3.4Å; L71-I75 PolarHBondContact O-N 2.73Å; A72-I75 PolarHBondContact O-N 3.48Å; D73-I75 PolarHBondContact O-N 2.92Å; I75-D77 VanDerWaalsContact C-N 3.35Å; I75-D77 PolarHBondContact O-N 3.26Å; I75-L78 VanDerWaalsContact O-CB 3.28Å; I75-L78 WeakPolarHBondContact O-CB 3.34Å; I75-L78 PolarHBondContact O-N 3.04Å; I75-L117 HydrophobicContact CB-CD1 4.03Å; I75-L117 HydrophobicContact CD1-CD1 4.32Å; I75-L117 HydrophobicContact CG2-CD1 3.79Å
76A98.1Very high96.3Very high0 Ų053.9 Ų53.90%028%0.28CS..Hα-helixtrans-61.1-43.5178.400000111.9A72 D73 L78 I79 R120 F121 A124A72-A76 WeakPolarHBondContact O-CB 3.17Å; A72-A76 PolarHBondContact O-N 2.94Å; D73-A76 PolarHBondContact O-N 2.87Å; A76-L78 PolarHBondContact O-N 3.2Å; A76-L78 VanDerWaalsContact O-N 3.12Å; A76-I79 VanDerWaalsContact O-CG2 3.3Å; A76-I79 WeakPolarHBondContact O-CG2 3.45Å; A76-I79 PolarHBondContact O-N 3.35Å; A76-I79 VanDerWaalsContact O-N 3.16Å; A76-R120 HydrophobicContact CB-CB 4.17Å; A76-R120 WeakPolarHBondContact CB-O 3.42Å; A76-F121 HydrophobicContact CB-CD2 4.33Å; A76-A124 HydrophobicContact CB-CB 3.88Å
77D97Very high96.3Very high69 Ų6950.1 Ų50.137%0.36926%0.255SS..Hα-helixtrans-67.1-11.2178.5-74-10.2000114D73 Q74 I75 I79 G80 R127D73-D77 WeakPolarHBondContact O-CB 3.41Å; D73-D77 PolarHBondContact O-N 3.07Å; Q74-D77 PolarHBondContact O-N 3.49Å; I75-D77 VanDerWaalsContact C-N 3.35Å; I75-D77 PolarHBondContact O-N 3.26Å; D77-I79 PolarHBondContact O-N 3.33Å; D77-G80 PolarHBondContact O-N 2.97Å; D77-G80 VanDerWaalsContact O-N 3.13Å; D77-R127 IonicContact OD1-NH1 3.84Å; D77-R127 PolarHBondContact OD1-NH1 3.31Å
78L97.7Very high96.2Very high1 Ų146.8 Ų46.81%0.00524%0.241CC..G310 helixtrans-61.8-23.1171.2-71.4176.3000112.4F26 L29 K30 I33 L55 Q74 I75 A76 G80 A81 F82 F91F26-L78 HydrophobicContact CE1-CD2 4.31Å; F26-L78 HydrophobicContact CE2-CD1 3.75Å; F26-L78 HydrophobicContact CE2-CG 4.23Å; F26-L78 HydrophobicContact CZ-CD1 3.8Å; F26-L78 HydrophobicContact CZ-CD2 3.89Å; F26-L78 HydrophobicContact CZ-CG 3.74Å; L29-L78 HydrophobicContact CD2-CD1 4.18Å; K30-L78 HydrophobicContact CB-CD2 4.02Å; K30-L78 HydrophobicContact CG-CD2 4.17Å; I33-L78 HydrophobicContact CD1-CD2 4.29Å; L55-L78 HydrophobicContact CD1-CD1 3.86Å; L55-L78 HydrophobicContact CD2-CD1 3.85Å; Q74-L78 PolarHBondContact O-N 3.43Å; I75-L78 VanDerWaalsContact O-CB 3.28Å; I75-L78 WeakPolarHBondContact O-CB 3.34Å; I75-L78 PolarHBondContact O-N 3.04Å; A76-L78 PolarHBondContact O-N 3.2Å; A76-L78 VanDerWaalsContact O-N 3.12Å; L78-G80 PolarHBondContact O-N 3.39Å; L78-A81 VanDerWaalsContact O-CB 3.27Å; L78-A81 WeakPolarHBondContact O-CB 3.28Å; L78-A81 PolarHBondContact O-N 3.38Å; L78-F82 WeakPolarHBondContact O-CD2 3.35Å; L78-F91 HydrophobicContact CB-CE1 4.02Å; L78-F91 HydrophobicContact CB-CZ 3.92Å; L78-F91 HydrophobicContact CD1-CZ 4.4Å
79I97Very high96.2Very high12 Ų1245.9 Ų45.96%0.06224%0.237CC..G310 helixtrans-55.2-35.3174.1-160170.5000111.4A76 D77 A81 F82 K88 F91 V92 A124 L128A76-I79 VanDerWaalsContact O-CG2 3.3Å; A76-I79 WeakPolarHBondContact O-CG2 3.45Å; A76-I79 PolarHBondContact O-N 3.35Å; A76-I79 VanDerWaalsContact O-N 3.16Å; D77-I79 PolarHBondContact O-N 3.33Å; I79-A81 PolarHBondContact O-N 3.28Å; I79-F82 PolarHBondContact O-N 2.97Å; I79-K88 HydrophobicContact CG1-CB 4.09Å; I79-K88 HydrophobicContact CG1-CG 4.24Å; I79-K88 WeakPolarHBondContact O-CG 3.15Å; I79-F91 HydrophobicContact CB-CD1 4.25Å; I79-F91 HydrophobicContact CG1-CD1 4.37Å; I79-V92 HydrophobicContact CD1-CG2 3.57Å; I79-A124 HydrophobicContact CG2-CB 4.07Å; I79-L128 HydrophobicContact CD1-CB 4.34Å; I79-L128 HydrophobicContact CD1-CD2 3.73Å; I79-L128 HydrophobicContact CG1-CD2 4.38Å
80G95.2Very high96.2Very high49 Ų4943.3 Ų43.351%0.50523%0.228SC..G310 helixtrans-73.6-9177.500000114.5D77 L78D77-G80 PolarHBondContact O-N 2.97Å; D77-G80 VanDerWaalsContact O-N 3.13Å; L78-G80 PolarHBondContact O-N 3.39Å
81A95.7Very high96.2Very high5 Ų539 Ų394%0.04120%0.204CC..G310 helixtrans-81.4-20.517500000112.9K30 I33 R34 L78 I79K30-A81 HydrophobicContact CG-CB 4.35Å; I33-A81 HydrophobicContact CB-CB 4.13Å; I33-A81 HydrophobicContact CG2-CB 3.74Å; R34-A81 HydrophobicContact CG-CB 4.11Å; R34-A81 WeakPolarHBondContact CG-O 3.26Å; L78-A81 VanDerWaalsContact O-CB 3.27Å; L78-A81 WeakPolarHBondContact O-CB 3.28Å; L78-A81 PolarHBondContact O-N 3.38Å; I79-A81 PolarHBondContact O-N 3.28Å
82F95.9Very high96.2Very high5 Ų538.2 Ų38.22%0.02220%0.2CC..SBendtrans-80.5139.6175.9-64-91.1000110.8I33 F43 L78 I79 Q87 K88 F91I33-F82 HydrophobicContact CD1-CE2 4.33Å; I33-F82 HydrophobicContact CD1-CZ 4.21Å; I33-F82 HydrophobicContact CG2-CD1 3.86Å; I33-F82 HydrophobicContact CG2-CD2 4.06Å; I33-F82 HydrophobicContact CG2-CE1 3.83Å; I33-F82 HydrophobicContact CG2-CE2 4.01Å; I33-F82 HydrophobicContact CG2-CG 3.99Å; I33-F82 HydrophobicContact CG2-CZ 3.9Å; F43-F82 HydrophobicContact CD2-CD1 4.38Å; F43-F82 AromaticContact CD2-CE1 3.93Å; F43-F82 HydrophobicContact CD2-CE1 3.93Å; F43-F82 HydrophobicContact CE2-CE1 4.25Å; F43-F82 HydrophobicContact CG-CE1 4.42Å; L78-F82 WeakPolarHBondContact O-CD2 3.35Å; I79-F82 PolarHBondContact O-N 2.97Å; F82-Q87 HydrophobicContact CB-CB 3.95Å; F82-Q87 HydrophobicContact CD1-CB 3.98Å; F82-Q87 HydrophobicContact CG-CB 4.38Å; F82-K88 HydrophobicContact CB-CG 3.75Å; F82-K88 WeakPolarHBondContact O-CE 3.31Å; F82-F91 HydrophobicContact CD2-CB 4.17Å; F82-F91 HydrophobicContact CD2-CD1 4.33Å; F82-F91 HydrophobicContact CD2-CG 4.16Å; F82-F91 HydrophobicContact CE1-CB 4.5Å; F82-F91 HydrophobicContact CE2-CB 3.72Å; F82-F91 AromaticContact CE2-CD1 3.75Å; F82-F91 HydrophobicContact CE2-CD1 3.75Å; F82-F91 AromaticContact CE2-CD2 3.5Å; F82-F91 HydrophobicContact CE2-CD2 3.5Å; F82-F91 VanDerWaalsContact CE2-CD2 3.5Å; F82-F91 HydrophobicContact CE2-CE1 4.17Å; F82-F91 AromaticContact CE2-CE2 3.99Å; F82-F91 HydrophobicContact CE2-CE2 3.99Å; F82-F91 AromaticContact CE2-CG 3.38Å; F82-F91 HydrophobicContact CE2-CG 3.38Å; F82-F91 HydrophobicContact CE2-CZ 4.29Å; F82-F91 HydrophobicContact CZ-CB 3.9Å; F82-F91 AromaticContact CZ-CD2 3.48Å; F82-F91 HydrophobicContact CZ-CD2 3.48Å; F82-F91 VanDerWaalsContact CZ-CD2 3.48Å; F82-F91 HydrophobicContact CZ-CE2 4.1Å; F82-F91 AromaticContact CZ-CG 3.74Å; F82-F91 HydrophobicContact CZ-CG 3.74Å
83K93.5Very high96.1Very high141 Ų14143.5 Ų43.561%0.61322%0.223SC*.  trans-77.5-56-170.6-176.6-176.6-172.1165.90112.4C37 N38C37-K83 HydrophobicContact CB-CB 3.95Å; N38-K83 WeakPolarHBondContact OD1-CD 3.2Å; N38-K83 PolarHBondContact OD1-NZ 3.44Å
84S93Very high96.1Very high49 Ų4941.4 Ų41.434%0.34321%0.212SC..SBendtrans-98.5154.5-173.571.30000112.5R86 Q87 K88S84-R86 PolarHBondContact O-N 2.94Å; S84-Q87 VanDerWaalsContact N-OE1 3.14Å; S84-Q87 WeakPolarHBondContact O-CB 3.05Å; S84-Q87 PolarHBondContact O-N 3.28Å; S84-Q87 WeakPolarHBondContact OG-CG 3.48Å; S84-Q87 PolarHBondContact OG-N 3.19Å; S84-K88 WeakPolarHBondContact O-CG 3.34Å; S84-K88 PolarHBondContact O-N 2.96Å
85A92.9Very high96.2Very high40 Ų4038 Ų3833%0.33120%0.197SC..Hα-helixtrans-53-41.4174.300000112.1Q87 K88 L89 L138A85-Q87 VanDerWaalsContact C-N 3.35Å; A85-Q87 PolarHBondContact O-N 3.39Å; A85-K88 PolarHBondContact O-N 3.3Å; A85-L89 WeakPolarHBondContact O-CB 3.49Å; A85-L89 VanDerWaalsContact O-CG 3.31Å; A85-L89 WeakPolarHBondContact O-CG 3.33Å; A85-L89 PolarHBondContact O-N 2.96Å; A85-L138 HydrophobicContact CB-CD1 4.24Å
86R92.9Very high96.1Very high202 Ų20238.2 Ų38.276%0.76220%0.198SC*.Hα-helixtrans-58.7-42.6175.6-177.5176.9175.5170.70.2112.6S84 L89 V90S84-R86 PolarHBondContact O-N 2.94Å; R86-L89 PolarHBondContact O-N 3.23Å; R86-V90 WeakPolarHBondContact O-CG2 3.39Å; R86-V90 PolarHBondContact O-N 3.16Å; R86-V90 VanDerWaalsContact O-N 3.11Å
87Q94.7Very high96Very high25 Ų2540 Ų4012%0.11721%0.209CC..Hα-helixtrans-67.9-42.5178.6-71.3168-14.200111.3C37 F82 S84 A85 L89 V90 F91C37-Q87 PolarHBondContact SG-OE1 2.67Å; F82-Q87 HydrophobicContact CB-CB 3.95Å; F82-Q87 HydrophobicContact CD1-CB 3.98Å; F82-Q87 HydrophobicContact CG-CB 4.38Å; S84-Q87 VanDerWaalsContact N-OE1 3.14Å; S84-Q87 WeakPolarHBondContact O-CB 3.05Å; S84-Q87 PolarHBondContact O-N 3.28Å; S84-Q87 WeakPolarHBondContact OG-CG 3.48Å; S84-Q87 PolarHBondContact OG-N 3.19Å; A85-Q87 VanDerWaalsContact C-N 3.35Å; A85-Q87 PolarHBondContact O-N 3.39Å; Q87-L89 VanDerWaalsContact C-N 3.33Å; Q87-L89 PolarHBondContact O-N 2.97Å; Q87-V90 PolarHBondContact O-N 3.29Å; Q87-F91 PolarHBondContact O-N 2.94Å; Q87-F91 VanDerWaalsContact O-N 3.14Å
88K96.4Very high96Very high32 Ų3237.2 Ų37.214%0.13919%0.193CC..Hα-helixtrans-58.8-44.1174.1-64.8-179.2-178.6-176.80111.4I79 F82 S84 A85 V90 F91 V92 L128I79-K88 HydrophobicContact CG1-CB 4.09Å; I79-K88 HydrophobicContact CG1-CG 4.24Å; I79-K88 WeakPolarHBondContact O-CG 3.15Å; F82-K88 HydrophobicContact CB-CG 3.75Å; F82-K88 WeakPolarHBondContact O-CE 3.31Å; S84-K88 WeakPolarHBondContact O-CG 3.34Å; S84-K88 PolarHBondContact O-N 2.96Å; A85-K88 PolarHBondContact O-N 3.3Å; K88-V90 VanDerWaalsContact C-N 3.35Å; K88-V90 PolarHBondContact O-N 3.21Å; K88-F91 WeakPolarHBondContact O-CA 3.29Å; K88-F91 WeakPolarHBondContact O-CB 3.39Å; K88-F91 PolarHBondContact O-N 3.18Å; K88-F91 VanDerWaalsContact O-N 3.09Å; K88-V92 WeakPolarHBondContact O-CG2 3.37Å; K88-V92 PolarHBondContact O-N 3.08Å; K88-L128 HydrophobicContact CB-CD2 3.91Å; K88-L128 HydrophobicContact CD-CD1 3.38Å; K88-L128 HydrophobicContact CD-CD2 4.04Å; K88-L128 HydrophobicContact CD-CG 4.36Å
89L96.1Very high95.9Very high12 Ų1237.6 Ų37.66%0.06320%0.195CC..Hα-helixtrans-63-36.2176.9-74.7170.4000113.4A85 R86 Q87 F91 V92 K93 L138 Q141 V142 I145A85-L89 WeakPolarHBondContact O-CB 3.49Å; A85-L89 VanDerWaalsContact O-CG 3.31Å; A85-L89 WeakPolarHBondContact O-CG 3.33Å; A85-L89 PolarHBondContact O-N 2.96Å; R86-L89 PolarHBondContact O-N 3.23Å; Q87-L89 VanDerWaalsContact C-N 3.33Å; Q87-L89 PolarHBondContact O-N 2.97Å; L89-F91 VanDerWaalsContact C-N 3.32Å; L89-V92 PolarHBondContact O-N 3.36Å; L89-K93 WeakPolarHBondContact O-CB 3.23Å; L89-K93 PolarHBondContact O-N 3.27Å; L89-L138 HydrophobicContact CD1-CD1 3.8Å; L89-L138 HydrophobicContact CD2-CD1 3.9Å; L89-L138 HydrophobicContact CG-CD1 3.88Å; L89-Q141 HydrophobicContact CD1-CB 3.66Å; L89-Q141 HydrophobicContact CD1-CG 4.19Å; L89-Q141 HydrophobicContact CD2-CB 4.12Å; L89-V142 HydrophobicContact CD2-CG2 3.65Å; L89-I145 HydrophobicContact CD2-CD1 4.03Å
90V96.5Very high95.9Very high36 Ų3637.2 Ų37.222%0.21819%0.194CC..Hα-helixtrans-62.9-42.8172.2174.90000110.2A45 V48 R86 Q87 K88 V92 K93 V94A45-V90 HydrophobicContact CB-CG1 4.3Å; V48-V90 HydrophobicContact CB-CG1 4.32Å; V48-V90 HydrophobicContact CG2-CG1 3.95Å; R86-V90 WeakPolarHBondContact O-CG2 3.39Å; R86-V90 PolarHBondContact O-N 3.16Å; R86-V90 VanDerWaalsContact O-N 3.11Å; Q87-V90 PolarHBondContact O-N 3.29Å; K88-V90 VanDerWaalsContact C-N 3.35Å; K88-V90 PolarHBondContact O-N 3.21Å; V90-V92 PolarHBondContact O-N 2.99Å; V90-K93 PolarHBondContact O-N 2.97Å; V90-V94 HydrophobicContact CG1-CG2 4.34Å; V90-V94 VanDerWaalsContact O-CG2 3.24Å; V90-V94 WeakPolarHBondContact O-CG2 3.5Å; V90-V94 PolarHBondContact O-N 2.98Å
91F97.7Very high95.8Very high1 Ų140.4 Ų40.40%0.00419%0.194CC..Hα-helixtrans-59.8-45175.8-168.7-119.1000112.6V48 W52 L55 L78 I79 F82 Q87 K88 L89 F95 F121V48-F91 HydrophobicContact CG1-CD2 3.77Å; W52-F91 HydrophobicContact CD2-CE2 4.22Å; W52-F91 AromaticContact CE2-CD2 3.84Å; W52-F91 AromaticContact CE2-CE2 3.38Å; W52-F91 AromaticContact CE2-CZ 3.63Å; W52-F91 HydrophobicContact CH2-CE1 4.15Å; W52-F91 HydrophobicContact CH2-CE2 4.38Å; W52-F91 AromaticContact CH2-CZ 3.79Å; W52-F91 HydrophobicContact CH2-CZ 3.79Å; W52-F91 HydrophobicContact CZ2-CD1 4.03Å; W52-F91 HydrophobicContact CZ2-CD2 4.04Å; W52-F91 AromaticContact CZ2-CE1 3.5Å; W52-F91 HydrophobicContact CZ2-CE1 3.5Å; W52-F91 AromaticContact CZ2-CE2 3.48Å; W52-F91 HydrophobicContact CZ2-CE2 3.48Å; W52-F91 VanDerWaalsContact CZ2-CE2 3.48Å; W52-F91 HydrophobicContact CZ2-CG 4.28Å; W52-F91 AromaticContact CZ2-CZ 3.18Å; W52-F91 HydrophobicContact CZ2-CZ 3.18Å; W52-F91 AromaticContact NE1-CD2 3.36Å; W52-F91 AromaticContact NE1-CE2 3.36Å; W52-F91 PolarHBondContact NE1-O 3.33Å; L55-F91 HydrophobicContact CD1-CE2 4.29Å; L55-F91 HydrophobicContact CD1-CZ 4.21Å; L78-F91 HydrophobicContact CB-CE1 4.02Å; L78-F91 HydrophobicContact CB-CZ 3.92Å; L78-F91 HydrophobicContact CD1-CZ 4.4Å; I79-F91 HydrophobicContact CB-CD1 4.25Å; I79-F91 HydrophobicContact CG1-CD1 4.37Å; F82-F91 HydrophobicContact CD2-CB 4.17Å; F82-F91 HydrophobicContact CD2-CD1 4.33Å; F82-F91 HydrophobicContact CD2-CG 4.16Å; F82-F91 HydrophobicContact CE1-CB 4.5Å; F82-F91 HydrophobicContact CE2-CB 3.72Å; F82-F91 AromaticContact CE2-CD1 3.75Å; F82-F91 HydrophobicContact CE2-CD1 3.75Å; F82-F91 AromaticContact CE2-CD2 3.5Å; F82-F91 HydrophobicContact CE2-CD2 3.5Å; F82-F91 VanDerWaalsContact CE2-CD2 3.5Å; F82-F91 HydrophobicContact CE2-CE1 4.17Å; F82-F91 AromaticContact CE2-CE2 3.99Å; F82-F91 HydrophobicContact CE2-CE2 3.99Å; F82-F91 AromaticContact CE2-CG 3.38Å; F82-F91 HydrophobicContact CE2-CG 3.38Å; F82-F91 HydrophobicContact CE2-CZ 4.29Å; F82-F91 HydrophobicContact CZ-CB 3.9Å; F82-F91 AromaticContact CZ-CD2 3.48Å; F82-F91 HydrophobicContact CZ-CD2 3.48Å; F82-F91 VanDerWaalsContact CZ-CD2 3.48Å; F82-F91 HydrophobicContact CZ-CE2 4.1Å; F82-F91 AromaticContact CZ-CG 3.74Å; F82-F91 HydrophobicContact CZ-CG 3.74Å; Q87-F91 PolarHBondContact O-N 2.94Å; Q87-F91 VanDerWaalsContact O-N 3.14Å; K88-F91 WeakPolarHBondContact O-CA 3.29Å; K88-F91 WeakPolarHBondContact O-CB 3.39Å; K88-F91 PolarHBondContact O-N 3.18Å; K88-F91 VanDerWaalsContact O-N 3.09Å; L89-F91 VanDerWaalsContact C-N 3.32Å; F91-F95 PolarHBondContact O-N 3.22Å; F91-F95 VanDerWaalsContact O-N 3.09Å; F91-F121 HydrophobicContact CD1-CE2 4.01Å; F91-F121 AromaticContact CD1-CZ 3.9Å; F91-F121 HydrophobicContact CD1-CZ 3.9Å; F91-F121 AromaticContact CE1-CE2 3.63Å; F91-F121 HydrophobicContact CE1-CE2 3.63Å; F91-F121 AromaticContact CE1-CZ 3.99Å; F91-F121 HydrophobicContact CE1-CZ 3.99Å; F91-F121 HydrophobicContact CZ-CE2 4.47Å
92V98Very high95.7Very high0 Ų042 Ų420%020%0.2CC..Hα-helixtrans-63.9-48.6176.4173.60000112I79 K88 L89 V90 V94 F95 F96 F121 I125 I145I79-V92 HydrophobicContact CD1-CG2 3.57Å; K88-V92 WeakPolarHBondContact O-CG2 3.37Å; K88-V92 PolarHBondContact O-N 3.08Å; L89-V92 PolarHBondContact O-N 3.36Å; V90-V92 PolarHBondContact O-N 2.99Å; V92-V94 VanDerWaalsContact C-N 3.31Å; V92-V94 PolarHBondContact O-N 2.7Å; V92-F95 WeakPolarHBondContact O-CB 3.34Å; V92-F95 PolarHBondContact O-N 2.9Å; V92-F96 HydrophobicContact CG1-CD2 4.34Å; V92-F96 HydrophobicContact CG1-CE2 4.08Å; V92-F96 WeakPolarHBondContact O-CD2 3.45Å; V92-F96 PolarHBondContact O-N 2.7Å; V92-F121 HydrophobicContact CB-CE1 4.45Å; V92-F121 HydrophobicContact CG1-CE1 4.49Å; V92-F121 HydrophobicContact CG2-CE1 4.2Å; V92-F121 HydrophobicContact CG2-CZ 4.25Å; V92-I125 HydrophobicContact CG1-CD1 3.61Å; V92-I125 HydrophobicContact CG1-CG1 4.07Å; V92-I125 HydrophobicContact CG2-CD1 4.3Å; V92-I125 HydrophobicContact CG2-CG1 3.87Å; V92-I145 HydrophobicContact CB-CD1 4.41Å; V92-I145 HydrophobicContact CG1-CD1 4.03Å
93K97.3Very high95.7Very high110 Ų11042.4 Ų42.448%0.47820%0.202SC..Hα-helixtrans-58.9-44.3-179.6-178.9-178.1176.5-175.20111.7L89 V90 T97 I145L89-K93 WeakPolarHBondContact O-CB 3.23Å; L89-K93 PolarHBondContact O-N 3.27Å; V90-K93 PolarHBondContact O-N 2.97Å; K93-T97 PolarHBondContact O-N 3.14Å; K93-T97 PolarHBondContact O-OG1 3.22Å; K93-I145 HydrophobicContact CB-CD1 4.03Å; K93-I145 HydrophobicContact CB-CG1 4.33Å
94V97.7Very high95.6Very high9 Ų944.1 Ų44.16%0.05521%0.206CC..Hα-helixtrans-71.3-32-177.9179.50000111.4A45 V48 W52 V90 V92 F96 T97 E98A45-V94 HydrophobicContact CB-CG2 4.16Å; V48-V94 HydrophobicContact CB-CG2 4.24Å; V48-V94 HydrophobicContact CG1-CB 3.83Å; V48-V94 HydrophobicContact CG1-CG1 4.04Å; V48-V94 HydrophobicContact CG1-CG2 4.03Å; W52-V94 HydrophobicContact CB-CG1 4.45Å; W52-V94 VanDerWaalsContact CD1-CG1 3.5Å; W52-V94 HydrophobicContact CG-CG1 4.27Å; V90-V94 HydrophobicContact CG1-CG2 4.34Å; V90-V94 VanDerWaalsContact O-CG2 3.24Å; V90-V94 WeakPolarHBondContact O-CG2 3.5Å; V90-V94 PolarHBondContact O-N 2.98Å; V92-V94 VanDerWaalsContact C-N 3.31Å; V92-V94 PolarHBondContact O-N 2.7Å; V94-F96 PolarHBondContact O-N 3.1Å; V94-T97 WeakPolarHBondContact O-CB 3.32Å; V94-T97 PolarHBondContact O-N 3.45Å; V94-E98 HydrophobicContact CG1-CG 3.87Å; V94-E98 WeakPolarHBondContact O-CG 3.49Å; V94-E98 PolarHBondContact O-N 2.94Å
95F98.1Very high95.6Very high1 Ų146.6 Ų46.60%0.00422%0.215CC..Hα-helixtrans-52.3-56.1172.4168.9-103.5000111.8W52 F91 V92 T97 E98 I99 L117 M118 F121W52-F95 HydrophobicContact CD2-CB 4.45Å; W52-F95 HydrophobicContact CD2-CD2 4.49Å; W52-F95 HydrophobicContact CE3-CD2 4.15Å; W52-F95 HydrophobicContact CH2-CB 4.12Å; W52-F95 AromaticContact CH2-CD2 3.39Å; W52-F95 HydrophobicContact CH2-CD2 3.39Å; W52-F95 HydrophobicContact CH2-CE2 4.19Å; W52-F95 HydrophobicContact CH2-CG 4.12Å; W52-F95 HydrophobicContact CZ2-CB 3.55Å; W52-F95 AromaticContact CZ2-CD2 3.76Å; W52-F95 HydrophobicContact CZ2-CD2 3.76Å; W52-F95 HydrophobicContact CZ2-CG 4.05Å; W52-F95 AromaticContact CZ3-CD2 3.6Å; W52-F95 HydrophobicContact CZ3-CD2 3.6Å; W52-F95 HydrophobicContact CZ3-CE2 4.23Å; F91-F95 PolarHBondContact O-N 3.22Å; F91-F95 VanDerWaalsContact O-N 3.09Å; V92-F95 WeakPolarHBondContact O-CB 3.34Å; V92-F95 PolarHBondContact O-N 2.9Å; F95-T97 VanDerWaalsContact C-N 3.28Å; F95-T97 PolarHBondContact O-N 3.47Å; F95-E98 PolarHBondContact O-N 3Å; F95-I99 HydrophobicContact CD2-CG1 3.93Å; F95-I99 HydrophobicContact CE1-CG1 4.32Å; F95-I99 HydrophobicContact CE2-CD1 4.02Å; F95-I99 HydrophobicContact CE2-CG1 3.5Å; F95-I99 HydrophobicContact CZ-CD1 4.42Å; F95-I99 HydrophobicContact CZ-CG1 3.72Å; F95-I99 WeakPolarHBondContact O-CG1 3.45Å; F95-I99 PolarHBondContact O-N 3.46Å; F95-L117 HydrophobicContact CE2-CD2 4.35Å; F95-L117 HydrophobicContact CE2-CG 4.22Å; F95-M118 HydrophobicContact CE1-CG 4.43Å; F95-M118 HydrophobicContact CZ-CB 4.32Å; F95-M118 HydrophobicContact CZ-CG 4.43Å; F95-F121 HydrophobicContact CB-CD1 4.05Å; F95-F121 HydrophobicContact CB-CE1 3.45Å; F95-F121 VanDerWaalsContact CB-CE1 3.45Å; F95-F121 HydrophobicContact CB-CZ 3.81Å; F95-F121 AromaticContact CD1-CD1 3.2Å; F95-F121 HydrophobicContact CD1-CD1 3.2Å; F95-F121 AromaticContact CD1-CE1 3.48Å; F95-F121 HydrophobicContact CD1-CE1 3.48Å; F95-F121 VanDerWaalsContact CD1-CE1 3.48Å; F95-F121 HydrophobicContact CD1-CG 4.05Å; F95-F121 AromaticContact CD2-CD1 3.94Å; F95-F121 HydrophobicContact CD2-CD1 3.94Å; F95-F121 HydrophobicContact CD2-CD2 4.41Å; F95-F121 HydrophobicContact CD2-CE1 4.14Å; F95-F121 HydrophobicContact CD2-CG 4.08Å; F95-F121 HydrophobicContact CD2-CZ 4.49Å; F95-F121 HydrophobicContact CE1-CB 4.15Å; F95-F121 AromaticContact CE1-CD1 3.52Å; F95-F121 HydrophobicContact CE1-CD1 3.52Å; F95-F121 HydrophobicContact CE1-CE1 4.26Å; F95-F121 HydrophobicContact CE1-CG 4.06Å; F95-F121 HydrophobicContact CE2-CB 4.19Å; F95-F121 HydrophobicContact CE2-CD1 4.19Å; F95-F121 HydrophobicContact CE2-CG 4.07Å; F95-F121 AromaticContact CG-CD1 3.43Å; F95-F121 HydrophobicContact CG-CD1 3.43Å; F95-F121 VanDerWaalsContact CG-CD1 3.43Å; F95-F121 AromaticContact CG-CE1 3.4Å; F95-F121 HydrophobicContact CG-CE1 3.4Å; F95-F121 VanDerWaalsContact CG-CE1 3.4Å; F95-F121 HydrophobicContact CG-CG 4.05Å; F95-F121 HydrophobicContact CG-CZ 4.02Å; F95-F121 HydrophobicContact CZ-CB 3.91Å; F95-F121 AromaticContact CZ-CD1 3.99Å; F95-F121 HydrophobicContact CZ-CD1 3.99Å; F95-F121 HydrophobicContact CZ-CG 4.06Å
96F97.4Very high95.7Very high4 Ų445.6 Ų45.62%0.01820%0.204CC..Hα-helixtrans-60.6-42.2180-74.9-80.4000111.2V92 V94 E98 I99 G100 I125 I145 F146 T149 V150 Y158 F166V92-F96 HydrophobicContact CG1-CD2 4.34Å; V92-F96 HydrophobicContact CG1-CE2 4.08Å; V92-F96 WeakPolarHBondContact O-CD2 3.45Å; V92-F96 PolarHBondContact O-N 2.7Å; V94-F96 PolarHBondContact O-N 3.1Å; F96-E98 VanDerWaalsContact C-N 3.35Å; F96-E98 PolarHBondContact O-N 2.83Å; F96-I99 PolarHBondContact O-N 3.01Å; F96-G100 PolarHBondContact O-N 3.31Å; F96-I125 HydrophobicContact CE2-CD1 3.94Å; F96-I125 HydrophobicContact CZ-CD1 4.33Å; F96-I145 HydrophobicContact CD2-CG2 3.91Å; F96-I145 HydrophobicContact CE2-CG2 4.43Å; F96-F146 HydrophobicContact CE2-CD1 4.03Å; F96-F146 AromaticContact CE2-CE1 3.58Å; F96-F146 HydrophobicContact CE2-CE1 3.58Å; F96-F146 AromaticContact CZ-CD1 3.89Å; F96-F146 HydrophobicContact CZ-CD1 3.89Å; F96-F146 AromaticContact CZ-CE1 3.5Å; F96-F146 HydrophobicContact CZ-CE1 3.5Å; F96-F146 VanDerWaalsContact CZ-CE1 3.5Å; F96-T149 HydrophobicContact CB-CG2 3.85Å; F96-T149 HydrophobicContact CG-CG2 4.43Å; F96-V150 HydrophobicContact CD1-CG1 3.78Å; F96-V150 HydrophobicContact CE1-CG1 3.63Å; F96-Y158 HydrophobicContact CB-CE1 4.3Å; F96-Y158 VanDerWaalsContact O-CE1 3.31Å; F96-Y158 WeakPolarHBondContact O-CE1 3.47Å; F96-F166 HydrophobicContact CE1-CD2 4.2Å; F96-F166 HydrophobicContact CE1-CE2 4.07Å; F96-F166 AromaticContact CZ-CE2 3.94Å; F96-F166 HydrophobicContact CZ-CE2 3.94Å
97T95.8Very high95.7Very high38 Ų3838.3 Ų38.323%0.23318%0.18CC..Hα-helixtrans-59.1-44.3178.4-55.70000111.9K93 V94 F95 K101K93-T97 PolarHBondContact O-N 3.14Å; K93-T97 PolarHBondContact O-OG1 3.22Å; V94-T97 WeakPolarHBondContact O-CB 3.32Å; V94-T97 PolarHBondContact O-N 3.45Å; F95-T97 VanDerWaalsContact C-N 3.28Å; F95-T97 PolarHBondContact O-N 3.47Å; T97-K101 VanDerWaalsContact O-CG 3.3Å; T97-K101 WeakPolarHBondContact O-CG 3.39Å; T97-K101 PolarHBondContact O-N 2.97Å
98E96.1Very high95.6Very high10 Ų1044.4 Ų44.45%0.04721%0.207CC..Hα-helixtrans-75.2-39-178.7-66.8-58.8132.900112.2S49 W52 R53 V94 F95 F96 K101 Q102S49-E98 PolarHBondContact OG-OE1 3.28Å; W52-E98 HydrophobicContact CB-CB 4.26Å; W52-E98 HydrophobicContact CB-CG 3.81Å; R53-E98 WeakPolarHBondContact CG-OE2 3.21Å; V94-E98 HydrophobicContact CG1-CG 3.87Å; V94-E98 WeakPolarHBondContact O-CG 3.49Å; V94-E98 PolarHBondContact O-N 2.94Å; F95-E98 PolarHBondContact O-N 3Å; F96-E98 VanDerWaalsContact C-N 3.35Å; F96-E98 PolarHBondContact O-N 2.83Å; E98-K101 PolarHBondContact O-N 3.37Å; E98-K101 IonicContact OE1-NZ 3.62Å; E98-K101 PolarHBondContact OE1-NZ 2.98Å; E98-Q102 WeakPolarHBondContact O-CG 3.42Å; E98-Q102 PolarHBondContact O-N 3.44Å
99I96.4Very high95.3Very high9 Ų952.7 Ų52.75%0.04624%0.237CC..Hα-helixtrans-63.7-43174.5-67.6-67.1000111F95 F96 K101 Q102 W103 Y114 M118 I162F95-I99 HydrophobicContact CD2-CG1 3.93Å; F95-I99 HydrophobicContact CE1-CG1 4.32Å; F95-I99 HydrophobicContact CE2-CD1 4.02Å; F95-I99 HydrophobicContact CE2-CG1 3.5Å; F95-I99 HydrophobicContact CZ-CD1 4.42Å; F95-I99 HydrophobicContact CZ-CG1 3.72Å; F95-I99 WeakPolarHBondContact O-CG1 3.45Å; F95-I99 PolarHBondContact O-N 3.46Å; F96-I99 PolarHBondContact O-N 3.01Å; I99-K101 PolarHBondContact O-N 2.79Å; I99-Q102 PolarHBondContact O-N 3.29Å; I99-W103 HydrophobicContact CG2-CE3 3.62Å; I99-W103 HydrophobicContact CG2-CZ3 3.86Å; I99-W103 WeakPolarHBondContact O-CB 3.33Å; I99-W103 PolarHBondContact O-N 3.35Å; I99-Y114 HydrophobicContact CD1-CD1 4.23Å; I99-M118 HydrophobicContact CG2-CE 3.61Å; I99-I162 HydrophobicContact CG2-CD1 3.9Å; I99-I162 HydrophobicContact CG2-CG1 4.47Å
100G95.9Very high95.3Very high3 Ų355.5 Ų55.53%0.03125%0.247CC..Hα-helixtrans-54.9-50.3175.400000112.9F96 Q102 W103 E157F96-G100 PolarHBondContact O-N 3.31Å; G100-Q102 VanDerWaalsContact C-N 3.29Å; G100-Q102 PolarHBondContact O-N 2.84Å; G100-W103 PolarHBondContact O-N 3.14Å; G100-E157 CarbonylContact C-O 3.41Å; G100-E157 WeakPolarHBondContact CA-O 3.36Å
101K94.3Very high95.2Very high116 Ų11655.5 Ų55.550%0.50425%0.245SC..Hα-helixtrans-60.4-33.8178.3-71.5170.5-172.2169.10114.2T97 E98 I99T97-K101 VanDerWaalsContact O-CG 3.3Å; T97-K101 WeakPolarHBondContact O-CG 3.39Å; T97-K101 PolarHBondContact O-N 2.97Å; E98-K101 PolarHBondContact O-N 3.37Å; E98-K101 IonicContact OE1-NZ 3.62Å; E98-K101 PolarHBondContact OE1-NZ 2.98Å; I99-K101 PolarHBondContact O-N 2.79Å
102Q93.8Very high95.1Very high39 Ų3961.2 Ų61.218%0.18228%0.275CS..Hα-helixtrans-97.1-9.7-172.1-61.2-55.7-25.500113.8Y56 E98 I99 G100 Y104 N105 L106Y56-Q102 HydrophobicContact CD2-CB 4.26Å; Y56-Q102 HydrophobicContact CD2-CG 4.24Å; Y56-Q102 HydrophobicContact CE1-CG 4.4Å; Y56-Q102 HydrophobicContact CE2-CB 3.52Å; Y56-Q102 HydrophobicContact CE2-CG 3.91Å; E98-Q102 WeakPolarHBondContact O-CG 3.42Å; E98-Q102 PolarHBondContact O-N 3.44Å; I99-Q102 PolarHBondContact O-N 3.29Å; G100-Q102 VanDerWaalsContact C-N 3.29Å; G100-Q102 PolarHBondContact O-N 2.84Å; Q102-Y104 PolarHBondContact O-N 3.44Å; Q102-N105 WeakPolarHBondContact O-CB 3.38Å; Q102-N105 PolarHBondContact O-N 3.14Å; Q102-N105 PolarHBondContact OE1-ND2 2.88Å; Q102-L106 PolarHBondContact O-N 3.14Å
103W94.5Very high95Very high14 Ų1461.5 Ų61.55%0.05328%0.277CS..G310 helixtrans-60.9-44.2-168.7-164.9-98.6000113.6I99 G100 N105 L106 M111 M115 M118 P159 I162I99-W103 HydrophobicContact CG2-CE3 3.62Å; I99-W103 HydrophobicContact CG2-CZ3 3.86Å; I99-W103 WeakPolarHBondContact O-CB 3.33Å; I99-W103 PolarHBondContact O-N 3.35Å; G100-W103 PolarHBondContact O-N 3.14Å; W103-N105 PolarHBondContact O-N 2.97Å; W103-L106 HydrophobicContact CD2-CD1 4.39Å; W103-L106 HydrophobicContact CE3-CD1 3.96Å; W103-L106 HydrophobicContact CZ3-CD1 4.4Å; W103-L106 WeakPolarHBondContact O-CB 3.3Å; W103-L106 PolarHBondContact O-N 3.17Å; W103-M111 HydrophobicContact CD2-CE 4.38Å; W103-M111 HydrophobicContact CH2-CE 4.15Å; W103-M111 HydrophobicContact CZ2-CE 3.55Å; W103-M115 HydrophobicContact CH2-CG 3.97Å; W103-M115 HydrophobicContact CZ2-CE 4.19Å; W103-M118 HydrophobicContact CH2-CE 4.32Å; W103-M118 HydrophobicContact CZ3-CE 3.96Å; W103-P159 HydrophobicContact CB-CG 3.97Å; W103-P159 HydrophobicContact CG-CB 4.33Å; W103-P159 HydrophobicContact CG-CG 4.28Å; W103-I162 HydrophobicContact CB-CD1 3.93Å; W103-I162 HydrophobicContact CB-CG1 4.24Å; W103-I162 HydrophobicContact CD2-CD1 3.81Å; W103-I162 HydrophobicContact CD2-CG1 3.22Å; W103-I162 VanDerWaalsContact CE2-CG1 3.46Å; W103-I162 HydrophobicContact CE3-CD1 3.91Å; W103-I162 HydrophobicContact CE3-CG1 3.49Å; W103-I162 VanDerWaalsContact CE3-CG1 3.49Å; W103-I162 HydrophobicContact CG-CD1 3.85Å; W103-I162 HydrophobicContact CG-CG1 3.59Å; W103-I162 HydrophobicContact CH2-CG1 4.1Å; W103-I162 HydrophobicContact CZ2-CG1 3.89Å; W103-I162 HydrophobicContact CZ3-CG1 3.92Å
104Y92.6Very high95Very high176 Ų17656.3 Ų56.369%0.6925%0.254SS*.G310 helixtrans-69.3-15.4176.5-66.6-55.2000113.9Q102 L106 P159Q102-Y104 PolarHBondContact O-N 3.44Å; Y104-L106 VanDerWaalsContact C-N 3.34Å; Y104-P159 HydrophobicContact CD1-CB 4.45Å; Y104-P159 HydrophobicContact CD1-CG 4.29Å; Y104-P159 HydrophobicContact CD2-CG 3.75Å; Y104-P159 HydrophobicContact CE1-CB 3.72Å; Y104-P159 HydrophobicContact CE1-CG 3.85Å; Y104-P159 HydrophobicContact CE2-CB 4Å; Y104-P159 HydrophobicContact CE2-CG 3.28Å; Y104-P159 HydrophobicContact CG-CG 4.24Å; Y104-P159 VanDerWaalsContact CZ-CB 3.46Å; Y104-P159 WeakPolarHBondContact OH-CB 3.48Å
105N92.4Very high95Very high102 Ų10258.4 Ų58.455%0.54526%0.264SS..G310 helixtrans-87.2-6.9177-59.3-32.8000112.6Q102 W103Q102-N105 WeakPolarHBondContact O-CB 3.38Å; Q102-N105 PolarHBondContact O-N 3.14Å; Q102-N105 PolarHBondContact OE1-ND2 2.88Å; W103-N105 PolarHBondContact O-N 2.97Å
106L94.1Very high95Very high19 Ų1960 Ų6010%0.09927%0.272CS..  trans-78.3124.7177.2-66.5174000110Y56 W60 Q102 W103 Y104 M111 Y114Y56-L106 HydrophobicContact CE2-CD2 4.24Å; Y56-L106 WeakPolarHBondContact OH-CD2 3.28Å; W60-L106 HydrophobicContact CE3-CD2 4.34Å; W60-L106 HydrophobicContact CZ3-CD2 4.02Å; Q102-L106 PolarHBondContact O-N 3.14Å; W103-L106 HydrophobicContact CD2-CD1 4.39Å; W103-L106 HydrophobicContact CE3-CD1 3.96Å; W103-L106 HydrophobicContact CZ3-CD1 4.4Å; W103-L106 WeakPolarHBondContact O-CB 3.3Å; W103-L106 PolarHBondContact O-N 3.17Å; Y104-L106 VanDerWaalsContact C-N 3.34Å; L106-M111 HydrophobicContact CB-CG 4.5Å; L106-M111 HydrophobicContact CB-SD 3.33Å; L106-M111 WeakPolarHBondContact CB-SD 3.3Å; L106-M111 HydrophobicContact CD1-SD 3.77Å; L106-M111 HydrophobicContact CG-SD 4.18Å; L106-Y114 HydrophobicContact CD1-CD2 3.9Å; L106-Y114 HydrophobicContact CD1-CG 3.97Å; L106-Y114 HydrophobicContact CD2-CD2 3.29Å; L106-Y114 HydrophobicContact CD2-CE2 3.27Å; L106-Y114 HydrophobicContact CD2-CG 4.05Å; L106-Y114 HydrophobicContact CG-CD2 4.26Å
107D93.6Very high95Very high48 Ų4859.9 Ų59.926%0.25727%0.271SS..  trans-78.4158.5167.268.496.7000111.1W109 R110 M111D107-W109 PolarHBondContact O-N 3.04Å; D107-W109 VanDerWaalsContact OD1-CB 3.27Å; D107-W109 WeakPolarHBondContact OD1-CB 3.33Å; D107-W109 VanDerWaalsContact OD1-CD1 3.28Å; D107-W109 PolarHBondContact OD1-N 3.18Å; D107-W109 VanDerWaalsContact OD1-N 3.09Å; D107-R110 PolarHBondContact O-N 3.11Å; D107-R110 IonicContact OD1-NH1 3.16Å; D107-R110 PolarHBondContact OD1-NH1 3.21Å; D107-R110 VanDerWaalsContact OD2-CD 3.26Å; D107-R110 WeakPolarHBondContact OD2-CD 3.31Å; D107-R110 WeakPolarHBondContact OD2-CG 3.38Å; D107-R110 IonicContact OD2-CZ 3.09Å; D107-R110 IonicContact OD2-NE 2.71Å; D107-R110 IonicContact OD2-NH1 2.84Å; D107-R110 PolarHBondContact OD2-NH1 3.48Å; D107-M111 PolarHBondContact O-N 3.46Å
108K92.9Very high95.1Very high154 Ų15458.1 Ų58.167%0.6726%0.261SS*.THydrogen-bonded Turntrans-52.9-31.1-176.668.9178.9-174.9176.10114.4R110K108-R110 VanDerWaalsContact C-N 3.27Å; K108-R110 PolarHBondContact O-N 3.22Å
109W91.1Very high95.2Very high206 Ų20660.3 Ų60.378%0.7827%0.268SS*.THydrogen-bonded Turntrans-77.7-15.2-177.2-49.8106.1000113D107D107-W109 PolarHBondContact O-N 3.04Å; D107-W109 VanDerWaalsContact OD1-CB 3.27Å; D107-W109 WeakPolarHBondContact OD1-CB 3.33Å; D107-W109 VanDerWaalsContact OD1-CD1 3.28Å; D107-W109 PolarHBondContact OD1-N 3.18Å; D107-W109 VanDerWaalsContact OD1-N 3.09Å
110R94.4Very high95.3Very high71 Ų7162 Ų6227%0.26827%0.274SS..THydrogen-bonded Turntrans-104.8-12.3179.3-66.5-176173.9774.7112.8D107 K108 D112 K113 Y114D107-R110 PolarHBondContact O-N 3.11Å; D107-R110 IonicContact OD1-NH1 3.16Å; D107-R110 PolarHBondContact OD1-NH1 3.21Å; D107-R110 VanDerWaalsContact OD2-CD 3.26Å; D107-R110 WeakPolarHBondContact OD2-CD 3.31Å; D107-R110 WeakPolarHBondContact OD2-CG 3.38Å; D107-R110 IonicContact OD2-CZ 3.09Å; D107-R110 IonicContact OD2-NE 2.71Å; D107-R110 IonicContact OD2-NH1 2.84Å; D107-R110 PolarHBondContact OD2-NH1 3.48Å; K108-R110 VanDerWaalsContact C-N 3.27Å; K108-R110 PolarHBondContact O-N 3.22Å; R110-D112 PolarHBondContact O-N 3.47Å; R110-K113 WeakPolarHBondContact O-CG 3.42Å; R110-K113 PolarHBondContact O-N 3.42Å; R110-Y114 HydrophobicContact CB-CE2 4.35Å; R110-Y114 VanDerWaalsContact O-CD2 3.3Å; R110-Y114 WeakPolarHBondContact O-CD2 3.41Å
111M95Very high95.4Very high35 Ų3561.8 Ų61.817%0.17227%0.272CS..Hα-helixtrans-55.7-49.6-174.1-72.5-60.7-65.600113.1W103 L106 D107 K113 Y114 M115W103-M111 HydrophobicContact CD2-CE 4.38Å; W103-M111 HydrophobicContact CH2-CE 4.15Å; W103-M111 HydrophobicContact CZ2-CE 3.55Å; L106-M111 HydrophobicContact CB-CG 4.5Å; L106-M111 HydrophobicContact CB-SD 3.33Å; L106-M111 WeakPolarHBondContact CB-SD 3.3Å; L106-M111 HydrophobicContact CD1-SD 3.77Å; L106-M111 HydrophobicContact CG-SD 4.18Å; D107-M111 PolarHBondContact O-N 3.46Å; M111-K113 VanDerWaalsContact C-N 3.27Å; M111-K113 PolarHBondContact O-N 3.11Å; M111-K113 VanDerWaalsContact O-N 3.16Å; M111-Y114 PolarHBondContact O-N 2.85Å; M111-M115 HydrophobicContact CE-CE 3.95Å; M111-M115 PolarHBondContact O-N 3.04Å
112D95.9Very high95.6Very high121 Ų12156.5 Ų56.565%0.64725%0.249SC*.Hα-helixtrans-55-41.5-172.6-62.9-19.8000113R110 Y114 M115 M116R110-D112 PolarHBondContact O-N 3.47Å; D112-Y114 PolarHBondContact O-N 3.01Å; D112-M115 WeakPolarHBondContact O-CB 3.48Å; D112-M115 PolarHBondContact O-N 2.98Å; D112-M116 WeakPolarHBondContact O-CB 3.36Å; D112-M116 PolarHBondContact O-N 3.45Å
113K96.6Very high95.8Very high7 Ų757.3 Ų57.33%0.0325%0.251CS..Hα-helixtrans-72.7-29.5-177.281.5-174166.6-177.20112.6M59 W60 Q62 Q68 R110 M111 M116 L117M59-K113 HydrophobicContact CE-CB 3.53Å; M59-K113 HydrophobicContact CE-CD 4.17Å; M59-K113 HydrophobicContact CE-CG 3.83Å; M59-K113 WeakPolarHBondContact CE-O 3.31Å; M59-K113 HydrophobicContact CG-CD 4.34Å; M59-K113 HydrophobicContact CG-CG 4.18Å; M59-K113 WeakPolarHBondContact O-CE 3.45Å; M59-K113 PolarHBondContact O-NZ 3.24Å; W60-K113 PolarHBondContact O-NZ 2.84Å; Q62-K113 PolarHBondContact O-NZ 3.22Å; Q68-K113 HydrophobicContact CB-CB 4.36Å; Q68-K113 HydrophobicContact CG-CB 4.32Å; Q68-K113 HydrophobicContact CG-CD 4.1Å; R110-K113 WeakPolarHBondContact O-CG 3.42Å; R110-K113 PolarHBondContact O-N 3.42Å; M111-K113 VanDerWaalsContact C-N 3.27Å; M111-K113 PolarHBondContact O-N 3.11Å; M111-K113 VanDerWaalsContact O-N 3.16Å; K113-M116 HydrophobicContact CB-CE 4.49Å; K113-L117 WeakPolarHBondContact O-CB 3.41Å; K113-L117 PolarHBondContact O-N 3.06Å
114Y97.3Very high95.9Very high0 Ų056.7 Ų56.70%025%0.249CC..Hα-helixtrans-79.4-33.2173.7-72.8-77.7000112.3Y56 M59 W60 I99 L106 R110 M111 D112 L117 M118Y56-Y114 HydrophobicContact CD2-CD1 4.13Å; Y56-Y114 AromaticContact CD2-CE1 3.31Å; Y56-Y114 HydrophobicContact CD2-CE1 3.31Å; Y56-Y114 AromaticContact CD2-CZ 3.83Å; Y56-Y114 HydrophobicContact CE2-CD1 4.02Å; Y56-Y114 AromaticContact CE2-CE1 3.35Å; Y56-Y114 HydrophobicContact CE2-CE1 3.35Å; Y56-Y114 HydrophobicContact CE2-CE2 4.35Å; Y56-Y114 AromaticContact CE2-CZ 3.53Å; Y56-Y114 HydrophobicContact CG-CE1 4.07Å; Y56-Y114 AromaticContact CZ-CZ 3.82Å; Y56-Y114 PolarHBondContact O-OH 2.81Å; M59-Y114 HydrophobicContact CB-CE1 4.03Å; M59-Y114 HydrophobicContact CG-CE1 4.13Å; W60-Y114 VanDerWaalsContact CA-OH 3.28Å; W60-Y114 WeakPolarHBondContact CA-OH 3.45Å; W60-Y114 VanDerWaalsContact CB-OH 3.29Å; W60-Y114 WeakPolarHBondContact CB-OH 3.14Å; W60-Y114 HydrophobicContact CE3-CE2 4.39Å; W60-Y114 PolarHBondContact N-OH 3.24Å; W60-Y114 VanDerWaalsContact N-OH 3.15Å; I99-Y114 HydrophobicContact CD1-CD1 4.23Å; L106-Y114 HydrophobicContact CD1-CD2 3.9Å; L106-Y114 HydrophobicContact CD1-CG 3.97Å; L106-Y114 HydrophobicContact CD2-CD2 3.29Å; L106-Y114 HydrophobicContact CD2-CE2 3.27Å; L106-Y114 HydrophobicContact CD2-CG 4.05Å; L106-Y114 HydrophobicContact CG-CD2 4.26Å; R110-Y114 HydrophobicContact CB-CE2 4.35Å; R110-Y114 VanDerWaalsContact O-CD2 3.3Å; R110-Y114 WeakPolarHBondContact O-CD2 3.41Å; M111-Y114 PolarHBondContact O-N 2.85Å; D112-Y114 PolarHBondContact O-N 3.01Å; Y114-L117 HydrophobicContact CD1-CD2 4.24Å; Y114-L117 PolarHBondContact O-N 3.48Å; Y114-M118 PolarHBondContact O-N 2.84Å
115M97.2Very high96.1Very high54 Ų5448.3 Ų48.327%0.26622%0.216SC..Hα-helixtrans-59.9-47.4167.6-77.9179.6169.500110.9W103 M111 D112 L117 M118 R119 H165W103-M115 HydrophobicContact CH2-CG 3.97Å; W103-M115 HydrophobicContact CZ2-CE 4.19Å; M111-M115 HydrophobicContact CE-CE 3.95Å; M111-M115 PolarHBondContact O-N 3.04Å; D112-M115 WeakPolarHBondContact O-CB 3.48Å; D112-M115 PolarHBondContact O-N 2.98Å; M115-L117 PolarHBondContact O-N 3.27Å; M115-M118 WeakPolarHBondContact O-CB 3.47Å; M115-M118 PolarHBondContact O-N 3.22Å; M115-R119 PolarHBondContact O-N 3.46Å; M115-H165 VanDerWaalsContact C-NE2 3.28Å; M115-H165 VanDerWaalsContact CA-NE2 3.34Å; M115-H165 WeakPolarHBondContact CA-NE2 3.34Å; M115-H165 WeakPolarHBondContact CB-NE2 3.35Å; M115-H165 HydrophobicContact CE-CB 4.48Å; M115-H165 PolarHBondContact O-NE2 3.44Å
116M97.7Very high96.3Very high33 Ų3343.5 Ų43.516%0.16319%0.19CC..Hα-helixtrans-61.4-42173.7177.8175.665.100112.6M59 Q68 E69 A72 D112 K113 M118 R119 R120M59-M116 HydrophobicContact CE-CE 4.07Å; Q68-M116 VanDerWaalsContact C-CE 3.48Å; Q68-M116 HydrophobicContact CB-CE 3.77Å; E69-M116 HydrophobicContact CB-CE 4.31Å; E69-M116 HydrophobicContact CB-SD 4.12Å; E69-M116 HydrophobicContact CG-CE 3.85Å; E69-M116 HydrophobicContact CG-SD 3.29Å; E69-M116 WeakPolarHBondContact CG-SD 3.28Å; A72-M116 HydrophobicContact CB-CE 4.35Å; D112-M116 WeakPolarHBondContact O-CB 3.36Å; D112-M116 PolarHBondContact O-N 3.45Å; K113-M116 HydrophobicContact CB-CE 4.49Å; M116-M118 VanDerWaalsContact C-N 3.28Å; M116-M118 PolarHBondContact O-N 3.09Å; M116-R119 WeakPolarHBondContact O-CB 3.48Å; M116-R119 PolarHBondContact O-N 3.46Å; M116-R119 VanDerWaalsContact O-N 3.15Å; M116-R120 HydrophobicContact CG-CG 4.45Å; M116-R120 PolarHBondContact O-N 2.92Å
117L98.2Very high96.3Very high3 Ų346.8 Ų46.82%0.01620%0.201CC..Hα-helixtrans-57.7-43174.9176.161.9000111.1A72 I75 F95 K113 Y114 M115 R119 R120 F121A72-L117 HydrophobicContact CB-CB 4.46Å; A72-L117 HydrophobicContact CB-CD1 4.15Å; I75-L117 HydrophobicContact CB-CD1 4.03Å; I75-L117 HydrophobicContact CD1-CD1 4.32Å; I75-L117 HydrophobicContact CG2-CD1 3.79Å; F95-L117 HydrophobicContact CE2-CD2 4.35Å; F95-L117 HydrophobicContact CE2-CG 4.22Å; K113-L117 WeakPolarHBondContact O-CB 3.41Å; K113-L117 PolarHBondContact O-N 3.06Å; Y114-L117 HydrophobicContact CD1-CD2 4.24Å; Y114-L117 PolarHBondContact O-N 3.48Å; M115-L117 PolarHBondContact O-N 3.27Å; L117-R119 PolarHBondContact O-N 3.46Å; L117-R120 PolarHBondContact O-N 3.04Å; L117-F121 WeakPolarHBondContact O-CB 3.4Å; L117-F121 PolarHBondContact O-N 3.37Å
118M98Very high96.3Very high1 Ų144.7 Ų44.71%0.00519%0.19CC..Hα-helixtrans-60.8-43.7175.3-172.2171.6-58.100112.2F95 I99 W103 Y114 M115 M116 F121 F122 I162 F166 L169F95-M118 HydrophobicContact CE1-CG 4.43Å; F95-M118 HydrophobicContact CZ-CB 4.32Å; F95-M118 HydrophobicContact CZ-CG 4.43Å; I99-M118 HydrophobicContact CG2-CE 3.61Å; W103-M118 HydrophobicContact CH2-CE 4.32Å; W103-M118 HydrophobicContact CZ3-CE 3.96Å; Y114-M118 PolarHBondContact O-N 2.84Å; M115-M118 WeakPolarHBondContact O-CB 3.47Å; M115-M118 PolarHBondContact O-N 3.22Å; M116-M118 VanDerWaalsContact C-N 3.28Å; M116-M118 PolarHBondContact O-N 3.09Å; M118-F121 PolarHBondContact O-N 3.17Å; M118-F122 WeakPolarHBondContact O-CB 3.5Å; M118-F122 PolarHBondContact O-N 3.01Å; M118-I162 HydrophobicContact CE-CG1 4.39Å; M118-I162 HydrophobicContact CE-CG2 3.75Å; M118-I162 HydrophobicContact SD-CG2 4.1Å; M118-F166 HydrophobicContact CG-CD2 4.37Å; M118-F166 HydrophobicContact SD-CB 4.21Å; M118-F166 HydrophobicContact SD-CD2 4.13Å; M118-L169 HydrophobicContact CG-CD2 4.27Å
119R98.1Very high96.4Very high56 Ų5637.7 Ų37.721%0.21116%0.16CC..Hα-helixtrans-58.3-51.8175.9-174.9177.6-77.7-85.24.6111.8M115 M116 L117 F121 F122 R123 L169 D172 E173M115-R119 PolarHBondContact O-N 3.46Å; M116-R119 WeakPolarHBondContact O-CB 3.48Å; M116-R119 PolarHBondContact O-N 3.46Å; M116-R119 VanDerWaalsContact O-N 3.15Å; L117-R119 PolarHBondContact O-N 3.46Å; R119-F121 VanDerWaalsContact C-N 3.34Å; R119-F121 PolarHBondContact O-N 3.03Å; R119-F122 PolarHBondContact O-N 3.21Å; R119-R123 PolarHBondContact O-N 3.29Å; R119-L169 HydrophobicContact CB-CD2 4.09Å; R119-L169 HydrophobicContact CG-CB 4.45Å; R119-L169 VanDerWaalsContact CZ-CB 3.49Å; R119-D172 IonicContact NH1-OD2 2.86Å; R119-E173 WeakPolarHBondContact CD-OE1 3.31Å; R119-E173 VanDerWaalsContact CG-CD 3.43Å; R119-E173 HydrophobicContact CG-CG 3.81Å; R119-E173 WeakPolarHBondContact CG-OE1 3.43Å; R119-E173 IonicContact CZ-OE1 2.67Å; R119-E173 IonicContact NE-OE1 2.68Å; R119-E173 IonicContact NH1-OE1 3.65Å; R119-E173 PolarHBondContact NH1-OE1 2.91Å
120R97.8Very high96.5Very high43 Ų4328.5 Ų28.516%0.16213%0.126CC..Hα-helixtrans-64.8-36.7177.8-63.1-53.1-169.3-108.5-8.9112.8A72 D73 A76 M116 L117 R123 A124A72-R120 HydrophobicContact CB-CB 4.37Å; A72-R120 HydrophobicContact CB-CG 4.07Å; D73-R120 WeakPolarHBondContact OD1-CD 3.46Å; D73-R120 WeakPolarHBondContact OD1-CG 3.33Å; D73-R120 IonicContact OD1-NE 3.63Å; D73-R120 PolarHBondContact OD1-NE 3.05Å; D73-R120 VanDerWaalsContact OD1-NE 3.08Å; A76-R120 HydrophobicContact CB-CB 4.17Å; A76-R120 WeakPolarHBondContact CB-O 3.42Å; M116-R120 HydrophobicContact CG-CG 4.45Å; M116-R120 PolarHBondContact O-N 2.92Å; L117-R120 PolarHBondContact O-N 3.04Å; R120-R123 WeakPolarHBondContact O-CB 3.33Å; R120-R123 PolarHBondContact O-N 3.45Å; R120-A124 PolarHBondContact O-N 3.27Å; R120-A124 VanDerWaalsContact O-N 3.08Å
121F98.2Very high96.4Very high0 Ų030.5 Ų30.50%014%0.142CC..Hα-helixtrans-69.6-40.7178.5-161.5-102.3000111.9W52 A76 F91 V92 F95 L117 M118 R119 A124 I125W52-F121 AromaticContact CH2-CD2 3.85Å; W52-F121 HydrophobicContact CH2-CD2 3.85Å; W52-F121 AromaticContact CH2-CE2 3.52Å; W52-F121 HydrophobicContact CH2-CE2 3.52Å; W52-F121 HydrophobicContact CH2-CZ 4.03Å; W52-F121 HydrophobicContact CZ2-CD2 4.27Å; W52-F121 HydrophobicContact CZ2-CE1 4.44Å; W52-F121 AromaticContact CZ2-CE2 3.5Å; W52-F121 HydrophobicContact CZ2-CE2 3.5Å; W52-F121 AromaticContact CZ2-CZ 3.59Å; W52-F121 HydrophobicContact CZ2-CZ 3.59Å; A76-F121 HydrophobicContact CB-CD2 4.33Å; F91-F121 HydrophobicContact CD1-CE2 4.01Å; F91-F121 AromaticContact CD1-CZ 3.9Å; F91-F121 HydrophobicContact CD1-CZ 3.9Å; F91-F121 AromaticContact CE1-CE2 3.63Å; F91-F121 HydrophobicContact CE1-CE2 3.63Å; F91-F121 AromaticContact CE1-CZ 3.99Å; F91-F121 HydrophobicContact CE1-CZ 3.99Å; F91-F121 HydrophobicContact CZ-CE2 4.47Å; V92-F121 HydrophobicContact CB-CE1 4.45Å; V92-F121 HydrophobicContact CG1-CE1 4.49Å; V92-F121 HydrophobicContact CG2-CE1 4.2Å; V92-F121 HydrophobicContact CG2-CZ 4.25Å; F95-F121 HydrophobicContact CB-CD1 4.05Å; F95-F121 HydrophobicContact CB-CE1 3.45Å; F95-F121 VanDerWaalsContact CB-CE1 3.45Å; F95-F121 HydrophobicContact CB-CZ 3.81Å; F95-F121 AromaticContact CD1-CD1 3.2Å; F95-F121 HydrophobicContact CD1-CD1 3.2Å; F95-F121 AromaticContact CD1-CE1 3.48Å; F95-F121 HydrophobicContact CD1-CE1 3.48Å; F95-F121 VanDerWaalsContact CD1-CE1 3.48Å; F95-F121 HydrophobicContact CD1-CG 4.05Å; F95-F121 AromaticContact CD2-CD1 3.94Å; F95-F121 HydrophobicContact CD2-CD1 3.94Å; F95-F121 HydrophobicContact CD2-CD2 4.41Å; F95-F121 HydrophobicContact CD2-CE1 4.14Å; F95-F121 HydrophobicContact CD2-CG 4.08Å; F95-F121 HydrophobicContact CD2-CZ 4.49Å; F95-F121 HydrophobicContact CE1-CB 4.15Å; F95-F121 AromaticContact CE1-CD1 3.52Å; F95-F121 HydrophobicContact CE1-CD1 3.52Å; F95-F121 HydrophobicContact CE1-CE1 4.26Å; F95-F121 HydrophobicContact CE1-CG 4.06Å; F95-F121 HydrophobicContact CE2-CB 4.19Å; F95-F121 HydrophobicContact CE2-CD1 4.19Å; F95-F121 HydrophobicContact CE2-CG 4.07Å; F95-F121 AromaticContact CG-CD1 3.43Å; F95-F121 HydrophobicContact CG-CD1 3.43Å; F95-F121 VanDerWaalsContact CG-CD1 3.43Å; F95-F121 AromaticContact CG-CE1 3.4Å; F95-F121 HydrophobicContact CG-CE1 3.4Å; F95-F121 VanDerWaalsContact CG-CE1 3.4Å; F95-F121 HydrophobicContact CG-CG 4.05Å; F95-F121 HydrophobicContact CG-CZ 4.02Å; F95-F121 HydrophobicContact CZ-CB 3.91Å; F95-F121 AromaticContact CZ-CD1 3.99Å; F95-F121 HydrophobicContact CZ-CD1 3.99Å; F95-F121 HydrophobicContact CZ-CG 4.06Å; L117-F121 WeakPolarHBondContact O-CB 3.4Å; L117-F121 PolarHBondContact O-N 3.37Å; M118-F121 PolarHBondContact O-N 3.17Å; R119-F121 VanDerWaalsContact C-N 3.34Å; R119-F121 PolarHBondContact O-N 3.03Å; F121-A124 WeakPolarHBondContact O-CB 3.47Å; F121-A124 PolarHBondContact O-N 3.48Å; F121-A124 VanDerWaalsContact O-N 3.16Å; F121-I125 HydrophobicContact CD1-CD1 3.93Å; F121-I125 HydrophobicContact CD1-CG1 4.35Å; F121-I125 HydrophobicContact CE1-CD1 3.99Å; F121-I125 HydrophobicContact CE1-CG1 4.27Å; F121-I125 WeakPolarHBondContact O-CG1 3.26Å; F121-I125 PolarHBondContact O-N 3.21Å
122F98.1Very high96.2Very high4 Ų433.2 Ų33.22%0.01815%0.154CC..Hα-helixtrans-61.6-45.2173.3-179.1-117.7000111.5M118 R119 A124 I125 V126 F146 F166 L169 Y170 E173 L174M118-F122 WeakPolarHBondContact O-CB 3.5Å; M118-F122 PolarHBondContact O-N 3.01Å; R119-F122 PolarHBondContact O-N 3.21Å; F122-A124 PolarHBondContact O-N 3.17Å; F122-I125 WeakPolarHBondContact O-CA 3.44Å; F122-I125 WeakPolarHBondContact O-CB 3.27Å; F122-I125 PolarHBondContact O-N 3.16Å; F122-V126 HydrophobicContact CD1-CG2 4.35Å; F122-V126 HydrophobicContact CD2-CG2 4.41Å; F122-V126 HydrophobicContact CE1-CG2 3.96Å; F122-V126 HydrophobicContact CE2-CG2 4.01Å; F122-V126 HydrophobicContact CZ-CG2 3.77Å; F122-V126 WeakPolarHBondContact O-CG2 3.45Å; F122-V126 PolarHBondContact O-N 3.42Å; F122-F146 AromaticContact CD2-CZ 3.98Å; F122-F146 HydrophobicContact CD2-CZ 3.98Å; F122-F146 AromaticContact CE2-CE2 3.99Å; F122-F146 HydrophobicContact CE2-CE2 3.99Å; F122-F146 AromaticContact CE2-CZ 3.79Å; F122-F146 HydrophobicContact CE2-CZ 3.79Å; F122-F166 HydrophobicContact CB-CE2 4.29Å; F122-F166 AromaticContact CD2-CE2 3.64Å; F122-F166 HydrophobicContact CD2-CE2 3.64Å; F122-F166 AromaticContact CD2-CZ 3.61Å; F122-F166 HydrophobicContact CD2-CZ 3.61Å; F122-F166 HydrophobicContact CE2-CE2 4.15Å; F122-F166 AromaticContact CE2-CZ 3.63Å; F122-F166 HydrophobicContact CE2-CZ 3.63Å; F122-F166 AromaticContact CG-CE2 3.98Å; F122-F166 HydrophobicContact CG-CE2 3.98Å; F122-F166 HydrophobicContact CG-CZ 4.28Å; F122-F166 HydrophobicContact CZ-CZ 4.3Å; F122-L169 HydrophobicContact CB-CD1 3.93Å; F122-L169 HydrophobicContact CD1-CD1 3.35Å; F122-L169 HydrophobicContact CE1-CD1 4.11Å; F122-L169 HydrophobicContact CG-CD1 3.85Å; F122-Y170 AromaticContact CE1-CD2 3.99Å; F122-Y170 HydrophobicContact CE1-CD2 3.99Å; F122-Y170 HydrophobicContact CE1-CE2 4.44Å; F122-Y170 HydrophobicContact CE2-CD2 4.18Å; F122-Y170 HydrophobicContact CE2-CE2 4.03Å; F122-Y170 AromaticContact CZ-CD2 3.51Å; F122-Y170 HydrophobicContact CZ-CD2 3.51Å; F122-Y170 AromaticContact CZ-CE2 3.54Å; F122-Y170 HydrophobicContact CZ-CE2 3.54Å; F122-Y170 HydrophobicContact CZ-CG 4.38Å; F122-E173 HydrophobicContact CD1-CB 3.55Å; F122-E173 HydrophobicContact CD1-CG 4.18Å; F122-E173 HydrophobicContact CE1-CB 3.81Å; F122-L174 HydrophobicContact CE1-CG 4.22Å; F122-L174 HydrophobicContact CZ-CD2 4.21Å; F122-L174 HydrophobicContact CZ-CG 4.07Å
123R97.2Very high95.9Very high56 Ų5634.4 Ų34.421%0.21116%0.16CC..Hα-helixtrans-51.5-43.2171.1-167.3-177-64-164.6-3.8112.5R119 R120 V126 R127 E173 S177R119-R123 PolarHBondContact O-N 3.29Å; R120-R123 WeakPolarHBondContact O-CB 3.33Å; R120-R123 PolarHBondContact O-N 3.45Å; R123-V126 PolarHBondContact O-N 3.39Å; R123-R127 VanDerWaalsContact CD-NH2 3.31Å; R123-R127 WeakPolarHBondContact O-CG 3.5Å; R123-R127 PolarHBondContact O-N 3.09Å; R123-E173 IonicContact CZ-OE2 2.67Å; R123-E173 IonicContact NE-OE2 2.9Å; R123-E173 PolarHBondContact NE-OE2 2.83Å; R123-E173 IonicContact NH2-OE1 3.08Å; R123-E173 PolarHBondContact NH2-OE1 3.06Å; R123-E173 VanDerWaalsContact NH2-OE1 3.09Å; R123-E173 IonicContact NH2-OE2 3.17Å; R123-E173 PolarHBondContact NH2-OE2 3.41Å; R123-S177 WeakPolarHBondContact CG-OG 3.29Å
124A97Very high95.6Very high1 Ų134.6 Ų34.61%0.00816%0.161CC..Hα-helixtrans-69.1-30.8177.500000113.4A76 I79 R120 F121 F122 L128A76-A124 HydrophobicContact CB-CB 3.88Å; I79-A124 HydrophobicContact CG2-CB 4.07Å; R120-A124 PolarHBondContact O-N 3.27Å; R120-A124 VanDerWaalsContact O-N 3.08Å; F121-A124 WeakPolarHBondContact O-CB 3.47Å; F121-A124 PolarHBondContact O-N 3.48Å; F121-A124 VanDerWaalsContact O-N 3.16Å; F122-A124 PolarHBondContact O-N 3.17Å; A124-L128 WeakPolarHBondContact O-CB 3.42Å; A124-L128 PolarHBondContact O-N 3.27Å
125I97.4Very high95.2Very high1 Ų138.2 Ų38.21%0.00518%0.181CC..Hα-helixtrans-66.7-43.9170.8-63.1166.1000110.4V92 F96 F121 F122 L128 L129 V142 F146V92-I125 HydrophobicContact CG1-CD1 3.61Å; V92-I125 HydrophobicContact CG1-CG1 4.07Å; V92-I125 HydrophobicContact CG2-CD1 4.3Å; V92-I125 HydrophobicContact CG2-CG1 3.87Å; F96-I125 HydrophobicContact CE2-CD1 3.94Å; F96-I125 HydrophobicContact CZ-CD1 4.33Å; F121-I125 HydrophobicContact CD1-CD1 3.93Å; F121-I125 HydrophobicContact CD1-CG1 4.35Å; F121-I125 HydrophobicContact CE1-CD1 3.99Å; F121-I125 HydrophobicContact CE1-CG1 4.27Å; F121-I125 WeakPolarHBondContact O-CG1 3.26Å; F121-I125 PolarHBondContact O-N 3.21Å; F122-I125 WeakPolarHBondContact O-CA 3.44Å; F122-I125 WeakPolarHBondContact O-CB 3.27Å; F122-I125 PolarHBondContact O-N 3.16Å; I125-L128 WeakPolarHBondContact O-CB 3.44Å; I125-L128 PolarHBondContact O-N 3.15Å; I125-L129 PolarHBondContact O-N 3.15Å; I125-V142 HydrophobicContact CG2-CG1 3.67Å; I125-V142 HydrophobicContact CG2-CG2 4.37Å; I125-F146 HydrophobicContact CD1-CE1 4.17Å; I125-F146 HydrophobicContact CD1-CZ 4.2Å; I125-F146 HydrophobicContact CG2-CZ 4.11Å
126V95.9Very high94.8Very high1 Ų141.2 Ų41.21%0.00620%0.197CC..Hα-helixtrans-63.9-43.8177.6178.80000110.9F122 R123 L128 L129 N130 W134 L174 S177 S178F122-V126 HydrophobicContact CD1-CG2 4.35Å; F122-V126 HydrophobicContact CD2-CG2 4.41Å; F122-V126 HydrophobicContact CE1-CG2 3.96Å; F122-V126 HydrophobicContact CE2-CG2 4.01Å; F122-V126 HydrophobicContact CZ-CG2 3.77Å; F122-V126 WeakPolarHBondContact O-CG2 3.45Å; F122-V126 PolarHBondContact O-N 3.42Å; R123-V126 PolarHBondContact O-N 3.39Å; V126-L128 VanDerWaalsContact C-N 3.31Å; V126-L128 PolarHBondContact O-N 3Å; V126-L129 WeakPolarHBondContact O-CB 3.39Å; V126-L129 PolarHBondContact O-N 3.08Å; V126-L129 VanDerWaalsContact O-N 3.11Å; V126-N130 PolarHBondContact O-N 3.45Å; V126-W134 HydrophobicContact CG1-CH2 4.48Å; V126-W134 HydrophobicContact CG1-CZ2 4.2Å; V126-L174 HydrophobicContact CG1-CD2 4.18Å; V126-L174 HydrophobicContact CG2-CD2 3.79Å; V126-S177 VanDerWaalsContact CG1-CB 3.47Å; V126-S178 WeakPolarHBondContact CG1-OG 3.49Å
127R94.7Very high94.6Very high88 Ų8843.3 Ų43.333%0.33221%0.214SC..Hα-helixtrans-57.8-41.6171.3-70.8-173.8-132.4141.1-4.7112.5D77 R123 L129 N130 D131D77-R127 IonicContact OD1-NH1 3.84Å; D77-R127 PolarHBondContact OD1-NH1 3.31Å; R123-R127 VanDerWaalsContact CD-NH2 3.31Å; R123-R127 WeakPolarHBondContact O-CG 3.5Å; R123-R127 PolarHBondContact O-N 3.09Å; R127-L129 VanDerWaalsContact C-N 3.3Å; R127-L129 PolarHBondContact O-N 3.25Å; R127-N130 WeakPolarHBondContact O-CB 3.3Å; R127-N130 PolarHBondContact O-N 2.89Å; R127-D131 WeakPolarHBondContact O-CB 3.47Å; R127-D131 PolarHBondContact O-N 2.9Å
128L94.6Very high94.4Very high4 Ų443.5 Ų43.52%0.02122%0.215CC..Hα-helixtrans-59.7-40.7175.1169.362.3000112.1I79 K88 A124 I125 V126 Q132 L138I79-L128 HydrophobicContact CD1-CB 4.34Å; I79-L128 HydrophobicContact CD1-CD2 3.73Å; I79-L128 HydrophobicContact CG1-CD2 4.38Å; K88-L128 HydrophobicContact CB-CD2 3.91Å; K88-L128 HydrophobicContact CD-CD1 3.38Å; K88-L128 HydrophobicContact CD-CD2 4.04Å; K88-L128 HydrophobicContact CD-CG 4.36Å; A124-L128 WeakPolarHBondContact O-CB 3.42Å; A124-L128 PolarHBondContact O-N 3.27Å; I125-L128 WeakPolarHBondContact O-CB 3.44Å; I125-L128 PolarHBondContact O-N 3.15Å; V126-L128 VanDerWaalsContact C-N 3.31Å; V126-L128 PolarHBondContact O-N 3Å; L128-Q132 HydrophobicContact CD1-CG 4.41Å; L128-Q132 WeakPolarHBondContact O-CG 3.16Å; L128-Q132 PolarHBondContact O-N 2.99Å; L128-L138 HydrophobicContact CD1-CD2 4.47Å; L128-L138 HydrophobicContact CG-CD2 4.3Å
129L94.8Very high94.2Very high6 Ų644.6 Ų44.63%0.03122%0.22CC..Hα-helixtrans-66.6-43.9176.5-68.1169.3000111.1I125 V126 R127 D131 Q132 N133 W134 L138 F139 V142I125-L129 PolarHBondContact O-N 3.15Å; V126-L129 WeakPolarHBondContact O-CB 3.39Å; V126-L129 PolarHBondContact O-N 3.08Å; V126-L129 VanDerWaalsContact O-N 3.11Å; R127-L129 VanDerWaalsContact C-N 3.3Å; R127-L129 PolarHBondContact O-N 3.25Å; L129-D131 PolarHBondContact O-N 2.93Å; L129-Q132 CarbonylContact O-C 3.6Å; L129-Q132 PolarHBondContact O-N 3.23Å; L129-Q132 VanDerWaalsContact O-N 3.13Å; L129-N133 PolarHBondContact O-N 3.08Å; L129-W134 HydrophobicContact CB-CD2 4.04Å; L129-W134 HydrophobicContact CB-CE3 4.03Å; L129-W134 HydrophobicContact CB-CH2 4.25Å; L129-W134 HydrophobicContact CB-CZ2 4.24Å; L129-W134 HydrophobicContact CB-CZ3 4.15Å; L129-W134 HydrophobicContact CD1-CE3 4.15Å; L129-W134 HydrophobicContact CD1-CH2 3.96Å; L129-W134 HydrophobicContact CD1-CZ3 3.63Å; L129-W134 HydrophobicContact CG-CZ3 4.45Å; L129-W134 PolarHBondContact O-N 3.01Å; L129-L138 HydrophobicContact CD2-CD2 4.24Å; L129-L138 HydrophobicContact CD2-CG 3.95Å; L129-F139 HydrophobicContact CD1-CD2 4.3Å; L129-F139 HydrophobicContact CD2-CB 4.3Å; L129-F139 HydrophobicContact CD2-CD2 4.45Å; L129-V142 HydrophobicContact CD1-CG1 4.35Å; L129-V142 HydrophobicContact CD2-CG2 4.07Å
130N92.7Very high94Very high13 Ų1344.5 Ų44.57%0.0723%0.227CC..Hα-helixtrans-57.4-48.1173.7-76.1-22.7000112.8V126 R127 Q132 N133 W134 S177 S178 K181V126-N130 PolarHBondContact O-N 3.45Å; R127-N130 WeakPolarHBondContact O-CB 3.3Å; R127-N130 PolarHBondContact O-N 2.89Å; N130-Q132 PolarHBondContact O-N 3.24Å; N130-N133 PolarHBondContact O-N 3.23Å; N130-W134 PolarHBondContact OD1-NE1 3.42Å; N130-S177 PolarHBondContact ND2-O 3.45Å; N130-S178 PolarHBondContact ND2-OG 3.15Å; N130-S178 PolarHBondContact OD1-OG 3.22Å; N130-K181 HydrophobicContact CB-CD 4.25Å
131D91.2Very high93.9Very high113 Ų11346.3 Ų46.360%0.60424%0.237SC*.THydrogen-bonded Turntrans-60.9-17.2-179.9-71-10.6000112.5R127 L129R127-D131 WeakPolarHBondContact O-CB 3.47Å; R127-D131 PolarHBondContact O-N 2.9Å; L129-D131 PolarHBondContact O-N 2.93Å
132Q90.9Very high93.8Very high93 Ų9346.3 Ų46.344%0.43524%0.237SC..THydrogen-bonded Turntrans-111.518177.5-59.7-63.1-78.900112L128 L129 N130 W134 N135 L138L128-Q132 HydrophobicContact CD1-CG 4.41Å; L128-Q132 WeakPolarHBondContact O-CG 3.16Å; L128-Q132 PolarHBondContact O-N 2.99Å; L129-Q132 CarbonylContact O-C 3.6Å; L129-Q132 PolarHBondContact O-N 3.23Å; L129-Q132 VanDerWaalsContact O-N 3.13Å; N130-Q132 PolarHBondContact O-N 3.24Å; Q132-W134 PolarHBondContact O-N 3.16Å; Q132-N135 HydrophobicContact CB-CB 4.43Å; Q132-N135 VanDerWaalsContact O-CB 3.31Å; Q132-N135 WeakPolarHBondContact O-CB 3.47Å; Q132-N135 PolarHBondContact O-N 3.3Å; Q132-L138 HydrophobicContact CB-CD2 3.77Å; Q132-L138 HydrophobicContact CG-CD2 3.64Å
133N90.8Very high93.7Very high145 Ų14547.2 Ų47.278%0.77524%0.244SC*.THydrogen-bonded Turntrans48.940.9-179.4-60.4-43.9000112.9L129 N130 N135L129-N133 PolarHBondContact O-N 3.08Å; N130-N133 PolarHBondContact O-N 3.23Å; N133-N135 PolarHBondContact O-N 3.35Å; N133-N135 VanDerWaalsContact O-N 3.15Å
134W90.4Very high93.6Very high11 Ų1150.9 Ų50.94%0.04226%0.258CS..THydrogen-bonded Turntrans54.435-179.8-67.386.6000113.9V126 L129 N130 Q132 D136 F139 L174 L182 L190V126-W134 HydrophobicContact CG1-CH2 4.48Å; V126-W134 HydrophobicContact CG1-CZ2 4.2Å; L129-W134 HydrophobicContact CB-CD2 4.04Å; L129-W134 HydrophobicContact CB-CE3 4.03Å; L129-W134 HydrophobicContact CB-CH2 4.25Å; L129-W134 HydrophobicContact CB-CZ2 4.24Å; L129-W134 HydrophobicContact CB-CZ3 4.15Å; L129-W134 HydrophobicContact CD1-CE3 4.15Å; L129-W134 HydrophobicContact CD1-CH2 3.96Å; L129-W134 HydrophobicContact CD1-CZ3 3.63Å; L129-W134 HydrophobicContact CG-CZ3 4.45Å; L129-W134 PolarHBondContact O-N 3.01Å; N130-W134 PolarHBondContact OD1-NE1 3.42Å; Q132-W134 PolarHBondContact O-N 3.16Å; W134-D136 PolarHBondContact O-N 2.94Å; W134-F139 AromaticContact CE3-CD2 3.91Å; W134-F139 HydrophobicContact CE3-CD2 3.91Å; W134-F139 HydrophobicContact CE3-CE2 4.25Å; W134-F139 AromaticContact CZ3-CD2 3.93Å; W134-F139 HydrophobicContact CZ3-CD2 3.93Å; W134-F139 AromaticContact CZ3-CE2 3.94Å; W134-F139 HydrophobicContact CZ3-CE2 3.94Å; W134-L174 HydrophobicContact CH2-CD2 4.09Å; W134-L182 HydrophobicContact CD2-CD2 3.55Å; W134-L182 HydrophobicContact CE3-CD2 3.81Å; W134-L182 HydrophobicContact CG-CD2 4.17Å; W134-L182 HydrophobicContact CH2-CD1 3.93Å; W134-L182 HydrophobicContact CH2-CD2 3.77Å; W134-L182 HydrophobicContact CH2-CG 4.25Å; W134-L182 HydrophobicContact CZ2-CD1 3.71Å; W134-L182 HydrophobicContact CZ2-CD2 3.51Å; W134-L182 HydrophobicContact CZ2-CG 3.72Å; W134-L182 HydrophobicContact CZ3-CD2 3.91Å; W134-L190 HydrophobicContact CH2-CD1 3.96Å; W134-L190 HydrophobicContact CZ3-CD1 3.91Å; W134-L190 HydrophobicContact CZ3-CD2 4.11Å; W134-L190 HydrophobicContact CZ3-CG 4.45Å
135N88.9Confident93.6Very high77 Ų7751.6 Ų51.641%0.41226%0.261SS..  trans-46.6122.5177.9175.3-90.2000112.7Q132 N133 P137 L138 F139Q132-N135 HydrophobicContact CB-CB 4.43Å; Q132-N135 VanDerWaalsContact O-CB 3.31Å; Q132-N135 WeakPolarHBondContact O-CB 3.47Å; Q132-N135 PolarHBondContact O-N 3.3Å; N133-N135 PolarHBondContact O-N 3.35Å; N133-N135 VanDerWaalsContact O-N 3.15Å; N135-P137 WeakPolarHBondContact OD1-CB 3.34Å; N135-P137 WeakPolarHBondContact OD1-CD 3.36Å; N135-P137 WeakPolarHBondContact OD1-CG 3.32Å; N135-L138 HydrophobicContact CB-CB 4.42Å; N135-L138 PolarHBondContact O-N 3.08Å; N135-L138 PolarHBondContact OD1-N 2.87Å; N135-F139 PolarHBondContact O-N 2.92Å
136D88.4Confident93.6Very high116 Ų11652 Ų5262%0.6226%0.263SS*.Hα-helixtrans-52.5-48.5-173.1-69.5-26.6000114.1W134 L138 F139 C140W134-D136 PolarHBondContact O-N 2.94Å; D136-L138 VanDerWaalsContact C-N 3.34Å; D136-L138 PolarHBondContact O-N 3.1Å; D136-F139 PolarHBondContact O-N 3.14Å; D136-C140 VanDerWaalsContact O-CB 3.29Å; D136-C140 WeakPolarHBondContact O-CB 3.42Å; D136-C140 PolarHBondContact O-N 3.06Å; D136-C140 PolarHBondContact O-SG 3.38Å
137P93.8Very high93.6Very high78 Ų7856.7 Ų56.751%0.50629%0.285SS..Hα-helixtrans-56.6-40.1174.4-27.928.8000115.3N135 Q141N135-P137 WeakPolarHBondContact OD1-CB 3.34Å; N135-P137 WeakPolarHBondContact OD1-CD 3.36Å; N135-P137 WeakPolarHBondContact OD1-CG 3.32Å; P137-Q141 WeakPolarHBondContact O-CG 3.21Å; P137-Q141 PolarHBondContact O-N 3.02Å; P137-Q141 PolarHBondContact O-NE2 2.98Å
138L93.8Very high93.6Very high7 Ų760.2 Ų60.24%0.03730%0.298CS..Hα-helixtrans-73-46.5179.1177.259.4000110.4A85 L89 L128 L129 Q132 N135 D136 C140 Q141 V142A85-L138 HydrophobicContact CB-CD1 4.24Å; L89-L138 HydrophobicContact CD1-CD1 3.8Å; L89-L138 HydrophobicContact CD2-CD1 3.9Å; L89-L138 HydrophobicContact CG-CD1 3.88Å; L128-L138 HydrophobicContact CD1-CD2 4.47Å; L128-L138 HydrophobicContact CG-CD2 4.3Å; L129-L138 HydrophobicContact CD2-CD2 4.24Å; L129-L138 HydrophobicContact CD2-CG 3.95Å; Q132-L138 HydrophobicContact CB-CD2 3.77Å; Q132-L138 HydrophobicContact CG-CD2 3.64Å; N135-L138 HydrophobicContact CB-CB 4.42Å; N135-L138 PolarHBondContact O-N 3.08Å; N135-L138 PolarHBondContact OD1-N 2.87Å; D136-L138 VanDerWaalsContact C-N 3.34Å; D136-L138 PolarHBondContact O-N 3.1Å; L138-C140 PolarHBondContact O-N 2.94Å; L138-Q141 WeakPolarHBondContact O-CB 3.49Å; L138-Q141 PolarHBondContact O-N 3.22Å; L138-Q141 VanDerWaalsContact O-N 3.08Å; L138-V142 HydrophobicContact CD1-CG2 4.42Å; L138-V142 PolarHBondContact O-N 3.07Å
139F93.7Very high93.7Very high24 Ų2460.2 Ų60.211%0.10530%0.298CS..Hα-helixtrans-55.6-51.1176.3177.2-115.8000111.1L129 W134 N135 D136 Q141 V142 S143 T189 L190L129-F139 HydrophobicContact CD1-CD2 4.3Å; L129-F139 HydrophobicContact CD2-CB 4.3Å; L129-F139 HydrophobicContact CD2-CD2 4.45Å; W134-F139 AromaticContact CE3-CD2 3.91Å; W134-F139 HydrophobicContact CE3-CD2 3.91Å; W134-F139 HydrophobicContact CE3-CE2 4.25Å; W134-F139 AromaticContact CZ3-CD2 3.93Å; W134-F139 HydrophobicContact CZ3-CD2 3.93Å; W134-F139 AromaticContact CZ3-CE2 3.94Å; W134-F139 HydrophobicContact CZ3-CE2 3.94Å; N135-F139 PolarHBondContact O-N 2.92Å; D136-F139 PolarHBondContact O-N 3.14Å; F139-Q141 PolarHBondContact O-N 3.25Å; F139-V142 PolarHBondContact O-N 3.18Å; F139-V142 VanDerWaalsContact O-N 3.07Å; F139-S143 PolarHBondContact O-N 3.08Å; F139-S143 PolarHBondContact O-OG 3.48Å; F139-S143 VanDerWaalsContact O-OG 3.1Å; F139-T189 HydrophobicContact CE1-CG2 3.76Å; F139-T189 HydrophobicContact CZ-CG2 4.12Å; F139-L190 HydrophobicContact CE2-CD2 3.52Å; F139-L190 HydrophobicContact CE2-CG 4.12Å; F139-L190 HydrophobicContact CZ-CD2 3.89Å; F139-L190 HydrophobicContact CZ-CG 4.1Å
140C94Very high93.7Very high54 Ų5460 Ų6037%0.36530%0.297SS..Hα-helixtrans-54.6-38174.9-72.60000113.1D136 L138 R144D136-C140 VanDerWaalsContact O-CB 3.29Å; D136-C140 WeakPolarHBondContact O-CB 3.42Å; D136-C140 PolarHBondContact O-N 3.06Å; D136-C140 PolarHBondContact O-SG 3.38Å; L138-C140 PolarHBondContact O-N 2.94Å; C140-R144 WeakPolarHBondContact O-CB 3.44Å; C140-R144 WeakPolarHBondContact O-CG 3.44Å; C140-R144 PolarHBondContact O-N 2.84Å; C140-R144 VanDerWaalsContact O-N 3.08Å
141Q95.9Very high93.9Very high81 Ų8160 Ų6038%0.37930%0.297SS..Hα-helixtrans-72.7-36.8178.9-77.417379.200112.6L89 P137 L138 F139 I145L89-Q141 HydrophobicContact CD1-CB 3.66Å; L89-Q141 HydrophobicContact CD1-CG 4.19Å; L89-Q141 HydrophobicContact CD2-CB 4.12Å; P137-Q141 WeakPolarHBondContact O-CG 3.21Å; P137-Q141 PolarHBondContact O-N 3.02Å; P137-Q141 PolarHBondContact O-NE2 2.98Å; L138-Q141 WeakPolarHBondContact O-CB 3.49Å; L138-Q141 PolarHBondContact O-N 3.22Å; L138-Q141 VanDerWaalsContact O-N 3.08Å; F139-Q141 PolarHBondContact O-N 3.25Å; Q141-I145 WeakPolarHBondContact O-CG1 3.13Å; Q141-I145 PolarHBondContact O-N 2.67Å
142V96.2Very high94Very high0 Ų056.7 Ų56.70%028%0.279CS..Hα-helixtrans-66.6-47173.2173.90000110.4L89 I125 L129 L138 F139 R144 I145 F146L89-V142 HydrophobicContact CD2-CG2 3.65Å; I125-V142 HydrophobicContact CG2-CG1 3.67Å; I125-V142 HydrophobicContact CG2-CG2 4.37Å; L129-V142 HydrophobicContact CD1-CG1 4.35Å; L129-V142 HydrophobicContact CD2-CG2 4.07Å; L138-V142 HydrophobicContact CD1-CG2 4.42Å; L138-V142 PolarHBondContact O-N 3.07Å; F139-V142 PolarHBondContact O-N 3.18Å; F139-V142 VanDerWaalsContact O-N 3.07Å; V142-R144 VanDerWaalsContact C-N 3.32Å; V142-R144 PolarHBondContact O-N 3.36Å; V142-I145 WeakPolarHBondContact O-CA 3.42Å; V142-I145 WeakPolarHBondContact O-CB 3.42Å; V142-I145 PolarHBondContact O-N 2.96Å; V142-F146 HydrophobicContact CG1-CD2 4.14Å; V142-F146 HydrophobicContact CG1-CE1 4.3Å; V142-F146 HydrophobicContact CG1-CE2 3.46Å; V142-F146 VanDerWaalsContact CG1-CE2 3.46Å; V142-F146 HydrophobicContact CG1-CZ 3.56Å; V142-F146 PolarHBondContact O-N 3.42Å; V142-F146 VanDerWaalsContact O-N 3.16Å
143S95Very high94.1Very high22 Ų2253.5 Ų53.515%0.15427%0.266CS..Hα-helixtrans-58-43.4177.8-55.80000111.9F139 I145 F146 E147F139-S143 PolarHBondContact O-N 3.08Å; F139-S143 PolarHBondContact O-OG 3.48Å; F139-S143 VanDerWaalsContact O-OG 3.1Å; S143-I145 PolarHBondContact O-N 3.3Å; S143-F146 PolarHBondContact O-N 3.15Å; S143-E147 WeakPolarHBondContact O-CB 3.37Å; S143-E147 WeakPolarHBondContact O-CG 3.34Å; S143-E147 PolarHBondContact O-N 3.04Å
144R95.9Very high94.2Very high133 Ų13350.8 Ų50.850%0.50226%0.259SS..Hα-helixtrans-61.4-27.6173.8-75.2172.4-169.2154.13.8114C140 V142 R148C140-R144 WeakPolarHBondContact O-CB 3.44Å; C140-R144 WeakPolarHBondContact O-CG 3.44Å; C140-R144 PolarHBondContact O-N 2.84Å; C140-R144 VanDerWaalsContact O-N 3.08Å; V142-R144 VanDerWaalsContact C-N 3.32Å; V142-R144 PolarHBondContact O-N 3.36Å; R144-R148 WeakPolarHBondContact O-CD 3.39Å; R144-R148 VanDerWaalsContact O-CG 3.23Å; R144-R148 WeakPolarHBondContact O-CG 3.06Å; R144-R148 PolarHBondContact O-N 3.35Å
145I97Very high94.2Very high17 Ų1751.9 Ų51.99%0.08727%0.266CS..Hα-helixtrans-68.6-50.8172.5-67.9166.3000108.2L89 V92 K93 F96 Q141 V142 S143 E147 R148 T149L89-I145 HydrophobicContact CD2-CD1 4.03Å; V92-I145 HydrophobicContact CB-CD1 4.41Å; V92-I145 HydrophobicContact CG1-CD1 4.03Å; K93-I145 HydrophobicContact CB-CD1 4.03Å; K93-I145 HydrophobicContact CB-CG1 4.33Å; F96-I145 HydrophobicContact CD2-CG2 3.91Å; F96-I145 HydrophobicContact CE2-CG2 4.43Å; Q141-I145 WeakPolarHBondContact O-CG1 3.13Å; Q141-I145 PolarHBondContact O-N 2.67Å; V142-I145 WeakPolarHBondContact O-CA 3.42Å; V142-I145 WeakPolarHBondContact O-CB 3.42Å; V142-I145 PolarHBondContact O-N 2.96Å; S143-I145 PolarHBondContact O-N 3.3Å; I145-E147 PolarHBondContact O-N 3.49Å; I145-R148 PolarHBondContact O-N 2.93Å; I145-R148 VanDerWaalsContact O-N 3.11Å; I145-T149 HydrophobicContact CG2-CG2 4.48Å; I145-T149 WeakPolarHBondContact O-CG2 3.4Å; I145-T149 PolarHBondContact O-N 3.37Å; I145-T149 VanDerWaalsContact O-N 3.14Å; I145-T149 PolarHBondContact O-OG1 3.16Å; I145-T149 VanDerWaalsContact O-OG1 3.08Å
146F97Very high94.2Very high8 Ų855.6 Ų55.64%0.03528%0.281CS..Hα-helixtrans-62.6-42.3-179.4-56-31.9000113F96 F122 I125 V142 S143 R148 T149 V150 F151 F166F96-F146 HydrophobicContact CE2-CD1 4.03Å; F96-F146 AromaticContact CE2-CE1 3.58Å; F96-F146 HydrophobicContact CE2-CE1 3.58Å; F96-F146 AromaticContact CZ-CD1 3.89Å; F96-F146 HydrophobicContact CZ-CD1 3.89Å; F96-F146 AromaticContact CZ-CE1 3.5Å; F96-F146 HydrophobicContact CZ-CE1 3.5Å; F96-F146 VanDerWaalsContact CZ-CE1 3.5Å; F122-F146 AromaticContact CD2-CZ 3.98Å; F122-F146 HydrophobicContact CD2-CZ 3.98Å; F122-F146 AromaticContact CE2-CE2 3.99Å; F122-F146 HydrophobicContact CE2-CE2 3.99Å; F122-F146 AromaticContact CE2-CZ 3.79Å; F122-F146 HydrophobicContact CE2-CZ 3.79Å; I125-F146 HydrophobicContact CD1-CE1 4.17Å; I125-F146 HydrophobicContact CD1-CZ 4.2Å; I125-F146 HydrophobicContact CG2-CZ 4.11Å; V142-F146 HydrophobicContact CG1-CD2 4.14Å; V142-F146 HydrophobicContact CG1-CE1 4.3Å; V142-F146 HydrophobicContact CG1-CE2 3.46Å; V142-F146 VanDerWaalsContact CG1-CE2 3.46Å; V142-F146 HydrophobicContact CG1-CZ 3.56Å; V142-F146 PolarHBondContact O-N 3.42Å; V142-F146 VanDerWaalsContact O-N 3.16Å; S143-F146 PolarHBondContact O-N 3.15Å; F146-R148 PolarHBondContact O-N 3.09Å; F146-T149 CarbonylContact O-C 3.56Å; F146-T149 PolarHBondContact O-N 3.38Å; F146-V150 HydrophobicContact CB-CG2 3.95Å; F146-V150 HydrophobicContact CD1-CG2 4.22Å; F146-V150 HydrophobicContact CG-CG2 4.34Å; F146-V150 PolarHBondContact O-N 3.48Å; F146-V150 VanDerWaalsContact O-N 3.14Å; F146-F151 HydrophobicContact CB-CD2 3.35Å; F146-F151 HydrophobicContact CB-CE2 3.44Å; F146-F151 VanDerWaalsContact CB-CE2 3.44Å; F146-F151 HydrophobicContact CB-CG 4.2Å; F146-F151 HydrophobicContact CB-CZ 4.32Å; F146-F151 AromaticContact CD2-CE2 3.99Å; F146-F151 HydrophobicContact CD2-CE2 3.99Å; F146-F151 HydrophobicContact CG-CD2 4.45Å; F146-F151 HydrophobicContact CG-CE2 4.09Å; F146-F151 WeakPolarHBondContact O-CB 3.33Å; F146-F151 PolarHBondContact O-N 2.98Å; F146-F166 HydrophobicContact CD1-CZ 4.17Å; F146-F166 HydrophobicContact CE1-CE2 4.41Å; F146-F166 AromaticContact CE1-CZ 4Å; F146-F166 HydrophobicContact CE1-CZ 4Å; F146-F166 HydrophobicContact CE2-CZ 4.37Å; F146-F166 HydrophobicContact CG-CZ 4.46Å; F146-F166 HydrophobicContact CZ-CZ 4.09Å
147E95.2Very high94.3Very high100 Ų10056.4 Ų56.447%0.46728%0.281SS..Hα-helixtrans-58-25.4173.6-73.8169-174.600113.9S143 I145 N152S143-E147 WeakPolarHBondContact O-CB 3.37Å; S143-E147 WeakPolarHBondContact O-CG 3.34Å; S143-E147 PolarHBondContact O-N 3.04Å; I145-E147 PolarHBondContact O-N 3.49Å; E147-N152 WeakPolarHBondContact O-CB 3.39Å; E147-N152 PolarHBondContact O-ND2 2.78Å
148R95Very high94.2Very high163 Ų16354 Ų5462%0.61526%0.262SS*.Hα-helixtrans-94.9-10.3176.8-70.1175.6-178.8-170.1-0.8113R144 I145 F146 Y158R144-R148 WeakPolarHBondContact O-CD 3.39Å; R144-R148 VanDerWaalsContact O-CG 3.23Å; R144-R148 WeakPolarHBondContact O-CG 3.06Å; R144-R148 PolarHBondContact O-N 3.35Å; I145-R148 PolarHBondContact O-N 2.93Å; I145-R148 VanDerWaalsContact O-N 3.11Å; F146-R148 PolarHBondContact O-N 3.09Å; R148-Y158 VanDerWaalsContact O-CE2 3.31Å; R148-Y158 WeakPolarHBondContact O-CE2 3.41Å
149T96Very high94.2Very high4 Ų453.9 Ų53.93%0.02526%0.262CS..THydrogen-bonded Turntrans-121.8-95.1-174.966.40000111.3F96 I145 F146 F151 N152 Y158F96-T149 HydrophobicContact CB-CG2 3.85Å; F96-T149 HydrophobicContact CG-CG2 4.43Å; I145-T149 HydrophobicContact CG2-CG2 4.48Å; I145-T149 WeakPolarHBondContact O-CG2 3.4Å; I145-T149 PolarHBondContact O-N 3.37Å; I145-T149 VanDerWaalsContact O-N 3.14Å; I145-T149 PolarHBondContact O-OG1 3.16Å; I145-T149 VanDerWaalsContact O-OG1 3.08Å; F146-T149 CarbonylContact O-C 3.56Å; F146-T149 PolarHBondContact O-N 3.38Å; T149-F151 VanDerWaalsContact C-N 3.35Å; T149-F151 PolarHBondContact O-N 3.01Å; T149-N152 PolarHBondContact O-N 3.33Å; T149-Y158 HydrophobicContact CG2-CD1 4.35Å; T149-Y158 HydrophobicContact CG2-CD2 4.36Å; T149-Y158 HydrophobicContact CG2-CE1 3.66Å; T149-Y158 HydrophobicContact CG2-CE2 3.68Å; T149-Y158 WeakPolarHBondContact CG2-OH 3.39Å
150V96.2Very high94.2Very high1 Ų156.1 Ų56.11%0.00627%0.273CS..THydrogen-bonded Turntrans-73.5-24.1-170.4-620000113.5F96 F146 I162 K163 F166F96-V150 HydrophobicContact CD1-CG1 3.78Å; F96-V150 HydrophobicContact CE1-CG1 3.63Å; F146-V150 HydrophobicContact CB-CG2 3.95Å; F146-V150 HydrophobicContact CD1-CG2 4.22Å; F146-V150 HydrophobicContact CG-CG2 4.34Å; F146-V150 PolarHBondContact O-N 3.48Å; F146-V150 VanDerWaalsContact O-N 3.14Å; V150-I162 HydrophobicContact CG1-CG2 3.8Å; V150-K163 WeakPolarHBondContact O-CG 3.48Å; V150-F166 HydrophobicContact CB-CB 4.16Å; V150-F166 HydrophobicContact CB-CD1 3.88Å; V150-F166 HydrophobicContact CB-CE1 4.43Å; V150-F166 HydrophobicContact CB-CG 3.93Å; V150-F166 HydrophobicContact CG1-CB 4.12Å; V150-F166 HydrophobicContact CG1-CD1 4.4Å; V150-F166 HydrophobicContact CG1-CD2 4.21Å; V150-F166 HydrophobicContact CG1-CG 3.97Å; V150-F166 HydrophobicContact CG2-CD1 3.45Å; V150-F166 VanDerWaalsContact CG2-CD1 3.45Å; V150-F166 HydrophobicContact CG2-CD2 4.32Å; V150-F166 HydrophobicContact CG2-CE1 3.52Å; V150-F166 HydrophobicContact CG2-CE2 4.38Å; V150-F166 HydrophobicContact CG2-CG 3.87Å; V150-F166 HydrophobicContact CG2-CZ 4Å
151F96.4Very high94.3Very high14 Ų1454.9 Ų54.96%0.06127%0.269CS..THydrogen-bonded Turntrans-98.210.6175.5-56-33.2000113.6F146 T149 F166 Y170 P193 Y194 L197F146-F151 HydrophobicContact CB-CD2 3.35Å; F146-F151 HydrophobicContact CB-CE2 3.44Å; F146-F151 VanDerWaalsContact CB-CE2 3.44Å; F146-F151 HydrophobicContact CB-CG 4.2Å; F146-F151 HydrophobicContact CB-CZ 4.32Å; F146-F151 AromaticContact CD2-CE2 3.99Å; F146-F151 HydrophobicContact CD2-CE2 3.99Å; F146-F151 HydrophobicContact CG-CD2 4.45Å; F146-F151 HydrophobicContact CG-CE2 4.09Å; F146-F151 WeakPolarHBondContact O-CB 3.33Å; F146-F151 PolarHBondContact O-N 2.98Å; T149-F151 VanDerWaalsContact C-N 3.35Å; T149-F151 PolarHBondContact O-N 3.01Å; F151-F166 AromaticContact CE1-CD1 3.9Å; F151-F166 HydrophobicContact CE1-CD1 3.9Å; F151-F166 AromaticContact CE1-CE1 3.75Å; F151-F166 HydrophobicContact CE1-CE1 3.75Å; F151-F166 HydrophobicContact CZ-CD1 4.31Å; F151-F166 AromaticContact CZ-CE1 3.67Å; F151-F166 HydrophobicContact CZ-CE1 3.67Å; F151-Y170 HydrophobicContact CZ-CD2 4.28Å; F151-Y170 AromaticContact CZ-CE2 3.78Å; F151-Y170 HydrophobicContact CZ-CE2 3.78Å; F151-P193 HydrophobicContact CB-CB 4.17Å; F151-P193 HydrophobicContact CD1-CB 4.29Å; F151-P193 HydrophobicContact CD2-CB 3.34Å; F151-P193 HydrophobicContact CD2-CG 3.8Å; F151-P193 HydrophobicContact CE2-CB 3.64Å; F151-P193 HydrophobicContact CE2-CG 3.79Å; F151-P193 HydrophobicContact CG-CB 3.7Å; F151-P193 HydrophobicContact CZ-CB 4.24Å; F151-Y194 HydrophobicContact CD1-CE1 4.16Å; F151-Y194 HydrophobicContact CE1-CD1 4.45Å; F151-Y194 AromaticContact CE1-CE1 3.68Å; F151-Y194 HydrophobicContact CE1-CE1 3.68Å; F151-Y194 AromaticContact CE1-CE2 3.96Å; F151-Y194 HydrophobicContact CE1-CE2 3.96Å; F151-Y194 AromaticContact CE1-CZ 3.41Å; F151-Y194 VanDerWaalsContact CE1-CZ 3.41Å; F151-Y194 WeakPolarHBondContact CE1-OH 3.31Å; F151-Y194 HydrophobicContact CZ-CE2 4.12Å; F151-Y194 AromaticContact CZ-CZ 4Å; F151-L197 HydrophobicContact CB-CD1 4.29Å; F151-L197 HydrophobicContact CD1-CD1 4.12Å
152N94.3Very high94.3Very high42 Ų4251.1 Ų51.123%0.22525%0.251CS..  trans-104.9106.1176.2-160.1-50.6000110.6E147 T149 S154 V155 K163E147-N152 WeakPolarHBondContact O-CB 3.39Å; E147-N152 PolarHBondContact O-ND2 2.78Å; T149-N152 PolarHBondContact O-N 3.33Å; N152-S154 VanDerWaalsContact C-N 3.28Å; N152-S154 PolarHBondContact O-N 3.15Å; N152-S154 PolarHBondContact OD1-N 3.49Å; N152-S154 VanDerWaalsContact OD1-N 3.07Å; N152-V155 HydrophobicContact CB-CB 4.22Å; N152-V155 HydrophobicContact CB-CG2 3.95Å; N152-V155 WeakPolarHBondContact OD1-CG2 3.42Å; N152-V155 PolarHBondContact OD1-N 3.19Å; N152-K163 WeakPolarHBondContact O-CE 3.35Å; N152-K163 PolarHBondContact O-NZ 3.33Å
153P93Very high94.3Very high26 Ų2651.7 Ų51.717%0.16925%0.254CS..THydrogen-bonded Turntrans-68.7-30.4-178.927.6-30.9000112V155 K163 L197 I202P153-V155 PolarHBondContact O-N 3.04Å; P153-K163 PolarHBondContact O-NZ 3.11Å; P153-K163 VanDerWaalsContact O-NZ 3.14Å; P153-L197 HydrophobicContact CB-CD2 4.29Å; P153-L197 HydrophobicContact CG-CD2 3.97Å; P153-I202 HydrophobicContact CB-CG2 3.6Å; P153-I202 HydrophobicContact CG-CG2 4.06Å
154S91.3Very high94.4Very high89 Ų8952.8 Ų52.862%0.62226%0.258SS*.THydrogen-bonded Turntrans-82.5-10.1-172.7-49.60000115.2N152N152-S154 VanDerWaalsContact C-N 3.28Å; N152-S154 PolarHBondContact O-N 3.15Å; N152-S154 PolarHBondContact OD1-N 3.49Å; N152-S154 VanDerWaalsContact OD1-N 3.07Å
155V90.4Very high94.5Very high33 Ų3347.5 Ų47.520%0.224%0.239CC..  trans-92.8114.3-179.2179.60000109.7N152 P153 E157 Y158 K163N152-V155 HydrophobicContact CB-CB 4.22Å; N152-V155 HydrophobicContact CB-CG2 3.95Å; N152-V155 WeakPolarHBondContact OD1-CG2 3.42Å; N152-V155 PolarHBondContact OD1-N 3.19Å; P153-V155 PolarHBondContact O-N 3.04Å; V155-E157 HydrophobicContact CG1-CB 4.11Å; V155-E157 WeakPolarHBondContact CG1-OE2 3.45Å; V155-Y158 HydrophobicContact CB-CD2 4.08Å; V155-Y158 HydrophobicContact CG1-CD2 3.4Å; V155-Y158 VanDerWaalsContact CG1-CD2 3.4Å; V155-Y158 HydrophobicContact CG1-CE2 3.63Å; V155-K163 PolarHBondContact O-NZ 3.18Å
156H88.7Confident94.5Very high156 Ų15646.7 Ų46.772%0.72223%0.234SC*.THydrogen-bonded Turntrans-81.6-18.5-175.9-63.4-64.6000113.4Y158H156-Y158 PolarHBondContact O-N 3.46Å; H156-Y158 VanDerWaalsContact O-N 3.14Å
157E90.3Very high94.6Very high133 Ų13346.3 Ų46.362%0.62123%0.233SC*.THydrogen-bonded Turntrans-62.4-15.1172.1-65.791.7147.600112.9G100 V155G100-E157 CarbonylContact C-O 3.41Å; G100-E157 WeakPolarHBondContact CA-O 3.36Å; V155-E157 HydrophobicContact CG1-CB 4.11Å; V155-E157 WeakPolarHBondContact CG1-OE2 3.45Å
158Y93.5Very high94.7Very high27 Ų2743 Ų4311%0.10622%0.221CC..SBendtrans-115.698.6171.6-53.4-73.5000108.5F96 R148 T149 V155 H156 K163F96-Y158 HydrophobicContact CB-CE1 4.3Å; F96-Y158 VanDerWaalsContact O-CE1 3.31Å; F96-Y158 WeakPolarHBondContact O-CE1 3.47Å; R148-Y158 VanDerWaalsContact O-CE2 3.31Å; R148-Y158 WeakPolarHBondContact O-CE2 3.41Å; T149-Y158 HydrophobicContact CG2-CD1 4.35Å; T149-Y158 HydrophobicContact CG2-CD2 4.36Å; T149-Y158 HydrophobicContact CG2-CE1 3.66Å; T149-Y158 HydrophobicContact CG2-CE2 3.68Å; T149-Y158 WeakPolarHBondContact CG2-OH 3.39Å; V155-Y158 HydrophobicContact CB-CD2 4.08Å; V155-Y158 HydrophobicContact CG1-CD2 3.4Å; V155-Y158 VanDerWaalsContact CG1-CD2 3.4Å; V155-Y158 HydrophobicContact CG1-CE2 3.63Å; H156-Y158 PolarHBondContact O-N 3.46Å; H156-Y158 VanDerWaalsContact O-N 3.14Å; Y158-K163 WeakPolarHBondContact O-CE 3.5Å; Y158-K163 PolarHBondContact O-NZ 3.28Å
159P93Very high94.8Very high4 Ų435.2 Ų35.23%0.02619%0.191CC..  trans-58.8152.8-178.3-33.543.8000113.2W103 Y104 G161 I162W103-P159 HydrophobicContact CB-CG 3.97Å; W103-P159 HydrophobicContact CG-CB 4.33Å; W103-P159 HydrophobicContact CG-CG 4.28Å; Y104-P159 HydrophobicContact CD1-CB 4.45Å; Y104-P159 HydrophobicContact CD1-CG 4.29Å; Y104-P159 HydrophobicContact CD2-CG 3.75Å; Y104-P159 HydrophobicContact CE1-CB 3.72Å; Y104-P159 HydrophobicContact CE1-CG 3.85Å; Y104-P159 HydrophobicContact CE2-CB 4Å; Y104-P159 HydrophobicContact CE2-CG 3.28Å; Y104-P159 HydrophobicContact CG-CG 4.24Å; Y104-P159 VanDerWaalsContact CZ-CB 3.46Å; Y104-P159 WeakPolarHBondContact OH-CB 3.48Å; P159-G161 PolarHBondContact O-N 3.48Å; P159-I162 WeakPolarHBondContact O-CB 3.24Å; P159-I162 PolarHBondContact O-N 2.98Å
160E94.2Very high94.9Very high72 Ų7235.2 Ų35.234%0.33619%0.191SC..Hα-helixtrans-56.1-39.8-178.4-171.2173.8150.300112.2I162 K163 L164 S203 S205E160-I162 PolarHBondContact O-N 2.92Å; E160-I162 VanDerWaalsContact O-N 3.1Å; E160-K163 WeakPolarHBondContact O-CA 3.31Å; E160-K163 WeakPolarHBondContact O-CB 3.47Å; E160-K163 PolarHBondContact O-N 2.93Å; E160-L164 HydrophobicContact CG-CD1 4.32Å; E160-L164 HydrophobicContact CG-CD2 4.34Å; E160-L164 HydrophobicContact CG-CG 4.11Å; E160-L164 WeakPolarHBondContact O-CG 3.37Å; E160-L164 PolarHBondContact O-N 2.91Å; E160-S203 WeakPolarHBondContact OE1-CB 3.34Å; E160-S203 PolarHBondContact OE1-OG 3.08Å; E160-S203 PolarHBondContact OE2-OG 2.9Å; E160-S205 PolarHBondContact OE1-OG 3.27Å
161G95Very high94.8Very high28 Ų2836 Ų3629%0.28920%0.195SC..Hα-helixtrans-56.8-29176.800000114.6P159 H165P159-G161 PolarHBondContact O-N 3.48Å; G161-H165 WeakPolarHBondContact O-CB 3.29Å; G161-H165 PolarHBondContact O-N 2.86Å
162I96.1Very high94.8Very high2 Ų239.7 Ų39.71%0.0122%0.216CC..Hα-helixtrans-68.4-44.9170.9-67.4177.8000110.5I99 W103 M118 V150 P159 E160 H165 F166I99-I162 HydrophobicContact CG2-CD1 3.9Å; I99-I162 HydrophobicContact CG2-CG1 4.47Å; W103-I162 HydrophobicContact CB-CD1 3.93Å; W103-I162 HydrophobicContact CB-CG1 4.24Å; W103-I162 HydrophobicContact CD2-CD1 3.81Å; W103-I162 HydrophobicContact CD2-CG1 3.22Å; W103-I162 VanDerWaalsContact CE2-CG1 3.46Å; W103-I162 HydrophobicContact CE3-CD1 3.91Å; W103-I162 HydrophobicContact CE3-CG1 3.49Å; W103-I162 VanDerWaalsContact CE3-CG1 3.49Å; W103-I162 HydrophobicContact CG-CD1 3.85Å; W103-I162 HydrophobicContact CG-CG1 3.59Å; W103-I162 HydrophobicContact CH2-CG1 4.1Å; W103-I162 HydrophobicContact CZ2-CG1 3.89Å; W103-I162 HydrophobicContact CZ3-CG1 3.92Å; M118-I162 HydrophobicContact CE-CG1 4.39Å; M118-I162 HydrophobicContact CE-CG2 3.75Å; M118-I162 HydrophobicContact SD-CG2 4.1Å; V150-I162 HydrophobicContact CG1-CG2 3.8Å; P159-I162 WeakPolarHBondContact O-CB 3.24Å; P159-I162 PolarHBondContact O-N 2.98Å; E160-I162 PolarHBondContact O-N 2.92Å; E160-I162 VanDerWaalsContact O-N 3.1Å; I162-H165 PolarHBondContact O-N 3.47Å; I162-F166 VanDerWaalsContact O-CB 3.28Å; I162-F166 WeakPolarHBondContact O-CB 3.41Å; I162-F166 PolarHBondContact O-N 3.24Å
163K96.8Very high94.8Very high11 Ų1138 Ų385%0.04821%0.206CC..Hα-helixtrans-65.1-43.5-176.6-54.6179.5-174.3164.90110.3V150 N152 P153 V155 Y158 E160 F166 T167 F206V150-K163 WeakPolarHBondContact O-CG 3.48Å; N152-K163 WeakPolarHBondContact O-CE 3.35Å; N152-K163 PolarHBondContact O-NZ 3.33Å; P153-K163 PolarHBondContact O-NZ 3.11Å; P153-K163 VanDerWaalsContact O-NZ 3.14Å; V155-K163 PolarHBondContact O-NZ 3.18Å; Y158-K163 WeakPolarHBondContact O-CE 3.5Å; Y158-K163 PolarHBondContact O-NZ 3.28Å; E160-K163 WeakPolarHBondContact O-CA 3.31Å; E160-K163 WeakPolarHBondContact O-CB 3.47Å; E160-K163 PolarHBondContact O-N 2.93Å; K163-F166 PolarHBondContact O-N 3.22Å; K163-T167 WeakPolarHBondContact O-CB 3.13Å; K163-T167 PolarHBondContact O-N 3.35Å; K163-T167 PolarHBondContact O-OG1 2.86Å; K163-F206 HydrophobicContact CB-CE1 4.04Å; K163-F206 HydrophobicContact CB-CE2 3.94Å; K163-F206 HydrophobicContact CB-CZ 3.66Å; K163-F206 HydrophobicContact CD-CE1 4.05Å; K163-F206 HydrophobicContact CD-CZ 4.43Å
164L97.3Very high94.9Very high45 Ų4537 Ų3724%0.23620%0.199CC..Hα-helixtrans-58.7-52.5174-58.3-178.8000111.1E160 F166 T167 S168 F206 V209E160-L164 HydrophobicContact CG-CD1 4.32Å; E160-L164 HydrophobicContact CG-CD2 4.34Å; E160-L164 HydrophobicContact CG-CG 4.11Å; E160-L164 WeakPolarHBondContact O-CG 3.37Å; E160-L164 PolarHBondContact O-N 2.91Å; L164-F166 PolarHBondContact O-N 2.83Å; L164-T167 WeakPolarHBondContact O-CB 3.19Å; L164-T167 PolarHBondContact O-N 2.78Å; L164-T167 VanDerWaalsContact O-N 3.14Å; L164-S168 PolarHBondContact O-N 2.73Å; L164-F206 VanDerWaalsContact CD2-CA 3.47Å; L164-F206 HydrophobicContact CD2-CB 3.84Å; L164-F206 HydrophobicContact CD2-CD2 3.71Å; L164-F206 HydrophobicContact CD2-CG 4.09Å; L164-V209 HydrophobicContact CD2-CB 4.1Å; L164-V209 HydrophobicContact CD2-CG1 4.5Å; L164-V209 HydrophobicContact CD2-CG2 4.01Å
165H97.4Very high95Very high22 Ų2236.2 Ų36.210%0.10219%0.188CC..Hα-helixtrans-64.3-39.9-179.6-179.261.8000113.1M115 G161 I162 T167 S168 L169M115-H165 VanDerWaalsContact C-NE2 3.28Å; M115-H165 VanDerWaalsContact CA-NE2 3.34Å; M115-H165 WeakPolarHBondContact CA-NE2 3.34Å; M115-H165 WeakPolarHBondContact CB-NE2 3.35Å; M115-H165 HydrophobicContact CE-CB 4.48Å; M115-H165 PolarHBondContact O-NE2 3.44Å; G161-H165 WeakPolarHBondContact O-CB 3.29Å; G161-H165 PolarHBondContact O-N 2.86Å; I162-H165 PolarHBondContact O-N 3.47Å; H165-T167 PolarHBondContact O-N 3.09Å; H165-S168 PolarHBondContact O-N 3.35Å; H165-S168 PolarHBondContact O-OG 3.38Å; H165-S168 VanDerWaalsContact O-OG 3.09Å; H165-L169 WeakPolarHBondContact NE2-CD2 3.46Å; H165-L169 VanDerWaalsContact O-CD2 3.31Å; H165-L169 WeakPolarHBondContact O-CD2 3.28Å; H165-L169 WeakPolarHBondContact O-CG 3.2Å; H165-L169 PolarHBondContact O-N 2.83Å
166F98.2Very high95.1Very high0 Ų038.7 Ų38.70%021%0.207CC..Hα-helixtrans-64-33.5176.1-170.1-93.4000111.6F96 M118 F122 F146 V150 F151 I162 K163 L164 L169 Y170F96-F166 HydrophobicContact CE1-CD2 4.2Å; F96-F166 HydrophobicContact CE1-CE2 4.07Å; F96-F166 AromaticContact CZ-CE2 3.94Å; F96-F166 HydrophobicContact CZ-CE2 3.94Å; M118-F166 HydrophobicContact CG-CD2 4.37Å; M118-F166 HydrophobicContact SD-CB 4.21Å; M118-F166 HydrophobicContact SD-CD2 4.13Å; F122-F166 HydrophobicContact CB-CE2 4.29Å; F122-F166 AromaticContact CD2-CE2 3.64Å; F122-F166 HydrophobicContact CD2-CE2 3.64Å; F122-F166 AromaticContact CD2-CZ 3.61Å; F122-F166 HydrophobicContact CD2-CZ 3.61Å; F122-F166 HydrophobicContact CE2-CE2 4.15Å; F122-F166 AromaticContact CE2-CZ 3.63Å; F122-F166 HydrophobicContact CE2-CZ 3.63Å; F122-F166 AromaticContact CG-CE2 3.98Å; F122-F166 HydrophobicContact CG-CE2 3.98Å; F122-F166 HydrophobicContact CG-CZ 4.28Å; F122-F166 HydrophobicContact CZ-CZ 4.3Å; F146-F166 HydrophobicContact CD1-CZ 4.17Å; F146-F166 HydrophobicContact CE1-CE2 4.41Å; F146-F166 AromaticContact CE1-CZ 4Å; F146-F166 HydrophobicContact CE1-CZ 4Å; F146-F166 HydrophobicContact CE2-CZ 4.37Å; F146-F166 HydrophobicContact CG-CZ 4.46Å; F146-F166 HydrophobicContact CZ-CZ 4.09Å; V150-F166 HydrophobicContact CB-CB 4.16Å; V150-F166 HydrophobicContact CB-CD1 3.88Å; V150-F166 HydrophobicContact CB-CE1 4.43Å; V150-F166 HydrophobicContact CB-CG 3.93Å; V150-F166 HydrophobicContact CG1-CB 4.12Å; V150-F166 HydrophobicContact CG1-CD1 4.4Å; V150-F166 HydrophobicContact CG1-CD2 4.21Å; V150-F166 HydrophobicContact CG1-CG 3.97Å; V150-F166 HydrophobicContact CG2-CD1 3.45Å; V150-F166 VanDerWaalsContact CG2-CD1 3.45Å; V150-F166 HydrophobicContact CG2-CD2 4.32Å; V150-F166 HydrophobicContact CG2-CE1 3.52Å; V150-F166 HydrophobicContact CG2-CE2 4.38Å; V150-F166 HydrophobicContact CG2-CG 3.87Å; V150-F166 HydrophobicContact CG2-CZ 4Å; F151-F166 AromaticContact CE1-CD1 3.9Å; F151-F166 HydrophobicContact CE1-CD1 3.9Å; F151-F166 AromaticContact CE1-CE1 3.75Å; F151-F166 HydrophobicContact CE1-CE1 3.75Å; F151-F166 HydrophobicContact CZ-CD1 4.31Å; F151-F166 AromaticContact CZ-CE1 3.67Å; F151-F166 HydrophobicContact CZ-CE1 3.67Å; I162-F166 VanDerWaalsContact O-CB 3.28Å; I162-F166 WeakPolarHBondContact O-CB 3.41Å; I162-F166 PolarHBondContact O-N 3.24Å; K163-F166 PolarHBondContact O-N 3.22Å; L164-F166 PolarHBondContact O-N 2.83Å; F166-L169 WeakPolarHBondContact O-CG 3.42Å; F166-Y170 HydrophobicContact CD1-CD2 4.24Å; F166-Y170 AromaticContact CE1-CD2 3.52Å; F166-Y170 HydrophobicContact CE1-CD2 3.52Å; F166-Y170 AromaticContact CE1-CE2 3.89Å; F166-Y170 HydrophobicContact CE1-CE2 3.89Å; F166-Y170 HydrophobicContact CZ-CD2 4.02Å; F166-Y170 HydrophobicContact CZ-CE2 4.27Å; F166-Y170 WeakPolarHBondContact O-CB 3.43Å; F166-Y170 PolarHBondContact O-N 3.5Å
167T98.1Very high95.1Very high1 Ų132.1 Ų32.11%0.00618%0.179CC..Hα-helixtrans-68.5-48.5176.2-54.30000111.4K163 L164 H165 L169 Y170 Y194 F206 V209 I210 E213 V214K163-T167 WeakPolarHBondContact O-CB 3.13Å; K163-T167 PolarHBondContact O-N 3.35Å; K163-T167 PolarHBondContact O-OG1 2.86Å; L164-T167 WeakPolarHBondContact O-CB 3.19Å; L164-T167 PolarHBondContact O-N 2.78Å; L164-T167 VanDerWaalsContact O-N 3.14Å; H165-T167 PolarHBondContact O-N 3.09Å; T167-L169 PolarHBondContact O-N 3.36Å; T167-L169 VanDerWaalsContact O-N 3.16Å; T167-Y170 WeakPolarHBondContact O-CB 3.41Å; T167-Y170 PolarHBondContact O-N 3.06Å; T167-Y170 VanDerWaalsContact O-N 3.09Å; T167-Y194 WeakPolarHBondContact CA-OH 3.37Å; T167-Y194 HydrophobicContact CG2-CD1 4.33Å; T167-Y194 HydrophobicContact CG2-CE1 3.65Å; T167-Y194 WeakPolarHBondContact OG1-CE1 3.4Å; T167-F206 WeakPolarHBondContact OG1-CE2 3.28Å; T167-V209 HydrophobicContact CG2-CG1 3.87Å; T167-I210 HydrophobicContact CG2-CG1 3.97Å; T167-E213 HydrophobicContact CG2-CB 4.48Å; T167-V214 HydrophobicContact CG2-CG2 3.77Å
168S97.3Very high95.1Very high30 Ų3025.8 Ų25.821%0.2115%0.149CC..Hα-helixtrans-67.6-13.7-178.968.10000115.2L164 H165L164-S168 PolarHBondContact O-N 2.73Å; H165-S168 PolarHBondContact O-N 3.35Å; H165-S168 PolarHBondContact O-OG 3.38Å; H165-S168 VanDerWaalsContact O-OG 3.09Å
169L97.1Very high94.6Very high0 Ų024.7 Ų24.70%015%0.146CC..THydrogen-bonded Turntrans-102.6-9.9173.469.686.2000113.6M118 R119 F122 H165 F166 T167 E173M118-L169 HydrophobicContact CG-CD2 4.27Å; R119-L169 HydrophobicContact CB-CD2 4.09Å; R119-L169 HydrophobicContact CG-CB 4.45Å; R119-L169 VanDerWaalsContact CZ-CB 3.49Å; F122-L169 HydrophobicContact CB-CD1 3.93Å; F122-L169 HydrophobicContact CD1-CD1 3.35Å; F122-L169 HydrophobicContact CE1-CD1 4.11Å; F122-L169 HydrophobicContact CG-CD1 3.85Å; H165-L169 WeakPolarHBondContact NE2-CD2 3.46Å; H165-L169 VanDerWaalsContact O-CD2 3.31Å; H165-L169 WeakPolarHBondContact O-CD2 3.28Å; H165-L169 WeakPolarHBondContact O-CG 3.2Å; H165-L169 PolarHBondContact O-N 2.83Å; F166-L169 WeakPolarHBondContact O-CG 3.42Å; T167-L169 PolarHBondContact O-N 3.36Å; T167-L169 VanDerWaalsContact O-N 3.16Å; L169-E173 HydrophobicContact CB-CG 4.27Å; L169-E173 HydrophobicContact CD1-CB 4.5Å; L169-E173 HydrophobicContact CD1-CG 4.03Å; L169-E173 WeakPolarHBondContact O-CB 3.12Å; L169-E173 WeakPolarHBondContact O-CG 2.93Å; L169-E173 PolarHBondContact O-N 2.92Å; L169-E173 VanDerWaalsContact O-N 3.08Å
170Y97.7Very high94.2Very high3 Ų330.2 Ų30.21%0.01218%0.175CC..Hα-helixtrans-65.5-54.5-162-172.5-99.2000112.9F122 F151 F166 T167 L174 L190 Y194F122-Y170 AromaticContact CE1-CD2 3.99Å; F122-Y170 HydrophobicContact CE1-CD2 3.99Å; F122-Y170 HydrophobicContact CE1-CE2 4.44Å; F122-Y170 HydrophobicContact CE2-CD2 4.18Å; F122-Y170 HydrophobicContact CE2-CE2 4.03Å; F122-Y170 AromaticContact CZ-CD2 3.51Å; F122-Y170 HydrophobicContact CZ-CD2 3.51Å; F122-Y170 AromaticContact CZ-CE2 3.54Å; F122-Y170 HydrophobicContact CZ-CE2 3.54Å; F122-Y170 HydrophobicContact CZ-CG 4.38Å; F151-Y170 HydrophobicContact CZ-CD2 4.28Å; F151-Y170 AromaticContact CZ-CE2 3.78Å; F151-Y170 HydrophobicContact CZ-CE2 3.78Å; F166-Y170 HydrophobicContact CD1-CD2 4.24Å; F166-Y170 AromaticContact CE1-CD2 3.52Å; F166-Y170 HydrophobicContact CE1-CD2 3.52Å; F166-Y170 AromaticContact CE1-CE2 3.89Å; F166-Y170 HydrophobicContact CE1-CE2 3.89Å; F166-Y170 HydrophobicContact CZ-CD2 4.02Å; F166-Y170 HydrophobicContact CZ-CE2 4.27Å; F166-Y170 WeakPolarHBondContact O-CB 3.43Å; F166-Y170 PolarHBondContact O-N 3.5Å; T167-Y170 WeakPolarHBondContact O-CB 3.41Å; T167-Y170 PolarHBondContact O-N 3.06Å; T167-Y170 VanDerWaalsContact O-N 3.09Å; Y170-L174 HydrophobicContact CD1-CD1 3.63Å; Y170-L174 HydrophobicContact CE1-CD1 3.19Å; Y170-L174 HydrophobicContact CE1-CG 4.37Å; Y170-L174 HydrophobicContact CE2-CD1 4.29Å; Y170-L174 HydrophobicContact CG-CD1 4.36Å; Y170-L174 WeakPolarHBondContact O-CB 3.43Å; Y170-L174 WeakPolarHBondContact O-CG 3.29Å; Y170-L174 PolarHBondContact O-N 3.44Å; Y170-L174 VanDerWaalsContact O-N 3.11Å; Y170-L190 VanDerWaalsContact OH-CD2 3.28Å; Y170-L190 WeakPolarHBondContact OH-CD2 3.21Å; Y170-L190 PolarHBondContact OH-O 3.38Å; Y170-L190 VanDerWaalsContact OH-O 3.11Å; Y170-Y194 WeakPolarHBondContact CB-OH 3.42Å; Y170-Y194 HydrophobicContact CD1-CD2 4.43Å; Y170-Y194 AromaticContact CD1-CE2 3.49Å; Y170-Y194 HydrophobicContact CD1-CE2 3.49Å; Y170-Y194 VanDerWaalsContact CD1-CE2 3.49Å; Y170-Y194 HydrophobicContact CD2-CE2 4.22Å; Y170-Y194 HydrophobicContact CE1-CD2 4.44Å; Y170-Y194 AromaticContact CE1-CE2 3.74Å; Y170-Y194 HydrophobicContact CE1-CE2 3.74Å; Y170-Y194 HydrophobicContact CE2-CE2 4.45Å; Y170-Y194 AromaticContact CG-CE2 3.72Å; Y170-Y194 HydrophobicContact CG-CE2 3.72Å
171L95.8Very high93.9Very high18 Ų1832.3 Ų32.39%0.09418%0.183CC..Hα-helixtrans-67.7-47-178.6-70.8-170.9000111.5E173 L174 D175 L191 V214 A217 I218L171-E173 VanDerWaalsContact C-N 3.3Å; L171-E173 PolarHBondContact O-N 2.91Å; L171-L174 PolarHBondContact O-N 2.86Å; L171-D175 WeakPolarHBondContact O-CB 3.44Å; L171-D175 PolarHBondContact O-N 3.18Å; L171-L191 HydrophobicContact CD2-CD2 3.94Å; L171-V214 HydrophobicContact CD1-CB 4.38Å; L171-V214 HydrophobicContact CD1-CG1 4.07Å; L171-V214 WeakPolarHBondContact CD1-O 3.45Å; L171-V214 HydrophobicContact CD2-CG1 4.49Å; L171-V214 HydrophobicContact CG-CG1 4.34Å; L171-A217 HydrophobicContact CD1-CB 4.36Å; L171-I218 HydrophobicContact CD1-CD1 4Å; L171-I218 HydrophobicContact CD1-CG1 3.75Å
172D94.7Very high93.6Very high92 Ų9231.3 Ų31.349%0.49217%0.171SC..Hα-helixtrans-51.3-48.3177.4-72.2-8.2000112.7R119 S176R119-D172 IonicContact NH1-OD2 2.86Å; D172-S176 WeakPolarHBondContact O-CB 3.34Å; D172-S176 PolarHBondContact O-N 3.3Å
173E95.2Very high93.3Very high6 Ų635.2 Ų35.23%0.02819%0.192CC..Hα-helixtrans-77.4-29.3-176-64.7-60.1148.400112.4R119 F122 R123 L169 L171 S177R119-E173 WeakPolarHBondContact CD-OE1 3.31Å; R119-E173 VanDerWaalsContact CG-CD 3.43Å; R119-E173 HydrophobicContact CG-CG 3.81Å; R119-E173 WeakPolarHBondContact CG-OE1 3.43Å; R119-E173 IonicContact CZ-OE1 2.67Å; R119-E173 IonicContact NE-OE1 2.68Å; R119-E173 IonicContact NH1-OE1 3.65Å; R119-E173 PolarHBondContact NH1-OE1 2.91Å; F122-E173 HydrophobicContact CD1-CB 3.55Å; F122-E173 HydrophobicContact CD1-CG 4.18Å; F122-E173 HydrophobicContact CE1-CB 3.81Å; R123-E173 IonicContact CZ-OE2 2.67Å; R123-E173 IonicContact NE-OE2 2.9Å; R123-E173 PolarHBondContact NE-OE2 2.83Å; R123-E173 IonicContact NH2-OE1 3.08Å; R123-E173 PolarHBondContact NH2-OE1 3.06Å; R123-E173 VanDerWaalsContact NH2-OE1 3.09Å; R123-E173 IonicContact NH2-OE2 3.17Å; R123-E173 PolarHBondContact NH2-OE2 3.41Å; L169-E173 HydrophobicContact CB-CG 4.27Å; L169-E173 HydrophobicContact CD1-CB 4.5Å; L169-E173 HydrophobicContact CD1-CG 4.03Å; L169-E173 WeakPolarHBondContact O-CB 3.12Å; L169-E173 WeakPolarHBondContact O-CG 2.93Å; L169-E173 PolarHBondContact O-N 2.92Å; L169-E173 VanDerWaalsContact O-N 3.08Å; L171-E173 VanDerWaalsContact C-N 3.3Å; L171-E173 PolarHBondContact O-N 2.91Å; E173-S177 WeakPolarHBondContact O-CB 3.41Å; E173-S177 PolarHBondContact O-N 3.47Å; E173-S177 PolarHBondContact O-OG 3.39Å
174L95.2Very high93.1Very high4 Ų436.6 Ų36.62%0.02120%0.203CC..Hα-helixtrans-66.6-48.3170.4-80.9176.4000111.1F122 V126 W134 Y170 L171 S177 S178 G179 L190 L238F122-L174 HydrophobicContact CE1-CG 4.22Å; F122-L174 HydrophobicContact CZ-CD2 4.21Å; F122-L174 HydrophobicContact CZ-CG 4.07Å; V126-L174 HydrophobicContact CG1-CD2 4.18Å; V126-L174 HydrophobicContact CG2-CD2 3.79Å; W134-L174 HydrophobicContact CH2-CD2 4.09Å; Y170-L174 HydrophobicContact CD1-CD1 3.63Å; Y170-L174 HydrophobicContact CE1-CD1 3.19Å; Y170-L174 HydrophobicContact CE1-CG 4.37Å; Y170-L174 HydrophobicContact CE2-CD1 4.29Å; Y170-L174 HydrophobicContact CG-CD1 4.36Å; Y170-L174 WeakPolarHBondContact O-CB 3.43Å; Y170-L174 WeakPolarHBondContact O-CG 3.29Å; Y170-L174 PolarHBondContact O-N 3.44Å; Y170-L174 VanDerWaalsContact O-N 3.11Å; L171-L174 PolarHBondContact O-N 2.86Å; L174-S177 PolarHBondContact O-N 3.24Å; L174-S178 CarbonylContact O-C 3.21Å; L174-S178 WeakPolarHBondContact O-CA 3.14Å; L174-S178 WeakPolarHBondContact O-CB 3.42Å; L174-S178 PolarHBondContact O-N 3.49Å; L174-G179 PolarHBondContact O-N 3.4Å; L174-L190 HydrophobicContact CD1-CB 4.49Å; L174-L190 HydrophobicContact CD1-CD1 4.21Å; L174-L190 HydrophobicContact CD2-CD1 4.2Å; L174-L238 HydrophobicContact CB-CD1 4.2Å
175D93.8Very high92.7Very high73 Ų7342.9 Ų42.939%0.3922%0.224SC..Hα-helixtrans-63.9-50.2-179.4-169.843.1000111L171 S177 G179 G237 L238L171-D175 WeakPolarHBondContact O-CB 3.44Å; L171-D175 PolarHBondContact O-N 3.18Å; D175-S177 PolarHBondContact O-N 3.11Å; D175-S177 VanDerWaalsContact O-N 3.16Å; D175-G179 WeakPolarHBondContact O-CA 3.36Å; D175-G179 PolarHBondContact O-N 2.97Å; D175-G237 WeakPolarHBondContact OD1-CA 3.28Å; D175-L238 HydrophobicContact CB-CD1 3.88Å; D175-L238 HydrophobicContact CB-CG 3.97Å; D175-L238 PolarHBondContact OD1-N 2.88Å
176S91.8Very high92.4Very high85 Ų8544 Ų4459%0.59423%0.229SC*.Hα-helixtrans-60.5-29.2178.5178.60000113.7D172D172-S176 WeakPolarHBondContact O-CB 3.34Å; D172-S176 PolarHBondContact O-N 3.3Å
177S89.2Confident92.2Very high19 Ų1944.2 Ų44.213%0.13323%0.23CC..Hα-helixtrans-100.7-27.1-174.8-55.20000114.2R123 V126 N130 E173 L174 D175R123-S177 WeakPolarHBondContact CG-OG 3.29Å; V126-S177 VanDerWaalsContact CG1-CB 3.47Å; N130-S177 PolarHBondContact ND2-O 3.45Å; E173-S177 WeakPolarHBondContact O-CB 3.41Å; E173-S177 PolarHBondContact O-N 3.47Å; E173-S177 PolarHBondContact O-OG 3.39Å; L174-S177 PolarHBondContact O-N 3.24Å; D175-S177 PolarHBondContact O-N 3.11Å; D175-S177 VanDerWaalsContact O-N 3.16Å
178S89.4Confident92Very high0 Ų044.2 Ų44.20%023%0.23CC..Hα-helixtrans-148.67.5-164.5-65.60000114.5V126 N130 L174 D180 K181 L182V126-S178 WeakPolarHBondContact CG1-OG 3.49Å; N130-S178 PolarHBondContact ND2-OG 3.15Å; N130-S178 PolarHBondContact OD1-OG 3.22Å; L174-S178 CarbonylContact O-C 3.21Å; L174-S178 WeakPolarHBondContact O-CA 3.14Å; L174-S178 WeakPolarHBondContact O-CB 3.42Å; L174-S178 PolarHBondContact O-N 3.49Å; S178-D180 PolarHBondContact O-N 2.89Å; S178-K181 PolarHBondContact O-N 3Å; S178-L182 PolarHBondContact O-N 3.05Å; S178-L182 VanDerWaalsContact O-N 3.14Å
179G83.9Confident91.8Very high3 Ų345 Ų453%0.03123%0.233CC..THydrogen-bonded Turntrans-51.3-42.1-177.900000112.9L174 D175 K181 G237L174-G179 PolarHBondContact O-N 3.4Å; D175-G179 WeakPolarHBondContact O-CA 3.36Å; D175-G179 PolarHBondContact O-N 2.97Å; G179-K181 PolarHBondContact O-N 2.95Å; G179-G237 CarbonylContact C-O 3.43Å; G179-G237 CarbonylContact O-C 3.39Å
180D84.7Confident91.7Very high120 Ų12045.5 Ų45.564%0.64224%0.236SC*.THydrogen-bonded Turntrans-80.2-9.9179.866.9-31.8000115.2S178S178-D180 PolarHBondContact O-N 2.89Å
181K87.5Confident91.7Very high117 Ų11745.4 Ų45.451%0.50924%0.236SC..THydrogen-bonded Turntrans-109.3-19.8-172.5-70.5169.3-169.5171.60114N130 S178 G179N130-K181 HydrophobicContact CB-CD 4.25Å; S178-K181 PolarHBondContact O-N 3Å; G179-K181 PolarHBondContact O-N 2.95Å
182L89.7Confident91.7Very high7 Ų748.8 Ų48.84%0.03725%0.25CS..  trans-90.3131.6-179.1-77.3167.6000110.3W134 S178 Q186 V187 L190 L238W134-L182 HydrophobicContact CD2-CD2 3.55Å; W134-L182 HydrophobicContact CE3-CD2 3.81Å; W134-L182 HydrophobicContact CG-CD2 4.17Å; W134-L182 HydrophobicContact CH2-CD1 3.93Å; W134-L182 HydrophobicContact CH2-CD2 3.77Å; W134-L182 HydrophobicContact CH2-CG 4.25Å; W134-L182 HydrophobicContact CZ2-CD1 3.71Å; W134-L182 HydrophobicContact CZ2-CD2 3.51Å; W134-L182 HydrophobicContact CZ2-CG 3.72Å; W134-L182 HydrophobicContact CZ3-CD2 3.91Å; S178-L182 PolarHBondContact O-N 3.05Å; S178-L182 VanDerWaalsContact O-N 3.14Å; L182-Q186 HydrophobicContact CD2-CB 3.67Å; L182-Q186 HydrophobicContact CD2-CG 4.45Å; L182-V187 HydrophobicContact CB-CG2 3.8Å; L182-V187 HydrophobicContact CD1-CG2 4.41Å; L182-L190 HydrophobicContact CD1-CD1 3.76Å; L182-L190 HydrophobicContact CD2-CD1 4.02Å; L182-L238 HydrophobicContact CB-CD2 4.25Å; L182-L238 HydrophobicContact CD1-CD2 3.62Å
183N89.4Confident91.8Very high83 Ų8345.4 Ų45.444%0.44423%0.233SC..  trans-82.7161.3166.665.158000111R185 Q186 V187N183-R185 VanDerWaalsContact C-N 3.28Å; N183-R185 PolarHBondContact O-N 3.31Å; N183-R185 WeakPolarHBondContact OD1-CB 3.44Å; N183-R185 PolarHBondContact OD1-N 3.01Å; N183-Q186 VanDerWaalsContact N-OE1 3.16Å; N183-Q186 PolarHBondContact ND2-OE1 2.89Å; N183-Q186 WeakPolarHBondContact O-CB 3.48Å; N183-Q186 PolarHBondContact O-N 2.77Å; N183-Q186 WeakPolarHBondContact OD1-CG 3.38Å; N183-Q186 PolarHBondContact OD1-N 2.97Å; N183-V187 WeakPolarHBondContact O-CG2 3.49Å; N183-V187 PolarHBondContact O-N 3.24Å
184S91.5Very high91.9Very high41 Ų4145.1 Ų45.129%0.28723%0.231SC..Hα-helixtrans-53.4-42.4-177.154.90000113.6Q186 V187 T188 Q239S184-Q186 VanDerWaalsContact C-N 3.35Å; S184-Q186 PolarHBondContact O-N 3.15Å; S184-V187 WeakPolarHBondContact O-CB 2.99Å; S184-V187 PolarHBondContact O-N 3.45Å; S184-V187 VanDerWaalsContact O-N 3.14Å; S184-T188 PolarHBondContact O-N 3.33Å; S184-T188 PolarHBondContact O-OG1 3.49Å; S184-T188 VanDerWaalsContact O-OG1 3.04Å; S184-Q239 VanDerWaalsContact CA-O 3.31Å; S184-Q239 WeakPolarHBondContact CA-O 3.3Å
185R90.4Very high92Very high176 Ų17645 Ų4566%0.66423%0.231SC*.Hα-helixtrans-61.9-38.9177.6-174.1-178.8179.7-167.50.1113.4N183 T189 E244N183-R185 VanDerWaalsContact C-N 3.28Å; N183-R185 PolarHBondContact O-N 3.31Å; N183-R185 WeakPolarHBondContact OD1-CB 3.44Å; N183-R185 PolarHBondContact OD1-N 3.01Å; R185-T189 WeakPolarHBondContact O-CB 3.47Å; R185-T189 PolarHBondContact O-N 2.77Å; R185-T189 PolarHBondContact O-OG1 2.93Å; R185-E244 WeakPolarHBondContact CA-OE2 3.27Å
186Q90.6Very high92.1Very high47 Ų4745.3 Ų45.322%0.2223%0.233CC..Hα-helixtrans-68-40.5175.2-71.1172.6-4500110.8L182 N183 S184 T189 L190L182-Q186 HydrophobicContact CD2-CB 3.67Å; L182-Q186 HydrophobicContact CD2-CG 4.45Å; N183-Q186 VanDerWaalsContact N-OE1 3.16Å; N183-Q186 PolarHBondContact ND2-OE1 2.89Å; N183-Q186 WeakPolarHBondContact O-CB 3.48Å; N183-Q186 PolarHBondContact O-N 2.77Å; N183-Q186 WeakPolarHBondContact OD1-CG 3.38Å; N183-Q186 PolarHBondContact OD1-N 2.97Å; S184-Q186 VanDerWaalsContact C-N 3.35Å; S184-Q186 PolarHBondContact O-N 3.15Å; Q186-T189 WeakPolarHBondContact O-CB 3.42Å; Q186-T189 PolarHBondContact O-N 3.23Å; Q186-L190 WeakPolarHBondContact O-CG 3.43Å; Q186-L190 PolarHBondContact O-N 3.43Å
187V93.7Very high92.3Very high4 Ų441.3 Ų41.32%0.02420%0.204CC..Hα-helixtrans-60.7-49.5174.3-178.70000110.5L182 N183 S184 T189 L190 L191 L238 Q239 F240L182-V187 HydrophobicContact CB-CG2 3.8Å; L182-V187 HydrophobicContact CD1-CG2 4.41Å; N183-V187 WeakPolarHBondContact O-CG2 3.49Å; N183-V187 PolarHBondContact O-N 3.24Å; S184-V187 WeakPolarHBondContact O-CB 2.99Å; S184-V187 PolarHBondContact O-N 3.45Å; S184-V187 VanDerWaalsContact O-N 3.14Å; V187-T189 PolarHBondContact O-N 2.95Å; V187-L190 WeakPolarHBondContact O-CA 3.41Å; V187-L190 WeakPolarHBondContact O-CB 3.35Å; V187-L190 PolarHBondContact O-N 2.85Å; V187-L191 HydrophobicContact CG1-CD1 4.35Å; V187-L191 WeakPolarHBondContact O-CG 3.5Å; V187-L191 PolarHBondContact O-N 3.09Å; V187-L238 HydrophobicContact CG2-CB 4.49Å; V187-L238 HydrophobicContact CG2-CD2 3.8Å; V187-Q239 WeakPolarHBondContact CG2-O 3.43Å; V187-F240 HydrophobicContact CG1-CD1 3.57Å; V187-F240 HydrophobicContact CG1-CE1 3.42Å; V187-F240 VanDerWaalsContact CG1-CE1 3.42Å; V187-F240 HydrophobicContact CG1-CZ 4.35Å
188T94.5Very high92.6Very high1 Ų140.5 Ų40.51%0.00620%0.199CC..Hα-helixtrans-55.9-40.8174.9-51.10000111.5S184 L190 L191 K192 E244 I245S184-T188 PolarHBondContact O-N 3.33Å; S184-T188 PolarHBondContact O-OG1 3.49Å; S184-T188 VanDerWaalsContact O-OG1 3.04Å; T188-L190 PolarHBondContact O-N 3.12Å; T188-L191 PolarHBondContact O-N 2.84Å; T188-K192 PolarHBondContact O-N 3.03Å; T188-E244 VanDerWaalsContact CB-OE2 3.32Å; T188-E244 WeakPolarHBondContact CB-OE2 3.32Å; T188-E244 HydrophobicContact CG2-CB 4.27Å; T188-E244 HydrophobicContact CG2-CG 3.86Å; T188-E244 PolarHBondContact OG1-OE2 3.13Å; T188-I245 HydrophobicContact CG2-CG1 4.15Å
189T93.2Very high92.9Very high45 Ų4542 Ų4228%0.27621%0.211SC..Hα-helixtrans-65.5-36.9177.2-590000112.7F139 R185 Q186 V187 L191 K192F139-T189 HydrophobicContact CE1-CG2 3.76Å; F139-T189 HydrophobicContact CZ-CG2 4.12Å; R185-T189 WeakPolarHBondContact O-CB 3.47Å; R185-T189 PolarHBondContact O-N 2.77Å; R185-T189 PolarHBondContact O-OG1 2.93Å; Q186-T189 WeakPolarHBondContact O-CB 3.42Å; Q186-T189 PolarHBondContact O-N 3.23Å; V187-T189 PolarHBondContact O-N 2.95Å; T189-L191 VanDerWaalsContact C-N 3.28Å; T189-L191 PolarHBondContact O-N 2.94Å; T189-K192 PolarHBondContact O-N 3.27Å
190L94.4Very high93.3Very high11 Ų1145.5 Ų45.56%0.05823%0.226CC..Hα-helixtrans-67.1-27.6173.9-76.3161.2000112.6W134 F139 Y170 L174 L182 Q186 V187 T188 P193W134-L190 HydrophobicContact CH2-CD1 3.96Å; W134-L190 HydrophobicContact CZ3-CD1 3.91Å; W134-L190 HydrophobicContact CZ3-CD2 4.11Å; W134-L190 HydrophobicContact CZ3-CG 4.45Å; F139-L190 HydrophobicContact CE2-CD2 3.52Å; F139-L190 HydrophobicContact CE2-CG 4.12Å; F139-L190 HydrophobicContact CZ-CD2 3.89Å; F139-L190 HydrophobicContact CZ-CG 4.1Å; Y170-L190 VanDerWaalsContact OH-CD2 3.28Å; Y170-L190 WeakPolarHBondContact OH-CD2 3.21Å; Y170-L190 PolarHBondContact OH-O 3.38Å; Y170-L190 VanDerWaalsContact OH-O 3.11Å; L174-L190 HydrophobicContact CD1-CB 4.49Å; L174-L190 HydrophobicContact CD1-CD1 4.21Å; L174-L190 HydrophobicContact CD2-CD1 4.2Å; L182-L190 HydrophobicContact CD1-CD1 3.76Å; L182-L190 HydrophobicContact CD2-CD1 4.02Å; Q186-L190 WeakPolarHBondContact O-CG 3.43Å; Q186-L190 PolarHBondContact O-N 3.43Å; V187-L190 WeakPolarHBondContact O-CA 3.41Å; V187-L190 WeakPolarHBondContact O-CB 3.35Å; V187-L190 PolarHBondContact O-N 2.85Å; T188-L190 PolarHBondContact O-N 3.12Å; L190-P193 WeakPolarHBondContact O-CD 3.48Å
191L96.6Very high93.7Very high1 Ų147.2 Ų47.21%0.00524%0.236CC..Hα-helixtrans-81.2-23.8178-64.4175.8000113.7L171 V187 T188 T189 P193 Y194 I195 V214 I218 F240 I245L171-L191 HydrophobicContact CD2-CD2 3.94Å; V187-L191 HydrophobicContact CG1-CD1 4.35Å; V187-L191 WeakPolarHBondContact O-CG 3.5Å; V187-L191 PolarHBondContact O-N 3.09Å; T188-L191 PolarHBondContact O-N 2.84Å; T189-L191 VanDerWaalsContact C-N 3.28Å; T189-L191 PolarHBondContact O-N 2.94Å; L191-P193 VanDerWaalsContact C-N 3.33Å; L191-P193 VanDerWaalsContact O-N 3.16Å; L191-Y194 PolarHBondContact O-N 3.36Å; L191-I195 PolarHBondContact O-N 3.49Å; L191-V214 HydrophobicContact CD2-CG1 3.66Å; L191-I218 HydrophobicContact CD1-CD1 3.81Å; L191-I218 HydrophobicContact CD2-CD1 4.1Å; L191-F240 HydrophobicContact CD1-CD1 4.38Å; L191-F240 HydrophobicContact CD1-CE1 4.37Å; L191-I245 HydrophobicContact CD1-CD1 3.8Å; L191-I245 HydrophobicContact CD1-CG1 4.1Å
192K95.9Very high94.1Very high90 Ų9042.4 Ų42.439%0.39122%0.215SC..Hα-helixtrans-49-40.9-178-76.1177.1-178.4173.40115.2T188 T189 Y194 I195 N196T188-K192 PolarHBondContact O-N 3.03Å; T189-K192 PolarHBondContact O-N 3.27Å; K192-Y194 VanDerWaalsContact C-N 3.31Å; K192-Y194 PolarHBondContact O-N 3.37Å; K192-I195 PolarHBondContact O-N 3.24Å; K192-N196 PolarHBondContact O-N 2.86Å; K192-N196 PolarHBondContact O-ND2 3.43Å
193P96.6Very high94.3Very high20 Ų2043.9 Ų43.913%0.1323%0.226CC..Hα-helixtrans-58.2-39.9176.1-25.836.2000113.5F151 L190 L191 N196 L197F151-P193 HydrophobicContact CB-CB 4.17Å; F151-P193 HydrophobicContact CD1-CB 4.29Å; F151-P193 HydrophobicContact CD2-CB 3.34Å; F151-P193 HydrophobicContact CD2-CG 3.8Å; F151-P193 HydrophobicContact CE2-CB 3.64Å; F151-P193 HydrophobicContact CE2-CG 3.79Å; F151-P193 HydrophobicContact CG-CB 3.7Å; F151-P193 HydrophobicContact CZ-CB 4.24Å; L190-P193 WeakPolarHBondContact O-CD 3.48Å; L191-P193 VanDerWaalsContact C-N 3.33Å; L191-P193 VanDerWaalsContact O-N 3.16Å; P193-N196 PolarHBondContact O-N 3.49Å; P193-L197 VanDerWaalsContact O-CG 3.29Å; P193-L197 WeakPolarHBondContact O-CG 3.33Å; P193-L197 PolarHBondContact O-N 3.44Å
194Y97.7Very high94.6Very high0 Ų044.5 Ų44.50%024%0.237CC..Hα-helixtrans-71.2-38.3176.8-68.4-62.3000112.5F151 T167 Y170 L191 K192 N196 L197 L198 I210 V214F151-Y194 HydrophobicContact CD1-CE1 4.16Å; F151-Y194 HydrophobicContact CE1-CD1 4.45Å; F151-Y194 AromaticContact CE1-CE1 3.68Å; F151-Y194 HydrophobicContact CE1-CE1 3.68Å; F151-Y194 AromaticContact CE1-CE2 3.96Å; F151-Y194 HydrophobicContact CE1-CE2 3.96Å; F151-Y194 AromaticContact CE1-CZ 3.41Å; F151-Y194 VanDerWaalsContact CE1-CZ 3.41Å; F151-Y194 WeakPolarHBondContact CE1-OH 3.31Å; F151-Y194 HydrophobicContact CZ-CE2 4.12Å; F151-Y194 AromaticContact CZ-CZ 4Å; T167-Y194 WeakPolarHBondContact CA-OH 3.37Å; T167-Y194 HydrophobicContact CG2-CD1 4.33Å; T167-Y194 HydrophobicContact CG2-CE1 3.65Å; T167-Y194 WeakPolarHBondContact OG1-CE1 3.4Å; Y170-Y194 WeakPolarHBondContact CB-OH 3.42Å; Y170-Y194 HydrophobicContact CD1-CD2 4.43Å; Y170-Y194 AromaticContact CD1-CE2 3.49Å; Y170-Y194 HydrophobicContact CD1-CE2 3.49Å; Y170-Y194 VanDerWaalsContact CD1-CE2 3.49Å; Y170-Y194 HydrophobicContact CD2-CE2 4.22Å; Y170-Y194 HydrophobicContact CE1-CD2 4.44Å; Y170-Y194 AromaticContact CE1-CE2 3.74Å; Y170-Y194 HydrophobicContact CE1-CE2 3.74Å; Y170-Y194 HydrophobicContact CE2-CE2 4.45Å; Y170-Y194 AromaticContact CG-CE2 3.72Å; Y170-Y194 HydrophobicContact CG-CE2 3.72Å; L191-Y194 PolarHBondContact O-N 3.36Å; K192-Y194 VanDerWaalsContact C-N 3.31Å; K192-Y194 PolarHBondContact O-N 3.37Å; Y194-N196 VanDerWaalsContact C-N 3.3Å; Y194-N196 PolarHBondContact O-N 3.09Å; Y194-L197 HydrophobicContact CD1-CD1 3.95Å; Y194-L197 HydrophobicContact CE1-CD1 4.42Å; Y194-L197 WeakPolarHBondContact O-CB 3.37Å; Y194-L197 PolarHBondContact O-N 2.79Å; Y194-L197 VanDerWaalsContact O-N 3.16Å; Y194-L198 PolarHBondContact O-N 3.47Å; Y194-I210 HydrophobicContact CD1-CD1 4.2Å; Y194-I210 HydrophobicContact CD1-CG1 3.89Å; Y194-I210 HydrophobicContact CD1-CG2 4.07Å; Y194-I210 HydrophobicContact CE1-CG1 4.36Å; Y194-I210 HydrophobicContact CG-CG2 4.33Å; Y194-V214 HydrophobicContact CD1-CG2 4.39Å; Y194-V214 HydrophobicContact CD2-CG1 4.14Å; Y194-V214 HydrophobicContact CD2-CG2 4.07Å; Y194-V214 HydrophobicContact CE1-CG2 4.47Å; Y194-V214 HydrophobicContact CE2-CG2 4.14Å; Y194-V214 HydrophobicContact CG-CG2 4.19Å
195I97.2Very high94.8Very high2 Ų245 Ų451%0.0124%0.241CC..Hα-helixtrans-57.6-47.3172.8-58.8174.9000110L191 K192 L197 L198 A199 F215 A248 I249 V252L191-I195 PolarHBondContact O-N 3.49Å; K192-I195 PolarHBondContact O-N 3.24Å; I195-L197 VanDerWaalsContact C-N 3.32Å; I195-L197 PolarHBondContact O-N 3.39Å; I195-L198 PolarHBondContact O-N 3.05Å; I195-A199 PolarHBondContact O-N 3.08Å; I195-F215 HydrophobicContact CG1-CE1 4.01Å; I195-F215 HydrophobicContact CG1-CZ 3.7Å; I195-A248 HydrophobicContact CD1-CB 3.72Å; I195-I249 HydrophobicContact CD1-CG1 3.87Å; I195-I249 HydrophobicContact CG1-CG1 3.9Å; I195-I249 HydrophobicContact CG2-CB 4.35Å; I195-I249 HydrophobicContact CG2-CG1 4.01Å; I195-V252 HydrophobicContact CG2-CB 3.92Å; I195-V252 HydrophobicContact CG2-CG1 4.2Å; I195-V252 HydrophobicContact CG2-CG2 3.89Å
196N96.2Very high95.1Very high79 Ų7936.9 Ų36.942%0.42221%0.21SC..Hα-helixtrans-65.6-33.1177.6-71.3-30000112.9K192 P193 Y194 A199 Q200K192-N196 PolarHBondContact O-N 2.86Å; K192-N196 PolarHBondContact O-ND2 3.43Å; P193-N196 PolarHBondContact O-N 3.49Å; Y194-N196 VanDerWaalsContact C-N 3.3Å; Y194-N196 PolarHBondContact O-N 3.09Å; N196-A199 PolarHBondContact O-N 2.73Å; N196-Q200 VanDerWaalsContact O-CG 3.31Å; N196-Q200 WeakPolarHBondContact O-CG 3.5Å; N196-Q200 PolarHBondContact O-N 3.2Å; N196-Q200 PolarHBondContact O-NE2 3.36Å
197L96.5Very high95.3Very high1 Ų136.3 Ų36.31%0.00521%0.208CC..Hα-helixtrans-67.5-41.4176.2-80.1166.2000111.7F151 P153 P193 Y194 I195 A199 Q200 I202 F206 I210F151-L197 HydrophobicContact CB-CD1 4.29Å; F151-L197 HydrophobicContact CD1-CD1 4.12Å; P153-L197 HydrophobicContact CB-CD2 4.29Å; P153-L197 HydrophobicContact CG-CD2 3.97Å; P193-L197 VanDerWaalsContact O-CG 3.29Å; P193-L197 WeakPolarHBondContact O-CG 3.33Å; P193-L197 PolarHBondContact O-N 3.44Å; Y194-L197 HydrophobicContact CD1-CD1 3.95Å; Y194-L197 HydrophobicContact CE1-CD1 4.42Å; Y194-L197 WeakPolarHBondContact O-CB 3.37Å; Y194-L197 PolarHBondContact O-N 2.79Å; Y194-L197 VanDerWaalsContact O-N 3.16Å; I195-L197 VanDerWaalsContact C-N 3.32Å; I195-L197 PolarHBondContact O-N 3.39Å; L197-A199 PolarHBondContact O-N 2.71Å; L197-Q200 PolarHBondContact O-N 3.16Å; L197-I202 HydrophobicContact CD2-CG2 4.24Å; L197-F206 HydrophobicContact CD1-CE1 4.26Å; L197-F206 HydrophobicContact CD1-CZ 3.87Å; L197-F206 HydrophobicContact CD2-CE1 4.02Å; L197-F206 HydrophobicContact CD2-CZ 4.45Å; L197-I210 HydrophobicContact CB-CD1 3.77Å; L197-I210 HydrophobicContact CD1-CD1 4.07Å
198L95.9Very high95.5Very high3 Ų338.9 Ų38.92%0.01622%0.223CC..Hα-helixtrans-61.4-28.4177.4-71.3-178.7000112.8Y194 I195 E207 I210 R211 F215 K261 L265 I268Y194-L198 PolarHBondContact O-N 3.47Å; I195-L198 PolarHBondContact O-N 3.05Å; L198-E207 HydrophobicContact CD2-CG 3.89Å; L198-I210 HydrophobicContact CD1-CG2 4.2Å; L198-I210 HydrophobicContact CD2-CB 4.02Å; L198-I210 HydrophobicContact CD2-CG2 3.68Å; L198-I210 HydrophobicContact CG-CG2 3.78Å; L198-R211 HydrophobicContact CD2-CG 4.17Å; L198-F215 HydrophobicContact CD1-CD2 3.73Å; L198-F215 HydrophobicContact CD1-CE2 3.31Å; L198-F215 HydrophobicContact CD1-CZ 4.06Å; L198-F215 HydrophobicContact CG-CE2 4.16Å; L198-K261 WeakPolarHBondContact O-CD 3.35Å; L198-K261 WeakPolarHBondContact O-CE 3.31Å; L198-K261 WeakPolarHBondContact O-CG 3.09Å; L198-L265 HydrophobicContact CB-CD2 3.73Å; L198-L265 HydrophobicContact CD1-CD2 4.02Å; L198-I268 HydrophobicContact CD1-CD1 4.05Å
199A94.4Very high95.7Very high30 Ų3040.2 Ų40.225%0.24823%0.232CC..THydrogen-bonded Turntrans-83.8-11.8174.100000115I195 N196 L197 V252 V256 L265I195-A199 PolarHBondContact O-N 3.08Å; N196-A199 PolarHBondContact O-N 2.73Å; L197-A199 PolarHBondContact O-N 2.71Å; A199-V252 HydrophobicContact CB-CG1 3.19Å; A199-V256 HydrophobicContact CB-CG2 3.48Å; A199-V256 VanDerWaalsContact CB-CG2 3.48Å; A199-L265 HydrophobicContact CB-CD1 4.44Å
200Q93.7Very high95.9Very high77 Ų7738.1 Ų38.136%0.3622%0.218SC..SBendtrans-88168178.4-75.8171.663.800111.6N196 L197 I202 K261N196-Q200 VanDerWaalsContact O-CG 3.31Å; N196-Q200 WeakPolarHBondContact O-CG 3.5Å; N196-Q200 PolarHBondContact O-N 3.2Å; N196-Q200 PolarHBondContact O-NE2 3.36Å; L197-Q200 PolarHBondContact O-N 3.16Å; Q200-I202 HydrophobicContact CB-CG2 4.34Å; Q200-I202 PolarHBondContact O-N 2.92Å; Q200-K261 PolarHBondContact O-NZ 3.31Å
201N92.3Very high96Very high156 Ų15641.1 Ų41.183%0.83423%0.229SC*.  trans-80.296.6171.2-169.514.2000109.7
202I94.7Very high96Very high16 Ų1646.2 Ų46.28%0.08225%0.253CS..  trans-118.2163.2176.463.1174.6000109.7P153 L197 Q200 F206 E207 I210P153-I202 HydrophobicContact CB-CG2 3.6Å; P153-I202 HydrophobicContact CG-CG2 4.06Å; L197-I202 HydrophobicContact CD2-CG2 4.24Å; Q200-I202 HydrophobicContact CB-CG2 4.34Å; Q200-I202 PolarHBondContact O-N 2.92Å; I202-F206 HydrophobicContact CB-CD1 4.06Å; I202-F206 HydrophobicContact CD1-CB 4.36Å; I202-F206 HydrophobicContact CD1-CD1 4.15Å; I202-F206 HydrophobicContact CD1-CG 4.28Å; I202-F206 HydrophobicContact CG2-CD1 4.19Å; I202-E207 HydrophobicContact CD1-CB 3.95Å; I202-E207 HydrophobicContact CD1-CG 4.49Å; I202-E207 HydrophobicContact CG1-CB 4.13Å; I202-I210 HydrophobicContact CD1-CD1 3.75Å
203S94.8Very high96.1Very high38 Ų3845.7 Ų45.727%0.26625%0.252SS..  trans-62.4153.1174.757.80000111.3E160 S205 F206 E207E160-S203 WeakPolarHBondContact OE1-CB 3.34Å; E160-S203 PolarHBondContact OE1-OG 3.08Å; E160-S203 PolarHBondContact OE2-OG 2.9Å; S203-S205 VanDerWaalsContact C-N 3.27Å; S203-S205 PolarHBondContact O-N 2.91Å; S203-S205 PolarHBondContact OG-OG 3.22Å; S203-F206 PolarHBondContact O-N 3.31Å; S203-F206 VanDerWaalsContact O-N 3.14Å; S203-F206 WeakPolarHBondContact OG-CB 3.46Å; S203-F206 PolarHBondContact OG-N 3.09Å; S203-E207 PolarHBondContact O-N 3.32Å
204S95.1Very high96.2Very high96 Ų9644.8 Ų44.867%0.67125%0.246SC*.Hα-helixtrans-59.9-38.617655.50000112F206 E207 T208S204-F206 VanDerWaalsContact C-N 3.34Å; S204-F206 PolarHBondContact O-N 2.65Å; S204-E207 PolarHBondContact O-N 3.33Å; S204-T208 WeakPolarHBondContact O-CB 3.32Å; S204-T208 PolarHBondContact O-N 3.47Å; S204-T208 PolarHBondContact O-OG1 3.45Å; S204-T208 VanDerWaalsContact O-OG1 3.05Å
205S95.7Very high96.2Very high53 Ų5344.8 Ų44.837%0.37125%0.246SC..Hα-helixtrans-58.8-43.7174.235.80000112.4E160 S203 V209E160-S205 PolarHBondContact OE1-OG 3.27Å; S203-S205 VanDerWaalsContact C-N 3.27Å; S203-S205 PolarHBondContact O-N 2.91Å; S203-S205 PolarHBondContact OG-OG 3.22Å; S205-V209 WeakPolarHBondContact O-CG2 3.47Å; S205-V209 PolarHBondContact O-N 3.16Å; S205-V209 VanDerWaalsContact O-N 3.12Å
206F96.6Very high96.1Very high4 Ų446.5 Ų46.52%0.01826%0.255CS..Hα-helixtrans-72.1-39.1179.5-168.3-161.9000111.8K163 L164 T167 L197 I202 S203 S204 V209 I210K163-F206 HydrophobicContact CB-CE1 4.04Å; K163-F206 HydrophobicContact CB-CE2 3.94Å; K163-F206 HydrophobicContact CB-CZ 3.66Å; K163-F206 HydrophobicContact CD-CE1 4.05Å; K163-F206 HydrophobicContact CD-CZ 4.43Å; L164-F206 VanDerWaalsContact CD2-CA 3.47Å; L164-F206 HydrophobicContact CD2-CB 3.84Å; L164-F206 HydrophobicContact CD2-CD2 3.71Å; L164-F206 HydrophobicContact CD2-CG 4.09Å; T167-F206 WeakPolarHBondContact OG1-CE2 3.28Å; L197-F206 HydrophobicContact CD1-CE1 4.26Å; L197-F206 HydrophobicContact CD1-CZ 3.87Å; L197-F206 HydrophobicContact CD2-CE1 4.02Å; L197-F206 HydrophobicContact CD2-CZ 4.45Å; I202-F206 HydrophobicContact CB-CD1 4.06Å; I202-F206 HydrophobicContact CD1-CB 4.36Å; I202-F206 HydrophobicContact CD1-CD1 4.15Å; I202-F206 HydrophobicContact CD1-CG 4.28Å; I202-F206 HydrophobicContact CG2-CD1 4.19Å; S203-F206 PolarHBondContact O-N 3.31Å; S203-F206 VanDerWaalsContact O-N 3.14Å; S203-F206 WeakPolarHBondContact OG-CB 3.46Å; S203-F206 PolarHBondContact OG-N 3.09Å; S204-F206 VanDerWaalsContact C-N 3.34Å; S204-F206 PolarHBondContact O-N 2.65Å; F206-V209 PolarHBondContact O-N 2.9Å; F206-I210 HydrophobicContact CD1-CD1 4.49Å; F206-I210 HydrophobicContact CD2-CD1 3.8Å; F206-I210 HydrophobicContact CD2-CG1 3.87Å; F206-I210 HydrophobicContact CE1-CD1 4.35Å; F206-I210 HydrophobicContact CE2-CD1 3.65Å; F206-I210 HydrophobicContact CE2-CG1 3.74Å; F206-I210 HydrophobicContact CG-CD1 4.23Å; F206-I210 HydrophobicContact CZ-CD1 3.94Å; F206-I210 HydrophobicContact CZ-CG1 4.47Å; F206-I210 VanDerWaalsContact O-CG1 3.27Å; F206-I210 WeakPolarHBondContact O-CG1 3.39Å; F206-I210 PolarHBondContact O-N 3.49Å
207E96.6Very high96.1Very high36 Ų3644.6 Ų44.617%0.16825%0.25CS..Hα-helixtrans-59.8-46.6174-167.5170.8140.500112L198 I202 S203 S204 I210 R211 K261L198-E207 HydrophobicContact CD2-CG 3.89Å; I202-E207 HydrophobicContact CD1-CB 3.95Å; I202-E207 HydrophobicContact CD1-CG 4.49Å; I202-E207 HydrophobicContact CG1-CB 4.13Å; S203-E207 PolarHBondContact O-N 3.32Å; S204-E207 PolarHBondContact O-N 3.33Å; E207-I210 PolarHBondContact O-N 3.32Å; E207-R211 WeakPolarHBondContact O-CG 3.44Å; E207-R211 PolarHBondContact O-N 2.93Å; E207-K261 WeakPolarHBondContact OE2-CE 3.45Å; E207-K261 IonicContact OE2-NZ 2.93Å; E207-K261 PolarHBondContact OE2-NZ 3.5Å
208T97Very high96Very high58 Ų5844.8 Ų44.836%0.35625%0.251SS..Hα-helixtrans-57.3-50.7175.6-65.50000111.6S204 I210 R211 E212S204-T208 WeakPolarHBondContact O-CB 3.32Å; S204-T208 PolarHBondContact O-N 3.47Å; S204-T208 PolarHBondContact O-OG1 3.45Å; S204-T208 VanDerWaalsContact O-OG1 3.05Å; T208-I210 VanDerWaalsContact C-N 3.33Å; T208-I210 PolarHBondContact O-N 3.01Å; T208-R211 PolarHBondContact O-N 3.02Å; T208-R211 VanDerWaalsContact O-N 3.14Å; T208-E212 VanDerWaalsContact CG2-CD 3.48Å; T208-E212 HydrophobicContact CG2-CG 4.24Å; T208-E212 VanDerWaalsContact CG2-OE1 3.26Å; T208-E212 WeakPolarHBondContact CG2-OE1 3.36Å; T208-E212 WeakPolarHBondContact O-CG 3.43Å; T208-E212 PolarHBondContact O-N 3.22Å
209V97.7Very high96Very high29 Ų2944.7 Ų44.718%0.17625%0.251CS..Hα-helixtrans-63.3-38.4-179.2171.60000111.8L164 T167 S205 F206 R211 E213L164-V209 HydrophobicContact CD2-CB 4.1Å; L164-V209 HydrophobicContact CD2-CG1 4.5Å; L164-V209 HydrophobicContact CD2-CG2 4.01Å; T167-V209 HydrophobicContact CG2-CG1 3.87Å; S205-V209 WeakPolarHBondContact O-CG2 3.47Å; S205-V209 PolarHBondContact O-N 3.16Å; S205-V209 VanDerWaalsContact O-N 3.12Å; F206-V209 PolarHBondContact O-N 2.9Å; V209-R211 VanDerWaalsContact C-N 3.35Å; V209-E213 HydrophobicContact CG1-CB 4.49Å; V209-E213 HydrophobicContact CG1-CG 3.88Å; V209-E213 WeakPolarHBondContact O-CB 3.35Å; V209-E213 WeakPolarHBondContact O-CG 3.22Å; V209-E213 PolarHBondContact O-N 2.67Å
210I98.1Very high95.9Very high0 Ų046.5 Ų46.50%026%0.256CS..Hα-helixtrans-63.9-42.3175.3-67.5168.3000110.9T167 Y194 L197 L198 I202 F206 E207 T208 V214 F215T167-I210 HydrophobicContact CG2-CG1 3.97Å; Y194-I210 HydrophobicContact CD1-CD1 4.2Å; Y194-I210 HydrophobicContact CD1-CG1 3.89Å; Y194-I210 HydrophobicContact CD1-CG2 4.07Å; Y194-I210 HydrophobicContact CE1-CG1 4.36Å; Y194-I210 HydrophobicContact CG-CG2 4.33Å; L197-I210 HydrophobicContact CB-CD1 3.77Å; L197-I210 HydrophobicContact CD1-CD1 4.07Å; L198-I210 HydrophobicContact CD1-CG2 4.2Å; L198-I210 HydrophobicContact CD2-CB 4.02Å; L198-I210 HydrophobicContact CD2-CG2 3.68Å; L198-I210 HydrophobicContact CG-CG2 3.78Å; I202-I210 HydrophobicContact CD1-CD1 3.75Å; F206-I210 HydrophobicContact CD1-CD1 4.49Å; F206-I210 HydrophobicContact CD2-CD1 3.8Å; F206-I210 HydrophobicContact CD2-CG1 3.87Å; F206-I210 HydrophobicContact CE1-CD1 4.35Å; F206-I210 HydrophobicContact CE2-CD1 3.65Å; F206-I210 HydrophobicContact CE2-CG1 3.74Å; F206-I210 HydrophobicContact CG-CD1 4.23Å; F206-I210 HydrophobicContact CZ-CD1 3.94Å; F206-I210 HydrophobicContact CZ-CG1 4.47Å; F206-I210 VanDerWaalsContact O-CG1 3.27Å; F206-I210 WeakPolarHBondContact O-CG1 3.39Å; F206-I210 PolarHBondContact O-N 3.49Å; E207-I210 PolarHBondContact O-N 3.32Å; T208-I210 VanDerWaalsContact C-N 3.33Å; T208-I210 PolarHBondContact O-N 3.01Å; I210-V214 WeakPolarHBondContact O-CB 3.29Å; I210-V214 PolarHBondContact O-N 2.79Å; I210-F215 HydrophobicContact CG2-CD2 4.06Å; I210-F215 HydrophobicContact CG2-CE2 3.68Å
211R97.3Very high95.8Very high75 Ų7545.8 Ų45.828%0.28325%0.252SS..Iπ-helixtrans-63.6-54.1178.1-72.5177.160.7-151.3-4.7111.1L198 E207 T208 V209 F215 D216 I268L198-R211 HydrophobicContact CD2-CG 4.17Å; E207-R211 WeakPolarHBondContact O-CG 3.44Å; E207-R211 PolarHBondContact O-N 2.93Å; T208-R211 PolarHBondContact O-N 3.02Å; T208-R211 VanDerWaalsContact O-N 3.14Å; V209-R211 VanDerWaalsContact C-N 3.35Å; R211-F215 PolarHBondContact O-N 2.95Å; R211-D216 WeakPolarHBondContact O-CB 3.04Å; R211-D216 PolarHBondContact O-N 3Å; R211-I268 HydrophobicContact CG-CD1 4.3Å
212E97Very high95.8Very high108 Ų10838.6 Ų38.651%0.50522%0.215SC..Iπ-helixtrans-66.8-51.5-174.1-69.1175.7177.100112.2T208 A217T208-E212 VanDerWaalsContact CG2-CD 3.48Å; T208-E212 HydrophobicContact CG2-CG 4.24Å; T208-E212 VanDerWaalsContact CG2-OE1 3.26Å; T208-E212 WeakPolarHBondContact CG2-OE1 3.36Å; T208-E212 WeakPolarHBondContact O-CG 3.43Å; T208-E212 PolarHBondContact O-N 3.22Å; E212-A217 PolarHBondContact O-N 2.77Å
213E97.5Very high95.7Very high79 Ų7938.2 Ų38.237%0.36921%0.213SC..Iπ-helixtrans-84.4-13.6-171-58.4-70.8175.700113.7T167 V209T167-E213 HydrophobicContact CG2-CB 4.48Å; V209-E213 HydrophobicContact CG1-CB 4.49Å; V209-E213 HydrophobicContact CG1-CG 3.88Å; V209-E213 WeakPolarHBondContact O-CB 3.35Å; V209-E213 WeakPolarHBondContact O-CG 3.22Å; V209-E213 PolarHBondContact O-N 2.67Å
214V97.7Very high95.5Very high0 Ų042.7 Ų42.70%023%0.225CC..Iπ-helixtrans-114.8-66.2179.6-169.40000111T167 L171 L191 Y194 I210 I218T167-V214 HydrophobicContact CG2-CG2 3.77Å; L171-V214 HydrophobicContact CD1-CB 4.38Å; L171-V214 HydrophobicContact CD1-CG1 4.07Å; L171-V214 WeakPolarHBondContact CD1-O 3.45Å; L171-V214 HydrophobicContact CD2-CG1 4.49Å; L171-V214 HydrophobicContact CG-CG1 4.34Å; L191-V214 HydrophobicContact CD2-CG1 3.66Å; Y194-V214 HydrophobicContact CD1-CG2 4.39Å; Y194-V214 HydrophobicContact CD2-CG1 4.14Å; Y194-V214 HydrophobicContact CD2-CG2 4.07Å; Y194-V214 HydrophobicContact CE1-CG2 4.47Å; Y194-V214 HydrophobicContact CE2-CG2 4.14Å; Y194-V214 HydrophobicContact CG-CG2 4.19Å; I210-V214 WeakPolarHBondContact O-CB 3.29Å; I210-V214 PolarHBondContact O-N 2.79Å; V214-I218 HydrophobicContact CG1-CD1 4.48Å; V214-I218 VanDerWaalsContact O-CD1 3.28Å; V214-I218 WeakPolarHBondContact O-CD1 3.44Å; V214-I218 WeakPolarHBondContact O-CG1 3.36Å; V214-I218 PolarHBondContact O-N 3.14Å
215F97.5Very high95.2Very high0 Ų041.3 Ų41.30%021%0.21CC..Iπ-helixtrans-80.8-45.3-168.7-64.2-75.1000112.6I195 L198 I210 R211 A217 I218 L219 I249 I268 F272I195-F215 HydrophobicContact CG1-CE1 4.01Å; I195-F215 HydrophobicContact CG1-CZ 3.7Å; L198-F215 HydrophobicContact CD1-CD2 3.73Å; L198-F215 HydrophobicContact CD1-CE2 3.31Å; L198-F215 HydrophobicContact CD1-CZ 4.06Å; L198-F215 HydrophobicContact CG-CE2 4.16Å; I210-F215 HydrophobicContact CG2-CD2 4.06Å; I210-F215 HydrophobicContact CG2-CE2 3.68Å; R211-F215 PolarHBondContact O-N 2.95Å; F215-A217 VanDerWaalsContact C-N 3.35Å; F215-I218 PolarHBondContact O-N 3.18Å; F215-L219 VanDerWaalsContact O-CG 3.3Å; F215-L219 WeakPolarHBondContact O-CG 3.41Å; F215-L219 PolarHBondContact O-N 3.11Å; F215-I249 HydrophobicContact CD1-CD1 4.07Å; F215-I249 HydrophobicContact CE1-CD1 3.8Å; F215-I249 HydrophobicContact CE1-CG1 4.36Å; F215-I268 HydrophobicContact CB-CG2 4.42Å; F215-I268 HydrophobicContact CD1-CG2 4.44Å; F215-I268 HydrophobicContact CG-CG2 4.47Å; F215-F272 HydrophobicContact CB-CE2 4.23Å; F215-F272 AromaticContact CD1-CE2 3.77Å; F215-F272 HydrophobicContact CD1-CE2 3.77Å; F215-F272 AromaticContact CD1-CZ 3.93Å; F215-F272 HydrophobicContact CD1-CZ 3.93Å; F215-F272 HydrophobicContact CG-CE2 4.46Å
216D95.7Very high94.9Very high38 Ų3840.7 Ų40.720%0.20320%0.202CC..Iπ-helixtrans-67.6-36.9176.9-64.1-32.4000111.1R211 I218 L219 L220 R271R211-D216 WeakPolarHBondContact O-CB 3.04Å; R211-D216 PolarHBondContact O-N 3Å; D216-I218 VanDerWaalsContact C-N 3.35Å; D216-I218 PolarHBondContact O-N 3.49Å; D216-L219 PolarHBondContact O-N 3.26Å; D216-L220 WeakPolarHBondContact O-CB 3.42Å; D216-L220 PolarHBondContact O-N 2.95Å; D216-R271 IonicContact OD1-CZ 2.9Å; D216-R271 IonicContact OD1-NH1 3.74Å; D216-R271 PolarHBondContact OD1-NH1 2.95Å; D216-R271 IonicContact OD1-NH2 3.48Å
217A95.6Very high94.3Very high39 Ų3943.9 Ų43.932%0.32223%0.225SC..Hα-helixtrans-57.3-44.5172.100000112.5L171 E212 F215 E221L171-A217 HydrophobicContact CD1-CB 4.36Å; E212-A217 PolarHBondContact O-N 2.77Å; F215-A217 VanDerWaalsContact C-N 3.35Å; A217-E221 PolarHBondContact O-N 3.42Å; A217-E221 VanDerWaalsContact O-N 3.15Å
218I95.9Very high93.7Very high5 Ų549.5 Ų49.53%0.02625%0.251CS..Hα-helixtrans-65.5-47.3175.9-67.1165.5000110.9L171 L191 V214 F215 D216 L220 E221 A222 F240 F242 F272L171-I218 HydrophobicContact CD1-CD1 4Å; L171-I218 HydrophobicContact CD1-CG1 3.75Å; L191-I218 HydrophobicContact CD1-CD1 3.81Å; L191-I218 HydrophobicContact CD2-CD1 4.1Å; V214-I218 HydrophobicContact CG1-CD1 4.48Å; V214-I218 VanDerWaalsContact O-CD1 3.28Å; V214-I218 WeakPolarHBondContact O-CD1 3.44Å; V214-I218 WeakPolarHBondContact O-CG1 3.36Å; V214-I218 PolarHBondContact O-N 3.14Å; F215-I218 PolarHBondContact O-N 3.18Å; D216-I218 VanDerWaalsContact C-N 3.35Å; D216-I218 PolarHBondContact O-N 3.49Å; I218-L220 VanDerWaalsContact C-N 3.33Å; I218-L220 PolarHBondContact O-N 3.09Å; I218-E221 PolarHBondContact O-N 3.26Å; I218-A222 WeakPolarHBondContact O-CB 3.3Å; I218-A222 PolarHBondContact O-N 3.43Å; I218-F240 HydrophobicContact CD1-CD1 4.09Å; I218-F240 HydrophobicContact CD1-CE1 3.58Å; I218-F240 HydrophobicContact CD1-CZ 4.16Å; I218-F240 HydrophobicContact CG1-CD1 4.32Å; I218-F240 HydrophobicContact CG1-CE1 3.68Å; I218-F240 HydrophobicContact CG1-CE2 4.4Å; I218-F240 HydrophobicContact CG1-CZ 3.74Å; I218-F240 HydrophobicContact CG2-CD1 4.05Å; I218-F240 HydrophobicContact CG2-CD2 4.18Å; I218-F240 HydrophobicContact CG2-CE1 4.21Å; I218-F240 HydrophobicContact CG2-CE2 4.35Å; I218-F240 HydrophobicContact CG2-CG 4.03Å; I218-F240 HydrophobicContact CG2-CZ 4.37Å; I218-F242 HydrophobicContact CG2-CD1 4.5Å; I218-F242 HydrophobicContact CG2-CE1 3.93Å; I218-F272 HydrophobicContact CB-CZ 4.37Å; I218-F272 HydrophobicContact CG2-CE1 3.8Å; I218-F272 HydrophobicContact CG2-CZ 4.11Å
219L95.2Very high92.7Very high1 Ų151 Ų511%0.00526%0.261CS..Hα-helixtrans-63.9-38-179.4-70169000111.9F215 D216 A222 S223 R271 F272 V275F215-L219 VanDerWaalsContact O-CG 3.3Å; F215-L219 WeakPolarHBondContact O-CG 3.41Å; F215-L219 PolarHBondContact O-N 3.11Å; D216-L219 PolarHBondContact O-N 3.26Å; L219-A222 PolarHBondContact O-N 3.24Å; L219-S223 WeakPolarHBondContact O-CB 3.41Å; L219-S223 PolarHBondContact O-N 3.42Å; L219-R271 HydrophobicContact CD1-CB 3.8Å; L219-R271 HydrophobicContact CD2-CB 4.11Å; L219-F272 HydrophobicContact CD1-CD2 4.41Å; L219-F272 HydrophobicContact CD1-CE2 4.08Å; L219-F272 HydrophobicContact CD2-CD1 4.08Å; L219-F272 HydrophobicContact CD2-CD2 4.05Å; L219-F272 HydrophobicContact CD2-CE1 4.12Å; L219-F272 HydrophobicContact CD2-CE2 4.09Å; L219-F272 HydrophobicContact CD2-CG 4.02Å; L219-F272 HydrophobicContact CD2-CZ 4.12Å; L219-F272 HydrophobicContact CG-CD2 4.44Å; L219-F272 HydrophobicContact CG-CE1 4.46Å; L219-F272 HydrophobicContact CG-CE2 4.02Å; L219-F272 HydrophobicContact CG-CZ 4.03Å; L219-V275 HydrophobicContact CD2-CG2 3.82Å
220L92.9Very high91.2Very high69 Ų6957.2 Ų57.236%0.36128%0.282SS..Hα-helixtrans-65.7-43.7176.9-179.463.5000111.7D216 I218 A222 S223 R224 L282D216-L220 WeakPolarHBondContact O-CB 3.42Å; D216-L220 PolarHBondContact O-N 2.95Å; I218-L220 VanDerWaalsContact C-N 3.33Å; I218-L220 PolarHBondContact O-N 3.09Å; L220-A222 VanDerWaalsContact C-N 3.31Å; L220-S223 PolarHBondContact O-N 3.14Å; L220-R224 VanDerWaalsContact O-CG 3.3Å; L220-R224 WeakPolarHBondContact O-CG 3.44Å; L220-R224 PolarHBondContact O-N 3.26Å; L220-L282 HydrophobicContact CD1-CD1 3.9Å
221E91.4Very high89.1Confident61 Ų6165 Ų6529%0.28532%0.324SS..Hα-helixtrans-66.7-36.3175.8-172.159.8-163.500111.4A217 I218 R224 N225 R230A217-E221 PolarHBondContact O-N 3.42Å; A217-E221 VanDerWaalsContact O-N 3.15Å; I218-E221 PolarHBondContact O-N 3.26Å; E221-R224 PolarHBondContact O-N 3.16Å; E221-R224 IonicContact OE2-NH1 3.39Å; E221-R224 PolarHBondContact OE2-NH1 2.87Å; E221-R224 VanDerWaalsContact OE2-NH1 3.17Å; E221-N225 PolarHBondContact O-N 3.04Å; E221-N225 VanDerWaalsContact O-N 3.08Å; E221-N225 PolarHBondContact O-ND2 2.86Å; E221-R230 IonicContact OE1-NH2 3.77Å; E221-R230 PolarHBondContact OE1-NH2 3.37Å
222A92.8Very high87Confident6 Ų665.4 Ų65.45%0.0535%0.351CS..Hα-helixtrans-66.8-44.2175.200000112.6I218 L219 L220 R224 N225 I226 F242 V275I218-A222 WeakPolarHBondContact O-CB 3.3Å; I218-A222 PolarHBondContact O-N 3.43Å; L219-A222 PolarHBondContact O-N 3.24Å; L220-A222 VanDerWaalsContact C-N 3.31Å; A222-R224 PolarHBondContact O-N 2.71Å; A222-N225 PolarHBondContact O-N 3.41Å; A222-N225 VanDerWaalsContact O-N 3.15Å; A222-I226 WeakPolarHBondContact O-CG1 3.32Å; A222-I226 PolarHBondContact O-N 3.11Å; A222-F242 HydrophobicContact CB-CE1 3.79Å; A222-F242 HydrophobicContact CB-CE2 4.38Å; A222-F242 HydrophobicContact CB-CZ 3.53Å; A222-V275 HydrophobicContact CB-CB 4.44Å; A222-V275 HydrophobicContact CB-CG1 3.37Å; A222-V275 HydrophobicContact CB-CG2 4.15Å
223S91.8Very high84.5Confident7 Ų762.6 Ų62.65%0.04935%0.346CS..Hα-helixtrans-54.7-49.7172.6168.50000111L219 L220 N225 I226 S227 D280L219-S223 WeakPolarHBondContact O-CB 3.41Å; L219-S223 PolarHBondContact O-N 3.42Å; L220-S223 PolarHBondContact O-N 3.14Å; S223-N225 VanDerWaalsContact C-N 3.3Å; S223-N225 PolarHBondContact O-N 3.18Å; S223-I226 PolarHBondContact O-N 3.38Å; S223-S227 PolarHBondContact O-N 3.48Å; S223-S227 PolarHBondContact O-OG 3.46Å; S223-D280 VanDerWaalsContact CB-OD1 3.25Å; S223-D280 WeakPolarHBondContact CB-OD1 3.38Å; S223-D280 PolarHBondContact OG-OD1 2.78Å; S223-D280 PolarHBondContact OG-OD2 2.94Å; S223-D280 VanDerWaalsContact OG-OD2 3.08Å
224R90.3Very high82.3Confident132 Ų13267 Ų6750%0.49837%0.366SS..Hα-helixtrans-56.1-41.6175.6-72170.4-175.6164.10.7113.1L220 E221 A222 I226 Q228L220-R224 VanDerWaalsContact O-CG 3.3Å; L220-R224 WeakPolarHBondContact O-CG 3.44Å; L220-R224 PolarHBondContact O-N 3.26Å; E221-R224 PolarHBondContact O-N 3.16Å; E221-R224 IonicContact OE2-NH1 3.39Å; E221-R224 PolarHBondContact OE2-NH1 2.87Å; E221-R224 VanDerWaalsContact OE2-NH1 3.17Å; A222-R224 PolarHBondContact O-N 2.71Å; R224-I226 VanDerWaalsContact C-N 3.34Å; R224-Q228 PolarHBondContact O-N 3.45Å
225N88.8Confident80.3Confident68 Ų6872.8 Ų72.836%0.36440%0.397SS..Hα-helixtrans-69.6-30.4178.7-72.6-40.8000112.7E221 A222 S223 Q228 P229E221-N225 PolarHBondContact O-N 3.04Å; E221-N225 VanDerWaalsContact O-N 3.08Å; E221-N225 PolarHBondContact O-ND2 2.86Å; A222-N225 PolarHBondContact O-N 3.41Å; A222-N225 VanDerWaalsContact O-N 3.15Å; S223-N225 VanDerWaalsContact C-N 3.3Å; S223-N225 PolarHBondContact O-N 3.18Å; N225-Q228 CarbonylContact O-C 3.54Å; N225-P229 WeakPolarHBondContact O-CA 3.41Å
226I88.8Confident78.4Confident39 Ų3977.4 Ų77.420%0.243%0.429CS..Hα-helixtrans-72.7-48.3174.2-65.7166.2000110.6A222 S223 R224 V275 D280A222-I226 WeakPolarHBondContact O-CG1 3.32Å; A222-I226 PolarHBondContact O-N 3.11Å; S223-I226 PolarHBondContact O-N 3.38Å; R224-I226 VanDerWaalsContact C-N 3.34Å; I226-V275 HydrophobicContact CD1-CG1 4.33Å; I226-D280 HydrophobicContact CG2-CB 4.37Å
227S85.8Confident77.8Confident72 Ų7276.1 Ų76.150%0.50343%0.425SS..Hα-helixtrans-72.9-30-178-27.50000112.8S223 D280S223-S227 PolarHBondContact O-N 3.48Å; S223-S227 PolarHBondContact O-OG 3.46Å; S227-D280 PolarHBondContact OG-OD2 3.39Å
228Q83.5Confident77.6Confident154 Ų15475.1 Ų75.172%0.7241%0.414SS*.SBendtrans-131.475.8-179.5-62.7-177.51600110.4R224 N225 R230R224-Q228 PolarHBondContact O-N 3.45Å; N225-Q228 CarbonylContact O-C 3.54Å; Q228-R230 PolarHBondContact O-N 3.05Å
229P75.5Confident77.4Confident88 Ų8878.4 Ų78.457%0.57143%0.429SS*.  trans-58.9114.2177.622.8-31.8000109.3N225 N231N225-P229 WeakPolarHBondContact O-CA 3.41Å; P229-N231 PolarHBondContact O-N 2.88Å
230R66.4Low77.3Confident160 Ų16080.6 Ų80.660%0.60444%0.439SS*.  trans-66.899178.7-68.5-174.8-178.2164.510.3109E221 Q228 G232 A233E221-R230 IonicContact OE1-NH2 3.77Å; E221-R230 PolarHBondContact OE1-NH2 3.37Å; Q228-R230 PolarHBondContact O-N 3.05Å; R230-G232 PolarHBondContact O-N 3.26Å; R230-A233 HydrophobicContact CB-CB 3.84Å; R230-A233 HydrophobicContact CG-CB 4.48Å
231N52.9Low77.5Confident165 Ų16580.2 Ų80.288%0.88244%0.437SS*.THydrogen-bonded Turntrans-62101.5171.8-76.6-29.8000109.9P229P229-N231 PolarHBondContact O-N 2.88Å
232G53.4Low77.7Confident82 Ų8279.6 Ų79.685%0.84543%0.433SS*.THydrogen-bonded Turntrans84.711.7167.800000116.8R230 Q234R230-G232 PolarHBondContact O-N 3.26Å; G232-Q234 PolarHBondContact O-N 3.02Å
233A46.1Very low77.9Confident49 Ų4982.1 Ų82.141%0.40545%0.448SS..  trans-74.7124.8166.900000108.7R230 N235R230-A233 HydrophobicContact CB-CB 3.84Å; R230-A233 HydrophobicContact CG-CB 4.48Å; A233-N235 PolarHBondContact O-N 3.39Å
234Q50.5Low78.1Confident171 Ų17184 Ų8480%0.79946%0.456SS*.  trans-50135.3162.4-84.2172.2-17.200107.9G232 C236G232-Q234 PolarHBondContact O-N 3.02Å; Q234-C236 PolarHBondContact O-N 3.18Å
235N56.4Low78.5Confident122 Ų12277.7 Ų77.765%0.65243%0.433SS*.  trans-61.672.4173.5-80.27000109.7A233 G237 Q239A233-N235 PolarHBondContact O-N 3.39Å; N235-G237 PolarHBondContact O-N 2.86Å; N235-Q239 PolarHBondContact ND2-OE1 3.03Å
236C56.5Low78.9Confident97 Ų9774.5 Ų74.566%0.65542%0.415SS*.  trans-88.491.7176.2-70.90000106.8Q234Q234-C236 PolarHBondContact O-N 3.18Å
237G84.3Confident79.3Confident12 Ų1278.2 Ų78.212%0.12443%0.432CS..SBendtrans155.9170.7175.600000112D175 G179 N235 Q239D175-G237 WeakPolarHBondContact OD1-CA 3.28Å; G179-G237 CarbonylContact C-O 3.43Å; G179-G237 CarbonylContact O-C 3.39Å; N235-G237 PolarHBondContact O-N 2.86Å; G237-Q239 PolarHBondContact O-N 3.13Å; G237-Q239 PolarHBondContact O-NE2 3.22Å
238L91.1Very high79.9Confident17 Ų1775.7 Ų75.79%0.08942%0.415CS..  trans-52.4131.2177-68.1170.5000111L174 D175 L182 V187 F240L174-L238 HydrophobicContact CB-CD1 4.2Å; D175-L238 HydrophobicContact CB-CD1 3.88Å; D175-L238 HydrophobicContact CB-CG 3.97Å; D175-L238 PolarHBondContact OD1-N 2.88Å; L182-L238 HydrophobicContact CB-CD2 4.25Å; L182-L238 HydrophobicContact CD1-CD2 3.62Å; V187-L238 HydrophobicContact CG2-CB 4.49Å; V187-L238 HydrophobicContact CG2-CD2 3.8Å; L238-F240 HydrophobicContact CB-CE1 4.34Å; L238-F240 HydrophobicContact CB-CE2 3.77Å; L238-F240 HydrophobicContact CB-CZ 3.62Å; L238-F240 HydrophobicContact CD1-CZ 4.02Å; L238-F240 HydrophobicContact CG-CZ 4.48Å; L238-F240 WeakPolarHBondContact O-CE2 3.07Å
239Q90.8Very high80.5Confident74 Ų7468.3 Ų68.335%0.34638%0.381SS..  trans-93.7130.6173.6-57.9-58.7-70.900109.1S184 V187 N235 G237S184-Q239 VanDerWaalsContact CA-O 3.31Å; S184-Q239 WeakPolarHBondContact CA-O 3.3Å; V187-Q239 WeakPolarHBondContact CG2-O 3.43Å; N235-Q239 PolarHBondContact ND2-OE1 3.03Å; G237-Q239 PolarHBondContact O-N 3.13Å; G237-Q239 PolarHBondContact O-NE2 3.22Å
240F94Very high81.6Confident47 Ų4767.9 Ų67.921%0.20637%0.37CS..  trans-113.5134.3-178.8-60.1-81.8000110.5V187 L191 I218 L238 F242 I245V187-F240 HydrophobicContact CG1-CD1 3.57Å; V187-F240 HydrophobicContact CG1-CE1 3.42Å; V187-F240 VanDerWaalsContact CG1-CE1 3.42Å; V187-F240 HydrophobicContact CG1-CZ 4.35Å; L191-F240 HydrophobicContact CD1-CD1 4.38Å; L191-F240 HydrophobicContact CD1-CE1 4.37Å; I218-F240 HydrophobicContact CD1-CD1 4.09Å; I218-F240 HydrophobicContact CD1-CE1 3.58Å; I218-F240 HydrophobicContact CD1-CZ 4.16Å; I218-F240 HydrophobicContact CG1-CD1 4.32Å; I218-F240 HydrophobicContact CG1-CE1 3.68Å; I218-F240 HydrophobicContact CG1-CE2 4.4Å; I218-F240 HydrophobicContact CG1-CZ 3.74Å; I218-F240 HydrophobicContact CG2-CD1 4.05Å; I218-F240 HydrophobicContact CG2-CD2 4.18Å; I218-F240 HydrophobicContact CG2-CE1 4.21Å; I218-F240 HydrophobicContact CG2-CE2 4.35Å; I218-F240 HydrophobicContact CG2-CG 4.03Å; I218-F240 HydrophobicContact CG2-CZ 4.37Å; L238-F240 HydrophobicContact CB-CE1 4.34Å; L238-F240 HydrophobicContact CB-CE2 3.77Å; L238-F240 HydrophobicContact CB-CZ 3.62Å; L238-F240 HydrophobicContact CD1-CZ 4.02Å; L238-F240 HydrophobicContact CG-CZ 4.48Å; L238-F240 WeakPolarHBondContact O-CE2 3.07Å; F240-F242 HydrophobicContact CB-CD1 4.06Å; F240-F242 HydrophobicContact CB-CE1 3.71Å; F240-F242 HydrophobicContact CB-CZ 4.07Å; F240-F242 HydrophobicContact CG-CE1 4.37Å; F240-I245 HydrophobicContact CB-CD1 4.02Å; F240-I245 HydrophobicContact CD1-CD1 3.88Å; F240-I245 HydrophobicContact CG-CD1 4.4Å
241D95.5Very high83.1Confident61 Ų6163 Ų6333%0.32636%0.364SS..  trans-94.695.9163.4-173-31.6000107.4T243 E244 I245D241-T243 PolarHBondContact O-N 2.82Å; D241-T243 WeakPolarHBondContact OD1-CB 3.15Å; D241-T243 PolarHBondContact OD1-N 3.02Å; D241-T243 VanDerWaalsContact OD1-N 3.16Å; D241-E244 HydrophobicContact CB-CB 3.8Å; D241-E244 PolarHBondContact O-N 3.37Å; D241-E244 PolarHBondContact OD1-N 3.27Å; D241-I245 VanDerWaalsContact O-CG1 3.29Å; D241-I245 WeakPolarHBondContact O-CG1 3.48Å; D241-I245 PolarHBondContact O-N 3.12Å
242F96.6Very high85.1Confident48 Ų4856.5 Ų56.521%0.21133%0.33CS..Hα-helixtrans-62.5-30.7-175-57.9-65.2000112.3I218 A222 F240 A246 F272 V275 A276I218-F242 HydrophobicContact CG2-CD1 4.5Å; I218-F242 HydrophobicContact CG2-CE1 3.93Å; A222-F242 HydrophobicContact CB-CE1 3.79Å; A222-F242 HydrophobicContact CB-CE2 4.38Å; A222-F242 HydrophobicContact CB-CZ 3.53Å; F240-F242 HydrophobicContact CB-CD1 4.06Å; F240-F242 HydrophobicContact CB-CE1 3.71Å; F240-F242 HydrophobicContact CB-CZ 4.07Å; F240-F242 HydrophobicContact CG-CE1 4.37Å; F242-A246 WeakPolarHBondContact O-CB 3.49Å; F242-A246 PolarHBondContact O-N 3.49Å; F242-F272 HydrophobicContact CB-CD1 4.29Å; F242-F272 AromaticContact CD1-CD1 3.87Å; F242-F272 HydrophobicContact CD1-CD1 3.87Å; F242-F272 HydrophobicContact CD1-CE1 4.03Å; F242-V275 HydrophobicContact CB-CG1 4.49Å; F242-V275 HydrophobicContact CD1-CG1 3.82Å; F242-V275 HydrophobicContact CD2-CG1 3.55Å; F242-V275 HydrophobicContact CE1-CG1 3.8Å; F242-V275 HydrophobicContact CE2-CG1 3.53Å; F242-V275 HydrophobicContact CG-CB 4.39Å; F242-V275 HydrophobicContact CG-CG1 3.69Å; F242-V275 HydrophobicContact CZ-CG1 3.66Å; F242-A276 HydrophobicContact CB-CB 3.9Å
243T96.9Very high87.2Confident59 Ų5952.6 Ų52.636%0.36229%0.29SS..Hα-helixtrans-69.5-47.7175.3-55.60000110.5D241 I245 A246 E247D241-T243 PolarHBondContact O-N 2.82Å; D241-T243 WeakPolarHBondContact OD1-CB 3.15Å; D241-T243 PolarHBondContact OD1-N 3.02Å; D241-T243 VanDerWaalsContact OD1-N 3.16Å; T243-I245 VanDerWaalsContact C-N 3.28Å; T243-I245 PolarHBondContact O-N 3.25Å; T243-A246 PolarHBondContact O-N 3.06Å; T243-E247 HydrophobicContact CG2-CG 4.5Å; T243-E247 WeakPolarHBondContact O-CB 3.21Å; T243-E247 WeakPolarHBondContact O-CG 3.36Å; T243-E247 PolarHBondContact O-N 3.23Å
244E96.7Very high89.6Confident47 Ų4756 Ų5622%0.2230%0.296CS..Hα-helixtrans-62-37.5178.2-160-165.818000111.6R185 T188 D241 A248R185-E244 WeakPolarHBondContact CA-OE2 3.27Å; T188-E244 VanDerWaalsContact CB-OE2 3.32Å; T188-E244 WeakPolarHBondContact CB-OE2 3.32Å; T188-E244 HydrophobicContact CG2-CB 4.27Å; T188-E244 HydrophobicContact CG2-CG 3.86Å; T188-E244 PolarHBondContact OG1-OE2 3.13Å; D241-E244 HydrophobicContact CB-CB 3.8Å; D241-E244 PolarHBondContact O-N 3.37Å; D241-E244 PolarHBondContact OD1-N 3.27Å; E244-A248 WeakPolarHBondContact O-CB 3.36Å; E244-A248 PolarHBondContact O-N 3.24Å
245I97.3Very high91.6Very high0 Ų055.4 Ų55.40%029%0.293CS..Hα-helixtrans-65.5-48.5174.7-65.5166000110.5T188 L191 F240 D241 T243 E247 A248 I249 F272T188-I245 HydrophobicContact CG2-CG1 4.15Å; L191-I245 HydrophobicContact CD1-CD1 3.8Å; L191-I245 HydrophobicContact CD1-CG1 4.1Å; F240-I245 HydrophobicContact CB-CD1 4.02Å; F240-I245 HydrophobicContact CD1-CD1 3.88Å; F240-I245 HydrophobicContact CG-CD1 4.4Å; D241-I245 VanDerWaalsContact O-CG1 3.29Å; D241-I245 WeakPolarHBondContact O-CG1 3.48Å; D241-I245 PolarHBondContact O-N 3.12Å; T243-I245 VanDerWaalsContact C-N 3.28Å; T243-I245 PolarHBondContact O-N 3.25Å; I245-E247 VanDerWaalsContact C-N 3.33Å; I245-E247 PolarHBondContact O-N 2.89Å; I245-A248 PolarHBondContact O-N 2.86Å; I245-I249 HydrophobicContact CG2-CD1 3.78Å; I245-I249 HydrophobicContact CG2-CG1 4.41Å; I245-I249 VanDerWaalsContact O-CG1 3.28Å; I245-I249 WeakPolarHBondContact O-CG1 3.48Å; I245-I249 PolarHBondContact O-N 3.4Å; I245-F272 HydrophobicContact CB-CD1 4.15Å; I245-F272 HydrophobicContact CB-CE1 4.24Å; I245-F272 HydrophobicContact CD1-CE1 4.11Å; I245-F272 HydrophobicContact CG2-CD1 3.81Å; I245-F272 HydrophobicContact CG2-CD2 4.3Å; I245-F272 HydrophobicContact CG2-CE1 3.64Å; I245-F272 HydrophobicContact CG2-CE2 4.15Å; I245-F272 HydrophobicContact CG2-CG 4.16Å; I245-F272 HydrophobicContact CG2-CZ 3.83Å
246A97.7Very high93.5Very high0 Ų050.1 Ų50.10%027%0.265CS..Hα-helixtrans-57.9-45177.400000111.7F242 T243 A248 I249 F250 V269 F272F242-A246 WeakPolarHBondContact O-CB 3.49Å; F242-A246 PolarHBondContact O-N 3.49Å; T243-A246 PolarHBondContact O-N 3.06Å; A246-A248 PolarHBondContact O-N 2.95Å; A246-I249 PolarHBondContact O-N 2.98Å; A246-F250 VanDerWaalsContact O-CB 3.26Å; A246-F250 WeakPolarHBondContact O-CB 3.17Å; A246-F250 PolarHBondContact O-N 2.88Å; A246-V269 HydrophobicContact CB-CG1 4.42Å; A246-F272 HydrophobicContact CB-CB 3.86Å
247E97.4Very high95.3Very high117 Ų11755 Ų5555%0.54728%0.275SS..Hα-helixtrans-63-41.7177.3-73.5178.718000112.3T243 I245 F250 A251T243-E247 HydrophobicContact CG2-CG 4.5Å; T243-E247 WeakPolarHBondContact O-CB 3.21Å; T243-E247 WeakPolarHBondContact O-CG 3.36Å; T243-E247 PolarHBondContact O-N 3.23Å; I245-E247 VanDerWaalsContact C-N 3.33Å; I245-E247 PolarHBondContact O-N 2.89Å; E247-F250 PolarHBondContact O-N 3.35Å; E247-A251 WeakPolarHBondContact O-CB 3.49Å; E247-A251 PolarHBondContact O-N 3.3Å
248A97.2Very high95.7Very high19 Ų1958.8 Ų58.816%0.15729%0.293CS..Hα-helixtrans-63.7-42.217700000111.9I195 E244 I245 A246 V252I195-A248 HydrophobicContact CD1-CB 3.72Å; E244-A248 WeakPolarHBondContact O-CB 3.36Å; E244-A248 PolarHBondContact O-N 3.24Å; I245-A248 PolarHBondContact O-N 2.86Å; A246-A248 PolarHBondContact O-N 2.95Å; A248-V252 PolarHBondContact O-N 3.42Å
249I97.7Very high95.9Very high0 Ų060.7 Ų60.70%031%0.311CS..Hα-helixtrans-66.4-45.6176.1-61168.1000110.2I195 F215 I245 A246 A251 V252 A253 L265 I268 V269 F272I195-I249 HydrophobicContact CD1-CG1 3.87Å; I195-I249 HydrophobicContact CG1-CG1 3.9Å; I195-I249 HydrophobicContact CG2-CB 4.35Å; I195-I249 HydrophobicContact CG2-CG1 4.01Å; F215-I249 HydrophobicContact CD1-CD1 4.07Å; F215-I249 HydrophobicContact CE1-CD1 3.8Å; F215-I249 HydrophobicContact CE1-CG1 4.36Å; I245-I249 HydrophobicContact CG2-CD1 3.78Å; I245-I249 HydrophobicContact CG2-CG1 4.41Å; I245-I249 VanDerWaalsContact O-CG1 3.28Å; I245-I249 WeakPolarHBondContact O-CG1 3.48Å; I245-I249 PolarHBondContact O-N 3.4Å; A246-I249 PolarHBondContact O-N 2.98Å; I249-A251 PolarHBondContact O-N 3Å; I249-V252 PolarHBondContact O-N 3.08Å; I249-A253 WeakPolarHBondContact O-CB 3.5Å; I249-A253 PolarHBondContact O-N 3.42Å; I249-L265 HydrophobicContact CG2-CB 4.38Å; I249-L265 HydrophobicContact CG2-CD2 3.96Å; I249-I268 HydrophobicContact CD1-CG2 3.71Å; I249-V269 HydrophobicContact CB-CG2 3.73Å; I249-V269 HydrophobicContact CG2-CG2 3.52Å; I249-F272 HydrophobicContact CD1-CD2 4.03Å; I249-F272 HydrophobicContact CD1-CE2 4.08Å
250F97.8Very high95.9Very high79 Ų7965 Ų6535%0.34633%0.328SS..Hα-helixtrans-61.1-41.8179.7-177.8-116.7000112.6A246 E247 V252 A253 K254 Y266 V269A246-F250 VanDerWaalsContact O-CB 3.26Å; A246-F250 WeakPolarHBondContact O-CB 3.17Å; A246-F250 PolarHBondContact O-N 2.88Å; E247-F250 PolarHBondContact O-N 3.35Å; F250-V252 VanDerWaalsContact C-N 3.3Å; F250-V252 PolarHBondContact O-N 2.98Å; F250-A253 PolarHBondContact O-N 2.96Å; F250-K254 HydrophobicContact CE1-CD 4.35Å; F250-K254 WeakPolarHBondContact O-CG 3.5Å; F250-K254 PolarHBondContact O-N 3.42Å; F250-Y266 HydrophobicContact CD2-CD1 4.08Å; F250-Y266 AromaticContact CD2-CE1 3.68Å; F250-Y266 HydrophobicContact CD2-CE1 3.68Å; F250-Y266 HydrophobicContact CE2-CD1 4.35Å; F250-Y266 AromaticContact CE2-CE1 3.74Å; F250-Y266 HydrophobicContact CE2-CE1 3.74Å; F250-V269 HydrophobicContact CB-CG1 4.32Å; F250-V269 HydrophobicContact CB-CG2 4.04Å
251A97.3Very high95.9Very high57 Ų5763.9 Ų63.947%0.47132%0.323SS..Hα-helixtrans-60-41.3177.100000112E247 I249E247-A251 WeakPolarHBondContact O-CB 3.49Å; E247-A251 PolarHBondContact O-N 3.3Å; I249-A251 PolarHBondContact O-N 3Å
252V96.7Very high95.9Very high29 Ų2964.7 Ų64.718%0.17632%0.322CS..Hα-helixtrans-74.4-39.6178.2167.30000111.5I195 A199 A248 I249 F250 K254 E255I195-V252 HydrophobicContact CG2-CB 3.92Å; I195-V252 HydrophobicContact CG2-CG1 4.2Å; I195-V252 HydrophobicContact CG2-CG2 3.89Å; A199-V252 HydrophobicContact CB-CG1 3.19Å; A248-V252 PolarHBondContact O-N 3.42Å; I249-V252 PolarHBondContact O-N 3.08Å; F250-V252 VanDerWaalsContact C-N 3.3Å; F250-V252 PolarHBondContact O-N 2.98Å; V252-K254 VanDerWaalsContact C-N 3.28Å; V252-K254 PolarHBondContact O-N 3.08Å; V252-E255 PolarHBondContact O-N 3.47Å; V252-E255 VanDerWaalsContact O-N 3.15Å
253A96.5Very high95.8Very high0 Ų069 Ų690%034%0.343CS..Hα-helixtrans-60.7-33.2179.500000113.5I249 F250 E255 V256 L265 Y266I249-A253 WeakPolarHBondContact O-CB 3.5Å; I249-A253 PolarHBondContact O-N 3.42Å; F250-A253 PolarHBondContact O-N 2.96Å; A253-E255 PolarHBondContact O-N 3.38Å; A253-V256 WeakPolarHBondContact O-CB 3.41Å; A253-V256 PolarHBondContact O-N 2.93Å; A253-V256 VanDerWaalsContact O-N 3.15Å; A253-L265 HydrophobicContact CB-CB 3.67Å; A253-L265 HydrophobicContact CB-CD1 3.85Å; A253-L265 HydrophobicContact CB-CG 4.4Å; A253-Y266 HydrophobicContact CB-CD1 4.12Å; A253-Y266 HydrophobicContact CB-CE1 3.79Å
254K95.6Very high95.7Very high120 Ų12068.1 Ų68.152%0.52234%0.337SS..THydrogen-bonded Turntrans-59.6-31.4176.4-76.7177.4-179.4176.40113.6F250 V252 V256F250-K254 HydrophobicContact CE1-CD 4.35Å; F250-K254 WeakPolarHBondContact O-CG 3.5Å; F250-K254 PolarHBondContact O-N 3.42Å; V252-K254 VanDerWaalsContact C-N 3.28Å; V252-K254 PolarHBondContact O-N 3.08Å; K254-V256 VanDerWaalsContact C-N 3.34Å
255E94.4Very high95.7Very high159 Ų15966 Ų6674%0.74333%0.327SS*.THydrogen-bonded Turntrans-86.8-7.4-178-58.2-58.2139.600112.5V252 A253 K257V252-E255 PolarHBondContact O-N 3.47Å; V252-E255 VanDerWaalsContact O-N 3.15Å; A253-E255 PolarHBondContact O-N 3.38Å; E255-K257 PolarHBondContact O-N 3.41Å
256V95Very high95.7Very high11 Ų1170.1 Ų70.17%0.06734%0.343CS..  trans-77.5118.7-178.7178.40000110.9A199 A253 K254 D258 K261 R262 L265A199-V256 HydrophobicContact CB-CG2 3.48Å; A199-V256 VanDerWaalsContact CB-CG2 3.48Å; A253-V256 WeakPolarHBondContact O-CB 3.41Å; A253-V256 PolarHBondContact O-N 2.93Å; A253-V256 VanDerWaalsContact O-N 3.15Å; K254-V256 VanDerWaalsContact C-N 3.34Å; V256-D258 HydrophobicContact CG1-CB 4.31Å; V256-D258 WeakPolarHBondContact CG1-O 3.21Å; V256-K261 HydrophobicContact CG1-CB 3.94Å; V256-K261 HydrophobicContact CG1-CD 4.27Å; V256-K261 HydrophobicContact CG1-CG 3.82Å; V256-R262 HydrophobicContact CB-CB 4.32Å; V256-R262 HydrophobicContact CG1-CB 4.23Å; V256-R262 PolarHBondContact O-NH1 3.18Å; V256-L265 HydrophobicContact CG2-CD1 3.72Å
257K93.8Very high95.6Very high200 Ų20073.3 Ų73.387%0.8736%0.36SS*.  trans-73.4-39177.9-64.1-176179.5-179.70113.1E255 A259 R262E255-K257 PolarHBondContact O-N 3.41Å; K257-A259 PolarHBondContact O-N 2.92Å; K257-R262 PolarHBondContact O-NH1 3.12Å
258D93.5Very high95.5Very high91 Ų9167.8 Ų67.849%0.48734%0.335SS..  trans-67.5120.2179.9-174.9-38.3000110.7V256 K260 K261 R262V256-D258 HydrophobicContact CG1-CB 4.31Å; V256-D258 WeakPolarHBondContact CG1-O 3.21Å; D258-K260 PolarHBondContact OD1-N 2.86Å; D258-K261 HydrophobicContact CB-CB 3.99Å; D258-K261 PolarHBondContact OD1-N 3.25Å; D258-R262 VanDerWaalsContact O-CB 3.29Å; D258-R262 WeakPolarHBondContact O-CB 3.27Å; D258-R262 PolarHBondContact O-N 3.35Å
259A94.3Very high95.5Very high57 Ų5767.3 Ų67.347%0.47133%0.33SS..Hα-helixtrans-65-39.9-176.300000113.1K257 R262 E263K257-A259 PolarHBondContact O-N 2.92Å; A259-R262 PolarHBondContact O-N 2.91Å; A259-E263 WeakPolarHBondContact O-CB 3.42Å; A259-E263 PolarHBondContact O-N 3.34Å
260K92.1Very high95.5Very high164 Ų16472.6 Ų72.671%0.71335%0.353SS*.Hα-helixtrans-68.1-44.2-178.8-66.8-175.6176.9-174.80110.6D258 R262 E263 V264D258-K260 PolarHBondContact OD1-N 2.86Å; K260-R262 VanDerWaalsContact C-N 3.33Å; K260-R262 PolarHBondContact O-N 3.49Å; K260-E263 WeakPolarHBondContact O-CB 3.34Å; K260-E263 PolarHBondContact O-N 3.37Å; K260-V264 WeakPolarHBondContact O-CG2 3.14Å; K260-V264 PolarHBondContact O-N 3.3Å
261K93Very high95.4Very high23 Ų2369.9 Ų69.910%0.134%0.34CS..Hα-helixtrans-63.7-40.6176.2-179.5157.3-90.3178.50111.8L198 Q200 E207 V256 D258 V264 L265L198-K261 WeakPolarHBondContact O-CD 3.35Å; L198-K261 WeakPolarHBondContact O-CE 3.31Å; L198-K261 WeakPolarHBondContact O-CG 3.09Å; Q200-K261 PolarHBondContact O-NZ 3.31Å; E207-K261 WeakPolarHBondContact OE2-CE 3.45Å; E207-K261 IonicContact OE2-NZ 2.93Å; E207-K261 PolarHBondContact OE2-NZ 3.5Å; V256-K261 HydrophobicContact CG1-CB 3.94Å; V256-K261 HydrophobicContact CG1-CD 4.27Å; V256-K261 HydrophobicContact CG1-CG 3.82Å; D258-K261 HydrophobicContact CB-CB 3.99Å; D258-K261 PolarHBondContact OD1-N 3.25Å; K261-V264 PolarHBondContact O-N 2.98Å; K261-L265 HydrophobicContact CG-CD1 4.45Å; K261-L265 WeakPolarHBondContact O-CG 2.98Å; K261-L265 PolarHBondContact O-N 2.77Å
262R95.8Very high95.4Very high79 Ų7967.1 Ų67.130%0.29832%0.318SS..Hα-helixtrans-63.5-40.7175.7-176.2172.562.7-114.4-1.9111.9V256 K257 D258 A259 K260 L265 Y266V256-R262 HydrophobicContact CB-CB 4.32Å; V256-R262 HydrophobicContact CG1-CB 4.23Å; V256-R262 PolarHBondContact O-NH1 3.18Å; K257-R262 PolarHBondContact O-NH1 3.12Å; D258-R262 VanDerWaalsContact O-CB 3.29Å; D258-R262 WeakPolarHBondContact O-CB 3.27Å; D258-R262 PolarHBondContact O-N 3.35Å; A259-R262 PolarHBondContact O-N 2.91Å; K260-R262 VanDerWaalsContact C-N 3.33Å; K260-R262 PolarHBondContact O-N 3.49Å; R262-L265 PolarHBondContact O-N 3.06Å; R262-Y266 HydrophobicContact CG-CD2 3.93Å; R262-Y266 HydrophobicContact CG-CE2 3.4Å; R262-Y266 VanDerWaalsContact CG-CE2 3.4Å; R262-Y266 WeakPolarHBondContact O-CD2 3.44Å; R262-Y266 PolarHBondContact O-N 2.93Å
263E95.2Very high95.4Very high138 Ų13869.5 Ų69.565%0.64533%0.327SS*.Hα-helixtrans-60.6-48.1174.3-177178-17000111.8A259 K260 L265 Y266 D267A259-E263 WeakPolarHBondContact O-CB 3.42Å; A259-E263 PolarHBondContact O-N 3.34Å; K260-E263 WeakPolarHBondContact O-CB 3.34Å; K260-E263 PolarHBondContact O-N 3.37Å; E263-L265 VanDerWaalsContact C-N 3.32Å; E263-L265 PolarHBondContact O-N 3.47Å; E263-Y266 PolarHBondContact O-N 3.16Å; E263-Y266 VanDerWaalsContact O-N 3.14Å; E263-D267 PolarHBondContact O-N 3.24Å
264V94.3Very high95.3Very high40 Ų4070.8 Ų70.824%0.24233%0.333CS..Hα-helixtrans-58-43.2175.3172.70000111.7K260 K261 D267 I268K260-V264 WeakPolarHBondContact O-CG2 3.14Å; K260-V264 PolarHBondContact O-N 3.3Å; K261-V264 PolarHBondContact O-N 2.98Å; V264-D267 PolarHBondContact O-N 3.39Å; V264-I268 HydrophobicContact CG1-CD1 4.27Å; V264-I268 WeakPolarHBondContact O-CG1 3.37Å; V264-I268 PolarHBondContact O-N 3.35Å; V264-I268 VanDerWaalsContact O-N 3.11Å
265L96.6Very high95.3Very high2 Ų265.5 Ų65.51%0.0131%0.311CS..Hα-helixtrans-65.4-38.3177.2-71.7171000112.5L198 A199 I249 A253 V256 K261 R262 E263 I268 V269L198-L265 HydrophobicContact CB-CD2 3.73Å; L198-L265 HydrophobicContact CD1-CD2 4.02Å; A199-L265 HydrophobicContact CB-CD1 4.44Å; I249-L265 HydrophobicContact CG2-CB 4.38Å; I249-L265 HydrophobicContact CG2-CD2 3.96Å; A253-L265 HydrophobicContact CB-CB 3.67Å; A253-L265 HydrophobicContact CB-CD1 3.85Å; A253-L265 HydrophobicContact CB-CG 4.4Å; V256-L265 HydrophobicContact CG2-CD1 3.72Å; K261-L265 HydrophobicContact CG-CD1 4.45Å; K261-L265 WeakPolarHBondContact O-CG 2.98Å; K261-L265 PolarHBondContact O-N 2.77Å; R262-L265 PolarHBondContact O-N 3.06Å; E263-L265 VanDerWaalsContact C-N 3.32Å; E263-L265 PolarHBondContact O-N 3.47Å; L265-I268 PolarHBondContact O-N 2.87Å; L265-V269 VanDerWaalsContact O-CG2 3.29Å; L265-V269 WeakPolarHBondContact O-CG2 3.31Å; L265-V269 PolarHBondContact O-N 2.83Å
266Y97.2Very high95.2Very high87 Ų8759.9 Ų59.934%0.34129%0.292SS..Hα-helixtrans-68.8-34.6176.1-70.7-31.8000113F250 A253 R262 E263 V269 K270F250-Y266 HydrophobicContact CD2-CD1 4.08Å; F250-Y266 AromaticContact CD2-CE1 3.68Å; F250-Y266 HydrophobicContact CD2-CE1 3.68Å; F250-Y266 HydrophobicContact CE2-CD1 4.35Å; F250-Y266 AromaticContact CE2-CE1 3.74Å; F250-Y266 HydrophobicContact CE2-CE1 3.74Å; A253-Y266 HydrophobicContact CB-CD1 4.12Å; A253-Y266 HydrophobicContact CB-CE1 3.79Å; R262-Y266 HydrophobicContact CG-CD2 3.93Å; R262-Y266 HydrophobicContact CG-CE2 3.4Å; R262-Y266 VanDerWaalsContact CG-CE2 3.4Å; R262-Y266 WeakPolarHBondContact O-CD2 3.44Å; R262-Y266 PolarHBondContact O-N 2.93Å; E263-Y266 PolarHBondContact O-N 3.16Å; E263-Y266 VanDerWaalsContact O-N 3.14Å; Y266-V269 PolarHBondContact O-N 2.52Å; Y266-K270 PolarHBondContact O-N 2.67Å
267D95.3Very high95.2Very high68 Ų6863.2 Ų63.236%0.36432%0.315SS..Hα-helixtrans-60.5-46.9171.1-179.864.1000111.3E263 V264 V269 K270 R271E263-D267 PolarHBondContact O-N 3.24Å; V264-D267 PolarHBondContact O-N 3.39Å; D267-V269 VanDerWaalsContact C-N 3.35Å; D267-V269 PolarHBondContact O-N 2.91Å; D267-K270 WeakPolarHBondContact O-CB 3.27Å; D267-K270 PolarHBondContact O-N 3.19Å; D267-K270 VanDerWaalsContact O-N 3.16Å; D267-R271 WeakPolarHBondContact O-CG 3.45Å; D267-R271 PolarHBondContact O-N 3.32Å
268I96.4Very high95.1Very high1 Ų159.3 Ų59.31%0.00530%0.304CS..Hα-helixtrans-58.7-46.5174.9-62.5166.7000110.7L198 R211 F215 I249 V264 L265 K270 R271 F272L198-I268 HydrophobicContact CD1-CD1 4.05Å; R211-I268 HydrophobicContact CG-CD1 4.3Å; F215-I268 HydrophobicContact CB-CG2 4.42Å; F215-I268 HydrophobicContact CD1-CG2 4.44Å; F215-I268 HydrophobicContact CG-CG2 4.47Å; I249-I268 HydrophobicContact CD1-CG2 3.71Å; V264-I268 HydrophobicContact CG1-CD1 4.27Å; V264-I268 WeakPolarHBondContact O-CG1 3.37Å; V264-I268 PolarHBondContact O-N 3.35Å; V264-I268 VanDerWaalsContact O-N 3.11Å; L265-I268 PolarHBondContact O-N 2.87Å; I268-K270 VanDerWaalsContact C-N 3.32Å; I268-K270 PolarHBondContact O-N 3.2Å; I268-R271 PolarHBondContact O-N 3.35Å; I268-F272 HydrophobicContact CG2-CD2 3.7Å; I268-F272 HydrophobicContact CG2-CE2 3.67Å; I268-F272 WeakPolarHBondContact O-CD2 3.43Å; I268-F272 PolarHBondContact O-N 3.49Å
269V97.7Very high95Very high9 Ų958.5 Ų58.56%0.05530%0.299CS..Hα-helixtrans-56.3-45.1176.41690000111.6A246 I249 F250 L265 Y266 D267 R271 F272 H273A246-V269 HydrophobicContact CB-CG1 4.42Å; I249-V269 HydrophobicContact CB-CG2 3.73Å; I249-V269 HydrophobicContact CG2-CG2 3.52Å; F250-V269 HydrophobicContact CB-CG1 4.32Å; F250-V269 HydrophobicContact CB-CG2 4.04Å; L265-V269 VanDerWaalsContact O-CG2 3.29Å; L265-V269 WeakPolarHBondContact O-CG2 3.31Å; L265-V269 PolarHBondContact O-N 2.83Å; Y266-V269 PolarHBondContact O-N 2.52Å; D267-V269 VanDerWaalsContact C-N 3.35Å; D267-V269 PolarHBondContact O-N 2.91Å; V269-R271 VanDerWaalsContact C-N 3.34Å; V269-R271 PolarHBondContact O-N 2.92Å; V269-F272 PolarHBondContact O-N 3.13Å; V269-H273 PolarHBondContact O-CD2 3.25Å; V269-H273 VanDerWaalsContact O-CD2 3.31Å; V269-H273 PolarHBondContact O-N 3.47Å
270K96.3Very high94.8Very high111 Ų11157 Ų5748%0.48328%0.283SS..Hα-helixtrans-57.6-47.4177.3-177.4-172.9174.7-168.60110.8Y266 D267 I268 F272 H273 L274Y266-K270 PolarHBondContact O-N 2.67Å; D267-K270 WeakPolarHBondContact O-CB 3.27Å; D267-K270 PolarHBondContact O-N 3.19Å; D267-K270 VanDerWaalsContact O-N 3.16Å; I268-K270 VanDerWaalsContact C-N 3.32Å; I268-K270 PolarHBondContact O-N 3.2Å; K270-F272 PolarHBondContact O-N 3.38Å; K270-H273 PolarHBondContact O-N 2.95Å; K270-L274 WeakPolarHBondContact O-CG 3.47Å; K270-L274 PolarHBondContact O-N 3.05Å
271R96.5Very high94.6Very high21 Ų2149.1 Ų49.18%0.07925%0.249CC..Hα-helixtrans-63-40.6-179.8-64172.477-150.8-0.3112.5D216 L219 D267 I268 V269 L274 V275 P281 E285D216-R271 IonicContact OD1-CZ 2.9Å; D216-R271 IonicContact OD1-NH1 3.74Å; D216-R271 PolarHBondContact OD1-NH1 2.95Å; D216-R271 IonicContact OD1-NH2 3.48Å; L219-R271 HydrophobicContact CD1-CB 3.8Å; L219-R271 HydrophobicContact CD2-CB 4.11Å; D267-R271 WeakPolarHBondContact O-CG 3.45Å; D267-R271 PolarHBondContact O-N 3.32Å; I268-R271 PolarHBondContact O-N 3.35Å; V269-R271 VanDerWaalsContact C-N 3.34Å; V269-R271 PolarHBondContact O-N 2.92Å; R271-L274 PolarHBondContact O-N 3.39Å; R271-V275 PolarHBondContact O-N 3.29Å; R271-V275 VanDerWaalsContact O-N 3.16Å; R271-P281 HydrophobicContact CB-CB 4.08Å; R271-P281 HydrophobicContact CG-CB 4.29Å; R271-E285 VanDerWaalsContact CD-OE1 3.3Å; R271-E285 WeakPolarHBondContact CD-OE1 3.49Å; R271-E285 IonicContact CZ-OE1 3.49Å; R271-E285 IonicContact NE-OE1 3.84Å; R271-E285 PolarHBondContact NE-OE1 3.35Å; R271-E285 IonicContact NH2-OE1 3.77Å
272F97.1Very high94.1Very high0 Ų050.7 Ų50.70%026%0.258CS..Hα-helixtrans-65.8-36.4173.8-85.1-81.8000112.9F215 I218 L219 F242 I245 A246 I249 I268 V269 K270 V275 A276F215-F272 HydrophobicContact CB-CE2 4.23Å; F215-F272 AromaticContact CD1-CE2 3.77Å; F215-F272 HydrophobicContact CD1-CE2 3.77Å; F215-F272 AromaticContact CD1-CZ 3.93Å; F215-F272 HydrophobicContact CD1-CZ 3.93Å; F215-F272 HydrophobicContact CG-CE2 4.46Å; I218-F272 HydrophobicContact CB-CZ 4.37Å; I218-F272 HydrophobicContact CG2-CE1 3.8Å; I218-F272 HydrophobicContact CG2-CZ 4.11Å; L219-F272 HydrophobicContact CD1-CD2 4.41Å; L219-F272 HydrophobicContact CD1-CE2 4.08Å; L219-F272 HydrophobicContact CD2-CD1 4.08Å; L219-F272 HydrophobicContact CD2-CD2 4.05Å; L219-F272 HydrophobicContact CD2-CE1 4.12Å; L219-F272 HydrophobicContact CD2-CE2 4.09Å; L219-F272 HydrophobicContact CD2-CG 4.02Å; L219-F272 HydrophobicContact CD2-CZ 4.12Å; L219-F272 HydrophobicContact CG-CD2 4.44Å; L219-F272 HydrophobicContact CG-CE1 4.46Å; L219-F272 HydrophobicContact CG-CE2 4.02Å; L219-F272 HydrophobicContact CG-CZ 4.03Å; F242-F272 HydrophobicContact CB-CD1 4.29Å; F242-F272 AromaticContact CD1-CD1 3.87Å; F242-F272 HydrophobicContact CD1-CD1 3.87Å; F242-F272 HydrophobicContact CD1-CE1 4.03Å; I245-F272 HydrophobicContact CB-CD1 4.15Å; I245-F272 HydrophobicContact CB-CE1 4.24Å; I245-F272 HydrophobicContact CD1-CE1 4.11Å; I245-F272 HydrophobicContact CG2-CD1 3.81Å; I245-F272 HydrophobicContact CG2-CD2 4.3Å; I245-F272 HydrophobicContact CG2-CE1 3.64Å; I245-F272 HydrophobicContact CG2-CE2 4.15Å; I245-F272 HydrophobicContact CG2-CG 4.16Å; I245-F272 HydrophobicContact CG2-CZ 3.83Å; A246-F272 HydrophobicContact CB-CB 3.86Å; I249-F272 HydrophobicContact CD1-CD2 4.03Å; I249-F272 HydrophobicContact CD1-CE2 4.08Å; I268-F272 HydrophobicContact CG2-CD2 3.7Å; I268-F272 HydrophobicContact CG2-CE2 3.67Å; I268-F272 WeakPolarHBondContact O-CD2 3.43Å; I268-F272 PolarHBondContact O-N 3.49Å; V269-F272 PolarHBondContact O-N 3.13Å; K270-F272 PolarHBondContact O-N 3.38Å; F272-V275 PolarHBondContact O-N 2.77Å; F272-A276 WeakPolarHBondContact O-CB 3.28Å; F272-A276 PolarHBondContact O-N 2.82Å
273H96.4Very high93.4Very high79 Ų7951.7 Ų51.737%0.36627%0.266SS..Hα-helixtrans-67.5-35.7173.8-77.9-51.7000113.5V269 K270 A276 S277V269-H273 PolarHBondContact O-CD2 3.25Å; V269-H273 VanDerWaalsContact O-CD2 3.31Å; V269-H273 PolarHBondContact O-N 3.47Å; K270-H273 PolarHBondContact O-N 2.95Å; H273-A276 PolarHBondContact O-N 3.34Å; H273-S277 PolarHBondContact O-N 3.25Å; H273-S277 PolarHBondContact O-OG 2.69Å
274L95.2Very high92.7Very high27 Ų2748.3 Ų48.314%0.14125%0.25CS..Hα-helixtrans-59.8-51.2173.1-69.8172.6000110.4K270 R271 A276 S277 N278 I279 P281 E284K270-L274 WeakPolarHBondContact O-CG 3.47Å; K270-L274 PolarHBondContact O-N 3.05Å; R271-L274 PolarHBondContact O-N 3.39Å; L274-A276 VanDerWaalsContact C-N 3.33Å; L274-A276 PolarHBondContact O-N 2.99Å; L274-S277 CarbonylContact O-C 3.33Å; L274-S277 WeakPolarHBondContact O-CA 3.29Å; L274-S277 WeakPolarHBondContact O-CB 3.47Å; L274-S277 PolarHBondContact O-N 3.31Å; L274-N278 PolarHBondContact O-N 2.98Å; L274-I279 CarbonylContact C-O 3.2Å; L274-I279 HydrophobicContact CB-CB 4.23Å; L274-I279 HydrophobicContact CB-CG2 4.46Å; L274-I279 HydrophobicContact CD2-CB 4.24Å; L274-I279 HydrophobicContact CD2-CD1 4.2Å; L274-I279 HydrophobicContact CD2-CG2 4.02Å; L274-I279 WeakPolarHBondContact O-CB 3.18Å; L274-I279 PolarHBondContact O-N 3.19Å; L274-P281 HydrophobicContact CB-CB 4.36Å; L274-P281 HydrophobicContact CD1-CB 4.15Å; L274-E284 HydrophobicContact CD1-CB 3.96Å; L274-E284 HydrophobicContact CD1-CG 3.91Å; L274-E284 HydrophobicContact CD2-CG 4.32Å
275V94.4Very high92.1Very high8 Ų850 Ų505%0.04826%0.256CS..Hα-helixtrans-60.5-42.2176.9174.70000111.7L219 A222 I226 F242 R271 F272 S277 N278 I279 P281L219-V275 HydrophobicContact CD2-CG2 3.82Å; A222-V275 HydrophobicContact CB-CB 4.44Å; A222-V275 HydrophobicContact CB-CG1 3.37Å; A222-V275 HydrophobicContact CB-CG2 4.15Å; I226-V275 HydrophobicContact CD1-CG1 4.33Å; F242-V275 HydrophobicContact CB-CG1 4.49Å; F242-V275 HydrophobicContact CD1-CG1 3.82Å; F242-V275 HydrophobicContact CD2-CG1 3.55Å; F242-V275 HydrophobicContact CE1-CG1 3.8Å; F242-V275 HydrophobicContact CE2-CG1 3.53Å; F242-V275 HydrophobicContact CG-CB 4.39Å; F242-V275 HydrophobicContact CG-CG1 3.69Å; F242-V275 HydrophobicContact CZ-CG1 3.66Å; R271-V275 PolarHBondContact O-N 3.29Å; R271-V275 VanDerWaalsContact O-N 3.16Å; F272-V275 PolarHBondContact O-N 2.77Å; V275-S277 PolarHBondContact O-N 3.36Å; V275-N278 PolarHBondContact O-N 3.06Å; V275-I279 PolarHBondContact N-O 3.32Å; V275-P281 HydrophobicContact CG2-CB 4.46Å; V275-P281 VanDerWaalsContact CG2-CD 3.46Å; V275-P281 HydrophobicContact CG2-CG 3.59Å
276A94Very high91.2Very high41 Ų4153.9 Ų53.934%0.33928%0.276SS..Hα-helixtrans-59.9-27.2175.300000112.7F242 F272 H273 L274 N278F242-A276 HydrophobicContact CB-CB 3.9Å; F272-A276 WeakPolarHBondContact O-CB 3.28Å; F272-A276 PolarHBondContact O-N 2.82Å; H273-A276 PolarHBondContact O-N 3.34Å; L274-A276 VanDerWaalsContact C-N 3.33Å; L274-A276 PolarHBondContact O-N 2.99Å; A276-N278 VanDerWaalsContact C-N 3.33Å
277S93.7Very high90.3Very high81 Ų8152.7 Ų52.757%0.56628%0.275SS*.THydrogen-bonded Turntrans-91.59.8175.8-50.40000113.3H273 L274 V275 I279H273-S277 PolarHBondContact O-N 3.25Å; H273-S277 PolarHBondContact O-OG 2.69Å; L274-S277 CarbonylContact O-C 3.33Å; L274-S277 WeakPolarHBondContact O-CA 3.29Å; L274-S277 WeakPolarHBondContact O-CB 3.47Å; L274-S277 PolarHBondContact O-N 3.31Å; V275-S277 PolarHBondContact O-N 3.36Å; S277-I279 PolarHBondContact O-N 2.87Å
278N91.6Very high89.4Confident119 Ų11952.1 Ų52.164%0.63627%0.274SS*.THydrogen-bonded Turntrans59.232.5-175.7-161.170.2000113.3L274 V275 A276L274-N278 PolarHBondContact O-N 2.98Å; V275-N278 PolarHBondContact O-N 3.06Å; A276-N278 VanDerWaalsContact C-N 3.33Å
279I91.7Very high88.3Confident74 Ų7454.2 Ų54.238%0.37929%0.292SS..  trans-105.7131.2173.5-58.9168000107.8L274 V275 S277 P281L274-I279 CarbonylContact C-O 3.2Å; L274-I279 HydrophobicContact CB-CB 4.23Å; L274-I279 HydrophobicContact CB-CG2 4.46Å; L274-I279 HydrophobicContact CD2-CB 4.24Å; L274-I279 HydrophobicContact CD2-CD1 4.2Å; L274-I279 HydrophobicContact CD2-CG2 4.02Å; L274-I279 WeakPolarHBondContact O-CB 3.18Å; L274-I279 PolarHBondContact O-N 3.19Å; V275-I279 PolarHBondContact N-O 3.32Å; S277-I279 PolarHBondContact O-N 2.87Å; I279-P281 VanDerWaalsContact O-CD 3.3Å; I279-P281 WeakPolarHBondContact O-CD 3.46Å
280D90.8Very high86.8Confident24 Ų2460.9 Ų60.913%0.12832%0.317CS..  trans-72.3113178.1-176.4-8.4000110.2S223 I226 S227 L282 Q283 E284S223-D280 VanDerWaalsContact CB-OD1 3.25Å; S223-D280 WeakPolarHBondContact CB-OD1 3.38Å; S223-D280 PolarHBondContact OG-OD1 2.78Å; S223-D280 PolarHBondContact OG-OD2 2.94Å; S223-D280 VanDerWaalsContact OG-OD2 3.08Å; I226-D280 HydrophobicContact CG2-CB 4.37Å; S227-D280 PolarHBondContact OG-OD2 3.39Å; D280-L282 VanDerWaalsContact C-N 3.25Å; D280-L282 PolarHBondContact O-N 3.16Å; D280-L282 PolarHBondContact OD1-N 3.49Å; D280-Q283 HydrophobicContact CB-CB 3.83Å; D280-Q283 PolarHBondContact O-N 3.45Å; D280-E284 PolarHBondContact O-N 3.08Å
281P87.4Confident85.4Confident0 Ų061.6 Ų61.60%032%0.322CS..Hα-helixtrans-64.8-30.2-176.428.2-36.5000112.5R271 L274 V275 I279 E284 E285R271-P281 HydrophobicContact CB-CB 4.08Å; R271-P281 HydrophobicContact CG-CB 4.29Å; L274-P281 HydrophobicContact CB-CB 4.36Å; L274-P281 HydrophobicContact CD1-CB 4.15Å; V275-P281 HydrophobicContact CG2-CB 4.46Å; V275-P281 VanDerWaalsContact CG2-CD 3.46Å; V275-P281 HydrophobicContact CG2-CG 3.59Å; I279-P281 VanDerWaalsContact O-CD 3.3Å; I279-P281 WeakPolarHBondContact O-CD 3.46Å; P281-E284 PolarHBondContact O-N 3.1Å; P281-E285 VanDerWaalsContact O-CG 3.31Å; P281-E285 WeakPolarHBondContact O-CG 3.38Å; P281-E285 PolarHBondContact O-N 3.13Å
282L82.9Confident84.1Confident56 Ų5663.7 Ų63.729%0.29334%0.34SS..Hα-helixtrans-73.7-36.5179.3-61.1178.1000111.1L220 D280 L286L220-L282 HydrophobicContact CD1-CD1 3.9Å; D280-L282 VanDerWaalsContact C-N 3.25Å; D280-L282 PolarHBondContact O-N 3.16Å; D280-L282 PolarHBondContact OD1-N 3.49Å; L282-L286 WeakPolarHBondContact O-CG 3.3Å; L282-L286 PolarHBondContact O-N 3.39Å; L282-L286 VanDerWaalsContact O-N 3.16Å
283Q81.2Confident82.5Confident100 Ų10068 Ų6847%0.46736%0.363SS..Hα-helixtrans-68.7-39.1174.6-170.364.225.900111.2D280 L286 N287D280-Q283 HydrophobicContact CB-CB 3.83Å; D280-Q283 PolarHBondContact O-N 3.45Å; Q283-L286 WeakPolarHBondContact O-CB 3.47Å; Q283-L286 PolarHBondContact O-N 3.4Å; Q283-N287 PolarHBondContact O-N 3.12Å; Q283-N287 PolarHBondContact O-ND2 3.46Å; Q283-N287 PolarHBondContact O-OD1 2.89Å
284E81.1Confident80.8Confident66 Ų6669 Ų6931%0.30837%0.371SS..Hα-helixtrans-66.4-41177.6-170.367.2-177.100112.1L274 D280 P281 L286 N287 T288L274-E284 HydrophobicContact CD1-CB 3.96Å; L274-E284 HydrophobicContact CD1-CG 3.91Å; L274-E284 HydrophobicContact CD2-CG 4.32Å; D280-E284 PolarHBondContact O-N 3.08Å; P281-E284 PolarHBondContact O-N 3.1Å; E284-L286 VanDerWaalsContact C-N 3.31Å; E284-L286 PolarHBondContact O-N 2.84Å; E284-N287 PolarHBondContact O-N 3.33Å; E284-T288 WeakPolarHBondContact O-CG2 3.36Å; E284-T288 PolarHBondContact O-N 3.39Å; E284-T288 PolarHBondContact O-OG1 3.17Å; E284-T288 VanDerWaalsContact O-OG1 3.09Å
285E80.1Confident79.1Confident77 Ų7774.4 Ų74.436%0.3640%0.396SS..Hα-helixtrans-58-43.7172-77.4167-149.400111.6R271 P281 T288 A289R271-E285 VanDerWaalsContact CD-OE1 3.3Å; R271-E285 WeakPolarHBondContact CD-OE1 3.49Å; R271-E285 IonicContact CZ-OE1 3.49Å; R271-E285 IonicContact NE-OE1 3.84Å; R271-E285 PolarHBondContact NE-OE1 3.35Å; R271-E285 IonicContact NH2-OE1 3.77Å; P281-E285 VanDerWaalsContact O-CG 3.31Å; P281-E285 WeakPolarHBondContact O-CG 3.38Å; P281-E285 PolarHBondContact O-N 3.13Å; E285-T288 PolarHBondContact O-OG1 2.77Å; E285-A289 WeakPolarHBondContact O-CB 3.25Å; E285-A289 PolarHBondContact O-N 3.17Å
286L77.9Confident77.5Confident83 Ų8376.7 Ų76.744%0.43541%0.412SS..Hα-helixtrans-62-47174.7-73.2166.2000111.6L282 Q283 E284 T288 A289 Y290L282-L286 WeakPolarHBondContact O-CG 3.3Å; L282-L286 PolarHBondContact O-N 3.39Å; L282-L286 VanDerWaalsContact O-N 3.16Å; Q283-L286 WeakPolarHBondContact O-CB 3.47Å; Q283-L286 PolarHBondContact O-N 3.4Å; E284-L286 VanDerWaalsContact C-N 3.31Å; E284-L286 PolarHBondContact O-N 2.84Å; L286-T288 PolarHBondContact O-N 2.87Å; L286-A289 PolarHBondContact O-N 3.26Å; L286-Y290 HydrophobicContact CB-CE2 4.26Å; L286-Y290 WeakPolarHBondContact O-CD2 3.48Å; L286-Y290 PolarHBondContact O-N 3.13Å
287N77.8Confident75.9Confident61 Ų6179.1 Ų79.133%0.32642%0.418SS..Hα-helixtrans-59-47.8179.8-65.6-18.3000111.5Q283 E284 A289 Y290 E291Q283-N287 PolarHBondContact O-N 3.12Å; Q283-N287 PolarHBondContact O-ND2 3.46Å; Q283-N287 PolarHBondContact O-OD1 2.89Å; E284-N287 PolarHBondContact O-N 3.33Å; N287-A289 VanDerWaalsContact C-N 3.32Å; N287-A289 PolarHBondContact O-N 3.13Å; N287-Y290 PolarHBondContact O-N 3.35Å; N287-E291 WeakPolarHBondContact O-CG 3.4Å; N287-E291 PolarHBondContact O-N 2.75Å
288T78.1Confident74.2Confident56 Ų5680.1 Ų80.134%0.34442%0.417SS..Hα-helixtrans-65.5-32.917954.90000113.1E284 E285 L286 S292E284-T288 WeakPolarHBondContact O-CG2 3.36Å; E284-T288 PolarHBondContact O-N 3.39Å; E284-T288 PolarHBondContact O-OG1 3.17Å; E284-T288 VanDerWaalsContact O-OG1 3.09Å; E285-T288 PolarHBondContact O-OG1 2.77Å; L286-T288 PolarHBondContact O-N 2.87Å; T288-S292 PolarHBondContact O-N 3.27Å; T288-S292 VanDerWaalsContact O-N 3.13Å; T288-S292 PolarHBondContact O-OG 3.3Å
289A72Confident72.7Confident45 Ų4577.8 Ų77.837%0.37241%0.407SS..Hα-helixtrans-64.9-45.9173.100000111.6E285 L286 N287 S292 D293E285-A289 WeakPolarHBondContact O-CB 3.25Å; E285-A289 PolarHBondContact O-N 3.17Å; L286-A289 PolarHBondContact O-N 3.26Å; N287-A289 VanDerWaalsContact C-N 3.32Å; N287-A289 PolarHBondContact O-N 3.13Å; A289-S292 PolarHBondContact O-N 3.43Å; A289-S292 PolarHBondContact O-OG 3.21Å; A289-D293 PolarHBondContact O-N 3.44Å
290Y65.9Low71.1Confident149 Ų14979.3 Ų79.358%0.58442%0.416SS*.Hα-helixtrans-63.7-41.5177.1-71.2-64.4000112.8L286 N287 S292 D293 D294L286-Y290 HydrophobicContact CB-CE2 4.26Å; L286-Y290 WeakPolarHBondContact O-CD2 3.48Å; L286-Y290 PolarHBondContact O-N 3.13Å; N287-Y290 PolarHBondContact O-N 3.35Å; Y290-S292 VanDerWaalsContact C-N 3.3Å; Y290-S292 PolarHBondContact O-N 3.25Å; Y290-D293 PolarHBondContact O-N 3.07Å; Y290-D294 PolarHBondContact O-N 3.16Å
291E68Low69.6Low127 Ų12784.7 Ų84.759%0.59344%0.442SS*.Hα-helixtrans-60.9-39.6175.8-73176.6178.400111.7N287 D294 E295N287-E291 WeakPolarHBondContact O-CG 3.4Å; N287-E291 PolarHBondContact O-N 2.75Å; E291-D294 PolarHBondContact O-N 3.06Å; E291-E295 WeakPolarHBondContact O-CG 3.36Å; E291-E295 PolarHBondContact O-N 3.5Å
292S68Low68.3Low64 Ų6490.3 Ų90.345%0.44848%0.476SS..Hα-helixtrans-68.8-35.5177.272.90000113.4T288 A289 Y290 S296T288-S292 PolarHBondContact O-N 3.27Å; T288-S292 VanDerWaalsContact O-N 3.13Å; T288-S292 PolarHBondContact O-OG 3.3Å; A289-S292 PolarHBondContact O-N 3.43Å; A289-S292 PolarHBondContact O-OG 3.21Å; Y290-S292 VanDerWaalsContact C-N 3.3Å; Y290-S292 PolarHBondContact O-N 3.25Å; S292-S296 WeakPolarHBondContact O-CB 3.32Å; S292-S296 PolarHBondContact O-N 3.47Å
293D64.6Low67.1Low90 Ų9096.9 Ų96.948%0.48150%0.497SS..Hα-helixtrans-68.3-42.5175.6-76.1-17.2000110.5A289 Y290 E295 S296 I297A289-D293 PolarHBondContact O-N 3.44Å; Y290-D293 PolarHBondContact O-N 3.07Å; D293-E295 PolarHBondContact O-N 2.97Å; D293-S296 PolarHBondContact O-N 2.89Å; D293-S296 PolarHBondContact O-OG 3.01Å; D293-I297 VanDerWaalsContact O-CG1 3.29Å; D293-I297 WeakPolarHBondContact O-CG1 3.46Å; D293-I297 PolarHBondContact O-N 3.43Å
294D59.9Low65.8Low101 Ų10197.6 Ų97.654%0.5451%0.508SS..Hα-helixtrans-64.7-38.5176.5-80.6-17.6000112.6Y290 E291 N298Y290-D294 PolarHBondContact O-N 3.16Å; E291-D294 PolarHBondContact O-N 3.06Å; D294-N298 WeakPolarHBondContact O-CB 3.38Å; D294-N298 PolarHBondContact O-N 3.36Å; D294-N298 PolarHBondContact O-ND2 3.32Å; D294-N298 VanDerWaalsContact O-ND2 3.16Å
295E61Low63.9Low141 Ų141105.2 Ų105.266%0.65955%0.551SS**Hα-helixtrans-66.2-37.1173.1-76.6-170.1171.700112.3E291 D293 N298 T299E291-E295 WeakPolarHBondContact O-CG 3.36Å; E291-E295 PolarHBondContact O-N 3.5Å; D293-E295 PolarHBondContact O-N 2.97Å; E295-N298 PolarHBondContact O-N 3.15Å; E295-T299 WeakPolarHBondContact O-CB 3.35Å; E295-T299 PolarHBondContact O-N 2.89Å; E295-T299 PolarHBondContact O-OG1 3.41Å
296S60.2Low63.1Low55 Ų55106.6 Ų106.639%0.38556%0.56SS.*Hα-helixtrans-66.5-42.4176.879.80000112S292 D293 T299 D300S292-S296 WeakPolarHBondContact O-CB 3.32Å; S292-S296 PolarHBondContact O-N 3.47Å; D293-S296 PolarHBondContact O-N 2.89Å; D293-S296 PolarHBondContact O-OG 3.01Å; S296-T299 PolarHBondContact O-N 3.22Å; S296-D300 PolarHBondContact O-N 3.21Å
297I60.6Low62.3Low93 Ų93107.8 Ų107.848%0.47757%0.567SS.*Hα-helixtrans-63.4-44.4176.8-67.6165.4000110.2D293 T299 D300 M301D293-I297 VanDerWaalsContact O-CG1 3.29Å; D293-I297 WeakPolarHBondContact O-CG1 3.46Å; D293-I297 PolarHBondContact O-N 3.43Å; I297-T299 VanDerWaalsContact C-N 3.34Å; I297-T299 PolarHBondContact O-N 3.46Å; I297-D300 PolarHBondContact O-N 2.88Å; I297-M301 WeakPolarHBondContact O-CG 3.4Å; I297-M301 PolarHBondContact O-N 3.43Å
298N57.5Low61.4Low101 Ų101110.4 Ų110.454%0.5458%0.58SS.*Hα-helixtrans-65.5-36.5177.2-79.5-40.2000112.5D294 E295 M301 V302D294-N298 WeakPolarHBondContact O-CB 3.38Å; D294-N298 PolarHBondContact O-N 3.36Å; D294-N298 PolarHBondContact O-ND2 3.32Å; D294-N298 VanDerWaalsContact O-ND2 3.16Å; E295-N298 PolarHBondContact O-N 3.15Å; N298-M301 PolarHBondContact O-N 3.36Å; N298-V302 VanDerWaalsContact O-CG2 3.25Å; N298-V302 WeakPolarHBondContact O-CG2 3.5Å; N298-V302 PolarHBondContact O-N 3.05Å; N298-V302 VanDerWaalsContact O-N 3.15Å
299T59.8Low60.5Low71 Ų71113.6 Ų113.644%0.43659%0.594SS.*Hα-helixtrans-70.9-36179.4-52.80000112.1E295 S296 I297 V302 R303E295-T299 WeakPolarHBondContact O-CB 3.35Å; E295-T299 PolarHBondContact O-N 2.89Å; E295-T299 PolarHBondContact O-OG1 3.41Å; S296-T299 PolarHBondContact O-N 3.22Å; I297-T299 VanDerWaalsContact C-N 3.34Å; I297-T299 PolarHBondContact O-N 3.46Å; T299-V302 PolarHBondContact O-N 3.45Å; T299-R303 PolarHBondContact O-N 2.8Å
300D59.1Low59.7Low106 Ų106117.9 Ų117.957%0.56761%0.608SS**Hα-helixtrans-72.7-32175.3-78.1-15.2000112.1S296 I297 R303S296-D300 PolarHBondContact O-N 3.21Å; I297-D300 PolarHBondContact O-N 2.88Å; D300-R303 PolarHBondContact O-N 3.29Å
301M58.9Low59.3Low136 Ų136115.9 Ų115.967%0.6761%0.61SS**Hα-helixtrans-68.5-31.1172.3-75.6-169.765.800113.4I297 N298 R303I297-M301 WeakPolarHBondContact O-CG 3.4Å; I297-M301 PolarHBondContact O-N 3.43Å; N298-M301 PolarHBondContact O-N 3.36Å; M301-R303 VanDerWaalsContact C-N 3.32Å
302V59.7Low58.7Low118 Ų118115.1 Ų115.172%0.71561%0.611SS**Hα-helixtrans-81-11.5179.5175.60000112.6N298 T299N298-V302 VanDerWaalsContact O-CG2 3.25Å; N298-V302 WeakPolarHBondContact O-CG2 3.5Å; N298-V302 PolarHBondContact O-N 3.05Å; N298-V302 VanDerWaalsContact O-N 3.15Å; T299-V302 PolarHBondContact O-N 3.45Å
303R57.1Low58Low194 Ų194119 Ų11973%0.73262%0.624SS**THydrogen-bonded Turntrans-93.37177.9-79.2-179.2172.7162.61.3114.6T299 D300 M301T299-R303 PolarHBondContact O-N 2.8Å; D300-R303 PolarHBondContact O-N 3.29Å; M301-R303 VanDerWaalsContact C-N 3.32Å
304V54.2Low57.5Low115 Ų115121.4 Ų121.470%0.69764%0.635SS**  trans-115.164.5176.3-168.10000109.2
305D41.8Very low57.2Low226 Ų226123.3 Ų123.3100%1.20964%0.644SS**  trans-156.90164.5-85.3-34.3000108.6

Retrieved 305 of 305 residues in 2675.4 ms (Link to these results)

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