A0A5K4F4E2_SCHMA Loading...

Phosphate transporter

Sodium-phosphate symporter.

AlphaFold DB , UniProt , Accession A0A5K4F4E2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 527 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
1M51.8Low88.7Confident179 Ų17979.3 Ų79.388%0.88239%0.387SS*.  0142.30-172.6160.9174.100107.9I3 I8M1-I3 VanDerWaalsContact C-N 3.33Å; M1-I8 HydrophobicContact CE-CD1 3.36Å; M1-I8 HydrophobicContact CE-CG1 3.68Å; M1-I8 HydrophobicContact SD-CD1 3.99Å
2L80.3Confident89.4Confident135 Ų13579.1 Ų79.171%0.70739%0.394SS*.  trans-80.2-11.9-176-87.7166.1000114.4
3I89.2Confident90Very high21 Ų2177.2 Ų77.211%0.10839%0.389CS..SBendtrans-122.3128.5-175.2-52175.1000107M1 Q7 I8 V11 W457 A460 T461M1-I3 VanDerWaalsContact C-N 3.33Å; I3-Q7 HydrophobicContact CG2-CB 4.14Å; I3-I8 HydrophobicContact CG2-CG1 4.49Å; I3-V11 HydrophobicContact CD1-CG2 4.37Å; I3-V11 HydrophobicContact CG2-CG2 4.41Å; I3-W457 HydrophobicContact CD1-CZ3 4.27Å; I3-A460 HydrophobicContact CD1-CB 4.08Å; I3-A460 HydrophobicContact CG1-CB 4.17Å; I3-A460 HydrophobicContact CG2-CB 4.08Å; I3-T461 HydrophobicContact CD1-CG2 4.16Å; I3-T461 HydrophobicContact CG1-CG2 4.23Å
4P91.5Very high90.6Very high44 Ų4471.6 Ų71.629%0.28636%0.361SS..  trans-59.3146.3174.4-27.237.4000113D6 Q7 I8P4-D6 VanDerWaalsContact C-N 3.33Å; P4-D6 WeakPolarHBondContact CB-OD1 3.28Å; P4-D6 PolarHBondContact O-N 3.04Å; P4-Q7 HydrophobicContact CB-CG 4.11Å; P4-Q7 HydrophobicContact CG-CG 4.48Å; P4-Q7 WeakPolarHBondContact O-CB 3.49Å; P4-Q7 PolarHBondContact O-N 3.2Å; P4-I8 PolarHBondContact O-N 3.02Å
5E91.4Very high91.1Very high165 Ų16568.5 Ų68.577%0.77134%0.344SS*.G310 helixtrans-63.6-37.3-170.7-66.2-172.9174.200113.1Q7 I8E5-Q7 PolarHBondContact O-N 3.31Å; E5-I8 HydrophobicContact CB-CD1 4.29Å; E5-I8 HydrophobicContact CG-CD1 4.3Å; E5-I8 PolarHBondContact O-N 2.89Å
6D92.1Very high91.6Very high103 Ų10369.9 Ų69.955%0.55135%0.352SS*.G310 helixtrans-64.8-16.7174.764-62.8000113.7P4 W9P4-D6 VanDerWaalsContact C-N 3.33Å; P4-D6 WeakPolarHBondContact CB-OD1 3.28Å; P4-D6 PolarHBondContact O-N 3.04Å; D6-W9 PolarHBondContact O-NE1 3.02Å
7Q94.2Very high92Very high6 Ų668 Ų683%0.02834%0.342CS..G310 helixtrans-102.4-15.4-178.8-58.4178.915.700113.6I3 P4 E5 W9 M10 M92I3-Q7 HydrophobicContact CG2-CB 4.14Å; P4-Q7 HydrophobicContact CB-CG 4.11Å; P4-Q7 HydrophobicContact CG-CG 4.48Å; P4-Q7 WeakPolarHBondContact O-CB 3.49Å; P4-Q7 PolarHBondContact O-N 3.2Å; E5-Q7 PolarHBondContact O-N 3.31Å; Q7-W9 VanDerWaalsContact C-N 3.28Å; Q7-W9 PolarHBondContact O-N 3.45Å; Q7-M10 HydrophobicContact CB-CE 4.01Å; Q7-M10 HydrophobicContact CG-CE 4.1Å; Q7-M10 PolarHBondContact O-N 3.26Å; Q7-M92 HydrophobicContact CB-CE 4.05Å
8I94.9Very high92.3Very high52 Ų5264.2 Ų64.227%0.26732%0.323SS..Hα-helixtrans-55.9-42.7-175.2-63.8168.5000111.5M1 I3 P4 E5 M10 V11 V12M1-I8 HydrophobicContact CE-CD1 3.36Å; M1-I8 HydrophobicContact CE-CG1 3.68Å; M1-I8 HydrophobicContact SD-CD1 3.99Å; I3-I8 HydrophobicContact CG2-CG1 4.49Å; P4-I8 PolarHBondContact O-N 3.02Å; E5-I8 HydrophobicContact CB-CD1 4.29Å; E5-I8 HydrophobicContact CG-CD1 4.3Å; E5-I8 PolarHBondContact O-N 2.89Å; I8-M10 VanDerWaalsContact C-N 3.28Å; I8-M10 PolarHBondContact O-N 3.47Å; I8-V11 WeakPolarHBondContact O-CB 3.4Å; I8-V11 PolarHBondContact O-N 2.97Å; I8-V12 HydrophobicContact CG2-CG2 3.97Å; I8-V12 PolarHBondContact O-N 3.34Å
9W96.2Very high92.6Very high152 Ų15263.8 Ų63.858%0.57632%0.32SS*.Hα-helixtrans-60.5-37.6-175.871.1-91.1000112D6 Q7 V11 V12 V13D6-W9 PolarHBondContact O-NE1 3.02Å; Q7-W9 VanDerWaalsContact C-N 3.28Å; Q7-W9 PolarHBondContact O-N 3.45Å; W9-V11 VanDerWaalsContact C-N 3.31Å; W9-V11 PolarHBondContact O-N 3.18Å; W9-V12 PolarHBondContact O-N 3.15Å; W9-V13 HydrophobicContact CE3-CG2 4.38Å; W9-V13 VanDerWaalsContact O-CB 3.28Å; W9-V13 WeakPolarHBondContact O-CB 3.15Å; W9-V13 VanDerWaalsContact O-CG2 3.24Å; W9-V13 WeakPolarHBondContact O-CG2 3.4Å; W9-V13 PolarHBondContact O-N 2.87Å
10M97.4Very high92.8Very high4 Ų464 Ų642%0.0232%0.321CS..Hα-helixtrans-61.8-42.2176.2-72-172.5-79.800111Q7 I8 G14 V89 M92 A93 V96 L456Q7-M10 HydrophobicContact CB-CE 4.01Å; Q7-M10 HydrophobicContact CG-CE 4.1Å; Q7-M10 PolarHBondContact O-N 3.26Å; I8-M10 VanDerWaalsContact C-N 3.28Å; I8-M10 PolarHBondContact O-N 3.47Å; M10-G14 WeakPolarHBondContact O-CA 3.3Å; M10-G14 PolarHBondContact O-N 3.15Å; M10-V89 HydrophobicContact CE-CG1 3.65Å; M10-M92 HydrophobicContact CB-CE 4.4Å; M10-M92 HydrophobicContact CE-CB 4.1Å; M10-M92 HydrophobicContact CE-CE 3.83Å; M10-M92 HydrophobicContact CE-SD 4.45Å; M10-M92 HydrophobicContact SD-CB 3.86Å; M10-A93 HydrophobicContact SD-CB 4.05Å; M10-V96 HydrophobicContact CB-CG2 4.16Å; M10-V96 WeakPolarHBondContact O-CG2 3.26Å; M10-L456 HydrophobicContact CB-CD1 4.31Å
11V96.5Very high93Very high11 Ų1161 Ų617%0.06731%0.306CS..Hα-helixtrans-64.8-51.1178.6-177.50000110I3 I8 W9 V13 G14 F15 M92 L456 W457 A460I3-V11 HydrophobicContact CD1-CG2 4.37Å; I3-V11 HydrophobicContact CG2-CG2 4.41Å; I8-V11 WeakPolarHBondContact O-CB 3.4Å; I8-V11 PolarHBondContact O-N 2.97Å; W9-V11 VanDerWaalsContact C-N 3.31Å; W9-V11 PolarHBondContact O-N 3.18Å; V11-V13 PolarHBondContact O-N 2.97Å; V11-G14 PolarHBondContact O-N 3.21Å; V11-F15 HydrophobicContact CG1-CD2 3.81Å; V11-F15 HydrophobicContact CG1-CE2 3.76Å; V11-F15 VanDerWaalsContact O-CD2 3.3Å; V11-F15 WeakPolarHBondContact O-CD2 3.31Å; V11-F15 PolarHBondContact O-N 3.43Å; V11-M92 HydrophobicContact CG2-CE 4.01Å; V11-L456 HydrophobicContact CG2-CD1 4.49Å; V11-W457 HydrophobicContact CG1-CE3 4.23Å; V11-W457 HydrophobicContact CG1-CZ3 4.46Å; V11-A460 HydrophobicContact CG2-CB 3.58Å
12V97.3Very high95.2Very high77 Ų7752.5 Ų52.547%0.46726%0.264SS..Hα-helixtrans-58.9-49.4179.3174.40000111.6I8 W9 F15 I16I8-V12 HydrophobicContact CG2-CG2 3.97Å; I8-V12 PolarHBondContact O-N 3.34Å; W9-V12 PolarHBondContact O-N 3.15Å; V12-F15 PolarHBondContact O-N 2.87Å; V12-I16 HydrophobicContact CG1-CD1 4Å; V12-I16 WeakPolarHBondContact O-CG1 3.23Å; V12-I16 PolarHBondContact O-N 2.6Å; V12-I16 VanDerWaalsContact O-N 3.13Å
13V97.9Very high95.9Very high54 Ų5447.9 Ų47.933%0.32724%0.238SC..Hα-helixtrans-63-42.5177.3170.70000110.9W9 V11 F15 I16 I17 V96W9-V13 HydrophobicContact CE3-CG2 4.38Å; W9-V13 VanDerWaalsContact O-CB 3.28Å; W9-V13 WeakPolarHBondContact O-CB 3.15Å; W9-V13 VanDerWaalsContact O-CG2 3.24Å; W9-V13 WeakPolarHBondContact O-CG2 3.4Å; W9-V13 PolarHBondContact O-N 2.87Å; V11-V13 PolarHBondContact O-N 2.97Å; V13-F15 PolarHBondContact O-N 3.07Å; V13-I16 PolarHBondContact O-N 2.86Å; V13-I17 HydrophobicContact CG1-CD1 3.54Å; V13-I17 HydrophobicContact CG1-CG1 4.14Å; V13-I17 WeakPolarHBondContact O-CG1 3.32Å; V13-I17 PolarHBondContact O-N 3.38Å; V13-V96 HydrophobicContact CG1-CG1 4.03Å
14G98.2Very high96.1Very high0 Ų046.9 Ų46.90%023%0.233CC..Hα-helixtrans-60.7-43.6177.600000113.2M10 V11 A18M10-G14 WeakPolarHBondContact O-CA 3.3Å; M10-G14 PolarHBondContact O-N 3.15Å; V11-G14 PolarHBondContact O-N 3.21Å; G14-A18 WeakPolarHBondContact O-CB 3.31Å; G14-A18 PolarHBondContact O-N 3.14Å
15F98.1Very high96.2Very high25 Ų2544.8 Ų44.811%0.1122%0.219CC..Hα-helixtrans-60.6-48173.3-89.5-80.6000111.5V11 V12 V13 A18 F19 L453 W457 W474 Y478V11-F15 HydrophobicContact CG1-CD2 3.81Å; V11-F15 HydrophobicContact CG1-CE2 3.76Å; V11-F15 VanDerWaalsContact O-CD2 3.3Å; V11-F15 WeakPolarHBondContact O-CD2 3.31Å; V11-F15 PolarHBondContact O-N 3.43Å; V12-F15 PolarHBondContact O-N 2.87Å; V13-F15 PolarHBondContact O-N 3.07Å; F15-A18 PolarHBondContact O-N 3.2Å; F15-F19 PolarHBondContact O-N 2.79Å; F15-L453 HydrophobicContact CB-CD1 4.41Å; F15-L453 HydrophobicContact CD1-CD1 3.98Å; F15-L453 HydrophobicContact CD1-CD2 3.75Å; F15-L453 HydrophobicContact CD1-CG 4.31Å; F15-L453 HydrophobicContact CD2-CD1 3.88Å; F15-L453 HydrophobicContact CE1-CD1 4.09Å; F15-L453 HydrophobicContact CE1-CD2 3.65Å; F15-L453 HydrophobicContact CE1-CG 4.08Å; F15-L453 HydrophobicContact CE2-CD1 3.98Å; F15-L453 HydrophobicContact CG-CD1 3.84Å; F15-L453 HydrophobicContact CG-CD2 4.43Å; F15-L453 HydrophobicContact CZ-CD1 4.07Å; F15-L453 HydrophobicContact CZ-CD2 4.27Å; F15-L453 HydrophobicContact CZ-CG 4.2Å; F15-W457 AromaticContact CE2-CE3 3.86Å; F15-W457 HydrophobicContact CE2-CE3 3.86Å; F15-W457 HydrophobicContact CE2-CZ3 4.38Å; F15-W457 HydrophobicContact CZ-CD2 4.48Å; F15-W457 HydrophobicContact CZ-CE3 4.14Å; F15-W474 AromaticContact CE1-CH2 3.43Å; F15-W474 HydrophobicContact CE1-CH2 3.43Å; F15-W474 VanDerWaalsContact CE1-CH2 3.43Å; F15-W474 AromaticContact CE1-CZ3 3.59Å; F15-W474 HydrophobicContact CE1-CZ3 3.59Å; F15-W474 HydrophobicContact CE2-CH2 4.43Å; F15-W474 AromaticContact CZ-CH2 3.36Å; F15-W474 HydrophobicContact CZ-CH2 3.36Å; F15-W474 HydrophobicContact CZ-CZ2 4.2Å; F15-W474 HydrophobicContact CZ-CZ3 4.04Å; F15-Y478 HydrophobicContact CD1-CD1 4.21Å; F15-Y478 AromaticContact CD1-CE1 3.72Å; F15-Y478 HydrophobicContact CD1-CE1 3.72Å; F15-Y478 HydrophobicContact CD1-CE2 4.5Å; F15-Y478 AromaticContact CD1-CZ 3.87Å; F15-Y478 HydrophobicContact CE1-CE1 4.46Å; F15-Y478 PolarHBondContact O-OH 3.49Å; F15-Y478 VanDerWaalsContact O-OH 3.06Å
16I98.4Very high96.2Very high91 Ų9137 Ų3747%0.46718%0.183SC..Hα-helixtrans-59.5-50.6178.9-67.1165.7000111V12 V13 A18 F19 I20V12-I16 HydrophobicContact CG1-CD1 4Å; V12-I16 WeakPolarHBondContact O-CG1 3.23Å; V12-I16 PolarHBondContact O-N 2.6Å; V12-I16 VanDerWaalsContact O-N 3.13Å; V13-I16 PolarHBondContact O-N 2.86Å; I16-A18 PolarHBondContact O-N 3.15Å; I16-F19 PolarHBondContact O-N 2.64Å; I16-I20 HydrophobicContact CG2-CD1 3.84Å; I16-I20 VanDerWaalsContact O-CG1 3.32Å; I16-I20 WeakPolarHBondContact O-CG1 3.34Å; I16-I20 PolarHBondContact O-N 3.28Å
17I98.3Very high96.1Very high37 Ų3732 Ų3219%0.1916%0.157CC..Hα-helixtrans-64.6-41.7-179.7-64.2175000110.9V13 F19 I20 L21 V96 L99 C103V13-I17 HydrophobicContact CG1-CD1 3.54Å; V13-I17 HydrophobicContact CG1-CG1 4.14Å; V13-I17 WeakPolarHBondContact O-CG1 3.32Å; V13-I17 PolarHBondContact O-N 3.38Å; I17-F19 VanDerWaalsContact C-N 3.32Å; I17-F19 PolarHBondContact O-N 3.38Å; I17-I20 PolarHBondContact O-N 3.09Å; I17-L21 WeakPolarHBondContact O-CB 3.34Å; I17-L21 PolarHBondContact O-N 3.23Å; I17-V96 HydrophobicContact CD1-CG1 4.37Å; I17-L99 HydrophobicContact CB-CB 4.47Å; I17-L99 HydrophobicContact CG2-CB 3.77Å; I17-C103 HydrophobicContact CG2-CB 3.78Å
18A98.2Very high95.6Very high0 Ų032.2 Ų32.20%016%0.158CC..Hα-helixtrans-62.9-37.3177.100000112.2G14 F15 I16 L21 A22 L99 A449 L453G14-A18 WeakPolarHBondContact O-CB 3.31Å; G14-A18 PolarHBondContact O-N 3.14Å; F15-A18 PolarHBondContact O-N 3.2Å; I16-A18 PolarHBondContact O-N 3.15Å; A18-L21 PolarHBondContact O-N 3.43Å; A18-A22 VanDerWaalsContact O-CB 3.31Å; A18-A22 WeakPolarHBondContact O-CB 3.45Å; A18-A22 PolarHBondContact O-N 2.98Å; A18-L99 HydrophobicContact CB-CD1 4.19Å; A18-L99 HydrophobicContact CB-CD2 4.09Å; A18-A449 WeakPolarHBondContact O-CB 3.3Å; A18-L453 HydrophobicContact CB-CB 4.13Å; A18-L453 HydrophobicContact CB-CD1 4.19Å; A18-L453 HydrophobicContact CB-CD2 3.75Å; A18-L453 HydrophobicContact CB-CG 4.25Å
19F98Very high95.1Very high57 Ų5730.3 Ų30.325%0.2515%0.148CC..Hα-helixtrans-66.3-41.6174-168-92.4000112.2F15 I16 I17 A22 F23 Y478 V481 V485F15-F19 PolarHBondContact O-N 2.79Å; I16-F19 PolarHBondContact O-N 2.64Å; I17-F19 VanDerWaalsContact C-N 3.32Å; I17-F19 PolarHBondContact O-N 3.38Å; F19-A22 PolarHBondContact O-N 2.85Å; F19-F23 VanDerWaalsContact O-CB 3.29Å; F19-F23 WeakPolarHBondContact O-CB 3.2Å; F19-F23 PolarHBondContact O-N 3.41Å; F19-Y478 HydrophobicContact CB-CE1 3.89Å; F19-Y478 WeakPolarHBondContact CB-OH 3.5Å; F19-Y478 HydrophobicContact CD2-CD1 4.43Å; F19-Y478 HydrophobicContact CD2-CD2 4.38Å; F19-Y478 AromaticContact CD2-CE1 3.96Å; F19-Y478 HydrophobicContact CD2-CE1 3.96Å; F19-Y478 AromaticContact CD2-CE2 3.91Å; F19-Y478 HydrophobicContact CD2-CE2 3.91Å; F19-Y478 AromaticContact CD2-CZ 3.7Å; F19-Y478 HydrophobicContact CG-CE1 4.43Å; F19-V481 HydrophobicContact CE2-CG1 4.25Å; F19-V485 HydrophobicContact CZ-CG2 4.35Å
20I97.2Very high94Very high67 Ų6723.1 Ų23.134%0.34412%0.121SC..Hα-helixtrans-67.6-36.4176.6-61.7165.8000111I16 I17 F23 G24 L107I16-I20 HydrophobicContact CG2-CD1 3.84Å; I16-I20 VanDerWaalsContact O-CG1 3.32Å; I16-I20 WeakPolarHBondContact O-CG1 3.34Å; I16-I20 PolarHBondContact O-N 3.28Å; I17-I20 PolarHBondContact O-N 3.09Å; I20-F23 WeakPolarHBondContact O-CB 3.44Å; I20-F23 PolarHBondContact O-N 3.09Å; I20-G24 PolarHBondContact O-N 3.09Å; I20-L107 HydrophobicContact CG2-CD1 3.82Å; I20-L107 HydrophobicContact CG2-CD2 4.42Å
21L97.1Very high93Very high1 Ų123.2 Ų23.21%0.00512%0.122CC..Hα-helixtrans-65.7-47173.4176.153.3000111I17 A18 F23 G24 I25 L99 C103 L106 A449I17-L21 WeakPolarHBondContact O-CB 3.34Å; I17-L21 PolarHBondContact O-N 3.23Å; A18-L21 PolarHBondContact O-N 3.43Å; L21-F23 VanDerWaalsContact C-N 3.3Å; L21-F23 PolarHBondContact O-N 3.07Å; L21-G24 WeakPolarHBondContact O-CA 3.32Å; L21-G24 PolarHBondContact O-N 3.27Å; L21-G24 VanDerWaalsContact O-N 3.08Å; L21-I25 HydrophobicContact CD1-CD1 4.27Å; L21-I25 HydrophobicContact CD1-CG1 4.42Å; L21-I25 HydrophobicContact CG-CD1 4.27Å; L21-I25 VanDerWaalsContact O-CG1 3.32Å; L21-I25 WeakPolarHBondContact O-CG1 3.35Å; L21-I25 PolarHBondContact O-N 3.45Å; L21-L99 HydrophobicContact CD2-CD2 3.87Å; L21-C103 HydrophobicContact CB-CB 4.04Å; L21-C103 HydrophobicContact CD1-CB 4.48Å; L21-L106 HydrophobicContact CD1-CB 4.38Å; L21-L106 HydrophobicContact CD1-CD2 3.72Å; L21-A449 HydrophobicContact CB-CB 4.32Å; L21-A449 HydrophobicContact CD2-CB 4.29Å; L21-A449 HydrophobicContact CG-CB 4.06Å
22A96.7Very high92.4Very high0 Ų027.3 Ų27.30%014%0.144CC..Hα-helixtrans-59.2-40.7173.700000112.1A18 F19 I25 G26 A449 I483A18-A22 VanDerWaalsContact O-CB 3.31Å; A18-A22 WeakPolarHBondContact O-CB 3.45Å; A18-A22 PolarHBondContact O-N 2.98Å; F19-A22 PolarHBondContact O-N 2.85Å; A22-I25 PolarHBondContact O-N 3.37Å; A22-G26 PolarHBondContact O-N 3.44Å; A22-A449 HydrophobicContact CB-CB 3.89Å; A22-I483 HydrophobicContact CB-CG1 4.24Å; A22-I483 VanDerWaalsContact O-CA 3.27Å; A22-I483 WeakPolarHBondContact O-CA 3.16Å; A22-I483 WeakPolarHBondContact O-CG1 3.47Å; A22-I483 PolarHBondContact O-N 3.4Å
23F95Very high91.9Very high39 Ų3924.3 Ų24.317%0.17113%0.126CC..Hα-helixtrans-60.3-44.5171.2172.7-81.2000112F19 I20 L21 I25 G26 A27 G482 V485 G486 I489 W490F19-F23 VanDerWaalsContact O-CB 3.29Å; F19-F23 WeakPolarHBondContact O-CB 3.2Å; F19-F23 PolarHBondContact O-N 3.41Å; I20-F23 WeakPolarHBondContact O-CB 3.44Å; I20-F23 PolarHBondContact O-N 3.09Å; L21-F23 VanDerWaalsContact C-N 3.3Å; L21-F23 PolarHBondContact O-N 3.07Å; F23-I25 VanDerWaalsContact C-N 3.34Å; F23-I25 PolarHBondContact O-N 2.82Å; F23-G26 PolarHBondContact O-N 3.05Å; F23-A27 WeakPolarHBondContact O-CB 3.23Å; F23-A27 PolarHBondContact O-N 2.89Å; F23-G482 WeakPolarHBondContact CA-O 3.32Å; F23-V485 HydrophobicContact CD2-CB 4.29Å; F23-V485 HydrophobicContact CD2-CG1 3.89Å; F23-V485 HydrophobicContact CE2-CG1 4.04Å; F23-G486 VanDerWaalsContact CD2-N 3.31Å; F23-G486 WeakPolarHBondContact O-CA 3.22Å; F23-I489 HydrophobicContact CE2-CB 3.94Å; F23-I489 HydrophobicContact CE2-CD1 4.1Å; F23-I489 HydrophobicContact CE2-CG1 4.39Å; F23-I489 HydrophobicContact CE2-CG2 4.29Å; F23-I489 HydrophobicContact CZ-CB 4.11Å; F23-I489 HydrophobicContact CZ-CG2 4.06Å; F23-W490 HydrophobicContact CE1-CE3 4.13Å
24G93.2Very high91.5Very high0 Ų021.8 Ų21.80%011%0.111CC..Hα-helixtrans-59.6-42.617500000112.7I20 L21 A27 N28I20-G24 PolarHBondContact O-N 3.09Å; L21-G24 WeakPolarHBondContact O-CA 3.32Å; L21-G24 PolarHBondContact O-N 3.27Å; L21-G24 VanDerWaalsContact O-N 3.08Å; G24-A27 WeakPolarHBondContact O-CB 3.45Å; G24-A27 PolarHBondContact O-N 2.98Å; G24-N28 PolarHBondContact O-N 2.95Å
25I93.3Very high90.9Very high0 Ų021.9 Ų21.90%011%0.112CC..Hα-helixtrans-61.5-51.8176.7-68.8167000110.4L21 A22 F23 A27 N28 D29 L106 D445 N448 A449 I483L21-I25 HydrophobicContact CD1-CD1 4.27Å; L21-I25 HydrophobicContact CD1-CG1 4.42Å; L21-I25 HydrophobicContact CG-CD1 4.27Å; L21-I25 VanDerWaalsContact O-CG1 3.32Å; L21-I25 WeakPolarHBondContact O-CG1 3.35Å; L21-I25 PolarHBondContact O-N 3.45Å; A22-I25 PolarHBondContact O-N 3.37Å; F23-I25 VanDerWaalsContact C-N 3.34Å; F23-I25 PolarHBondContact O-N 2.82Å; I25-A27 PolarHBondContact O-N 2.93Å; I25-N28 PolarHBondContact O-N 2.92Å; I25-N28 VanDerWaalsContact O-N 3.14Å; I25-D29 PolarHBondContact O-N 3.49Å; I25-L106 HydrophobicContact CB-CD2 4.34Å; I25-L106 HydrophobicContact CG1-CD2 3.49Å; I25-L106 VanDerWaalsContact CG1-CD2 3.49Å; I25-D445 WeakPolarHBondContact CD1-O 3.19Å; I25-D445 HydrophobicContact CG2-CB 3.81Å; I25-N448 HydrophobicContact CD1-CB 3.83Å; I25-A449 HydrophobicContact CD1-CB 4.47Å; I25-I483 HydrophobicContact CB-CG1 4.49Å; I25-I483 HydrophobicContact CG2-CD1 4.27Å; I25-I483 HydrophobicContact CG2-CG1 4.21Å
26G92.4Very high90.2Very high0 Ų023.7 Ų23.70%013%0.125CC..Hα-helixtrans-62.9-25.8177.200000114.2A22 F23 I483 L487A22-G26 PolarHBondContact O-N 3.44Å; F23-G26 PolarHBondContact O-N 3.05Å; G26-I483 WeakPolarHBondContact CA-O 3.46Å; G26-L487 VanDerWaalsContact O-CA 3.29Å; G26-L487 WeakPolarHBondContact O-CA 3.38Å; G26-L487 PolarHBondContact O-N 3.49Å
27A89.2Confident89.7Confident0 Ų019.4 Ų19.40%010%0.103CC..Hα-helixtrans-76.6-38173.300000113.3F23 G24 I25 T110 W490 G491 V494F23-A27 WeakPolarHBondContact O-CB 3.23Å; F23-A27 PolarHBondContact O-N 2.89Å; G24-A27 WeakPolarHBondContact O-CB 3.45Å; G24-A27 PolarHBondContact O-N 2.98Å; I25-A27 PolarHBondContact O-N 2.93Å; A27-T110 HydrophobicContact CB-CG2 4.24Å; A27-W490 HydrophobicContact CB-CB 3.79Å; A27-W490 HydrophobicContact CB-CD2 4.43Å; A27-W490 HydrophobicContact CB-CG 4.15Å; A27-G491 VanDerWaalsContact O-CA 3.3Å; A27-G491 WeakPolarHBondContact O-CA 3.18Å; A27-V494 WeakPolarHBondContact O-CG2 3.01Å
28N84.6Confident89.2Confident10 Ų1018.7 Ų18.75%0.05310%0.101CC..Hα-helixtrans-79.2-49.9-178-153-79.8000111.3G24 I25 L106 T110 L114 P115 V116G24-N28 PolarHBondContact O-N 2.95Å; I25-N28 PolarHBondContact O-N 2.92Å; I25-N28 VanDerWaalsContact O-N 3.14Å; N28-L106 HydrophobicContact CB-CD1 4.31Å; N28-T110 PolarHBondContact ND2-OG1 2.86Å; N28-L114 PolarHBondContact ND2-O 3.31Å; N28-P115 WeakPolarHBondContact OD1-CA 3.36Å; N28-V116 PolarHBondContact OD1-N 2.88Å
29D84.3Confident88.5Confident12 Ų1219.4 Ų19.46%0.06411%0.108CC..Hα-helixtrans-102-17.4-153.9-67.6-64.3000116.9I25 A31 N32 H441I25-D29 PolarHBondContact O-N 3.49Å; D29-A31 PolarHBondContact O-N 3Å; D29-N32 WeakPolarHBondContact CA-ND2 3.39Å; D29-N32 WeakPolarHBondContact O-CB 3.46Å; D29-N32 VanDerWaalsContact O-CG 3.22Å; D29-N32 PolarHBondContact O-N 3.24Å; D29-N32 PolarHBondContact O-ND2 2.87Å; D29-N32 VanDerWaalsContact O-ND2 3.11Å; D29-N32 PolarHBondContact OD1-ND2 2.92Å; D29-H441 VanDerWaalsContact CB-CE1 3.43Å; D29-H441 WeakPolarHBondContact CB-CE1 3.38Å; D29-H441 WeakPolarHBondContact CB-NE2 3.3Å
30V72.3Confident87.8Confident1 Ų117.8 Ų17.81%0.00611%0.105CC..Hα-helixtrans-61.1-25.8-176.5173.50000112.9N32 S33 F34 A52 E56 L487 I495V30-N32 PolarHBondContact O-N 2.75Å; V30-S33 PolarHBondContact O-N 3.2Å; V30-S33 VanDerWaalsContact O-N 3.13Å; V30-F34 HydrophobicContact CG1-CD2 4.1Å; V30-F34 PolarHBondContact O-N 2.9Å; V30-F34 VanDerWaalsContact O-N 3.08Å; V30-A52 HydrophobicContact CG1-CB 3.59Å; V30-E56 HydrophobicContact CG2-CG 4.37Å; V30-L487 HydrophobicContact CB-CD1 3.88Å; V30-L487 HydrophobicContact CG1-CD1 3.59Å; V30-L487 HydrophobicContact CG1-CD2 4.28Å; V30-L487 HydrophobicContact CG1-CG 4.48Å; V30-L487 HydrophobicContact CG2-CB 4.15Å; V30-L487 HydrophobicContact CG2-CD1 4.08Å; V30-L487 HydrophobicContact CG2-CD2 4.24Å; V30-L487 HydrophobicContact CG2-CG 4.37Å; V30-I495 HydrophobicContact CB-CD1 4.47Å; V30-I495 HydrophobicContact CG1-CD1 3.91Å
31A77.1Confident87.2Confident6 Ų623.8 Ų23.85%0.0513%0.128CC..Hα-helixtrans-63.2-25.1174.300000113.4D29 S33 G35 V494 I495 L498D29-A31 PolarHBondContact O-N 3Å; A31-S33 PolarHBondContact O-N 2.99Å; A31-G35 VanDerWaalsContact O-CA 3.32Å; A31-G35 WeakPolarHBondContact O-CA 3.15Å; A31-G35 PolarHBondContact O-N 3.38Å; A31-V494 HydrophobicContact CB-CB 4.47Å; A31-V494 HydrophobicContact CB-CG1 3.87Å; A31-I495 HydrophobicContact CB-CB 4.45Å; A31-I495 HydrophobicContact CB-CG1 3.92Å; A31-L498 HydrophobicContact CB-CB 4.3Å; A31-L498 HydrophobicContact CB-CD1 3.47Å; A31-L498 VanDerWaalsContact CB-CD1 3.47Å; A31-L498 HydrophobicContact CB-CG 4.43Å
32N82.7Confident86.7Confident97 Ų9725.3 Ų25.352%0.51914%0.138SC..Hα-helixtrans-59.3-36173.2-60.3-33.7000111.5D29 V30D29-N32 WeakPolarHBondContact CA-ND2 3.39Å; D29-N32 WeakPolarHBondContact O-CB 3.46Å; D29-N32 VanDerWaalsContact O-CG 3.22Å; D29-N32 PolarHBondContact O-N 3.24Å; D29-N32 PolarHBondContact O-ND2 2.87Å; D29-N32 VanDerWaalsContact O-ND2 3.11Å; D29-N32 PolarHBondContact OD1-ND2 2.92Å; V30-N32 PolarHBondContact O-N 2.75Å
33S87.3Confident86.3Confident14 Ų1426 Ų2610%0.09814%0.141CC..Hα-helixtrans-89.5-46.5-179.6-66.20000113V30 A31 A434 S438V30-S33 PolarHBondContact O-N 3.2Å; V30-S33 VanDerWaalsContact O-N 3.13Å; A31-S33 PolarHBondContact O-N 2.99Å; S33-A434 WeakPolarHBondContact O-CB 3.48Å; S33-S438 WeakPolarHBondContact OG-CA 3.29Å; S33-S438 PolarHBondContact OG-N 2.98Å; S33-S438 VanDerWaalsContact OG-N 3.15Å
34F90.2Very high86.2Confident0 Ų028 Ų280%016%0.157CC..Hα-helixtrans-106-12.5-170.4-74.3-82.7000116V30 T36 S37 V38 L43 A48 L51 A52 A434 V435 S438V30-F34 HydrophobicContact CG1-CD2 4.1Å; V30-F34 PolarHBondContact O-N 2.9Å; V30-F34 VanDerWaalsContact O-N 3.08Å; F34-T36 VanDerWaalsContact C-N 3.31Å; F34-T36 PolarHBondContact O-N 2.91Å; F34-S37 PolarHBondContact O-N 3.35Å; F34-V38 PolarHBondContact O-N 3.43Å; F34-L43 HydrophobicContact CD1-CD1 3.79Å; F34-L43 HydrophobicContact CE1-CD1 3.92Å; F34-A48 HydrophobicContact CB-CB 3.93Å; F34-A48 HydrophobicContact CD1-CB 3.91Å; F34-A48 HydrophobicContact CG-CB 4.05Å; F34-L51 HydrophobicContact CE1-CB 3.8Å; F34-L51 HydrophobicContact CE1-CD1 4.17Å; F34-L51 HydrophobicContact CZ-CB 3.66Å; F34-A52 HydrophobicContact CD2-CB 3.74Å; F34-A52 HydrophobicContact CE2-CB 3.49Å; F34-A52 VanDerWaalsContact CE2-CB 3.49Å; F34-A52 HydrophobicContact CZ-CB 4.35Å; F34-A434 HydrophobicContact CD1-CB 3.82Å; F34-A434 HydrophobicContact CE1-CB 3.79Å; F34-A434 HydrophobicContact CG-CB 4.37Å; F34-A434 HydrophobicContact CZ-CB 4.32Å; F34-V435 HydrophobicContact CZ-CG2 4.35Å; F34-S438 VanDerWaalsContact CE2-CB 3.47Å
35G85.2Confident86Confident3 Ų329.7 Ų29.73%0.03117%0.166CC..Hα-helixtrans-55-45-177.200000112.6A31 S37 V38 G39 G499A31-G35 VanDerWaalsContact O-CA 3.32Å; A31-G35 WeakPolarHBondContact O-CA 3.15Å; A31-G35 PolarHBondContact O-N 3.38Å; G35-S37 PolarHBondContact O-N 3.18Å; G35-V38 PolarHBondContact O-N 3.44Å; G35-G39 PolarHBondContact O-N 3.36Å; G35-G499 WeakPolarHBondContact O-CA 3.44Å
36T83.6Confident86Confident63 Ų6336.7 Ų36.739%0.38720%0.196SC..Hα-helixtrans-63.3-38.9177.765.70000112.7F34 A40 Q430F34-T36 VanDerWaalsContact C-N 3.31Å; F34-T36 PolarHBondContact O-N 2.91Å; T36-A40 WeakPolarHBondContact O-CB 3.4Å; T36-A40 PolarHBondContact O-N 3.45Å; T36-Q430 PolarHBondContact O-NE2 2.94Å; T36-Q430 PolarHBondContact OG1-NE2 2.81Å
37S87.7Confident86Confident0 Ų041.3 Ų41.30%022%0.218CC..Hα-helixtrans-73-33.9-178.7-65.40000112.3F34 G35 V42 L43F34-S37 PolarHBondContact O-N 3.35Å; G35-S37 PolarHBondContact O-N 3.18Å; S37-V42 WeakPolarHBondContact O-CA 3.35Å; S37-V42 WeakPolarHBondContact O-CB 3.32Å; S37-V42 PolarHBondContact O-N 3.01Å; S37-L43 PolarHBondContact O-N 3.47Å
38V88.4Confident86.2Confident23 Ų2341.3 Ų41.314%0.13922%0.218CC..Hα-helixtrans-73.9-45.3173.7176.80000110.4F34 G35 A40 K41 L43 A48 I495F34-V38 PolarHBondContact O-N 3.43Å; G35-V38 PolarHBondContact O-N 3.44Å; V38-A40 PolarHBondContact O-N 2.9Å; V38-K41 WeakPolarHBondContact O-CA 3.18Å; V38-K41 PolarHBondContact O-N 3.44Å; V38-L43 WeakPolarHBondContact CA-O 3.32Å; V38-A48 HydrophobicContact CG2-CB 3.47Å; V38-A48 VanDerWaalsContact CG2-CB 3.47Å; V38-I495 HydrophobicContact CB-CG2 4.02Å; V38-I495 HydrophobicContact CG1-CG2 4.26Å; V38-I495 HydrophobicContact CG2-CG2 3.78Å
39G83.4Confident86.6Confident14 Ų1440.8 Ų40.814%0.14422%0.215CC..Hα-helixtrans-62.1-41.1177.700000114.1G35 K41 G499G35-G39 PolarHBondContact O-N 3.36Å; G39-K41 PolarHBondContact O-N 2.78Å; G39-K41 VanDerWaalsContact O-N 3.1Å; G39-G499 WeakPolarHBondContact CA-O 3.32Å
40A83.7Confident87.1Confident23 Ų2343.8 Ų43.819%0.1923%0.23CC..THydrogen-bonded Turntrans-70.92.3172.300000113.9T36 V38 V42 P507T36-A40 WeakPolarHBondContact O-CB 3.4Å; T36-A40 PolarHBondContact O-N 3.45Å; V38-A40 PolarHBondContact O-N 2.9Å; A40-V42 HydrophobicContact CB-CG2 3.93Å; A40-V42 PolarHBondContact O-N 3.08Å; A40-V42 VanDerWaalsContact O-N 3.17Å; A40-P507 HydrophobicContact CB-CG 4.44Å
41K84.4Confident88.2Confident193 Ų19346.1 Ų46.184%0.83924%0.243SC*.THydrogen-bonded Turntrans56.425-176.1-55.7-175.8-179.8-177.20113.9V38 G39V38-K41 WeakPolarHBondContact O-CA 3.18Å; V38-K41 PolarHBondContact O-N 3.44Å; G39-K41 PolarHBondContact O-N 2.78Å; G39-K41 VanDerWaalsContact O-N 3.1Å
42V85.9Confident89Confident33 Ų3345.9 Ų45.920%0.224%0.24CC..SBendtrans-79.2-35177.1169.10000111.1S37 A40 I431S37-V42 WeakPolarHBondContact O-CA 3.35Å; S37-V42 WeakPolarHBondContact O-CB 3.32Å; S37-V42 PolarHBondContact O-N 3.01Å; A40-V42 HydrophobicContact CB-CG2 3.93Å; A40-V42 PolarHBondContact O-N 3.08Å; A40-V42 VanDerWaalsContact O-N 3.17Å; V42-I431 HydrophobicContact CG1-CD1 3.6Å; V42-I431 HydrophobicContact CG1-CG1 3.49Å; V42-I431 VanDerWaalsContact CG1-CG1 3.49Å
43L88.9Confident89.6Confident15 Ų1542.9 Ų42.98%0.07923%0.225CC..SBendtrans-124.7142.1172.5-67.5175000110.2F34 S37 V38 Q47 L51 I431F34-L43 HydrophobicContact CD1-CD1 3.79Å; F34-L43 HydrophobicContact CE1-CD1 3.92Å; S37-L43 PolarHBondContact O-N 3.47Å; V38-L43 WeakPolarHBondContact CA-O 3.32Å; L43-Q47 HydrophobicContact CB-CB 4.5Å; L43-Q47 HydrophobicContact CD2-CB 4.18Å; L43-L51 HydrophobicContact CD1-CD1 3.86Å; L43-L51 HydrophobicContact CD2-CD1 4.15Å; L43-I431 HydrophobicContact CD1-CG1 4.2Å; L43-I431 HydrophobicContact CD2-CD1 3.97Å; L43-I431 HydrophobicContact CD2-CG1 4.04Å; L43-I431 HydrophobicContact CG-CD1 4.4Å; L43-I431 HydrophobicContact CG-CG1 4.01Å
44T91.8Very high90Very high80 Ų8047 Ų4749%0.49125%0.245SC..  trans-69.8152.516262.50000110K46 Q47 A48T44-K46 PolarHBondContact O-N 3.14Å; T44-K46 VanDerWaalsContact O-N 3.16Å; T44-Q47 PolarHBondContact O-N 2.95Å; T44-Q47 VanDerWaalsContact OG1-CD 3.26Å; T44-Q47 VanDerWaalsContact OG1-CG 3.27Å; T44-Q47 WeakPolarHBondContact OG1-CG 3.4Å; T44-Q47 PolarHBondContact OG1-N 3.12Å; T44-Q47 PolarHBondContact OG1-OE1 3.37Å; T44-A48 PolarHBondContact O-N 3.4Å
45L89.7Confident90.2Very high37 Ų3747.6 Ų47.619%0.19425%0.25CC..Hα-helixtrans-51.7-39.3175.3-176.963.5000112.6A48 C49 R492 I495 Q496L45-A48 PolarHBondContact O-N 3.4Å; L45-C49 PolarHBondContact O-N 2.93Å; L45-C49 PolarHBondContact O-SG 3Å; L45-R492 HydrophobicContact CD1-CB 4.44Å; L45-R492 HydrophobicContact CD2-CB 4.22Å; L45-I495 HydrophobicContact CD1-CB 3.82Å; L45-I495 HydrophobicContact CD1-CD1 4.26Å; L45-I495 HydrophobicContact CD1-CG2 3.57Å; L45-Q496 HydrophobicContact CD1-CG 4.25Å; L45-Q496 HydrophobicContact CD2-CG 3.67Å
46K92.7Very high90.7Very high146 Ų14647.5 Ų47.564%0.63525%0.248SC*.Hα-helixtrans-65-42.4176.8-173.4174.5-179.7176.40112.2T44 C49 I50T44-K46 PolarHBondContact O-N 3.14Å; T44-K46 VanDerWaalsContact O-N 3.16Å; K46-C49 PolarHBondContact O-N 3.34Å; K46-I50 HydrophobicContact CG-CD1 4.14Å; K46-I50 VanDerWaalsContact O-CG1 3.3Å; K46-I50 WeakPolarHBondContact O-CG1 3.32Å; K46-I50 PolarHBondContact O-N 3.23Å; K46-I50 VanDerWaalsContact O-N 3.13Å
47Q94.2Very high91.2Very high97 Ų9747 Ų4745%0.45324%0.243SC..Hα-helixtrans-66.1-42.9176-72.6162.2-48.600111.6L43 T44 C49 I50 L51L43-Q47 HydrophobicContact CB-CB 4.5Å; L43-Q47 HydrophobicContact CD2-CB 4.18Å; T44-Q47 PolarHBondContact O-N 2.95Å; T44-Q47 VanDerWaalsContact OG1-CD 3.26Å; T44-Q47 VanDerWaalsContact OG1-CG 3.27Å; T44-Q47 WeakPolarHBondContact OG1-CG 3.4Å; T44-Q47 PolarHBondContact OG1-N 3.12Å; T44-Q47 PolarHBondContact OG1-OE1 3.37Å; Q47-C49 PolarHBondContact O-N 3.36Å; Q47-I50 PolarHBondContact O-N 3.35Å; Q47-L51 WeakPolarHBondContact O-CG 3.33Å; Q47-L51 PolarHBondContact O-N 3.01Å
48A92.5Very high91.6Very high0 Ų049.3 Ų49.30%026%0.259CS..Hα-helixtrans-58.4-46.4175.100000111.9F34 V38 T44 L45 I50 L51 A52F34-A48 HydrophobicContact CB-CB 3.93Å; F34-A48 HydrophobicContact CD1-CB 3.91Å; F34-A48 HydrophobicContact CG-CB 4.05Å; V38-A48 HydrophobicContact CG2-CB 3.47Å; V38-A48 VanDerWaalsContact CG2-CB 3.47Å; T44-A48 PolarHBondContact O-N 3.4Å; L45-A48 PolarHBondContact O-N 3.4Å; A48-I50 PolarHBondContact O-N 2.75Å; A48-L51 PolarHBondContact O-N 3.02Å; A48-A52 VanDerWaalsContact O-CB 3.23Å; A48-A52 WeakPolarHBondContact O-CB 3.41Å; A48-A52 PolarHBondContact O-N 2.97Å
49C93.1Very high91.8Very high0 Ų048.2 Ų48.20%025%0.253CS..Hα-helixtrans-60.8-41.2176.7-63.20000112.6L45 K46 Q47 T53 W488L45-C49 PolarHBondContact O-N 2.93Å; L45-C49 PolarHBondContact O-SG 3Å; K46-C49 PolarHBondContact O-N 3.34Å; Q47-C49 PolarHBondContact O-N 3.36Å; C49-T53 WeakPolarHBondContact O-CB 3.23Å; C49-T53 PolarHBondContact O-N 3.05Å; C49-T53 PolarHBondContact O-OG1 3.06Å; C49-W488 HydrophobicContact CB-CD2 4.44Å; C49-W488 HydrophobicContact CB-CH2 4.31Å; C49-W488 HydrophobicContact CB-CZ2 3.59Å; C49-W488 PolarHBondContact O-NE1 3.1Å
50I95.1Very high92.4Very high74 Ų7447.6 Ų47.638%0.37925%0.246SC..Hα-helixtrans-67.1-46.4179.1-67.6165.3000110.8K46 Q47 A48 T53 I54 W488K46-I50 HydrophobicContact CG-CD1 4.14Å; K46-I50 VanDerWaalsContact O-CG1 3.3Å; K46-I50 WeakPolarHBondContact O-CG1 3.32Å; K46-I50 PolarHBondContact O-N 3.23Å; K46-I50 VanDerWaalsContact O-N 3.13Å; Q47-I50 PolarHBondContact O-N 3.35Å; A48-I50 PolarHBondContact O-N 2.75Å; I50-T53 PolarHBondContact O-N 3.06Å; I50-I54 HydrophobicContact CG2-CD1 4.14Å; I50-I54 WeakPolarHBondContact O-CG1 3.47Å; I50-I54 PolarHBondContact O-N 2.86Å; I50-W488 HydrophobicContact CG1-CH2 3.98Å; I50-W488 HydrophobicContact CG1-CZ2 3.76Å
51L94.5Very high92.8Very high51 Ų5147.7 Ų47.727%0.26724%0.244SC..Hα-helixtrans-62.7-47.4177.8-71.1172.3000110.9F34 L43 Q47 A48 T53 I54 C55 I431 V435F34-L51 HydrophobicContact CE1-CB 3.8Å; F34-L51 HydrophobicContact CE1-CD1 4.17Å; F34-L51 HydrophobicContact CZ-CB 3.66Å; L43-L51 HydrophobicContact CD1-CD1 3.86Å; L43-L51 HydrophobicContact CD2-CD1 4.15Å; Q47-L51 WeakPolarHBondContact O-CG 3.33Å; Q47-L51 PolarHBondContact O-N 3.01Å; A48-L51 PolarHBondContact O-N 3.02Å; L51-T53 PolarHBondContact O-N 3.12Å; L51-I54 PolarHBondContact O-N 3.38Å; L51-C55 WeakPolarHBondContact O-CB 3.33Å; L51-C55 PolarHBondContact O-N 2.84Å; L51-C55 PolarHBondContact O-SG 2.92Å; L51-I431 HydrophobicContact CD1-CG2 4.45Å; L51-V435 HydrophobicContact CB-CG2 4.47Å; L51-V435 HydrophobicContact CD1-CG2 4.36Å; L51-V435 HydrophobicContact CD2-CG2 4.36Å
52A93.9Very high93.3Very high0 Ų040.8 Ų40.80%022%0.216CC..Hα-helixtrans-55.5-51.5175.600000111.7V30 F34 A48 I54 C55 E56 L487V30-A52 HydrophobicContact CG1-CB 3.59Å; F34-A52 HydrophobicContact CD2-CB 3.74Å; F34-A52 HydrophobicContact CE2-CB 3.49Å; F34-A52 VanDerWaalsContact CE2-CB 3.49Å; F34-A52 HydrophobicContact CZ-CB 4.35Å; A48-A52 VanDerWaalsContact O-CB 3.23Å; A48-A52 WeakPolarHBondContact O-CB 3.41Å; A48-A52 PolarHBondContact O-N 2.97Å; A52-I54 VanDerWaalsContact C-N 3.28Å; A52-I54 PolarHBondContact O-N 3.24Å; A52-C55 PolarHBondContact O-N 3.33Å; A52-E56 WeakPolarHBondContact O-CB 3.2Å; A52-E56 VanDerWaalsContact O-CG 3.26Å; A52-E56 WeakPolarHBondContact O-CG 3.49Å; A52-E56 PolarHBondContact O-N 3.45Å; A52-L487 HydrophobicContact CB-CD2 3.54Å
53T95.2Very high93.5Very high34 Ų3440 Ų4021%0.20921%0.21CC..Hα-helixtrans-52.5-44177.2-66.60000113.1C49 I50 L51 L57 W488C49-T53 WeakPolarHBondContact O-CB 3.23Å; C49-T53 PolarHBondContact O-N 3.05Å; C49-T53 PolarHBondContact O-OG1 3.06Å; I50-T53 PolarHBondContact O-N 3.06Å; L51-T53 PolarHBondContact O-N 3.12Å; T53-L57 WeakPolarHBondContact O-CB 3.49Å; T53-L57 PolarHBondContact O-N 3.45Å; T53-W488 PolarHBondContact OG1-NE1 3.32Å
54I96.2Very high93.7Very high101 Ų10139.2 Ų39.252%0.51821%0.207SC..Hα-helixtrans-67.4-43.3178.5-64.3165.4000110.7I50 L51 A52 S58I50-I54 HydrophobicContact CG2-CD1 4.14Å; I50-I54 WeakPolarHBondContact O-CG1 3.47Å; I50-I54 PolarHBondContact O-N 2.86Å; L51-I54 PolarHBondContact O-N 3.38Å; A52-I54 VanDerWaalsContact C-N 3.28Å; A52-I54 PolarHBondContact O-N 3.24Å; I54-S58 WeakPolarHBondContact O-CB 3.45Å; I54-S58 PolarHBondContact O-N 3.4Å; I54-S58 VanDerWaalsContact O-N 3.09Å; I54-S58 PolarHBondContact O-OG 3.41Å
55C94.8Very high93.6Very high13 Ų1335.8 Ų35.89%0.08819%0.186CC..Hα-helixtrans-72.5-50.9-176.1-600000112.1L51 A52 L57 S58 G59 S438 F439L51-C55 WeakPolarHBondContact O-CB 3.33Å; L51-C55 PolarHBondContact O-N 2.84Å; L51-C55 PolarHBondContact O-SG 2.92Å; A52-C55 PolarHBondContact O-N 3.33Å; C55-L57 PolarHBondContact O-N 3.1Å; C55-S58 PolarHBondContact O-N 3.34Å; C55-G59 PolarHBondContact O-N 3.4Å; C55-S438 WeakPolarHBondContact CB-OG 3.33Å; C55-F439 HydrophobicContact CB-CB 4.26Å
56E94.6Very high93.5Very high0 Ų039.2 Ų39.20%020%0.2CC..Hα-helixtrans-57.8-47.2178.1-62.3-64.1144.300111.2V30 A52 G59 S60 S438 H441 G442 I483V30-E56 HydrophobicContact CG2-CG 4.37Å; A52-E56 WeakPolarHBondContact O-CB 3.2Å; A52-E56 VanDerWaalsContact O-CG 3.26Å; A52-E56 WeakPolarHBondContact O-CG 3.49Å; A52-E56 PolarHBondContact O-N 3.45Å; E56-G59 PolarHBondContact O-N 2.9Å; E56-S60 VanDerWaalsContact O-CB 3.22Å; E56-S60 WeakPolarHBondContact O-CB 3.29Å; E56-S60 PolarHBondContact O-N 3.33Å; E56-S438 VanDerWaalsContact CD-OG 3.32Å; E56-S438 WeakPolarHBondContact CG-OG 3.44Å; E56-S438 WeakPolarHBondContact OE1-CA 3.27Å; E56-S438 WeakPolarHBondContact OE1-CB 3.36Å; E56-S438 VanDerWaalsContact OE1-O 3.13Å; E56-S438 PolarHBondContact OE1-OG 2.72Å; E56-H441 IonicContact OE1-CG 3.39Å; E56-H441 IonicContact OE1-ND1 3.71Å; E56-H441 PolarHBondContact OE1-ND1 3Å; E56-H441 IonicContact OE2-CE1 3.68Å; E56-H441 IonicContact OE2-CG 2.78Å; E56-H441 IonicContact OE2-ND1 3.88Å; E56-H441 PolarHBondContact OE2-ND1 2.96Å; E56-G442 WeakPolarHBondContact OE2-CA 3.31Å; E56-G442 PolarHBondContact OE2-N 3.02Å; E56-G442 VanDerWaalsContact OE2-N 3.11Å; E56-I483 HydrophobicContact CB-CG2 4.01Å; E56-I483 HydrophobicContact CG-CG2 4.06Å
57L95.5Very high93.4Very high53 Ų5333.9 Ų33.928%0.27718%0.179SC..Hα-helixtrans-66-41.7179.7-178.261.7000111.6T53 C55 V61 V481T53-L57 WeakPolarHBondContact O-CB 3.49Å; T53-L57 PolarHBondContact O-N 3.45Å; C55-L57 PolarHBondContact O-N 3.1Å; L57-V61 VanDerWaalsContact O-CG2 3.3Å; L57-V61 WeakPolarHBondContact O-CG2 3.47Å; L57-V61 PolarHBondContact O-N 3.29Å; L57-V61 VanDerWaalsContact O-N 3.15Å; L57-V481 HydrophobicContact CD1-CG2 4.41Å
58S94.7Very high93.3Very high49 Ų4929.3 Ų29.334%0.34316%0.158SC..Hα-helixtrans-67.9-40.2177.9-59.10000111.4I54 C55 V61 L62 F439I54-S58 WeakPolarHBondContact O-CB 3.45Å; I54-S58 PolarHBondContact O-N 3.4Å; I54-S58 VanDerWaalsContact O-N 3.09Å; I54-S58 PolarHBondContact O-OG 3.41Å; C55-S58 PolarHBondContact O-N 3.34Å; S58-V61 PolarHBondContact O-N 3.27Å; S58-L62 VanDerWaalsContact O-CB 3.25Å; S58-L62 WeakPolarHBondContact O-CB 3.31Å; S58-L62 VanDerWaalsContact O-CG 3.28Å; S58-L62 WeakPolarHBondContact O-CG 3.19Å; S58-L62 PolarHBondContact O-N 2.96Å; S58-F439 VanDerWaalsContact C-CE2 3.48Å
59G94Very high93.1Very high0 Ų031.7 Ų31.70%017%0.171CC..Hα-helixtrans-63-47.717600000112.1C55 E56 V61 L62 L63 G64 F439 G443C55-G59 PolarHBondContact O-N 3.4Å; E56-G59 PolarHBondContact O-N 2.9Å; G59-V61 VanDerWaalsContact C-N 3.31Å; G59-V61 PolarHBondContact O-N 3.29Å; G59-L62 PolarHBondContact O-N 3.43Å; G59-L63 WeakPolarHBondContact O-CB 3.49Å; G59-L63 PolarHBondContact O-N 3.01Å; G59-G64 PolarHBondContact O-N 3.43Å; G59-F439 VanDerWaalsContact CA-CE2 3.46Å; G59-F439 VanDerWaalsContact CA-O 3.23Å; G59-F439 WeakPolarHBondContact CA-O 3.23Å; G59-F439 VanDerWaalsContact N-CE2 3.34Å; G59-G443 VanDerWaalsContact C-CA 3.49Å; G59-G443 VanDerWaalsContact O-CA 3.26Å; G59-G443 WeakPolarHBondContact O-CA 3.33Å
60S94.4Very high92.9Very high0 Ų034.8 Ų34.80%019%0.19CC..Hα-helixtrans-52-49.6174.7161.60000112E56 G64 G442 V446 L476E56-S60 VanDerWaalsContact O-CB 3.22Å; E56-S60 WeakPolarHBondContact O-CB 3.29Å; E56-S60 PolarHBondContact O-N 3.33Å; S60-G64 WeakPolarHBondContact O-CA 3.48Å; S60-G64 PolarHBondContact O-N 2.99Å; S60-G64 VanDerWaalsContact O-N 3.09Å; S60-G442 VanDerWaalsContact CA-O 3.24Å; S60-G442 WeakPolarHBondContact CA-O 3.41Å; S60-G442 WeakPolarHBondContact CB-O 3.36Å; S60-G442 PolarHBondContact N-O 3.08Å; S60-V446 WeakPolarHBondContact OG-CG2 3.49Å; S60-L476 PolarHBondContact OG-O 3.49Å
61V93.8Very high92.6Very high26 Ų2631.6 Ų31.616%0.15817%0.173CC..Hα-helixtrans-72.2-39.7-178.1173.20000112.4L57 S58 G59 I473 V477L57-V61 VanDerWaalsContact O-CG2 3.3Å; L57-V61 WeakPolarHBondContact O-CG2 3.47Å; L57-V61 PolarHBondContact O-N 3.29Å; L57-V61 VanDerWaalsContact O-N 3.15Å; S58-V61 PolarHBondContact O-N 3.27Å; G59-V61 VanDerWaalsContact C-N 3.31Å; G59-V61 PolarHBondContact O-N 3.29Å; V61-I473 HydrophobicContact CG1-CD1 3.77Å; V61-I473 HydrophobicContact CG1-CG1 3.88Å; V61-V477 HydrophobicContact CG2-CG2 3.6Å
62L93.1Very high92.3Very high47 Ų4730.1 Ų30.125%0.24616%0.164CC..Hα-helixtrans-91.1-19.8-171.7-65.9177.9000115.1S58 G59 I202 G206 P207 L210 F439S58-L62 VanDerWaalsContact O-CB 3.25Å; S58-L62 WeakPolarHBondContact O-CB 3.31Å; S58-L62 VanDerWaalsContact O-CG 3.28Å; S58-L62 WeakPolarHBondContact O-CG 3.19Å; S58-L62 PolarHBondContact O-N 2.96Å; G59-L62 PolarHBondContact O-N 3.43Å; L62-I202 HydrophobicContact CB-CG1 4.34Å; L62-I202 HydrophobicContact CB-CG2 4.32Å; L62-I202 HydrophobicContact CD1-CD1 4.29Å; L62-G206 WeakPolarHBondContact O-CA 3.4Å; L62-P207 VanDerWaalsContact O-CD 3.27Å; L62-P207 WeakPolarHBondContact O-CD 3.41Å; L62-L210 HydrophobicContact CD2-CD1 3.79Å; L62-F439 HydrophobicContact CB-CE2 4.47Å; L62-F439 HydrophobicContact CB-CZ 4.09Å; L62-F439 HydrophobicContact CD1-CE2 4.07Å; L62-F439 HydrophobicContact CD1-CZ 4.09Å
63L91.8Very high92Very high16 Ų1633 Ų338%0.08418%0.177CC..Hα-helixtrans-126.8-26.8-178.4-64.7176.5000113.5G59 A65 K66 I202 F439G59-L63 WeakPolarHBondContact O-CB 3.49Å; G59-L63 PolarHBondContact O-N 3.01Å; L63-A65 PolarHBondContact O-N 3.17Å; L63-A65 VanDerWaalsContact O-N 3.09Å; L63-K66 PolarHBondContact O-N 3.19Å; L63-I202 HydrophobicContact CD2-CG1 4.1Å; L63-I202 HydrophobicContact CG-CG1 4.45Å; L63-F439 HydrophobicContact CD1-CD1 4.21Å; L63-F439 HydrophobicContact CD1-CE1 3.6Å; L63-F439 HydrophobicContact CD1-CZ 4.22Å; L63-F439 HydrophobicContact CG-CE1 4.2Å; L63-F439 HydrophobicContact CG-CZ 4.37Å
64G92.3Very high91.6Very high0 Ų031.7 Ų31.70%017%0.17CC..Hα-helixtrans-62.6-23.2-169.800000115.7G59 S60 K66 S68 G443 S447G59-G64 PolarHBondContact O-N 3.43Å; S60-G64 WeakPolarHBondContact O-CA 3.48Å; S60-G64 PolarHBondContact O-N 2.99Å; S60-G64 VanDerWaalsContact O-N 3.09Å; G64-K66 VanDerWaalsContact C-N 3.31Å; G64-K66 PolarHBondContact O-N 2.87Å; G64-S68 WeakPolarHBondContact O-CB 3.31Å; G64-S68 PolarHBondContact O-N 2.86Å; G64-S68 PolarHBondContact O-OG 2.86Å; G64-G443 VanDerWaalsContact CA-O 3.22Å; G64-G443 WeakPolarHBondContact CA-O 3.41Å; G64-S447 PolarHBondContact O-OG 3.01Å
65A89.7Confident91.5Very high8 Ų826.9 Ų26.97%0.06615%0.145CC..Hα-helixtrans-58-39.6177.800000113.3L63 N69 P207 L476L63-A65 PolarHBondContact O-N 3.17Å; L63-A65 VanDerWaalsContact O-N 3.09Å; A65-N69 PolarHBondContact O-N 3.31Å; A65-N69 PolarHBondContact O-ND2 3.07Å; A65-P207 HydrophobicContact CB-CB 3.87Å; A65-L476 HydrophobicContact CB-CD1 4.01Å
66K88.1Confident91.3Very high109 Ų10926.4 Ų26.447%0.47414%0.142SC..Hα-helixtrans-72.4-49.3-176.4-173.269.2168.7-165.90111.7L63 G64 N69 T70 E205L63-K66 PolarHBondContact O-N 3.19Å; G64-K66 VanDerWaalsContact C-N 3.31Å; G64-K66 PolarHBondContact O-N 2.87Å; K66-N69 PolarHBondContact O-N 3.31Å; K66-T70 PolarHBondContact O-N 3.31Å; K66-T70 PolarHBondContact O-OG1 3.23Å; K66-E205 HydrophobicContact CB-CB 4.25Å; K66-E205 WeakPolarHBondContact CB-O 3.45Å; K66-E205 HydrophobicContact CG-CB 4.21Å
67V88.9Confident91.2Very high34 Ų3427.7 Ų27.721%0.20615%0.151CC..Hα-helixtrans-66.1-39.7179.8-176.50000110.4N69 T70 I71 S447V67-N69 VanDerWaalsContact C-N 3.3Å; V67-N69 PolarHBondContact O-N 3.4Å; V67-T70 WeakPolarHBondContact O-CA 3.44Å; V67-T70 WeakPolarHBondContact O-CB 3.46Å; V67-T70 PolarHBondContact O-N 2.78Å; V67-I71 PolarHBondContact O-N 3.12Å; V67-S447 WeakPolarHBondContact CB-OG 3.35Å
68S92.3Very high90.9Very high1 Ų125.5 Ų25.51%0.00714%0.14CC..Hα-helixtrans-57.7-39.4173.6-70.20000113G64 I71 R72 S447G64-S68 WeakPolarHBondContact O-CB 3.31Å; G64-S68 PolarHBondContact O-N 2.86Å; G64-S68 PolarHBondContact O-OG 2.86Å; S68-I71 PolarHBondContact O-N 3.1Å; S68-R72 WeakPolarHBondContact O-CB 3.19Å; S68-R72 PolarHBondContact O-N 3.48Å; S68-S447 PolarHBondContact N-OG 3.04Å; S68-S447 VanDerWaalsContact N-OG 3.09Å; S68-S447 WeakPolarHBondContact OG-CA 3.01Å; S68-S447 WeakPolarHBondContact OG-CB 3.31Å; S68-S447 PolarHBondContact OG-OG 2.86Å; S68-S447 VanDerWaalsContact OG-OG 3.05Å
69N88.3Confident90.6Very high50 Ų5027.9 Ų27.927%0.26715%0.146SC..Hα-helixtrans-69.1-32.6174.8-82.2-67.2000112.6A65 K66 V67 R72 K73A65-N69 PolarHBondContact O-N 3.31Å; A65-N69 PolarHBondContact O-ND2 3.07Å; K66-N69 PolarHBondContact O-N 3.31Å; V67-N69 VanDerWaalsContact C-N 3.3Å; V67-N69 PolarHBondContact O-N 3.4Å; N69-R72 PolarHBondContact O-N 3.25Å; N69-R72 PolarHBondContact OD1-NE 3.28Å; N69-R72 PolarHBondContact OD1-NH2 2.91Å; N69-K73 PolarHBondContact O-N 3.44Å
70T89.1Confident90.5Very high64 Ų6430.2 Ų30.239%0.39316%0.158SC..Hα-helixtrans-67.3-39.7173-55.60000112K66 V67 G74 I147K66-T70 PolarHBondContact O-N 3.31Å; K66-T70 PolarHBondContact O-OG1 3.23Å; V67-T70 WeakPolarHBondContact O-CA 3.44Å; V67-T70 WeakPolarHBondContact O-CB 3.46Å; V67-T70 PolarHBondContact O-N 2.78Å; T70-G74 WeakPolarHBondContact O-CA 3.48Å; T70-G74 PolarHBondContact O-N 3.49Å; T70-I147 HydrophobicContact CG2-CD1 4.22Å; T70-I147 HydrophobicContact CG2-CG1 4.29Å
71I89.8Confident90.4Very high7 Ų730.3 Ų30.34%0.03616%0.158CC..Hα-helixtrans-64.4-45.2172.5-60.2-60.3000110.5V67 S68 I75 I122 V123 P452V67-I71 PolarHBondContact O-N 3.12Å; S68-I71 PolarHBondContact O-N 3.1Å; I71-I75 HydrophobicContact CD1-CD1 4.27Å; I71-I75 HydrophobicContact CG2-CD1 4.29Å; I71-I75 WeakPolarHBondContact O-CD1 3.33Å; I71-I122 HydrophobicContact CD1-CG2 4.34Å; I71-I122 HydrophobicContact CG2-CG1 4.34Å; I71-V123 HydrophobicContact CD1-CG2 3.99Å; I71-P452 HydrophobicContact CG2-CG 4.2Å
72R88.3Confident90.2Very high20 Ų2034.6 Ų34.68%0.07518%0.177CC..Hα-helixtrans-65.1-43.9-178.4-176.3177.367.2117.8-10.3114.5S68 N69 S467S68-R72 WeakPolarHBondContact O-CB 3.19Å; S68-R72 PolarHBondContact O-N 3.48Å; N69-R72 PolarHBondContact O-N 3.25Å; N69-R72 PolarHBondContact OD1-NE 3.28Å; N69-R72 PolarHBondContact OD1-NH2 2.91Å; R72-S467 PolarHBondContact NH1-O 2.93Å; R72-S467 PolarHBondContact NH2-O 3Å
73K86.3Confident90.1Very high60 Ų6037.5 Ų37.526%0.26120%0.196SC..Hα-helixtrans-126.814.2-168.8-69.7-160.4171.8-157.30114.6N69 Q140 D466N69-K73 PolarHBondContact O-N 3.44Å; K73-Q140 PolarHBondContact O-OE1 3.5Å; K73-D466 IonicContact NZ-OD1 2.6Å; K73-D466 PolarHBondContact NZ-OD1 2.83Å
74G88.4Confident90Very high7 Ų739.8 Ų39.87%0.07221%0.208CC..SBendtrans-113.6-6.2-17900000114.8T70 G143 L144T70-G74 WeakPolarHBondContact O-CA 3.48Å; T70-G74 PolarHBondContact O-N 3.49Å; G74-G143 CarbonylContact O-C 3.28Å; G74-G143 VanDerWaalsContact O-C 3.28Å; G74-G143 VanDerWaalsContact O-CA 3.22Å; G74-G143 WeakPolarHBondContact O-CA 3.05Å; G74-L144 PolarHBondContact O-N 3.28Å
75I92.7Very high90Very high0 Ų047.3 Ų47.30%025%0.248CC..SBendtrans-113.5-43.9-173.1-53.7169.1000110.6I71 V123 T126 M127 Q140 I147I71-I75 HydrophobicContact CD1-CD1 4.27Å; I71-I75 HydrophobicContact CG2-CD1 4.29Å; I71-I75 WeakPolarHBondContact O-CD1 3.33Å; I75-V123 HydrophobicContact CD1-CB 4.23Å; I75-V123 HydrophobicContact CD1-CG1 4.27Å; I75-V123 HydrophobicContact CD1-CG2 3.73Å; I75-T126 HydrophobicContact CB-CG2 3.96Å; I75-T126 HydrophobicContact CD1-CG2 3.95Å; I75-T126 HydrophobicContact CG2-CG2 3.83Å; I75-M127 HydrophobicContact CG2-CG 3.61Å; I75-Q140 PolarHBondContact O-N 3.5Å; I75-I147 HydrophobicContact CD1-CD1 4.49Å; I75-I147 HydrophobicContact CG1-CD1 3.76Å
76V91.9Very high90Very high4 Ų452.2 Ų52.22%0.02427%0.273CS..BIsolated β-bridgetrans-119.3132.9-174.4-179.20000109.5V78 F81 T126 F129 A138V76-V78 VanDerWaalsContact C-N 3.33Å; V76-V78 PolarHBondContact O-N 2.81Å; V76-F81 HydrophobicContact CG1-CE2 3.77Å; V76-T126 HydrophobicContact CG2-CG2 3.71Å; V76-F129 HydrophobicContact CG2-CZ 4.4Å; V76-A138 WeakPolarHBondContact CA-O 3.28Å
77S91Very high90.3Very high26 Ų2647 Ų4718%0.18225%0.251CS..  trans-71.886.3172.6-52.20000109.1E79 L80 A138S77-E79 PolarHBondContact O-N 3.31Å; S77-E79 VanDerWaalsContact O-N 3.15Å; S77-L80 PolarHBondContact O-N 2.87Å; S77-A138 PolarHBondContact N-O 3.04Å; S77-A138 PolarHBondContact OG-O 3.42Å
78V89.4Confident90.4Very high7 Ų747.3 Ų47.34%0.04225%0.25CS..G310 helixtrans-59.9-26.7-174-62.10000112.2V76 L80 F81 L91 V465V76-V78 VanDerWaalsContact C-N 3.33Å; V76-V78 PolarHBondContact O-N 2.81Å; V78-L80 PolarHBondContact O-N 2.93Å; V78-L80 VanDerWaalsContact O-N 3.15Å; V78-F81 WeakPolarHBondContact O-CB 3.35Å; V78-F81 PolarHBondContact O-N 3.28Å; V78-L91 HydrophobicContact CB-CD2 4.23Å; V78-L91 HydrophobicContact CG1-CD2 4.2Å; V78-V465 HydrophobicContact CB-CG1 3.66Å; V78-V465 HydrophobicContact CG2-CG1 4.12Å; V78-V465 WeakPolarHBondContact O-CG1 3.43Å
79E88.7Confident90.6Very high99 Ų9949 Ų4946%0.46326%0.26SS..G310 helixtrans-57.6-29.4178.8-58.972.7-157.800112.5S77 F81 Q82S77-E79 PolarHBondContact O-N 3.31Å; S77-E79 VanDerWaalsContact O-N 3.15Å; E79-F81 PolarHBondContact O-N 3.2Å; E79-Q82 VanDerWaalsContact O-CB 3.28Å; E79-Q82 WeakPolarHBondContact O-CB 3.23Å; E79-Q82 PolarHBondContact O-N 3.4Å
80L91.3Very high90.9Very high49 Ų4949.9 Ų49.926%0.25726%0.264SS..G310 helixtrans-64.2-28.6175.8-65.1172.5000112.7S77 V78 Q82 T83 F134 N137S77-L80 PolarHBondContact O-N 2.87Å; V78-L80 PolarHBondContact O-N 2.93Å; V78-L80 VanDerWaalsContact O-N 3.15Å; L80-Q82 PolarHBondContact O-N 3.48Å; L80-T83 PolarHBondContact O-N 3.07Å; L80-T83 PolarHBondContact O-OG1 3.26Å; L80-F134 VanDerWaalsContact C-CZ 3.47Å; L80-F134 HydrophobicContact CB-CD1 4.18Å; L80-F134 HydrophobicContact CB-CD2 4.26Å; L80-F134 HydrophobicContact CB-CE1 3.86Å; L80-F134 HydrophobicContact CB-CE2 3.96Å; L80-F134 HydrophobicContact CB-CG 4.37Å; L80-F134 HydrophobicContact CB-CZ 3.75Å; L80-F134 HydrophobicContact CD1-CB 4.46Å; L80-F134 HydrophobicContact CD1-CG 4.33Å; L80-F134 VanDerWaalsContact O-CZ 3.23Å; L80-F134 WeakPolarHBondContact O-CZ 3.19Å; L80-N137 VanDerWaalsContact CD1-O 3.3Å; L80-N137 WeakPolarHBondContact CD1-O 3.33Å
81F92.3Very high91.1Very high3 Ų346.9 Ų46.91%0.01325%0.246CC..G310 helixtrans-71.8-6.7175.1-67.2-99000112.8V76 V78 E79 T83 G87 L90 L91 F129 I133 F134 V465V76-F81 HydrophobicContact CG1-CE2 3.77Å; V78-F81 WeakPolarHBondContact O-CB 3.35Å; V78-F81 PolarHBondContact O-N 3.28Å; E79-F81 PolarHBondContact O-N 3.2Å; F81-T83 VanDerWaalsContact C-N 3.33Å; F81-G87 VanDerWaalsContact CD1-O 3.32Å; F81-G87 WeakPolarHBondContact CD1-O 3.45Å; F81-G87 VanDerWaalsContact O-CA 3.31Å; F81-G87 WeakPolarHBondContact O-CA 3.1Å; F81-L90 HydrophobicContact CD1-CB 4.47Å; F81-L90 HydrophobicContact CE1-CD2 4.47Å; F81-L90 HydrophobicContact CE1-CG 4.26Å; F81-L91 HydrophobicContact CB-CB 4.38Å; F81-L91 HydrophobicContact CB-CD2 4.43Å; F81-L91 HydrophobicContact CD1-CB 3.62Å; F81-L91 HydrophobicContact CD1-CD1 4.35Å; F81-L91 HydrophobicContact CD1-CG 4.43Å; F81-L91 HydrophobicContact CD2-CD1 4.11Å; F81-L91 HydrophobicContact CD2-CD2 4.32Å; F81-L91 HydrophobicContact CE1-CB 3.92Å; F81-L91 HydrophobicContact CE1-CD1 4.06Å; F81-L91 HydrophobicContact CE2-CD1 3.86Å; F81-L91 HydrophobicContact CG-CB 3.94Å; F81-L91 HydrophobicContact CG-CD1 4.35Å; F81-L91 HydrophobicContact CG-CD2 4.26Å; F81-L91 HydrophobicContact CG-CG 4.41Å; F81-L91 HydrophobicContact CZ-CD1 3.83Å; F81-F129 HydrophobicContact CZ-CD2 4.47Å; F81-F129 AromaticContact CZ-CE2 3.88Å; F81-F129 HydrophobicContact CZ-CE2 3.88Å; F81-I133 HydrophobicContact CE1-CD1 3.73Å; F81-I133 HydrophobicContact CZ-CD1 3.93Å; F81-F134 AromaticContact CD1-CE2 3.96Å; F81-F134 HydrophobicContact CD1-CE2 3.96Å; F81-F134 HydrophobicContact CD1-CZ 4.46Å; F81-F134 AromaticContact CD2-CE2 3.74Å; F81-F134 HydrophobicContact CD2-CE2 3.74Å; F81-F134 HydrophobicContact CD2-CZ 4.44Å; F81-F134 AromaticContact CE1-CE2 3.88Å; F81-F134 HydrophobicContact CE1-CE2 3.88Å; F81-F134 HydrophobicContact CE2-CD2 4.13Å; F81-F134 AromaticContact CE2-CE2 3.6Å; F81-F134 HydrophobicContact CE2-CE2 3.6Å; F81-F134 AromaticContact CG-CE2 3.91Å; F81-F134 HydrophobicContact CG-CE2 3.91Å; F81-F134 HydrophobicContact CG-CZ 4.32Å; F81-F134 HydrophobicContact CZ-CD2 4.19Å; F81-F134 AromaticContact CZ-CE2 3.68Å; F81-F134 HydrophobicContact CZ-CE2 3.68Å; F81-V465 HydrophobicContact CB-CG1 4.3Å; F81-V465 HydrophobicContact CB-CG2 4.04Å
82Q90.9Very high91.4Very high116 Ų11646.6 Ų46.654%0.54224%0.244SC..G310 helixtrans-81.8-13.4169.2-58.2178.2-41.200112.3E79 L80 V465E79-Q82 VanDerWaalsContact O-CB 3.28Å; E79-Q82 WeakPolarHBondContact O-CB 3.23Å; E79-Q82 PolarHBondContact O-N 3.4Å; L80-Q82 PolarHBondContact O-N 3.48Å; Q82-V465 HydrophobicContact CG-CB 4.11Å; Q82-V465 HydrophobicContact CG-CG2 4.42Å
83T90.8Very high91.8Very high107 Ų10747.5 Ų47.566%0.65626%0.256SS*.SBendtrans-95.55-179.680.60000113.7L80 F81L80-T83 PolarHBondContact O-N 3.07Å; L80-T83 PolarHBondContact O-OG1 3.26Å; F81-T83 VanDerWaalsContact C-N 3.33Å
84I90.3Very high92.2Very high65 Ų6544.8 Ų44.833%0.33325%0.246SC..SBendtrans-120.7134.8177.5-60-172.9000108.6N86 G87 L90 I133 F134I84-N86 PolarHBondContact O-N 3.41Å; I84-G87 WeakPolarHBondContact O-CA 3.4Å; I84-G87 PolarHBondContact O-N 2.91Å; I84-L90 HydrophobicContact CD1-CD2 4.46Å; I84-I133 HydrophobicContact CD1-CG2 4.1Å; I84-F134 HydrophobicContact CD1-CD1 4.37Å; I84-F134 HydrophobicContact CD1-CE1 3.4Å; I84-F134 VanDerWaalsContact CD1-CE1 3.4Å; I84-F134 HydrophobicContact CD1-CE2 4.3Å; I84-F134 HydrophobicContact CD1-CZ 3.34Å; I84-F134 HydrophobicContact CG1-CE1 3.88Å; I84-F134 HydrophobicContact CG1-CZ 3.89Å
85D90.8Very high92.6Very high157 Ų15744.9 Ų44.984%0.8424%0.244SC*.THydrogen-bonded Turntrans-56.4127.8171.5-65.4-38.9000110.6G87D85-G87 PolarHBondContact O-N 3.44Å
86N90.7Very high92.8Very high111 Ų11145.7 Ų45.759%0.59425%0.249SC*.THydrogen-bonded Turntrans57.422.9-171.9-54.9-44.8000114.8I84 H88 V89 L90I84-N86 PolarHBondContact O-N 3.41Å; N86-H88 PolarHBondContact O-N 2.97Å; N86-V89 HydrophobicContact CB-CB 4.38Å; N86-V89 HydrophobicContact CB-CG2 4.05Å; N86-V89 WeakPolarHBondContact O-CA 3.43Å; N86-V89 VanDerWaalsContact O-CB 3.31Å; N86-V89 WeakPolarHBondContact O-CB 3.27Å; N86-V89 PolarHBondContact O-N 3.21Å; N86-L90 PolarHBondContact O-N 2.85Å; N86-L90 VanDerWaalsContact O-N 3.14Å
87G93.4Very high93.1Very high1 Ų148.1 Ų48.11%0.0127%0.27CS..Hα-helixtrans-59.1-22.1178.600000114.3F81 I84 D85 L90 L91F81-G87 VanDerWaalsContact CD1-O 3.32Å; F81-G87 WeakPolarHBondContact CD1-O 3.45Å; F81-G87 VanDerWaalsContact O-CA 3.31Å; F81-G87 WeakPolarHBondContact O-CA 3.1Å; I84-G87 WeakPolarHBondContact O-CA 3.4Å; I84-G87 PolarHBondContact O-N 2.91Å; D85-G87 PolarHBondContact O-N 3.44Å; G87-L90 PolarHBondContact O-N 3.07Å; G87-L91 WeakPolarHBondContact O-CB 3.39Å; G87-L91 PolarHBondContact O-N 3.25Å
88H92.8Very high93.4Very high40 Ų4046.9 Ų46.919%0.18526%0.261CS..Hα-helixtrans-62.9-43.6168.561.7-88.9000112.3N86 L91 M92 I459 Q463 V465N86-H88 PolarHBondContact O-N 2.97Å; H88-L91 PolarHBondContact O-N 3.13Å; H88-M92 WeakPolarHBondContact O-CG 3.23Å; H88-M92 PolarHBondContact O-N 3Å; H88-I459 HydrophobicContact CB-CG2 3.77Å; H88-Q463 PolarHBondContact NE2-OE1 2.91Å; H88-V465 HydrophobicContact CB-CG2 3.88Å
89V94.8Very high93.8Very high36 Ų3646.6 Ų46.622%0.21826%0.259CS..Hα-helixtrans-63.7-42.8173.7-171.10000110.4M10 N86 L91 M92 A93M10-V89 HydrophobicContact CE-CG1 3.65Å; N86-V89 HydrophobicContact CB-CB 4.38Å; N86-V89 HydrophobicContact CB-CG2 4.05Å; N86-V89 WeakPolarHBondContact O-CA 3.43Å; N86-V89 VanDerWaalsContact O-CB 3.31Å; N86-V89 WeakPolarHBondContact O-CB 3.27Å; N86-V89 PolarHBondContact O-N 3.21Å; V89-L91 VanDerWaalsContact C-N 3.33Å; V89-L91 PolarHBondContact O-N 3.39Å; V89-M92 WeakPolarHBondContact O-CB 3.27Å; V89-M92 PolarHBondContact O-N 3.45Å; V89-A93 PolarHBondContact O-N 2.92Å
90L94.7Very high94.2Very high68 Ų6842.5 Ų42.536%0.35624%0.244SC..Hα-helixtrans-64.6-37.4178.2-173.562.1000112.1F81 I84 N86 G87 A93 G94 I133F81-L90 HydrophobicContact CD1-CB 4.47Å; F81-L90 HydrophobicContact CE1-CD2 4.47Å; F81-L90 HydrophobicContact CE1-CG 4.26Å; I84-L90 HydrophobicContact CD1-CD2 4.46Å; N86-L90 PolarHBondContact O-N 2.85Å; N86-L90 VanDerWaalsContact O-N 3.14Å; G87-L90 PolarHBondContact O-N 3.07Å; L90-A93 PolarHBondContact O-N 3.15Å; L90-G94 PolarHBondContact O-N 3.14Å; L90-I133 HydrophobicContact CD1-CD1 4.16Å; L90-I133 HydrophobicContact CD2-CD1 3.98Å; L90-I133 HydrophobicContact CD2-CG1 4.2Å; L90-I133 HydrophobicContact CD2-CG2 3.65Å; L90-I133 HydrophobicContact CG-CD1 3.81Å; L90-I133 HydrophobicContact CG-CG1 4.45Å
91L94.4Very high94.5Very high2 Ų242 Ų421%0.0125%0.251CS..Hα-helixtrans-67.3-39.7173.2-174.654.3000111.6V78 F81 G87 H88 V89 G94 Q95 F129 I459 V465V78-L91 HydrophobicContact CB-CD2 4.23Å; V78-L91 HydrophobicContact CG1-CD2 4.2Å; F81-L91 HydrophobicContact CB-CB 4.38Å; F81-L91 HydrophobicContact CB-CD2 4.43Å; F81-L91 HydrophobicContact CD1-CB 3.62Å; F81-L91 HydrophobicContact CD1-CD1 4.35Å; F81-L91 HydrophobicContact CD1-CG 4.43Å; F81-L91 HydrophobicContact CD2-CD1 4.11Å; F81-L91 HydrophobicContact CD2-CD2 4.32Å; F81-L91 HydrophobicContact CE1-CB 3.92Å; F81-L91 HydrophobicContact CE1-CD1 4.06Å; F81-L91 HydrophobicContact CE2-CD1 3.86Å; F81-L91 HydrophobicContact CG-CB 3.94Å; F81-L91 HydrophobicContact CG-CD1 4.35Å; F81-L91 HydrophobicContact CG-CD2 4.26Å; F81-L91 HydrophobicContact CG-CG 4.41Å; F81-L91 HydrophobicContact CZ-CD1 3.83Å; G87-L91 WeakPolarHBondContact O-CB 3.39Å; G87-L91 PolarHBondContact O-N 3.25Å; H88-L91 PolarHBondContact O-N 3.13Å; V89-L91 VanDerWaalsContact C-N 3.33Å; V89-L91 PolarHBondContact O-N 3.39Å; L91-G94 WeakPolarHBondContact O-CA 3.43Å; L91-G94 PolarHBondContact O-N 3.13Å; L91-Q95 WeakPolarHBondContact O-CG 3.4Å; L91-Q95 PolarHBondContact O-N 3.02Å; L91-F129 HydrophobicContact CD1-CE2 3.95Å; L91-F129 HydrophobicContact CD1-CZ 4.05Å; L91-I459 HydrophobicContact CB-CD1 4.14Å; L91-I459 HydrophobicContact CD2-CD1 3.52Å; L91-I459 HydrophobicContact CG-CD1 3.59Å; L91-V465 HydrophobicContact CD2-CB 4.46Å; L91-V465 HydrophobicContact CD2-CG1 3.55Å; L91-V465 HydrophobicContact CD2-CG2 4.36Å
92M95.6Very high94.7Very high0 Ų041.9 Ų41.90%025%0.25CS..Hα-helixtrans-58.8-47.5172.8-71.617459.200111.6Q7 M10 V11 H88 V89 G94 Q95 V96 L456 I459 A460Q7-M92 HydrophobicContact CB-CE 4.05Å; M10-M92 HydrophobicContact CB-CE 4.4Å; M10-M92 HydrophobicContact CE-CB 4.1Å; M10-M92 HydrophobicContact CE-CE 3.83Å; M10-M92 HydrophobicContact CE-SD 4.45Å; M10-M92 HydrophobicContact SD-CB 3.86Å; V11-M92 HydrophobicContact CG2-CE 4.01Å; H88-M92 WeakPolarHBondContact O-CG 3.23Å; H88-M92 PolarHBondContact O-N 3Å; V89-M92 WeakPolarHBondContact O-CB 3.27Å; V89-M92 PolarHBondContact O-N 3.45Å; M92-G94 VanDerWaalsContact C-N 3.28Å; M92-G94 PolarHBondContact O-N 3.47Å; M92-Q95 PolarHBondContact O-N 2.87Å; M92-V96 PolarHBondContact O-N 3.5Å; M92-L456 HydrophobicContact CB-CD1 3.63Å; M92-L456 HydrophobicContact CE-CD1 3.8Å; M92-L456 HydrophobicContact CG-CD1 3.85Å; M92-I459 HydrophobicContact CG-CB 3.86Å; M92-I459 HydrophobicContact CG-CD1 4.47Å; M92-I459 HydrophobicContact CG-CG2 3.61Å; M92-I459 HydrophobicContact SD-CB 4.3Å; M92-I459 HydrophobicContact SD-CG2 3.8Å; M92-A460 HydrophobicContact CE-CB 3.64Å; M92-A460 HydrophobicContact SD-CB 4.19Å
93A96.1Very high95Very high39 Ų3936.8 Ų36.832%0.32223%0.227SC..Hα-helixtrans-59.8-39.9174.100000111.6M10 V89 L90 V96 A97M10-A93 HydrophobicContact SD-CB 4.05Å; V89-A93 PolarHBondContact O-N 2.92Å; L90-A93 PolarHBondContact O-N 3.15Å; A93-V96 PolarHBondContact O-N 3.35Å; A93-A97 WeakPolarHBondContact O-CB 3.43Å; A93-A97 PolarHBondContact O-N 3.41Å
94G96Very high95.2Very high4 Ų437.2 Ų37.24%0.04122%0.224CC..Hα-helixtrans-58.8-44.6172.400000113.8L90 L91 M92 A97 A98 F129L90-G94 PolarHBondContact O-N 3.14Å; L91-G94 WeakPolarHBondContact O-CA 3.43Å; L91-G94 PolarHBondContact O-N 3.13Å; M92-G94 VanDerWaalsContact C-N 3.28Å; M92-G94 PolarHBondContact O-N 3.47Å; G94-A97 PolarHBondContact O-N 3.18Å; G94-A98 WeakPolarHBondContact O-CB 3.4Å; G94-A98 PolarHBondContact O-N 3.12Å; G94-F129 VanDerWaalsContact CA-CD2 3.47Å; G94-F129 WeakPolarHBondContact O-CD1 3.36Å; G94-F129 WeakPolarHBondContact O-CE1 3.39Å
95Q95.8Very high95.5Very high8 Ų840.8 Ų40.84%0.03723%0.234CC..Hα-helixtrans-62.9-42.6175.1-59.6-51.8-36.400111.8L91 M92 A98 L99 P452 L456L91-Q95 WeakPolarHBondContact O-CG 3.4Å; L91-Q95 PolarHBondContact O-N 3.02Å; M92-Q95 PolarHBondContact O-N 2.87Å; Q95-A98 PolarHBondContact O-N 2.94Å; Q95-L99 VanDerWaalsContact O-CG 3.3Å; Q95-L99 WeakPolarHBondContact O-CG 3.45Å; Q95-L99 PolarHBondContact O-N 2.7Å; Q95-P452 HydrophobicContact CB-CB 4.35Å; Q95-P452 VanDerWaalsContact OE1-CA 3.24Å; Q95-P452 VanDerWaalsContact OE1-CB 3.32Å; Q95-L456 HydrophobicContact CB-CB 4.12Å; Q95-L456 HydrophobicContact CG-CB 4.48Å
96V97.7Very high95.5Very high17 Ų1733.4 Ų33.410%0.10319%0.194CC..Hα-helixtrans-64.6-40.4176.3176.20000111.1M10 V13 I17 M92 A93 L99 G100 L456M10-V96 HydrophobicContact CB-CG2 4.16Å; M10-V96 WeakPolarHBondContact O-CG2 3.26Å; V13-V96 HydrophobicContact CG1-CG1 4.03Å; I17-V96 HydrophobicContact CD1-CG1 4.37Å; M92-V96 PolarHBondContact O-N 3.5Å; A93-V96 PolarHBondContact O-N 3.35Å; V96-L99 PolarHBondContact O-N 3.15Å; V96-G100 PolarHBondContact O-N 2.86Å; V96-L456 HydrophobicContact CG2-CD1 4.12Å; V96-L456 HydrophobicContact CG2-CD2 3.72Å
97A97.5Very high95.5Very high56 Ų5630.6 Ų30.646%0.46318%0.179SC..Hα-helixtrans-65.1-41175.400000112.4A93 G94 G100 G101A93-A97 WeakPolarHBondContact O-CB 3.43Å; A93-A97 PolarHBondContact O-N 3.41Å; G94-A97 PolarHBondContact O-N 3.18Å; A97-G100 PolarHBondContact O-N 3.28Å; A97-G101 PolarHBondContact O-N 3.48Å
98A97.3Very high95.3Very high0 Ų033.6 Ų33.60%020%0.197CC..Hα-helixtrans-62.2-47175.700000111.7G94 Q95 S102 I122 A125 F129G94-A98 WeakPolarHBondContact O-CB 3.4Å; G94-A98 PolarHBondContact O-N 3.12Å; Q95-A98 PolarHBondContact O-N 2.94Å; A98-S102 WeakPolarHBondContact O-CB 3.44Å; A98-S102 PolarHBondContact O-N 2.88Å; A98-I122 HydrophobicContact CB-CD1 4.03Å; A98-I122 WeakPolarHBondContact O-CD1 3.44Å; A98-A125 HydrophobicContact CB-CB 4.35Å; A98-A125 WeakPolarHBondContact O-CB 3.37Å; A98-F129 HydrophobicContact CB-CD1 3.95Å; A98-F129 HydrophobicContact CB-CE1 4Å
99L98.1Very high95Very high0 Ų031.8 Ų31.80%019%0.189CC..Hα-helixtrans-58.6-47.8173.3-71.8170.2000111.2I17 A18 L21 Q95 V96 C103 A449 P452I17-L99 HydrophobicContact CB-CB 4.47Å; I17-L99 HydrophobicContact CG2-CB 3.77Å; A18-L99 HydrophobicContact CB-CD1 4.19Å; A18-L99 HydrophobicContact CB-CD2 4.09Å; L21-L99 HydrophobicContact CD2-CD2 3.87Å; Q95-L99 VanDerWaalsContact O-CG 3.3Å; Q95-L99 WeakPolarHBondContact O-CG 3.45Å; Q95-L99 PolarHBondContact O-N 2.7Å; V96-L99 PolarHBondContact O-N 3.15Å; L99-C103 WeakPolarHBondContact O-CB 3.16Å; L99-C103 PolarHBondContact O-N 3.32Å; L99-A449 WeakPolarHBondContact CD2-O 3.45Å; L99-P452 HydrophobicContact CD1-CB 4.19Å; L99-P452 HydrophobicContact CD2-CB 3.82Å; L99-P452 HydrophobicContact CD2-CG 3.92Å; L99-P452 HydrophobicContact CG-CB 3.75Å; L99-P452 HydrophobicContact CG-CG 4.3Å
100G97.9Very high94.4Very high13 Ų1330.2 Ų30.213%0.13418%0.179CC..Hα-helixtrans-60.2-52-179.700000112.6V96 A97 S102 C103 I104V96-G100 PolarHBondContact O-N 2.86Å; A97-G100 PolarHBondContact O-N 3.28Å; G100-S102 PolarHBondContact O-N 3.33Å; G100-C103 PolarHBondContact O-N 2.88Å; G100-I104 VanDerWaalsContact O-CG1 3.29Å; G100-I104 WeakPolarHBondContact O-CG1 3.15Å; G100-I104 PolarHBondContact O-N 2.83Å
101G97Very high94Very high39 Ų3933.9 Ų33.940%0.40219%0.192SC..Hα-helixtrans-60.9-45.8178.900000112.8A97 C103 W105A97-G101 PolarHBondContact O-N 3.48Å; G101-C103 PolarHBondContact O-N 3.37Å; G101-W105 PolarHBondContact O-N 2.94Å; G101-W105 VanDerWaalsContact O-N 3.12Å
102S96.8Very high93.5Very high1 Ų140.1 Ų40.11%0.00722%0.22CC..Hα-helixtrans-66.2-37177-169.30000112.5A98 G100 L106 S121 I122A98-S102 WeakPolarHBondContact O-CB 3.44Å; A98-S102 PolarHBondContact O-N 2.88Å; G100-S102 PolarHBondContact O-N 3.33Å; S102-L106 VanDerWaalsContact O-CB 3.3Å; S102-L106 WeakPolarHBondContact O-CB 3.25Å; S102-L106 PolarHBondContact O-N 3.33Å; S102-S121 WeakPolarHBondContact OG-CB 3.37Å; S102-I122 PolarHBondContact OG-N 2.92Å
103C96.8Very high92.6Very high9 Ų949.9 Ų49.96%0.06126%0.257CS..Hα-helixtrans-66.5-49.3178.2-172.90000111.7I17 L21 L99 G100 G101 W105 L106 L107I17-C103 HydrophobicContact CG2-CB 3.78Å; L21-C103 HydrophobicContact CB-CB 4.04Å; L21-C103 HydrophobicContact CD1-CB 4.48Å; L99-C103 WeakPolarHBondContact O-CB 3.16Å; L99-C103 PolarHBondContact O-N 3.32Å; G100-C103 PolarHBondContact O-N 2.88Å; G101-C103 PolarHBondContact O-N 3.37Å; C103-W105 PolarHBondContact O-N 2.87Å; C103-L106 PolarHBondContact O-N 3.39Å; C103-L107 WeakPolarHBondContact O-CB 3.3Å; C103-L107 VanDerWaalsContact O-CG 3.28Å; C103-L107 WeakPolarHBondContact O-CG 3.45Å; C103-L107 PolarHBondContact O-N 2.99Å
104I95.8Very high91.8Very high115 Ų11552.4 Ų52.459%0.5926%0.264SS*.Hα-helixtrans-58.2-49.4177.8-68.5164.1000110.3G100 L106 L107 V108G100-I104 VanDerWaalsContact O-CG1 3.29Å; G100-I104 WeakPolarHBondContact O-CG1 3.15Å; G100-I104 PolarHBondContact O-N 2.83Å; I104-L106 PolarHBondContact O-N 2.85Å; I104-L107 PolarHBondContact O-N 3.48Å; I104-V108 HydrophobicContact CG2-CG2 4.47Å; I104-V108 WeakPolarHBondContact O-CB 3.25Å; I104-V108 VanDerWaalsContact O-CG2 3.27Å; I104-V108 WeakPolarHBondContact O-CG2 3.49Å; I104-V108 PolarHBondContact O-N 3.37Å
105W94.7Very high90.9Very high141 Ų14157.1 Ų57.153%0.53429%0.294SS..Hα-helixtrans-61.8-45.6-179.8178.9-111.9000112.6G101 C103 L107 V108 A109G101-W105 PolarHBondContact O-N 2.94Å; G101-W105 VanDerWaalsContact O-N 3.12Å; C103-W105 PolarHBondContact O-N 2.87Å; W105-L107 PolarHBondContact O-N 3.32Å; W105-V108 PolarHBondContact O-N 3Å; W105-A109 WeakPolarHBondContact O-CB 3.46Å; W105-A109 PolarHBondContact O-N 3.34Å
106L91.2Very high90.5Very high1 Ų158.1 Ų58.11%0.00530%0.301CS..Hα-helixtrans-65.9-39-179.8-173.263.7000112.4L21 I25 N28 S102 C103 I104 T110 V116L21-L106 HydrophobicContact CD1-CB 4.38Å; L21-L106 HydrophobicContact CD1-CD2 3.72Å; I25-L106 HydrophobicContact CB-CD2 4.34Å; I25-L106 HydrophobicContact CG1-CD2 3.49Å; I25-L106 VanDerWaalsContact CG1-CD2 3.49Å; N28-L106 HydrophobicContact CB-CD1 4.31Å; S102-L106 VanDerWaalsContact O-CB 3.3Å; S102-L106 WeakPolarHBondContact O-CB 3.25Å; S102-L106 PolarHBondContact O-N 3.33Å; C103-L106 PolarHBondContact O-N 3.39Å; I104-L106 PolarHBondContact O-N 2.85Å; L106-T110 VanDerWaalsContact O-CB 3.26Å; L106-T110 WeakPolarHBondContact O-CB 3.15Å; L106-T110 PolarHBondContact O-N 3.19Å; L106-T110 PolarHBondContact O-OG1 3.31Å; L106-V116 HydrophobicContact CD1-CG2 3.65Å
107L90.4Very high90.1Very high53 Ų5359.5 Ų59.528%0.27731%0.311SS..Hα-helixtrans-66.2-42.4175.7-71.3176000112I20 C103 I104 W105 T110 F111I20-L107 HydrophobicContact CG2-CD1 3.82Å; I20-L107 HydrophobicContact CG2-CD2 4.42Å; C103-L107 WeakPolarHBondContact O-CB 3.3Å; C103-L107 VanDerWaalsContact O-CG 3.28Å; C103-L107 WeakPolarHBondContact O-CG 3.45Å; C103-L107 PolarHBondContact O-N 2.99Å; I104-L107 PolarHBondContact O-N 3.48Å; W105-L107 PolarHBondContact O-N 3.32Å; L107-T110 PolarHBondContact O-N 2.84Å; L107-F111 WeakPolarHBondContact O-CB 3.35Å; L107-F111 PolarHBondContact O-N 3.09Å
108V90.9Very high89.8Confident63 Ų6356.9 Ų56.938%0.38229%0.289SS..Hα-helixtrans-62.6-47.8175.9168.90000110.7I104 W105 T110 F111 F112I104-V108 HydrophobicContact CG2-CG2 4.47Å; I104-V108 WeakPolarHBondContact O-CB 3.25Å; I104-V108 VanDerWaalsContact O-CG2 3.27Å; I104-V108 WeakPolarHBondContact O-CG2 3.49Å; I104-V108 PolarHBondContact O-N 3.37Å; W105-V108 PolarHBondContact O-N 3Å; V108-T110 PolarHBondContact O-N 2.92Å; V108-F111 WeakPolarHBondContact O-CB 3.43Å; V108-F111 PolarHBondContact O-N 3.05Å; V108-F112 HydrophobicContact CG1-CD2 3.91Å; V108-F112 HydrophobicContact CG1-CE2 3.93Å; V108-F112 VanDerWaalsContact O-CD2 3.25Å; V108-F112 WeakPolarHBondContact O-CD2 3.45Å; V108-F112 PolarHBondContact O-N 3.09Å
109A86.6Confident89.5Confident2 Ų258.3 Ų58.32%0.01730%0.298CS..Hα-helixtrans-60.3-43.9176.100000112.2W105 F111 F112 R113 L114 V116W105-A109 WeakPolarHBondContact O-CB 3.46Å; W105-A109 PolarHBondContact O-N 3.34Å; A109-F111 VanDerWaalsContact C-N 3.34Å; A109-F111 PolarHBondContact O-N 3Å; A109-F112 CarbonylContact O-C 3.41Å; A109-F112 PolarHBondContact O-N 2.85Å; A109-R113 PolarHBondContact O-N 2.89Å; A109-L114 HydrophobicContact CB-CB 4.32Å; A109-L114 PolarHBondContact O-N 3.26Å; A109-V116 HydrophobicContact CB-CB 4.17Å; A109-V116 HydrophobicContact CB-CG1 3.68Å; A109-V116 HydrophobicContact CB-CG2 3.36Å
110T82.2Confident89.3Confident4 Ų462.5 Ų62.53%0.02532%0.317CS..Hα-helixtrans-66.1-34.9178.3-55.10000112.2A27 N28 L106 L107 V108 R113 W490A27-T110 HydrophobicContact CB-CG2 4.24Å; N28-T110 PolarHBondContact ND2-OG1 2.86Å; L106-T110 VanDerWaalsContact O-CB 3.26Å; L106-T110 WeakPolarHBondContact O-CB 3.15Å; L106-T110 PolarHBondContact O-N 3.19Å; L106-T110 PolarHBondContact O-OG1 3.31Å; L107-T110 PolarHBondContact O-N 2.84Å; V108-T110 PolarHBondContact O-N 2.92Å; T110-R113 PolarHBondContact O-N 3.24Å; T110-R113 VanDerWaalsContact O-N 3.13Å; T110-W490 HydrophobicContact CG2-CD2 4.05Å; T110-W490 HydrophobicContact CG2-CE3 4.25Å; T110-W490 HydrophobicContact CG2-CH2 4.02Å; T110-W490 HydrophobicContact CG2-CZ2 3.8Å; T110-W490 HydrophobicContact CG2-CZ3 4.23Å
111F84.7Confident89.2Confident144 Ų14462.7 Ų62.763%0.63232%0.317SS*.Hα-helixtrans-61.7-45.5171.3-178.8-94.5000112.1L107 V108 A109 R113 W490L107-F111 WeakPolarHBondContact O-CB 3.35Å; L107-F111 PolarHBondContact O-N 3.09Å; V108-F111 WeakPolarHBondContact O-CB 3.43Å; V108-F111 PolarHBondContact O-N 3.05Å; A109-F111 VanDerWaalsContact C-N 3.34Å; A109-F111 PolarHBondContact O-N 3Å; F111-R113 PolarHBondContact O-N 2.87Å; F111-W490 HydrophobicContact CB-CH2 4.4Å
112F84.6Confident89.2Confident133 Ų13360.9 Ų60.958%0.58330%0.298SS*.THydrogen-bonded Turntrans-77.54.9173.7-70.1-65.5000114.4V108 A109 L114V108-F112 HydrophobicContact CG1-CD2 3.91Å; V108-F112 HydrophobicContact CG1-CE2 3.93Å; V108-F112 VanDerWaalsContact O-CD2 3.25Å; V108-F112 WeakPolarHBondContact O-CD2 3.45Å; V108-F112 PolarHBondContact O-N 3.09Å; A109-F112 CarbonylContact O-C 3.41Å; A109-F112 PolarHBondContact O-N 2.85Å; F112-L114 HydrophobicContact CB-CD1 4.16Å; F112-L114 HydrophobicContact CB-CG 4.03Å; F112-L114 PolarHBondContact O-N 3.49Å
113R76.9Confident89.1Confident205 Ų20560.9 Ų60.977%0.77430%0.298SS*.THydrogen-bonded Turntrans58.328.4-178.8-48.1-180-171.9175.73113.9A109 T110 F111A109-R113 PolarHBondContact O-N 2.89Å; T110-R113 PolarHBondContact O-N 3.24Å; T110-R113 VanDerWaalsContact O-N 3.13Å; F111-R113 PolarHBondContact O-N 2.87Å
114L79.9Confident89Confident93 Ų9362.4 Ų62.449%0.48732%0.315SS..  trans-86.7122.3176.4-59.9177.6000109.4N28 A109 F112 V116N28-L114 PolarHBondContact ND2-O 3.31Å; A109-L114 HydrophobicContact CB-CB 4.32Å; A109-L114 PolarHBondContact O-N 3.26Å; F112-L114 HydrophobicContact CB-CD1 4.16Å; F112-L114 HydrophobicContact CB-CG 4.03Å; F112-L114 PolarHBondContact O-N 3.49Å; L114-V116 HydrophobicContact CB-CG1 4.22Å; L114-V116 PolarHBondContact O-N 3.46Å
115P77Confident89.1Confident102 Ų10258 Ų5866%0.66230%0.296SS*.  trans-70.2119168.928.9-31.7000108.5N28N28-P115 WeakPolarHBondContact OD1-CA 3.36Å
116V85.9Confident89.1Confident30 Ų3051.5 Ų51.518%0.18227%0.272CS..  trans-135.2146.8-179.5-60.90000110.1N28 L106 A109 L114 G118N28-V116 PolarHBondContact OD1-N 2.88Å; L106-V116 HydrophobicContact CD1-CG2 3.65Å; A109-V116 HydrophobicContact CB-CB 4.17Å; A109-V116 HydrophobicContact CB-CG1 3.68Å; A109-V116 HydrophobicContact CB-CG2 3.36Å; L114-V116 HydrophobicContact CB-CG1 4.22Å; L114-V116 PolarHBondContact O-N 3.46Å; V116-G118 PolarHBondContact O-N 3.41Å
117S90.4Very high89.3Confident46 Ų4653.6 Ų53.632%0.32228%0.282SS..  trans-78.4116.9-178.8178.60000111.8T119 H120 S121S117-T119 PolarHBondContact O-N 2.79Å; S117-T119 PolarHBondContact OG-N 3.21Å; S117-H120 WeakPolarHBondContact CB-ND1 3.38Å; S117-H120 PolarHBondContact O-N 3.24Å; S117-H120 PolarHBondContact OG-N 2.96Å; S117-H120 PolarHBondContact OG-ND1 3.09Å; S117-S121 PolarHBondContact O-N 3.46Å; S117-S121 PolarHBondContact O-OG 3.32Å
118G90.1Very high89.5Confident0 Ų052.6 Ų52.60%029%0.285CS..Hα-helixtrans-55.6-38.6168.900000112.4V116 S121 I122V116-G118 PolarHBondContact O-N 3.41Å; G118-S121 WeakPolarHBondContact O-CB 3.42Å; G118-S121 PolarHBondContact O-N 2.86Å; G118-S121 VanDerWaalsContact O-N 3.16Å; G118-I122 PolarHBondContact O-N 3.17Å
119T92.6Very high89.7Confident30 Ų3050.6 Ų50.618%0.18427%0.271CS..Hα-helixtrans-63.9-43.9-179.7-45.30000113.1S117 S121 V123 N448S117-T119 PolarHBondContact O-N 2.79Å; S117-T119 PolarHBondContact OG-N 3.21Å; T119-S121 VanDerWaalsContact C-N 3.29Å; T119-S121 PolarHBondContact O-N 2.91Å; T119-V123 WeakPolarHBondContact O-CB 3.34Å; T119-V123 WeakPolarHBondContact O-CG2 3.3Å; T119-V123 PolarHBondContact O-N 3.42Å; T119-V123 VanDerWaalsContact O-N 3.15Å; T119-N448 WeakPolarHBondContact CA-OD1 3.41Å; T119-N448 PolarHBondContact N-ND2 2.96Å; T119-N448 VanDerWaalsContact N-ND2 3.17Å; T119-N448 PolarHBondContact OG1-ND2 3.47Å; T119-N448 PolarHBondContact OG1-OD1 2.95Å
120H93.8Very high89.9Confident88 Ų8850.5 Ų50.541%0.40727%0.27SS..Hα-helixtrans-64.7-38.5174.2-69.477.3000111.1S117 G124 W151S117-H120 WeakPolarHBondContact CB-ND1 3.38Å; S117-H120 PolarHBondContact O-N 3.24Å; S117-H120 PolarHBondContact OG-N 2.96Å; S117-H120 PolarHBondContact OG-ND1 3.09Å; H120-G124 PolarHBondContact O-N 3.13Å; H120-W151 HydrophobicContact CB-CH2 4.33Å; H120-W151 HydrophobicContact CB-CZ2 4.46Å; H120-W151 AromaticContact CD2-CD2 3.73Å; H120-W151 AromaticContact CD2-CE2 3.97Å; H120-W151 AromaticContact CD2-CE3 3.41Å; H120-W151 VanDerWaalsContact CD2-CE3 3.41Å; H120-W151 AromaticContact CD2-CH2 3.61Å; H120-W151 AromaticContact CD2-CZ2 3.91Å; H120-W151 AromaticContact CD2-CZ3 3.36Å; H120-W151 WeakPolarHBondContact CD2-CZ3 2.98Å; H120-W151 AromaticContact CE1-CD2 3.78Å; H120-W151 AromaticContact CE1-CE2 4Å; H120-W151 AromaticContact CE1-CG 3.9Å; H120-W151 AromaticContact CG-CH2 3.99Å; H120-W151 AromaticContact CG-CZ2 3.99Å; H120-W151 AromaticContact NE2-CD2 3.32Å; H120-W151 VanDerWaalsContact NE2-CD2 3.32Å; H120-W151 AromaticContact NE2-CE2 3.86Å; H120-W151 AromaticContact NE2-CE3 3.29Å; H120-W151 VanDerWaalsContact NE2-CE3 3.29Å; H120-W151 AromaticContact NE2-CG 3.73Å; H120-W151 AromaticContact NE2-CZ3 3.79Å
121S94.9Very high90.6Very high18 Ų1853.4 Ų53.413%0.12629%0.285CS..Hα-helixtrans-64.3-49.4-178.2-52.40000112.1S102 S117 G118 T119 G124 A125S102-S121 WeakPolarHBondContact OG-CB 3.37Å; S117-S121 PolarHBondContact O-N 3.46Å; S117-S121 PolarHBondContact O-OG 3.32Å; G118-S121 WeakPolarHBondContact O-CB 3.42Å; G118-S121 PolarHBondContact O-N 2.86Å; G118-S121 VanDerWaalsContact O-N 3.16Å; T119-S121 VanDerWaalsContact C-N 3.29Å; T119-S121 PolarHBondContact O-N 2.91Å; S121-G124 PolarHBondContact O-N 3.4Å; S121-A125 WeakPolarHBondContact O-CB 3.49Å; S121-A125 PolarHBondContact O-N 2.87Å
122I96.1Very high91.1Very high0 Ų052.7 Ų52.70%029%0.292CS..Hα-helixtrans-70.9-36.6179.5-167.861.8000112.1I71 A98 S102 G118 A125 T126 N448 P452I71-I122 HydrophobicContact CD1-CG2 4.34Å; I71-I122 HydrophobicContact CG2-CG1 4.34Å; A98-I122 HydrophobicContact CB-CD1 4.03Å; A98-I122 WeakPolarHBondContact O-CD1 3.44Å; S102-I122 PolarHBondContact OG-N 2.92Å; G118-I122 PolarHBondContact O-N 3.17Å; I122-A125 PolarHBondContact O-N 3.11Å; I122-T126 WeakPolarHBondContact O-CB 3.41Å; I122-T126 PolarHBondContact O-N 3.44Å; I122-T126 PolarHBondContact O-OG1 3.25Å; I122-N448 HydrophobicContact CB-CB 4.46Å; I122-N448 WeakPolarHBondContact CG1-O 3.48Å; I122-N448 HydrophobicContact CG2-CB 3.9Å; I122-N448 WeakPolarHBondContact CG2-OD1 3.38Å; I122-P452 HydrophobicContact CD1-CG 3.7Å; I122-P452 HydrophobicContact CG1-CG 3.8Å
123V95.5Very high91.5Very high1 Ų148.7 Ų48.71%0.00628%0.277CS..Hα-helixtrans-63.5-46.2176.8169.80000109.9I71 I75 T119 T126 M127 L144 I147 W151I71-V123 HydrophobicContact CD1-CG2 3.99Å; I75-V123 HydrophobicContact CD1-CB 4.23Å; I75-V123 HydrophobicContact CD1-CG1 4.27Å; I75-V123 HydrophobicContact CD1-CG2 3.73Å; T119-V123 WeakPolarHBondContact O-CB 3.34Å; T119-V123 WeakPolarHBondContact O-CG2 3.3Å; T119-V123 PolarHBondContact O-N 3.42Å; T119-V123 VanDerWaalsContact O-N 3.15Å; V123-T126 PolarHBondContact O-N 2.93Å; V123-M127 HydrophobicContact CG1-SD 4.29Å; V123-M127 VanDerWaalsContact O-CG 3.31Å; V123-M127 WeakPolarHBondContact O-CG 3.47Å; V123-M127 PolarHBondContact O-N 2.87Å; V123-L144 HydrophobicContact CG1-CD1 4.07Å; V123-I147 HydrophobicContact CG2-CG2 4.29Å; V123-W151 HydrophobicContact CB-CH2 4.05Å; V123-W151 HydrophobicContact CB-CZ2 4.02Å; V123-W151 HydrophobicContact CG1-CH2 3.82Å; V123-W151 HydrophobicContact CG1-CZ2 4.08Å; V123-W151 HydrophobicContact CG2-CZ2 4.01Å
124G95.7Very high92.3Very high41 Ų4140.8 Ų40.842%0.42325%0.248SC..Hα-helixtrans-61-44.5174.400000113.3H120 S121 T126 M127 G128H120-G124 PolarHBondContact O-N 3.13Å; S121-G124 PolarHBondContact O-N 3.4Å; G124-T126 VanDerWaalsContact C-N 3.35Å; G124-T126 PolarHBondContact O-N 3.47Å; G124-M127 PolarHBondContact O-N 2.87Å; G124-G128 PolarHBondContact O-N 3.31Å
125A96.4Very high92.9Very high24 Ų2437.8 Ų37.820%0.19824%0.24CC..Hα-helixtrans-66.3-36.6177.700000112.6A98 S121 I122 G128 F129A98-A125 HydrophobicContact CB-CB 4.35Å; A98-A125 WeakPolarHBondContact O-CB 3.37Å; S121-A125 WeakPolarHBondContact O-CB 3.49Å; S121-A125 PolarHBondContact O-N 2.87Å; I122-A125 PolarHBondContact O-N 3.11Å; A125-G128 PolarHBondContact O-N 2.85Å; A125-F129 PolarHBondContact O-N 3.45Å
126T95Very high93.7Very high4 Ų438.5 Ų38.53%0.02524%0.237CC..Hα-helixtrans-67-43.5175.6-610000111.6I75 V76 I122 V123 G124 G128 F129 S130I75-T126 HydrophobicContact CB-CG2 3.96Å; I75-T126 HydrophobicContact CD1-CG2 3.95Å; I75-T126 HydrophobicContact CG2-CG2 3.83Å; V76-T126 HydrophobicContact CG2-CG2 3.71Å; I122-T126 WeakPolarHBondContact O-CB 3.41Å; I122-T126 PolarHBondContact O-N 3.44Å; I122-T126 PolarHBondContact O-OG1 3.25Å; V123-T126 PolarHBondContact O-N 2.93Å; G124-T126 VanDerWaalsContact C-N 3.35Å; G124-T126 PolarHBondContact O-N 3.47Å; T126-G128 VanDerWaalsContact C-N 3.33Å; T126-F129 HydrophobicContact CG2-CE1 3.93Å; T126-F129 HydrophobicContact CG2-CZ 4.48Å; T126-F129 VanDerWaalsContact O-CD1 3.23Å; T126-F129 WeakPolarHBondContact O-CD1 3.35Å; T126-F129 WeakPolarHBondContact O-CE1 3.12Å; T126-S130 PolarHBondContact O-OG 3.46Å
127M94.6Very high93.9Very high44 Ų4443.3 Ų43.322%0.21726%0.262CS..Hα-helixtrans-60.2-45.9170.1-70.2177.563.400110.7I75 V123 G124 F129 S130 L131 I139 L144I75-M127 HydrophobicContact CG2-CG 3.61Å; V123-M127 HydrophobicContact CG1-SD 4.29Å; V123-M127 VanDerWaalsContact O-CG 3.31Å; V123-M127 WeakPolarHBondContact O-CG 3.47Å; V123-M127 PolarHBondContact O-N 2.87Å; G124-M127 PolarHBondContact O-N 2.87Å; M127-F129 PolarHBondContact O-N 3.03Å; M127-S130 PolarHBondContact O-N 2.86Å; M127-S130 VanDerWaalsContact O-N 3.1Å; M127-S130 PolarHBondContact O-OG 2.9Å; M127-L131 VanDerWaalsContact O-CG 3.31Å; M127-L131 WeakPolarHBondContact O-CG 3.35Å; M127-L131 PolarHBondContact O-N 3.37Å; M127-I139 HydrophobicContact CB-CD1 4.13Å; M127-I139 HydrophobicContact CE-CD1 4.29Å; M127-I139 HydrophobicContact CG-CD1 3.99Å; M127-L144 HydrophobicContact CE-CD2 3.61Å; M127-L144 HydrophobicContact SD-CD1 3.67Å; M127-L144 HydrophobicContact SD-CD2 3.79Å; M127-L144 HydrophobicContact SD-CG 4.41Å
128G95.4Very high93.8Very high32 Ų3241.1 Ų41.133%0.3325%0.247SC..Hα-helixtrans-51.3-54.7-176.600000114G124 A125 T126 S130 L131 V132G124-G128 PolarHBondContact O-N 3.31Å; A125-G128 PolarHBondContact O-N 2.85Å; T126-G128 VanDerWaalsContact C-N 3.33Å; G128-S130 VanDerWaalsContact C-N 3.31Å; G128-S130 PolarHBondContact O-N 3.38Å; G128-L131 PolarHBondContact O-N 3.38Å; G128-V132 WeakPolarHBondContact O-CG2 3.2Å; G128-V132 PolarHBondContact O-N 2.96Å
129F94.3Very high93.9Very high21 Ų2141.4 Ų41.49%0.09225%0.248CC..Hα-helixtrans-65-36.7179.382-102.6000112.1V76 F81 L91 G94 A98 A125 T126 M127 V132 I133V76-F129 HydrophobicContact CG2-CZ 4.4Å; F81-F129 HydrophobicContact CZ-CD2 4.47Å; F81-F129 AromaticContact CZ-CE2 3.88Å; F81-F129 HydrophobicContact CZ-CE2 3.88Å; L91-F129 HydrophobicContact CD1-CE2 3.95Å; L91-F129 HydrophobicContact CD1-CZ 4.05Å; G94-F129 VanDerWaalsContact CA-CD2 3.47Å; G94-F129 WeakPolarHBondContact O-CD1 3.36Å; G94-F129 WeakPolarHBondContact O-CE1 3.39Å; A98-F129 HydrophobicContact CB-CD1 3.95Å; A98-F129 HydrophobicContact CB-CE1 4Å; A125-F129 PolarHBondContact O-N 3.45Å; T126-F129 HydrophobicContact CG2-CE1 3.93Å; T126-F129 HydrophobicContact CG2-CZ 4.48Å; T126-F129 VanDerWaalsContact O-CD1 3.23Å; T126-F129 WeakPolarHBondContact O-CD1 3.35Å; T126-F129 WeakPolarHBondContact O-CE1 3.12Å; M127-F129 PolarHBondContact O-N 3.03Å; F129-V132 PolarHBondContact O-N 3.47Å; F129-I133 HydrophobicContact CD2-CD1 4.03Å; F129-I133 WeakPolarHBondContact O-CD1 3.22Å; F129-I133 WeakPolarHBondContact O-CG1 3.28Å; F129-I133 PolarHBondContact O-N 3.41Å
130S92.8Very high93.8Very high0 Ų043.1 Ų43.10%025%0.254CS..Hα-helixtrans-68.8-37.6-177.876.60000112.4T126 M127 G128 V132 I133 F134 A138 I139T126-S130 PolarHBondContact O-OG 3.46Å; M127-S130 PolarHBondContact O-N 2.86Å; M127-S130 VanDerWaalsContact O-N 3.1Å; M127-S130 PolarHBondContact O-OG 2.9Å; G128-S130 VanDerWaalsContact C-N 3.31Å; G128-S130 PolarHBondContact O-N 3.38Å; S130-V132 VanDerWaalsContact C-N 3.34Å; S130-V132 PolarHBondContact O-N 2.9Å; S130-I133 PolarHBondContact O-N 3.43Å; S130-F134 PolarHBondContact O-N 2.68Å; S130-A138 VanDerWaalsContact O-CB 3.23Å; S130-A138 WeakPolarHBondContact O-CB 3.24Å; S130-I139 WeakPolarHBondContact OG-CD1 3.21Å
131L95.3Very high93.8Very high65 Ų6545.2 Ų45.234%0.3426%0.258SS..Hα-helixtrans-65-35.5174.9-70.6172000112.1M127 G128 I133 G135 L136 I139M127-L131 VanDerWaalsContact O-CG 3.31Å; M127-L131 WeakPolarHBondContact O-CG 3.35Å; M127-L131 PolarHBondContact O-N 3.37Å; G128-L131 PolarHBondContact O-N 3.38Å; L131-I133 VanDerWaalsContact C-N 3.28Å; L131-I133 PolarHBondContact O-N 3.43Å; L131-G135 WeakPolarHBondContact O-CA 3.33Å; L131-G135 PolarHBondContact O-N 3.17Å; L131-L136 HydrophobicContact CD2-CD2 3.94Å; L131-I139 HydrophobicContact CD2-CD1 4.08Å; L131-I139 HydrophobicContact CD2-CG1 3.83Å; L131-I139 HydrophobicContact CG-CD1 4.19Å; L131-I139 HydrophobicContact CG-CG1 4.49Å
132V95.4Very high93.7Very high129 Ų12952.8 Ų52.878%0.78229%0.289SS*.Hα-helixtrans-65.8-31.6176.2170.90000112G128 F129 S130G128-V132 WeakPolarHBondContact O-CG2 3.2Å; G128-V132 PolarHBondContact O-N 2.96Å; F129-V132 PolarHBondContact O-N 3.47Å; S130-V132 VanDerWaalsContact C-N 3.34Å; S130-V132 PolarHBondContact O-N 2.9Å
133I92.5Very high93.5Very high49 Ų4953.4 Ų53.425%0.25130%0.295SS..Hα-helixtrans-91.2-46.7-174.3-59.3162.6000112.2F81 I84 L90 F129 S130 L131F81-I133 HydrophobicContact CE1-CD1 3.73Å; F81-I133 HydrophobicContact CZ-CD1 3.93Å; I84-I133 HydrophobicContact CD1-CG2 4.1Å; L90-I133 HydrophobicContact CD1-CD1 4.16Å; L90-I133 HydrophobicContact CD2-CD1 3.98Å; L90-I133 HydrophobicContact CD2-CG1 4.2Å; L90-I133 HydrophobicContact CD2-CG2 3.65Å; L90-I133 HydrophobicContact CG-CD1 3.81Å; L90-I133 HydrophobicContact CG-CG1 4.45Å; F129-I133 HydrophobicContact CD2-CD1 4.03Å; F129-I133 WeakPolarHBondContact O-CD1 3.22Å; F129-I133 WeakPolarHBondContact O-CG1 3.28Å; F129-I133 PolarHBondContact O-N 3.41Å; S130-I133 PolarHBondContact O-N 3.43Å; L131-I133 VanDerWaalsContact C-N 3.28Å; L131-I133 PolarHBondContact O-N 3.43Å
134F93.8Very high93.4Very high40 Ų4054 Ų5418%0.17530%0.298CS..Hα-helixtrans-123.44.4-172.9-61.7-81.1000114.1L80 F81 I84 S130 A138L80-F134 VanDerWaalsContact C-CZ 3.47Å; L80-F134 HydrophobicContact CB-CD1 4.18Å; L80-F134 HydrophobicContact CB-CD2 4.26Å; L80-F134 HydrophobicContact CB-CE1 3.86Å; L80-F134 HydrophobicContact CB-CE2 3.96Å; L80-F134 HydrophobicContact CB-CG 4.37Å; L80-F134 HydrophobicContact CB-CZ 3.75Å; L80-F134 HydrophobicContact CD1-CB 4.46Å; L80-F134 HydrophobicContact CD1-CG 4.33Å; L80-F134 VanDerWaalsContact O-CZ 3.23Å; L80-F134 WeakPolarHBondContact O-CZ 3.19Å; F81-F134 AromaticContact CD1-CE2 3.96Å; F81-F134 HydrophobicContact CD1-CE2 3.96Å; F81-F134 HydrophobicContact CD1-CZ 4.46Å; F81-F134 AromaticContact CD2-CE2 3.74Å; F81-F134 HydrophobicContact CD2-CE2 3.74Å; F81-F134 HydrophobicContact CD2-CZ 4.44Å; F81-F134 AromaticContact CE1-CE2 3.88Å; F81-F134 HydrophobicContact CE1-CE2 3.88Å; F81-F134 HydrophobicContact CE2-CD2 4.13Å; F81-F134 AromaticContact CE2-CE2 3.6Å; F81-F134 HydrophobicContact CE2-CE2 3.6Å; F81-F134 AromaticContact CG-CE2 3.91Å; F81-F134 HydrophobicContact CG-CE2 3.91Å; F81-F134 HydrophobicContact CG-CZ 4.32Å; F81-F134 HydrophobicContact CZ-CD2 4.19Å; F81-F134 AromaticContact CZ-CE2 3.68Å; F81-F134 HydrophobicContact CZ-CE2 3.68Å; I84-F134 HydrophobicContact CD1-CD1 4.37Å; I84-F134 HydrophobicContact CD1-CE1 3.4Å; I84-F134 VanDerWaalsContact CD1-CE1 3.4Å; I84-F134 HydrophobicContact CD1-CE2 4.3Å; I84-F134 HydrophobicContact CD1-CZ 3.34Å; I84-F134 HydrophobicContact CG1-CE1 3.88Å; I84-F134 HydrophobicContact CG1-CZ 3.89Å; S130-F134 PolarHBondContact O-N 2.68Å; F134-A138 HydrophobicContact CB-CB 3.8Å; F134-A138 HydrophobicContact CD2-CB 4.44Å
135G93.6Very high93.3Very high30 Ų3057.4 Ų57.431%0.30931%0.306SS..G310 helixtrans60.3-151.5-172.600000112.6L131 N137 A138L131-G135 WeakPolarHBondContact O-CA 3.33Å; L131-G135 PolarHBondContact O-N 3.17Å; G135-N137 PolarHBondContact O-N 3.16Å; G135-N137 VanDerWaalsContact O-N 3.09Å; G135-A138 WeakPolarHBondContact O-CB 3.16Å; G135-A138 PolarHBondContact O-N 3.34Å; G135-A138 VanDerWaalsContact O-N 3.09Å
136L93.3Very high93.2Very high117 Ų11764 Ų6461%0.61333%0.33SS*.G310 helixtrans-61.9-18.6-177.8-62.4178.5000114.2L131 A138 I139 W141L131-L136 HydrophobicContact CD2-CD2 3.94Å; L136-A138 PolarHBondContact O-N 2.92Å; L136-I139 PolarHBondContact O-N 3.32Å; L136-W141 HydrophobicContact CD2-CZ2 4.32Å; L136-W141 PolarHBondContact O-NE1 3.2Å
137N89.8Confident93.1Very high131 Ų13164.5 Ų64.570%0.70133%0.332SS*.G310 helixtrans-68.4-24.6177.2-64.3-23.2000112.2L80 G135 I139L80-N137 VanDerWaalsContact CD1-O 3.3Å; L80-N137 WeakPolarHBondContact CD1-O 3.33Å; G135-N137 PolarHBondContact O-N 3.16Å; G135-N137 VanDerWaalsContact O-N 3.09Å; N137-I139 PolarHBondContact O-N 3.17Å
138A88.3Confident93.1Very high0 Ų064.8 Ų64.80%034%0.336CS..G310 helixtrans-62.1-27.9177.800000113.3V76 S77 S130 F134 G135 L136V76-A138 WeakPolarHBondContact CA-O 3.28Å; S77-A138 PolarHBondContact N-O 3.04Å; S77-A138 PolarHBondContact OG-O 3.42Å; S130-A138 VanDerWaalsContact O-CB 3.23Å; S130-A138 WeakPolarHBondContact O-CB 3.24Å; F134-A138 HydrophobicContact CB-CB 3.8Å; F134-A138 HydrophobicContact CD2-CB 4.44Å; G135-A138 WeakPolarHBondContact O-CB 3.16Å; G135-A138 PolarHBondContact O-N 3.34Å; G135-A138 VanDerWaalsContact O-N 3.09Å; L136-A138 PolarHBondContact O-N 2.92Å
139I92.1Very high93.1Very high6 Ų665 Ų653%0.03134%0.338CS..BIsolated β-bridgetrans-84.6124.2-165-57.3-56.4000111.1M127 S130 L131 L136 N137 W141 L144M127-I139 HydrophobicContact CB-CD1 4.13Å; M127-I139 HydrophobicContact CE-CD1 4.29Å; M127-I139 HydrophobicContact CG-CD1 3.99Å; S130-I139 WeakPolarHBondContact OG-CD1 3.21Å; L131-I139 HydrophobicContact CD2-CD1 4.08Å; L131-I139 HydrophobicContact CD2-CG1 3.83Å; L131-I139 HydrophobicContact CG-CD1 4.19Å; L131-I139 HydrophobicContact CG-CG1 4.49Å; L136-I139 PolarHBondContact O-N 3.32Å; N137-I139 PolarHBondContact O-N 3.17Å; I139-W141 VanDerWaalsContact C-N 3.26Å; I139-W141 HydrophobicContact CB-CZ2 4.33Å; I139-W141 HydrophobicContact CG2-CD2 3.96Å; I139-W141 HydrophobicContact CG2-CE3 4.33Å; I139-W141 HydrophobicContact CG2-CG 4.27Å; I139-W141 HydrophobicContact CG2-CZ2 4.29Å; I139-W141 PolarHBondContact O-N 3.41Å; I139-L144 HydrophobicContact CG2-CB 4.34Å; I139-L144 HydrophobicContact CG2-CD2 3.58Å
140Q92Very high93.1Very high66 Ų6666.4 Ų66.431%0.30835%0.351SS..  trans-80.276.3173.3-168.5-178.9-1.500110.1K73 I75 K142 G143 L144K73-Q140 PolarHBondContact O-OE1 3.5Å; I75-Q140 PolarHBondContact O-N 3.5Å; Q140-K142 PolarHBondContact O-N 3.23Å; Q140-G143 WeakPolarHBondContact O-CA 3.27Å; Q140-G143 PolarHBondContact O-N 3.42Å; Q140-L144 PolarHBondContact O-N 3.12Å
141W93.2Very high93.1Very high131 Ų13169.4 Ų69.450%0.49636%0.362SS..Hα-helixtrans-48.5-38.9-174.7-67.898.2000114.5L136 I139 G143 L144 I145L136-W141 HydrophobicContact CD2-CZ2 4.32Å; L136-W141 PolarHBondContact O-NE1 3.2Å; I139-W141 VanDerWaalsContact C-N 3.26Å; I139-W141 HydrophobicContact CB-CZ2 4.33Å; I139-W141 HydrophobicContact CG2-CD2 3.96Å; I139-W141 HydrophobicContact CG2-CE3 4.33Å; I139-W141 HydrophobicContact CG2-CG 4.27Å; I139-W141 HydrophobicContact CG2-CZ2 4.29Å; I139-W141 PolarHBondContact O-N 3.41Å; W141-G143 VanDerWaalsContact C-N 3.3Å; W141-G143 PolarHBondContact O-N 2.86Å; W141-L144 HydrophobicContact CE3-CD2 4.4Å; W141-L144 HydrophobicContact CZ3-CD2 4.35Å; W141-L144 PolarHBondContact O-N 3.14Å; W141-I145 VanDerWaalsContact O-CB 3.29Å; W141-I145 WeakPolarHBondContact O-CB 3.43Å; W141-I145 WeakPolarHBondContact O-CD1 3.34Å; W141-I145 WeakPolarHBondContact O-CG1 3.3Å; W141-I145 PolarHBondContact O-N 3.08Å
142K93Very high93.1Very high178 Ų17874 Ų7477%0.77438%0.38SS*.Hα-helixtrans-64.8-29.4176.6-67.9-175.4-178.7176.10114Q140 K146Q140-K142 PolarHBondContact O-N 3.23Å; K142-K146 WeakPolarHBondContact O-CD 3.28Å; K142-K146 WeakPolarHBondContact O-CG 3.29Å
143G90.9Very high93Very high12 Ų1272 Ų7212%0.12436%0.364CS..Hα-helixtrans-85-46.5175.200000111.1G74 Q140 W141 I145 K146 I147G74-G143 CarbonylContact O-C 3.28Å; G74-G143 VanDerWaalsContact O-C 3.28Å; G74-G143 VanDerWaalsContact O-CA 3.22Å; G74-G143 WeakPolarHBondContact O-CA 3.05Å; Q140-G143 WeakPolarHBondContact O-CA 3.27Å; Q140-G143 PolarHBondContact O-N 3.42Å; W141-G143 VanDerWaalsContact C-N 3.3Å; W141-G143 PolarHBondContact O-N 2.86Å; G143-I145 PolarHBondContact O-N 2.96Å; G143-K146 WeakPolarHBondContact O-CB 3.36Å; G143-K146 PolarHBondContact O-N 3.3Å; G143-I147 WeakPolarHBondContact O-CG1 3.27Å; G143-I147 PolarHBondContact O-N 3.06Å
144L93.3Very high93Very high13 Ų1373 Ų737%0.06838%0.375CS..Hα-helixtrans-57.2-45176.6-177.162.5000112.6G74 V123 M127 I139 Q140 W141 K146 I147 V148G74-L144 PolarHBondContact O-N 3.28Å; V123-L144 HydrophobicContact CG1-CD1 4.07Å; M127-L144 HydrophobicContact CE-CD2 3.61Å; M127-L144 HydrophobicContact SD-CD1 3.67Å; M127-L144 HydrophobicContact SD-CD2 3.79Å; M127-L144 HydrophobicContact SD-CG 4.41Å; I139-L144 HydrophobicContact CG2-CB 4.34Å; I139-L144 HydrophobicContact CG2-CD2 3.58Å; Q140-L144 PolarHBondContact O-N 3.12Å; W141-L144 HydrophobicContact CE3-CD2 4.4Å; W141-L144 HydrophobicContact CZ3-CD2 4.35Å; W141-L144 PolarHBondContact O-N 3.14Å; L144-K146 VanDerWaalsContact C-N 3.27Å; L144-K146 PolarHBondContact O-N 3.11Å; L144-I147 PolarHBondContact O-N 3.37Å; L144-I147 VanDerWaalsContact O-N 3.12Å; L144-V148 HydrophobicContact CD1-CG2 4.03Å; L144-V148 HydrophobicContact CG-CG2 4.25Å; L144-V148 WeakPolarHBondContact O-CG2 3.46Å; L144-V148 PolarHBondContact O-N 2.93Å
145I94.6Very high92.9Very high114 Ų11475.2 Ų75.259%0.58539%0.394SS*.Hα-helixtrans-62.4-33.2177.6-70.5166.6000111.7W141 G143 G149W141-I145 VanDerWaalsContact O-CB 3.29Å; W141-I145 WeakPolarHBondContact O-CB 3.43Å; W141-I145 WeakPolarHBondContact O-CD1 3.34Å; W141-I145 WeakPolarHBondContact O-CG1 3.3Å; W141-I145 PolarHBondContact O-N 3.08Å; G143-I145 PolarHBondContact O-N 2.96Å; I145-G149 WeakPolarHBondContact O-CA 3.46Å; I145-G149 PolarHBondContact O-N 3.09Å
146K93.8Very high93Very high162 Ų16278.8 Ų78.870%0.70441%0.405SS*.Hα-helixtrans-69.5-39.4174.1-70.4174.6-179.1-175.60111.9K142 G143 L144 S150K142-K146 WeakPolarHBondContact O-CD 3.28Å; K142-K146 WeakPolarHBondContact O-CG 3.29Å; G143-K146 WeakPolarHBondContact O-CB 3.36Å; G143-K146 PolarHBondContact O-N 3.3Å; L144-K146 VanDerWaalsContact C-N 3.27Å; L144-K146 PolarHBondContact O-N 3.11Å; K146-S150 WeakPolarHBondContact O-CB 3.47Å; K146-S150 PolarHBondContact O-N 2.87Å
147I93.2Very high93.1Very high15 Ų1577.6 Ų77.68%0.07740%0.399CS..Hα-helixtrans-65.5-53.1176.2-64.7165.8000110T70 I75 V123 G143 L144 G149 S150 W151T70-I147 HydrophobicContact CG2-CD1 4.22Å; T70-I147 HydrophobicContact CG2-CG1 4.29Å; I75-I147 HydrophobicContact CD1-CD1 4.49Å; I75-I147 HydrophobicContact CG1-CD1 3.76Å; V123-I147 HydrophobicContact CG2-CG2 4.29Å; G143-I147 WeakPolarHBondContact O-CG1 3.27Å; G143-I147 PolarHBondContact O-N 3.06Å; L144-I147 PolarHBondContact O-N 3.37Å; L144-I147 VanDerWaalsContact O-N 3.12Å; I147-G149 VanDerWaalsContact C-N 3.34Å; I147-G149 PolarHBondContact O-N 2.81Å; I147-S150 PolarHBondContact O-N 3.44Å; I147-S150 VanDerWaalsContact O-N 3.13Å; I147-S150 PolarHBondContact O-OG 3.14Å; I147-W151 HydrophobicContact CG2-CD2 4.4Å; I147-W151 HydrophobicContact CG2-CH2 4.4Å; I147-W151 HydrophobicContact CG2-CZ2 3.63Å; I147-W151 PolarHBondContact O-N 3.4Å; I147-W151 VanDerWaalsContact O-N 3.12Å
148V94.4Very high93.2Very high50 Ų5075.1 Ų75.130%0.30339%0.392SS..Hα-helixtrans-62.1-41.9178.9175.50000111.1L144 S150 W151 F152L144-V148 HydrophobicContact CD1-CG2 4.03Å; L144-V148 HydrophobicContact CG-CG2 4.25Å; L144-V148 WeakPolarHBondContact O-CG2 3.46Å; L144-V148 PolarHBondContact O-N 2.93Å; V148-S150 VanDerWaalsContact C-N 3.31Å; V148-S150 PolarHBondContact O-N 3.37Å; V148-W151 HydrophobicContact CB-CE3 4.42Å; V148-W151 HydrophobicContact CG2-CE3 4.11Å; V148-W151 HydrophobicContact CG2-CZ3 4.01Å; V148-W151 WeakPolarHBondContact O-CB 3.33Å; V148-W151 PolarHBondContact O-N 3.14Å; V148-F152 HydrophobicContact CG1-CD2 4.34Å; V148-F152 HydrophobicContact CG1-CE2 3.87Å; V148-F152 VanDerWaalsContact O-CD2 3.26Å; V148-F152 WeakPolarHBondContact O-CD2 3.31Å; V148-F152 PolarHBondContact O-N 3.41Å
149G95.3Very high93.4Very high36 Ų3676.4 Ų76.437%0.37141%0.405SS..Hα-helixtrans-60.6-37.5174.700000113.1I145 I147 W151 F152 L153I145-G149 WeakPolarHBondContact O-CA 3.46Å; I145-G149 PolarHBondContact O-N 3.09Å; I147-G149 VanDerWaalsContact C-N 3.34Å; I147-G149 PolarHBondContact O-N 2.81Å; G149-W151 VanDerWaalsContact C-N 3.35Å; G149-F152 PolarHBondContact O-N 3.38Å; G149-L153 VanDerWaalsContact O-CB 3.25Å; G149-L153 WeakPolarHBondContact O-CB 3.26Å; G149-L153 PolarHBondContact O-N 3.12Å
150S93.6Very high93.5Very high50 Ų5080.9 Ų80.935%0.3543%0.429SS..Hα-helixtrans-70.1-29.8176.481.90000112.8K146 I147 V148 F152 L153 S154K146-S150 WeakPolarHBondContact O-CB 3.47Å; K146-S150 PolarHBondContact O-N 2.87Å; I147-S150 PolarHBondContact O-N 3.44Å; I147-S150 VanDerWaalsContact O-N 3.13Å; I147-S150 PolarHBondContact O-OG 3.14Å; V148-S150 VanDerWaalsContact C-N 3.31Å; V148-S150 PolarHBondContact O-N 3.37Å; S150-F152 VanDerWaalsContact C-N 3.34Å; S150-F152 PolarHBondContact O-N 3.49Å; S150-L153 PolarHBondContact O-N 3.24Å; S150-S154 VanDerWaalsContact O-CB 3.26Å; S150-S154 WeakPolarHBondContact O-CB 3.31Å; S150-S154 PolarHBondContact O-N 3.33Å; S150-S154 PolarHBondContact O-OG 2.81Å
151W93.8Very high93.5Very high63 Ų6380.5 Ų80.524%0.23944%0.437CS..Hα-helixtrans-63.5-34.8174.9-62.5-16000113.4H120 V123 I147 V148 G149 P155H120-W151 HydrophobicContact CB-CH2 4.33Å; H120-W151 HydrophobicContact CB-CZ2 4.46Å; H120-W151 AromaticContact CD2-CD2 3.73Å; H120-W151 AromaticContact CD2-CE2 3.97Å; H120-W151 AromaticContact CD2-CE3 3.41Å; H120-W151 VanDerWaalsContact CD2-CE3 3.41Å; H120-W151 AromaticContact CD2-CH2 3.61Å; H120-W151 AromaticContact CD2-CZ2 3.91Å; H120-W151 AromaticContact CD2-CZ3 3.36Å; H120-W151 WeakPolarHBondContact CD2-CZ3 2.98Å; H120-W151 AromaticContact CE1-CD2 3.78Å; H120-W151 AromaticContact CE1-CE2 4Å; H120-W151 AromaticContact CE1-CG 3.9Å; H120-W151 AromaticContact CG-CH2 3.99Å; H120-W151 AromaticContact CG-CZ2 3.99Å; H120-W151 AromaticContact NE2-CD2 3.32Å; H120-W151 VanDerWaalsContact NE2-CD2 3.32Å; H120-W151 AromaticContact NE2-CE2 3.86Å; H120-W151 AromaticContact NE2-CE3 3.29Å; H120-W151 VanDerWaalsContact NE2-CE3 3.29Å; H120-W151 AromaticContact NE2-CG 3.73Å; H120-W151 AromaticContact NE2-CZ3 3.79Å; V123-W151 HydrophobicContact CB-CH2 4.05Å; V123-W151 HydrophobicContact CB-CZ2 4.02Å; V123-W151 HydrophobicContact CG1-CH2 3.82Å; V123-W151 HydrophobicContact CG1-CZ2 4.08Å; V123-W151 HydrophobicContact CG2-CZ2 4.01Å; I147-W151 HydrophobicContact CG2-CD2 4.4Å; I147-W151 HydrophobicContact CG2-CH2 4.4Å; I147-W151 HydrophobicContact CG2-CZ2 3.63Å; I147-W151 PolarHBondContact O-N 3.4Å; I147-W151 VanDerWaalsContact O-N 3.12Å; V148-W151 HydrophobicContact CB-CE3 4.42Å; V148-W151 HydrophobicContact CG2-CE3 4.11Å; V148-W151 HydrophobicContact CG2-CZ3 4.01Å; V148-W151 WeakPolarHBondContact O-CB 3.33Å; V148-W151 PolarHBondContact O-N 3.14Å; G149-W151 VanDerWaalsContact C-N 3.35Å; W151-P155 WeakPolarHBondContact O-CD 3.26Å; W151-P155 VanDerWaalsContact O-CG 3.31Å; W151-P155 WeakPolarHBondContact O-CG 3.39Å
152F94.5Very high93.3Very high162 Ų16277 Ų7771%0.71143%0.432SS*.Hα-helixtrans-82.5-40.4173-66.8-77.3000112.5V148 G149 S150V148-F152 HydrophobicContact CG1-CD2 4.34Å; V148-F152 HydrophobicContact CG1-CE2 3.87Å; V148-F152 VanDerWaalsContact O-CD2 3.26Å; V148-F152 WeakPolarHBondContact O-CD2 3.31Å; V148-F152 PolarHBondContact O-N 3.41Å; G149-F152 PolarHBondContact O-N 3.38Å; S150-F152 VanDerWaalsContact C-N 3.34Å; S150-F152 PolarHBondContact O-N 3.49Å
153L94.8Very high93.3Very high88 Ų8871.9 Ų71.946%0.46141%0.412SS..Hα-helixtrans-71.2-35.1-174.8-173.162000112.5G149 S150 L156 L157G149-L153 VanDerWaalsContact O-CB 3.25Å; G149-L153 WeakPolarHBondContact O-CB 3.26Å; G149-L153 PolarHBondContact O-N 3.12Å; S150-L153 PolarHBondContact O-N 3.24Å; L153-L156 PolarHBondContact O-N 3.43Å; L153-L157 HydrophobicContact CD1-CD1 4.03Å; L153-L157 HydrophobicContact CD1-CD2 4.35Å; L153-L157 HydrophobicContact CD1-CG 3.89Å; L153-L157 HydrophobicContact CD2-CD1 4.19Å; L153-L157 HydrophobicContact CG-CD1 3.71Å; L153-L157 HydrophobicContact CG-CG 4Å; L153-L157 WeakPolarHBondContact O-CB 3.17Å; L153-L157 VanDerWaalsContact O-CG 3.31Å; L153-L157 WeakPolarHBondContact O-CG 3.35Å; L153-L157 PolarHBondContact O-N 2.85Å
154S92.1Very high93.3Very high68 Ų6873.2 Ų73.248%0.47643%0.427SS..Hα-helixtrans-69.4-45.8-174.5-510000113.4S150 L156 S158S150-S154 VanDerWaalsContact O-CB 3.26Å; S150-S154 WeakPolarHBondContact O-CB 3.31Å; S150-S154 PolarHBondContact O-N 3.33Å; S150-S154 PolarHBondContact O-OG 2.81Å; S154-L156 VanDerWaalsContact C-N 3.33Å; S154-L156 PolarHBondContact O-N 2.66Å; S154-S158 WeakPolarHBondContact O-CB 3.36Å; S154-S158 PolarHBondContact O-N 2.97Å
155P92.1Very high93.1Very high88 Ų8875.8 Ų75.857%0.57144%0.443SS*.Hα-helixtrans-62.5-37.7171.7-23.435.3000112.7W151 G159W151-P155 WeakPolarHBondContact O-CD 3.26Å; W151-P155 VanDerWaalsContact O-CG 3.31Å; W151-P155 WeakPolarHBondContact O-CG 3.39Å; P155-G159 PolarHBondContact O-N 2.88Å
156L95.4Very high92.7Very high104 Ų10471 Ų7155%0.54542%0.418SS..Hα-helixtrans-63.6-51.9177.1178.261.8000111.6L153 S154 S158 G159 L160L153-L156 PolarHBondContact O-N 3.43Å; S154-L156 VanDerWaalsContact C-N 3.33Å; S154-L156 PolarHBondContact O-N 2.66Å; L156-S158 VanDerWaalsContact C-N 3.35Å; L156-S158 PolarHBondContact O-N 3.44Å; L156-G159 PolarHBondContact O-N 2.84Å; L156-L160 HydrophobicContact CD1-CD1 4.42Å; L156-L160 HydrophobicContact CG-CD1 4.36Å; L156-L160 WeakPolarHBondContact O-CG 3.18Å; L156-L160 PolarHBondContact O-N 3.45Å
157L94.4Very high92.6Very high93 Ų9368 Ų6849%0.48740%0.404SS..Hα-helixtrans-63.5-39.5177.3-70.1179.9000111.8L153 L160 A161L153-L157 HydrophobicContact CD1-CD1 4.03Å; L153-L157 HydrophobicContact CD1-CD2 4.35Å; L153-L157 HydrophobicContact CD1-CG 3.89Å; L153-L157 HydrophobicContact CD2-CD1 4.19Å; L153-L157 HydrophobicContact CG-CD1 3.71Å; L153-L157 HydrophobicContact CG-CG 4Å; L153-L157 WeakPolarHBondContact O-CB 3.17Å; L153-L157 VanDerWaalsContact O-CG 3.31Å; L153-L157 WeakPolarHBondContact O-CG 3.35Å; L153-L157 PolarHBondContact O-N 2.85Å; L157-L160 PolarHBondContact O-N 3.15Å; L157-A161 VanDerWaalsContact O-CB 3.25Å; L157-A161 WeakPolarHBondContact O-CB 3.35Å; L157-A161 PolarHBondContact O-N 2.8Å
158S91.6Very high92.3Very high79 Ų7970.9 Ų70.955%0.55242%0.42SS*.Hα-helixtrans-62.5-41.1173.5-176.70000111.8S154 L156 A161 S162S154-S158 WeakPolarHBondContact O-CB 3.36Å; S154-S158 PolarHBondContact O-N 2.97Å; L156-S158 VanDerWaalsContact C-N 3.35Å; L156-S158 PolarHBondContact O-N 3.44Å; S158-A161 PolarHBondContact O-N 2.89Å; S158-S162 WeakPolarHBondContact O-CB 3.06Å; S158-S162 PolarHBondContact O-N 3.27Å
159G92.6Very high92Very high27 Ų2768.8 Ų68.828%0.27841%0.407SS..Hα-helixtrans-61.7-46.717400000112.8P155 L156 S162 I163P155-G159 PolarHBondContact O-N 2.88Å; L156-G159 PolarHBondContact O-N 2.84Å; G159-S162 WeakPolarHBondContact O-CB 3.41Å; G159-S162 PolarHBondContact O-N 3.36Å; G159-I163 WeakPolarHBondContact O-CD1 3.22Å; G159-I163 VanDerWaalsContact O-CG1 3.27Å; G159-I163 WeakPolarHBondContact O-CG1 3.15Å; G159-I163 PolarHBondContact O-N 3.31Å
160L95.4Very high91.6Very high100 Ų10069.6 Ų69.652%0.52440%0.399SS..Hα-helixtrans-64.8-44.3176.2-69.1172.8000112L156 L157 I163 G164L156-L160 HydrophobicContact CD1-CD1 4.42Å; L156-L160 HydrophobicContact CG-CD1 4.36Å; L156-L160 WeakPolarHBondContact O-CG 3.18Å; L156-L160 PolarHBondContact O-N 3.45Å; L157-L160 PolarHBondContact O-N 3.15Å; L160-I163 PolarHBondContact O-N 2.87Å; L160-G164 PolarHBondContact O-N 3.42Å
161A90.6Very high91.4Very high58 Ų5874 Ų7448%0.47941%0.412SS..Hα-helixtrans-63.1-42.5175.500000111.8L157 S158 I163 G164 V165L157-A161 VanDerWaalsContact O-CB 3.25Å; L157-A161 WeakPolarHBondContact O-CB 3.35Å; L157-A161 PolarHBondContact O-N 2.8Å; S158-A161 PolarHBondContact O-N 2.89Å; A161-I163 VanDerWaalsContact C-N 3.32Å; A161-I163 PolarHBondContact O-N 3.14Å; A161-G164 PolarHBondContact O-N 3.43Å; A161-V165 WeakPolarHBondContact O-CB 3.42Å; A161-V165 WeakPolarHBondContact O-CG2 3.35Å; A161-V165 PolarHBondContact O-N 3.35Å
162S89.2Confident91.1Very high56 Ų5674.7 Ų74.739%0.39242%0.419SS..Hα-helixtrans-57.8-43.6172.7173.40000111.5S158 G159 F166 K514S158-S162 WeakPolarHBondContact O-CB 3.06Å; S158-S162 PolarHBondContact O-N 3.27Å; G159-S162 WeakPolarHBondContact O-CB 3.41Å; G159-S162 PolarHBondContact O-N 3.36Å; S162-F166 WeakPolarHBondContact O-CB 3.29Å; S162-F166 PolarHBondContact O-N 2.87Å; S162-K514 PolarHBondContact OG-NZ 3.48Å
163I93.1Very high90.8Very high71 Ų7167 Ų6736%0.36439%0.385SS..Hα-helixtrans-65.3-44.5175.8-71.6162.6000111G159 L160 A161 F166 F167G159-I163 WeakPolarHBondContact O-CD1 3.22Å; G159-I163 VanDerWaalsContact O-CG1 3.27Å; G159-I163 WeakPolarHBondContact O-CG1 3.15Å; G159-I163 PolarHBondContact O-N 3.31Å; L160-I163 PolarHBondContact O-N 2.87Å; A161-I163 VanDerWaalsContact C-N 3.32Å; A161-I163 PolarHBondContact O-N 3.14Å; I163-F166 WeakPolarHBondContact O-CB 3.37Å; I163-F166 PolarHBondContact O-N 3.45Å; I163-F167 HydrophobicContact CG2-CD2 3.63Å; I163-F167 HydrophobicContact CG2-CE2 3.64Å; I163-F167 VanDerWaalsContact O-CD2 3.29Å; I163-F167 WeakPolarHBondContact O-CD2 3.26Å; I163-F167 PolarHBondContact O-N 2.99Å
164G92Very high90.2Very high41 Ų4165.7 Ų65.742%0.42338%0.378SS..Hα-helixtrans-61.7-51.317800000112.9L160 A161 F166 F167 L168L160-G164 PolarHBondContact O-N 3.42Å; A161-G164 PolarHBondContact O-N 3.43Å; G164-F166 VanDerWaalsContact C-N 3.27Å; G164-F166 PolarHBondContact O-N 3.06Å; G164-F167 PolarHBondContact O-N 2.94Å; G164-L168 WeakPolarHBondContact O-CB 3.37Å; G164-L168 PolarHBondContact O-N 3.28Å
165V88.1Confident89.8Confident67 Ų6769.9 Ų69.941%0.40638%0.384SS..Hα-helixtrans-59.9-39.7174.7172.10000110.8A161 L168 M169 F190A161-V165 WeakPolarHBondContact O-CB 3.42Å; A161-V165 WeakPolarHBondContact O-CG2 3.35Å; A161-V165 PolarHBondContact O-N 3.35Å; V165-L168 WeakPolarHBondContact O-CB 3.35Å; V165-L168 PolarHBondContact O-N 3.47Å; V165-M169 HydrophobicContact CG1-CG 4.46Å; V165-M169 WeakPolarHBondContact O-CG 3.5Å; V165-M169 PolarHBondContact O-N 3.03Å; V165-F190 HydrophobicContact CG1-CE1 3.98Å; V165-F190 HydrophobicContact CG1-CZ 4.09Å
166F87.1Confident89.5Confident14 Ų1471.2 Ų71.26%0.06138%0.38CS..Hα-helixtrans-61.6-49.1176.2171.1-118.5000112.8S162 I163 G164 L168 M169 R170 I511 K514 C515S162-F166 WeakPolarHBondContact O-CB 3.29Å; S162-F166 PolarHBondContact O-N 2.87Å; I163-F166 WeakPolarHBondContact O-CB 3.37Å; I163-F166 PolarHBondContact O-N 3.45Å; G164-F166 VanDerWaalsContact C-N 3.27Å; G164-F166 PolarHBondContact O-N 3.06Å; F166-L168 VanDerWaalsContact C-N 3.31Å; F166-L168 PolarHBondContact O-N 3.32Å; F166-M169 PolarHBondContact O-N 2.86Å; F166-R170 WeakPolarHBondContact O-CB 3.24Å; F166-R170 PolarHBondContact O-N 2.86Å; F166-I511 HydrophobicContact CD2-CB 4.1Å; F166-I511 HydrophobicContact CD2-CG2 3.6Å; F166-I511 HydrophobicContact CE2-CB 4.04Å; F166-I511 HydrophobicContact CE2-CG2 3.38Å; F166-I511 WeakPolarHBondContact CE2-O 3.19Å; F166-I511 WeakPolarHBondContact CZ-O 3.43Å; F166-K514 HydrophobicContact CD1-CB 4.26Å; F166-K514 HydrophobicContact CE1-CB 3.8Å; F166-K514 HydrophobicContact CZ-CB 4.13Å; F166-C515 HydrophobicContact CZ-CB 4.21Å; F166-C515 WeakPolarHBondContact CZ-SG 3.28Å
167F90.5Very high88.8Confident97 Ų9775.3 Ų75.343%0.42540%0.397SS..Hα-helixtrans-63.2-37.9176.2-85.6-69.4000112I163 G164 R170 F171 M518I163-F167 HydrophobicContact CG2-CD2 3.63Å; I163-F167 HydrophobicContact CG2-CE2 3.64Å; I163-F167 VanDerWaalsContact O-CD2 3.29Å; I163-F167 WeakPolarHBondContact O-CD2 3.26Å; I163-F167 PolarHBondContact O-N 2.99Å; G164-F167 PolarHBondContact O-N 2.94Å; F167-R170 PolarHBondContact O-N 2.89Å; F167-F171 VanDerWaalsContact O-CB 3.31Å; F167-F171 WeakPolarHBondContact O-CB 3.41Å; F167-F171 PolarHBondContact O-N 3.23Å; F167-M518 HydrophobicContact CZ-CE 4.46Å
168L88.8Confident88.3Confident76 Ų7674.8 Ų74.840%0.39839%0.394SS..Hα-helixtrans-59.5-50.1174.2-170.470.3000111.3G164 V165 F166 R170 F171 M172 F190G164-L168 WeakPolarHBondContact O-CB 3.37Å; G164-L168 PolarHBondContact O-N 3.28Å; V165-L168 WeakPolarHBondContact O-CB 3.35Å; V165-L168 PolarHBondContact O-N 3.47Å; F166-L168 VanDerWaalsContact C-N 3.31Å; F166-L168 PolarHBondContact O-N 3.32Å; L168-R170 PolarHBondContact O-N 2.89Å; L168-F171 PolarHBondContact O-N 3.39Å; L168-M172 HydrophobicContact CD1-CG 4.05Å; L168-M172 HydrophobicContact CD1-SD 3.45Å; L168-M172 WeakPolarHBondContact CD1-SD 3.46Å; L168-M172 HydrophobicContact CD2-SD 4.46Å; L168-M172 HydrophobicContact CG-CG 4.37Å; L168-M172 HydrophobicContact CG-SD 3.77Å; L168-M172 WeakPolarHBondContact O-CB 3.31Å; L168-M172 WeakPolarHBondContact O-CG 3.25Å; L168-M172 PolarHBondContact O-N 3.21Å; L168-F190 HydrophobicContact CD2-CZ 4.32Å
169M87.7Confident87.8Confident7 Ų771.2 Ų71.23%0.03437%0.369CS..Hα-helixtrans-63-40.1176-67.3-50.5-74.800112.3V165 F166 F171 V173 L174 L186 F190 F426 L429V165-M169 HydrophobicContact CG1-CG 4.46Å; V165-M169 WeakPolarHBondContact O-CG 3.5Å; V165-M169 PolarHBondContact O-N 3.03Å; F166-M169 PolarHBondContact O-N 2.86Å; M169-F171 VanDerWaalsContact C-N 3.35Å; M169-F171 PolarHBondContact O-N 2.93Å; M169-V173 HydrophobicContact CE-CB 4.36Å; M169-V173 HydrophobicContact CE-CG2 3.88Å; M169-V173 WeakPolarHBondContact O-CA 3.25Å; M169-V173 WeakPolarHBondContact O-CB 3.22Å; M169-V173 PolarHBondContact O-N 3.47Å; M169-V173 HydrophobicContact SD-CG2 4.46Å; M169-L174 PolarHBondContact O-N 2.83Å; M169-L186 HydrophobicContact CE-CD2 4.27Å; M169-L186 HydrophobicContact SD-CD2 3.59Å; M169-L186 VanDerWaalsContact SD-CD2 3.59Å; M169-F190 HydrophobicContact CE-CE2 4.43Å; M169-F190 HydrophobicContact CG-CZ 4.39Å; M169-F190 HydrophobicContact SD-CE2 3.39Å; M169-F190 WeakPolarHBondContact SD-CE2 3.42Å; M169-F190 HydrophobicContact SD-CZ 3.64Å; M169-F426 HydrophobicContact CE-CD1 4.36Å; M169-F426 HydrophobicContact CE-CE1 3.44Å; M169-F426 VanDerWaalsContact CE-CE1 3.44Å; M169-F426 HydrophobicContact CE-CZ 4.02Å; M169-L429 HydrophobicContact CE-CD1 4.26Å
170R86.2Confident87.5Confident52 Ų5270.9 Ų70.920%0.19636%0.361CS..Iπ-helixtrans-62.8-41.6176.9-168.8-174.9-172.2-169.67.2111.8F166 F167 L168 R175 C515F166-R170 WeakPolarHBondContact O-CB 3.24Å; F166-R170 PolarHBondContact O-N 2.86Å; F167-R170 PolarHBondContact O-N 2.89Å; L168-R170 PolarHBondContact O-N 2.89Å; R170-R175 HydrophobicContact CG-CG 4.36Å; R170-R175 WeakPolarHBondContact O-CB 3.28Å; R170-R175 VanDerWaalsContact O-CG 3.27Å; R170-R175 WeakPolarHBondContact O-CG 3.43Å; R170-R175 PolarHBondContact O-N 2.83Å; R170-R175 VanDerWaalsContact O-N 3.15Å; R170-C515 VanDerWaalsContact CD-SG 3.53Å; R170-C515 PolarHBondContact NE-SG 2.89Å; R170-C515 PolarHBondContact NH1-SG 2.84Å
171F88.8Confident87.1Confident143 Ų14368.1 Ų68.163%0.62735%0.345SS*.Iπ-helixtrans-78.9-47-176.6179.8-102.2000113F167 L168 M169F167-F171 VanDerWaalsContact O-CB 3.31Å; F167-F171 WeakPolarHBondContact O-CB 3.41Å; F167-F171 PolarHBondContact O-N 3.23Å; L168-F171 PolarHBondContact O-N 3.39Å; M169-F171 VanDerWaalsContact C-N 3.35Å; M169-F171 PolarHBondContact O-N 2.93Å
172M88.5Confident87Confident77 Ų7766.8 Ų66.838%0.37933%0.332SS..Iπ-helixtrans-78.7-34.3-175.9-63.8-17277.300113.1L168 P182 L186L168-M172 HydrophobicContact CD1-CG 4.05Å; L168-M172 HydrophobicContact CD1-SD 3.45Å; L168-M172 WeakPolarHBondContact CD1-SD 3.46Å; L168-M172 HydrophobicContact CD2-SD 4.46Å; L168-M172 HydrophobicContact CG-CG 4.37Å; L168-M172 HydrophobicContact CG-SD 3.77Å; L168-M172 WeakPolarHBondContact O-CB 3.31Å; L168-M172 WeakPolarHBondContact O-CG 3.25Å; L168-M172 PolarHBondContact O-N 3.21Å; M172-P182 WeakPolarHBondContact O-CB 3.22Å; M172-L186 HydrophobicContact CB-CD2 4.15Å; M172-L186 HydrophobicContact CE-CD1 3.82Å; M172-L186 HydrophobicContact SD-CD1 3.87Å; M172-L186 HydrophobicContact SD-CD2 4.04Å
173V87.1Confident86.9Confident0 Ų064.4 Ų64.40%032%0.315CS..Iπ-helixtrans-114.4-71.2-170.6-179.30000111.4M169 R175 K176 P179 P182 A183 L186 F426M169-V173 HydrophobicContact CE-CB 4.36Å; M169-V173 HydrophobicContact CE-CG2 3.88Å; M169-V173 WeakPolarHBondContact O-CA 3.25Å; M169-V173 WeakPolarHBondContact O-CB 3.22Å; M169-V173 PolarHBondContact O-N 3.47Å; M169-V173 HydrophobicContact SD-CG2 4.46Å; V173-R175 VanDerWaalsContact C-N 3.26Å; V173-R175 PolarHBondContact O-N 3.48Å; V173-R175 VanDerWaalsContact O-N 3.08Å; V173-K176 WeakPolarHBondContact O-CB 3.22Å; V173-K176 PolarHBondContact O-N 3.47Å; V173-P179 HydrophobicContact CG1-CB 3.81Å; V173-P179 WeakPolarHBondContact O-CB 3.25Å; V173-P182 HydrophobicContact CG2-CB 4.34Å; V173-A183 HydrophobicContact CG1-CB 3.74Å; V173-A183 HydrophobicContact CG2-CB 4.3Å; V173-L186 HydrophobicContact CG2-CD2 3.83Å; V173-F426 HydrophobicContact CG1-CZ 4.2Å
174L82.9Confident86.7Confident61 Ų6161.1 Ų61.132%0.31930%0.299SS..Iπ-helixtrans-68.1-16.8-163.4-63.9-174.8000115.9M169 F426 I511M169-L174 PolarHBondContact O-N 2.83Å; L174-F426 HydrophobicContact CD2-CE2 4.06Å; L174-F426 HydrophobicContact CD2-CZ 3.85Å; L174-I511 HydrophobicContact CD1-CG2 3.33Å; L174-I511 HydrophobicContact CG-CG2 4.49Å
175R84.6Confident86.6Confident157 Ų15766.6 Ų66.659%0.59231%0.311SS*.THydrogen-bonded Turntrans-91.26.1174.9-77.6177.6168.5-170.4-3.7113.8R170 V173R170-R175 HydrophobicContact CG-CG 4.36Å; R170-R175 WeakPolarHBondContact O-CB 3.28Å; R170-R175 VanDerWaalsContact O-CG 3.27Å; R170-R175 WeakPolarHBondContact O-CG 3.43Å; R170-R175 PolarHBondContact O-N 2.83Å; R170-R175 VanDerWaalsContact O-N 3.15Å; V173-R175 VanDerWaalsContact C-N 3.26Å; V173-R175 PolarHBondContact O-N 3.48Å; V173-R175 VanDerWaalsContact O-N 3.08Å
176K85.2Confident86.8Confident115 Ų11564.7 Ų64.750%0.530%0.298SS..SBendtrans-95.4144.9176.5-59.2-60.4-176.7178.90110.5V173 P182V173-K176 WeakPolarHBondContact O-CB 3.22Å; V173-K176 PolarHBondContact O-N 3.47Å; K176-P182 HydrophobicContact CB-CG 4.06Å; K176-P182 HydrophobicContact CG-CG 3.99Å
177E80.5Confident86.9Confident191 Ų19164 Ų6489%0.89330%0.295SS*.SBendtrans-57.8-50.5-178.7-63.6168.7179.900111.4P179E177-P179 WeakPolarHBondContact O-CD 3.47Å
178D83.2Confident87Confident82 Ų8259.9 Ų59.944%0.43928%0.278SS..SBendtrans-102104.1160.4175.622.5000109.8L180 E181 P182D178-L180 VanDerWaalsContact OD1-CB 3.28Å; D178-L180 WeakPolarHBondContact OD1-CB 3.49Å; D178-L180 PolarHBondContact OD1-N 2.89Å; D178-E181 WeakPolarHBondContact OD2-CG 3.49Å; D178-P182 WeakPolarHBondContact O-CD 3.4Å; D178-P182 VanDerWaalsContact O-CG 3.31Å; D178-P182 WeakPolarHBondContact O-CG 3.48Å
179P82.9Confident87.2Confident4 Ų457.8 Ų57.83%0.02628%0.275CS..  trans-85.8-10.1174.734.5-35.3000113V173 E177 A183 E422V173-P179 HydrophobicContact CG1-CB 3.81Å; V173-P179 WeakPolarHBondContact O-CB 3.25Å; E177-P179 WeakPolarHBondContact O-CD 3.47Å; P179-A183 WeakPolarHBondContact O-CB 3.25Å; P179-A183 PolarHBondContact O-N 2.92Å; P179-E422 HydrophobicContact CG-CG 4.1Å; P179-E422 WeakPolarHBondContact CG-OE1 3.46Å
180L85Confident87.4Confident20 Ų2059.4 Ų59.411%0.10528%0.282CS..Hα-helixtrans-65.1-50.5-178.9176.261.6000111D178 A183 L184 I247 A421 V425D178-L180 VanDerWaalsContact OD1-CB 3.28Å; D178-L180 WeakPolarHBondContact OD1-CB 3.49Å; D178-L180 PolarHBondContact OD1-N 2.89Å; L180-A183 PolarHBondContact O-N 3.49Å; L180-L184 HydrophobicContact CD1-CD1 3.97Å; L180-L184 HydrophobicContact CD1-CG 4.14Å; L180-L184 HydrophobicContact CG-CD1 3.96Å; L180-L184 WeakPolarHBondContact O-CB 3.24Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.3Å; L180-L184 PolarHBondContact O-N 3.42Å; L180-I247 HydrophobicContact CD1-CD1 3.86Å; L180-I247 HydrophobicContact CD1-CG2 4.2Å; L180-I247 HydrophobicContact CD2-CG2 3.84Å; L180-A421 HydrophobicContact CD1-CB 4.38Å; L180-A421 HydrophobicContact CD2-CB 4.25Å; L180-V425 HydrophobicContact CD1-CG2 3.7Å
181E86.8Confident87.8Confident41 Ų4158.5 Ų58.519%0.19228%0.28CS..Hα-helixtrans-64.8-45179.5-70.3-65144.900113.3D178 A183 L184 K185 R244D178-E181 WeakPolarHBondContact OD2-CG 3.49Å; E181-A183 PolarHBondContact O-N 3.36Å; E181-L184 PolarHBondContact O-N 2.95Å; E181-K185 WeakPolarHBondContact O-CB 3.27Å; E181-K185 WeakPolarHBondContact O-CD 3.45Å; E181-K185 VanDerWaalsContact O-CG 3.24Å; E181-K185 WeakPolarHBondContact O-CG 3.32Å; E181-K185 PolarHBondContact O-N 2.76Å; E181-R244 IonicContact OE1-CZ 2.7Å; E181-R244 IonicContact OE1-NE 3.72Å; E181-R244 PolarHBondContact OE1-NE 3.34Å; E181-R244 IonicContact OE1-NH2 2.71Å; E181-R244 PolarHBondContact OE1-NH2 3.36Å; E181-R244 IonicContact OE2-CZ 3.4Å; E181-R244 IonicContact OE2-NE 3.15Å; E181-R244 IonicContact OE2-NH2 3.64Å; E181-R244 PolarHBondContact OE2-NH2 3.04Å
182P88.5Confident88.1Confident31 Ų3151.9 Ų51.920%0.20125%0.252CS..Hα-helixtrans-57.4-42.7169.1-2634.1000113.6M172 V173 K176 D178 K185 L186M172-P182 WeakPolarHBondContact O-CB 3.22Å; V173-P182 HydrophobicContact CG2-CB 4.34Å; K176-P182 HydrophobicContact CB-CG 4.06Å; K176-P182 HydrophobicContact CG-CG 3.99Å; D178-P182 WeakPolarHBondContact O-CD 3.4Å; D178-P182 VanDerWaalsContact O-CG 3.31Å; D178-P182 WeakPolarHBondContact O-CG 3.48Å; P182-K185 PolarHBondContact O-N 3.49Å; P182-L186 WeakPolarHBondContact O-CB 3.16Å; P182-L186 PolarHBondContact O-N 3.02Å; P182-L186 VanDerWaalsContact O-N 3.12Å
183A87.5Confident88.3Confident5 Ų552.3 Ų52.34%0.04126%0.259CS..Hα-helixtrans-61.8-50.817800000110.8V173 P179 L180 E181 K185 L186 I187 V425V173-A183 HydrophobicContact CG1-CB 3.74Å; V173-A183 HydrophobicContact CG2-CB 4.3Å; P179-A183 WeakPolarHBondContact O-CB 3.25Å; P179-A183 PolarHBondContact O-N 2.92Å; L180-A183 PolarHBondContact O-N 3.49Å; E181-A183 PolarHBondContact O-N 3.36Å; A183-K185 VanDerWaalsContact C-N 3.3Å; A183-K185 PolarHBondContact O-N 3.44Å; A183-L186 PolarHBondContact O-N 2.88Å; A183-I187 WeakPolarHBondContact O-CG1 3.17Å; A183-I187 PolarHBondContact O-N 2.99Å; A183-I187 VanDerWaalsContact O-N 3.11Å; A183-V425 HydrophobicContact CB-CB 4.34Å; A183-V425 HydrophobicContact CB-CG1 3.62Å
184L89.7Confident88.5Confident2 Ų254 Ų541%0.0127%0.269CS..Hα-helixtrans-57.9-38.5177.2-72.7170.9000112.9L180 E181 L186 I187 P188 V240 V243 R244 V425L180-L184 HydrophobicContact CD1-CD1 3.97Å; L180-L184 HydrophobicContact CD1-CG 4.14Å; L180-L184 HydrophobicContact CG-CD1 3.96Å; L180-L184 WeakPolarHBondContact O-CB 3.24Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.3Å; L180-L184 PolarHBondContact O-N 3.42Å; E181-L184 PolarHBondContact O-N 2.95Å; L184-L186 VanDerWaalsContact C-N 3.27Å; L184-L186 PolarHBondContact O-N 3.34Å; L184-I187 HydrophobicContact CD2-CD1 3.98Å; L184-P188 WeakPolarHBondContact O-CD 3.3Å; L184-V240 HydrophobicContact CB-CG1 4.19Å; L184-V240 HydrophobicContact CD2-CG1 4.44Å; L184-V240 WeakPolarHBondContact O-CG2 3.41Å; L184-V243 HydrophobicContact CD2-CB 4.38Å; L184-V243 HydrophobicContact CD2-CG1 3.93Å; L184-R244 HydrophobicContact CD1-CB 3.88Å; L184-R244 HydrophobicContact CD1-CG 3.75Å; L184-V425 HydrophobicContact CD2-CG2 3.94Å; L184-V425 HydrophobicContact CG-CG2 4.23Å
185K90.1Very high89Confident157 Ų15752.3 Ų52.368%0.68326%0.261SS*.Hα-helixtrans-66.8-26.9175.2-74.4167.4-175.4172.50113.1E181 P182 A183 P188E181-K185 WeakPolarHBondContact O-CB 3.27Å; E181-K185 WeakPolarHBondContact O-CD 3.45Å; E181-K185 VanDerWaalsContact O-CG 3.24Å; E181-K185 WeakPolarHBondContact O-CG 3.32Å; E181-K185 PolarHBondContact O-N 2.76Å; P182-K185 PolarHBondContact O-N 3.49Å; A183-K185 VanDerWaalsContact C-N 3.3Å; A183-K185 PolarHBondContact O-N 3.44Å; K185-P188 WeakPolarHBondContact O-CD 3.28Å
186L90.6Very high89.5Confident27 Ų2747.6 Ų47.614%0.14125%0.247CC..Hα-helixtrans-90.2-25.6-175.9-167.457.6000113.3M169 M172 V173 P182 A183 L184 P188 G189 F190M169-L186 HydrophobicContact CE-CD2 4.27Å; M169-L186 HydrophobicContact SD-CD2 3.59Å; M169-L186 VanDerWaalsContact SD-CD2 3.59Å; M172-L186 HydrophobicContact CB-CD2 4.15Å; M172-L186 HydrophobicContact CE-CD1 3.82Å; M172-L186 HydrophobicContact SD-CD1 3.87Å; M172-L186 HydrophobicContact SD-CD2 4.04Å; V173-L186 HydrophobicContact CG2-CD2 3.83Å; P182-L186 WeakPolarHBondContact O-CB 3.16Å; P182-L186 PolarHBondContact O-N 3.02Å; P182-L186 VanDerWaalsContact O-N 3.12Å; A183-L186 PolarHBondContact O-N 2.88Å; L184-L186 VanDerWaalsContact C-N 3.27Å; L184-L186 PolarHBondContact O-N 3.34Å; L186-P188 VanDerWaalsContact C-CD 3.5Å; L186-G189 PolarHBondContact O-N 3.33Å; L186-G189 VanDerWaalsContact O-N 3.14Å; L186-F190 HydrophobicContact CD1-CE2 4.33Å; L186-F190 HydrophobicContact CD2-CD2 4.43Å; L186-F190 HydrophobicContact CD2-CE2 3.71Å; L186-F190 HydrophobicContact CG-CD2 3.87Å; L186-F190 HydrophobicContact CG-CE2 3.62Å; L186-F190 PolarHBondContact O-N 3.33Å
187I90.2Very high89.9Confident0 Ų045.9 Ų45.90%025%0.246CC..Hα-helixtrans-49.2-49.4177.6-60.7169.4000113.1A183 L184 G189 F190 F191 V235 V240 V425A183-I187 WeakPolarHBondContact O-CG1 3.17Å; A183-I187 PolarHBondContact O-N 2.99Å; A183-I187 VanDerWaalsContact O-N 3.11Å; L184-I187 HydrophobicContact CD2-CD1 3.98Å; I187-G189 VanDerWaalsContact C-N 3.27Å; I187-G189 PolarHBondContact O-N 2.83Å; I187-F190 PolarHBondContact O-N 3.39Å; I187-F191 HydrophobicContact CG2-CD2 3.51Å; I187-F191 HydrophobicContact CG2-CE2 3.51Å; I187-F191 HydrophobicContact CG2-CZ 4.49Å; I187-F191 WeakPolarHBondContact O-CD2 3.32Å; I187-F191 PolarHBondContact O-N 3.5Å; I187-V235 HydrophobicContact CG2-CG1 3.81Å; I187-V240 HydrophobicContact CB-CG2 4.4Å; I187-V425 HydrophobicContact CD1-CG1 3.68Å; I187-V425 HydrophobicContact CG1-CG1 3.97Å
188P93.4Very high90.4Very high9 Ų937.8 Ų37.86%0.05821%0.209CC..Hα-helixtrans-59.1-38.2-177.9-22.833.8000112.9L184 K185 L186 G192 V232 V235 K236 V240L184-P188 WeakPolarHBondContact O-CD 3.3Å; K185-P188 WeakPolarHBondContact O-CD 3.28Å; L186-P188 VanDerWaalsContact C-CD 3.5Å; P188-G192 PolarHBondContact O-N 2.85Å; P188-V232 HydrophobicContact CB-CG1 4Å; P188-V232 WeakPolarHBondContact O-CG2 3.47Å; P188-V235 HydrophobicContact CB-CB 4.34Å; P188-V235 HydrophobicContact CB-CG1 4.15Å; P188-V235 HydrophobicContact CG-CG1 4.09Å; P188-K236 HydrophobicContact CB-CB 4.18Å; P188-K236 HydrophobicContact CG-CB 3.98Å; P188-V240 HydrophobicContact CG-CG2 3.88Å
189G92.9Very high90.9Very high33 Ų3334.5 Ų34.534%0.3419%0.193SC..Hα-helixtrans-63-48.5177.700000112L186 I187 G192 T193L186-G189 PolarHBondContact O-N 3.33Å; L186-G189 VanDerWaalsContact O-N 3.14Å; I187-G189 VanDerWaalsContact C-N 3.27Å; I187-G189 PolarHBondContact O-N 2.83Å; G189-G192 PolarHBondContact O-N 2.95Å; G189-T193 WeakPolarHBondContact O-CB 3.48Å; G189-T193 PolarHBondContact O-N 2.95Å; G189-T193 PolarHBondContact O-OG1 3.39Å
190F91.4Very high91.4Very high40 Ų4036.6 Ų36.618%0.17520%0.201CC..Hα-helixtrans-59.7-49175.7-84.5-71000112.8V165 L168 M169 L186 I187 G192 T193 V194 L429V165-F190 HydrophobicContact CG1-CE1 3.98Å; V165-F190 HydrophobicContact CG1-CZ 4.09Å; L168-F190 HydrophobicContact CD2-CZ 4.32Å; M169-F190 HydrophobicContact CE-CE2 4.43Å; M169-F190 HydrophobicContact CG-CZ 4.39Å; M169-F190 HydrophobicContact SD-CE2 3.39Å; M169-F190 WeakPolarHBondContact SD-CE2 3.42Å; M169-F190 HydrophobicContact SD-CZ 3.64Å; L186-F190 HydrophobicContact CD1-CE2 4.33Å; L186-F190 HydrophobicContact CD2-CD2 4.43Å; L186-F190 HydrophobicContact CD2-CE2 3.71Å; L186-F190 HydrophobicContact CG-CD2 3.87Å; L186-F190 HydrophobicContact CG-CE2 3.62Å; L186-F190 PolarHBondContact O-N 3.33Å; I187-F190 PolarHBondContact O-N 3.39Å; F190-G192 VanDerWaalsContact C-N 3.32Å; F190-G192 PolarHBondContact O-N 2.97Å; F190-T193 PolarHBondContact O-N 3.11Å; F190-V194 VanDerWaalsContact O-CG2 3.28Å; F190-V194 WeakPolarHBondContact O-CG2 3.49Å; F190-V194 PolarHBondContact O-N 3.35Å; F190-L429 HydrophobicContact CB-CD2 3.75Å; F190-L429 HydrophobicContact CD2-CD2 4.2Å; F190-L429 HydrophobicContact CG-CD2 4.12Å
191F93.1Very high91.7Very high34 Ų3437.5 Ų37.515%0.14921%0.209CC..Hα-helixtrans-59.1-44.4178.2-86.6-113.8000111.3I187 V195 T231 V235 L429 L432I187-F191 HydrophobicContact CG2-CD2 3.51Å; I187-F191 HydrophobicContact CG2-CE2 3.51Å; I187-F191 HydrophobicContact CG2-CZ 4.49Å; I187-F191 WeakPolarHBondContact O-CD2 3.32Å; I187-F191 PolarHBondContact O-N 3.5Å; F191-V195 WeakPolarHBondContact O-CB 3.3Å; F191-V195 WeakPolarHBondContact O-CG2 3.19Å; F191-V195 PolarHBondContact O-N 3.46Å; F191-T231 HydrophobicContact CB-CG2 3.85Å; F191-V235 HydrophobicContact CB-CG1 4.4Å; F191-V235 HydrophobicContact CB-CG2 3.89Å; F191-V235 HydrophobicContact CD1-CG2 3.74Å; F191-V235 HydrophobicContact CD2-CG1 4.48Å; F191-V235 HydrophobicContact CG-CG1 4.28Å; F191-V235 HydrophobicContact CG-CG2 3.94Å; F191-L429 HydrophobicContact CD2-CD2 4.31Å; F191-L429 HydrophobicContact CE2-CD2 4.11Å; F191-L432 HydrophobicContact CD1-CD1 3.73Å; F191-L432 HydrophobicContact CD1-CD2 4.39Å; F191-L432 HydrophobicContact CD2-CD1 4.41Å; F191-L432 HydrophobicContact CD2-CD2 3.65Å; F191-L432 HydrophobicContact CE1-CD1 3.67Å; F191-L432 HydrophobicContact CE2-CB 4.29Å; F191-L432 HydrophobicContact CE2-CD1 4.34Å; F191-L432 HydrophobicContact CE2-CD2 3.83Å; F191-L432 HydrophobicContact CE2-CG 4.39Å; F191-L432 HydrophobicContact CG-CD1 4.12Å; F191-L432 HydrophobicContact CG-CD2 3.95Å; F191-L432 HydrophobicContact CZ-CB 4.17Å; F191-L432 HydrophobicContact CZ-CD1 3.98Å; F191-L432 HydrophobicContact CZ-CD2 4.3Å; F191-L432 HydrophobicContact CZ-CG 4.39Å
192G95.2Very high92Very high4 Ų436.9 Ų36.94%0.04121%0.207CC..Hα-helixtrans-61.5-47.1176.200000113.5P188 G189 F190 V195 L196P188-G192 PolarHBondContact O-N 2.85Å; G189-G192 PolarHBondContact O-N 2.95Å; F190-G192 VanDerWaalsContact C-N 3.32Å; F190-G192 PolarHBondContact O-N 2.97Å; G192-V195 PolarHBondContact O-N 3.36Å; G192-L196 VanDerWaalsContact O-CB 3.25Å; G192-L196 WeakPolarHBondContact O-CB 3.15Å; G192-L196 PolarHBondContact O-N 3.45Å
193T93.3Very high92.1Very high86 Ų8637.2 Ų37.253%0.52821%0.205SC..Hα-helixtrans-62.5-44.7178-60.30000111.7G189 F190 L196 V197G189-T193 WeakPolarHBondContact O-CB 3.48Å; G189-T193 PolarHBondContact O-N 2.95Å; G189-T193 PolarHBondContact O-OG1 3.39Å; F190-T193 PolarHBondContact O-N 3.11Å; T193-L196 PolarHBondContact O-N 2.78Å; T193-V197 HydrophobicContact CG2-CG2 4.49Å; T193-V197 WeakPolarHBondContact O-CG2 3.23Å; T193-V197 PolarHBondContact O-N 3.4Å
194V91.8Very high92.3Very high34 Ų3443.4 Ų43.421%0.20623%0.229CC..Hα-helixtrans-67.3-42-1791780000111F190 N198 L432 F436F190-V194 VanDerWaalsContact O-CG2 3.28Å; F190-V194 WeakPolarHBondContact O-CG2 3.49Å; F190-V194 PolarHBondContact O-N 3.35Å; V194-N198 WeakPolarHBondContact O-CB 3.28Å; V194-N198 PolarHBondContact O-N 3.41Å; V194-N198 VanDerWaalsContact O-N 3.09Å; V194-N198 PolarHBondContact O-ND2 2.92Å; V194-L432 HydrophobicContact CB-CD2 4.3Å; V194-L432 HydrophobicContact CG2-CD2 4.13Å; V194-F436 HydrophobicContact CB-CD2 4.42Å; V194-F436 HydrophobicContact CG1-CB 3.8Å; V194-F436 HydrophobicContact CG1-CD1 3.94Å; V194-F436 HydrophobicContact CG1-CD2 3.21Å; V194-F436 HydrophobicContact CG1-CE1 4.31Å; V194-F436 HydrophobicContact CG1-CE2 3.65Å; V194-F436 HydrophobicContact CG1-CG 3.35Å; V194-F436 HydrophobicContact CG1-CZ 4.17Å
195V93.8Very high92.1Very high27 Ų2747 Ų4716%0.16425%0.246CC..Hα-helixtrans-63.1-43.2173.1169.30000111.5F191 G192 S199 L227 T231 F436F191-V195 WeakPolarHBondContact O-CB 3.3Å; F191-V195 WeakPolarHBondContact O-CG2 3.19Å; F191-V195 PolarHBondContact O-N 3.46Å; G192-V195 PolarHBondContact O-N 3.36Å; V195-S199 VanDerWaalsContact O-CB 3.22Å; V195-S199 WeakPolarHBondContact O-CB 3.27Å; V195-S199 PolarHBondContact O-N 3Å; V195-S199 PolarHBondContact O-OG 2.85Å; V195-L227 HydrophobicContact CG1-CB 4.12Å; V195-T231 HydrophobicContact CB-CG2 4.37Å; V195-T231 HydrophobicContact CG2-CG2 3.87Å; V195-F436 HydrophobicContact CG2-CZ 3.97Å
196L95.3Very high91.7Very high58 Ų5840.3 Ų40.330%0.30422%0.22SC..Hα-helixtrans-58.7-51.4178.2-177.1164.3000111.2G192 T193 S199 F200G192-L196 VanDerWaalsContact O-CB 3.25Å; G192-L196 WeakPolarHBondContact O-CB 3.15Å; G192-L196 PolarHBondContact O-N 3.45Å; T193-L196 PolarHBondContact O-N 2.78Å; L196-S199 PolarHBondContact O-N 3.08Å; L196-F200 WeakPolarHBondContact O-CB 3.35Å; L196-F200 PolarHBondContact O-N 3.42Å
197V92.7Very high91.2Very high78 Ų7839.5 Ų39.547%0.47322%0.217SC..Hα-helixtrans-62.1-47.2-178.8171.60000111.1T193 F200 S201T193-V197 HydrophobicContact CG2-CG2 4.49Å; T193-V197 WeakPolarHBondContact O-CG2 3.23Å; T193-V197 PolarHBondContact O-N 3.4Å; V197-F200 WeakPolarHBondContact O-CB 3.42Å; V197-F200 PolarHBondContact O-N 2.85Å; V197-S201 PolarHBondContact O-N 2.92Å; V197-S201 PolarHBondContact O-OG 2.97Å
198N91.4Very high90.6Very high22 Ų2241.8 Ų41.812%0.11823%0.233CC..Hα-helixtrans-68.8-38.6-179.6-75.6-92.5000112.4V194 F200 S201 I202 F436V194-N198 WeakPolarHBondContact O-CB 3.28Å; V194-N198 PolarHBondContact O-N 3.41Å; V194-N198 VanDerWaalsContact O-N 3.09Å; V194-N198 PolarHBondContact O-ND2 2.92Å; N198-F200 VanDerWaalsContact C-N 3.31Å; N198-F200 PolarHBondContact O-N 3.05Å; N198-S201 PolarHBondContact O-N 3.02Å; N198-I202 WeakPolarHBondContact O-CD1 3.36Å; N198-I202 WeakPolarHBondContact O-CG1 3.39Å; N198-I202 PolarHBondContact O-N 3.45Å; N198-F436 HydrophobicContact CB-CD1 3.89Å; N198-F436 HydrophobicContact CB-CE1 3.77Å; N198-F436 VanDerWaalsContact ND2-CD1 3.3Å; N198-F436 WeakPolarHBondContact ND2-CD1 3.5Å
199S92.9Very high89.7Confident13 Ų1345.9 Ų45.99%0.09125%0.253CS..Hα-helixtrans-61-43173.4-55.70000110.8V195 L196 I202 F203V195-S199 VanDerWaalsContact O-CB 3.22Å; V195-S199 WeakPolarHBondContact O-CB 3.27Å; V195-S199 PolarHBondContact O-N 3Å; V195-S199 PolarHBondContact O-OG 2.85Å; L196-S199 PolarHBondContact O-N 3.08Å; S199-I202 PolarHBondContact O-N 3.23Å; S199-F203 WeakPolarHBondContact O-CD2 3.48Å; S199-F203 PolarHBondContact O-N 2.76Å
200F94.2Very high89.1Confident48 Ų4847.7 Ų47.721%0.21125%0.254CS..Hα-helixtrans-59.9-48.8176.8-174.6-82.8000111L196 V197 N198 I202 F203 Y204 L217 I220 F221 S224L196-F200 WeakPolarHBondContact O-CB 3.35Å; L196-F200 PolarHBondContact O-N 3.42Å; V197-F200 WeakPolarHBondContact O-CB 3.42Å; V197-F200 PolarHBondContact O-N 2.85Å; N198-F200 VanDerWaalsContact C-N 3.31Å; N198-F200 PolarHBondContact O-N 3.05Å; F200-I202 VanDerWaalsContact C-N 3.33Å; F200-I202 PolarHBondContact O-N 2.91Å; F200-F203 PolarHBondContact O-N 3.28Å; F200-Y204 HydrophobicContact CE1-CD1 4.17Å; F200-Y204 HydrophobicContact CE1-CD2 4.38Å; F200-Y204 AromaticContact CE1-CG 3.89Å; F200-Y204 HydrophobicContact CE1-CG 3.89Å; F200-Y204 HydrophobicContact CZ-CD2 4.28Å; F200-Y204 HydrophobicContact CZ-CG 4.25Å; F200-Y204 WeakPolarHBondContact O-CB 3.44Å; F200-Y204 PolarHBondContact O-N 3.48Å; F200-L217 HydrophobicContact CE2-CD1 4.41Å; F200-L217 HydrophobicContact CZ-CD1 4.19Å; F200-I220 HydrophobicContact CD2-CG2 3.67Å; F200-I220 HydrophobicContact CE2-CG2 3.76Å; F200-I220 HydrophobicContact CG-CG2 4.31Å; F200-I220 HydrophobicContact CZ-CG2 4.46Å; F200-F221 HydrophobicContact CD2-CD1 4.18Å; F200-F221 HydrophobicContact CD2-CE1 4.1Å; F200-F221 AromaticContact CE2-CD1 3.9Å; F200-F221 HydrophobicContact CE2-CD1 3.9Å; F200-F221 HydrophobicContact CE2-CD2 4.18Å; F200-F221 AromaticContact CE2-CE1 3.58Å; F200-F221 HydrophobicContact CE2-CE1 3.58Å; F200-F221 AromaticContact CE2-CE2 3.88Å; F200-F221 HydrophobicContact CE2-CE2 3.88Å; F200-F221 HydrophobicContact CE2-CG 4.18Å; F200-F221 AromaticContact CE2-CZ 3.56Å; F200-F221 HydrophobicContact CE2-CZ 3.56Å; F200-F221 HydrophobicContact CZ-CE1 4.39Å; F200-F221 HydrophobicContact CZ-CE2 4.4Å; F200-F221 HydrophobicContact CZ-CZ 4.04Å; F200-S224 VanDerWaalsContact CA-OG 3.29Å; F200-S224 WeakPolarHBondContact CA-OG 3.45Å; F200-S224 PolarHBondContact N-OG 2.93Å
201S91.2Very high88.7Confident39 Ų3951.5 Ų51.527%0.27327%0.271SS..Hα-helixtrans-57.3-43.3175-63.70000112.6V197 N198 E205V197-S201 PolarHBondContact O-N 2.92Å; V197-S201 PolarHBondContact O-OG 2.97Å; N198-S201 PolarHBondContact O-N 3.02Å; S201-E205 WeakPolarHBondContact O-CB 3.32Å; S201-E205 PolarHBondContact O-N 3.29Å
202I92.1Very high88.1Confident27 Ų2751.5 Ų51.514%0.13827%0.27CS..Hα-helixtrans-62.8-47178.6-66.8160.5000111.4L62 L63 N198 S199 F200 G206 F212 F439L62-I202 HydrophobicContact CB-CG1 4.34Å; L62-I202 HydrophobicContact CB-CG2 4.32Å; L62-I202 HydrophobicContact CD1-CD1 4.29Å; L63-I202 HydrophobicContact CD2-CG1 4.1Å; L63-I202 HydrophobicContact CG-CG1 4.45Å; N198-I202 WeakPolarHBondContact O-CD1 3.36Å; N198-I202 WeakPolarHBondContact O-CG1 3.39Å; N198-I202 PolarHBondContact O-N 3.45Å; S199-I202 PolarHBondContact O-N 3.23Å; F200-I202 VanDerWaalsContact C-N 3.33Å; F200-I202 PolarHBondContact O-N 2.91Å; I202-G206 WeakPolarHBondContact O-CA 3.49Å; I202-G206 PolarHBondContact O-N 2.78Å; I202-F212 HydrophobicContact CG2-CD2 4.48Å; I202-F212 HydrophobicContact CG2-CE2 3.7Å; I202-F212 HydrophobicContact CG2-CZ 4.36Å; I202-F212 VanDerWaalsContact O-CD2 3.27Å; I202-F212 WeakPolarHBondContact O-CD2 3.44Å; I202-F439 HydrophobicContact CD1-CE1 3.8Å; I202-F439 HydrophobicContact CD1-CZ 3.53Å; I202-F439 HydrophobicContact CG1-CE1 3.92Å; I202-F439 HydrophobicContact CG1-CZ 3.75Å
203F91.9Very high87.3Confident38 Ų3856.4 Ų56.417%0.16730%0.296CS..Hα-helixtrans-78.1-24.4-177.9-67.4-59.4000113.5S199 F200 F212 I215 I220 I223 L227S199-F203 WeakPolarHBondContact O-CD2 3.48Å; S199-F203 PolarHBondContact O-N 2.76Å; F200-F203 PolarHBondContact O-N 3.28Å; F203-F212 AromaticContact CD1-CD1 3.9Å; F203-F212 HydrophobicContact CD1-CD1 3.9Å; F203-F212 HydrophobicContact CD1-CD2 4.26Å; F203-F212 AromaticContact CD1-CE1 3.81Å; F203-F212 HydrophobicContact CD1-CE1 3.81Å; F203-F212 HydrophobicContact CD1-CE2 4.18Å; F203-F212 HydrophobicContact CD1-CG 4.12Å; F203-F212 AromaticContact CD1-CZ 3.95Å; F203-F212 HydrophobicContact CD1-CZ 3.95Å; F203-F212 HydrophobicContact CE1-CD1 4.26Å; F203-F212 AromaticContact CE1-CE1 3.73Å; F203-F212 HydrophobicContact CE1-CE1 3.73Å; F203-F212 HydrophobicContact CE1-CE2 4.44Å; F203-F212 AromaticContact CE1-CZ 3.83Å; F203-F212 HydrophobicContact CE1-CZ 3.83Å; F203-I215 HydrophobicContact CD1-CD1 4.15Å; F203-I220 HydrophobicContact CB-CB 4.45Å; F203-I220 HydrophobicContact CB-CG1 4.15Å; F203-I220 HydrophobicContact CB-CG2 3.87Å; F203-I220 WeakPolarHBondContact O-CD1 3.43Å; F203-I223 HydrophobicContact CD2-CG2 3.94Å; F203-I223 HydrophobicContact CE2-CB 4.43Å; F203-I223 HydrophobicContact CE2-CG2 3.38Å; F203-I223 HydrophobicContact CZ-CG2 3.73Å; F203-L227 HydrophobicContact CE2-CD1 3.9Å; F203-L227 HydrophobicContact CZ-CD1 4.46Å
204Y90.6Very high87Confident135 Ų13561 Ų6153%0.52930%0.303SS..Hα-helixtrans-88.7-34.1179.3-172.9-107.7000113.4F200 L217 I220F200-Y204 HydrophobicContact CE1-CD1 4.17Å; F200-Y204 HydrophobicContact CE1-CD2 4.38Å; F200-Y204 AromaticContact CE1-CG 3.89Å; F200-Y204 HydrophobicContact CE1-CG 3.89Å; F200-Y204 HydrophobicContact CZ-CD2 4.28Å; F200-Y204 HydrophobicContact CZ-CG 4.25Å; F200-Y204 WeakPolarHBondContact O-CB 3.44Å; F200-Y204 PolarHBondContact O-N 3.48Å; Y204-L217 HydrophobicContact CD2-CD1 3.96Å; Y204-L217 HydrophobicContact CE2-CD1 3.95Å; Y204-I220 HydrophobicContact CD2-CD1 4.16Å
205E85.1Confident86.9Confident79 Ų7961.5 Ų61.537%0.36931%0.305SS..Hα-helixtrans-119.1-4.8-175.2-53.5-155.5137.300114.5K66 S201K66-E205 HydrophobicContact CB-CB 4.25Å; K66-E205 WeakPolarHBondContact CB-O 3.45Å; K66-E205 HydrophobicContact CG-CB 4.21Å; S201-E205 WeakPolarHBondContact O-CB 3.32Å; S201-E205 PolarHBondContact O-N 3.29Å
206G82.5Confident86.9Confident15 Ų1563 Ų6316%0.15531%0.314CS..SBendtrans-67170.4-176.600000115.2L62 I202 S208L62-G206 WeakPolarHBondContact O-CA 3.4Å; I202-G206 WeakPolarHBondContact O-CA 3.49Å; I202-G206 PolarHBondContact O-N 2.78Å; G206-S208 PolarHBondContact O-N 3.01Å
207P80.2Confident86.8Confident10 Ų1064.5 Ų64.57%0.06532%0.322CS..  trans-63.9131.2-173.126-35.4000112.2L62 A65 M209 L210L62-P207 VanDerWaalsContact O-CD 3.27Å; L62-P207 WeakPolarHBondContact O-CD 3.41Å; A65-P207 HydrophobicContact CB-CB 3.87Å; P207-M209 PolarHBondContact O-N 3.14Å; P207-L210 HydrophobicContact CG-CD1 3.79Å; P207-L210 HydrophobicContact CG-CG 4.01Å; P207-L210 PolarHBondContact O-N 2.93Å
208S78.6Confident86.9Confident49 Ų4968.7 Ų68.734%0.34333%0.331SS..G310 helixtrans-60.3-16.9176.653.40000114.2G206 L210 K211 D213 T470G206-S208 PolarHBondContact O-N 3.01Å; S208-L210 PolarHBondContact O-N 3.37Å; S208-K211 WeakPolarHBondContact O-CA 3.36Å; S208-K211 PolarHBondContact O-N 3.49Å; S208-D213 WeakPolarHBondContact CA-OD1 3.29Å; S208-T470 WeakPolarHBondContact OG-CG2 3.3Å
209M73.6Confident87Confident95 Ų9568.2 Ų68.247%0.46833%0.331SS..G310 helixtrans-57.3-36.9168.6-172.3-156.6-96.600111.9P207 K211 I473P207-M209 PolarHBondContact O-N 3.14Å; M209-K211 PolarHBondContact O-N 2.97Å; M209-I473 HydrophobicContact CE-CB 3.74Å; M209-I473 HydrophobicContact CE-CG2 3.57Å; M209-I473 HydrophobicContact SD-CB 3.88Å; M209-I473 HydrophobicContact SD-CD1 4.02Å; M209-I473 HydrophobicContact SD-CG2 3.86Å
210L81.2Confident87.1Confident70 Ų7067.9 Ų67.937%0.36633%0.329SS..G310 helixtrans-76.82.3176.7-62.6178.1000112.9L62 P207 S208 F212L62-L210 HydrophobicContact CD2-CD1 3.79Å; P207-L210 HydrophobicContact CG-CD1 3.79Å; P207-L210 HydrophobicContact CG-CG 4.01Å; P207-L210 PolarHBondContact O-N 2.93Å; S208-L210 PolarHBondContact O-N 3.37Å; L210-F212 HydrophobicContact CB-CD1 3.93Å; L210-F212 HydrophobicContact CB-CD2 4.07Å; L210-F212 HydrophobicContact CB-CE1 3.77Å; L210-F212 HydrophobicContact CB-CE2 3.91Å; L210-F212 HydrophobicContact CB-CG 4.09Å; L210-F212 HydrophobicContact CB-CZ 3.77Å; L210-F212 HydrophobicContact CD1-CD2 4.36Å; L210-F212 HydrophobicContact CD1-CE1 4.45Å; L210-F212 HydrophobicContact CD1-CE2 3.56Å; L210-F212 HydrophobicContact CD1-CZ 3.62Å; L210-F212 HydrophobicContact CG-CE2 4.39Å; L210-F212 HydrophobicContact CG-CZ 4.31Å; L210-F212 WeakPolarHBondContact O-CD1 3.47Å; L210-F212 PolarHBondContact O-N 3.18Å
211K81.1Confident87.2Confident121 Ų12170.5 Ų70.553%0.52634%0.34SS..THydrogen-bonded Turntrans60.421179.9-58.1174.2-174.6169.30114S208 M209 D213 R214S208-K211 WeakPolarHBondContact O-CA 3.36Å; S208-K211 PolarHBondContact O-N 3.49Å; M209-K211 PolarHBondContact O-N 2.97Å; K211-D213 WeakPolarHBondContact CA-OD1 3.35Å; K211-D213 PolarHBondContact O-N 2.95Å; K211-R214 HydrophobicContact CB-CG 4.23Å; K211-R214 WeakPolarHBondContact O-CB 3.5Å; K211-R214 PolarHBondContact O-N 3.37Å
212F81.7Confident87.5Confident33 Ų3374.1 Ų74.115%0.14536%0.355CS..G310 helixtrans-64-28.7176.8-64.3-17.4000112.3I202 F203 L210 R214 I215I202-F212 HydrophobicContact CG2-CD2 4.48Å; I202-F212 HydrophobicContact CG2-CE2 3.7Å; I202-F212 HydrophobicContact CG2-CZ 4.36Å; I202-F212 VanDerWaalsContact O-CD2 3.27Å; I202-F212 WeakPolarHBondContact O-CD2 3.44Å; F203-F212 AromaticContact CD1-CD1 3.9Å; F203-F212 HydrophobicContact CD1-CD1 3.9Å; F203-F212 HydrophobicContact CD1-CD2 4.26Å; F203-F212 AromaticContact CD1-CE1 3.81Å; F203-F212 HydrophobicContact CD1-CE1 3.81Å; F203-F212 HydrophobicContact CD1-CE2 4.18Å; F203-F212 HydrophobicContact CD1-CG 4.12Å; F203-F212 AromaticContact CD1-CZ 3.95Å; F203-F212 HydrophobicContact CD1-CZ 3.95Å; F203-F212 HydrophobicContact CE1-CD1 4.26Å; F203-F212 AromaticContact CE1-CE1 3.73Å; F203-F212 HydrophobicContact CE1-CE1 3.73Å; F203-F212 HydrophobicContact CE1-CE2 4.44Å; F203-F212 AromaticContact CE1-CZ 3.83Å; F203-F212 HydrophobicContact CE1-CZ 3.83Å; L210-F212 HydrophobicContact CB-CD1 3.93Å; L210-F212 HydrophobicContact CB-CD2 4.07Å; L210-F212 HydrophobicContact CB-CE1 3.77Å; L210-F212 HydrophobicContact CB-CE2 3.91Å; L210-F212 HydrophobicContact CB-CG 4.09Å; L210-F212 HydrophobicContact CB-CZ 3.77Å; L210-F212 HydrophobicContact CD1-CD2 4.36Å; L210-F212 HydrophobicContact CD1-CE1 4.45Å; L210-F212 HydrophobicContact CD1-CE2 3.56Å; L210-F212 HydrophobicContact CD1-CZ 3.62Å; L210-F212 HydrophobicContact CG-CE2 4.39Å; L210-F212 HydrophobicContact CG-CZ 4.31Å; L210-F212 WeakPolarHBondContact O-CD1 3.47Å; L210-F212 PolarHBondContact O-N 3.18Å; F212-R214 PolarHBondContact O-N 3.1Å; F212-R214 VanDerWaalsContact O-N 3.12Å; F212-I215 HydrophobicContact CD1-CD1 4Å; F212-I215 WeakPolarHBondContact O-CB 3.38Å; F212-I215 PolarHBondContact O-N 3.4Å
213D78.6Confident87.6Confident107 Ų10775.9 Ų75.957%0.57236%0.364SS*.G310 helixtrans-57.4-19.116960.3-59.2000114.1S208 K211S208-D213 WeakPolarHBondContact CA-OD1 3.29Å; K211-D213 WeakPolarHBondContact CA-OD1 3.35Å; K211-D213 PolarHBondContact O-N 2.95Å
214R86.9Confident87.9Confident183 Ų18374.1 Ų74.169%0.69136%0.356SS*.G310 helixtrans-90.4-8.2175.4-51.4-171.6-176.9-161.6-5.7113.5K211 F212 P216K211-R214 HydrophobicContact CB-CG 4.23Å; K211-R214 WeakPolarHBondContact O-CB 3.5Å; K211-R214 PolarHBondContact O-N 3.37Å; F212-R214 PolarHBondContact O-N 3.1Å; F212-R214 VanDerWaalsContact O-N 3.12Å; R214-P216 WeakPolarHBondContact O-CD 3.17Å
215I90.1Very high88.2Confident45 Ų4570 Ų7023%0.23135%0.347CS..SBendtrans-84.6117.1178.2-53.5176.4000107.3F203 F212 I220 I223F203-I215 HydrophobicContact CD1-CD1 4.15Å; F212-I215 HydrophobicContact CD1-CD1 4Å; F212-I215 WeakPolarHBondContact O-CB 3.38Å; F212-I215 PolarHBondContact O-N 3.4Å; I215-I220 HydrophobicContact CB-CG1 4.14Å; I215-I220 HydrophobicContact CG2-CG1 3.77Å; I215-I223 HydrophobicContact CD1-CD1 4.37Å; I215-I223 HydrophobicContact CG2-CD1 4.25Å
216P93.6Very high88.8Confident57 Ų5767.5 Ų67.537%0.3734%0.342SS..  trans-66.2153.3177.929.2-35.2000110.4R214 Y218 G219 I220R214-P216 WeakPolarHBondContact O-CD 3.17Å; P216-Y218 HydrophobicContact CB-CD1 3.82Å; P216-Y218 HydrophobicContact CB-CE1 3.44Å; P216-Y218 VanDerWaalsContact CB-CE1 3.44Å; P216-Y218 HydrophobicContact CG-CD1 4.03Å; P216-Y218 HydrophobicContact CG-CE1 3.4Å; P216-Y218 HydrophobicContact CG-CE2 3.99Å; P216-Y218 PolarHBondContact O-N 3.14Å; P216-Y218 VanDerWaalsContact O-N 3.08Å; P216-G219 WeakPolarHBondContact O-CA 3.32Å; P216-G219 PolarHBondContact O-N 3.39Å; P216-I220 PolarHBondContact O-N 3.26Å; P216-I220 VanDerWaalsContact O-N 3.14Å
217L93Very high89.5Confident90 Ų9070 Ų7047%0.47135%0.352SS..Hα-helixtrans-53.3-38.1-172.1-175.963.3000113.8F200 Y204 G219 I220 F221F200-L217 HydrophobicContact CE2-CD1 4.41Å; F200-L217 HydrophobicContact CZ-CD1 4.19Å; Y204-L217 HydrophobicContact CD2-CD1 3.96Å; Y204-L217 HydrophobicContact CE2-CD1 3.95Å; L217-G219 VanDerWaalsContact C-N 3.31Å; L217-G219 PolarHBondContact O-N 2.91Å; L217-I220 WeakPolarHBondContact O-CB 3.39Å; L217-I220 PolarHBondContact O-N 3.09Å; L217-F221 HydrophobicContact CD1-CD2 4.33Å; L217-F221 HydrophobicContact CD1-CE2 3.97Å; L217-F221 HydrophobicContact CD2-CE2 4.3Å; L217-F221 HydrophobicContact CG-CD2 4.09Å; L217-F221 HydrophobicContact CG-CE2 3.85Å; L217-F221 VanDerWaalsContact O-CD2 3.27Å; L217-F221 WeakPolarHBondContact O-CD2 3.29Å; L217-F221 PolarHBondContact O-N 2.9Å; L217-F221 VanDerWaalsContact O-N 3.07Å
218Y94.5Very high90.3Very high166 Ų16669.7 Ų69.765%0.65135%0.35SS*.Hα-helixtrans-64.6-34.6175.267.9-97000112.6P216 F221 I222P216-Y218 HydrophobicContact CB-CD1 3.82Å; P216-Y218 HydrophobicContact CB-CE1 3.44Å; P216-Y218 VanDerWaalsContact CB-CE1 3.44Å; P216-Y218 HydrophobicContact CG-CD1 4.03Å; P216-Y218 HydrophobicContact CG-CE1 3.4Å; P216-Y218 HydrophobicContact CG-CE2 3.99Å; P216-Y218 PolarHBondContact O-N 3.14Å; P216-Y218 VanDerWaalsContact O-N 3.08Å; Y218-F221 PolarHBondContact O-N 3.31Å; Y218-I222 HydrophobicContact CD2-CD1 4.13Å; Y218-I222 VanDerWaalsContact O-CG1 3.26Å; Y218-I222 WeakPolarHBondContact O-CG1 3.43Å; Y218-I222 PolarHBondContact O-N 3.44Å
219G94.7Very high91.2Very high12 Ų1272.3 Ų72.312%0.12436%0.359CS..Hα-helixtrans-66.1-40.6173.900000111.8P216 L217 F221 I222 I223P216-G219 WeakPolarHBondContact O-CA 3.32Å; P216-G219 PolarHBondContact O-N 3.39Å; L217-G219 VanDerWaalsContact C-N 3.31Å; L217-G219 PolarHBondContact O-N 2.91Å; G219-F221 VanDerWaalsContact C-N 3.35Å; G219-F221 PolarHBondContact O-N 3.24Å; G219-I222 PolarHBondContact O-N 2.86Å; G219-I223 WeakPolarHBondContact O-CB 3.14Å; G219-I223 VanDerWaalsContact O-CG1 3.25Å; G219-I223 WeakPolarHBondContact O-CG1 3.27Å; G219-I223 PolarHBondContact O-N 2.64Å
220I94.7Very high92.3Very high7 Ų772.1 Ų72.14%0.03636%0.359CS..Hα-helixtrans-58.8-46.4173.3-62.4176.5000110.7F200 F203 Y204 I215 P216 L217 S224F200-I220 HydrophobicContact CD2-CG2 3.67Å; F200-I220 HydrophobicContact CE2-CG2 3.76Å; F200-I220 HydrophobicContact CG-CG2 4.31Å; F200-I220 HydrophobicContact CZ-CG2 4.46Å; F203-I220 HydrophobicContact CB-CB 4.45Å; F203-I220 HydrophobicContact CB-CG1 4.15Å; F203-I220 HydrophobicContact CB-CG2 3.87Å; F203-I220 WeakPolarHBondContact O-CD1 3.43Å; Y204-I220 HydrophobicContact CD2-CD1 4.16Å; I215-I220 HydrophobicContact CB-CG1 4.14Å; I215-I220 HydrophobicContact CG2-CG1 3.77Å; P216-I220 PolarHBondContact O-N 3.26Å; P216-I220 VanDerWaalsContact O-N 3.14Å; L217-I220 WeakPolarHBondContact O-CB 3.39Å; L217-I220 PolarHBondContact O-N 3.09Å; I220-S224 VanDerWaalsContact O-CB 3.28Å; I220-S224 WeakPolarHBondContact O-CB 3.47Å; I220-S224 PolarHBondContact O-N 3.29Å; I220-S224 PolarHBondContact O-OG 2.81Å
221F95.6Very high93Very high103 Ų10370 Ų7045%0.45235%0.35SS..Hα-helixtrans-61.4-47.4174.8-82.9-69.3000112.3F200 L217 Y218 G219 I223 S224 C225F200-F221 HydrophobicContact CD2-CD1 4.18Å; F200-F221 HydrophobicContact CD2-CE1 4.1Å; F200-F221 AromaticContact CE2-CD1 3.9Å; F200-F221 HydrophobicContact CE2-CD1 3.9Å; F200-F221 HydrophobicContact CE2-CD2 4.18Å; F200-F221 AromaticContact CE2-CE1 3.58Å; F200-F221 HydrophobicContact CE2-CE1 3.58Å; F200-F221 AromaticContact CE2-CE2 3.88Å; F200-F221 HydrophobicContact CE2-CE2 3.88Å; F200-F221 HydrophobicContact CE2-CG 4.18Å; F200-F221 AromaticContact CE2-CZ 3.56Å; F200-F221 HydrophobicContact CE2-CZ 3.56Å; F200-F221 HydrophobicContact CZ-CE1 4.39Å; F200-F221 HydrophobicContact CZ-CE2 4.4Å; F200-F221 HydrophobicContact CZ-CZ 4.04Å; L217-F221 HydrophobicContact CD1-CD2 4.33Å; L217-F221 HydrophobicContact CD1-CE2 3.97Å; L217-F221 HydrophobicContact CD2-CE2 4.3Å; L217-F221 HydrophobicContact CG-CD2 4.09Å; L217-F221 HydrophobicContact CG-CE2 3.85Å; L217-F221 VanDerWaalsContact O-CD2 3.27Å; L217-F221 WeakPolarHBondContact O-CD2 3.29Å; L217-F221 PolarHBondContact O-N 2.9Å; L217-F221 VanDerWaalsContact O-N 3.07Å; Y218-F221 PolarHBondContact O-N 3.31Å; G219-F221 VanDerWaalsContact C-N 3.35Å; G219-F221 PolarHBondContact O-N 3.24Å; F221-I223 PolarHBondContact O-N 2.96Å; F221-S224 PolarHBondContact O-N 3.44Å; F221-C225 WeakPolarHBondContact O-CB 3.41Å; F221-C225 PolarHBondContact O-N 3.32Å; F221-C225 PolarHBondContact O-SG 3.44Å
222I96.7Very high93.8Very high114 Ų11466.5 Ų66.559%0.58534%0.338SS*.Hα-helixtrans-59.3-47.2179.2-71164.3000111.2Y218 G219 G226Y218-I222 HydrophobicContact CD2-CD1 4.13Å; Y218-I222 VanDerWaalsContact O-CG1 3.26Å; Y218-I222 WeakPolarHBondContact O-CG1 3.43Å; Y218-I222 PolarHBondContact O-N 3.44Å; G219-I222 PolarHBondContact O-N 2.86Å; I222-G226 PolarHBondContact O-N 3.39Å
223I95.5Very high94.5Very high64 Ų6468.8 Ų68.833%0.32835%0.351SS..Hα-helixtrans-65.2-47.6-179.7-64.9164.3000110.4F203 I215 G219 F221 G226 L227F203-I223 HydrophobicContact CD2-CG2 3.94Å; F203-I223 HydrophobicContact CE2-CB 4.43Å; F203-I223 HydrophobicContact CE2-CG2 3.38Å; F203-I223 HydrophobicContact CZ-CG2 3.73Å; I215-I223 HydrophobicContact CD1-CD1 4.37Å; I215-I223 HydrophobicContact CG2-CD1 4.25Å; G219-I223 WeakPolarHBondContact O-CB 3.14Å; G219-I223 VanDerWaalsContact O-CG1 3.25Å; G219-I223 WeakPolarHBondContact O-CG1 3.27Å; G219-I223 PolarHBondContact O-N 2.64Å; F221-I223 PolarHBondContact O-N 2.96Å; I223-G226 PolarHBondContact O-N 2.91Å; I223-L227 HydrophobicContact CG2-CD1 4.02Å; I223-L227 HydrophobicContact CG2-CG 4.47Å; I223-L227 WeakPolarHBondContact O-CG 3.45Å; I223-L227 PolarHBondContact O-N 2.93Å
224S96.8Very high95.4Very high1 Ų168.2 Ų68.21%0.00735%0.348CS..Hα-helixtrans-68.7-40.9-176.1-54.30000112.5F200 I220 F221 G228F200-S224 VanDerWaalsContact CA-OG 3.29Å; F200-S224 WeakPolarHBondContact CA-OG 3.45Å; F200-S224 PolarHBondContact N-OG 2.93Å; I220-S224 VanDerWaalsContact O-CB 3.28Å; I220-S224 WeakPolarHBondContact O-CB 3.47Å; I220-S224 PolarHBondContact O-N 3.29Å; I220-S224 PolarHBondContact O-OG 2.81Å; F221-S224 PolarHBondContact O-N 3.44Å; S224-G228 PolarHBondContact O-N 3.38Å
225C97.2Very high95.7Very high50 Ų5060 Ų6034%0.33832%0.318SS..Hα-helixtrans-65.6-40.4171.5-70.30000111.4F221 G228 I229F221-C225 WeakPolarHBondContact O-CB 3.41Å; F221-C225 PolarHBondContact O-N 3.32Å; F221-C225 PolarHBondContact O-SG 3.44Å; C225-G228 PolarHBondContact O-N 3.49Å; C225-I229 WeakPolarHBondContact O-CB 3.47Å; C225-I229 VanDerWaalsContact O-CG1 3.25Å; C225-I229 WeakPolarHBondContact O-CG1 3.48Å; C225-I229 PolarHBondContact O-N 3.25Å
226G97.5Very high96Very high26 Ų2663.3 Ų63.327%0.26833%0.331SS..Hα-helixtrans-59.8-49175.800000112.4I222 I223 I229 I230I222-G226 PolarHBondContact O-N 3.39Å; I223-G226 PolarHBondContact O-N 2.91Å; G226-I229 PolarHBondContact O-N 3.04Å; G226-I230 WeakPolarHBondContact O-CB 3.25Å; G226-I230 WeakPolarHBondContact O-CD1 3.06Å; G226-I230 VanDerWaalsContact O-CG1 3.24Å; G226-I230 WeakPolarHBondContact O-CG1 3.47Å; G226-I230 PolarHBondContact O-N 2.93Å
227L97.1Very high96.1Very high67 Ų6766.9 Ų66.935%0.35134%0.34SS..Hα-helixtrans-60.6-44.9174.6-70.5171.9000111.6V195 F203 I223 I229 I230 T231V195-L227 HydrophobicContact CG1-CB 4.12Å; F203-L227 HydrophobicContact CE2-CD1 3.9Å; F203-L227 HydrophobicContact CZ-CD1 4.46Å; I223-L227 HydrophobicContact CG2-CD1 4.02Å; I223-L227 HydrophobicContact CG2-CG 4.47Å; I223-L227 WeakPolarHBondContact O-CG 3.45Å; I223-L227 PolarHBondContact O-N 2.93Å; L227-I229 PolarHBondContact O-N 3.11Å; L227-I230 PolarHBondContact O-N 2.92Å; L227-T231 WeakPolarHBondContact O-CB 3.38Å; L227-T231 PolarHBondContact O-N 3.06Å; L227-T231 PolarHBondContact O-OG1 3.27Å
228G97Very high96.1Very high3 Ų367.1 Ų67.13%0.03134%0.341CS..Hα-helixtrans-56.7-48.3174.100000112.8S224 C225 T231 V232S224-G228 PolarHBondContact O-N 3.38Å; C225-G228 PolarHBondContact O-N 3.49Å; G228-T231 WeakPolarHBondContact O-CB 3.18Å; G228-T231 PolarHBondContact O-N 3.33Å; G228-V232 WeakPolarHBondContact O-CG2 3.43Å; G228-V232 PolarHBondContact O-N 3.13Å
229I97.7Very high95.9Very high104 Ų10463.6 Ų63.653%0.53333%0.327SS..Hα-helixtrans-63.7-45.2178.1-68.9163.5000111.1C225 G226 L227 T231 V232 L233C225-I229 WeakPolarHBondContact O-CB 3.47Å; C225-I229 VanDerWaalsContact O-CG1 3.25Å; C225-I229 WeakPolarHBondContact O-CG1 3.48Å; C225-I229 PolarHBondContact O-N 3.25Å; G226-I229 PolarHBondContact O-N 3.04Å; L227-I229 PolarHBondContact O-N 3.11Å; I229-T231 VanDerWaalsContact C-N 3.29Å; I229-T231 PolarHBondContact O-N 3.04Å; I229-V232 WeakPolarHBondContact O-CB 3.13Å; I229-V232 PolarHBondContact O-N 2.87Å; I229-V232 VanDerWaalsContact O-N 3.14Å; I229-L233 HydrophobicContact CG2-CD1 4.19Å; I229-L233 HydrophobicContact CG2-CG 4.46Å; I229-L233 WeakPolarHBondContact O-CG 3.39Å; I229-L233 PolarHBondContact O-N 3.14Å
230I97.4Very high95.8Very high92 Ų9264 Ų6447%0.47233%0.327SS..Hα-helixtrans-58.1-44.1175.8-70.5164.2000110.1G226 L227 L233 L234G226-I230 WeakPolarHBondContact O-CB 3.25Å; G226-I230 WeakPolarHBondContact O-CD1 3.06Å; G226-I230 VanDerWaalsContact O-CG1 3.24Å; G226-I230 WeakPolarHBondContact O-CG1 3.47Å; G226-I230 PolarHBondContact O-N 2.93Å; L227-I230 PolarHBondContact O-N 2.92Å; I230-L233 PolarHBondContact O-N 3.24Å; I230-L234 HydrophobicContact CG2-CD1 3.83Å; I230-L234 HydrophobicContact CG2-CG 4.3Å; I230-L234 WeakPolarHBondContact O-CB 3.45Å; I230-L234 WeakPolarHBondContact O-CG 3.39Å; I230-L234 PolarHBondContact O-N 2.92Å
231T96.5Very high95.5Very high26 Ų2666.2 Ų66.216%0.1634%0.342CS..Hα-helixtrans-60.6-45.4174.2-61.80000112F191 V195 L227 G228 I229 L233 L234 V235F191-T231 HydrophobicContact CB-CG2 3.85Å; V195-T231 HydrophobicContact CB-CG2 4.37Å; V195-T231 HydrophobicContact CG2-CG2 3.87Å; L227-T231 WeakPolarHBondContact O-CB 3.38Å; L227-T231 PolarHBondContact O-N 3.06Å; L227-T231 PolarHBondContact O-OG1 3.27Å; G228-T231 WeakPolarHBondContact O-CB 3.18Å; G228-T231 PolarHBondContact O-N 3.33Å; I229-T231 VanDerWaalsContact C-N 3.29Å; I229-T231 PolarHBondContact O-N 3.04Å; T231-L233 VanDerWaalsContact C-N 3.31Å; T231-L233 PolarHBondContact O-N 2.69Å; T231-L234 PolarHBondContact O-N 3.27Å; T231-V235 HydrophobicContact CG2-CG2 4.07Å; T231-V235 VanDerWaalsContact O-CB 3.31Å; T231-V235 WeakPolarHBondContact O-CB 3.32Å; T231-V235 VanDerWaalsContact O-CG2 3.23Å; T231-V235 WeakPolarHBondContact O-CG2 3.43Å; T231-V235 PolarHBondContact O-N 3.41Å
232V97.1Very high95.1Very high47 Ų4762.3 Ų62.329%0.28533%0.326SS..Hα-helixtrans-55.2-46.9174.6173.40000110.7P188 G228 I229 K236P188-V232 HydrophobicContact CB-CG1 4Å; P188-V232 WeakPolarHBondContact O-CG2 3.47Å; G228-V232 WeakPolarHBondContact O-CG2 3.43Å; G228-V232 PolarHBondContact O-N 3.13Å; I229-V232 WeakPolarHBondContact O-CB 3.13Å; I229-V232 PolarHBondContact O-N 2.87Å; I229-V232 VanDerWaalsContact O-N 3.14Å; V232-K236 WeakPolarHBondContact O-CB 3.36Å; V232-K236 PolarHBondContact O-N 2.83Å
233L97.3Very high94.6Very high81 Ų8157.1 Ų57.142%0.42430%0.299SS..Hα-helixtrans-65.8-47.7-178.8-63.4173.6000111.8I229 I230 T231 V235 K236 F237I229-L233 HydrophobicContact CG2-CD1 4.19Å; I229-L233 HydrophobicContact CG2-CG 4.46Å; I229-L233 WeakPolarHBondContact O-CG 3.39Å; I229-L233 PolarHBondContact O-N 3.14Å; I230-L233 PolarHBondContact O-N 3.24Å; T231-L233 VanDerWaalsContact C-N 3.31Å; T231-L233 PolarHBondContact O-N 2.69Å; L233-V235 PolarHBondContact O-N 2.87Å; L233-K236 PolarHBondContact O-N 3.31Å; L233-F237 HydrophobicContact CB-CD2 4.4Å; L233-F237 HydrophobicContact CD2-CD2 4.49Å; L233-F237 HydrophobicContact CD2-CE2 3.92Å; L233-F237 WeakPolarHBondContact O-CB 3.45Å; L233-F237 VanDerWaalsContact O-CD2 3.24Å; L233-F237 WeakPolarHBondContact O-CD2 3.26Å; L233-F237 PolarHBondContact O-N 3.02Å
234L95.8Very high94.2Very high94 Ų9459.3 Ų59.349%0.49230%0.303SS..Hα-helixtrans-60.9-44.9177.5-69.6173000111.5I230 T231 I238 W239I230-L234 HydrophobicContact CG2-CD1 3.83Å; I230-L234 HydrophobicContact CG2-CG 4.3Å; I230-L234 WeakPolarHBondContact O-CB 3.45Å; I230-L234 WeakPolarHBondContact O-CG 3.39Å; I230-L234 PolarHBondContact O-N 2.92Å; T231-L234 PolarHBondContact O-N 3.27Å; L234-I238 HydrophobicContact CD2-CD1 3.81Å; L234-I238 WeakPolarHBondContact O-CA 3.31Å; L234-I238 VanDerWaalsContact O-CB 3.23Å; L234-I238 WeakPolarHBondContact O-CB 3.35Å; L234-I238 PolarHBondContact O-N 3.25Å; L234-W239 PolarHBondContact O-N 3.14Å
235V94.9Very high93.5Very high12 Ų1263.8 Ų63.87%0.07332%0.32CS..Iπ-helixtrans-68.4-41.4179.4175.70000110.8I187 P188 F191 T231 L233 W239 V240I187-V235 HydrophobicContact CG2-CG1 3.81Å; P188-V235 HydrophobicContact CB-CB 4.34Å; P188-V235 HydrophobicContact CB-CG1 4.15Å; P188-V235 HydrophobicContact CG-CG1 4.09Å; F191-V235 HydrophobicContact CB-CG1 4.4Å; F191-V235 HydrophobicContact CB-CG2 3.89Å; F191-V235 HydrophobicContact CD1-CG2 3.74Å; F191-V235 HydrophobicContact CD2-CG1 4.48Å; F191-V235 HydrophobicContact CG-CG1 4.28Å; F191-V235 HydrophobicContact CG-CG2 3.94Å; T231-V235 HydrophobicContact CG2-CG2 4.07Å; T231-V235 VanDerWaalsContact O-CB 3.31Å; T231-V235 WeakPolarHBondContact O-CB 3.32Å; T231-V235 VanDerWaalsContact O-CG2 3.23Å; T231-V235 WeakPolarHBondContact O-CG2 3.43Å; T231-V235 PolarHBondContact O-N 3.41Å; L233-V235 PolarHBondContact O-N 2.87Å; V235-W239 HydrophobicContact CB-CB 4.38Å; V235-W239 HydrophobicContact CG1-CB 4.09Å; V235-W239 HydrophobicContact CG1-CG 4.45Å; V235-W239 WeakPolarHBondContact O-CB 3.2Å; V235-W239 PolarHBondContact O-N 3Å; V235-V240 HydrophobicContact CG1-CG2 4.38Å; V235-V240 WeakPolarHBondContact O-CG2 3.39Å; V235-V240 PolarHBondContact O-N 3.31Å
236K95.5Very high92.5Very high114 Ų11465.4 Ų65.450%0.49632%0.319SS..Iπ-helixtrans-65.1-43177.5-179.8177.51771790113.4P188 V232 L233 P241P188-K236 HydrophobicContact CB-CB 4.18Å; P188-K236 HydrophobicContact CG-CB 3.98Å; V232-K236 WeakPolarHBondContact O-CB 3.36Å; V232-K236 PolarHBondContact O-N 2.83Å; L233-K236 PolarHBondContact O-N 3.31Å; K236-P241 WeakPolarHBondContact O-CD 3.49Å
237F95.7Very high91.7Very high131 Ų13165.3 Ų65.358%0.57531%0.312SS*.Iπ-helixtrans-95.9-19.8-172.8-68.3-62.3000114.8L233L233-F237 HydrophobicContact CB-CD2 4.4Å; L233-F237 HydrophobicContact CD2-CD2 4.49Å; L233-F237 HydrophobicContact CD2-CE2 3.92Å; L233-F237 WeakPolarHBondContact O-CB 3.45Å; L233-F237 VanDerWaalsContact O-CD2 3.24Å; L233-F237 WeakPolarHBondContact O-CD2 3.26Å; L233-F237 PolarHBondContact O-N 3.02Å
238I93.5Very high90.7Very high96 Ų9667.8 Ų67.849%0.49233%0.325SS..Iπ-helixtrans-114.3-58.5-179.7-50.4177.1000110.5L234 L242L234-I238 HydrophobicContact CD2-CD1 3.81Å; L234-I238 WeakPolarHBondContact O-CA 3.31Å; L234-I238 VanDerWaalsContact O-CB 3.23Å; L234-I238 WeakPolarHBondContact O-CB 3.35Å; L234-I238 PolarHBondContact O-N 3.25Å; I238-L242 HydrophobicContact CG2-CD1 3.97Å; I238-L242 WeakPolarHBondContact O-CD1 3.42Å; I238-L242 WeakPolarHBondContact O-CG 3.29Å; I238-L242 PolarHBondContact O-N 3.41Å
239W89.8Confident89.5Confident92 Ų9271.3 Ų71.335%0.34835%0.346SS..Iπ-helixtrans-70.2-50.6-171.2-173-108.8000113.3L234 V235 L242 V243L234-W239 PolarHBondContact O-N 3.14Å; V235-W239 HydrophobicContact CB-CB 4.38Å; V235-W239 HydrophobicContact CG1-CB 4.09Å; V235-W239 HydrophobicContact CG1-CG 4.45Å; V235-W239 WeakPolarHBondContact O-CB 3.2Å; V235-W239 PolarHBondContact O-N 3Å; W239-L242 WeakPolarHBondContact O-CB 3.36Å; W239-L242 PolarHBondContact O-N 3.01Å; W239-V243 HydrophobicContact CD2-CG2 3.99Å; W239-V243 HydrophobicContact CG-CG2 4.21Å; W239-V243 HydrophobicContact CZ2-CG2 3.91Å; W239-V243 WeakPolarHBondContact O-CG2 3.26Å; W239-V243 PolarHBondContact O-N 3.2Å
240V91.6Very high88Confident21 Ų2169.5 Ų69.513%0.12735%0.353CS..Hα-helixtrans-58.1-46.4-178.4167.20000112L184 I187 P188 V235 L242 V243 R244L184-V240 HydrophobicContact CB-CG1 4.19Å; L184-V240 HydrophobicContact CD2-CG1 4.44Å; L184-V240 WeakPolarHBondContact O-CG2 3.41Å; I187-V240 HydrophobicContact CB-CG2 4.4Å; P188-V240 HydrophobicContact CG-CG2 3.88Å; V235-V240 HydrophobicContact CG1-CG2 4.38Å; V235-V240 WeakPolarHBondContact O-CG2 3.39Å; V235-V240 PolarHBondContact O-N 3.31Å; V240-L242 VanDerWaalsContact C-N 3.31Å; V240-L242 PolarHBondContact O-N 2.99Å; V240-V243 PolarHBondContact O-N 3.44Å; V240-R244 WeakPolarHBondContact O-CB 3.46Å; V240-R244 PolarHBondContact O-N 3.15Å
241P90.3Very high86.1Confident52 Ų5270 Ų7034%0.33835%0.354SS..Hα-helixtrans-60.6-34.5173.1-27.736.9000114.4K236 R245K236-P241 WeakPolarHBondContact O-CD 3.49Å; P241-R245 WeakPolarHBondContact O-CB 3.41Å; P241-R245 WeakPolarHBondContact O-CG 3.43Å; P241-R245 PolarHBondContact O-N 3.35Å; P241-R245 VanDerWaalsContact O-N 3.09Å
242L87.1Confident84.3Confident22 Ų2272.5 Ų72.512%0.11537%0.372CS..Hα-helixtrans-72.6-42.2177.7-70.2171.6000112.3I238 W239 V240 R246 I256 L257I238-L242 HydrophobicContact CG2-CD1 3.97Å; I238-L242 WeakPolarHBondContact O-CD1 3.42Å; I238-L242 WeakPolarHBondContact O-CG 3.29Å; I238-L242 PolarHBondContact O-N 3.41Å; W239-L242 WeakPolarHBondContact O-CB 3.36Å; W239-L242 PolarHBondContact O-N 3.01Å; V240-L242 VanDerWaalsContact C-N 3.31Å; V240-L242 PolarHBondContact O-N 2.99Å; L242-R246 PolarHBondContact O-N 2.57Å; L242-I256 HydrophobicContact CD2-CG2 3.72Å; L242-L257 HydrophobicContact CD1-CD1 3.76Å; L242-L257 HydrophobicContact CD2-CD1 4.01Å
243V85.7Confident82.3Confident4 Ų471.5 Ų71.52%0.02437%0.367CS..Hα-helixtrans-67-47.1175.7174.40000110.6L184 W239 V240 R245 R246 I247L184-V243 HydrophobicContact CD2-CB 4.38Å; L184-V243 HydrophobicContact CD2-CG1 3.93Å; W239-V243 HydrophobicContact CD2-CG2 3.99Å; W239-V243 HydrophobicContact CG-CG2 4.21Å; W239-V243 HydrophobicContact CZ2-CG2 3.91Å; W239-V243 WeakPolarHBondContact O-CG2 3.26Å; W239-V243 PolarHBondContact O-N 3.2Å; V240-V243 PolarHBondContact O-N 3.44Å; V243-R245 VanDerWaalsContact C-N 3.3Å; V243-R245 PolarHBondContact O-N 3.41Å; V243-R246 PolarHBondContact O-N 3.06Å; V243-R246 VanDerWaalsContact O-N 3.16Å; V243-I247 HydrophobicContact CG1-CD1 3.67Å; V243-I247 HydrophobicContact CG1-CG1 4.39Å; V243-I247 WeakPolarHBondContact O-CG1 3.09Å; V243-I247 PolarHBondContact O-N 3Å
244R87Confident80.1Confident111 Ų11177.7 Ų77.742%0.41939%0.385SS..Hα-helixtrans-56.5-43.7176.5-169.4177.8-167.7-142.2-0.6111.5E181 L184 V240 L248E181-R244 IonicContact OE1-CZ 2.7Å; E181-R244 IonicContact OE1-NE 3.72Å; E181-R244 PolarHBondContact OE1-NE 3.34Å; E181-R244 IonicContact OE1-NH2 2.71Å; E181-R244 PolarHBondContact OE1-NH2 3.36Å; E181-R244 IonicContact OE2-CZ 3.4Å; E181-R244 IonicContact OE2-NE 3.15Å; E181-R244 IonicContact OE2-NH2 3.64Å; E181-R244 PolarHBondContact OE2-NH2 3.04Å; L184-R244 HydrophobicContact CD1-CB 3.88Å; L184-R244 HydrophobicContact CD1-CG 3.75Å; V240-R244 WeakPolarHBondContact O-CB 3.46Å; V240-R244 PolarHBondContact O-N 3.15Å; R244-L248 HydrophobicContact CG-CD1 3.96Å; R244-L248 WeakPolarHBondContact O-CB 3.23Å; R244-L248 VanDerWaalsContact O-CG 3.27Å; R244-L248 WeakPolarHBondContact O-CG 3.47Å; R244-L248 PolarHBondContact O-N 2.98Å
245R80.8Confident78.4Confident94 Ų9479.7 Ų79.736%0.35539%0.391SS..Hα-helixtrans-64-48.3174.4-75.3175.2-177.3-158.51112.5P241 V243 I247 L248 T249 I256P241-R245 WeakPolarHBondContact O-CB 3.41Å; P241-R245 WeakPolarHBondContact O-CG 3.43Å; P241-R245 PolarHBondContact O-N 3.35Å; P241-R245 VanDerWaalsContact O-N 3.09Å; V243-R245 VanDerWaalsContact C-N 3.3Å; V243-R245 PolarHBondContact O-N 3.41Å; R245-I247 VanDerWaalsContact C-N 3.26Å; R245-I247 PolarHBondContact O-N 3.04Å; R245-L248 PolarHBondContact O-N 3.28Å; R245-L248 VanDerWaalsContact O-N 3.16Å; R245-T249 PolarHBondContact O-N 3.05Å; R245-T249 PolarHBondContact O-OG1 2.94Å; R245-T249 VanDerWaalsContact O-OG1 3.1Å; R245-I256 HydrophobicContact CB-CD1 4.02Å; R245-I256 HydrophobicContact CB-CG2 4.19Å
246R78.1Confident76.6Confident84 Ų8479.5 Ų79.532%0.31739%0.39SS..Hα-helixtrans-54.5-43.6177.5-174.3-163.8-65.9179.12.5111.6L242 V243 G250 E251 S253 I256L242-R246 PolarHBondContact O-N 2.57Å; V243-R246 PolarHBondContact O-N 3.06Å; V243-R246 VanDerWaalsContact O-N 3.16Å; R246-G250 VanDerWaalsContact O-CA 3.28Å; R246-G250 WeakPolarHBondContact O-CA 3.24Å; R246-G250 PolarHBondContact O-N 3.2Å; R246-E251 WeakPolarHBondContact CG-O 3.49Å; R246-S253 PolarHBondContact NE-OG 3.48Å; R246-S253 PolarHBondContact NH2-OG 3.47Å; R246-I256 HydrophobicContact CB-CD1 4.13Å
247I78.8Confident74.8Confident25 Ų2577.5 Ų77.513%0.12838%0.384CS..Hα-helixtrans-67.8-41.2-179.7-69.5170000111.6L180 V243 R245 A421 Q424 V425L180-I247 HydrophobicContact CD1-CD1 3.86Å; L180-I247 HydrophobicContact CD1-CG2 4.2Å; L180-I247 HydrophobicContact CD2-CG2 3.84Å; V243-I247 HydrophobicContact CG1-CD1 3.67Å; V243-I247 HydrophobicContact CG1-CG1 4.39Å; V243-I247 WeakPolarHBondContact O-CG1 3.09Å; V243-I247 PolarHBondContact O-N 3Å; R245-I247 VanDerWaalsContact C-N 3.26Å; R245-I247 PolarHBondContact O-N 3.04Å; I247-A421 HydrophobicContact CG2-CB 3.46Å; I247-A421 VanDerWaalsContact CG2-CB 3.46Å; I247-Q424 HydrophobicContact CD1-CB 4.03Å; I247-Q424 HydrophobicContact CG1-CB 3.94Å; I247-V425 HydrophobicContact CD1-CG2 3.65Å
248L77.6Confident73.2Confident118 Ų11879.2 Ų79.262%0.61839%0.392SS*.Hα-helixtrans-82.3-31.3-176.5-67.2174000114.4R244 R245R244-L248 HydrophobicContact CG-CD1 3.96Å; R244-L248 WeakPolarHBondContact O-CB 3.23Å; R244-L248 VanDerWaalsContact O-CG 3.27Å; R244-L248 WeakPolarHBondContact O-CG 3.47Å; R244-L248 PolarHBondContact O-N 2.98Å; R245-L248 PolarHBondContact O-N 3.28Å; R245-L248 VanDerWaalsContact O-N 3.16Å
249T71.5Confident71.7Confident77 Ų7776 Ų7647%0.47238%0.382SS..Hα-helixtrans-102.4-13.2-179.370.80000114R245 E251R245-T249 PolarHBondContact O-N 3.05Å; R245-T249 PolarHBondContact O-OG1 2.94Å; R245-T249 VanDerWaalsContact O-OG1 3.1Å; T249-E251 WeakPolarHBondContact CB-OE2 3.31Å; T249-E251 PolarHBondContact O-N 2.85Å; T249-E251 VanDerWaalsContact O-N 3.16Å; T249-E251 WeakPolarHBondContact OG1-CB 3.44Å; T249-E251 WeakPolarHBondContact OG1-CG 3.23Å; T249-E251 PolarHBondContact OG1-N 3.47Å; T249-E251 PolarHBondContact OG1-OE2 2.98Å
250G65Low70.4Confident67 Ų6776 Ų7669%0.69138%0.383SS*.  trans69.9-2.1-172.200000114.6R246R246-G250 VanDerWaalsContact O-CA 3.28Å; R246-G250 WeakPolarHBondContact O-CA 3.24Å; R246-G250 PolarHBondContact O-N 3.2Å
251E59.2Low69.2Low103 Ų10381.2 Ų81.248%0.48140%0.404SS..  trans-77.3140.9-173-64.5172.611900113.1R246 T249 S253 I256R246-E251 WeakPolarHBondContact CG-O 3.49Å; T249-E251 WeakPolarHBondContact CB-OE2 3.31Å; T249-E251 PolarHBondContact O-N 2.85Å; T249-E251 VanDerWaalsContact O-N 3.16Å; T249-E251 WeakPolarHBondContact OG1-CB 3.44Å; T249-E251 WeakPolarHBondContact OG1-CG 3.23Å; T249-E251 PolarHBondContact OG1-N 3.47Å; T249-E251 PolarHBondContact OG1-OE2 2.98Å; E251-S253 PolarHBondContact O-N 3.42Å; E251-I256 HydrophobicContact CB-CD1 4.21Å; E251-I256 HydrophobicContact CB-CG1 4.04Å; E251-I256 WeakPolarHBondContact O-CD1 3.41Å
252S57.4Low67.9Low78 Ų7881.6 Ų81.655%0.54541%0.408SS..  trans-63.8132.9174.8-179.20000112.1R254 H255 I256S252-R254 PolarHBondContact O-N 3.26Å; S252-H255 PolarHBondContact O-N 3.05Å; S252-I256 PolarHBondContact O-N 3.22Å
253S55.4Low66.6Low26 Ų2689.2 Ų89.218%0.18244%0.435CS..Hα-helixtrans-58-19.6-172-680000115.6R246 E251 H255 I256 L257R246-S253 PolarHBondContact NE-OG 3.48Å; R246-S253 PolarHBondContact NH2-OG 3.47Å; E251-S253 PolarHBondContact O-N 3.42Å; S253-H255 VanDerWaalsContact C-N 3.34Å; S253-I256 PolarHBondContact O-N 3.38Å; S253-L257 WeakPolarHBondContact O-CB 3.47Å; S253-L257 PolarHBondContact O-N 3.48Å
254R51.8Low65.5Low211 Ų21195.7 Ų95.780%0.79646%0.463SS*.Hα-helixtrans-63.4-39.6173.1-69.6-173.7179.8-177.50.6112S252 K258S252-R254 PolarHBondContact O-N 3.26Å; R254-K258 PolarHBondContact O-N 2.89Å
255H59.5Low64.1Low135 Ų13594.2 Ų94.263%0.62547%0.469SS*.Hα-helixtrans-71.8-42.4176.1-68.7-101.7000110.5S252 S253 L257 K258 G259S252-H255 PolarHBondContact O-N 3.05Å; S253-H255 VanDerWaalsContact C-N 3.34Å; H255-L257 VanDerWaalsContact C-N 3.33Å; H255-L257 PolarHBondContact O-N 2.87Å; H255-K258 PolarHBondContact O-N 3.19Å; H255-G259 PolarHBondContact O-N 2.92Å
256I56.9Low63Low8 Ų896.8 Ų96.84%0.04148%0.483CS..Hα-helixtrans-59.5-42.1176.8-55.4178.6000111.5L242 R245 R246 E251 S252 S253 G259 Y260L242-I256 HydrophobicContact CD2-CG2 3.72Å; R245-I256 HydrophobicContact CB-CD1 4.02Å; R245-I256 HydrophobicContact CB-CG2 4.19Å; R246-I256 HydrophobicContact CB-CD1 4.13Å; E251-I256 HydrophobicContact CB-CD1 4.21Å; E251-I256 HydrophobicContact CB-CG1 4.04Å; E251-I256 WeakPolarHBondContact O-CD1 3.41Å; S252-I256 PolarHBondContact O-N 3.22Å; S253-I256 PolarHBondContact O-N 3.38Å; I256-G259 PolarHBondContact O-N 2.85Å; I256-Y260 VanDerWaalsContact O-CB 3.31Å; I256-Y260 WeakPolarHBondContact O-CB 3.45Å; I256-Y260 PolarHBondContact O-N 2.95Å
257L57.3Low62Low73 Ų73100.2 Ų100.238%0.38250%0.501SS..Hα-helixtrans-66.4-47.6-179.3-15281.1000111.5L242 S253 H255 G259 Y260 F261L242-L257 HydrophobicContact CD1-CD1 3.76Å; L242-L257 HydrophobicContact CD2-CD1 4.01Å; S253-L257 WeakPolarHBondContact O-CB 3.47Å; S253-L257 PolarHBondContact O-N 3.48Å; H255-L257 VanDerWaalsContact C-N 3.33Å; H255-L257 PolarHBondContact O-N 2.87Å; L257-G259 VanDerWaalsContact C-N 3.34Å; L257-G259 PolarHBondContact O-N 3.38Å; L257-Y260 PolarHBondContact O-N 3.23Å; L257-F261 HydrophobicContact CD1-CE2 4.31Å; L257-F261 HydrophobicContact CD2-CE2 3.99Å; L257-F261 HydrophobicContact CG-CD2 4.06Å; L257-F261 HydrophobicContact CG-CE2 3.73Å; L257-F261 VanDerWaalsContact O-CD2 3.23Å; L257-F261 WeakPolarHBondContact O-CD2 3.31Å; L257-F261 PolarHBondContact O-N 3Å
258K62.8Low60.9Low167 Ų167107.2 Ų107.273%0.72653%0.53SS*.Hα-helixtrans-57.6-46.3172.8-74.7-172.5175.2-172.40111.4R254 H255 Y260 S262R254-K258 PolarHBondContact O-N 2.89Å; H255-K258 PolarHBondContact O-N 3.19Å; K258-Y260 PolarHBondContact O-N 3.22Å; K258-S262 WeakPolarHBondContact O-CB 3.23Å; K258-S262 PolarHBondContact O-N 2.9Å
259G62.1Low59.6Low29 Ų29107 Ų10730%0.29953%0.529SS..Hα-helixtrans-64.5-36.3178.300000113.5H255 I256 L257 R263H255-G259 PolarHBondContact O-N 2.92Å; I256-G259 PolarHBondContact O-N 2.85Å; L257-G259 VanDerWaalsContact C-N 3.34Å; L257-G259 PolarHBondContact O-N 3.38Å; G259-R263 VanDerWaalsContact O-CB 3.32Å; G259-R263 WeakPolarHBondContact O-CB 3.43Å; G259-R263 VanDerWaalsContact O-CG 3.3Å; G259-R263 WeakPolarHBondContact O-CG 3.36Å; G259-R263 PolarHBondContact O-N 3.1Å
260Y63.2Low58.7Low91 Ų91105.9 Ų105.936%0.35752%0.524SS..Hα-helixtrans-69.8-47.1176.8-178.4-108.6000111.9I256 L257 K258 R263 K264I256-Y260 VanDerWaalsContact O-CB 3.31Å; I256-Y260 WeakPolarHBondContact O-CB 3.45Å; I256-Y260 PolarHBondContact O-N 2.95Å; L257-Y260 PolarHBondContact O-N 3.23Å; K258-Y260 PolarHBondContact O-N 3.22Å; Y260-R263 PolarHBondContact O-N 2.81Å; Y260-K264 VanDerWaalsContact O-CB 3.32Å; Y260-K264 WeakPolarHBondContact O-CB 3.38Å; Y260-K264 PolarHBondContact O-N 3.01Å
261F65.2Low58.4Low131 Ų131106.1 Ų106.158%0.57551%0.512SS*.Hα-helixtrans-64-40.7174.6-73.9-61.5000111.8L257 K264 S265L257-F261 HydrophobicContact CD1-CE2 4.31Å; L257-F261 HydrophobicContact CD2-CE2 3.99Å; L257-F261 HydrophobicContact CG-CD2 4.06Å; L257-F261 HydrophobicContact CG-CE2 3.73Å; L257-F261 VanDerWaalsContact O-CD2 3.23Å; L257-F261 WeakPolarHBondContact O-CD2 3.31Å; L257-F261 PolarHBondContact O-N 3Å; F261-K264 PolarHBondContact O-N 2.86Å; F261-S265 VanDerWaalsContact O-CB 3.3Å; F261-S265 WeakPolarHBondContact O-CB 3.13Å; F261-S265 PolarHBondContact O-N 3.4Å
262S62.9Low58.2Low59 Ų59103.8 Ų103.841%0.41351%0.51SS..Hα-helixtrans-62-48.4174.4-1780000112.3K258 K264 S265 K266K258-S262 WeakPolarHBondContact O-CB 3.23Å; K258-S262 PolarHBondContact O-N 2.9Å; S262-K264 PolarHBondContact O-N 3.31Å; S262-S265 PolarHBondContact O-N 2.89Å; S262-K266 WeakPolarHBondContact O-CB 3.39Å; S262-K266 WeakPolarHBondContact O-CG 3.34Å; S262-K266 PolarHBondContact O-N 3.48Å
263R61Low58.2Low183 Ų183103.2 Ų103.269%0.69150%0.504SS*.Hα-helixtrans-65-38.5176.3-73.9-177.4-169.7179.36.8112.6G259 Y260 S265 K267G259-R263 VanDerWaalsContact O-CB 3.32Å; G259-R263 WeakPolarHBondContact O-CB 3.43Å; G259-R263 VanDerWaalsContact O-CG 3.3Å; G259-R263 WeakPolarHBondContact O-CG 3.36Å; G259-R263 PolarHBondContact O-N 3.1Å; Y260-R263 PolarHBondContact O-N 2.81Å; R263-S265 VanDerWaalsContact C-N 3.32Å; R263-K267 VanDerWaalsContact O-CB 3.32Å; R263-K267 WeakPolarHBondContact O-CB 3.32Å; R263-K267 PolarHBondContact O-N 3.36Å
264K61.8Low58.3Low139 Ų139106.1 Ų106.160%0.60452%0.517SS*.Hα-helixtrans-67.4-35.2176.2-161.7177.8-173.5-175.70111.3Y260 F261 S262 K268Y260-K264 VanDerWaalsContact O-CB 3.32Å; Y260-K264 WeakPolarHBondContact O-CB 3.38Å; Y260-K264 PolarHBondContact O-N 3.01Å; F261-K264 PolarHBondContact O-N 2.86Å; S262-K264 PolarHBondContact O-N 3.31Å; K264-K268 PolarHBondContact O-N 2.88Å
265S57.9Low58.6Low80 Ų80101.2 Ų101.256%0.55951%0.506SS*.Hα-helixtrans-67.6-53.1171.9-169.10000111.8F261 S262 R263 K267 K268 L269F261-S265 VanDerWaalsContact O-CB 3.3Å; F261-S265 WeakPolarHBondContact O-CB 3.13Å; F261-S265 PolarHBondContact O-N 3.4Å; S262-S265 PolarHBondContact O-N 2.89Å; R263-S265 VanDerWaalsContact C-N 3.32Å; S265-K267 VanDerWaalsContact C-N 3.32Å; S265-K267 PolarHBondContact O-N 3.32Å; S265-K268 WeakPolarHBondContact O-CA 3.39Å; S265-K268 WeakPolarHBondContact O-CB 3.49Å; S265-K268 PolarHBondContact O-N 3.33Å; S265-L269 PolarHBondContact O-N 3.45Å
266K58.1Low58.5Low149 Ų149101.4 Ų101.465%0.64851%0.505SS*.Hα-helixtrans-56.9-40.6177-74.9-167.3176.8-165.30112.8S262 K268 L269 S270S262-K266 WeakPolarHBondContact O-CB 3.39Å; S262-K266 WeakPolarHBondContact O-CG 3.34Å; S262-K266 PolarHBondContact O-N 3.48Å; K266-K268 VanDerWaalsContact C-N 3.34Å; K266-L269 PolarHBondContact O-N 3.36Å; K266-S270 PolarHBondContact O-N 3.47Å
267K56.6Low58.2Low156 Ų156108.4 Ų108.468%0.67853%0.532SS*.Hα-helixtrans-72.1-26.2176.8-158.7176.3-172.8-176.60112.9R263 S265 S270 V271R263-K267 VanDerWaalsContact O-CB 3.32Å; R263-K267 WeakPolarHBondContact O-CB 3.32Å; R263-K267 PolarHBondContact O-N 3.36Å; S265-K267 VanDerWaalsContact C-N 3.32Å; S265-K267 PolarHBondContact O-N 3.32Å; K267-S270 PolarHBondContact O-OG 3.29Å; K267-V271 VanDerWaalsContact O-CG2 3.32Å; K267-V271 WeakPolarHBondContact O-CG2 3.44Å; K267-V271 PolarHBondContact O-N 2.86Å
268K55.8Low58.1Low172 Ų172110 Ų11075%0.74854%0.538SS*.Hα-helixtrans-72.8-35.6169.5-132.4-172-179.5-161.90111.4K264 S265 K266 A272K264-K268 PolarHBondContact O-N 2.88Å; S265-K268 WeakPolarHBondContact O-CA 3.39Å; S265-K268 WeakPolarHBondContact O-CB 3.49Å; S265-K268 PolarHBondContact O-N 3.33Å; K266-K268 VanDerWaalsContact C-N 3.34Å; K268-A272 WeakPolarHBondContact O-CB 3.39Å; K268-A272 PolarHBondContact O-N 2.91Å
269L49.7Very low57.8Low114 Ų114104.6 Ų104.660%0.59752%0.522SS*.Hα-helixtrans-72.8-41.3177.5-174.262.8000112.3S265 K266 A272 V273S265-L269 PolarHBondContact O-N 3.45Å; K266-L269 PolarHBondContact O-N 3.36Å; L269-A272 PolarHBondContact O-N 3.28Å; L269-V273 WeakPolarHBondContact O-CG2 3.49Å; L269-V273 PolarHBondContact O-N 3.13Å
270S53.6Low57.6Low52 Ų52107 Ų10736%0.36453%0.526SS..Hα-helixtrans-62-49.517870.20000111.1K266 K267 A272 V273 D274K266-S270 PolarHBondContact O-N 3.47Å; K267-S270 PolarHBondContact O-OG 3.29Å; S270-A272 VanDerWaalsContact C-N 3.28Å; S270-A272 PolarHBondContact O-N 3Å; S270-V273 CarbonylContact O-C 3.57Å; S270-V273 WeakPolarHBondContact O-CA 3.42Å; S270-V273 WeakPolarHBondContact O-CB 3.45Å; S270-V273 PolarHBondContact O-N 3.22Å; S270-D274 PolarHBondContact O-N 3.2Å; S270-D274 VanDerWaalsContact O-OD2 3.14Å
271V58.6Low57.2Low72 Ų72108 Ų10844%0.43653%0.534SS..Hα-helixtrans-57.3-41.6176.5174.30000111.5K267 V273 D274 D275K267-V271 VanDerWaalsContact O-CG2 3.32Å; K267-V271 WeakPolarHBondContact O-CG2 3.44Å; K267-V271 PolarHBondContact O-N 2.86Å; V271-V273 VanDerWaalsContact C-N 3.28Å; V271-V273 PolarHBondContact O-N 3.45Å; V271-D274 PolarHBondContact O-N 3.3Å; V271-D275 WeakPolarHBondContact O-CB 3.18Å; V271-D275 VanDerWaalsContact O-CG 3.23Å; V271-D275 PolarHBondContact O-N 3.44Å
272A55.8Low56.7Low55 Ų55106.7 Ų106.746%0.45553%0.533SS..Hα-helixtrans-69.8-20.6176.500000114.4K268 L269 S270 K276K268-A272 WeakPolarHBondContact O-CB 3.39Å; K268-A272 PolarHBondContact O-N 2.91Å; L269-A272 PolarHBondContact O-N 3.28Å; S270-A272 VanDerWaalsContact C-N 3.28Å; S270-A272 PolarHBondContact O-N 3Å; A272-K276 WeakPolarHBondContact O-CB 3.33Å
273V57Low56.3Low66 Ų66109.2 Ų109.240%0.454%0.542SS..Hα-helixtrans-83.2-41.4172169.70000110.3L269 S270 V271 K276 Y277L269-V273 WeakPolarHBondContact O-CG2 3.49Å; L269-V273 PolarHBondContact O-N 3.13Å; S270-V273 CarbonylContact O-C 3.57Å; S270-V273 WeakPolarHBondContact O-CA 3.42Å; S270-V273 WeakPolarHBondContact O-CB 3.45Å; S270-V273 PolarHBondContact O-N 3.22Å; V271-V273 VanDerWaalsContact C-N 3.28Å; V271-V273 PolarHBondContact O-N 3.45Å; V273-K276 CarbonylContact O-C 3.57Å; V273-K276 WeakPolarHBondContact O-CB 3.42Å; V273-K276 PolarHBondContact O-N 3.33Å; V273-K276 VanDerWaalsContact O-N 3.16Å; V273-Y277 HydrophobicContact CG1-CD2 4.11Å; V273-Y277 HydrophobicContact CG1-CE2 4.46Å; V273-Y277 PolarHBondContact O-N 3.36Å
274D56.7Low55.8Low86 Ų86107 Ų10746%0.4654%0.538SS..Hα-helixtrans-61.1-49.8176.2-58.6-32.2000110.2S270 V271 K276 Y277 Q278S270-D274 PolarHBondContact O-N 3.2Å; S270-D274 VanDerWaalsContact O-OD2 3.14Å; V271-D274 PolarHBondContact O-N 3.3Å; D274-K276 PolarHBondContact O-N 2.87Å; D274-Y277 PolarHBondContact O-N 2.99Å; D274-Q278 PolarHBondContact O-N 3.12Å
275D58.2Low55.1Low108 Ų108104.4 Ų104.458%0.57854%0.537SS*.Hα-helixtrans-55.6-35.7173.7-70.2-25.7000112.3V271 S279V271-D275 WeakPolarHBondContact O-CB 3.18Å; V271-D275 VanDerWaalsContact O-CG 3.23Å; V271-D275 PolarHBondContact O-N 3.44Å; D275-S279 WeakPolarHBondContact O-CB 3.44Å; D275-S279 PolarHBondContact O-N 2.94Å; D275-S279 VanDerWaalsContact O-N 3.16Å; D275-S279 PolarHBondContact O-OG 2.86Å
276K56.7Low54.7Low139 Ų139105.5 Ų105.560%0.60455%0.545SS*.Hα-helixtrans-76.6-31.8178.4-166.4178-178.1-175.40112.3A272 V273 D274 S279 I280A272-K276 WeakPolarHBondContact O-CB 3.33Å; V273-K276 CarbonylContact O-C 3.57Å; V273-K276 WeakPolarHBondContact O-CB 3.42Å; V273-K276 PolarHBondContact O-N 3.33Å; V273-K276 VanDerWaalsContact O-N 3.16Å; D274-K276 PolarHBondContact O-N 2.87Å; K276-S279 WeakPolarHBondContact CA-OG 3.42Å; K276-S279 PolarHBondContact O-OG 3.41Å; K276-I280 HydrophobicContact CG-CD1 4.38Å; K276-I280 WeakPolarHBondContact O-CD1 3.48Å; K276-I280 VanDerWaalsContact O-CG1 3.23Å; K276-I280 WeakPolarHBondContact O-CG1 3.3Å; K276-I280 PolarHBondContact O-N 3.11Å
277Y51.5Low54.2Low155 Ų155106.9 Ų106.961%0.60855%0.551SS**Hα-helixtrans-72-46.5173.2-103.9-94.6000111.2V273 D274 S279 I280 E281V273-Y277 HydrophobicContact CG1-CD2 4.11Å; V273-Y277 HydrophobicContact CG1-CE2 4.46Å; V273-Y277 PolarHBondContact O-N 3.36Å; D274-Y277 PolarHBondContact O-N 2.99Å; Y277-S279 PolarHBondContact O-N 3.32Å; Y277-I280 WeakPolarHBondContact O-CA 3.5Å; Y277-I280 PolarHBondContact O-N 3.16Å; Y277-E281 PolarHBondContact O-N 3.45Å
278Q56.1Low53.4Low106 Ų106109.5 Ų109.550%0.49556%0.557SS.*Hα-helixtrans-54.8-49.5176-125.969.445.600111.5D274 I280 E281 D282D274-Q278 PolarHBondContact O-N 3.12Å; Q278-I280 PolarHBondContact O-N 2.99Å; Q278-E281 PolarHBondContact O-N 3.45Å; Q278-E281 VanDerWaalsContact O-N 3.08Å; Q278-D282 PolarHBondContact O-N 3.35Å
279S56.3Low52.7Low55 Ų55107.3 Ų107.339%0.38556%0.563SS.*Hα-helixtrans-66.2-18.7177.754.30000114.6D275 K276 Y277 N283D275-S279 WeakPolarHBondContact O-CB 3.44Å; D275-S279 PolarHBondContact O-N 2.94Å; D275-S279 VanDerWaalsContact O-N 3.16Å; D275-S279 PolarHBondContact O-OG 2.86Å; K276-S279 WeakPolarHBondContact CA-OG 3.42Å; K276-S279 PolarHBondContact O-OG 3.41Å; Y277-S279 PolarHBondContact O-N 3.32Å; S279-N283 PolarHBondContact O-ND2 3.23Å
280I57.4Low52.3Low78 Ų78106.1 Ų106.140%0.456%0.564SS.*Hα-helixtrans-83.7-36.2170.8-70.6167.7000111.2K276 Y277 Q278 N283 K284K276-I280 HydrophobicContact CG-CD1 4.38Å; K276-I280 WeakPolarHBondContact O-CD1 3.48Å; K276-I280 VanDerWaalsContact O-CG1 3.23Å; K276-I280 WeakPolarHBondContact O-CG1 3.3Å; K276-I280 PolarHBondContact O-N 3.11Å; Y277-I280 WeakPolarHBondContact O-CA 3.5Å; Y277-I280 PolarHBondContact O-N 3.16Å; Q278-I280 PolarHBondContact O-N 2.99Å; I280-N283 PolarHBondContact O-N 2.91Å; I280-K284 HydrophobicContact CG2-CD 4.43Å; I280-K284 WeakPolarHBondContact O-CG 3.35Å; I280-K284 PolarHBondContact O-N 3Å; I280-K284 VanDerWaalsContact O-N 3.11Å
281E54.2Low51.5Low113 Ų113108.4 Ų108.453%0.52858%0.58SS.*Hα-helixtrans-67.9-42.7174.5-69.8-162.1137.400112.1Y277 Q278 N283 K284 S285Y277-E281 PolarHBondContact O-N 3.45Å; Q278-E281 PolarHBondContact O-N 3.45Å; Q278-E281 VanDerWaalsContact O-N 3.08Å; E281-N283 VanDerWaalsContact C-N 3.26Å; E281-N283 PolarHBondContact O-N 3.09Å; E281-K284 CarbonylContact O-C 3.57Å; E281-K284 WeakPolarHBondContact O-CA 3.45Å; E281-K284 PolarHBondContact O-N 3.08Å; E281-S285 PolarHBondContact O-N 2.96Å; E281-S285 PolarHBondContact O-OG 3.49Å
282D54.9Low50.6Low103 Ų103112.9 Ų112.955%0.55160%0.602SS**Hα-helixtrans-60.9-35.1175.3-68.3-28000112.2Q278 S285 S286Q278-D282 PolarHBondContact O-N 3.35Å; D282-S285 PolarHBondContact O-OG 3.08Å; D282-S285 VanDerWaalsContact O-OG 3.05Å; D282-S286 PolarHBondContact O-N 2.95Å
283N54.4Low49.4Very low113 Ų113118.8 Ų118.860%0.60462%0.619SS**Hα-helixtrans-75.4-20.7173.4-86.8-68.8000113.7S279 I280 E281S279-N283 PolarHBondContact O-ND2 3.23Å; I280-N283 PolarHBondContact O-N 2.91Å; E281-N283 VanDerWaalsContact C-N 3.26Å; E281-N283 PolarHBondContact O-N 3.09Å
284K51.4Low48.4Very low136 Ų136124.5 Ų124.559%0.59164%0.642SS**Hα-helixtrans-87.1-37.1175.1-79.7178.9177.2178.90112.4I280 E281 S286 K287 R288I280-K284 HydrophobicContact CG2-CD 4.43Å; I280-K284 WeakPolarHBondContact O-CG 3.35Å; I280-K284 PolarHBondContact O-N 3Å; I280-K284 VanDerWaalsContact O-N 3.11Å; E281-K284 CarbonylContact O-C 3.57Å; E281-K284 WeakPolarHBondContact O-CA 3.45Å; E281-K284 PolarHBondContact O-N 3.08Å; K284-S286 VanDerWaalsContact C-N 3.34Å; K284-K287 PolarHBondContact O-N 3.22Å; K284-K287 VanDerWaalsContact O-N 3.15Å; K284-R288 PolarHBondContact O-N 3.04Å
285S46.7Very low47.2Very low84 Ų84126.4 Ų126.459%0.58766%0.657SS**Hα-helixtrans-63.3-41.1177.1630000111.2E281 D282 K287 R288E281-S285 PolarHBondContact O-N 2.96Å; E281-S285 PolarHBondContact O-OG 3.49Å; D282-S285 PolarHBondContact O-OG 3.08Å; D282-S285 VanDerWaalsContact O-OG 3.05Å; S285-K287 PolarHBondContact O-N 3.21Å; S285-K287 VanDerWaalsContact O-N 3.16Å; S285-R288 PolarHBondContact O-N 3.49Å
286S48.4Very low46Very low104 Ų104128.8 Ų128.873%0.72767%0.668SS**THydrogen-bonded Turntrans-63.2-16.6174.5-166.30000114.6D282 K284D282-S286 PolarHBondContact O-N 2.95Å; K284-S286 VanDerWaalsContact C-N 3.34Å
287K49.1Very low45Very low178 Ų178129.5 Ų129.577%0.77468%0.678SS**THydrogen-bonded Turntrans-109.11.8-178.1-75.6-174.5175-179.40115.4K284 S285K284-K287 PolarHBondContact O-N 3.22Å; K284-K287 VanDerWaalsContact O-N 3.15Å; S285-K287 PolarHBondContact O-N 3.21Å; S285-K287 VanDerWaalsContact O-N 3.16Å
288R40.1Very low44Very low211 Ų211131 Ų13180%0.79669%0.693SS**  trans-99.616.6-171.9-117.6176.2178.5-178.6-3.4116K284 S285 S290K284-R288 PolarHBondContact O-N 3.04Å; S285-R288 PolarHBondContact O-N 3.49Å; R288-S290 PolarHBondContact O-N 3.39Å
289S40.6Very low43.1Very low125 Ų125133.6 Ų133.687%0.87471%0.71SS**  trans-74.356.5169.2178.60000112.1
290S40.6Very low42Very low90 Ų90137 Ų13763%0.62973%0.729SS**SBendtrans-166139.1175.5172.90000111.5R288R288-S290 PolarHBondContact O-N 3.39Å
291S38Very low40.9Very low100 Ų100142.6 Ų142.670%0.69975%0.746SS**  trans57.795.1161580000119.4
292N37.6Very low39.7Very low166 Ų166142.5 Ų142.589%0.88875%0.753SS**  33.5133.6129-60.9-2.9000122.6
293H31.4Very low38.8Very low179 Ų179141.5 Ų141.583%0.82975%0.752SS**  trans-14.7130.8159-92.5-33.9000119.4
294E36.7Very low37.8Very low186 Ų186144.8 Ų144.887%0.86976%0.763SS**  trans-145.1146.4134.4-124.7170.2-171.700109.1
295T30Very low36.8Very low126 Ų126144.7 Ų144.777%0.77377%0.774SS**  trans-112.2119.8-170.1-46.50000109.7
296I34.9Very low36.2Very low157 Ų157148.1 Ų148.181%0.80579%0.786SS**  trans-137.8145.7176.5-60.6-176.5000110.1
297D35.7Very low35.3Very low155 Ų155152 Ų15283%0.82979%0.793SS**  trans-61.6159.1-164.6-96.2-55.7000118.1
298M29.2Very low34.5Very low185 Ų185152.8 Ų152.891%0.91180%0.799SS**  trans-87.9103.4167.6-93.5-125.2-62.800110.9
299D37Very low34Very low162 Ų162147.2 Ų147.287%0.86680%0.799SS**PPolyproline II helixtrans-100.8143.8166.1-106.3-36.9000112.7
300T33.9Very low33.4Very low125 Ų125148.1 Ų148.177%0.76780%0.798SS**PPolyproline II helixtrans-82.6124.8-163.2-56.50000112.4V302T300-V302 HydrophobicContact CG2-CG2 4.18Å
301Y33.5Very low32.9Very low197 Ų197150.8 Ų150.877%0.77381%0.811SS**PPolyproline II helixtrans-96.8118.7172.1-176.4-101.3000112.1P303Y301-P303 HydrophobicContact CE1-CB 3.91Å; Y301-P303 HydrophobicContact CE1-CG 4.04Å
302V29.4Very low32.4Very low111 Ų111149 Ų14967%0.67381%0.807SS**  trans-118.1117.4171.8-179.50000109T300T300-V302 HydrophobicContact CG2-CG2 4.18Å
303P35.6Very low32Very low82 Ų82150.5 Ų150.553%0.53281%0.807SS.*  trans-86.6136.7170.931.7-29.8000111.6Y301Y301-P303 HydrophobicContact CE1-CB 3.91Å; Y301-P303 HydrophobicContact CE1-CG 4.04Å
304H34Very low31.8Very low181 Ų181151.9 Ų151.984%0.83880%0.804SS**  trans-61.2150.4-176.2-72.9-103.7000114.6
305T31.2Very low31.7Very low134 Ų134150 Ų15082%0.82280%0.8SS**  trans-105.7118.2162.550.90000109.8
306D34Very low31.8Very low156 Ų156149.8 Ų149.883%0.83479%0.794SS**  trans-82.7129.9168-64.4-41.1000110.3
307E28.5Very low31.4Very low187 Ų187149.5 Ų149.587%0.87480%0.8SS**  trans-76.3147.1167-63.3-177.1114.100110.5
308E33Very low31.3Very low194 Ų194146.5 Ų146.591%0.90780%0.797SS**  -169.6146.5124.5-111-176.6-177.800114.4
309A29.9Very low31.2Very low94 Ų94149.9 Ų149.978%0.77780%0.799SS**  trans6480.7157.200000120
310V27.2Very low30.9Very low144 Ų144146.1 Ų146.187%0.87380%0.798SS**  trans-93.5124.5151.6173.60000109.9
311V30.5Very low30.7Very low146 Ų146147.4 Ų147.489%0.88580%0.801SS**  trans-127.5107.5160.5178.90000108.3
312G27.9Very low30.6Very low61 Ų61142.8 Ų142.863%0.62979%0.793SS**  trans-90.4149.3-17600000113.3
313F28.9Very low30.7Very low199 Ų199144.2 Ų144.287%0.87380%0.797SS**  trans-101.6111.2167.8-133.9-87.3000109.7
314R26.7Very low30.7Very low207 Ų207147.4 Ų147.478%0.78181%0.81SS**  trans-118.598.3-175.8-176.6-176.7-174.7164.35.2109.3N316R314-N316 PolarHBondContact NE-OD1 3.41Å
315N33.9Very low30.4Very low147 Ų147147.6 Ų147.679%0.78681%0.808SS**  trans-93.8108.4169.8-87.1-0.1000109.7
316N32Very low30.4Very low121 Ų121148 Ų14865%0.64781%0.805SS**  trans-74.8141178.9-70.3-32.8000111.4R314R314-N316 PolarHBondContact NE-OD1 3.41Å
317V27.5Very low30.4Very low152 Ų152150.2 Ų150.292%0.92181%0.807SS**  trans-74.7125.2155.7172.60000107.7
318A33.4Very low30.3Very low92 Ų92148.5 Ų148.576%0.7680%0.803SS**  trans-143.4122.816900000110.7
319R27.4Very low30.1Very low256 Ų256145.2 Ų145.297%0.96679%0.788SS**  trans-71.7144.4162.8-76.1167.3154.1144.9-10.5108.7
320G30Very low30Very low82 Ų82150.1 Ų150.185%0.84579%0.786SS**  trans-171.9120169.400000109.6
321N29.4Very low30.2Very low153 Ų153153.4 Ų153.482%0.81879%0.789SS**  trans-101.6175.5179.3-161.916.1000110.1
322T32.5Very low30.2Very low100 Ų100152.7 Ų152.761%0.61379%0.785SS**  trans67106.5162.356.80000119.8
323D32.3Very low30.3Very low141 Ų141155.1 Ų155.175%0.75479%0.793SS**  77.8149.2120-58.5-34.6000124.7
324N33.7Very low30.6Very low149 Ų149153.2 Ų153.280%0.79779%0.787SS**  trans68.6107.8177.8-58.8-41.3000115.7
325K28.9Very low31Very low184 Ų184149.4 Ų149.480%0.878%0.782SS**  63.4129.461.6-77.2-164.3172-176.70115.4
326D31.4Very low30.8Very low142 Ų142150.3 Ų150.376%0.75979%0.786SS**  trans82.5143.7158.9-53.6-22.1000120.4
327K33.6Very low30.9Very low203 Ų203148 Ų14888%0.88379%0.791SS**  trans77.898.7178.5-58.8172.7179.2172.90114.5
328L27.2Very low30.9Very low151 Ų151147.2 Ų147.279%0.79179%0.787SS**  cis71.9114.644.4-157.283.8000114
329E28Very low30.9Very low125 Ų125150.8 Ų150.858%0.58479%0.791SS**  trans75141150.8-93.4179.1-136.700122.9
330R27.8Very low31Very low198 Ų198148.1 Ų148.175%0.74779%0.789SS**  trans69.6112.7161.1-59.7158.8-146.4-166.76.1116.8
331F32.1Very low30.9Very low212 Ų212147.6 Ų147.693%0.9378%0.784SS**  -153.9130.896.1-104.3-78000110.4
332T30.3Very low31Very low131 Ų131148.2 Ų148.280%0.80479%0.787SS**  trans-109.4165.2-176.742.20000111.7
333S30.3Very low30.8Very low112 Ų112151.2 Ų151.278%0.78379%0.793SS**  trans81.7133.7170.1-134.20000114.2
334E34.2Very low30.6Very low160 Ų160150.2 Ų150.275%0.74879%0.788SS**  cis-153.7169.241.9-75-173.8145.500115.5
335N34.2Very low30.3Very low127 Ų127150.6 Ų150.668%0.67979%0.785SS**  trans81.975.8151.4-63.3-32.8000122.1
336N31.7Very low30.4Very low165 Ų165149.1 Ų149.188%0.88279%0.786SS**  32.4133.5113.9-68.5-21.8000121.6
337G33.4Very low30.1Very low72 Ų72151.8 Ų151.874%0.74279%0.791SS**  trans-173.438.2173.300000119.4
338V28.1Very low29.9Very low137 Ų137149.3 Ų149.383%0.8379%0.792SS**  trans42.9116.3153.7-159.10000120.5
339I33Very low29.8Very low167 Ų167146.2 Ų146.286%0.85678%0.784SS**  -175.2135.7113.4-92.1172.7000109.5
340Q28Very low29.9Very low199 Ų199146 Ų14693%0.9380%0.796SS**  trans-112.4155.2-178-114.9176.3-10.900110.4
341G29.6Very low29.8Very low71 Ų71144.4 Ų144.473%0.73280%0.797SS**  trans172.595.9167.600000118.1
342L31.5Very low29.5Very low167 Ų167143.7 Ų143.787%0.87479%0.794SS**  trans71.184.3144.8-58.6172.1000121.2
343E28.3Very low29.2Very low162 Ų162144.6 Ų144.676%0.75779%0.789SS**  30.3127.5115.1-94.4-170.3127.900123.8
344N27.1Very low29.2Very low120 Ų120144.8 Ų144.864%0.64279%0.785SS**  99.5134.7120.8-86.7-20.4000124.7
345Q26.9Very low28.9Very low158 Ų158145.2 Ų145.274%0.73878%0.784SS**  trans66.4118.3158.9-62.5-178.821.200117.6
346N31.7Very low28.6Very low153 Ų153145.4 Ų145.482%0.81879%0.792SS**  -158.115757.9-109.7-44.4000116.1
347K25.4Very low28.7Very low197 Ų197143.2 Ų143.286%0.85779%0.79SS**  trans-77.4141.2171.8-80.3170.7166.6173.50112.2
348V28.8Very low28.7Very low151 Ų151147.6 Ų147.692%0.91580%0.796SS**  trans-142.4141.4132.9-179.60000108.3
349S24.3Very low29.1Very low87 Ų87145.7 Ų145.761%0.60879%0.787SS**  trans-104.8147.1-174.9-179.70000112.5
350S30.7Very low29.1Very low121 Ų121145.2 Ų145.285%0.84679%0.786SS**  trans-146.7127.8142.954.60000110.1
351H25.9Very low29.3Very low164 Ų164144 Ų14476%0.75978%0.78SS**  trans-83135.9-172.4-78.9-99.5000112.8
352F26.3Very low29.6Very low197 Ų197147.3 Ų147.386%0.86479%0.786SS**  -153.5111.4129.8-157.7-104.3000109.7V354F352-V354 HydrophobicContact CD1-CG2 4.07Å; F352-V354 HydrophobicContact CE1-CG2 3.51Å; F352-V354 HydrophobicContact CZ-CG2 4.21Å
353E24.2Very low29.4Very low150 Ų150143 Ų14370%0.70178%0.782SS**  trans-118.3125.9-179.1-174.6-174.4151.500108.8
354V29.2Very low29.6Very low115 Ų115143.6 Ų143.670%0.69779%0.785SS**  trans-123.7117.5169.3179.70000107.8F352F352-V354 HydrophobicContact CD1-CG2 4.07Å; F352-V354 HydrophobicContact CE1-CG2 3.51Å; F352-V354 HydrophobicContact CZ-CG2 4.21Å
355K28.6Very low29.7Very low170 Ų170147.8 Ų147.874%0.73980%0.797SS**  trans-70147.3-178.5-74.8174.4170.7174.50112
356P28.2Very low29.7Very low131 Ų131150.2 Ų150.285%0.85180%0.8SS**  trans-79.3136.8165.433.2-31.8000110.7
357S33.4Very low29.6Very low118 Ų118149.6 Ų149.683%0.82580%0.796SS**  trans-104.8130.2164.853.80000109.5
358N33.4Very low29.8Very low164 Ų164148.1 Ų148.188%0.87779%0.792SS**  trans-71.7161.6-179.4-131.223.8000111.5
359P36.4Very low29.7Very low98 Ų98146.4 Ų146.464%0.63678%0.778SS**  trans-87.8156.7-170.536.5-34.8000112.6
360D32.7Very low29.8Very low157 Ų157149.4 Ų149.484%0.8479%0.787SS**  trans-163.3149.1134.6-102.2-30.7000112.8
361E32.5Very low29.7Very low172 Ų172154.2 Ų154.280%0.80479%0.787SS**  trans59.5146.1160-61.6-164.7137.600124.2
362T35.1Very low29.7Very low141 Ų141151.4 Ų151.487%0.86578%0.781SS**  trans73.7110.4171.470.40000117.8
363G27.5Very low29.9Very low76 Ų76149.4 Ų149.478%0.78478%0.778SS**  trans-86.9133-175.100000114.3
364H32.6Very low30Very low175 Ų175149.3 Ų149.381%0.8178%0.782SS**  trans-143.2105.4153.7-108.550.1000109.1R366H364-R366 PolarHBondContact O-N 3.06Å; H364-R366 VanDerWaalsContact O-N 3.13Å
365K29.4Very low30Very low209 Ų209154.2 Ų154.291%0.90979%0.79SS**  trans-69.2106.6170.7-81.2-173.4176.8179.60109.1
366R26.6Very low29.8Very low208 Ų208151.3 Ų151.379%0.78579%0.791SS**  trans-140.7157.8166.1-122.3178.2-177.4156.32108.6H364H364-R366 PolarHBondContact O-N 3.06Å; H364-R366 VanDerWaalsContact O-N 3.13Å
367N29.5Very low30Very low141 Ų141150.4 Ų150.475%0.75479%0.788SS**  trans74.4144.8170.7-57.2-8.4000115.5
368Q30Very low29.7Very low165 Ų165149.8 Ų149.877%0.77178%0.783SS**  cis-142.2172.1-31.3-45.6-168.2-13.600106.7
369L27.6Very low29.6Very low116 Ų116150.1 Ų150.161%0.60779%0.785SS**  cis-148.9149.8-10.1-158.185.7000106.2
370N27.1Very low29.2Very low150 Ų150153.5 Ų153.580%0.80279%0.793SS**  trans-108.4116.8171.6-108.5-10.4000110.4V372N370-V372 PolarHBondContact O-N 2.96Å
371W26.7Very low29.3Very low222 Ų222153.5 Ų153.584%0.84179%0.793SS**  trans-85.786.7166.4-79.999.5000109.9
372V27.8Very low29.2Very low104 Ų104149.4 Ų149.463%0.6379%0.788SS**  trans-87109.1163.81780000107.5N370 D374N370-V372 PolarHBondContact O-N 2.96Å; V372-D374 VanDerWaalsContact C-N 3.32Å; V372-D374 HydrophobicContact CG1-CB 4.36Å; V372-D374 PolarHBondContact O-N 3.48Å; V372-D374 VanDerWaalsContact O-N 3.16Å
373L28.6Very low28.9Very low155 Ų155150.2 Ų150.281%0.81279%0.786SS**  trans-79.386.5165-74.1171.2000108
374D27.2Very low29.3Very low148 Ų148152.7 Ų152.779%0.79179%0.786SS**  trans-79.6117.4168.2-124.1-18.1000108.7V372 S376V372-D374 VanDerWaalsContact C-N 3.32Å; V372-D374 HydrophobicContact CG1-CB 4.36Å; V372-D374 PolarHBondContact O-N 3.48Å; V372-D374 VanDerWaalsContact O-N 3.16Å; D374-S376 PolarHBondContact O-N 2.83Å
375Y28.6Very low29.2Very low218 Ų218151.9 Ų151.986%0.85579%0.787SS**  trans-85.6105.9-178.8-133.8-94.4000108S377Y375-S377 PolarHBondContact O-N 3.33Å; Y375-S377 VanDerWaalsContact O-N 3.1Å
376S24.9Very low29.4Very low110 Ų110145.3 Ų145.377%0.76978%0.779SS**  trans-60.8114.4177.3-175.90000110.3D374D374-S376 PolarHBondContact O-N 2.83Å
377S32.1Very low29.5Very low112 Ų112140.2 Ų140.278%0.78378%0.775SS**  trans-111.6120.5159.354.20000108.2Y375Y375-S377 PolarHBondContact O-N 3.33Å; Y375-S377 VanDerWaalsContact O-N 3.1Å
378S27.2Very low29.8Very low104 Ų104142.6 Ų142.673%0.72778%0.782SS**  trans-71129.2-177-40.40000111.2
379D32.5Very low29.7Very low171 Ų171142 Ų14291%0.91478%0.784SS**  trans-147128.1149-97.9-40000109.8
380Q28.3Very low29.8Very low170 Ų170144 Ų14479%0.79479%0.794SS**  trans-96.2139.7177.6-63.6170.8-52.400108.9
381N33Very low30.2Very low157 Ų157142.9 Ų142.984%0.8479%0.793SS**  165149.2120.7-83.7-40.4000114.2
382A31.5Very low30.3Very low86 Ų86140.7 Ų140.771%0.71180%0.798SS**  trans49.2111.2159.600000118
383I29.3Very low30.5Very low158 Ų158138.6 Ų138.681%0.8180%0.797SS**  cis60.2110.746.7-43178.8000114.4
384T34.8Very low30.5Very low127 Ų127141.5 Ų141.578%0.77980%0.803SS**  trans139.5103141.1560000109.2
385D29.9Very low30.6Very low158 Ų158142.3 Ų142.385%0.84580%0.804SS**  90.7139.374.9-162.511.6000111.8
386G34.1Very low30.6Very low72 Ų72139.8 Ų139.874%0.74281%0.806SS**  trans165.167-164.700000113.8
387S28.8Very low31Very low101 Ų101140 Ų14071%0.70680%0.802SS**  trans-91.8131.8-179.241.70000112.8
388H35Very low31Very low191 Ų191139.8 Ų139.888%0.88480%0.801SS**  trans-135.4106.2166.8-87.9-77.1000111.1
389N28.5Very low31.3Very low153 Ų153141.1 Ų141.182%0.81880%0.799SS**  trans-81.6143.6163.1-79.9-41.9000109.8
390L30.8Very low31.4Very low158 Ų158138 Ų13883%0.82779%0.788SS**  167.2151.9117.2-94.2152.4000115.2
391T33.8Very low31.6Very low125 Ų125136.1 Ų136.177%0.76779%0.79SS**  trans75.596.215651.20000121.4G393T391-G393 PolarHBondContact O-N 3.48Å
392N29.8Very low31.8Very low176 Ų176135.4 Ų135.494%0.94179%0.787SS**  trans-3.295.1139-68.5-22.7000117.7
393G32.2Very low31.7Very low61 Ų61138.3 Ų138.363%0.62979%0.789SS**  trans-114.4112.9156.900000110.4T391 M395T391-G393 PolarHBondContact O-N 3.48Å; G393-M395 PolarHBondContact O-N 2.83Å
394K27.6Very low31.8Very low215 Ų215134.7 Ų134.794%0.93578%0.778SS**  trans-71.189.1172-76.8-179.3175.5177.50109.8
395M30.6Very low31.5Very low165 Ų165135 Ų13581%0.81378%0.78SS**  trans-92.8105.5169.2-100.1-178.1-91.200110.5G393 V397G393-M395 PolarHBondContact O-N 2.83Å; M395-V397 PolarHBondContact O-N 2.95Å
396N28.2Very low31.6Very low166 Ų166135.2 Ų135.289%0.88878%0.779SS**  trans-6995165.1-80.8-9.6000109S398N396-S398 PolarHBondContact O-N 3.19Å
397V33.8Very low31.5Very low114 Ų114134.3 Ų134.369%0.69177%0.771SS**  trans-84.898.9168.5-177.80000108.4M395 L399M395-V397 PolarHBondContact O-N 2.95Å; V397-L399 PolarHBondContact O-N 3.28Å
398S31Very low31.8Very low108 Ų108138 Ų13876%0.75578%0.777SS**  trans-65111.6168.352.40000109.6N396N396-S398 PolarHBondContact O-N 3.19Å
399L33.7Very low31.6Very low131 Ų131137.2 Ų137.269%0.68677%0.773SS**  trans-62.6134.8170.5-92.680.3000109.4V397V397-L399 PolarHBondContact O-N 3.28Å
400P34.4Very low32Very low107 Ų107135.2 Ų135.270%0.69577%0.769SS**  trans-65141169.927.9-33.4000109.9N402P400-N402 VanDerWaalsContact C-N 3.27Å; P400-N402 PolarHBondContact O-N 3.13Å
401P33.5Very low32.3Very low129 Ų129132.6 Ų132.684%0.83876%0.756SS**SBendtrans-7973.2-176.633.2-35.9000111
402N36.1Very low32.7Very low142 Ų142131.7 Ų131.776%0.75975%0.752SS**  trans-162.445.7171.3-107.2-28.1000113.4P400 S404P400-N402 VanDerWaalsContact C-N 3.27Å; P400-N402 PolarHBondContact O-N 3.13Å; N402-S404 VanDerWaalsContact C-N 3.3Å
403L30.7Very low33.2Very low147 Ų147128 Ų12877%0.7773%0.73SS**  trans-96.839.8169.9-150.176.6000112.3
404S29.6Very low33.6Very low82 Ų82131 Ų13157%0.57373%0.732SS**  trans-88.2116.3172.152.20000110.2N402N402-S404 VanDerWaalsContact C-N 3.3Å
405T30.5Very low34Very low133 Ų133125.2 Ų125.282%0.81672%0.718SS**  trans48.886.5169.344.20000115.2G407T405-G407 PolarHBondContact O-N 3.43Å
406I30.3Very low34.6Very low163 Ų163120.8 Ų120.884%0.83670%0.7SS**  trans-67.382.5142.2-57.6176.3000105.8E408I406-E408 PolarHBondContact O-N 3.36Å
407G32.5Very low35.4Very low54 Ų54121.3 Ų121.356%0.55770%0.695SS**  trans-60.5129.7160.700000107T405 E409T405-G407 PolarHBondContact O-N 3.43Å; G407-E409 VanDerWaalsContact C-N 3.35Å; G407-E409 PolarHBondContact O-N 3.27Å
408E34.7Very low36.3Very low179 Ų179116.8 Ų116.884%0.83667%0.667SS**  trans-59.297.9173.2-164.8168.2-151.800107.2I406I406-E408 PolarHBondContact O-N 3.36Å
409E31.4Very low37.8Very low173 Ų173118.1 Ų118.181%0.80866%0.655SS**  trans-57.2124.5174.4-103.9-162.9151.400106.8G407 D411G407-E409 VanDerWaalsContact C-N 3.35Å; G407-E409 PolarHBondContact O-N 3.27Å; E409-D411 PolarHBondContact O-N 3.39Å
410P37.3Very low39.3Very low112 Ų112116.7 Ų116.773%0.72765%0.654SS**  trans-62115.8-178.924.7-32.6000108.1P412P410-P412 VanDerWaalsContact O-N 3.15Å
411D37.1Very low40.8Very low103 Ų103113 Ų11355%0.55163%0.632SS**  trans-40.9120.6-177.4-176.5-5.7000109.4E409 M413 D414E409-D411 PolarHBondContact O-N 3.39Å; D411-M413 PolarHBondContact O-N 3.43Å; D411-M413 PolarHBondContact OD1-N 3.16Å; D411-D414 PolarHBondContact O-N 3.48Å
412P41.6Very low42.5Very low105 Ų105108 Ų10868%0.68260%0.597SS**G310 helixtrans-52.9-18.1-172.5-30.435.7000114.2P410 D414 S415P410-P412 VanDerWaalsContact O-N 3.15Å; P412-D414 VanDerWaalsContact C-N 3.34Å; P412-D414 PolarHBondContact O-N 2.85Å; P412-S415 PolarHBondContact O-OG 3.21Å
413M40.2Very low44.1Very low98 Ų98102.2 Ų102.248%0.48357%0.57SS.*G310 helixtrans-68.8-18.8175-126.4166.445.100116D411 S415 K516D411-M413 PolarHBondContact O-N 3.43Å; D411-M413 PolarHBondContact OD1-N 3.16Å; M413-S415 VanDerWaalsContact C-N 3.35Å; M413-S415 PolarHBondContact O-N 3.05Å; M413-K516 VanDerWaalsContact CG-NZ 3.32Å; M413-K516 HydrophobicContact SD-CD 3.8Å; M413-K516 PolarHBondContact SD-NZ 2.79Å
414D40.4Very low46Very low125 Ų12598.7 Ų98.767%0.66855%0.549SS*.G310 helixtrans-78.8-19-175-124.1-7.4000113.5D411 P412 R509D411-D414 PolarHBondContact O-N 3.48Å; P412-D414 VanDerWaalsContact C-N 3.34Å; P412-D414 PolarHBondContact O-N 2.85Å; D414-R509 PolarHBondContact O-NH2 3.02Å; D414-R509 VanDerWaalsContact O-NH2 3.15Å
415S36.7Very low48.2Very low93 Ų9394.8 Ų94.865%0.6552%0.522SS*.G310 helixtrans-90.4-10.5-173.570.60000116.3P412 M413 K417P412-S415 PolarHBondContact O-OG 3.21Å; M413-S415 VanDerWaalsContact C-N 3.35Å; M413-S415 PolarHBondContact O-N 3.05Å; S415-K417 VanDerWaalsContact C-N 3.35Å; S415-K417 PolarHBondContact O-N 3.12Å
416V42.4Very low50.6Low72 Ų7289.1 Ų89.144%0.43649%0.486SS..  trans-7288.9178.9-173.20000110.2R509V416-R509 PolarHBondContact O-NE 3.32Å; V416-R509 PolarHBondContact O-NH2 3.16Å
417K46.4Very low53.1Low177 Ų17782.4 Ų82.477%0.7745%0.454SS*.PPolyproline II helixtrans-88.1144.9164.5-69.6173.9179.6170.10108.8S415S415-K417 VanDerWaalsContact C-N 3.35Å; S415-K417 PolarHBondContact O-N 3.12Å
418D52.7Low55.5Low20 Ų2080.4 Ų80.411%0.10743%0.431CS..PPolyproline II helixtrans-54.4144.8172.6-67.1-14.7000111.3A423 S506 S508D418-A423 HydrophobicContact CB-CB 3.88Å; D418-S506 PolarHBondContact OD2-OG 3.08Å; D418-S508 WeakPolarHBondContact OD1-CB 3.49Å; D418-S508 PolarHBondContact OD1-OG 3.2Å; D418-S508 PolarHBondContact OD2-N 3.29Å
419R62Low57.9Low135 Ų13572.9 Ų72.951%0.50940%0.397SS..PPolyproline II helixtrans-61.8129.4166.2-61-176-79.4-165.7-8.7105.9A421 E422 A423R419-A421 PolarHBondContact O-N 3.05Å; R419-E422 HydrophobicContact CB-CG 4.19Å; R419-E422 VanDerWaalsContact CB-OE2 3.28Å; R419-E422 WeakPolarHBondContact CB-OE2 3.41Å; R419-E422 IonicContact CZ-OE1 2.73Å; R419-E422 PolarHBondContact N-OE2 3.12Å; R419-E422 IonicContact NE-OE1 3.08Å; R419-E422 PolarHBondContact NE-OE1 3.48Å; R419-E422 IonicContact NE-OE2 3.75Å; R419-E422 IonicContact NH2-OE1 2.76Å; R419-E422 PolarHBondContact NH2-OE1 2.83Å; R419-E422 WeakPolarHBondContact O-CB 3.45Å; R419-E422 PolarHBondContact O-N 3.3Å; R419-A423 PolarHBondContact O-N 3.26Å
420P64.2Low60.5Low102 Ų10266 Ų6666%0.66237%0.365SS*.Hα-helixtrans-60.4-23.3-16519.7-32.5000113.9Q424P420-Q424 WeakPolarHBondContact O-CG 3.46Å; P420-Q424 PolarHBondContact O-N 3.15Å
421A66.2Low63Low28 Ų2863.1 Ų63.123%0.23134%0.343CS..Hα-helixtrans-65.5-42.1171.300000113.7L180 I247 R419 Q424 V425L180-A421 HydrophobicContact CD1-CB 4.38Å; L180-A421 HydrophobicContact CD2-CB 4.25Å; I247-A421 HydrophobicContact CG2-CB 3.46Å; I247-A421 VanDerWaalsContact CG2-CB 3.46Å; R419-A421 PolarHBondContact O-N 3.05Å; A421-Q424 PolarHBondContact O-N 3.35Å; A421-V425 PolarHBondContact O-N 3.25Å
422E69.4Low65.5Low24 Ų2459 Ų5911%0.11232%0.32CS..Hα-helixtrans-67.6-48.6-178.7-61.4162.1158.500110.1P179 R419 Q424 V425 F426P179-E422 HydrophobicContact CG-CG 4.1Å; P179-E422 WeakPolarHBondContact CG-OE1 3.46Å; R419-E422 HydrophobicContact CB-CG 4.19Å; R419-E422 VanDerWaalsContact CB-OE2 3.28Å; R419-E422 WeakPolarHBondContact CB-OE2 3.41Å; R419-E422 IonicContact CZ-OE1 2.73Å; R419-E422 PolarHBondContact N-OE2 3.12Å; R419-E422 IonicContact NE-OE1 3.08Å; R419-E422 PolarHBondContact NE-OE1 3.48Å; R419-E422 IonicContact NE-OE2 3.75Å; R419-E422 IonicContact NH2-OE1 2.76Å; R419-E422 PolarHBondContact NH2-OE1 2.83Å; R419-E422 WeakPolarHBondContact O-CB 3.45Å; R419-E422 PolarHBondContact O-N 3.3Å; E422-Q424 PolarHBondContact O-N 3.17Å; E422-V425 PolarHBondContact O-N 3.28Å; E422-F426 HydrophobicContact CB-CD2 4.39Å; E422-F426 HydrophobicContact CB-CE2 4.37Å; E422-F426 WeakPolarHBondContact O-CD2 3.4Å; E422-F426 PolarHBondContact O-N 3.03Å
423A69.4Low67.7Low22 Ų2258.7 Ų58.718%0.18232%0.316CS..Hα-helixtrans-55.7-35.217800000112.5D418 R419 S427 P507D418-A423 HydrophobicContact CB-CB 3.88Å; R419-A423 PolarHBondContact O-N 3.26Å; A423-S427 VanDerWaalsContact O-CB 3.26Å; A423-S427 WeakPolarHBondContact O-CB 3.3Å; A423-S427 PolarHBondContact O-N 2.76Å; A423-S427 PolarHBondContact O-OG 2.99Å; A423-P507 HydrophobicContact CB-CG 4.45Å
424Q71.4Confident70.1Confident72 Ų7254.2 Ų54.234%0.33630%0.295SS..Hα-helixtrans-68.9-29.8175.2-74.6-176.247.900113.8I247 P420 A421 E422 S427 S428I247-Q424 HydrophobicContact CD1-CB 4.03Å; I247-Q424 HydrophobicContact CG1-CB 3.94Å; P420-Q424 WeakPolarHBondContact O-CG 3.46Å; P420-Q424 PolarHBondContact O-N 3.15Å; A421-Q424 PolarHBondContact O-N 3.35Å; E422-Q424 PolarHBondContact O-N 3.17Å; Q424-S427 PolarHBondContact O-OG 3.2Å; Q424-S428 PolarHBondContact O-OG 2.96Å
425V76.1Confident72.5Confident0 Ų049.9 Ų49.90%027%0.273CS..Hα-helixtrans-74.5-49.4172.3171.90000110.6L180 A183 L184 I187 I247 A421 E422 S427 S428 L429L180-V425 HydrophobicContact CD1-CG2 3.7Å; A183-V425 HydrophobicContact CB-CB 4.34Å; A183-V425 HydrophobicContact CB-CG1 3.62Å; L184-V425 HydrophobicContact CD2-CG2 3.94Å; L184-V425 HydrophobicContact CG-CG2 4.23Å; I187-V425 HydrophobicContact CD1-CG1 3.68Å; I187-V425 HydrophobicContact CG1-CG1 3.97Å; I247-V425 HydrophobicContact CD1-CG2 3.65Å; A421-V425 PolarHBondContact O-N 3.25Å; E422-V425 PolarHBondContact O-N 3.28Å; V425-S427 VanDerWaalsContact C-N 3.28Å; V425-S427 PolarHBondContact O-N 2.86Å; V425-S428 WeakPolarHBondContact O-CB 3.41Å; V425-S428 PolarHBondContact O-N 3.08Å; V425-S428 VanDerWaalsContact O-N 3.13Å; V425-L429 PolarHBondContact O-N 3.29Å
426F80.2Confident75.1Confident14 Ų1447.5 Ų47.56%0.06125%0.251CS..Hα-helixtrans-61.9-34.9-179.9-73.9-72.7000112.5M169 V173 L174 E422 S428 L429 Q430 P507 I511M169-F426 HydrophobicContact CE-CD1 4.36Å; M169-F426 HydrophobicContact CE-CE1 3.44Å; M169-F426 VanDerWaalsContact CE-CE1 3.44Å; M169-F426 HydrophobicContact CE-CZ 4.02Å; V173-F426 HydrophobicContact CG1-CZ 4.2Å; L174-F426 HydrophobicContact CD2-CE2 4.06Å; L174-F426 HydrophobicContact CD2-CZ 3.85Å; E422-F426 HydrophobicContact CB-CD2 4.39Å; E422-F426 HydrophobicContact CB-CE2 4.37Å; E422-F426 WeakPolarHBondContact O-CD2 3.4Å; E422-F426 PolarHBondContact O-N 3.03Å; F426-S428 VanDerWaalsContact C-N 3.28Å; F426-S428 PolarHBondContact O-N 3.02Å; F426-L429 PolarHBondContact O-N 3.35Å; F426-L429 VanDerWaalsContact O-N 3.16Å; F426-Q430 WeakPolarHBondContact O-CB 3.21Å; F426-Q430 PolarHBondContact O-N 2.9Å; F426-P507 HydrophobicContact CB-CB 4.11Å; F426-I511 HydrophobicContact CD1-CD1 3.75Å; F426-I511 HydrophobicContact CE1-CD1 3.49Å; F426-I511 VanDerWaalsContact CE1-CD1 3.49Å; F426-I511 HydrophobicContact CZ-CD1 4.31Å
427S83.5Confident77.4Confident23 Ų2345.6 Ų45.616%0.16125%0.246CC..Hα-helixtrans-60.5-35175.671.10000113.2A423 Q424 V425 Q430 I431A423-S427 VanDerWaalsContact O-CB 3.26Å; A423-S427 WeakPolarHBondContact O-CB 3.3Å; A423-S427 PolarHBondContact O-N 2.76Å; A423-S427 PolarHBondContact O-OG 2.99Å; Q424-S427 PolarHBondContact O-OG 3.2Å; V425-S427 VanDerWaalsContact C-N 3.28Å; V425-S427 PolarHBondContact O-N 2.86Å; S427-Q430 PolarHBondContact O-N 3.37Å; S427-I431 VanDerWaalsContact O-CG1 3.32Å; S427-I431 WeakPolarHBondContact O-CG1 3.43Å; S427-I431 PolarHBondContact O-N 3.41Å
428S82.7Confident79.6Confident12 Ų1237.2 Ų37.28%0.08421%0.21CC..Hα-helixtrans-67.7-39.4176-61.50000112.2Q424 V425 F426 L432Q424-S428 PolarHBondContact O-OG 2.96Å; V425-S428 WeakPolarHBondContact O-CB 3.41Å; V425-S428 PolarHBondContact O-N 3.08Å; V425-S428 VanDerWaalsContact O-N 3.13Å; F426-S428 VanDerWaalsContact C-N 3.28Å; F426-S428 PolarHBondContact O-N 3.02Å; S428-L432 PolarHBondContact O-N 2.92Å
429L84.2Confident81.6Confident21 Ų2137.1 Ų37.111%0.1121%0.208CC..Hα-helixtrans-70.1-33.6174-67.4170.9000111.6M169 F190 F191 V425 F426 L432 T433M169-L429 HydrophobicContact CE-CD1 4.26Å; F190-L429 HydrophobicContact CB-CD2 3.75Å; F190-L429 HydrophobicContact CD2-CD2 4.2Å; F190-L429 HydrophobicContact CG-CD2 4.12Å; F191-L429 HydrophobicContact CD2-CD2 4.31Å; F191-L429 HydrophobicContact CE2-CD2 4.11Å; V425-L429 PolarHBondContact O-N 3.29Å; F426-L429 PolarHBondContact O-N 3.35Å; F426-L429 VanDerWaalsContact O-N 3.16Å; L429-L432 WeakPolarHBondContact O-CB 3.46Å; L429-L432 PolarHBondContact O-N 3.16Å; L429-T433 PolarHBondContact O-N 2.92Å; L429-T433 PolarHBondContact O-OG1 3.19Å
430Q87Confident83Confident29 Ų2932.3 Ų32.314%0.13620%0.198CC..Hα-helixtrans-67.8-43.6176.9-164.9-177-3.300111.9T36 F426 S427 L432 T433 A434T36-Q430 PolarHBondContact O-NE2 2.94Å; T36-Q430 PolarHBondContact OG1-NE2 2.81Å; F426-Q430 WeakPolarHBondContact O-CB 3.21Å; F426-Q430 PolarHBondContact O-N 2.9Å; S427-Q430 PolarHBondContact O-N 3.37Å; Q430-L432 VanDerWaalsContact C-N 3.31Å; Q430-L432 PolarHBondContact O-N 2.85Å; Q430-T433 PolarHBondContact O-N 3.47Å; Q430-A434 WeakPolarHBondContact O-CB 3.44Å; Q430-A434 PolarHBondContact O-N 3.39Å
431I89.9Confident84.3Confident51 Ų5128.5 Ų28.526%0.26217%0.171SC..Hα-helixtrans-59.6-43.5173.5-66.2164.9000110.5V42 L43 L51 S427 A434 V435V42-I431 HydrophobicContact CG1-CD1 3.6Å; V42-I431 HydrophobicContact CG1-CG1 3.49Å; V42-I431 VanDerWaalsContact CG1-CG1 3.49Å; L43-I431 HydrophobicContact CD1-CG1 4.2Å; L43-I431 HydrophobicContact CD2-CD1 3.97Å; L43-I431 HydrophobicContact CD2-CG1 4.04Å; L43-I431 HydrophobicContact CG-CD1 4.4Å; L43-I431 HydrophobicContact CG-CG1 4.01Å; L51-I431 HydrophobicContact CD1-CG2 4.45Å; S427-I431 VanDerWaalsContact O-CG1 3.32Å; S427-I431 WeakPolarHBondContact O-CG1 3.43Å; S427-I431 PolarHBondContact O-N 3.41Å; I431-A434 PolarHBondContact O-N 3.46Å; I431-V435 HydrophobicContact CG2-CG2 4.36Å; I431-V435 WeakPolarHBondContact O-CB 3.38Å; I431-V435 WeakPolarHBondContact O-CG2 3.11Å; I431-V435 PolarHBondContact O-N 2.91Å
432L89Confident85.5Confident16 Ų1627.2 Ų27.28%0.08416%0.16CC..Hα-helixtrans-56.6-52.3176.3-176.677000111.1F191 V194 S428 L429 Q430 A434 V435 F436F191-L432 HydrophobicContact CD1-CD1 3.73Å; F191-L432 HydrophobicContact CD1-CD2 4.39Å; F191-L432 HydrophobicContact CD2-CD1 4.41Å; F191-L432 HydrophobicContact CD2-CD2 3.65Å; F191-L432 HydrophobicContact CE1-CD1 3.67Å; F191-L432 HydrophobicContact CE2-CB 4.29Å; F191-L432 HydrophobicContact CE2-CD1 4.34Å; F191-L432 HydrophobicContact CE2-CD2 3.83Å; F191-L432 HydrophobicContact CE2-CG 4.39Å; F191-L432 HydrophobicContact CG-CD1 4.12Å; F191-L432 HydrophobicContact CG-CD2 3.95Å; F191-L432 HydrophobicContact CZ-CB 4.17Å; F191-L432 HydrophobicContact CZ-CD1 3.98Å; F191-L432 HydrophobicContact CZ-CD2 4.3Å; F191-L432 HydrophobicContact CZ-CG 4.39Å; V194-L432 HydrophobicContact CB-CD2 4.3Å; V194-L432 HydrophobicContact CG2-CD2 4.13Å; S428-L432 PolarHBondContact O-N 2.92Å; L429-L432 WeakPolarHBondContact O-CB 3.46Å; L429-L432 PolarHBondContact O-N 3.16Å; Q430-L432 VanDerWaalsContact C-N 3.31Å; Q430-L432 PolarHBondContact O-N 2.85Å; L432-A434 VanDerWaalsContact C-N 3.32Å; L432-A434 PolarHBondContact O-N 2.93Å; L432-V435 PolarHBondContact O-N 3.5Å; L432-F436 HydrophobicContact CD1-CD2 3.75Å; L432-F436 HydrophobicContact CD1-CE2 3.51Å; L432-F436 HydrophobicContact CG-CD2 4.03Å; L432-F436 HydrophobicContact CG-CE2 4.28Å; L432-F436 WeakPolarHBondContact O-CD2 3.47Å; L432-F436 PolarHBondContact O-N 3.44Å
433T86.9Confident86.6Confident98 Ų9826 Ų2660%0.60116%0.155SC*.Hα-helixtrans-62.3-38.8-179.6-55.30000111.9L429 Q430 G437L429-T433 PolarHBondContact O-N 2.92Å; L429-T433 PolarHBondContact O-OG1 3.19Å; Q430-T433 PolarHBondContact O-N 3.47Å; T433-G437 PolarHBondContact O-N 3.12Å
434A90.5Very high87.7Confident4 Ų428.6 Ų28.63%0.03317%0.165CC..Hα-helixtrans-65.9-43.4176.300000112.8S33 F34 Q430 I431 L432 S438S33-A434 WeakPolarHBondContact O-CB 3.48Å; F34-A434 HydrophobicContact CD1-CB 3.82Å; F34-A434 HydrophobicContact CE1-CB 3.79Å; F34-A434 HydrophobicContact CG-CB 4.37Å; F34-A434 HydrophobicContact CZ-CB 4.32Å; Q430-A434 WeakPolarHBondContact O-CB 3.44Å; Q430-A434 PolarHBondContact O-N 3.39Å; I431-A434 PolarHBondContact O-N 3.46Å; L432-A434 VanDerWaalsContact C-N 3.32Å; L432-A434 PolarHBondContact O-N 2.93Å; A434-S438 VanDerWaalsContact O-CB 3.31Å; A434-S438 WeakPolarHBondContact O-CB 3.29Å; A434-S438 PolarHBondContact O-N 3.33Å
435V92.8Very high88.7Confident34 Ų3426 Ų2621%0.20615%0.154CC..Hα-helixtrans-59.8-49.5175.8156.70000111.3F34 L51 I431 L432 S438 F439F34-V435 HydrophobicContact CZ-CG2 4.35Å; L51-V435 HydrophobicContact CB-CG2 4.47Å; L51-V435 HydrophobicContact CD1-CG2 4.36Å; L51-V435 HydrophobicContact CD2-CG2 4.36Å; I431-V435 HydrophobicContact CG2-CG2 4.36Å; I431-V435 WeakPolarHBondContact O-CB 3.38Å; I431-V435 WeakPolarHBondContact O-CG2 3.11Å; I431-V435 PolarHBondContact O-N 2.91Å; L432-V435 PolarHBondContact O-N 3.5Å; V435-S438 PolarHBondContact O-N 2.91Å; V435-F439 PolarHBondContact O-N 3.32Å
436F90.2Very high89.6Confident44 Ų4426 Ų2619%0.19315%0.154CC..Hα-helixtrans-76.4-30.9-178.8-79-73.5000113.6V194 V195 N198 L432 F439 A440V194-F436 HydrophobicContact CB-CD2 4.42Å; V194-F436 HydrophobicContact CG1-CB 3.8Å; V194-F436 HydrophobicContact CG1-CD1 3.94Å; V194-F436 HydrophobicContact CG1-CD2 3.21Å; V194-F436 HydrophobicContact CG1-CE1 4.31Å; V194-F436 HydrophobicContact CG1-CE2 3.65Å; V194-F436 HydrophobicContact CG1-CG 3.35Å; V194-F436 HydrophobicContact CG1-CZ 4.17Å; V195-F436 HydrophobicContact CG2-CZ 3.97Å; N198-F436 HydrophobicContact CB-CD1 3.89Å; N198-F436 HydrophobicContact CB-CE1 3.77Å; N198-F436 VanDerWaalsContact ND2-CD1 3.3Å; N198-F436 WeakPolarHBondContact ND2-CD1 3.5Å; L432-F436 HydrophobicContact CD1-CD2 3.75Å; L432-F436 HydrophobicContact CD1-CE2 3.51Å; L432-F436 HydrophobicContact CG-CD2 4.03Å; L432-F436 HydrophobicContact CG-CE2 4.28Å; L432-F436 WeakPolarHBondContact O-CD2 3.47Å; L432-F436 PolarHBondContact O-N 3.44Å; F436-F439 PolarHBondContact O-N 3.49Å; F436-A440 PolarHBondContact O-N 3Å
437G90.4Very high90.3Very high32 Ų3225.4 Ų25.433%0.3315%0.151SC..Hα-helixtrans-58.5-47.5168.700000111.5T433 F439 A440 H441T433-G437 PolarHBondContact O-N 3.12Å; G437-F439 PolarHBondContact O-N 3.29Å; G437-A440 PolarHBondContact O-N 3.13Å; G437-H441 WeakPolarHBondContact O-CB 2.81Å; G437-H441 PolarHBondContact O-N 2.93Å
438S93.2Very high90.9Very high0 Ų024.3 Ų24.30%014%0.143CC..Hα-helixtrans-67.7-33177.1-179.40000113.4S33 F34 C55 E56 A434 V435 G442S33-S438 WeakPolarHBondContact OG-CA 3.29Å; S33-S438 PolarHBondContact OG-N 2.98Å; S33-S438 VanDerWaalsContact OG-N 3.15Å; F34-S438 VanDerWaalsContact CE2-CB 3.47Å; C55-S438 WeakPolarHBondContact CB-OG 3.33Å; E56-S438 VanDerWaalsContact CD-OG 3.32Å; E56-S438 WeakPolarHBondContact CG-OG 3.44Å; E56-S438 WeakPolarHBondContact OE1-CA 3.27Å; E56-S438 WeakPolarHBondContact OE1-CB 3.36Å; E56-S438 VanDerWaalsContact OE1-O 3.13Å; E56-S438 PolarHBondContact OE1-OG 2.72Å; A434-S438 VanDerWaalsContact O-CB 3.31Å; A434-S438 WeakPolarHBondContact O-CB 3.29Å; A434-S438 PolarHBondContact O-N 3.33Å; V435-S438 PolarHBondContact O-N 2.91Å; S438-G442 PolarHBondContact O-N 3.06Å
439F93.8Very high91.5Very high18 Ų1823.7 Ų23.78%0.07914%0.139CC..Hα-helixtrans-65.7-47.9172.8179-97.5000112.1C55 S58 G59 L62 L63 I202 V435 F436 G437 H441 G443C55-F439 HydrophobicContact CB-CB 4.26Å; S58-F439 VanDerWaalsContact C-CE2 3.48Å; G59-F439 VanDerWaalsContact CA-CE2 3.46Å; G59-F439 VanDerWaalsContact CA-O 3.23Å; G59-F439 WeakPolarHBondContact CA-O 3.23Å; G59-F439 VanDerWaalsContact N-CE2 3.34Å; L62-F439 HydrophobicContact CB-CE2 4.47Å; L62-F439 HydrophobicContact CB-CZ 4.09Å; L62-F439 HydrophobicContact CD1-CE2 4.07Å; L62-F439 HydrophobicContact CD1-CZ 4.09Å; L63-F439 HydrophobicContact CD1-CD1 4.21Å; L63-F439 HydrophobicContact CD1-CE1 3.6Å; L63-F439 HydrophobicContact CD1-CZ 4.22Å; L63-F439 HydrophobicContact CG-CE1 4.2Å; L63-F439 HydrophobicContact CG-CZ 4.37Å; I202-F439 HydrophobicContact CD1-CE1 3.8Å; I202-F439 HydrophobicContact CD1-CZ 3.53Å; I202-F439 HydrophobicContact CG1-CE1 3.92Å; I202-F439 HydrophobicContact CG1-CZ 3.75Å; V435-F439 PolarHBondContact O-N 3.32Å; F436-F439 PolarHBondContact O-N 3.49Å; G437-F439 PolarHBondContact O-N 3.29Å; F439-H441 VanDerWaalsContact C-N 3.33Å; F439-G443 PolarHBondContact O-N 3.45Å
440A91.2Very high92.1Very high35 Ų3522.7 Ų22.729%0.28913%0.134SC..Hα-helixtrans-65.2-39.4176.300000111.8F436 G437 G443 N444F436-A440 PolarHBondContact O-N 3Å; G437-A440 PolarHBondContact O-N 3.13Å; A440-G443 PolarHBondContact O-N 3.4Å; A440-N444 PolarHBondContact O-N 2.93Å; A440-N444 VanDerWaalsContact O-N 3.11Å; A440-N444 PolarHBondContact O-ND2 3.16Å
441H91.8Very high92.4Very high22 Ų2221.3 Ų21.310%0.10213%0.128CC..Hα-helixtrans-58.1-52.9175.4-177.3-91.4000111.8D29 E56 G437 F439 G443 N444 D445D29-H441 VanDerWaalsContact CB-CE1 3.43Å; D29-H441 WeakPolarHBondContact CB-CE1 3.38Å; D29-H441 WeakPolarHBondContact CB-NE2 3.3Å; E56-H441 IonicContact OE1-CG 3.39Å; E56-H441 IonicContact OE1-ND1 3.71Å; E56-H441 PolarHBondContact OE1-ND1 3Å; E56-H441 IonicContact OE2-CE1 3.68Å; E56-H441 IonicContact OE2-CG 2.78Å; E56-H441 IonicContact OE2-ND1 3.88Å; E56-H441 PolarHBondContact OE2-ND1 2.96Å; G437-H441 WeakPolarHBondContact O-CB 2.81Å; G437-H441 PolarHBondContact O-N 2.93Å; F439-H441 VanDerWaalsContact C-N 3.33Å; H441-G443 PolarHBondContact O-N 3.43Å; H441-G443 VanDerWaalsContact O-N 3.14Å; H441-N444 PolarHBondContact O-N 2.94Å; H441-D445 IonicContact CD2-OD1 3.68Å; H441-D445 IonicContact NE2-OD1 3.74Å; H441-D445 IonicContact NE2-OD2 3.92Å; H441-D445 PolarHBondContact O-N 3.36Å
442G93Very high92.6Very high0 Ų018.9 Ų18.90%012%0.115CC..Hα-helixtrans-58.6-31.7-179.600000114.1E56 S60 S438 V446E56-G442 WeakPolarHBondContact OE2-CA 3.31Å; E56-G442 PolarHBondContact OE2-N 3.02Å; E56-G442 VanDerWaalsContact OE2-N 3.11Å; S60-G442 VanDerWaalsContact CA-O 3.24Å; S60-G442 WeakPolarHBondContact CA-O 3.41Å; S60-G442 WeakPolarHBondContact CB-O 3.36Å; S60-G442 PolarHBondContact N-O 3.08Å; S438-G442 PolarHBondContact O-N 3.06Å; G442-V446 VanDerWaalsContact O-CB 3.22Å; G442-V446 WeakPolarHBondContact O-CB 3.47Å; G442-V446 WeakPolarHBondContact O-CG1 3.48Å; G442-V446 PolarHBondContact O-N 2.86Å
443G91.4Very high93Very high0 Ų018.1 Ų18.10%011%0.111CC..Hα-helixtrans-69.7-47.5172.900000113.3G59 G64 F439 A440 H441 S447G59-G443 VanDerWaalsContact C-CA 3.49Å; G59-G443 VanDerWaalsContact O-CA 3.26Å; G59-G443 WeakPolarHBondContact O-CA 3.33Å; G64-G443 VanDerWaalsContact CA-O 3.22Å; G64-G443 WeakPolarHBondContact CA-O 3.41Å; F439-G443 PolarHBondContact O-N 3.45Å; A440-G443 PolarHBondContact O-N 3.4Å; H441-G443 PolarHBondContact O-N 3.43Å; H441-G443 VanDerWaalsContact O-N 3.14Å; G443-S447 PolarHBondContact O-OG 2.72Å
444N92.6Very high93.3Very high76 Ų7613.6 Ų13.641%0.4068%0.083SC..Hα-helixtrans-67.1-54.2179.8-69.3-25000111.3A440 H441 S447A440-N444 PolarHBondContact O-N 2.93Å; A440-N444 VanDerWaalsContact O-N 3.11Å; A440-N444 PolarHBondContact O-ND2 3.16Å; H441-N444 PolarHBondContact O-N 2.94Å; N444-S447 WeakPolarHBondContact O-CB 3.21Å; N444-S447 PolarHBondContact O-N 3.43Å; N444-S447 PolarHBondContact O-OG 2.99Å
445D93.1Very high93.4Very high18 Ų1813.5 Ų13.510%0.0968%0.083CC..Hα-helixtrans-85.8-23.1-161.9-79.569.1000113.3I25 H441 S447 N448I25-D445 WeakPolarHBondContact CD1-O 3.19Å; I25-D445 HydrophobicContact CG2-CB 3.81Å; H441-D445 IonicContact CD2-OD1 3.68Å; H441-D445 IonicContact NE2-OD1 3.74Å; H441-D445 IonicContact NE2-OD2 3.92Å; H441-D445 PolarHBondContact O-N 3.36Å; D445-S447 PolarHBondContact O-N 3.4Å; D445-S447 VanDerWaalsContact O-N 3.14Å; D445-N448 WeakPolarHBondContact O-CB 3.24Å; D445-N448 PolarHBondContact O-N 3.29Å; D445-N448 VanDerWaalsContact O-N 3.08Å; D445-N448 PolarHBondContact OD2-ND2 3.43Å; D445-N448 VanDerWaalsContact OD2-ND2 3.14Å
446V95.1Very high93.5Very high0 Ų011.9 Ų11.90%07%0.073CC..Hα-helixtrans-56.8-32.1166.977.90000111.7S60 G442 N448 A449 I450 L476 I483S60-V446 WeakPolarHBondContact OG-CG2 3.49Å; G442-V446 VanDerWaalsContact O-CB 3.22Å; G442-V446 WeakPolarHBondContact O-CB 3.47Å; G442-V446 WeakPolarHBondContact O-CG1 3.48Å; G442-V446 PolarHBondContact O-N 2.86Å; V446-N448 PolarHBondContact O-N 2.89Å; V446-A449 PolarHBondContact O-N 2.86Å; V446-A449 VanDerWaalsContact O-N 3.12Å; V446-I450 HydrophobicContact CG2-CB 4.3Å; V446-I450 HydrophobicContact CG2-CG1 3.58Å; V446-I450 VanDerWaalsContact O-CB 3.28Å; V446-I450 WeakPolarHBondContact O-CB 3.47Å; V446-I450 WeakPolarHBondContact O-CG1 3.4Å; V446-I450 PolarHBondContact O-N 3.49Å; V446-L476 HydrophobicContact CG1-CD2 4.41Å; V446-I483 HydrophobicContact CB-CD1 3.81Å; V446-I483 HydrophobicContact CG2-CD1 4.11Å
447S94.5Very high93.7Very high0 Ų012.6 Ų12.60%07%0.074CC..Hα-helixtrans-67.6-18.9-177.4-57.10000113G64 V67 S68 G443 N444 D445 A449 G451G64-S447 PolarHBondContact O-OG 3.01Å; V67-S447 WeakPolarHBondContact CB-OG 3.35Å; S68-S447 PolarHBondContact N-OG 3.04Å; S68-S447 VanDerWaalsContact N-OG 3.09Å; S68-S447 WeakPolarHBondContact OG-CA 3.01Å; S68-S447 WeakPolarHBondContact OG-CB 3.31Å; S68-S447 PolarHBondContact OG-OG 2.86Å; S68-S447 VanDerWaalsContact OG-OG 3.05Å; G443-S447 PolarHBondContact O-OG 2.72Å; N444-S447 WeakPolarHBondContact O-CB 3.21Å; N444-S447 PolarHBondContact O-N 3.43Å; N444-S447 PolarHBondContact O-OG 2.99Å; D445-S447 PolarHBondContact O-N 3.4Å; D445-S447 VanDerWaalsContact O-N 3.14Å; S447-A449 VanDerWaalsContact C-N 3.34Å; S447-G451 WeakPolarHBondContact O-CA 3.17Å; S447-G451 PolarHBondContact O-N 2.88Å
448N95.3Very high93.8Very high0 Ų011.3 Ų11.30%06%0.06CC..Hα-helixtrans-70.8-32175.3-60.8-32000112.1I25 T119 I122 D445 V446I25-N448 HydrophobicContact CD1-CB 3.83Å; T119-N448 WeakPolarHBondContact CA-OD1 3.41Å; T119-N448 PolarHBondContact N-ND2 2.96Å; T119-N448 VanDerWaalsContact N-ND2 3.17Å; T119-N448 PolarHBondContact OG1-ND2 3.47Å; T119-N448 PolarHBondContact OG1-OD1 2.95Å; I122-N448 HydrophobicContact CB-CB 4.46Å; I122-N448 WeakPolarHBondContact CG1-O 3.48Å; I122-N448 HydrophobicContact CG2-CB 3.9Å; I122-N448 WeakPolarHBondContact CG2-OD1 3.38Å; D445-N448 WeakPolarHBondContact O-CB 3.24Å; D445-N448 PolarHBondContact O-N 3.29Å; D445-N448 VanDerWaalsContact O-N 3.08Å; D445-N448 PolarHBondContact OD2-ND2 3.43Å; D445-N448 VanDerWaalsContact OD2-ND2 3.14Å; V446-N448 PolarHBondContact O-N 2.89Å
449A96.5Very high93.7Very high0 Ų011.6 Ų11.60%06%0.061CC..Hα-helixtrans-90.1-36.6171.200000112.5A18 L21 A22 I25 L99 V446 S447A18-A449 WeakPolarHBondContact O-CB 3.3Å; L21-A449 HydrophobicContact CB-CB 4.32Å; L21-A449 HydrophobicContact CD2-CB 4.29Å; L21-A449 HydrophobicContact CG-CB 4.06Å; A22-A449 HydrophobicContact CB-CB 3.89Å; I25-A449 HydrophobicContact CD1-CB 4.47Å; L99-A449 WeakPolarHBondContact CD2-O 3.45Å; V446-A449 PolarHBondContact O-N 2.86Å; V446-A449 VanDerWaalsContact O-N 3.12Å; S447-A449 VanDerWaalsContact C-N 3.34Å
450I95.5Very high93.7Very high0 Ų010.7 Ų10.70%06%0.057CC..Hα-helixtrans-95.8-26.5-165.4-62.6-52.3000113.4V446 L453 I454 I475 L476 Y478V446-I450 HydrophobicContact CG2-CB 4.3Å; V446-I450 HydrophobicContact CG2-CG1 3.58Å; V446-I450 VanDerWaalsContact O-CB 3.28Å; V446-I450 WeakPolarHBondContact O-CB 3.47Å; V446-I450 WeakPolarHBondContact O-CG1 3.4Å; V446-I450 PolarHBondContact O-N 3.49Å; I450-L453 HydrophobicContact CD1-CD2 3.63Å; I450-L453 PolarHBondContact O-N 2.88Å; I450-I454 HydrophobicContact CG2-CD1 3.45Å; I450-I454 VanDerWaalsContact CG2-CD1 3.45Å; I450-I454 HydrophobicContact CG2-CG1 3.86Å; I450-I454 WeakPolarHBondContact O-CB 3.5Å; I450-I454 WeakPolarHBondContact O-CD1 3.4Å; I450-I454 WeakPolarHBondContact O-CG1 3.46Å; I450-I454 PolarHBondContact O-N 3.44Å; I450-I475 HydrophobicContact CD1-CG2 4.2Å; I450-I475 WeakPolarHBondContact CD1-O 3.47Å; I450-I475 HydrophobicContact CG2-CB 4.46Å; I450-I475 HydrophobicContact CG2-CG2 3.76Å; I450-L476 HydrophobicContact CG2-CD2 3.92Å; I450-Y478 HydrophobicContact CD1-CD1 4.29Å
451G93.8Very high93.7Very high0 Ų010 Ų100%05%0.05CC..Hα-helixtrans-55.5-54.3173.700000113.6S447 I454 G455S447-G451 WeakPolarHBondContact O-CA 3.17Å; S447-G451 PolarHBondContact O-N 2.88Å; G451-I454 PolarHBondContact O-N 2.87Å; G451-G455 PolarHBondContact O-N 3.34Å; G451-G455 VanDerWaalsContact O-N 3.12Å
452P95.3Very high93.6Very high0 Ų011 Ų110%06%0.057CC..Hα-helixtrans-64.5-38.6175.8-19.730.9000112.9I71 Q95 L99 I122 I454 G455 L456I71-P452 HydrophobicContact CG2-CG 4.2Å; Q95-P452 HydrophobicContact CB-CB 4.35Å; Q95-P452 VanDerWaalsContact OE1-CA 3.24Å; Q95-P452 VanDerWaalsContact OE1-CB 3.32Å; L99-P452 HydrophobicContact CD1-CB 4.19Å; L99-P452 HydrophobicContact CD2-CB 3.82Å; L99-P452 HydrophobicContact CD2-CG 3.92Å; L99-P452 HydrophobicContact CG-CB 3.75Å; L99-P452 HydrophobicContact CG-CG 4.3Å; I122-P452 HydrophobicContact CD1-CG 3.7Å; I122-P452 HydrophobicContact CG1-CG 3.8Å; P452-I454 PolarHBondContact O-N 3.04Å; P452-G455 WeakPolarHBondContact O-CA 3.32Å; P452-G455 PolarHBondContact O-N 3.24Å; P452-G455 VanDerWaalsContact O-N 3.1Å; P452-L456 PolarHBondContact O-N 3.17Å
453L96.3Very high93.4Very high0 Ų014 Ų140%07%0.071CC..Hα-helixtrans-64-39.4178.3-175.765.3000112.4F15 A18 I450 G455 L456 W457 I475 Y478F15-L453 HydrophobicContact CB-CD1 4.41Å; F15-L453 HydrophobicContact CD1-CD1 3.98Å; F15-L453 HydrophobicContact CD1-CD2 3.75Å; F15-L453 HydrophobicContact CD1-CG 4.31Å; F15-L453 HydrophobicContact CD2-CD1 3.88Å; F15-L453 HydrophobicContact CE1-CD1 4.09Å; F15-L453 HydrophobicContact CE1-CD2 3.65Å; F15-L453 HydrophobicContact CE1-CG 4.08Å; F15-L453 HydrophobicContact CE2-CD1 3.98Å; F15-L453 HydrophobicContact CG-CD1 3.84Å; F15-L453 HydrophobicContact CG-CD2 4.43Å; F15-L453 HydrophobicContact CZ-CD1 4.07Å; F15-L453 HydrophobicContact CZ-CD2 4.27Å; F15-L453 HydrophobicContact CZ-CG 4.2Å; A18-L453 HydrophobicContact CB-CB 4.13Å; A18-L453 HydrophobicContact CB-CD1 4.19Å; A18-L453 HydrophobicContact CB-CD2 3.75Å; A18-L453 HydrophobicContact CB-CG 4.25Å; I450-L453 HydrophobicContact CD1-CD2 3.63Å; I450-L453 PolarHBondContact O-N 2.88Å; L453-G455 VanDerWaalsContact C-N 3.33Å; L453-L456 HydrophobicContact CD1-CD2 4.32Å; L453-L456 PolarHBondContact O-N 3.3Å; L453-W457 VanDerWaalsContact O-CB 3.3Å; L453-W457 WeakPolarHBondContact O-CB 3.48Å; L453-W457 PolarHBondContact O-N 2.84Å; L453-I475 HydrophobicContact CD2-CG2 3.74Å; L453-I475 HydrophobicContact CG-CG2 4.18Å; L453-Y478 HydrophobicContact CD2-CD1 4.19Å; L453-Y478 HydrophobicContact CD2-CE1 4.26Å
454I93.8Very high93.2Very high2 Ų216.2 Ų16.21%0.019%0.087CC..Hα-helixtrans-63.7-41171.3-70158.3000110.1I450 G451 P452 W457 L458 T471 I475I450-I454 HydrophobicContact CG2-CD1 3.45Å; I450-I454 VanDerWaalsContact CG2-CD1 3.45Å; I450-I454 HydrophobicContact CG2-CG1 3.86Å; I450-I454 WeakPolarHBondContact O-CB 3.5Å; I450-I454 WeakPolarHBondContact O-CD1 3.4Å; I450-I454 WeakPolarHBondContact O-CG1 3.46Å; I450-I454 PolarHBondContact O-N 3.44Å; G451-I454 PolarHBondContact O-N 2.87Å; P452-I454 PolarHBondContact O-N 3.04Å; I454-W457 PolarHBondContact O-N 3.46Å; I454-L458 HydrophobicContact CG2-CD1 3.64Å; I454-L458 HydrophobicContact CG2-CG 4.06Å; I454-L458 VanDerWaalsContact O-CB 3.27Å; I454-L458 WeakPolarHBondContact O-CB 3.46Å; I454-L458 VanDerWaalsContact O-CG 3.23Å; I454-L458 WeakPolarHBondContact O-CG 3.39Å; I454-L458 PolarHBondContact O-N 3.47Å; I454-T471 HydrophobicContact CD1-CG2 3.33Å; I454-T471 HydrophobicContact CG1-CG2 3.96Å; I454-I475 HydrophobicContact CG1-CD1 4.37Å; I454-I475 HydrophobicContact CG1-CG2 4.13Å
455G92.7Very high92.8Very high2 Ų213.1 Ų13.12%0.0217%0.071CC..Hα-helixtrans-54.9-55.5172.800000111.6G451 P452 L453 W457 L458 I459G451-G455 PolarHBondContact O-N 3.34Å; G451-G455 VanDerWaalsContact O-N 3.12Å; P452-G455 WeakPolarHBondContact O-CA 3.32Å; P452-G455 PolarHBondContact O-N 3.24Å; P452-G455 VanDerWaalsContact O-N 3.1Å; L453-G455 VanDerWaalsContact C-N 3.33Å; G455-W457 PolarHBondContact O-N 2.89Å; G455-L458 PolarHBondContact O-N 3Å; G455-I459 VanDerWaalsContact O-CD1 3.32Å; G455-I459 WeakPolarHBondContact O-CD1 3.31Å; G455-I459 WeakPolarHBondContact O-CG1 3.39Å; G455-I459 PolarHBondContact O-N 2.8Å
456L94.8Very high91.8Very high0 Ų015.9 Ų15.90%09%0.085CC..Hα-helixtrans-55.4-50177.1177.562.4000112.6M10 V11 M92 Q95 V96 P452 L453 A460M10-L456 HydrophobicContact CB-CD1 4.31Å; V11-L456 HydrophobicContact CG2-CD1 4.49Å; M92-L456 HydrophobicContact CB-CD1 3.63Å; M92-L456 HydrophobicContact CE-CD1 3.8Å; M92-L456 HydrophobicContact CG-CD1 3.85Å; Q95-L456 HydrophobicContact CB-CB 4.12Å; Q95-L456 HydrophobicContact CG-CB 4.48Å; V96-L456 HydrophobicContact CG2-CD1 4.12Å; V96-L456 HydrophobicContact CG2-CD2 3.72Å; P452-L456 PolarHBondContact O-N 3.17Å; L453-L456 HydrophobicContact CD1-CD2 4.32Å; L453-L456 PolarHBondContact O-N 3.3Å; L456-A460 VanDerWaalsContact O-CB 3.23Å; L456-A460 WeakPolarHBondContact O-CB 3.19Å; L456-A460 PolarHBondContact O-N 2.91Å
457W94Very high90.3Very high59 Ų5916.1 Ų16.122%0.2239%0.087CC..Hα-helixtrans-62.8-45.7-179.7176.8-110.9000112.9I3 V11 F15 L453 I454 G455 T461 D472 W474 I475I3-W457 HydrophobicContact CD1-CZ3 4.27Å; V11-W457 HydrophobicContact CG1-CE3 4.23Å; V11-W457 HydrophobicContact CG1-CZ3 4.46Å; F15-W457 AromaticContact CE2-CE3 3.86Å; F15-W457 HydrophobicContact CE2-CE3 3.86Å; F15-W457 HydrophobicContact CE2-CZ3 4.38Å; F15-W457 HydrophobicContact CZ-CD2 4.48Å; F15-W457 HydrophobicContact CZ-CE3 4.14Å; L453-W457 VanDerWaalsContact O-CB 3.3Å; L453-W457 WeakPolarHBondContact O-CB 3.48Å; L453-W457 PolarHBondContact O-N 2.84Å; I454-W457 PolarHBondContact O-N 3.46Å; G455-W457 PolarHBondContact O-N 2.89Å; W457-T461 HydrophobicContact CD2-CG2 4Å; W457-T461 HydrophobicContact CE3-CG2 4.1Å; W457-T461 HydrophobicContact CH2-CG2 4.1Å; W457-T461 HydrophobicContact CZ2-CG2 3.97Å; W457-T461 HydrophobicContact CZ3-CG2 4.16Å; W457-T461 WeakPolarHBondContact O-CB 3.48Å; W457-T461 WeakPolarHBondContact O-CG2 3.27Å; W457-T461 PolarHBondContact O-N 2.88Å; W457-T461 PolarHBondContact O-OG1 3.03Å; W457-D472 PolarHBondContact NE1-OD2 3.44Å; W457-D472 VanDerWaalsContact NE1-OD2 3.13Å; W457-W474 HydrophobicContact CD2-CZ2 4.42Å; W457-W474 AromaticContact CE2-CZ2 3.96Å; W457-W474 HydrophobicContact CH2-CZ2 4.3Å; W457-W474 AromaticContact CZ2-CZ2 3.9Å; W457-W474 HydrophobicContact CZ2-CZ2 3.9Å; W457-I475 HydrophobicContact CB-CD1 4.24Å; W457-I475 VanDerWaalsContact CD1-CD1 3.45Å; W457-I475 HydrophobicContact CG-CD1 3.84Å
458L91.3Very high89Confident5 Ų521.4 Ų21.43%0.02612%0.124CC..Hα-helixtrans-66.9-41.9-179.9-72.2179.9000111.5I454 G455 T461 T462 K469I454-L458 HydrophobicContact CG2-CD1 3.64Å; I454-L458 HydrophobicContact CG2-CG 4.06Å; I454-L458 VanDerWaalsContact O-CB 3.27Å; I454-L458 WeakPolarHBondContact O-CB 3.46Å; I454-L458 VanDerWaalsContact O-CG 3.23Å; I454-L458 WeakPolarHBondContact O-CG 3.39Å; I454-L458 PolarHBondContact O-N 3.47Å; G455-L458 PolarHBondContact O-N 3Å; L458-T461 PolarHBondContact O-OG1 3.18Å; L458-T462 WeakPolarHBondContact O-CB 3.42Å; L458-T462 WeakPolarHBondContact O-CG2 3.32Å; L458-T462 PolarHBondContact O-N 3.33Å; L458-T462 PolarHBondContact O-OG1 3.36Å; L458-K469 HydrophobicContact CD2-CB 3.81Å; L458-K469 HydrophobicContact CD2-CD 4.38Å
459I92.3Very high87.8Confident6 Ų626.9 Ų26.93%0.03115%0.147CC..Hα-helixtrans-65.8-48.2177-60.8159.9000110H88 L91 M92 G455 T461 T462 Q463H88-I459 HydrophobicContact CB-CG2 3.77Å; L91-I459 HydrophobicContact CB-CD1 4.14Å; L91-I459 HydrophobicContact CD2-CD1 3.52Å; L91-I459 HydrophobicContact CG-CD1 3.59Å; M92-I459 HydrophobicContact CG-CB 3.86Å; M92-I459 HydrophobicContact CG-CD1 4.47Å; M92-I459 HydrophobicContact CG-CG2 3.61Å; M92-I459 HydrophobicContact SD-CB 4.3Å; M92-I459 HydrophobicContact SD-CG2 3.8Å; G455-I459 VanDerWaalsContact O-CD1 3.32Å; G455-I459 WeakPolarHBondContact O-CD1 3.31Å; G455-I459 WeakPolarHBondContact O-CG1 3.39Å; G455-I459 PolarHBondContact O-N 2.8Å; I459-T461 VanDerWaalsContact C-N 3.29Å; I459-T461 PolarHBondContact O-N 3.27Å; I459-T462 PolarHBondContact O-N 2.83Å; I459-Q463 VanDerWaalsContact O-CA 3.32Å; I459-Q463 WeakPolarHBondContact O-CA 3.22Å; I459-Q463 PolarHBondContact O-N 2.93Å
460A92.8Very high86.7Confident0 Ų030.7 Ų30.70%017%0.171CC..Hα-helixtrans-56.3-41.4178.800000112.9I3 V11 M92 L456 Q463I3-A460 HydrophobicContact CD1-CB 4.08Å; I3-A460 HydrophobicContact CG1-CB 4.17Å; I3-A460 HydrophobicContact CG2-CB 4.08Å; V11-A460 HydrophobicContact CG2-CB 3.58Å; M92-A460 HydrophobicContact CE-CB 3.64Å; M92-A460 HydrophobicContact SD-CB 4.19Å; L456-A460 VanDerWaalsContact O-CB 3.23Å; L456-A460 WeakPolarHBondContact O-CB 3.19Å; L456-A460 PolarHBondContact O-N 2.91Å; A460-Q463 PolarHBondContact O-NE2 2.99Å
461T91Very high85.7Confident21 Ų2131.3 Ų31.313%0.12918%0.175CC..Hα-helixtrans-88.2-9.9-175.957.40000114.9I3 W457 L458 I459I3-T461 HydrophobicContact CD1-CG2 4.16Å; I3-T461 HydrophobicContact CG1-CG2 4.23Å; W457-T461 HydrophobicContact CD2-CG2 4Å; W457-T461 HydrophobicContact CE3-CG2 4.1Å; W457-T461 HydrophobicContact CH2-CG2 4.1Å; W457-T461 HydrophobicContact CZ2-CG2 3.97Å; W457-T461 HydrophobicContact CZ3-CG2 4.16Å; W457-T461 WeakPolarHBondContact O-CB 3.48Å; W457-T461 WeakPolarHBondContact O-CG2 3.27Å; W457-T461 PolarHBondContact O-N 2.88Å; W457-T461 PolarHBondContact O-OG1 3.03Å; L458-T461 PolarHBondContact O-OG1 3.18Å; I459-T461 VanDerWaalsContact C-N 3.29Å; I459-T461 PolarHBondContact O-N 3.27Å
462T90Very high85.2Confident42 Ų4234 Ų3426%0.25819%0.189SC..Hα-helixtrans-116.8-16.5177.861.90000114.1L458 I459 S464 S467 K469L458-T462 WeakPolarHBondContact O-CB 3.42Å; L458-T462 WeakPolarHBondContact O-CG2 3.32Å; L458-T462 PolarHBondContact O-N 3.33Å; L458-T462 PolarHBondContact O-OG1 3.36Å; I459-T462 PolarHBondContact O-N 2.83Å; T462-S464 PolarHBondContact O-N 3.28Å; T462-S464 VanDerWaalsContact O-N 3.15Å; T462-S464 PolarHBondContact OG1-N 3.31Å; T462-S464 PolarHBondContact OG1-O 2.9Å; T462-S467 WeakPolarHBondContact CG2-OG 3.32Å; T462-S467 PolarHBondContact OG1-OG 2.86Å; T462-K469 HydrophobicContact CG2-CD 3.77Å
463Q89.3Confident84.9Confident64 Ų6436.3 Ų36.330%0.29920%0.201SC..SBendtrans52.226.9-167.8-58.4-65.2-62.700112.7H88 I459 A460H88-Q463 PolarHBondContact NE2-OE1 2.91Å; I459-Q463 VanDerWaalsContact O-CA 3.32Å; I459-Q463 WeakPolarHBondContact O-CA 3.22Å; I459-Q463 PolarHBondContact O-N 2.93Å; A460-Q463 PolarHBondContact O-NE2 2.99Å
464S87.3Confident84.7Confident46 Ų4641.7 Ų41.732%0.32222%0.221SC..  trans-131.3136.3-179.7179.60000111.3T462 D466T462-S464 PolarHBondContact O-N 3.28Å; T462-S464 VanDerWaalsContact O-N 3.15Å; T462-S464 PolarHBondContact OG1-N 3.31Å; T462-S464 PolarHBondContact OG1-O 2.9Å; S464-D466 PolarHBondContact OG-N 3.08Å
465V83.9Confident84.8Confident11 Ų1141.7 Ų41.77%0.06722%0.221CC..SBendtrans-69-43.2176.3177.40000111.6V78 F81 Q82 H88 L91 S467V78-V465 HydrophobicContact CB-CG1 3.66Å; V78-V465 HydrophobicContact CG2-CG1 4.12Å; V78-V465 WeakPolarHBondContact O-CG1 3.43Å; F81-V465 HydrophobicContact CB-CG1 4.3Å; F81-V465 HydrophobicContact CB-CG2 4.04Å; Q82-V465 HydrophobicContact CG-CB 4.11Å; Q82-V465 HydrophobicContact CG-CG2 4.42Å; H88-V465 HydrophobicContact CB-CG2 3.88Å; L91-V465 HydrophobicContact CD2-CB 4.46Å; L91-V465 HydrophobicContact CD2-CG1 3.55Å; L91-V465 HydrophobicContact CD2-CG2 4.36Å; V465-S467 PolarHBondContact O-N 3.2Å; V465-S467 VanDerWaalsContact O-N 3.09Å
466D71.3Confident84.8Confident76 Ų7641.6 Ų41.641%0.40622%0.22SC..  trans-87.876.4176.8-170.618.1000111.8K73 S464 S468K73-D466 IonicContact NZ-OD1 2.6Å; K73-D466 PolarHBondContact NZ-OD1 2.83Å; S464-D466 PolarHBondContact OG-N 3.08Å; D466-S468 PolarHBondContact O-N 3.35Å
467S63.8Low84.9Confident5 Ų544.5 Ų44.54%0.03524%0.238CC..  trans-83.9103.6165.9-840000111.3R72 T462 V465R72-S467 PolarHBondContact NH1-O 2.93Å; R72-S467 PolarHBondContact NH2-O 3Å; T462-S467 WeakPolarHBondContact CG2-OG 3.32Å; T462-S467 PolarHBondContact OG1-OG 2.86Å; V465-S467 PolarHBondContact O-N 3.2Å; V465-S467 VanDerWaalsContact O-N 3.09Å
468S66.8Low85.1Confident110 Ų11044.7 Ų44.777%0.76924%0.239SC*.  trans-75.3-8164.561.70000113.6D466D466-S468 PolarHBondContact O-N 3.35Å
469K72Confident85.3Confident115 Ų11544.4 Ų44.450%0.524%0.238SC..PPolyproline II helixtrans-51.8139.8175.2-72.7-170.5179.5-178.80111.5L458 T462L458-K469 HydrophobicContact CD2-CB 3.81Å; L458-K469 HydrophobicContact CD2-CD 4.38Å; T462-K469 HydrophobicContact CG2-CD 3.77Å
470T71.9Confident85.5Confident81 Ų8144.1 Ų44.150%0.49724%0.236SC..PPolyproline II helixtrans-67147.5176.150.90000111.4S208 D472S208-T470 WeakPolarHBondContact OG-CG2 3.3Å; T470-D472 PolarHBondContact O-N 3.16Å
471T75.6Confident85.7Confident12 Ų1247 Ų477%0.07425%0.254CS..PPolyproline II helixtrans-58.4127.3169.8-61.80000111.3I454 L476I454-T471 HydrophobicContact CD1-CG2 3.33Å; I454-T471 HydrophobicContact CG1-CG2 3.96Å; T471-L476 HydrophobicContact CG2-CD1 4.08Å; T471-L476 HydrophobicContact CG2-CD2 4.48Å; T471-L476 HydrophobicContact CG2-CG 4.06Å
472D83.4Confident86Confident58 Ų5846 Ų4631%0.3125%0.248SC..PPolyproline II helixtrans-71.3128.2170.7-67.6-37.1000110.8W457 T470 W474 I475W457-D472 PolarHBondContact NE1-OD2 3.44Å; W457-D472 VanDerWaalsContact NE1-OD2 3.13Å; T470-D472 PolarHBondContact O-N 3.16Å; D472-W474 VanDerWaalsContact CB-CD1 3.46Å; D472-W474 HydrophobicContact CB-CG 4.42Å; D472-W474 PolarHBondContact O-N 3.39Å; D472-W474 VanDerWaalsContact O-N 3.15Å; D472-I475 HydrophobicContact CB-CD1 4.18Å; D472-I475 HydrophobicContact CB-CG1 4.2Å; D472-I475 PolarHBondContact O-N 3.16Å; D472-I475 VanDerWaalsContact O-N 3.14Å
473I88.1Confident86.3Confident47 Ų4744 Ų4424%0.24124%0.235CC..Hα-helixtrans-60.8-28.7-174.6-158.2168.2000113.4V61 M209 I475 L476 V477V61-I473 HydrophobicContact CG1-CD1 3.77Å; V61-I473 HydrophobicContact CG1-CG1 3.88Å; M209-I473 HydrophobicContact CE-CB 3.74Å; M209-I473 HydrophobicContact CE-CG2 3.57Å; M209-I473 HydrophobicContact SD-CB 3.88Å; M209-I473 HydrophobicContact SD-CD1 4.02Å; M209-I473 HydrophobicContact SD-CG2 3.86Å; I473-I475 PolarHBondContact O-N 2.84Å; I473-L476 WeakPolarHBondContact O-CB 3.46Å; I473-L476 PolarHBondContact O-N 3.29Å; I473-V477 WeakPolarHBondContact O-CG2 3.23Å; I473-V477 PolarHBondContact O-N 3.15Å
474W93.1Very high86.5Confident114 Ų11441.6 Ų41.643%0.43223%0.225SC..Hα-helixtrans-65.7-27.3-178.973.7-98.7000112.3F15 W457 D472 V477 Y478F15-W474 AromaticContact CE1-CH2 3.43Å; F15-W474 HydrophobicContact CE1-CH2 3.43Å; F15-W474 VanDerWaalsContact CE1-CH2 3.43Å; F15-W474 AromaticContact CE1-CZ3 3.59Å; F15-W474 HydrophobicContact CE1-CZ3 3.59Å; F15-W474 HydrophobicContact CE2-CH2 4.43Å; F15-W474 AromaticContact CZ-CH2 3.36Å; F15-W474 HydrophobicContact CZ-CH2 3.36Å; F15-W474 HydrophobicContact CZ-CZ2 4.2Å; F15-W474 HydrophobicContact CZ-CZ3 4.04Å; W457-W474 HydrophobicContact CD2-CZ2 4.42Å; W457-W474 AromaticContact CE2-CZ2 3.96Å; W457-W474 HydrophobicContact CH2-CZ2 4.3Å; W457-W474 AromaticContact CZ2-CZ2 3.9Å; W457-W474 HydrophobicContact CZ2-CZ2 3.9Å; D472-W474 VanDerWaalsContact CB-CD1 3.46Å; D472-W474 HydrophobicContact CB-CG 4.42Å; D472-W474 PolarHBondContact O-N 3.39Å; D472-W474 VanDerWaalsContact O-N 3.15Å; W474-V477 PolarHBondContact O-N 3.4Å; W474-Y478 WeakPolarHBondContact O-CB 3.32Å; W474-Y478 PolarHBondContact O-N 2.95Å
475I94.7Very high86.9Confident1 Ų141.9 Ų41.91%0.00523%0.225CC..Hα-helixtrans-73.6-34.7177.5-49.1179000110.2I450 L453 I454 W457 D472 I473 Y478 G479I450-I475 HydrophobicContact CD1-CG2 4.2Å; I450-I475 WeakPolarHBondContact CD1-O 3.47Å; I450-I475 HydrophobicContact CG2-CB 4.46Å; I450-I475 HydrophobicContact CG2-CG2 3.76Å; L453-I475 HydrophobicContact CD2-CG2 3.74Å; L453-I475 HydrophobicContact CG-CG2 4.18Å; I454-I475 HydrophobicContact CG1-CD1 4.37Å; I454-I475 HydrophobicContact CG1-CG2 4.13Å; W457-I475 HydrophobicContact CB-CD1 4.24Å; W457-I475 VanDerWaalsContact CD1-CD1 3.45Å; W457-I475 HydrophobicContact CG-CD1 3.84Å; D472-I475 HydrophobicContact CB-CD1 4.18Å; D472-I475 HydrophobicContact CB-CG1 4.2Å; D472-I475 PolarHBondContact O-N 3.16Å; D472-I475 VanDerWaalsContact O-N 3.14Å; I473-I475 PolarHBondContact O-N 2.84Å; I475-Y478 WeakPolarHBondContact O-CB 3.47Å; I475-Y478 PolarHBondContact O-N 3.11Å; I475-G479 PolarHBondContact O-N 2.9Å; I475-G479 VanDerWaalsContact O-N 3.11Å
476L94.4Very high87.4Confident1 Ų141.4 Ų41.41%0.00522%0.222CC..Hα-helixtrans-66.1-48170.8-63.2168.1000110.3S60 A65 V446 I450 T471 I473 Y478 G479 G480S60-L476 PolarHBondContact OG-O 3.49Å; A65-L476 HydrophobicContact CB-CD1 4.01Å; V446-L476 HydrophobicContact CG1-CD2 4.41Å; I450-L476 HydrophobicContact CG2-CD2 3.92Å; T471-L476 HydrophobicContact CG2-CD1 4.08Å; T471-L476 HydrophobicContact CG2-CD2 4.48Å; T471-L476 HydrophobicContact CG2-CG 4.06Å; I473-L476 WeakPolarHBondContact O-CB 3.46Å; I473-L476 PolarHBondContact O-N 3.29Å; L476-Y478 VanDerWaalsContact C-N 3.28Å; L476-Y478 PolarHBondContact O-N 3.28Å; L476-G479 PolarHBondContact O-N 3.44Å; L476-G479 VanDerWaalsContact O-N 3.14Å; L476-G480 PolarHBondContact O-N 2.46Å
477V96.1Very high88.4Confident60 Ų6037.8 Ų37.836%0.36420%0.203SC..Hα-helixtrans-54.4-44.6173.5175.60000111.2V61 I473 W474 G479 G480 V481V61-V477 HydrophobicContact CG2-CG2 3.6Å; I473-V477 WeakPolarHBondContact O-CG2 3.23Å; I473-V477 PolarHBondContact O-N 3.15Å; W474-V477 PolarHBondContact O-N 3.4Å; V477-G479 PolarHBondContact O-N 3.01Å; V477-G480 PolarHBondContact O-N 2.9Å; V477-V481 HydrophobicContact CG1-CG2 4.32Å; V477-V481 WeakPolarHBondContact O-CB 3.44Å; V477-V481 VanDerWaalsContact O-CG2 3.32Å; V477-V481 WeakPolarHBondContact O-CG2 3.35Å; V477-V481 PolarHBondContact O-N 3.22Å
478Y97.4Very high89.8Confident63 Ų6341.4 Ų41.425%0.24722%0.216CC..Hα-helixtrans-57.1-47177.3-179.3-99.6000112.3F15 F19 I450 L453 W474 I475 L476 V481 G482F15-Y478 HydrophobicContact CD1-CD1 4.21Å; F15-Y478 AromaticContact CD1-CE1 3.72Å; F15-Y478 HydrophobicContact CD1-CE1 3.72Å; F15-Y478 HydrophobicContact CD1-CE2 4.5Å; F15-Y478 AromaticContact CD1-CZ 3.87Å; F15-Y478 HydrophobicContact CE1-CE1 4.46Å; F15-Y478 PolarHBondContact O-OH 3.49Å; F15-Y478 VanDerWaalsContact O-OH 3.06Å; F19-Y478 HydrophobicContact CB-CE1 3.89Å; F19-Y478 WeakPolarHBondContact CB-OH 3.5Å; F19-Y478 HydrophobicContact CD2-CD1 4.43Å; F19-Y478 HydrophobicContact CD2-CD2 4.38Å; F19-Y478 AromaticContact CD2-CE1 3.96Å; F19-Y478 HydrophobicContact CD2-CE1 3.96Å; F19-Y478 AromaticContact CD2-CE2 3.91Å; F19-Y478 HydrophobicContact CD2-CE2 3.91Å; F19-Y478 AromaticContact CD2-CZ 3.7Å; F19-Y478 HydrophobicContact CG-CE1 4.43Å; I450-Y478 HydrophobicContact CD1-CD1 4.29Å; L453-Y478 HydrophobicContact CD2-CD1 4.19Å; L453-Y478 HydrophobicContact CD2-CE1 4.26Å; W474-Y478 WeakPolarHBondContact O-CB 3.32Å; W474-Y478 PolarHBondContact O-N 2.95Å; I475-Y478 WeakPolarHBondContact O-CB 3.47Å; I475-Y478 PolarHBondContact O-N 3.11Å; L476-Y478 VanDerWaalsContact C-N 3.28Å; L476-Y478 PolarHBondContact O-N 3.28Å; Y478-V481 PolarHBondContact O-N 2.91Å; Y478-G482 PolarHBondContact O-N 3.27Å
479G96.9Very high90.9Very high0 Ų041.6 Ų41.60%021%0.207CC..Hα-helixtrans-65.1-43.4174.800000113.6I475 L476 V477 V481 G482 I483I475-G479 PolarHBondContact O-N 2.9Å; I475-G479 VanDerWaalsContact O-N 3.11Å; L476-G479 PolarHBondContact O-N 3.44Å; L476-G479 VanDerWaalsContact O-N 3.14Å; V477-G479 PolarHBondContact O-N 3.01Å; G479-V481 VanDerWaalsContact C-N 3.3Å; G479-V481 PolarHBondContact O-N 2.8Å; G479-G482 WeakPolarHBondContact O-CA 3.43Å; G479-G482 PolarHBondContact O-N 2.73Å; G479-G482 VanDerWaalsContact O-N 3.1Å; G479-I483 WeakPolarHBondContact O-CG1 3.43Å; G479-I483 PolarHBondContact O-N 3.1Å
480G96.3Very high91.7Very high0 Ų039.5 Ų39.50%020%0.196CC..Hα-helixtrans-63.9-33176.500000113.3L476 V477 S484L476-G480 PolarHBondContact O-N 2.46Å; V477-G480 PolarHBondContact O-N 2.9Å; G480-S484 WeakPolarHBondContact O-CB 3.32Å; G480-S484 PolarHBondContact O-N 3.43Å; G480-S484 PolarHBondContact O-OG 2.86Å
481V97.3Very high92.3Very high61 Ų6135.8 Ų35.837%0.3717%0.173SC..Hα-helixtrans-67.5-43.9169.61700000110.6F19 L57 V477 Y478 G479 I483 S484 V485F19-V481 HydrophobicContact CE2-CG1 4.25Å; L57-V481 HydrophobicContact CD1-CG2 4.41Å; V477-V481 HydrophobicContact CG1-CG2 4.32Å; V477-V481 WeakPolarHBondContact O-CB 3.44Å; V477-V481 VanDerWaalsContact O-CG2 3.32Å; V477-V481 WeakPolarHBondContact O-CG2 3.35Å; V477-V481 PolarHBondContact O-N 3.22Å; Y478-V481 PolarHBondContact O-N 2.91Å; G479-V481 VanDerWaalsContact C-N 3.3Å; G479-V481 PolarHBondContact O-N 2.8Å; V481-I483 PolarHBondContact O-N 3.21Å; V481-S484 WeakPolarHBondContact O-CB 3.23Å; V481-S484 PolarHBondContact O-N 2.66Å; V481-S484 VanDerWaalsContact O-N 3.14Å; V481-V485 HydrophobicContact CG1-CG2 4.39Å; V481-V485 WeakPolarHBondContact O-CG2 3.49Å; V481-V485 PolarHBondContact O-N 2.92Å
482G96.9Very high92.6Very high0 Ų038.5 Ų38.50%018%0.182CC..Hα-helixtrans-54.9-51.717400000112.7F23 Y478 G479 S484 V485 G486F23-G482 WeakPolarHBondContact CA-O 3.32Å; Y478-G482 PolarHBondContact O-N 3.27Å; G479-G482 WeakPolarHBondContact O-CA 3.43Å; G479-G482 PolarHBondContact O-N 2.73Å; G479-G482 VanDerWaalsContact O-N 3.1Å; G482-S484 VanDerWaalsContact C-N 3.3Å; G482-S484 PolarHBondContact O-N 3.25Å; G482-V485 PolarHBondContact O-N 2.76Å; G482-G486 PolarHBondContact O-N 2.9Å
483I95.2Very high92.4Very high0 Ų044 Ų440%020%0.199CC..Hα-helixtrans-54.1-47173.2-68.7171.4000110.8A22 I25 G26 E56 V446 G479 V481 V485 G486 L487A22-I483 HydrophobicContact CB-CG1 4.24Å; A22-I483 VanDerWaalsContact O-CA 3.27Å; A22-I483 WeakPolarHBondContact O-CA 3.16Å; A22-I483 WeakPolarHBondContact O-CG1 3.47Å; A22-I483 PolarHBondContact O-N 3.4Å; I25-I483 HydrophobicContact CB-CG1 4.49Å; I25-I483 HydrophobicContact CG2-CD1 4.27Å; I25-I483 HydrophobicContact CG2-CG1 4.21Å; G26-I483 WeakPolarHBondContact CA-O 3.46Å; E56-I483 HydrophobicContact CB-CG2 4.01Å; E56-I483 HydrophobicContact CG-CG2 4.06Å; V446-I483 HydrophobicContact CB-CD1 3.81Å; V446-I483 HydrophobicContact CG2-CD1 4.11Å; G479-I483 WeakPolarHBondContact O-CG1 3.43Å; G479-I483 PolarHBondContact O-N 3.1Å; V481-I483 PolarHBondContact O-N 3.21Å; I483-V485 PolarHBondContact O-N 2.92Å; I483-G486 PolarHBondContact O-N 3.45Å; I483-L487 WeakPolarHBondContact O-CB 3.34Å; I483-L487 PolarHBondContact O-N 3.44Å
484S95.1Very high92Very high12 Ų1243.4 Ų43.48%0.08420%0.197CC..Hα-helixtrans-62.3-39.9179.8-62.80000112.7G480 V481 G482 W488G480-S484 WeakPolarHBondContact O-CB 3.32Å; G480-S484 PolarHBondContact O-N 3.43Å; G480-S484 PolarHBondContact O-OG 2.86Å; V481-S484 WeakPolarHBondContact O-CB 3.23Å; V481-S484 PolarHBondContact O-N 2.66Å; V481-S484 VanDerWaalsContact O-N 3.14Å; G482-S484 VanDerWaalsContact C-N 3.3Å; G482-S484 PolarHBondContact O-N 3.25Å; S484-W488 PolarHBondContact O-N 2.81Å
485V95.5Very high91.4Very high53 Ų5338 Ų3832%0.32118%0.176SC..Hα-helixtrans-68.4-41.2176.41780000110.8F19 F23 V481 G482 I483 L487 W488 I489F19-V485 HydrophobicContact CZ-CG2 4.35Å; F23-V485 HydrophobicContact CD2-CB 4.29Å; F23-V485 HydrophobicContact CD2-CG1 3.89Å; F23-V485 HydrophobicContact CE2-CG1 4.04Å; V481-V485 HydrophobicContact CG1-CG2 4.39Å; V481-V485 WeakPolarHBondContact O-CG2 3.49Å; V481-V485 PolarHBondContact O-N 2.92Å; G482-V485 PolarHBondContact O-N 2.76Å; I483-V485 PolarHBondContact O-N 2.92Å; V485-L487 PolarHBondContact O-N 3.45Å; V485-W488 PolarHBondContact O-N 3.19Å; V485-I489 HydrophobicContact CG1-CD1 3.79Å; V485-I489 HydrophobicContact CG1-CG1 4.33Å; V485-I489 WeakPolarHBondContact O-CG1 3.4Å; V485-I489 PolarHBondContact O-N 2.84Å
486G93.4Very high90.5Very high0 Ų041.8 Ų41.80%019%0.194CC..Hα-helixtrans-54.9-49.8174.600000113.8F23 G482 I483 W488 W490 G491F23-G486 VanDerWaalsContact CD2-N 3.31Å; F23-G486 WeakPolarHBondContact O-CA 3.22Å; G482-G486 PolarHBondContact O-N 2.9Å; I483-G486 PolarHBondContact O-N 3.45Å; G486-W488 PolarHBondContact O-N 3.35Å; G486-W490 PolarHBondContact O-N 3.47Å; G486-G491 PolarHBondContact O-N 2.71Å
487L91.8Very high89.5Confident0 Ų044.4 Ų44.40%021%0.21CC..Iπ-helixtrans-53.4-52.1172.9161.958.8000112.2G26 V30 A52 I483 V485 I489 G491 R492 I495G26-L487 VanDerWaalsContact O-CA 3.29Å; G26-L487 WeakPolarHBondContact O-CA 3.38Å; G26-L487 PolarHBondContact O-N 3.49Å; V30-L487 HydrophobicContact CB-CD1 3.88Å; V30-L487 HydrophobicContact CG1-CD1 3.59Å; V30-L487 HydrophobicContact CG1-CD2 4.28Å; V30-L487 HydrophobicContact CG1-CG 4.48Å; V30-L487 HydrophobicContact CG2-CB 4.15Å; V30-L487 HydrophobicContact CG2-CD1 4.08Å; V30-L487 HydrophobicContact CG2-CD2 4.24Å; V30-L487 HydrophobicContact CG2-CG 4.37Å; A52-L487 HydrophobicContact CB-CD2 3.54Å; I483-L487 WeakPolarHBondContact O-CB 3.34Å; I483-L487 PolarHBondContact O-N 3.44Å; V485-L487 PolarHBondContact O-N 3.45Å; L487-I489 PolarHBondContact O-N 2.95Å; L487-G491 WeakPolarHBondContact O-CA 3.15Å; L487-G491 PolarHBondContact O-N 3.09Å; L487-R492 WeakPolarHBondContact O-CG 3.46Å; L487-R492 PolarHBondContact O-N 2.95Å; L487-R492 VanDerWaalsContact O-N 3.08Å; L487-I495 HydrophobicContact CD1-CD1 3.64Å
488W93.2Very high88.4Confident82 Ų8244 Ų4431%0.31121%0.206SC..Iπ-helixtrans-72.8-28.5-171.6-84.169.2000113.6C49 I50 T53 S484 V485 G486 R492C49-W488 HydrophobicContact CB-CD2 4.44Å; C49-W488 HydrophobicContact CB-CH2 4.31Å; C49-W488 HydrophobicContact CB-CZ2 3.59Å; C49-W488 PolarHBondContact O-NE1 3.1Å; I50-W488 HydrophobicContact CG1-CH2 3.98Å; I50-W488 HydrophobicContact CG1-CZ2 3.76Å; T53-W488 PolarHBondContact OG1-NE1 3.32Å; S484-W488 PolarHBondContact O-N 2.81Å; V485-W488 PolarHBondContact O-N 3.19Å; G486-W488 PolarHBondContact O-N 3.35Å; W488-R492 VanDerWaalsContact CE3-CZ 3.44Å; W488-R492 VanDerWaalsContact CE3-NH1 3.33Å; W488-R492 VanDerWaalsContact CZ3-NH1 3.3Å; W488-R492 PolarHBondContact O-NE 3.4Å; W488-R492 PolarHBondContact O-NH2 3.17Å
489I91.7Very high87Confident113 Ų11341.1 Ų41.158%0.57920%0.195SC*.Iπ-helixtrans-89.4-48.4-179.5-64.4-172.8000111.8F23 V485 L487F23-I489 HydrophobicContact CE2-CB 3.94Å; F23-I489 HydrophobicContact CE2-CD1 4.1Å; F23-I489 HydrophobicContact CE2-CG1 4.39Å; F23-I489 HydrophobicContact CE2-CG2 4.29Å; F23-I489 HydrophobicContact CZ-CB 4.11Å; F23-I489 HydrophobicContact CZ-CG2 4.06Å; V485-I489 HydrophobicContact CG1-CD1 3.79Å; V485-I489 HydrophobicContact CG1-CG1 4.33Å; V485-I489 WeakPolarHBondContact O-CG1 3.4Å; V485-I489 PolarHBondContact O-N 2.84Å; L487-I489 PolarHBondContact O-N 2.95Å
490W87.3Confident85.6Confident72 Ų7247.9 Ų47.927%0.27323%0.227SC..Iπ-helixtrans-118-43.6-172.3-162.6-16.5000112.6F23 A27 T110 F111 G486 R492 R493F23-W490 HydrophobicContact CE1-CE3 4.13Å; A27-W490 HydrophobicContact CB-CB 3.79Å; A27-W490 HydrophobicContact CB-CD2 4.43Å; A27-W490 HydrophobicContact CB-CG 4.15Å; T110-W490 HydrophobicContact CG2-CD2 4.05Å; T110-W490 HydrophobicContact CG2-CE3 4.25Å; T110-W490 HydrophobicContact CG2-CH2 4.02Å; T110-W490 HydrophobicContact CG2-CZ2 3.8Å; T110-W490 HydrophobicContact CG2-CZ3 4.23Å; F111-W490 HydrophobicContact CB-CH2 4.4Å; G486-W490 PolarHBondContact O-N 3.47Å; W490-R492 PolarHBondContact O-N 3.16Å; W490-R493 PolarHBondContact O-N 2.7Å
491G85.1Confident84Confident2 Ų253.9 Ų53.92%0.02126%0.259CS..Iπ-helixtrans-56-27.4-174.500000114.9A27 G486 L487 R493 V494 I495A27-G491 VanDerWaalsContact O-CA 3.3Å; A27-G491 WeakPolarHBondContact O-CA 3.18Å; G486-G491 PolarHBondContact O-N 2.71Å; L487-G491 WeakPolarHBondContact O-CA 3.15Å; L487-G491 PolarHBondContact O-N 3.09Å; G491-R493 VanDerWaalsContact C-N 3.27Å; G491-R493 PolarHBondContact O-N 3.34Å; G491-V494 WeakPolarHBondContact O-CB 2.99Å; G491-V494 PolarHBondContact O-N 3.06Å; G491-V494 VanDerWaalsContact O-N 3.09Å; G491-I495 WeakPolarHBondContact O-CG1 3.15Å; G491-I495 PolarHBondContact O-N 3.29Å
492R81.6Confident82Confident70 Ų7056.4 Ų56.426%0.26427%0.27SS..Hα-helixtrans-50.8-42.3171.4-59.7-152.8-141.5-123.118.6114.4L45 L487 W488 W490 I495 Q496L45-R492 HydrophobicContact CD1-CB 4.44Å; L45-R492 HydrophobicContact CD2-CB 4.22Å; L487-R492 WeakPolarHBondContact O-CG 3.46Å; L487-R492 PolarHBondContact O-N 2.95Å; L487-R492 VanDerWaalsContact O-N 3.08Å; W488-R492 VanDerWaalsContact CE3-CZ 3.44Å; W488-R492 VanDerWaalsContact CE3-NH1 3.33Å; W488-R492 VanDerWaalsContact CZ3-NH1 3.3Å; W488-R492 PolarHBondContact O-NE 3.4Å; W488-R492 PolarHBondContact O-NH2 3.17Å; W490-R492 PolarHBondContact O-N 3.16Å; R492-I495 PolarHBondContact O-N 3.1Å; R492-Q496 WeakPolarHBondContact O-CG 3.27Å; R492-Q496 PolarHBondContact O-N 2.95Å; R492-Q496 VanDerWaalsContact O-N 3.08Å
493R79.6Confident79.7Confident174 Ų17457.5 Ų57.566%0.65728%0.276SS*.Hα-helixtrans-67.5-41.3-179.5-62.8-178.8-178.3177-0.1110.2W490 G491 Q496 T497W490-R493 PolarHBondContact O-N 2.7Å; G491-R493 VanDerWaalsContact C-N 3.27Å; G491-R493 PolarHBondContact O-N 3.34Å; R493-Q496 WeakPolarHBondContact O-CB 3.39Å; R493-Q496 PolarHBondContact O-N 2.84Å; R493-T497 PolarHBondContact O-N 3.46Å; R493-T497 PolarHBondContact O-OG1 2.93Å; R493-T497 VanDerWaalsContact O-OG1 3.12Å
494V78.9Confident77.2Confident34 Ų3466.6 Ų66.621%0.20632%0.316CS..Hα-helixtrans-64.7-40.4177.7-173.50000111.1A27 A31 G491 Q496 T497 L498A27-V494 WeakPolarHBondContact O-CG2 3.01Å; A31-V494 HydrophobicContact CB-CB 4.47Å; A31-V494 HydrophobicContact CB-CG1 3.87Å; G491-V494 WeakPolarHBondContact O-CB 2.99Å; G491-V494 PolarHBondContact O-N 3.06Å; G491-V494 VanDerWaalsContact O-N 3.09Å; V494-Q496 VanDerWaalsContact C-N 3.34Å; V494-Q496 PolarHBondContact O-N 3.16Å; V494-T497 PolarHBondContact O-N 2.94Å; V494-L498 HydrophobicContact CG1-CD1 3.97Å; V494-L498 WeakPolarHBondContact O-CB 2.99Å; V494-L498 PolarHBondContact O-N 3.46Å
495I80.4Confident75.1Confident0 Ų067.7 Ų67.70%032%0.321CS..Hα-helixtrans-62.1-39.4173.1-63161.7000111.5V30 A31 V38 L45 L487 G491 R492 G499V30-I495 HydrophobicContact CB-CD1 4.47Å; V30-I495 HydrophobicContact CG1-CD1 3.91Å; A31-I495 HydrophobicContact CB-CB 4.45Å; A31-I495 HydrophobicContact CB-CG1 3.92Å; V38-I495 HydrophobicContact CB-CG2 4.02Å; V38-I495 HydrophobicContact CG1-CG2 4.26Å; V38-I495 HydrophobicContact CG2-CG2 3.78Å; L45-I495 HydrophobicContact CD1-CB 3.82Å; L45-I495 HydrophobicContact CD1-CD1 4.26Å; L45-I495 HydrophobicContact CD1-CG2 3.57Å; L487-I495 HydrophobicContact CD1-CD1 3.64Å; G491-I495 WeakPolarHBondContact O-CG1 3.15Å; G491-I495 PolarHBondContact O-N 3.29Å; R492-I495 PolarHBondContact O-N 3.1Å; I495-G499 WeakPolarHBondContact O-CA 3.41Å; I495-G499 PolarHBondContact O-N 3.3Å
496Q76.3Confident72.8Confident81 Ų8166.8 Ų66.838%0.37932%0.317SS..Hα-helixtrans-66.9-51.1176-71174.2-72.200111.3L45 R492 R493 V494 L498 G499 E500L45-Q496 HydrophobicContact CD1-CG 4.25Å; L45-Q496 HydrophobicContact CD2-CG 3.67Å; R492-Q496 WeakPolarHBondContact O-CG 3.27Å; R492-Q496 PolarHBondContact O-N 2.95Å; R492-Q496 VanDerWaalsContact O-N 3.08Å; R493-Q496 WeakPolarHBondContact O-CB 3.39Å; R493-Q496 PolarHBondContact O-N 2.84Å; V494-Q496 VanDerWaalsContact C-N 3.34Å; V494-Q496 PolarHBondContact O-N 3.16Å; Q496-L498 PolarHBondContact O-N 2.8Å; Q496-G499 CarbonylContact O-C 3.53Å; Q496-G499 PolarHBondContact O-N 3.38Å; Q496-G499 VanDerWaalsContact O-N 3.16Å; Q496-E500 WeakPolarHBondContact O-CB 3.28Å; Q496-E500 WeakPolarHBondContact O-CG 3.41Å; Q496-E500 PolarHBondContact O-N 3.39Å
497T74.2Confident70.7Confident56 Ų5667.9 Ų67.934%0.34432%0.324SS..Hα-helixtrans-56.1-54.2178.1-59.10000111.5R493 V494 G499 E500 D501R493-T497 PolarHBondContact O-N 3.46Å; R493-T497 PolarHBondContact O-OG1 2.93Å; R493-T497 VanDerWaalsContact O-OG1 3.12Å; V494-T497 PolarHBondContact O-N 2.94Å; T497-G499 VanDerWaalsContact C-N 3.29Å; T497-G499 PolarHBondContact O-N 2.92Å; T497-E500 PolarHBondContact O-N 3.43Å; T497-D501 WeakPolarHBondContact CG2-OD2 3.39Å; T497-D501 VanDerWaalsContact O-CB 3.27Å; T497-D501 WeakPolarHBondContact O-CB 3.26Å; T497-D501 PolarHBondContact O-N 2.84Å
498L71.8Confident68.8Low51 Ų5168.5 Ų68.527%0.26733%0.328SS..Hα-helixtrans-68.1-28.2178.3-70.6169.3000112.8A31 V494 Q496 L502 T503A31-L498 HydrophobicContact CB-CB 4.3Å; A31-L498 HydrophobicContact CB-CD1 3.47Å; A31-L498 VanDerWaalsContact CB-CD1 3.47Å; A31-L498 HydrophobicContact CB-CG 4.43Å; V494-L498 HydrophobicContact CG1-CD1 3.97Å; V494-L498 WeakPolarHBondContact O-CB 2.99Å; V494-L498 PolarHBondContact O-N 3.46Å; Q496-L498 PolarHBondContact O-N 2.8Å; L498-L502 HydrophobicContact CB-CD1 4.36Å; L498-L502 HydrophobicContact CD2-CD1 3.64Å; L498-L502 HydrophobicContact CD2-CG 4.13Å; L498-L502 VanDerWaalsContact O-CB 3.31Å; L498-L502 WeakPolarHBondContact O-CB 3.37Å; L498-L502 PolarHBondContact O-N 3.38Å; L498-T503 PolarHBondContact O-OG1 3.49Å
499G67.7Low66.7Low3 Ų366.6 Ų66.63%0.03132%0.321CS..Hα-helixtrans-72.4-30.217400000114.1G35 G39 I495 Q496 T497 T503G35-G499 WeakPolarHBondContact O-CA 3.44Å; G39-G499 WeakPolarHBondContact CA-O 3.32Å; I495-G499 WeakPolarHBondContact O-CA 3.41Å; I495-G499 PolarHBondContact O-N 3.3Å; Q496-G499 CarbonylContact O-C 3.53Å; Q496-G499 PolarHBondContact O-N 3.38Å; Q496-G499 VanDerWaalsContact O-N 3.16Å; T497-G499 VanDerWaalsContact C-N 3.29Å; T497-G499 PolarHBondContact O-N 2.92Å; G499-T503 VanDerWaalsContact C-OG1 3.29Å; G499-T503 WeakPolarHBondContact O-CB 3.27Å; G499-T503 PolarHBondContact O-OG1 3.33Å
500E67.9Low64.7Low141 Ų14166.5 Ų66.566%0.65932%0.321SS*.Hα-helixtrans-94.8-44.2-178.4-70.1174.6-173.300111.4Q496 T497Q496-E500 WeakPolarHBondContact O-CB 3.28Å; Q496-E500 WeakPolarHBondContact O-CG 3.41Å; Q496-E500 PolarHBondContact O-N 3.39Å; T497-E500 PolarHBondContact O-N 3.43Å
501D63.1Low63Low127 Ų12764.3 Ų64.368%0.67932%0.315SS*.Hα-helixtrans-75.9-35.2-174.6-63.6-24.4000113.2T497T497-D501 WeakPolarHBondContact CG2-OD2 3.39Å; T497-D501 VanDerWaalsContact O-CB 3.27Å; T497-D501 WeakPolarHBondContact O-CB 3.26Å; T497-D501 PolarHBondContact O-N 2.84Å
502L54.8Low61.2Low113 Ų11367.8 Ų67.859%0.59233%0.33SS*.SBendtrans-87.2-16.1178.4-58.5-179.7000113.5L498 I505L498-L502 HydrophobicContact CB-CD1 4.36Å; L498-L502 HydrophobicContact CD2-CD1 3.64Å; L498-L502 HydrophobicContact CD2-CG 4.13Å; L498-L502 VanDerWaalsContact O-CB 3.31Å; L498-L502 WeakPolarHBondContact O-CB 3.37Å; L498-L502 PolarHBondContact O-N 3.38Å; L502-I505 WeakPolarHBondContact O-CD1 3.43Å
503T48.4Very low59.5Low23 Ų2371.7 Ų71.714%0.14135%0.345CS..  trans-124.244.4-154.6-7.80000116.3L498 G499 I505L498-T503 PolarHBondContact O-OG1 3.49Å; G499-T503 VanDerWaalsContact C-OG1 3.29Å; G499-T503 WeakPolarHBondContact O-CB 3.27Å; G499-T503 PolarHBondContact O-OG1 3.33Å; T503-I505 HydrophobicContact CG2-CB 4.18Å; T503-I505 PolarHBondContact O-N 2.85Å
504K43.3Very low58Low192 Ų19267.4 Ų67.484%0.83533%0.331SS*.  trans-69.139.2146.7-75.2-170.8178.1179.40112
505I51.8Low56.3Low34 Ų3466.2 Ų66.217%0.17432%0.324CS..  trans-123.9110.2-169.8-55.9-177.8000108.2L502 T503 R509 L510L502-I505 WeakPolarHBondContact O-CD1 3.43Å; T503-I505 HydrophobicContact CG2-CB 4.18Å; T503-I505 PolarHBondContact O-N 2.85Å; I505-R509 HydrophobicContact CG2-CB 3.7Å; I505-L510 HydrophobicContact CG2-CB 4.41Å
506S47.4Very low54.5Low34 Ų3470.6 Ų70.624%0.23834%0.343CS..  trans-62.1151.6171.3-151.40000110.5D418 S508 R509D418-S506 PolarHBondContact OD2-OG 3.08Å; S506-S508 VanDerWaalsContact C-N 3.25Å; S506-S508 PolarHBondContact O-N 2.78Å; S506-S508 VanDerWaalsContact O-N 3.1Å; S506-R509 WeakPolarHBondContact O-CB 3.35Å; S506-R509 PolarHBondContact O-N 3.15Å
507P48.2Very low52.9Low24 Ų2474.9 Ų74.916%0.15636%0.361CS..THydrogen-bonded Turntrans-49.8-37.3-177.9-31.537.7000115.3A40 A423 F426A40-P507 HydrophobicContact CB-CG 4.44Å; A423-P507 HydrophobicContact CB-CG 4.45Å; F426-P507 HydrophobicContact CB-CB 4.11Å
508S51.4Low51.4Low13 Ų1377 Ų779%0.09137%0.368CS..THydrogen-bonded Turntrans-75.1-27.6172.885.30000114.3D418 S506 L510 I511 E512D418-S508 WeakPolarHBondContact OD1-CB 3.49Å; D418-S508 PolarHBondContact OD1-OG 3.2Å; D418-S508 PolarHBondContact OD2-N 3.29Å; S506-S508 VanDerWaalsContact C-N 3.25Å; S506-S508 PolarHBondContact O-N 2.78Å; S506-S508 VanDerWaalsContact O-N 3.1Å; S508-L510 PolarHBondContact O-N 2.94Å; S508-I511 CarbonylContact O-C 3.45Å; S508-I511 VanDerWaalsContact O-CA 3.3Å; S508-I511 WeakPolarHBondContact O-CA 3.3Å; S508-I511 VanDerWaalsContact O-CB 3.23Å; S508-I511 WeakPolarHBondContact O-CB 3.32Å; S508-I511 PolarHBondContact O-N 2.98Å; S508-E512 PolarHBondContact O-N 2.85Å
509R49.9Very low50.1Low41 Ų4179.4 Ų79.416%0.15538%0.378CS..Hα-helixtrans-66.8-22.6-174.8-69.9-176.5-176.7-168.3-4.2111.8D414 V416 I505 S506 I511 R513D414-R509 PolarHBondContact O-NH2 3.02Å; D414-R509 VanDerWaalsContact O-NH2 3.15Å; V416-R509 PolarHBondContact O-NE 3.32Å; V416-R509 PolarHBondContact O-NH2 3.16Å; I505-R509 HydrophobicContact CG2-CB 3.7Å; S506-R509 WeakPolarHBondContact O-CB 3.35Å; S506-R509 PolarHBondContact O-N 3.15Å; R509-I511 VanDerWaalsContact C-N 3.27Å; R509-R513 VanDerWaalsContact O-CB 3.29Å; R509-R513 WeakPolarHBondContact O-CB 3.4Å; R509-R513 WeakPolarHBondContact O-CG 3.28Å; R509-R513 PolarHBondContact O-N 3.36Å
510L49.7Very low49.1Very low112 Ų11284 Ų8459%0.58641%0.405SS*.Hα-helixtrans-62.2-36.9168.5-174.372.5000111.8I505 S508I505-L510 HydrophobicContact CG2-CB 4.41Å; S508-L510 PolarHBondContact O-N 2.94Å
511I51.2Low47.9Very low26 Ų2685.1 Ų85.113%0.13341%0.41CS..Hα-helixtrans-77.3-59.3174.7-69.8164.8000106.8F166 L174 F426 S508 R509 R513F166-I511 HydrophobicContact CD2-CB 4.1Å; F166-I511 HydrophobicContact CD2-CG2 3.6Å; F166-I511 HydrophobicContact CE2-CB 4.04Å; F166-I511 HydrophobicContact CE2-CG2 3.38Å; F166-I511 WeakPolarHBondContact CE2-O 3.19Å; F166-I511 WeakPolarHBondContact CZ-O 3.43Å; L174-I511 HydrophobicContact CD1-CG2 3.33Å; L174-I511 HydrophobicContact CG-CG2 4.49Å; F426-I511 HydrophobicContact CD1-CD1 3.75Å; F426-I511 HydrophobicContact CE1-CD1 3.49Å; F426-I511 VanDerWaalsContact CE1-CD1 3.49Å; F426-I511 HydrophobicContact CZ-CD1 4.31Å; S508-I511 CarbonylContact O-C 3.45Å; S508-I511 VanDerWaalsContact O-CA 3.3Å; S508-I511 WeakPolarHBondContact O-CA 3.3Å; S508-I511 VanDerWaalsContact O-CB 3.23Å; S508-I511 WeakPolarHBondContact O-CB 3.32Å; S508-I511 PolarHBondContact O-N 2.98Å; R509-I511 VanDerWaalsContact C-N 3.27Å; I511-R513 PolarHBondContact O-N 3.16Å
512E48.4Very low46.9Very low75 Ų7589 Ų8935%0.3542%0.416SS..Hα-helixtrans-62.4-34.5-171.2-155-170.8179.900116.1S508 K514 C515 K516S508-E512 PolarHBondContact O-N 2.85Å; E512-K514 PolarHBondContact O-N 3.49Å; E512-K514 VanDerWaalsContact O-N 3.12Å; E512-C515 WeakPolarHBondContact O-CB 3.39Å; E512-C515 PolarHBondContact O-N 2.77Å; E512-K516 PolarHBondContact O-N 3.13Å
513R45.4Very low46.5Very low151 Ų15190.1 Ų90.157%0.5742%0.422SS*.Hα-helixtrans-59.6-28-175.2-85.7-178168.3-173.7-2.6114.2R509 I511 C515R509-R513 VanDerWaalsContact O-CB 3.29Å; R509-R513 WeakPolarHBondContact O-CB 3.4Å; R509-R513 WeakPolarHBondContact O-CG 3.28Å; R509-R513 PolarHBondContact O-N 3.36Å; I511-R513 PolarHBondContact O-N 3.16Å; R513-C515 VanDerWaalsContact C-N 3.3Å; R513-C515 PolarHBondContact O-N 3.35Å
514K46.8Very low45.9Very low84 Ų8492.9 Ų92.937%0.36544%0.442SS..Hα-helixtrans-70.3-23.5172.9-78.4-175.6176.1-179.90112.8S162 F166 E512 M518S162-K514 PolarHBondContact OG-NZ 3.48Å; F166-K514 HydrophobicContact CD1-CB 4.26Å; F166-K514 HydrophobicContact CE1-CB 3.8Å; F166-K514 HydrophobicContact CZ-CB 4.13Å; E512-K514 PolarHBondContact O-N 3.49Å; E512-K514 VanDerWaalsContact O-N 3.12Å; K514-M518 WeakPolarHBondContact O-CE 3.46Å
515C45.1Very low45.7Very low9 Ų989 Ų896%0.06144%0.436CS..Hα-helixtrans-81.2-44.1179.9-90.50000114.7F166 R170 E512 R513 M518 Q519F166-C515 HydrophobicContact CZ-CB 4.21Å; F166-C515 WeakPolarHBondContact CZ-SG 3.28Å; R170-C515 VanDerWaalsContact CD-SG 3.53Å; R170-C515 PolarHBondContact NE-SG 2.89Å; R170-C515 PolarHBondContact NH1-SG 2.84Å; E512-C515 WeakPolarHBondContact O-CB 3.39Å; E512-C515 PolarHBondContact O-N 2.77Å; R513-C515 VanDerWaalsContact C-N 3.3Å; R513-C515 PolarHBondContact O-N 3.35Å; C515-M518 PolarHBondContact O-N 3.48Å; C515-Q519 PolarHBondContact O-N 2.87Å; C515-Q519 VanDerWaalsContact O-N 3.08Å
516K41.7Very low45.2Very low93 Ų9395.7 Ų95.740%0.40447%0.471SS..Hα-helixtrans-66.9-39.4-176.1-96-177.6172.4179.20112.7M413 E512 M518 Q519 V520M413-K516 VanDerWaalsContact CG-NZ 3.32Å; M413-K516 HydrophobicContact SD-CD 3.8Å; M413-K516 PolarHBondContact SD-NZ 2.79Å; E512-K516 PolarHBondContact O-N 3.13Å; K516-M518 VanDerWaalsContact C-N 3.28Å; K516-M518 PolarHBondContact O-N 3.44Å; K516-Q519 PolarHBondContact O-N 3.19Å; K516-V520 WeakPolarHBondContact O-CG2 3.37Å; K516-V520 PolarHBondContact O-N 2.86Å
517K43.3Very low44.6Very low171 Ų171105 Ų10574%0.74352%0.516SS*.Hα-helixtrans-58.9-36.9173.7-77.4-165.4170.2-167.60112.8Q521K517-Q521 PolarHBondContact O-N 2.99Å
518M42Very low44.5Very low99 Ų99109 Ų10949%0.48853%0.534SS..Hα-helixtrans-78.6-13.7175.1-73.8-168.9-78.800115.1F167 K514 C515 K516F167-M518 HydrophobicContact CZ-CE 4.46Å; K514-M518 WeakPolarHBondContact O-CE 3.46Å; C515-M518 PolarHBondContact O-N 3.48Å; K516-M518 VanDerWaalsContact C-N 3.28Å; K516-M518 PolarHBondContact O-N 3.44Å
519Q44.5Very low44.1Very low102 Ų102114.1 Ų114.148%0.47756%0.558SS.*Hα-helixtrans-95-32.6172.8-76.6-171.7-105.800112.5C515 K516 R522 N523C515-Q519 PolarHBondContact O-N 2.87Å; C515-Q519 VanDerWaalsContact O-N 3.08Å; K516-Q519 PolarHBondContact O-N 3.19Å; Q519-R522 PolarHBondContact O-N 2.96Å; Q519-R522 VanDerWaalsContact O-N 3.12Å; Q519-N523 PolarHBondContact O-N 3.05Å
520V47.1Very low43.8Very low101 Ų101118.1 Ų118.161%0.61258%0.58SS**Hα-helixtrans-65.6-41.9173.8174.80000110.6K516 R522 N523K516-V520 WeakPolarHBondContact O-CG2 3.37Å; K516-V520 PolarHBondContact O-N 2.86Å; V520-R522 PolarHBondContact O-N 3.42Å; V520-N523 PolarHBondContact O-N 3.21Å
521Q43.1Very low43.4Very low164 Ų164118.5 Ų118.577%0.76658%0.58SS**THydrogen-bonded Turntrans-68.8-9.6171.9-80-176.4-4200114.9K517K517-Q521 PolarHBondContact O-N 2.99Å
522R42.4Very low43Very low209 Ų209124.3 Ų124.379%0.78961%0.608SS**THydrogen-bonded Turntrans-101.4-10.6-179.4-154.5174.9-168.2178.34.5113.6Q519 V520Q519-R522 PolarHBondContact O-N 2.96Å; Q519-R522 VanDerWaalsContact O-N 3.12Å; V520-R522 PolarHBondContact O-N 3.42Å
523N44.4Very low42.6Very low135 Ų135127.5 Ų127.572%0.72263%0.625SS**SBendtrans-116.99.1-179.6-75.719.7000112.9Q519 V520 P525Q519-N523 PolarHBondContact O-N 3.05Å; V520-N523 PolarHBondContact O-N 3.21Å; N523-P525 WeakPolarHBondContact O-CD 3.4Å
524S36.8Very low42.4Very low81 Ų81125.9 Ų125.957%0.56663%0.629SS**  trans-67.2120163.7-65.10000108.8I526S524-I526 PolarHBondContact O-N 3.34Å
525P39.9Very low42Very low110 Ų110129.1 Ų129.171%0.71465%0.649SS**  trans-64.4136.3170.427.8-32.6000109N523 L527N523-P525 WeakPolarHBondContact O-CD 3.4Å; P525-L527 PolarHBondContact O-N 2.86Å
526I40.1Very low41.8Very low176 Ų176139.1 Ų139.190%0.90370%0.698SS**  trans-77.2105.2165.3-60.8169.8000106S524S524-I526 PolarHBondContact O-N 3.34Å
527L36.1Very low41.8Very low228 Ų228143.3 Ų143.3100%1.19473%0.725SS**  trans-146.80169.9-100.3170.4000108.4P525P525-L527 PolarHBondContact O-N 2.86Å

Retrieved 527 of 527 residues in 91.1 ms (Link to these results)

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