A0A3Q0KTS1_SCHMA Loading...

Ribosomal RNA-processing protein 42

AlphaFold DB , UniProt , Accession A0A3Q0KTS1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 277 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M46.8Very low77.8Confident163 Ų16396.5 Ų96.580%0.80351%0.506SS*.  01330-67-165.8-154.400106.5T3M1-T3 PolarHBondContact O-N 3.37Å; M1-T3 VanDerWaalsContact O-N 3.13Å
2D51Low79Confident46 Ų4699.4 Ų99.425%0.24651%0.512CS..  trans-52.5121.8175.7-73.9-17.4000108.9V4 T90D2-V4 HydrophobicContact CB-CG2 4.44Å; D2-V4 PolarHBondContact O-N 3.46Å; D2-T90 WeakPolarHBondContact OD2-CG2 3.4Å
3T59.6Low80Confident104 Ų104103.4 Ų103.464%0.63852%0.518SS*.  trans-75.876.7174.254.70000107.8M1 L5M1-T3 PolarHBondContact O-N 3.37Å; M1-T3 VanDerWaalsContact O-N 3.13Å; T3-L5 PolarHBondContact O-N 3.42Å; T3-L5 VanDerWaalsContact O-N 3.16Å
4V72.6Confident80.8Confident43 Ų4396.6 Ų96.626%0.26148%0.484SS..  trans-61.7117165.5-171.60000106D2 L6 K211 E212 A215D2-V4 HydrophobicContact CB-CG2 4.44Å; D2-V4 PolarHBondContact O-N 3.46Å; V4-L6 VanDerWaalsContact C-N 3.33Å; V4-L6 HydrophobicContact CB-CD1 4.3Å; V4-L6 HydrophobicContact CB-CG 4.44Å; V4-L6 HydrophobicContact CG1-CD1 4.17Å; V4-L6 HydrophobicContact CG1-CD2 4.5Å; V4-L6 HydrophobicContact CG1-CG 3.91Å; V4-L6 PolarHBondContact O-N 3.22Å; V4-K211 HydrophobicContact CG2-CB 4.04Å; V4-E212 HydrophobicContact CG1-CG 4.26Å; V4-A215 HydrophobicContact CB-CB 4.15Å; V4-A215 HydrophobicContact CG2-CB 4.36Å
5L79.7Confident81.6Confident139 Ų13992.6 Ų92.673%0.72847%0.467SS*.  trans-76.791.8176.4-65.8176.3000107T3T3-L5 PolarHBondContact O-N 3.42Å; T3-L5 VanDerWaalsContact O-N 3.16Å
6L85.7Confident82.2Confident38 Ų3893.3 Ų93.320%0.19947%0.468CS..  trans-96.3132.9174.2-75152.2000108.9V4 E10 L14 E212 A215V4-L6 VanDerWaalsContact C-N 3.33Å; V4-L6 HydrophobicContact CB-CD1 4.3Å; V4-L6 HydrophobicContact CB-CG 4.44Å; V4-L6 HydrophobicContact CG1-CD1 4.17Å; V4-L6 HydrophobicContact CG1-CD2 4.5Å; V4-L6 HydrophobicContact CG1-CG 3.91Å; V4-L6 PolarHBondContact O-N 3.22Å; L6-E10 HydrophobicContact CD2-CB 3.99Å; L6-L14 HydrophobicContact CD2-CD1 3.96Å; L6-E212 HydrophobicContact CD2-CB 4.26Å; L6-E212 HydrophobicContact CD2-CG 4.28Å; L6-A215 HydrophobicContact CD1-CB 3.62Å
7S92.2Very high82.8Confident54 Ų5488.8 Ų88.838%0.37845%0.45SS..  trans-68.7155.1166.866.70000110.6L9 E10 R11S7-L9 PolarHBondContact O-N 3.03Å; S7-E10 WeakPolarHBondContact CB-OE2 3.35Å; S7-E10 PolarHBondContact N-OE2 2.97Å; S7-E10 PolarHBondContact O-N 3.48Å; S7-E10 VanDerWaalsContact O-N 3.14Å; S7-E10 WeakPolarHBondContact OG-CB 3.48Å; S7-E10 WeakPolarHBondContact OG-CG 3.16Å; S7-E10 PolarHBondContact OG-N 3.2Å; S7-E10 PolarHBondContact OG-OE2 3.27Å; S7-R11 PolarHBondContact O-N 3.27Å
8D91.8Very high83.3Confident141 Ų14184.2 Ų84.275%0.75443%0.428SS*.Hα-helixtrans-59.8-32177.9-66.1-32000112.1F12D8-F12 VanDerWaalsContact O-CB 3.27Å; D8-F12 WeakPolarHBondContact O-CB 3.13Å; D8-F12 PolarHBondContact O-N 3.48Å
9L93.8Very high83.6Confident143 Ų14385.1 Ų85.175%0.74943%0.43SS*.Hα-helixtrans-69.3-42.4176.3-67.4177000112.1S7 F12 Y13S7-L9 PolarHBondContact O-N 3.03Å; L9-F12 PolarHBondContact O-N 2.92Å; L9-Y13 WeakPolarHBondContact O-CB 3.44Å; L9-Y13 PolarHBondContact O-N 3.36Å
10E91.7Very high83.9Confident100 Ų10086.4 Ų86.447%0.46744%0.442SS..Hα-helixtrans-63.8-44.8174.7-74.2160.116300110.7L6 S7 F12 Y13 L14L6-E10 HydrophobicContact CD2-CB 3.99Å; S7-E10 WeakPolarHBondContact CB-OE2 3.35Å; S7-E10 PolarHBondContact N-OE2 2.97Å; S7-E10 PolarHBondContact O-N 3.48Å; S7-E10 VanDerWaalsContact O-N 3.14Å; S7-E10 WeakPolarHBondContact OG-CB 3.48Å; S7-E10 WeakPolarHBondContact OG-CG 3.16Å; S7-E10 PolarHBondContact OG-N 3.2Å; S7-E10 PolarHBondContact OG-OE2 3.27Å; E10-F12 VanDerWaalsContact C-N 3.33Å; E10-F12 PolarHBondContact O-N 2.67Å; E10-Y13 PolarHBondContact O-N 3.39Å; E10-L14 WeakPolarHBondContact O-CB 3.42Å; E10-L14 VanDerWaalsContact O-CG 3.31Å; E10-L14 WeakPolarHBondContact O-CG 3.3Å; E10-L14 PolarHBondContact O-N 2.67Å
11R91.2Very high84.1Confident90 Ų9084 Ų8434%0.3444%0.438SS..Hα-helixtrans-59.2-45.5175.7-175.1177.5-175.5100.97.1111.3S7 L14 V15 A215 C216S7-R11 PolarHBondContact O-N 3.27Å; R11-L14 PolarHBondContact O-N 3.36Å; R11-V15 VanDerWaalsContact O-CG2 3.27Å; R11-V15 WeakPolarHBondContact O-CG2 3.38Å; R11-V15 PolarHBondContact O-N 2.98Å; R11-A215 PolarHBondContact NH1-O 2.95Å; R11-C216 PolarHBondContact NH2-O 3.01Å
12F92.1Very high86Confident132 Ų13280 Ų8058%0.57943%0.426SS*.Hα-helixtrans-62.5-44.9177.7-177.1-96.9000111.7D8 L9 E10 V15 Q16D8-F12 VanDerWaalsContact O-CB 3.27Å; D8-F12 WeakPolarHBondContact O-CB 3.13Å; D8-F12 PolarHBondContact O-N 3.48Å; L9-F12 PolarHBondContact O-N 2.92Å; E10-F12 VanDerWaalsContact C-N 3.33Å; E10-F12 PolarHBondContact O-N 2.67Å; F12-V15 PolarHBondContact O-N 3.29Å; F12-Q16 WeakPolarHBondContact O-CB 3.36Å; F12-Q16 PolarHBondContact O-N 3.3Å
13Y92.1Very high87.8Confident151 Ų15178.5 Ų78.559%0.59242%0.417SS*.Hα-helixtrans-60.7-45.7177.5-176.6-100.4000112L9 E10 Q16 G17 M24L9-Y13 WeakPolarHBondContact O-CB 3.44Å; L9-Y13 PolarHBondContact O-N 3.36Å; E10-Y13 PolarHBondContact O-N 3.39Å; Y13-Q16 PolarHBondContact O-N 2.73Å; Y13-G17 PolarHBondContact O-N 3.25Å; Y13-M24 HydrophobicContact CD1-CE 4.33Å; Y13-M24 HydrophobicContact CD1-SD 3.72Å; Y13-M24 HydrophobicContact CE1-CE 4Å; Y13-M24 HydrophobicContact CE1-SD 3.46Å; Y13-M24 WeakPolarHBondContact CE1-SD 3.36Å
14L91.6Very high89.1Confident8 Ų878.5 Ų78.54%0.04241%0.411CS..Hα-helixtrans-60.7-49.6177.8-76167.9000111.8L6 E10 R11 Q16 G17 V18 M24 E212L6-L14 HydrophobicContact CD2-CD1 3.96Å; E10-L14 WeakPolarHBondContact O-CB 3.42Å; E10-L14 VanDerWaalsContact O-CG 3.31Å; E10-L14 WeakPolarHBondContact O-CG 3.3Å; E10-L14 PolarHBondContact O-N 2.67Å; R11-L14 PolarHBondContact O-N 3.36Å; L14-Q16 PolarHBondContact O-N 3.01Å; L14-G17 PolarHBondContact O-N 3.13Å; L14-V18 WeakPolarHBondContact O-CB 3.43Å; L14-V18 WeakPolarHBondContact O-CG2 3.32Å; L14-V18 PolarHBondContact O-N 2.96Å; L14-M24 HydrophobicContact CD2-CG 3.27Å; L14-M24 HydrophobicContact CD2-SD 3.61Å; L14-M24 HydrophobicContact CG-SD 4.5Å; L14-E212 HydrophobicContact CD1-CB 4Å
15V91.7Very high89.8Confident37 Ų3780.5 Ų80.522%0.22442%0.42CS..Hα-helixtrans-62.3-46.2-179.7174.70000110.7R11 F12 V18 E19 I201R11-V15 VanDerWaalsContact O-CG2 3.27Å; R11-V15 WeakPolarHBondContact O-CG2 3.38Å; R11-V15 PolarHBondContact O-N 2.98Å; F12-V15 PolarHBondContact O-N 3.29Å; V15-V18 PolarHBondContact O-N 3.37Å; V15-E19 WeakPolarHBondContact O-CG 3.39Å; V15-E19 PolarHBondContact O-N 3.19Å; V15-I201 HydrophobicContact CB-CG2 4.32Å; V15-I201 HydrophobicContact CG1-CG2 4.43Å; V15-I201 HydrophobicContact CG2-CG2 3.82Å
16Q92Very high90.2Very high103 Ų10377 Ų7748%0.48142%0.418SS..Hα-helixtrans-67.2-41.1-179.7-171.61775.700112.2F12 Y13 L14 V18 E19 V20F12-Q16 WeakPolarHBondContact O-CB 3.36Å; F12-Q16 PolarHBondContact O-N 3.3Å; Y13-Q16 PolarHBondContact O-N 2.73Å; L14-Q16 PolarHBondContact O-N 3.01Å; Q16-V18 VanDerWaalsContact C-N 3.34Å; Q16-V18 PolarHBondContact O-N 3.01Å; Q16-E19 PolarHBondContact O-N 3.28Å; Q16-V20 WeakPolarHBondContact O-CG2 3.43Å; Q16-V20 PolarHBondContact O-N 3.14Å; Q16-V20 VanDerWaalsContact O-N 3.15Å
17G91.8Very high90.4Very high17 Ų1776.6 Ų76.618%0.17541%0.414CS..Hα-helixtrans-60.1-46.2176.500000111.5Y13 L14 E19 V20 G21 C22Y13-G17 PolarHBondContact O-N 3.25Å; L14-G17 PolarHBondContact O-N 3.13Å; G17-E19 VanDerWaalsContact C-N 3.34Å; G17-E19 PolarHBondContact O-N 3.27Å; G17-V20 CarbonylContact O-C 3.56Å; G17-V20 PolarHBondContact O-N 2.85Å; G17-V20 VanDerWaalsContact O-N 3.1Å; G17-G21 PolarHBondContact O-N 3.31Å; G17-C22 CarbonylContact C-O 3.58Å; G17-C22 WeakPolarHBondContact CA-O 3.4Å; G17-C22 PolarHBondContact O-N 3.37Å; G17-C22 VanDerWaalsContact O-O 3.08Å
18V91.6Very high90.2Very high7 Ų774.9 Ų74.94%0.04240%0.404CS..Hα-helixtrans-63.7-37.5178.2167.20000112.1L14 V15 Q16 V20 G21 I201 A204 L206L14-V18 WeakPolarHBondContact O-CB 3.43Å; L14-V18 WeakPolarHBondContact O-CG2 3.32Å; L14-V18 PolarHBondContact O-N 2.96Å; V15-V18 PolarHBondContact O-N 3.37Å; Q16-V18 VanDerWaalsContact C-N 3.34Å; Q16-V18 PolarHBondContact O-N 3.01Å; V18-V20 VanDerWaalsContact C-N 3.28Å; V18-V20 PolarHBondContact O-N 2.79Å; V18-G21 PolarHBondContact O-N 2.95Å; V18-I201 HydrophobicContact CG1-CB 4.04Å; V18-I201 HydrophobicContact CG1-CG2 4.3Å; V18-A204 HydrophobicContact CG1-CB 3.72Å; V18-L206 HydrophobicContact CB-CD1 4.43Å; V18-L206 HydrophobicContact CG1-CD1 3.76Å; V18-L206 HydrophobicContact CG1-CD2 3.9Å; V18-L206 HydrophobicContact CG1-CG 3.82Å; V18-L206 HydrophobicContact CG2-CD1 3.74Å
19E89.2Confident90Very high101 Ų10170.8 Ų70.847%0.47239%0.385SS..Hα-helixtrans-64.8-31.2173.8-75.3-172.4164.700113.2V15 Q16 G17 G21V15-E19 WeakPolarHBondContact O-CG 3.39Å; V15-E19 PolarHBondContact O-N 3.19Å; Q16-E19 PolarHBondContact O-N 3.28Å; G17-E19 VanDerWaalsContact C-N 3.34Å; G17-E19 PolarHBondContact O-N 3.27Å; E19-G21 VanDerWaalsContact C-N 3.29Å
20V90Very high89.8Confident111 Ų11166.9 Ų66.967%0.67337%0.37SS*.Hα-helixtrans-81.6-11.3173.8179.30000111.8Q16 G17 V18Q16-V20 WeakPolarHBondContact O-CG2 3.43Å; Q16-V20 PolarHBondContact O-N 3.14Å; Q16-V20 VanDerWaalsContact O-N 3.15Å; G17-V20 CarbonylContact O-C 3.56Å; G17-V20 PolarHBondContact O-N 2.85Å; G17-V20 VanDerWaalsContact O-N 3.1Å; V18-V20 VanDerWaalsContact C-N 3.28Å; V18-V20 PolarHBondContact O-N 2.79Å
21G87.2Confident89.7Confident35 Ų3567.2 Ų67.236%0.36137%0.372SS..THydrogen-bonded Turntrans84.617.6-176.900000114G17 V18 E19G17-G21 PolarHBondContact O-N 3.31Å; V18-G21 PolarHBondContact O-N 2.95Å; E19-G21 VanDerWaalsContact C-N 3.29Å
22C87.3Confident89.7Confident81 Ų8164.5 Ų64.555%0.54736%0.362SS..  trans-107114176.1-63.50000110.3G17G17-C22 CarbonylContact C-O 3.58Å; G17-C22 WeakPolarHBondContact CA-O 3.4Å; G17-C22 PolarHBondContact O-N 3.37Å; G17-C22 VanDerWaalsContact O-O 3.08Å
23R89.8Confident89.7Confident13 Ų1359.5 Ų59.55%0.04934%0.339CS..  trans-87.9161.8173.3-62.2177.868.8176.44.8111.2D25 G26 R27 G28 E31 I207 D208 E213R23-D25 WeakPolarHBondContact CB-OD1 3.5Å; R23-D25 PolarHBondContact O-N 3.21Å; R23-G26 PolarHBondContact O-N 3.16Å; R23-R27 VanDerWaalsContact CD-O 3.29Å; R23-R27 WeakPolarHBondContact CD-O 3.45Å; R23-R27 WeakPolarHBondContact CG-O 3.44Å; R23-R27 VanDerWaalsContact CZ-CZ 3.47Å; R23-G28 VanDerWaalsContact CD-O 3.29Å; R23-G28 WeakPolarHBondContact CD-O 3.36Å; R23-G28 PolarHBondContact NH1-O 2.64Å; R23-E31 PolarHBondContact NH1-O 3.06Å; R23-E31 VanDerWaalsContact NH1-O 3.11Å; R23-I207 PolarHBondContact NH1-O 3.06Å; R23-D208 PolarHBondContact NH2-O 3.39Å; R23-E213 IonicContact CZ-OE1 3.75Å; R23-E213 IonicContact CZ-OE2 3.6Å; R23-E213 IonicContact NE-OE1 3.02Å; R23-E213 PolarHBondContact NE-OE1 2.68Å; R23-E213 IonicContact NE-OE2 3.65Å; R23-E213 IonicContact NH2-OE1 3.56Å; R23-E213 IonicContact NH2-OE2 2.74Å; R23-E213 PolarHBondContact NH2-OE2 3.12Å
24M85.8Confident89.6Confident104 Ų10457.1 Ų57.151%0.51234%0.342SS..THydrogen-bonded Turntrans-57.9-32.7-179.7-66.2-57.3-66.600113.5Y13 L14Y13-M24 HydrophobicContact CD1-CE 4.33Å; Y13-M24 HydrophobicContact CD1-SD 3.72Å; Y13-M24 HydrophobicContact CE1-CE 4Å; Y13-M24 HydrophobicContact CE1-SD 3.46Å; Y13-M24 WeakPolarHBondContact CE1-SD 3.36Å; L14-M24 HydrophobicContact CD2-CG 3.27Å; L14-M24 HydrophobicContact CD2-SD 3.61Å; L14-M24 HydrophobicContact CG-SD 4.5Å
25D88.2Confident89.7Confident85 Ų8559.7 Ų59.746%0.45536%0.355SS..THydrogen-bonded Turntrans-96.31-179.755.214.4000113.5R23 R27R23-D25 WeakPolarHBondContact CB-OD1 3.5Å; R23-D25 PolarHBondContact O-N 3.21Å; D25-R27 VanDerWaalsContact C-N 3.34Å; D25-R27 VanDerWaalsContact CG-NE 3.32Å; D25-R27 WeakPolarHBondContact OD1-CB 3.47Å; D25-R27 PolarHBondContact OD1-N 3.33Å; D25-R27 VanDerWaalsContact OD1-N 3.12Å; D25-R27 IonicContact OD1-NE 3.45Å; D25-R27 PolarHBondContact OD1-NE 3.3Å; D25-R27 IonicContact OD2-CZ 3.11Å; D25-R27 IonicContact OD2-NE 2.68Å; D25-R27 PolarHBondContact OD2-NE 3.04Å; D25-R27 IonicContact OD2-NH2 2.71Å; D25-R27 PolarHBondContact OD2-NH2 3.43Å
26G86.6Confident89.7Confident67 Ų6763.3 Ų63.369%0.69137%0.37SS*.SBendtrans80.65.6-179.800000115.4R23R23-G26 PolarHBondContact O-N 3.16Å
27R89.9Confident89.8Confident29 Ų2959.3 Ų59.311%0.10935%0.352CS..  trans-71.7156.8175.2-71-173.8-67.9155.3-11.7112.5R23 D25 E31 Y32 D208R23-R27 VanDerWaalsContact CD-O 3.29Å; R23-R27 WeakPolarHBondContact CD-O 3.45Å; R23-R27 WeakPolarHBondContact CG-O 3.44Å; R23-R27 VanDerWaalsContact CZ-CZ 3.47Å; D25-R27 VanDerWaalsContact C-N 3.34Å; D25-R27 VanDerWaalsContact CG-NE 3.32Å; D25-R27 WeakPolarHBondContact OD1-CB 3.47Å; D25-R27 PolarHBondContact OD1-N 3.33Å; D25-R27 VanDerWaalsContact OD1-N 3.12Å; D25-R27 IonicContact OD1-NE 3.45Å; D25-R27 PolarHBondContact OD1-NE 3.3Å; D25-R27 IonicContact OD2-CZ 3.11Å; D25-R27 IonicContact OD2-NE 2.68Å; D25-R27 PolarHBondContact OD2-NE 3.04Å; D25-R27 IonicContact OD2-NH2 2.71Å; D25-R27 PolarHBondContact OD2-NH2 3.43Å; R27-E31 HydrophobicContact CB-CB 4.33Å; R27-E31 PolarHBondContact NH1-O 3.09Å; R27-Y32 VanDerWaalsContact NH1-C 3.31Å; R27-D208 IonicContact CZ-OD2 2.69Å; R27-D208 IonicContact NH1-OD2 3.46Å; R27-D208 PolarHBondContact NH1-OD2 2.86Å
28G89Confident89.8Confident17 Ų1764.1 Ų64.118%0.17537%0.37CS..  trans-68.3164.2165.600000113.1R23 S30 E31R23-G28 VanDerWaalsContact CD-O 3.29Å; R23-G28 WeakPolarHBondContact CD-O 3.36Å; R23-G28 PolarHBondContact NH1-O 2.64Å; G28-S30 VanDerWaalsContact C-N 3.26Å; G28-S30 PolarHBondContact O-N 3.14Å; G28-E31 PolarHBondContact N-OE2 2.86Å; G28-E31 PolarHBondContact O-N 3.08Å
29P88.1Confident89.8Confident55 Ų5563.9 Ų63.936%0.35737%0.368SS..THydrogen-bonded Turntrans-66.5-25.2-178.325.8-34.7000113.9L206 I207P29-L206 HydrophobicContact CB-CD2 3.67Å; P29-L206 WeakPolarHBondContact O-CA 3.4Å; P29-I207 PolarHBondContact O-N 3.43Å
30S88.6Confident89.7Confident61 Ų6162.9 Ų62.943%0.42737%0.366SS..THydrogen-bonded Turntrans-106.711.8-178.855.40000113.7G28G28-S30 VanDerWaalsContact C-N 3.26Å; G28-S30 PolarHBondContact O-N 3.14Å
31E90.3Very high89.6Confident107 Ų10761.3 Ų61.350%0.535%0.353SS..PPolyproline II helixtrans-101.2129-175.5-66.6-179.116900112.1R23 R27 G28R23-E31 PolarHBondContact NH1-O 3.06Å; R23-E31 VanDerWaalsContact NH1-O 3.11Å; R27-E31 HydrophobicContact CB-CB 4.33Å; R27-E31 PolarHBondContact NH1-O 3.09Å; G28-E31 PolarHBondContact N-OE2 2.86Å; G28-E31 PolarHBondContact O-N 3.08Å
32Y91.3Very high89.7Confident34 Ų3463.1 Ų63.113%0.13335%0.354CS..PPolyproline II helixtrans-75.6156.5172.1-84.3-100.6000111.7R27 D149 I207 D208 V257 L261R27-Y32 VanDerWaalsContact NH1-C 3.31Å; Y32-D149 HydrophobicContact CE1-CB 4.4Å; Y32-D149 PolarHBondContact OH-OD2 3.35Å; Y32-I207 HydrophobicContact CD2-CG2 4.06Å; Y32-I207 HydrophobicContact CE1-CG2 4.47Å; Y32-I207 HydrophobicContact CE2-CG2 3.23Å; Y32-I207 VanDerWaalsContact CZ-CG2 3.47Å; Y32-I207 WeakPolarHBondContact OH-CG2 3.42Å; Y32-D208 HydrophobicContact CD1-CB 3.52Å; Y32-D208 HydrophobicContact CD2-CB 4.47Å; Y32-D208 HydrophobicContact CE1-CB 3.7Å; Y32-D208 HydrophobicContact CG-CB 3.93Å; Y32-V257 HydrophobicContact CD2-CG1 4.13Å; Y32-V257 HydrophobicContact CE2-CG1 3.59Å; Y32-L261 HydrophobicContact CD2-CD1 3.94Å; Y32-L261 HydrophobicContact CD2-CD2 4.14Å; Y32-L261 HydrophobicContact CD2-CG 4.34Å; Y32-L261 HydrophobicContact CE1-CD1 4.09Å; Y32-L261 HydrophobicContact CE2-CD1 3.36Å; Y32-L261 HydrophobicContact CE2-CD2 4.4Å; Y32-L261 HydrophobicContact CE2-CG 4.15Å; Y32-L261 HydrophobicContact CG-CD2 4.42Å; Y32-L261 VanDerWaalsContact CZ-CD1 3.47Å
33R92.3Very high89.5Confident26 Ų2664.4 Ų64.410%0.09836%0.364CS..PPolyproline II helixtrans-59.5159.1165.6-79.1171.5-72.1179.83.4110.3L35 I53 A144 G145 D208R33-L35 PolarHBondContact O-N 2.86Å; R33-I53 HydrophobicContact CB-CG2 3.77Å; R33-A144 PolarHBondContact NH1-O 2.94Å; R33-G145 PolarHBondContact NH2-O 2.99Å; R33-D208 WeakPolarHBondContact CB-OD2 3.38Å; R33-D208 WeakPolarHBondContact CG-OD2 3.46Å; R33-D208 IonicContact CZ-OD1 3.09Å; R33-D208 IonicContact CZ-OD2 3.33Å; R33-D208 PolarHBondContact N-OD2 3.1Å; R33-D208 IonicContact NE-OD1 3.92Å; R33-D208 PolarHBondContact NE-OD1 2.79Å; R33-D208 IonicContact NE-OD2 2.71Å; R33-D208 PolarHBondContact NE-OD2 2.88Å; R33-D208 IonicContact NH2-OD1 2.89Å; R33-D208 PolarHBondContact NH2-OD1 2.88Å; R33-D208 IonicContact NH2-OD2 3.57Å
34P90.2Very high89.3Confident101 Ų10172.7 Ų72.766%0.65640%0.403SS*.PPolyproline II helixtrans-52.2128.8168.224.2-34.5000109.5G54P34-G54 PolarHBondContact O-N 3.01Å
35L92.1Very high89.2Confident62 Ų6268.5 Ų68.533%0.32539%0.385SS..EExtended strand (participates in β ladder)trans-120.4121.8-171.7-178.5155.3000108.5R33 I37 I51 R52 I53 L153R33-L35 PolarHBondContact O-N 2.86Å; L35-I37 HydrophobicContact CD2-CD1 3.54Å; L35-I37 HydrophobicContact CD2-CG1 3.57Å; L35-I51 HydrophobicContact CD1-CD1 4.01Å; L35-I51 HydrophobicContact CD2-CD1 4.29Å; L35-I51 HydrophobicContact CD2-CG1 4.44Å; L35-I51 HydrophobicContact CG-CD1 4.06Å; L35-I51 HydrophobicContact CG-CG1 4.19Å; L35-R52 WeakPolarHBondContact CA-O 3.28Å; L35-I53 HydrophobicContact CD1-CD1 3.84Å; L35-I53 HydrophobicContact CD1-CG1 4.02Å; L35-I53 HydrophobicContact CG-CD1 4.44Å; L35-I53 HydrophobicContact CG-CG1 4.07Å; L35-L153 HydrophobicContact CD1-CD1 3.84Å
36E93.2Very high89.1Confident113 Ų11365.6 Ų65.653%0.52837%0.37SS..EExtended strand (participates in β ladder)trans-115.3126.5177-58.3173167.100107.7I51 R52E36-I51 CarbonylContact O-C 3.57Å; E36-I51 VanDerWaalsContact O-CA 3.32Å; E36-I51 WeakPolarHBondContact O-CA 3.36Å; E36-I51 WeakPolarHBondContact O-CG1 3Å; E36-R52 HydrophobicContact CB-CB 4.22Å; E36-R52 PolarHBondContact N-O 3.17Å; E36-R52 PolarHBondContact O-N 2.85Å
37I93.1Very high89.2Confident20 Ų2062.4 Ų62.410%0.10334%0.337CS..EExtended strand (participates in β ladder)trans-120.2131.8174-67.6165.4000107.4L35 T39 S50 I51 A157 L265 L269L35-I37 HydrophobicContact CD2-CD1 3.54Å; L35-I37 HydrophobicContact CD2-CG1 3.57Å; I37-T39 HydrophobicContact CG2-CG2 4.36Å; I37-S50 WeakPolarHBondContact CA-O 3.47Å; I37-I51 HydrophobicContact CD1-CD1 4.16Å; I37-I51 HydrophobicContact CG1-CB 4.48Å; I37-I51 HydrophobicContact CG1-CD1 3.83Å; I37-I51 HydrophobicContact CG1-CG1 3.71Å; I37-A157 HydrophobicContact CG2-CB 3.96Å; I37-L265 HydrophobicContact CD1-CD1 3.97Å; I37-L265 HydrophobicContact CD1-CG 4.21Å; I37-L269 HydrophobicContact CG2-CD2 4.33Å
38E92.1Very high89.4Confident117 Ų11761 Ų6155%0.54733%0.332SS..EExtended strand (participates in β ladder)trans-123.3128.1170.1-62.9-174.4167.600108.2I41 A49 S50E38-I41 HydrophobicContact CB-CD1 4.11Å; E38-I41 HydrophobicContact CB-CG1 4.27Å; E38-A49 CarbonylContact O-C 3.56Å; E38-A49 WeakPolarHBondContact O-CA 3.38Å; E38-S50 PolarHBondContact N-O 3.04Å; E38-S50 PolarHBondContact O-N 2.96Å
39T91.1Very high89.7Confident3 Ų360.2 Ų60.22%0.01832%0.324CS..EExtended strand (participates in β ladder)trans-97.4170.2174.159.10000111.2I37 I41 S48 A49 N161 L269 E272 R276I37-T39 HydrophobicContact CG2-CG2 4.36Å; T39-I41 PolarHBondContact O-N 2.79Å; T39-S48 CarbonylContact C-O 3.6Å; T39-S48 WeakPolarHBondContact CA-O 3.37Å; T39-A49 HydrophobicContact CG2-CB 4.17Å; T39-N161 HydrophobicContact CG2-CB 4.31Å; T39-L269 HydrophobicContact CG2-CD2 3.4Å; T39-L269 VanDerWaalsContact CG2-CD2 3.4Å; T39-E272 WeakPolarHBondContact CG2-OE2 3.3Å; T39-E272 PolarHBondContact N-OE1 2.87Å; T39-E272 PolarHBondContact OG1-OE1 2.99Å; T39-E272 PolarHBondContact OG1-OE2 2.74Å; T39-R276 PolarHBondContact O-NH1 2.91Å; T39-R276 PolarHBondContact O-NH2 3.2Å; T39-R276 PolarHBondContact OG1-NH1 2.95Å
40N87.2Confident90Very high80 Ų8057.8 Ų57.843%0.42831%0.309SS..  trans53.443.5175.6-68.4-40.3000116S48 N161 R276N40-S48 VanDerWaalsContact CA-OG 3.3Å; N40-S48 WeakPolarHBondContact CA-OG 3.44Å; N40-S48 PolarHBondContact N-O 2.9Å; N40-N161 PolarHBondContact N-ND2 3.01Å; N40-N161 PolarHBondContact ND2-OD1 2.77Å; N40-N161 VanDerWaalsContact ND2-OD1 3.13Å; N40-N161 PolarHBondContact OD1-ND2 2.97Å; N40-N161 PolarHBondContact OD1-OD1 2.83Å; N40-R276 PolarHBondContact ND2-NH1 2.87Å
41I88.7Confident90.3Very high77 Ų7754.9 Ų54.940%0.39529%0.288SS..  trans-78.1-36.2176.5-58.2168.1000110.9E38 T39 S48 S50E38-I41 HydrophobicContact CB-CD1 4.11Å; E38-I41 HydrophobicContact CB-CG1 4.27Å; T39-I41 PolarHBondContact O-N 2.79Å; I41-S48 PolarHBondContact N-OG 2.99Å; I41-S50 WeakPolarHBondContact CD1-OG 3.39Å
42L88.7Confident90.5Very high73 Ų7355.6 Ų55.638%0.38229%0.286SS..  trans-101.6118.8-179.5-61.7169.4000109.7H44 A45 S48 C61L42-H44 VanDerWaalsContact C-N 3.32Å; L42-H44 PolarHBondContact O-N 2.81Å; L42-A45 HydrophobicContact CB-CB 4.03Å; L42-S48 PolarHBondContact N-OG 2.85Å; L42-S48 PolarHBondContact O-OG 3.17Å; L42-C61 HydrophobicContact CD1-CB 3.76Å
43S84.2Confident90.6Very high109 Ų10954 Ų5476%0.76228%0.28SS*.THydrogen-bonded Turntrans-71.3-23.5179.853.60000114.2
44H84.6Confident90.4Very high186 Ų18653.9 Ų53.986%0.86129%0.287SS*.THydrogen-bonded Turntrans-92.2-8.4-176.3-60.9-63.8000113.6L42L42-H44 VanDerWaalsContact C-N 3.32Å; L42-H44 PolarHBondContact O-N 2.81Å
45A84.8Confident90.3Very high17 Ų1755.7 Ų55.714%0.1429%0.287CS..SBendtrans-91.9148.1-178.700000110.9L42 G47 C61L42-A45 HydrophobicContact CB-CB 4.03Å; A45-G47 VanDerWaalsContact C-N 3.26Å; A45-G47 WeakPolarHBondContact CB-O 3.33Å; A45-G47 PolarHBondContact O-N 3.06Å; A45-C61 WeakPolarHBondContact CB-SG 3.16Å
46T85.3Confident90.3Very high23 Ų2352.8 Ų52.814%0.14127%0.271CS..SBendtrans-64.6-37.7173.1-53.20000110.8V62 M64 A162 S165 N166T46-V62 WeakPolarHBondContact CB-O 3.38Å; T46-V62 PolarHBondContact N-O 3.39Å; T46-M64 HydrophobicContact CG2-CG 4.5Å; T46-M64 HydrophobicContact CG2-SD 4.35Å; T46-A162 HydrophobicContact CG2-CB 4.27Å; T46-S165 WeakPolarHBondContact O-CB 3.42Å; T46-N166 WeakPolarHBondContact CG2-OD1 3.28Å
47G89Confident90.4Very high0 Ų050.3 Ų50.30%026%0.259CS..EExtended strand (participates in β ladder)trans-144.6145.8167.100000110A45 V62A45-G47 VanDerWaalsContact C-N 3.26Å; A45-G47 WeakPolarHBondContact CB-O 3.33Å; A45-G47 PolarHBondContact O-N 3.06Å; G47-V62 PolarHBondContact N-O 2.86Å; G47-V62 PolarHBondContact O-N 2.94Å
48S93.4Very high90.5Very high0 Ų049.3 Ų49.30%025%0.254CS..EExtended strand (participates in β ladder)trans-141.8152.5172.352.50000110T39 N40 I41 L42 C60 N161T39-S48 CarbonylContact C-O 3.6Å; T39-S48 WeakPolarHBondContact CA-O 3.37Å; N40-S48 VanDerWaalsContact CA-OG 3.3Å; N40-S48 WeakPolarHBondContact CA-OG 3.44Å; N40-S48 PolarHBondContact N-O 2.9Å; I41-S48 PolarHBondContact N-OG 2.99Å; L42-S48 PolarHBondContact N-OG 2.85Å; L42-S48 PolarHBondContact O-OG 3.17Å; S48-C60 WeakPolarHBondContact CA-O 3.21Å; S48-N161 PolarHBondContact N-ND2 3.49Å; S48-N161 PolarHBondContact O-ND2 3.39Å
49A94.6Very high90.6Very high0 Ų045 Ų450%024%0.235CC..EExtended strand (participates in β ladder)trans-152.2151.3170.200000110.5E38 T39 C60 V154 A157 A158E38-A49 CarbonylContact O-C 3.56Å; E38-A49 WeakPolarHBondContact O-CA 3.38Å; T39-A49 HydrophobicContact CG2-CB 4.17Å; A49-C60 PolarHBondContact N-O 3.07Å; A49-C60 PolarHBondContact O-N 3.47Å; A49-V154 HydrophobicContact CB-CG1 3.99Å; A49-V154 VanDerWaalsContact O-CG1 3.3Å; A49-V154 WeakPolarHBondContact O-CG1 3.43Å; A49-A157 HydrophobicContact CB-CB 3.91Å; A49-A158 HydrophobicContact CB-CB 3.96Å
50S95.2Very high90.8Very high5 Ų544.8 Ų44.84%0.03523%0.234CC..EExtended strand (participates in β ladder)trans-119.3149.8161.873.70000109.7I37 E38 I41 I58I37-S50 WeakPolarHBondContact CA-O 3.47Å; E38-S50 PolarHBondContact N-O 3.04Å; E38-S50 PolarHBondContact O-N 2.96Å; I41-S50 WeakPolarHBondContact CD1-OG 3.39Å; S50-I58 CarbonylContact C-O 3.44Å; S50-I58 VanDerWaalsContact CA-O 3.28Å; S50-I58 WeakPolarHBondContact CA-O 3.45Å
51I95.2Very high91.2Very high0 Ų042.4 Ų42.40%022%0.223CC..EExtended strand (participates in β ladder)trans-121144.4169.1-154.4162000109.9L35 E36 I37 I53 F57 I58 A150 L153 V154L35-I51 HydrophobicContact CD1-CD1 4.01Å; L35-I51 HydrophobicContact CD2-CD1 4.29Å; L35-I51 HydrophobicContact CD2-CG1 4.44Å; L35-I51 HydrophobicContact CG-CD1 4.06Å; L35-I51 HydrophobicContact CG-CG1 4.19Å; E36-I51 CarbonylContact O-C 3.57Å; E36-I51 VanDerWaalsContact O-CA 3.32Å; E36-I51 WeakPolarHBondContact O-CA 3.36Å; E36-I51 WeakPolarHBondContact O-CG1 3Å; I37-I51 HydrophobicContact CD1-CD1 4.16Å; I37-I51 HydrophobicContact CG1-CB 4.48Å; I37-I51 HydrophobicContact CG1-CD1 3.83Å; I37-I51 HydrophobicContact CG1-CG1 3.71Å; I51-I53 HydrophobicContact CD1-CD1 3.93Å; I51-I53 HydrophobicContact CD1-CG1 4.02Å; I51-I53 HydrophobicContact CG1-CD1 4.38Å; I51-I53 HydrophobicContact CG1-CG1 3.93Å; I51-I53 HydrophobicContact CG2-CG1 4.46Å; I51-F57 WeakPolarHBondContact O-CA 3.09Å; I51-F57 WeakPolarHBondContact O-CD2 3.23Å; I51-I58 HydrophobicContact CG2-CB 4.11Å; I51-I58 PolarHBondContact N-O 3.27Å; I51-I58 PolarHBondContact O-N 3.14Å; I51-I58 VanDerWaalsContact O-N 3.07Å; I51-A150 HydrophobicContact CG2-CB 4.38Å; I51-L153 HydrophobicContact CD1-CB 3.48Å; I51-L153 VanDerWaalsContact CD1-CB 3.48Å; I51-L153 HydrophobicContact CD1-CD1 4.06Å; I51-L153 HydrophobicContact CD1-CG 4.34Å; I51-V154 HydrophobicContact CB-CG2 3.47Å; I51-V154 VanDerWaalsContact CB-CG2 3.47Å; I51-V154 HydrophobicContact CD1-CG2 4.4Å; I51-V154 HydrophobicContact CG2-CB 4.49Å; I51-V154 HydrophobicContact CG2-CG2 3.11Å
52R94.7Very high91.3Very high122 Ų12238.7 Ų38.746%0.4620%0.204SC..EExtended strand (participates in β ladder)trans-122.5118.4163.7-169.1178.6-175.8163.86.5109.2L35 E36 G54 T56 F57L35-R52 WeakPolarHBondContact CA-O 3.28Å; E36-R52 HydrophobicContact CB-CB 4.22Å; E36-R52 PolarHBondContact N-O 3.17Å; E36-R52 PolarHBondContact O-N 2.85Å; R52-G54 WeakPolarHBondContact CG-O 3.29Å; R52-G54 PolarHBondContact NE-O 2.87Å; R52-G54 VanDerWaalsContact NE-O 3.17Å; R52-T56 CarbonylContact C-O 3.54Å; R52-T56 VanDerWaalsContact CA-O 3.32Å; R52-T56 WeakPolarHBondContact CA-O 3.43Å; R52-F57 HydrophobicContact CB-CD2 4.07Å; R52-F57 HydrophobicContact CG-CD2 4.43Å
53I92.7Very high91.4Very high0 Ų039.9 Ų39.90%021%0.206CC..EExtended strand (participates in β ladder)trans-116.591.6174-56.4-172.3000107.2R33 L35 I51 E55 T56 A150 L153R33-I53 HydrophobicContact CB-CG2 3.77Å; L35-I53 HydrophobicContact CD1-CD1 3.84Å; L35-I53 HydrophobicContact CD1-CG1 4.02Å; L35-I53 HydrophobicContact CG-CD1 4.44Å; L35-I53 HydrophobicContact CG-CG1 4.07Å; I51-I53 HydrophobicContact CD1-CD1 3.93Å; I51-I53 HydrophobicContact CD1-CG1 4.02Å; I51-I53 HydrophobicContact CG1-CD1 4.38Å; I51-I53 HydrophobicContact CG1-CG1 3.93Å; I51-I53 HydrophobicContact CG2-CG1 4.46Å; I53-E55 PolarHBondContact O-N 3.04Å; I53-E55 VanDerWaalsContact O-N 3.07Å; I53-T56 PolarHBondContact N-O 3.32Å; I53-T56 WeakPolarHBondContact O-CB 3.16Å; I53-T56 PolarHBondContact O-N 3.32Å; I53-A150 HydrophobicContact CD1-CB 3.73Å; I53-A150 HydrophobicContact CG1-CB 4.48Å; I53-L153 HydrophobicContact CD1-CD1 3.94Å
54G88.9Confident91.6Very high23 Ų2336.3 Ų36.324%0.23718%0.178CC..THydrogen-bonded Turntrans57.4-109.4-167.800000112.3P34 R52P34-G54 PolarHBondContact O-N 3.01Å; R52-G54 WeakPolarHBondContact CG-O 3.29Å; R52-G54 PolarHBondContact NE-O 2.87Å; R52-G54 VanDerWaalsContact NE-O 3.17Å
55E88.5Confident91.7Very high140 Ų14031.1 Ų31.165%0.65415%0.154SC*.THydrogen-bonded Turntrans-97.52.7178.4-67.6176.3-170.400113.1I53 E142 A144I53-E55 PolarHBondContact O-N 3.04Å; I53-E55 VanDerWaalsContact O-N 3.07Å; E55-E142 VanDerWaalsContact O-CB 3.29Å; E55-E142 WeakPolarHBondContact O-CB 3.39Å; E55-A144 HydrophobicContact CB-CB 3.39Å
56T91.5Very high91.9Very high0 Ų033.8 Ų33.80%017%0.169CC..EExtended strand (participates in β ladder)trans-90.5120.2172.3-61.90000109.1R52 I53 I58 E142 A144 G145 L147 A150R52-T56 CarbonylContact C-O 3.54Å; R52-T56 VanDerWaalsContact CA-O 3.32Å; R52-T56 WeakPolarHBondContact CA-O 3.43Å; I53-T56 PolarHBondContact N-O 3.32Å; I53-T56 WeakPolarHBondContact O-CB 3.16Å; I53-T56 PolarHBondContact O-N 3.32Å; T56-I58 HydrophobicContact CG2-CD1 4.07Å; T56-I58 HydrophobicContact CG2-CG1 4.09Å; T56-E142 CarbonylContact C-O 3.56Å; T56-E142 VanDerWaalsContact CA-O 3.31Å; T56-E142 WeakPolarHBondContact CA-O 3.38Å; T56-A144 PolarHBondContact OG1-N 3.4Å; T56-G145 PolarHBondContact OG1-O 2.65Å; T56-L147 HydrophobicContact CG2-CD2 3.85Å; T56-A150 HydrophobicContact CG2-CB 4.08Å
57F94.1Very high92Very high61 Ų6133.6 Ų33.627%0.26817%0.171SC..EExtended strand (participates in β ladder)trans-124.3121.4178.3-171.2-123.4000110.9I51 R52 V59 L141 E142I51-F57 WeakPolarHBondContact O-CA 3.09Å; I51-F57 WeakPolarHBondContact O-CD2 3.23Å; R52-F57 HydrophobicContact CB-CD2 4.07Å; R52-F57 HydrophobicContact CG-CD2 4.43Å; F57-V59 HydrophobicContact CE1-CG2 3.99Å; F57-V59 HydrophobicContact CZ-CG2 4.02Å; F57-L141 HydrophobicContact CD1-CB 3.77Å; F57-L141 HydrophobicContact CD1-CD1 3.38Å; F57-L141 HydrophobicContact CD1-CG 4.19Å; F57-L141 HydrophobicContact CE1-CD1 3.3Å; F57-L141 HydrophobicContact CZ-CD1 4.49Å; F57-L141 PolarHBondContact O-N 3.27Å; F57-E142 HydrophobicContact CB-CB 4.18Å; F57-E142 PolarHBondContact N-O 2.97Å; F57-E142 PolarHBondContact O-N 3.42Å; F57-E142 VanDerWaalsContact O-N 3.17Å
58I95.1Very high91.9Very high0 Ų041.6 Ų41.60%021%0.206CC..EExtended strand (participates in β ladder)trans-133.5136.3-177.1-54.1177.4000109S50 I51 T56 L138 L139 I140 L147 A150 V154S50-I58 CarbonylContact C-O 3.44Å; S50-I58 VanDerWaalsContact CA-O 3.28Å; S50-I58 WeakPolarHBondContact CA-O 3.45Å; I51-I58 HydrophobicContact CG2-CB 4.11Å; I51-I58 PolarHBondContact N-O 3.27Å; I51-I58 PolarHBondContact O-N 3.14Å; I51-I58 VanDerWaalsContact O-N 3.07Å; T56-I58 HydrophobicContact CG2-CD1 4.07Å; T56-I58 HydrophobicContact CG2-CG1 4.09Å; I58-L138 HydrophobicContact CG2-CD2 4.12Å; I58-L139 WeakPolarHBondContact CA-O 3.32Å; I58-I140 HydrophobicContact CD1-CG1 4.44Å; I58-I140 HydrophobicContact CG1-CG1 4.38Å; I58-I140 HydrophobicContact CG1-CG2 4.34Å; I58-I140 HydrophobicContact CG2-CG1 4.48Å; I58-L147 HydrophobicContact CD1-CD2 4.27Å; I58-A150 HydrophobicContact CD1-CB 3.62Å; I58-V154 HydrophobicContact CB-CG2 3.99Å; I58-V154 HydrophobicContact CG2-CG2 4.04Å
59V95.4Very high91.6Very high25 Ų2542.5 Ų42.515%0.15221%0.212CC..EExtended strand (participates in β ladder)trans-113.6136.5175.3-179.20000109F57 L139 L141F57-V59 HydrophobicContact CE1-CG2 3.99Å; F57-V59 HydrophobicContact CZ-CG2 4.02Å; V59-L139 PolarHBondContact N-O 3.39Å; V59-L139 PolarHBondContact O-N 2.84Å; V59-L141 HydrophobicContact CG2-CD1 3.75Å
60C95.4Very high91Very high0 Ų044.7 Ų44.70%023%0.227CC..EExtended strand (participates in β ladder)trans-122.2136.2177.2-174.30000110.5S48 A49 D137 L138 V154 A158S48-C60 WeakPolarHBondContact CA-O 3.21Å; A49-C60 PolarHBondContact N-O 3.07Å; A49-C60 PolarHBondContact O-N 3.47Å; C60-D137 CarbonylContact C-O 3.04Å; C60-D137 WeakPolarHBondContact CA-O 3.5Å; C60-L138 HydrophobicContact CB-CD2 3.59Å; C60-V154 HydrophobicContact CB-CB 3.99Å; C60-V154 HydrophobicContact CB-CG1 3.35Å; C60-A158 HydrophobicContact CB-CB 4.01Å
61C94.4Very high90.5Very high29 Ų2952.9 Ų52.920%0.19627%0.269CS..EExtended strand (participates in β ladder)trans-121.9131.2173.6178.20000109.6L42 A45 I136 D137L42-C61 HydrophobicContact CD1-CB 3.76Å; A45-C61 WeakPolarHBondContact CB-SG 3.16Å; C61-I136 WeakPolarHBondContact O-CA 3.2Å; C61-D137 HydrophobicContact CB-CB 4.48Å; C61-D137 PolarHBondContact N-O 3.28Å; C61-D137 PolarHBondContact O-N 3.29Å
62V92.8Very high89.9Confident0 Ų058.5 Ų58.50%030%0.304CS..EExtended strand (participates in β ladder)trans-114.5123.2175.1-1790000108.7T46 G47 I134 Y135 I136 A158 L159 A162T46-V62 WeakPolarHBondContact CB-O 3.38Å; T46-V62 PolarHBondContact N-O 3.39Å; G47-V62 PolarHBondContact N-O 2.86Å; G47-V62 PolarHBondContact O-N 2.94Å; V62-I134 HydrophobicContact CG1-CG2 3.65Å; V62-Y135 WeakPolarHBondContact CA-O 3.32Å; V62-I136 HydrophobicContact CG2-CG1 4.37Å; V62-A158 HydrophobicContact CG2-CB 3.68Å; V62-L159 HydrophobicContact CG1-CD2 4.1Å; V62-L159 HydrophobicContact CG2-CD2 4.17Å; V62-A162 HydrophobicContact CB-CB 4.35Å; V62-A162 HydrophobicContact CG1-CB 4.04Å
63K90.4Very high89.3Confident97 Ų9756.1 Ų56.142%0.42230%0.3SS..EExtended strand (participates in β ladder)trans-124.3137176.1-167.8-175.6-173.2-162.10110E65 Y135K63-E65 WeakPolarHBondContact CE-OE1 3.48Å; K63-E65 IonicContact NZ-OE1 2.67Å; K63-E65 PolarHBondContact NZ-OE1 3.18Å; K63-Y135 PolarHBondContact N-O 3.18Å; K63-Y135 PolarHBondContact O-N 2.76Å
64M87.9Confident88.7Confident35 Ų3559.4 Ų59.417%0.17232%0.32CS..EExtended strand (participates in β ladder)trans-114.5131.2178-65.2-175.362.700111.2T46 L123 W132 V133 I134 N166T46-M64 HydrophobicContact CG2-CG 4.5Å; T46-M64 HydrophobicContact CG2-SD 4.35Å; M64-L123 HydrophobicContact CE-CD2 4.22Å; M64-W132 HydrophobicContact CB-CE3 4.24Å; M64-W132 HydrophobicContact CB-CZ3 4.35Å; M64-W132 HydrophobicContact CE-CB 4.41Å; M64-W132 HydrophobicContact CE-CD2 4.43Å; M64-W132 HydrophobicContact CE-CE3 4.29Å; M64-V133 WeakPolarHBondContact CA-O 3.37Å; M64-I134 HydrophobicContact CE-CD1 4.29Å; M64-I134 HydrophobicContact CE-CG1 4.07Å; M64-I134 HydrophobicContact CG-CG1 4.14Å; M64-I134 HydrophobicContact CG-CG2 4.41Å; M64-I134 HydrophobicContact SD-CG1 4.37Å; M64-N166 PolarHBondContact SD-ND2 3.42Å
65E87.6Confident88.3Confident76 Ų7661.1 Ų61.136%0.35533%0.328SS..EExtended strand (participates in β ladder)trans-136.2156.7177.9-61.3-173.9166.100110.9K63 V133 Y135K63-E65 WeakPolarHBondContact CE-OE1 3.48Å; K63-E65 IonicContact NZ-OE1 2.67Å; K63-E65 PolarHBondContact NZ-OE1 3.18Å; E65-V133 PolarHBondContact N-O 2.8Å; E65-V133 PolarHBondContact O-N 3.06Å; E65-Y135 HydrophobicContact CB-CE2 4.09Å; E65-Y135 HydrophobicContact CG-CD2 4.4Å; E65-Y135 HydrophobicContact CG-CE2 4.12Å; E65-Y135 WeakPolarHBondContact OE2-CE2 3.37Å
66V88.6Confident88.1Confident74 Ų7457.2 Ų57.245%0.44831%0.31SS..EExtended strand (participates in β ladder)trans-87.6120.2172.4-1790000108.8I125 Q130 W132V66-I125 HydrophobicContact CB-CD1 4.5Å; V66-I125 HydrophobicContact CG1-CD1 3.86Å; V66-I125 HydrophobicContact CG2-CD1 3.86Å; V66-Q130 HydrophobicContact CG1-CB 4.04Å; V66-Q130 HydrophobicContact CG1-CG 4.2Å; V66-W132 HydrophobicContact CG2-CD2 4.29Å; V66-W132 HydrophobicContact CG2-CE3 4.01Å; V66-W132 HydrophobicContact CG2-CH2 3.85Å; V66-W132 HydrophobicContact CG2-CZ2 4.13Å; V66-W132 HydrophobicContact CG2-CZ3 3.79Å
67G87Confident87.6Confident18 Ų1857.4 Ų57.419%0.18631%0.312CS..EExtended strand (participates in β ladder)trans-133.3-174.4-178.900000112.9Q130 C131G67-Q130 CarbonylContact O-C 3.59Å; G67-Q130 WeakPolarHBondContact O-CA 3.45Å; G67-C131 PolarHBondContact N-O 3.34Å; G67-C131 PolarHBondContact O-N 2.88Å
68K87.7Confident87.2Confident169 Ų16958.1 Ų58.174%0.73531%0.313SS*.PPolyproline II helixtrans-87.1140.1173.3-67.4179.4-179.7176.30109.7
69P85.1Confident86.9Confident19 Ų1959 Ų5912%0.12332%0.317CS..PPolyproline II helixtrans-68.5162.7175.429.1-34.4000111.5C131P69-C131 WeakPolarHBondContact CA-SG 3.31Å; P69-C131 HydrophobicContact CB-CB 4.23Å; P69-C131 VanDerWaalsContact N-SG 3.4Å
70S83.7Confident86.7Confident45 Ų4561.2 Ų61.232%0.31533%0.326SS..PPolyproline II helixtrans-60.9151.4172.673.50000111T72 N73S70-T72 PolarHBondContact O-N 2.88Å; S70-T72 PolarHBondContact OG-OG1 3.36Å; S70-N73 CarbonylContact O-C 3.49Å; S70-N73 PolarHBondContact OG-N 2.91Å; S70-N73 PolarHBondContact OG-O 3.09Å
71L83.3Confident86.6Confident177 Ų17761.5 Ų61.593%0.92733%0.327SS*.SBendtrans-66.4-27.5177.7-64.3176.2000112.2
72T84.2Confident86.6Confident118 Ų11862.4 Ų62.472%0.72433%0.33SS*.SBendtrans-78.1-46.4-179.8470000111.5S70S70-T72 PolarHBondContact O-N 2.88Å; S70-T72 PolarHBondContact OG-OG1 3.36Å
73N80.5Confident86.7Confident73 Ų7362.6 Ų62.639%0.3933%0.332SS..  trans-121.796.3-176.6-55.4-30.4000109.6S70 E76S70-N73 CarbonylContact O-C 3.49Å; S70-N73 PolarHBondContact OG-N 2.91Å; S70-N73 PolarHBondContact OG-O 3.09Å; N73-E76 VanDerWaalsContact CB-CD 3.47Å; N73-E76 HydrophobicContact CB-CG 3.56Å; N73-E76 WeakPolarHBondContact CB-OE1 3.44Å; N73-E76 PolarHBondContact ND2-OE1 2.75Å
74T80.3Confident86.8Confident68 Ų6863.1 Ų63.142%0.41734%0.336SS..SBendtrans-85-9.9-176.456.80000113.9G128T74-G128 PolarHBondContact O-N 2.83Å
75S81.8Confident86.8Confident59 Ų5962.3 Ų62.341%0.41333%0.333SS..SBendtrans-104.8-1.6-173.155.60000114.5C124S75-C124 WeakPolarHBondContact O-CB 3.07Å
76E83.4Confident86.8Confident59 Ų5964.5 Ų64.528%0.27634%0.339SS..SBendtrans-126.6156.7-177.665.1-174.1-164.800111.1N73 L120N73-E76 VanDerWaalsContact CB-CD 3.47Å; N73-E76 HydrophobicContact CB-CG 3.56Å; N73-E76 WeakPolarHBondContact CB-OE1 3.44Å; N73-E76 PolarHBondContact ND2-OE1 2.75Å; E76-L120 HydrophobicContact CB-CB 3.83Å
77G82.2Confident86.5Confident3 Ų366.4 Ų66.43%0.03135%0.353CS..  trans-71.1173.8167.600000112.2L120 W132G77-L120 PolarHBondContact N-O 3.33Å; G77-W132 WeakPolarHBondContact CA-O 3.28Å
78R85.4Confident86.1Confident76 Ų7669.4 Ų69.429%0.28737%0.368SS..EExtended strand (participates in β ladder)trans-122.7143.2177.576.2-172.1177.5157.4-3.9110.8E80 W132 V133 I134 Y135R78-E80 WeakPolarHBondContact CD-OE1 3.29Å; R78-E80 IonicContact CZ-OE1 3.92Å; R78-E80 IonicContact NE-OE1 2.83Å; R78-E80 PolarHBondContact NE-OE1 2.83Å; R78-E80 IonicContact NH1-OE1 3.86Å; R78-E80 PolarHBondContact NH1-OE1 2.89Å; R78-E80 IonicContact NH2-OE1 3.86Å; R78-W132 PolarHBondContact N-O 2.71Å; R78-V133 HydrophobicContact CG-CB 4.07Å; R78-V133 HydrophobicContact CG-CG1 3.64Å; R78-V133 HydrophobicContact CG-CG2 3.84Å; R78-V133 WeakPolarHBondContact O-CA 3.26Å; R78-I134 PolarHBondContact O-N 2.85Å; R78-Y135 PolarHBondContact NH2-OH 2.96Å; R78-Y135 VanDerWaalsContact NH2-OH 3.08Å
79I88.2Confident85.5Confident18 Ų1861.5 Ų61.59%0.09233%0.334CS..EExtended strand (participates in β ladder)trans-111.9125.6171-58.7178.5000107.2I81 Y113 L120 I134 I136I79-I81 HydrophobicContact CG2-CG1 4.09Å; I79-Y113 HydrophobicContact CD1-CD1 4.38Å; I79-L120 HydrophobicContact CD1-CD2 3.66Å; I79-L120 HydrophobicContact CG1-CD2 4.01Å; I79-I134 WeakPolarHBondContact CA-O 3.49Å; I79-I134 HydrophobicContact CG1-CB 4.35Å; I79-I134 HydrophobicContact CG1-CD1 4.48Å; I79-I136 HydrophobicContact CG2-CD1 3.57Å; I79-I136 HydrophobicContact CG2-CG1 4.33Å
80E90.6Very high84.7Confident73 Ų7361 Ų6134%0.34133%0.33SS..EExtended strand (participates in β ladder)trans-117.5119.8175.7-67.6-174.1-170.500108.4R78 I134 Y135 I136R78-E80 WeakPolarHBondContact CD-OE1 3.29Å; R78-E80 IonicContact CZ-OE1 3.92Å; R78-E80 IonicContact NE-OE1 2.83Å; R78-E80 PolarHBondContact NE-OE1 2.83Å; R78-E80 IonicContact NH1-OE1 3.86Å; R78-E80 PolarHBondContact NH1-OE1 2.89Å; R78-E80 IonicContact NH2-OE1 3.86Å; E80-I134 PolarHBondContact N-O 2.67Å; E80-Y135 HydrophobicContact CB-CD1 3.96Å; E80-Y135 HydrophobicContact CB-CE1 4.28Å; E80-Y135 WeakPolarHBondContact O-CA 3.42Å; E80-Y135 VanDerWaalsContact OE2-CE1 3.29Å; E80-Y135 WeakPolarHBondContact OE2-CE1 3.47Å; E80-I136 PolarHBondContact O-N 3.13Å
81I94.1Very high83.6Confident5 Ų566.6 Ų66.63%0.02635%0.351CS..EExtended strand (participates in β ladder)trans-105.7128.2-179.8-54.2-179.2000107.7I79 V83 K106 L109 Y113 I136 L138I79-I81 HydrophobicContact CG2-CG1 4.09Å; I81-V83 HydrophobicContact CG2-CG2 4.3Å; I81-K106 VanDerWaalsContact O-CE 3.23Å; I81-K106 WeakPolarHBondContact O-CE 3.45Å; I81-K106 WeakPolarHBondContact O-CG 3.32Å; I81-L109 HydrophobicContact CD1-CB 3.89Å; I81-L109 HydrophobicContact CG2-CB 4.35Å; I81-L109 HydrophobicContact CG2-CD1 4.37Å; I81-Y113 HydrophobicContact CD1-CD2 3.44Å; I81-Y113 VanDerWaalsContact CD1-CD2 3.44Å; I81-Y113 HydrophobicContact CD1-CE2 4.1Å; I81-Y113 HydrophobicContact CD1-CG 4.06Å; I81-I136 CarbonylContact C-O 3.59Å; I81-I136 WeakPolarHBondContact CA-O 3Å; I81-I136 HydrophobicContact CG1-CB 4.23Å; I81-I136 HydrophobicContact CG1-CD1 4.17Å; I81-I136 HydrophobicContact CG2-CG2 4.49Å; I81-L138 HydrophobicContact CG2-CD1 4.39Å
82N94.9Very high82.6Confident48 Ų4865.9 Ų65.926%0.25734%0.336SS..EExtended strand (participates in β ladder)trans-118.1140.8170.1-162.445.1000109.5E84 I136 D137 L138N82-E84 PolarHBondContact ND2-OE1 2.8Å; N82-E84 VanDerWaalsContact ND2-OE1 3.14Å; N82-I136 PolarHBondContact N-O 3.07Å; N82-D137 WeakPolarHBondContact CB-OD1 3.35Å; N82-L138 PolarHBondContact O-N 3.17Å
83V94.3Very high81.5Confident5 Ų561.7 Ų61.73%0.0331%0.311CS..EExtended strand (participates in β ladder)trans-127.8125.5180-175.40000107.3I81 L105 K106 L109 L138 I140I81-V83 HydrophobicContact CG2-CG2 4.3Å; V83-L105 HydrophobicContact CG1-CB 4.21Å; V83-L105 HydrophobicContact CG1-CD1 4.14Å; V83-L105 HydrophobicContact CG2-CB 4.3Å; V83-K106 HydrophobicContact CG2-CB 4.13Å; V83-L109 HydrophobicContact CG2-CD1 4.32Å; V83-L138 WeakPolarHBondContact CA-O 3.31Å; V83-L138 HydrophobicContact CG1-CB 4.43Å; V83-L138 HydrophobicContact CG2-CB 4.31Å; V83-L138 HydrophobicContact CG2-CD1 4.06Å; V83-I140 HydrophobicContact CG1-CD1 4Å; V83-I140 HydrophobicContact CG1-CG1 4.49Å
84E91.9Very high81.2Confident108 Ų10864.3 Ų64.351%0.50533%0.325SS..EExtended strand (participates in β ladder)trans-124.6131.7177.9-65.6-177.5-178.700109N82 L138 L139 I140N82-E84 PolarHBondContact ND2-OE1 2.8Å; N82-E84 VanDerWaalsContact ND2-OE1 3.14Å; E84-L138 PolarHBondContact N-O 3Å; E84-L139 HydrophobicContact CB-CD1 4.16Å; E84-L139 WeakPolarHBondContact O-CA 3.14Å; E84-I140 PolarHBondContact O-N 3.35Å
85C88.7Confident81.1Confident17 Ų1769.5 Ų69.512%0.11535%0.345CS..EExtended strand (participates in β ladder)trans-100123176.1-166.10000108.8A98 E102C85-A98 HydrophobicContact CB-CB 4.49Å; C85-E102 WeakPolarHBondContact CA-OE1 3.41Å; C85-E102 HydrophobicContact CB-CG 3.85Å; C85-E102 WeakPolarHBondContact CB-OE1 3.37Å; C85-E102 PolarHBondContact N-OE1 2.86Å
86Y87.7Confident81.1Confident122 Ų12274.9 Ų74.948%0.47836%0.361SS..  trans-66.1138.2172.9-163.2-110.5000109.2T88 A89 I140 L141Y86-T88 PolarHBondContact O-N 2.82Å; Y86-A89 WeakPolarHBondContact O-CB 3.38Å; Y86-A89 PolarHBondContact O-N 2.9Å; Y86-I140 WeakPolarHBondContact CB-O 3.09Å; Y86-I140 PolarHBondContact N-O 3.03Å; Y86-L141 HydrophobicContact CD1-CD2 4.5Å; Y86-L141 HydrophobicContact CD2-CD2 4.39Å; Y86-L141 HydrophobicContact CG-CD2 4.08Å
87P81.3Confident80.9Confident115 Ų11573.9 Ų73.975%0.74736%0.363SS*.THydrogen-bonded Turntrans-57.6-20.3-174.3-28.435.2000115.3
88T79Confident81Confident81 Ų8174.4 Ų74.450%0.49737%0.367SS..THydrogen-bonded Turntrans-91.6-12.4178.3-49.60000113.1Y86 T90Y86-T88 PolarHBondContact O-N 2.82Å; T88-T90 PolarHBondContact O-N 2.86Å; T88-T90 VanDerWaalsContact O-N 3.13Å
89A74.3Confident81Confident3 Ų373.8 Ų73.83%0.02537%0.374CS..SBendtrans-60.9-31.8-170.700000113.5Y86 I140 L141 G143Y86-A89 WeakPolarHBondContact O-CB 3.38Å; Y86-A89 PolarHBondContact O-N 2.9Å; A89-I140 HydrophobicContact CB-CG2 4.1Å; A89-I140 WeakPolarHBondContact CB-O 3.35Å; A89-L141 WeakPolarHBondContact CA-O 3.41Å; A89-L141 VanDerWaalsContact CB-O 3.23Å; A89-L141 WeakPolarHBondContact CB-O 3.32Å; A89-G143 PolarHBondContact O-N 2.98Å
90T69.3Low81Confident7 Ų779.4 Ų79.44%0.04340%0.4CS..SBendtrans-12899.117638.80000107.8D2 T88 R92 C93D2-T90 WeakPolarHBondContact OD2-CG2 3.4Å; T88-T90 PolarHBondContact O-N 2.86Å; T88-T90 VanDerWaalsContact O-N 3.13Å; T90-R92 PolarHBondContact O-N 3.3Å; T90-C93 PolarHBondContact O-N 2.97Å; T90-C93 WeakPolarHBondContact OG1-CB 3.21Å
91H60.5Low80.8Confident163 Ų16377.3 Ų77.376%0.75539%0.391SS*.THydrogen-bonded Turntrans-49.1-8.8-176.4-74.8-65.8000116.8
92R63.1Low80.7Confident163 Ų16379.2 Ų79.262%0.61540%0.4SS*.THydrogen-bonded Turntrans-137.57.8-177.3-62.7-172.4176.9175.81.1114.3T90 N94T90-R92 PolarHBondContact O-N 3.3Å; R92-N94 PolarHBondContact O-N 3.22Å
93C60.8Low80.5Confident30 Ų3083 Ų8320%0.20342%0.416CS..  trans-76122.3174.8-1160000109.4T90 A97 A98T90-C93 PolarHBondContact O-N 2.97Å; T90-C93 WeakPolarHBondContact OG1-CB 3.21Å; C93-A97 VanDerWaalsContact SG-CB 3.57Å; C93-A98 HydrophobicContact CB-CB 4.31Å
94N73.3Confident80.4Confident127 Ų12786 Ų8668%0.67943%0.427SS*.  trans-64.6150.6159.6-65-29.9000108.4R92 K96 A97 A98R92-N94 PolarHBondContact O-N 3.22Å; N94-K96 PolarHBondContact O-N 2.94Å; N94-A97 WeakPolarHBondContact O-CA 3.48Å; N94-A97 WeakPolarHBondContact O-CB 3.17Å; N94-A97 PolarHBondContact O-N 3.21Å; N94-A98 PolarHBondContact O-N 3.01Å
95E77.9Confident80.4Confident178 Ų17880.9 Ų80.983%0.83240%0.403SS*.Hα-helixtrans-49.1-37.1179.3-64.4178163.400112.8A98 S99E95-A98 PolarHBondContact O-N 3.17Å; E95-S99 PolarHBondContact O-N 3.01Å
96K82Confident80.6Confident171 Ų17183.7 Ų83.774%0.74341%0.413SS*.Hα-helixtrans-62.4-44.8175.2-64.7-174.4177.6-176.10113.2N94 A98 S99 E100N94-K96 PolarHBondContact O-N 2.94Å; K96-A98 VanDerWaalsContact C-N 3.33Å; K96-S99 PolarHBondContact O-N 3.07Å; K96-E100 WeakPolarHBondContact O-CG 3.44Å; K96-E100 PolarHBondContact O-N 2.91Å
97A80.4Confident80.8Confident39 Ų3981.5 Ų81.532%0.32241%0.412SS..Hα-helixtrans-70.5-32.9-179.600000111.6C93 N94 L101C93-A97 VanDerWaalsContact SG-CB 3.57Å; N94-A97 WeakPolarHBondContact O-CA 3.48Å; N94-A97 WeakPolarHBondContact O-CB 3.17Å; N94-A97 PolarHBondContact O-N 3.21Å; A97-L101 WeakPolarHBondContact O-CB 3.31Å; A97-L101 PolarHBondContact O-N 2.82Å; A97-L101 VanDerWaalsContact O-N 3.13Å
98A82.9Confident81.3Confident14 Ų1476.3 Ų76.312%0.11638%0.378CS..Hα-helixtrans-63.8-47.317200000110.8C85 C93 N94 E95 K96 E100 L101 E102C85-A98 HydrophobicContact CB-CB 4.49Å; C93-A98 HydrophobicContact CB-CB 4.31Å; N94-A98 PolarHBondContact O-N 3.01Å; E95-A98 PolarHBondContact O-N 3.17Å; K96-A98 VanDerWaalsContact C-N 3.33Å; A98-E100 PolarHBondContact O-N 2.84Å; A98-L101 WeakPolarHBondContact O-CB 3.28Å; A98-L101 PolarHBondContact O-N 2.79Å; A98-L101 VanDerWaalsContact O-N 3.11Å; A98-E102 WeakPolarHBondContact O-CG 3.49Å; A98-E102 PolarHBondContact O-N 3.1Å
99S86.1Confident81.9Confident62 Ų6272.4 Ų72.443%0.43436%0.355SS..Hα-helixtrans-61.9-41178.3-176.70000113.1E95 K96 L101 E102 E103E95-S99 PolarHBondContact O-N 3.01Å; K96-S99 PolarHBondContact O-N 3.07Å; S99-L101 VanDerWaalsContact C-N 3.3Å; S99-L101 PolarHBondContact O-N 3.43Å; S99-E102 PolarHBondContact O-N 3.32Å; S99-E103 WeakPolarHBondContact O-CB 3.32Å; S99-E103 PolarHBondContact O-N 2.9Å
100E88.3Confident82.7Confident137 Ų13775 Ų7564%0.6437%0.366SS*.Hα-helixtrans-62.4-37.7174-73.4173.7-168.900112.2K96 A98 R104K96-E100 WeakPolarHBondContact O-CG 3.44Å; K96-E100 PolarHBondContact O-N 2.91Å; A98-E100 PolarHBondContact O-N 2.84Å; E100-R104 VanDerWaalsContact O-CB 3.32Å; E100-R104 WeakPolarHBondContact O-CB 3.33Å; E100-R104 PolarHBondContact O-N 3.27Å
101L87.2Confident83.5Confident28 Ų2876.5 Ų76.515%0.14738%0.377CS..Hα-helixtrans-70.2-44.2177.7-178.4136.7000111.5A97 A98 S99 R104 L105 I140 L147A97-L101 WeakPolarHBondContact O-CB 3.31Å; A97-L101 PolarHBondContact O-N 2.82Å; A97-L101 VanDerWaalsContact O-N 3.13Å; A98-L101 WeakPolarHBondContact O-CB 3.28Å; A98-L101 PolarHBondContact O-N 2.79Å; A98-L101 VanDerWaalsContact O-N 3.11Å; S99-L101 VanDerWaalsContact C-N 3.3Å; S99-L101 PolarHBondContact O-N 3.43Å; L101-R104 PolarHBondContact O-N 2.88Å; L101-L105 HydrophobicContact CD2-CD1 3.62Å; L101-L105 HydrophobicContact CD2-CG 4.3Å; L101-L105 HydrophobicContact CG-CD1 4.32Å; L101-L105 WeakPolarHBondContact O-CB 3.39Å; L101-L105 VanDerWaalsContact O-CG 3.27Å; L101-L105 WeakPolarHBondContact O-CG 3.46Å; L101-L105 PolarHBondContact O-N 3.45Å; L101-I140 HydrophobicContact CD2-CD1 4.35Å; L101-L147 HydrophobicContact CD1-CD1 4.06Å; L101-L147 HydrophobicContact CD2-CD1 4.06Å
102E90.6Very high84.7Confident45 Ų4568.7 Ų68.721%0.2134%0.341CS..Hα-helixtrans-57.6-50174.4-72.6167.2-178.400111.4C85 A98 S99 R104 L105 K106C85-E102 WeakPolarHBondContact CA-OE1 3.41Å; C85-E102 HydrophobicContact CB-CG 3.85Å; C85-E102 WeakPolarHBondContact CB-OE1 3.37Å; C85-E102 PolarHBondContact N-OE1 2.86Å; A98-E102 WeakPolarHBondContact O-CG 3.49Å; A98-E102 PolarHBondContact O-N 3.1Å; S99-E102 PolarHBondContact O-N 3.32Å; E102-R104 VanDerWaalsContact C-N 3.35Å; E102-R104 PolarHBondContact O-N 3.47Å; E102-L105 PolarHBondContact O-N 3.11Å; E102-K106 WeakPolarHBondContact O-CB 3.35Å; E102-K106 PolarHBondContact O-N 2.83Å
103E92Very high85.6Confident127 Ų12761.2 Ų61.259%0.59331%0.313SS*.Hα-helixtrans-61-45179.3-173.4174.4-16600110.9S99 K106 T107S99-E103 WeakPolarHBondContact O-CB 3.32Å; S99-E103 PolarHBondContact O-N 2.9Å; E103-K106 WeakPolarHBondContact O-CB 3.37Å; E103-K106 PolarHBondContact O-N 2.89Å; E103-T107 HydrophobicContact CG-CG2 4.5Å; E103-T107 WeakPolarHBondContact O-CG2 3.44Å; E103-T107 PolarHBondContact O-N 2.93Å; E103-T107 PolarHBondContact O-OG1 3.19Å; E103-T107 VanDerWaalsContact O-OG1 3.14Å
104R90.7Very high86.4Confident70 Ų7066.2 Ų66.226%0.26433%0.333SS..Hα-helixtrans-61.9-46.8177.6-171.3179.967.789.95.6112.3E100 L101 E102 K106 T107 T108 D237E100-R104 VanDerWaalsContact O-CB 3.32Å; E100-R104 WeakPolarHBondContact O-CB 3.33Å; E100-R104 PolarHBondContact O-N 3.27Å; L101-R104 PolarHBondContact O-N 2.88Å; E102-R104 VanDerWaalsContact C-N 3.35Å; E102-R104 PolarHBondContact O-N 3.47Å; R104-K106 VanDerWaalsContact C-N 3.32Å; R104-K106 PolarHBondContact O-N 3Å; R104-T107 WeakPolarHBondContact CA-OG1 3.39Å; R104-T107 PolarHBondContact O-N 3.04Å; R104-T107 PolarHBondContact O-OG1 2.9Å; R104-T108 WeakPolarHBondContact O-CB 3.27Å; R104-T108 PolarHBondContact O-N 3.31Å; R104-T108 PolarHBondContact O-OG1 3.06Å; R104-D237 IonicContact NH1-OD2 3.43Å; R104-D237 PolarHBondContact NH1-OD2 3.46Å
105L92Very high86.1Confident0 Ų062.6 Ų62.60%031%0.313CS..Hα-helixtrans-61.6-44.1177.1-71.6-179.7000110.8V83 L101 E102 T108 L109 I140 L147 L148V83-L105 HydrophobicContact CG1-CB 4.21Å; V83-L105 HydrophobicContact CG1-CD1 4.14Å; V83-L105 HydrophobicContact CG2-CB 4.3Å; L101-L105 HydrophobicContact CD2-CD1 3.62Å; L101-L105 HydrophobicContact CD2-CG 4.3Å; L101-L105 HydrophobicContact CG-CD1 4.32Å; L101-L105 WeakPolarHBondContact O-CB 3.39Å; L101-L105 VanDerWaalsContact O-CG 3.27Å; L101-L105 WeakPolarHBondContact O-CG 3.46Å; L101-L105 PolarHBondContact O-N 3.45Å; E102-L105 PolarHBondContact O-N 3.11Å; L105-T108 PolarHBondContact O-N 2.97Å; L105-L109 WeakPolarHBondContact O-CB 3.4Å; L105-L109 VanDerWaalsContact O-CG 3.24Å; L105-L109 WeakPolarHBondContact O-CG 3.43Å; L105-L109 PolarHBondContact O-N 3.32Å; L105-I140 HydrophobicContact CD1-CD1 3.52Å; L105-L147 HydrophobicContact CD1-CB 4.47Å; L105-L148 HydrophobicContact CD2-CD2 3.28Å; L105-L148 HydrophobicContact CD2-CG 3.58Å
106K93.5Very high85.3Confident76 Ų7664 Ų6433%0.3332%0.317SS..Hα-helixtrans-58.5-49.8176.7179.9176-179.1166.10111.3I81 V83 E102 E103 R104 Q110I81-K106 VanDerWaalsContact O-CE 3.23Å; I81-K106 WeakPolarHBondContact O-CE 3.45Å; I81-K106 WeakPolarHBondContact O-CG 3.32Å; V83-K106 HydrophobicContact CG2-CB 4.13Å; E102-K106 WeakPolarHBondContact O-CB 3.35Å; E102-K106 PolarHBondContact O-N 2.83Å; E103-K106 WeakPolarHBondContact O-CB 3.37Å; E103-K106 PolarHBondContact O-N 2.89Å; R104-K106 VanDerWaalsContact C-N 3.32Å; R104-K106 PolarHBondContact O-N 3Å; K106-Q110 WeakPolarHBondContact O-CB 3.48Å; K106-Q110 PolarHBondContact O-N 3.32Å
107T92.6Very high84.3Confident75 Ų7561.1 Ų61.146%0.4630%0.304SS..Hα-helixtrans-64.9-42.7-179.552.90000112.5E103 R104 Q110 S111E103-T107 HydrophobicContact CG-CG2 4.5Å; E103-T107 WeakPolarHBondContact O-CG2 3.44Å; E103-T107 PolarHBondContact O-N 2.93Å; E103-T107 PolarHBondContact O-OG1 3.19Å; E103-T107 VanDerWaalsContact O-OG1 3.14Å; R104-T107 WeakPolarHBondContact CA-OG1 3.39Å; R104-T107 PolarHBondContact O-N 3.04Å; R104-T107 PolarHBondContact O-OG1 2.9Å; T107-Q110 PolarHBondContact O-N 3.27Å; T107-S111 WeakPolarHBondContact O-CB 3.35Å; T107-S111 PolarHBondContact O-N 3.34Å
108T91.5Very high83.7Confident6 Ų660 Ų604%0.03729%0.292CS..Hα-helixtrans-67.9-43.8179.8-66.70000111.3R104 L105 S111 A112 L148 F195 E235R104-T108 WeakPolarHBondContact O-CB 3.27Å; R104-T108 PolarHBondContact O-N 3.31Å; R104-T108 PolarHBondContact O-OG1 3.06Å; L105-T108 PolarHBondContact O-N 2.97Å; T108-S111 PolarHBondContact O-N 2.96Å; T108-S111 PolarHBondContact O-OG 2.87Å; T108-A112 PolarHBondContact O-N 3.37Å; T108-L148 HydrophobicContact CG2-CD2 3.84Å; T108-F195 HydrophobicContact CG2-CD1 4.39Å; T108-F195 HydrophobicContact CG2-CE1 3.51Å; T108-F195 HydrophobicContact CG2-CZ 3.6Å; T108-F195 WeakPolarHBondContact O-CZ 3.49Å; T108-E235 WeakPolarHBondContact CG2-OE2 3.35Å; T108-E235 PolarHBondContact OG1-OE2 2.9Å
109L91.6Very high83.2Confident0 Ų064.2 Ų64.20%031%0.313CS..Hα-helixtrans-65.4-46.5175.7-68.3174.4000110.4I81 V83 L105 S111 A112 Y113 L138 F195I81-L109 HydrophobicContact CD1-CB 3.89Å; I81-L109 HydrophobicContact CG2-CB 4.35Å; I81-L109 HydrophobicContact CG2-CD1 4.37Å; V83-L109 HydrophobicContact CG2-CD1 4.32Å; L105-L109 WeakPolarHBondContact O-CB 3.4Å; L105-L109 VanDerWaalsContact O-CG 3.24Å; L105-L109 WeakPolarHBondContact O-CG 3.43Å; L105-L109 PolarHBondContact O-N 3.32Å; L109-S111 VanDerWaalsContact C-N 3.28Å; L109-S111 PolarHBondContact O-N 3.48Å; L109-A112 PolarHBondContact O-N 3Å; L109-A112 VanDerWaalsContact O-N 3.15Å; L109-Y113 VanDerWaalsContact O-CD2 3.26Å; L109-Y113 WeakPolarHBondContact O-CD2 3.4Å; L109-Y113 PolarHBondContact O-N 2.96Å; L109-Y113 VanDerWaalsContact O-N 3.13Å; L109-L138 HydrophobicContact CD1-CD1 3.43Å; L109-L138 VanDerWaalsContact CD1-CD1 3.43Å; L109-F195 HydrophobicContact CD2-CD2 3.97Å; L109-F195 HydrophobicContact CD2-CE2 3.73Å
110Q89.8Confident82.7Confident58 Ų5862.1 Ų62.127%0.27130%0.297SS..Hα-helixtrans-60.8-37.7-179.8-171.5170.81100111.9K106 T107 Y113 Q114K106-Q110 WeakPolarHBondContact O-CB 3.48Å; K106-Q110 PolarHBondContact O-N 3.32Å; T107-Q110 PolarHBondContact O-N 3.27Å; Q110-Y113 PolarHBondContact O-N 2.99Å; Q110-Q114 WeakPolarHBondContact O-CB 3.32Å; Q110-Q114 VanDerWaalsContact O-CG 3.24Å; Q110-Q114 WeakPolarHBondContact O-CG 3.46Å; Q110-Q114 PolarHBondContact O-N 3.48Å; Q110-Q114 VanDerWaalsContact O-N 3.12Å
111S87.4Confident82.2Confident37 Ų3758.5 Ų58.526%0.25929%0.287SS..Hα-helixtrans-63.4-41.2176.577.20000111.9T107 T108 L109 Q114 L115T107-S111 WeakPolarHBondContact O-CB 3.35Å; T107-S111 PolarHBondContact O-N 3.34Å; T108-S111 PolarHBondContact O-N 2.96Å; T108-S111 PolarHBondContact O-OG 2.87Å; L109-S111 VanDerWaalsContact C-N 3.28Å; L109-S111 PolarHBondContact O-N 3.48Å; S111-Q114 PolarHBondContact O-N 3.36Å; S111-L115 WeakPolarHBondContact O-CG 3.2Å
112A85.2Confident81.8Confident0 Ų058.1 Ų58.10%029%0.286CS..Hα-helixtrans-67.6-38.1178.600000113.4T108 L109 Q114 L115 F195 V224T108-A112 PolarHBondContact O-N 3.37Å; L109-A112 PolarHBondContact O-N 3Å; L109-A112 VanDerWaalsContact O-N 3.15Å; A112-Q114 VanDerWaalsContact C-N 3.33Å; A112-L115 WeakPolarHBondContact O-CB 3.19Å; A112-L115 WeakPolarHBondContact O-CG 3.04Å; A112-L115 PolarHBondContact O-N 3.01Å; A112-F195 HydrophobicContact CB-CE1 4.49Å; A112-F195 HydrophobicContact CB-CE2 3.47Å; A112-F195 VanDerWaalsContact CB-CE2 3.47Å; A112-F195 HydrophobicContact CB-CZ 3.37Å; A112-V224 HydrophobicContact CB-CG2 3.91Å
113Y82.6Confident81.3Confident6 Ų656.2 Ų56.22%0.02428%0.278CS..Hα-helixtrans-78.5-16.1178.9-77.5-82.8000113.7I79 I81 L109 Q110 L115 I118 V155 L159 L192 P193I79-Y113 HydrophobicContact CD1-CD1 4.38Å; I81-Y113 HydrophobicContact CD1-CD2 3.44Å; I81-Y113 VanDerWaalsContact CD1-CD2 3.44Å; I81-Y113 HydrophobicContact CD1-CE2 4.1Å; I81-Y113 HydrophobicContact CD1-CG 4.06Å; L109-Y113 VanDerWaalsContact O-CD2 3.26Å; L109-Y113 WeakPolarHBondContact O-CD2 3.4Å; L109-Y113 PolarHBondContact O-N 2.96Å; L109-Y113 VanDerWaalsContact O-N 3.13Å; Q110-Y113 PolarHBondContact O-N 2.99Å; Y113-L115 VanDerWaalsContact C-N 3.32Å; Y113-I118 HydrophobicContact CD1-CD1 3.44Å; Y113-I118 VanDerWaalsContact CD1-CD1 3.44Å; Y113-I118 HydrophobicContact CE1-CD1 4.03Å; Y113-I118 HydrophobicContact CG-CD1 4.32Å; Y113-V155 HydrophobicContact CE1-CG1 4.32Å; Y113-V155 HydrophobicContact CE2-CG1 3.93Å; Y113-V155 WeakPolarHBondContact OH-CG1 3.36Å; Y113-L159 HydrophobicContact CE1-CD1 3.63Å; Y113-L192 HydrophobicContact CE1-CD2 4.08Å; Y113-P193 HydrophobicContact CD1-CG 4.33Å; Y113-P193 HydrophobicContact CE1-CG 4.04Å; Y113-P193 HydrophobicContact CE2-CG 4.45Å
114Q76.9Confident80.7Confident134 Ų13451.7 Ų51.763%0.62626%0.259SS*.THydrogen-bonded Turntrans-83.1-8.1171.5-74.2174.8-0.500113.2Q110 S111 A112Q110-Q114 WeakPolarHBondContact O-CB 3.32Å; Q110-Q114 VanDerWaalsContact O-CG 3.24Å; Q110-Q114 WeakPolarHBondContact O-CG 3.46Å; Q110-Q114 PolarHBondContact O-N 3.48Å; Q110-Q114 VanDerWaalsContact O-N 3.12Å; S111-Q114 PolarHBondContact O-N 3.36Å; A112-Q114 VanDerWaalsContact C-N 3.33Å
115L66.4Low80.3Confident52 Ų5250.5 Ų50.527%0.27226%0.258SS..SBendtrans-65.9144.6178.8-63.9176.3000110.8S111 A112 Y113 F117 I118S111-L115 WeakPolarHBondContact O-CG 3.2Å; A112-L115 WeakPolarHBondContact O-CB 3.19Å; A112-L115 WeakPolarHBondContact O-CG 3.04Å; A112-L115 PolarHBondContact O-N 3.01Å; Y113-L115 VanDerWaalsContact C-N 3.32Å; L115-F117 HydrophobicContact CB-CD2 4.43Å; L115-F117 PolarHBondContact O-N 3.42Å; L115-I118 PolarHBondContact O-N 2.83Å
116K61.7Low79.9Confident207 Ų20754.6 Ų54.690%0.928%0.277SS*.THydrogen-bonded Turntrans-56.3-6.9-176.2-65.2-176.7177.1-179.40115.9I118K116-I118 VanDerWaalsContact C-N 3.34Å
117F60.8Low79.5Confident110 Ų11060.7 Ų60.748%0.48230%0.298SS..THydrogen-bonded Turntrans-78.3-19.5-177.5-71.6-80.9000113.1L115 Y226L115-F117 HydrophobicContact CB-CD2 4.43Å; L115-F117 PolarHBondContact O-N 3.42Å; F117-Y226 HydrophobicContact CB-CD1 4.48Å; F117-Y226 HydrophobicContact CB-CE1 3.64Å; F117-Y226 HydrophobicContact CB-CE2 4.4Å; F117-Y226 HydrophobicContact CD1-CE2 4.46Å; F117-Y226 HydrophobicContact CD2-CE1 4.45Å; F117-Y226 AromaticContact CD2-CE2 3.73Å; F117-Y226 HydrophobicContact CD2-CE2 3.73Å; F117-Y226 AromaticContact CD2-CZ 3.55Å; F117-Y226 WeakPolarHBondContact CD2-OH 3.46Å; F117-Y226 HydrophobicContact CE2-CE2 4.05Å; F117-Y226 HydrophobicContact CG-CE1 4.08Å; F117-Y226 AromaticContact CG-CE2 3.95Å; F117-Y226 HydrophobicContact CG-CE2 3.95Å; F117-Y226 AromaticContact CG-CZ 3.61Å
118I68.6Low78.9Confident15 Ų1559.2 Ų59.28%0.07730%0.298CS..SBendtrans-97.2113173.6-57.7177.7000108Y113 L115 K116 L120 F187 L192 P193Y113-I118 HydrophobicContact CD1-CD1 3.44Å; Y113-I118 VanDerWaalsContact CD1-CD1 3.44Å; Y113-I118 HydrophobicContact CE1-CD1 4.03Å; Y113-I118 HydrophobicContact CG-CD1 4.32Å; L115-I118 PolarHBondContact O-N 2.83Å; K116-I118 VanDerWaalsContact C-N 3.34Å; I118-L120 HydrophobicContact CG2-CD2 3.77Å; I118-L120 HydrophobicContact CG2-CG 4.31Å; I118-L120 PolarHBondContact O-N 2.7Å; I118-F187 HydrophobicContact CG2-CE2 3.47Å; I118-F187 VanDerWaalsContact CG2-CE2 3.47Å; I118-F187 HydrophobicContact CG2-CZ 3.47Å; I118-F187 VanDerWaalsContact CG2-CZ 3.47Å; I118-L192 HydrophobicContact CD1-CD2 4.41Å; I118-P193 HydrophobicContact CD1-CG 4.29Å
119D71.1Confident78.6Confident104 Ų10466.9 Ų66.956%0.55633%0.326SS*.  trans-75.1108.9174.1-166.34.6000109.8S121 P122D119-S121 WeakPolarHBondContact OD1-CB 3.23Å; D119-S121 PolarHBondContact OD1-N 2.86Å; D119-S121 VanDerWaalsContact OD1-N 3.09Å; D119-S121 PolarHBondContact OD1-OG 3.05Å; D119-P122 WeakPolarHBondContact O-CD 3.46Å; D119-P122 WeakPolarHBondContact O-CG 3.47Å
120L77.2Confident78.3Confident17 Ų1771.2 Ų71.29%0.08935%0.347CS..  trans-94.3-3.1177.7-61176.7000112.4E76 G77 I79 I118 P122 L123 F187E76-L120 HydrophobicContact CB-CB 3.83Å; G77-L120 PolarHBondContact N-O 3.33Å; I79-L120 HydrophobicContact CD1-CD2 3.66Å; I79-L120 HydrophobicContact CG1-CD2 4.01Å; I118-L120 HydrophobicContact CG2-CD2 3.77Å; I118-L120 HydrophobicContact CG2-CG 4.31Å; I118-L120 PolarHBondContact O-N 2.7Å; L120-P122 VanDerWaalsContact C-CD 3.41Å; L120-L123 HydrophobicContact CD2-CD1 3.78Å; L120-L123 WeakPolarHBondContact O-CB 3.48Å; L120-L123 PolarHBondContact O-N 3.01Å; L120-F187 HydrophobicContact CD2-CE2 4.26Å
121S77.8Confident78.1Confident62 Ų6268.5 Ų68.543%0.43433%0.334SS..G310 helixtrans-51.5-43.7171.6-50.80000114.1D119 L123 C124D119-S121 WeakPolarHBondContact OD1-CB 3.23Å; D119-S121 PolarHBondContact OD1-N 2.86Å; D119-S121 VanDerWaalsContact OD1-N 3.09Å; D119-S121 PolarHBondContact OD1-OG 3.05Å; S121-L123 PolarHBondContact O-N 3.11Å; S121-L123 VanDerWaalsContact O-N 3.11Å; S121-C124 WeakPolarHBondContact O-CB 2.77Å; S121-C124 PolarHBondContact O-N 3.45Å; S121-C124 VanDerWaalsContact O-N 3.1Å
122P78.7Confident78.1Confident20 Ų2069.4 Ų69.413%0.1333%0.332CS..G310 helixtrans-64.7-16.8-17925-36.7000113.9D119 L120 C124 Q185D119-P122 WeakPolarHBondContact O-CD 3.46Å; D119-P122 WeakPolarHBondContact O-CG 3.47Å; L120-P122 VanDerWaalsContact C-CD 3.41Å; P122-C124 VanDerWaalsContact C-N 3.3Å; P122-Q185 HydrophobicContact CB-CB 3.48Å; P122-Q185 VanDerWaalsContact CB-CB 3.48Å
123L78.7Confident78.2Confident5 Ų569.4 Ų69.43%0.02633%0.332CS..G310 helixtrans-81.6-7.8178.3-63.2176.5000112.7M64 L120 S121 W132 I134 F187M64-L123 HydrophobicContact CE-CD2 4.22Å; L120-L123 HydrophobicContact CD2-CD1 3.78Å; L120-L123 WeakPolarHBondContact O-CB 3.48Å; L120-L123 PolarHBondContact O-N 3.01Å; S121-L123 PolarHBondContact O-N 3.11Å; S121-L123 VanDerWaalsContact O-N 3.11Å; L123-W132 HydrophobicContact CB-CB 4.01Å; L123-W132 HydrophobicContact CD2-CB 4Å; L123-W132 WeakPolarHBondContact O-CB 3.27Å; L123-W132 PolarHBondContact O-N 2.6Å; L123-I134 HydrophobicContact CD1-CD1 3.78Å; L123-I134 HydrophobicContact CD1-CG1 4.32Å; L123-I134 HydrophobicContact CD2-CD1 4.24Å; L123-F187 HydrophobicContact CD1-CD2 4.45Å
124C80.6Confident78.5Confident31 Ų3169.4 Ų69.421%0.20933%0.332CS..EExtended strand (participates in β ladder)trans-82.2118.3177.8178.90000111.4S75 S121 P122S75-C124 WeakPolarHBondContact O-CB 3.07Å; S121-C124 WeakPolarHBondContact O-CB 2.77Å; S121-C124 PolarHBondContact O-N 3.45Å; S121-C124 VanDerWaalsContact O-N 3.1Å; P122-C124 VanDerWaalsContact C-N 3.3Å
125I82.2Confident79.2Confident46 Ų4665.7 Ų65.724%0.23631%0.312CS..EExtended strand (participates in β ladder)trans-83.1-54.3175-54.7173.5000109.6V66 Q130 W132 A182V66-I125 HydrophobicContact CB-CD1 4.5Å; V66-I125 HydrophobicContact CG1-CD1 3.86Å; V66-I125 HydrophobicContact CG2-CD1 3.86Å; I125-Q130 HydrophobicContact CB-CB 4.34Å; I125-Q130 PolarHBondContact N-O 3.16Å; I125-W132 HydrophobicContact CD1-CD2 4.41Å; I125-W132 HydrophobicContact CD1-CG 4.42Å; I125-W132 HydrophobicContact CD1-CZ2 4.46Å; I125-A182 HydrophobicContact CG2-CB 4.3Å
126Q82.6Confident80.5Confident86 Ų8663.2 Ų63.240%0.40230%0.299SS..EExtended strand (participates in β ladder)trans-139.6117.6178.4-173174.427.800110G128 R129 Q130Q126-G128 PolarHBondContact O-N 3.33Å; Q126-R129 HydrophobicContact CB-CB 4.27Å; Q126-R129 HydrophobicContact CG-CB 4.13Å; Q126-R129 PolarHBondContact O-N 3Å; Q126-R129 VanDerWaalsContact OE1-CD 3.27Å; Q126-Q130 PolarHBondContact N-O 2.97Å; Q126-Q130 PolarHBondContact O-N 3.27Å; Q126-Q130 VanDerWaalsContact O-O 3.11Å
127R84.9Confident82.1Confident203 Ų20356.6 Ų56.677%0.76627%0.274SS*.THydrogen-bonded Turntrans-49.9123.8-178.3-66.3-177.6179.3167.1-0.2111.2R129R127-R129 PolarHBondContact O-N 3.36Å
128G80.9Confident83.7Confident45 Ų4551.5 Ų51.546%0.46425%0.252SS..THydrogen-bonded Turntrans71.50.9178.200000116.5T74 Q126T74-G128 PolarHBondContact O-N 2.83Å; Q126-G128 PolarHBondContact O-N 3.33Å
129R85.6Confident85Confident166 Ų16653.6 Ų53.663%0.62626%0.263SS*.THydrogen-bonded Turntrans-119.6-56.7178.7-73.3-172.7177.6174.21.5113.1Q126 R127Q126-R129 HydrophobicContact CB-CB 4.27Å; Q126-R129 HydrophobicContact CG-CB 4.13Å; Q126-R129 PolarHBondContact O-N 3Å; Q126-R129 VanDerWaalsContact OE1-CD 3.27Å; R127-R129 PolarHBondContact O-N 3.36Å
130Q85.3Confident86Confident92 Ų9248.7 Ų48.743%0.4324%0.237SC..EExtended strand (participates in β ladder)trans-137.6129.6-173.1-71-179.2-15.700110.4V66 G67 I125 Q126V66-Q130 HydrophobicContact CG1-CB 4.04Å; V66-Q130 HydrophobicContact CG1-CG 4.2Å; G67-Q130 CarbonylContact O-C 3.59Å; G67-Q130 WeakPolarHBondContact O-CA 3.45Å; I125-Q130 HydrophobicContact CB-CB 4.34Å; I125-Q130 PolarHBondContact N-O 3.16Å; Q126-Q130 PolarHBondContact N-O 2.97Å; Q126-Q130 PolarHBondContact O-N 3.27Å; Q126-Q130 VanDerWaalsContact O-O 3.11Å
131C85.7Confident86.7Confident0 Ų050 Ų500%024%0.244CC..EExtended strand (participates in β ladder)trans-137.5158.2172.468.50000109.8G67 P69G67-C131 PolarHBondContact N-O 3.34Å; G67-C131 PolarHBondContact O-N 2.88Å; P69-C131 WeakPolarHBondContact CA-SG 3.31Å; P69-C131 HydrophobicContact CB-CB 4.23Å; P69-C131 VanDerWaalsContact N-SG 3.4Å
132W86Confident87.3Confident57 Ų5751.9 Ų51.922%0.21625%0.246CC..EExtended strand (participates in β ladder)trans-71.4136.4167-71.9103.9000110.2M64 V66 G77 R78 L123 I125M64-W132 HydrophobicContact CB-CE3 4.24Å; M64-W132 HydrophobicContact CB-CZ3 4.35Å; M64-W132 HydrophobicContact CE-CB 4.41Å; M64-W132 HydrophobicContact CE-CD2 4.43Å; M64-W132 HydrophobicContact CE-CE3 4.29Å; V66-W132 HydrophobicContact CG2-CD2 4.29Å; V66-W132 HydrophobicContact CG2-CE3 4.01Å; V66-W132 HydrophobicContact CG2-CH2 3.85Å; V66-W132 HydrophobicContact CG2-CZ2 4.13Å; V66-W132 HydrophobicContact CG2-CZ3 3.79Å; G77-W132 WeakPolarHBondContact CA-O 3.28Å; R78-W132 PolarHBondContact N-O 2.71Å; L123-W132 HydrophobicContact CB-CB 4.01Å; L123-W132 HydrophobicContact CD2-CB 4Å; L123-W132 WeakPolarHBondContact O-CB 3.27Å; L123-W132 PolarHBondContact O-N 2.6Å; I125-W132 HydrophobicContact CD1-CD2 4.41Å; I125-W132 HydrophobicContact CD1-CG 4.42Å; I125-W132 HydrophobicContact CD1-CZ2 4.46Å
133V87.5Confident87.7Confident0 Ų051.1 Ų51.10%024%0.241CC..EExtended strand (participates in β ladder)trans-116.6122.6176.1-178.10000107.1M64 E65 R78 Y135M64-V133 WeakPolarHBondContact CA-O 3.37Å; E65-V133 PolarHBondContact N-O 2.8Å; E65-V133 PolarHBondContact O-N 3.06Å; R78-V133 HydrophobicContact CG-CB 4.07Å; R78-V133 HydrophobicContact CG-CG1 3.64Å; R78-V133 HydrophobicContact CG-CG2 3.84Å; R78-V133 WeakPolarHBondContact O-CA 3.26Å; V133-Y135 HydrophobicContact CB-CE2 4.15Å; V133-Y135 HydrophobicContact CG1-CD1 4.29Å; V133-Y135 HydrophobicContact CG1-CD2 4.06Å; V133-Y135 HydrophobicContact CG1-CE1 3.8Å; V133-Y135 HydrophobicContact CG1-CE2 3.57Å; V133-Y135 HydrophobicContact CG1-CG 4.41Å; V133-Y135 VanDerWaalsContact CG1-CZ 3.42Å
134I89.2Confident88.1Confident5 Ų551.3 Ų51.33%0.02624%0.243CC..EExtended strand (participates in β ladder)trans-102.4113.8175.6-51.8-179.3000107.3V62 M64 R78 I79 E80 L123 I136 L159V62-I134 HydrophobicContact CG1-CG2 3.65Å; M64-I134 HydrophobicContact CE-CD1 4.29Å; M64-I134 HydrophobicContact CE-CG1 4.07Å; M64-I134 HydrophobicContact CG-CG1 4.14Å; M64-I134 HydrophobicContact CG-CG2 4.41Å; M64-I134 HydrophobicContact SD-CG1 4.37Å; R78-I134 PolarHBondContact O-N 2.85Å; I79-I134 WeakPolarHBondContact CA-O 3.49Å; I79-I134 HydrophobicContact CG1-CB 4.35Å; I79-I134 HydrophobicContact CG1-CD1 4.48Å; E80-I134 PolarHBondContact N-O 2.67Å; L123-I134 HydrophobicContact CD1-CD1 3.78Å; L123-I134 HydrophobicContact CD1-CG1 4.32Å; L123-I134 HydrophobicContact CD2-CD1 4.24Å; I134-I136 HydrophobicContact CG2-CD1 4.5Å; I134-I136 HydrophobicContact CG2-CG1 4.06Å; I134-L159 HydrophobicContact CG2-CD2 4.24Å
135Y92.3Very high88.4Confident56 Ų5650 Ų5022%0.2224%0.235CC..EExtended strand (participates in β ladder)trans-93126.6170.2-60.3-78.2000108.7V62 K63 E65 R78 E80 V133V62-Y135 WeakPolarHBondContact CA-O 3.32Å; K63-Y135 PolarHBondContact N-O 3.18Å; K63-Y135 PolarHBondContact O-N 2.76Å; E65-Y135 HydrophobicContact CB-CE2 4.09Å; E65-Y135 HydrophobicContact CG-CD2 4.4Å; E65-Y135 HydrophobicContact CG-CE2 4.12Å; E65-Y135 WeakPolarHBondContact OE2-CE2 3.37Å; R78-Y135 PolarHBondContact NH2-OH 2.96Å; R78-Y135 VanDerWaalsContact NH2-OH 3.08Å; E80-Y135 HydrophobicContact CB-CD1 3.96Å; E80-Y135 HydrophobicContact CB-CE1 4.28Å; E80-Y135 WeakPolarHBondContact O-CA 3.42Å; E80-Y135 VanDerWaalsContact OE2-CE1 3.29Å; E80-Y135 WeakPolarHBondContact OE2-CE1 3.47Å; V133-Y135 HydrophobicContact CB-CE2 4.15Å; V133-Y135 HydrophobicContact CG1-CD1 4.29Å; V133-Y135 HydrophobicContact CG1-CD2 4.06Å; V133-Y135 HydrophobicContact CG1-CE1 3.8Å; V133-Y135 HydrophobicContact CG1-CE2 3.57Å; V133-Y135 HydrophobicContact CG1-CG 4.41Å; V133-Y135 VanDerWaalsContact CG1-CZ 3.42Å
136I93.8Very high88.7Confident0 Ų047.9 Ų47.90%022%0.224CC..EExtended strand (participates in β ladder)trans-118.3107.7177.7-58.9171.7000106.7C61 V62 I79 E80 I81 N82 I134 V155 L159C61-I136 WeakPolarHBondContact O-CA 3.2Å; V62-I136 HydrophobicContact CG2-CG1 4.37Å; I79-I136 HydrophobicContact CG2-CD1 3.57Å; I79-I136 HydrophobicContact CG2-CG1 4.33Å; E80-I136 PolarHBondContact O-N 3.13Å; I81-I136 CarbonylContact C-O 3.59Å; I81-I136 WeakPolarHBondContact CA-O 3Å; I81-I136 HydrophobicContact CG1-CB 4.23Å; I81-I136 HydrophobicContact CG1-CD1 4.17Å; I81-I136 HydrophobicContact CG2-CG2 4.49Å; N82-I136 PolarHBondContact N-O 3.07Å; I134-I136 HydrophobicContact CG2-CD1 4.5Å; I134-I136 HydrophobicContact CG2-CG1 4.06Å; I136-V155 HydrophobicContact CD1-CG1 3.9Å; I136-V155 HydrophobicContact CG2-CG1 3.92Å; I136-V155 HydrophobicContact CG2-CG2 3.89Å; I136-L159 HydrophobicContact CD1-CD1 4.22Å; I136-L159 HydrophobicContact CD1-CD2 4.11Å; I136-L159 HydrophobicContact CD1-CG 4.42Å
137D95Very high89.1Confident69 Ų6944.8 Ų44.837%0.36921%0.21SC..EExtended strand (participates in β ladder)trans-104120.8178.4-60.7-42.3000109.1C60 C61 N82C60-D137 CarbonylContact C-O 3.04Å; C60-D137 WeakPolarHBondContact CA-O 3.5Å; C61-D137 HydrophobicContact CB-CB 4.48Å; C61-D137 PolarHBondContact N-O 3.28Å; C61-D137 PolarHBondContact O-N 3.29Å; N82-D137 WeakPolarHBondContact CB-OD1 3.35Å
138L94.9Very high89.5Confident3 Ų335.5 Ų35.52%0.01618%0.176CC..EExtended strand (participates in β ladder)trans-107.4125.9176.6-73.1168.4000110.1I58 C60 I81 N82 V83 E84 L109 V155I58-L138 HydrophobicContact CG2-CD2 4.12Å; C60-L138 HydrophobicContact CB-CD2 3.59Å; I81-L138 HydrophobicContact CG2-CD1 4.39Å; N82-L138 PolarHBondContact O-N 3.17Å; V83-L138 WeakPolarHBondContact CA-O 3.31Å; V83-L138 HydrophobicContact CG1-CB 4.43Å; V83-L138 HydrophobicContact CG2-CB 4.31Å; V83-L138 HydrophobicContact CG2-CD1 4.06Å; E84-L138 PolarHBondContact N-O 3Å; L109-L138 HydrophobicContact CD1-CD1 3.43Å; L109-L138 VanDerWaalsContact CD1-CD1 3.43Å; L138-V155 HydrophobicContact CD1-CG2 3.65Å; L138-V155 HydrophobicContact CD2-CG2 3.71Å; L138-V155 HydrophobicContact CG-CG2 3.96Å
139L94.4Very high90.1Very high59 Ų5933.4 Ų33.431%0.30915%0.154SC..EExtended strand (participates in β ladder)trans-113.7114173.3-178.264.7000109.6I58 V59 E84 L141I58-L139 WeakPolarHBondContact CA-O 3.32Å; V59-L139 PolarHBondContact N-O 3.39Å; V59-L139 PolarHBondContact O-N 2.84Å; E84-L139 HydrophobicContact CB-CD1 4.16Å; E84-L139 WeakPolarHBondContact O-CA 3.14Å; L139-L141 HydrophobicContact CD2-CD2 3.81Å; L139-L141 HydrophobicContact CD2-CG 4.29Å; L139-L141 HydrophobicContact CG-CD2 4.04Å; L139-L141 HydrophobicContact CG-CG 4.24Å
140I93.4Very high90.5Very high1 Ų125.5 Ų25.51%0.00512%0.124CC..EExtended strand (participates in β ladder)trans-87.5114175-54.1172.5000107.5I58 V83 E84 Y86 A89 L101 L105 L147I58-I140 HydrophobicContact CD1-CG1 4.44Å; I58-I140 HydrophobicContact CG1-CG1 4.38Å; I58-I140 HydrophobicContact CG1-CG2 4.34Å; I58-I140 HydrophobicContact CG2-CG1 4.48Å; V83-I140 HydrophobicContact CG1-CD1 4Å; V83-I140 HydrophobicContact CG1-CG1 4.49Å; E84-I140 PolarHBondContact O-N 3.35Å; Y86-I140 WeakPolarHBondContact CB-O 3.09Å; Y86-I140 PolarHBondContact N-O 3.03Å; A89-I140 HydrophobicContact CB-CG2 4.1Å; A89-I140 WeakPolarHBondContact CB-O 3.35Å; L101-I140 HydrophobicContact CD2-CD1 4.35Å; L105-I140 HydrophobicContact CD1-CD1 3.52Å; I140-L147 HydrophobicContact CG2-CD2 3.94Å
141L91.7Very high90.9Very high45 Ų4521.1 Ų21.124%0.23610%0.103CC..EExtended strand (participates in β ladder)trans-95.9-40.6-177.6-71.9172000112.1F57 V59 Y86 A89 L139F57-L141 HydrophobicContact CD1-CB 3.77Å; F57-L141 HydrophobicContact CD1-CD1 3.38Å; F57-L141 HydrophobicContact CD1-CG 4.19Å; F57-L141 HydrophobicContact CE1-CD1 3.3Å; F57-L141 HydrophobicContact CZ-CD1 4.49Å; F57-L141 PolarHBondContact O-N 3.27Å; V59-L141 HydrophobicContact CG2-CD1 3.75Å; Y86-L141 HydrophobicContact CD1-CD2 4.5Å; Y86-L141 HydrophobicContact CD2-CD2 4.39Å; Y86-L141 HydrophobicContact CG-CD2 4.08Å; A89-L141 WeakPolarHBondContact CA-O 3.41Å; A89-L141 VanDerWaalsContact CB-O 3.23Å; A89-L141 WeakPolarHBondContact CB-O 3.32Å; L139-L141 HydrophobicContact CD2-CD2 3.81Å; L139-L141 HydrophobicContact CD2-CG 4.29Å; L139-L141 HydrophobicContact CG-CD2 4.04Å; L139-L141 HydrophobicContact CG-CG 4.24Å
142E90.6Very high91.2Very high101 Ų10121.1 Ų21.147%0.47210%0.103SC..EExtended strand (participates in β ladder)trans-139.7133.2174.4-64.4-177.8168.800108E55 T56 F57E55-E142 VanDerWaalsContact O-CB 3.29Å; E55-E142 WeakPolarHBondContact O-CB 3.39Å; T56-E142 CarbonylContact C-O 3.56Å; T56-E142 VanDerWaalsContact CA-O 3.31Å; T56-E142 WeakPolarHBondContact CA-O 3.38Å; F57-E142 HydrophobicContact CB-CB 4.18Å; F57-E142 PolarHBondContact N-O 2.97Å; F57-E142 PolarHBondContact O-N 3.42Å; F57-E142 VanDerWaalsContact O-N 3.17Å
143G87.1Confident91.6Very high3 Ų318.5 Ų18.53%0.0319%0.094CC..  trans-122.9120.1175.700000109.5A89 K211A89-G143 PolarHBondContact O-N 2.98Å; G143-K211 WeakPolarHBondContact O-CE 3.43Å; G143-K211 PolarHBondContact O-NZ 3.28Å
144A85.9Confident91.9Very high9 Ų918.5 Ų18.57%0.0749%0.094CC..  trans-123.836.4178.100000112.2R33 E55 T56R33-A144 PolarHBondContact NH1-O 2.94Å; E55-A144 HydrophobicContact CB-CB 3.39Å; T56-A144 PolarHBondContact OG1-N 3.4Å
145G86.8Confident92.1Very high3 Ų318.2 Ų18.23%0.0319%0.092CC..SBendtrans96.4160.4-175.400000112.2R33 T56R33-G145 PolarHBondContact NH2-O 2.99Å; T56-G145 PolarHBondContact OG1-O 2.65Å
146N89.6Confident92Very high2 Ų215.7 Ų15.71%0.0118%0.083CC..  trans5349.4-178.4-161.315.9000115.2L148 D149 A150 T197 D208 E214N146-L148 VanDerWaalsContact C-N 3.34Å; N146-L148 PolarHBondContact O-N 3.2Å; N146-D149 WeakPolarHBondContact ND2-CB 3.43Å; N146-D149 PolarHBondContact ND2-OD2 3.4Å; N146-D149 VanDerWaalsContact OD1-CB 3.26Å; N146-D149 WeakPolarHBondContact OD1-CB 3.45Å; N146-D149 PolarHBondContact OD1-OD1 3.21Å; N146-D149 PolarHBondContact OD1-OD2 3.01Å; N146-D149 VanDerWaalsContact OD1-OD2 3.1Å; N146-A150 WeakPolarHBondContact O-CB 3.38Å; N146-A150 PolarHBondContact O-N 2.99Å; N146-T197 PolarHBondContact OD1-OG1 3.26Å; N146-D208 WeakPolarHBondContact CB-OD1 3.18Å; N146-D208 WeakPolarHBondContact ND2-CA 3.27Å; N146-D208 PolarHBondContact ND2-OD1 3.21Å; N146-E214 WeakPolarHBondContact CA-OE1 3.26Å; N146-E214 PolarHBondContact N-OE1 3.15Å
147L90.9Very high92Very high22 Ų2215.7 Ų15.712%0.1158%0.083CC..Hα-helixtrans-66.9-33.1-178.5-69.9173.7000113.4T56 I58 L101 L105 I140 S151T56-L147 HydrophobicContact CG2-CD2 3.85Å; I58-L147 HydrophobicContact CD1-CD2 4.27Å; L101-L147 HydrophobicContact CD1-CD1 4.06Å; L101-L147 HydrophobicContact CD2-CD1 4.06Å; L105-L147 HydrophobicContact CD1-CB 4.47Å; I140-L147 HydrophobicContact CG2-CD2 3.94Å; L147-S151 VanDerWaalsContact O-CB 3.27Å; L147-S151 WeakPolarHBondContact O-CB 3.34Å; L147-S151 PolarHBondContact O-N 3.09Å; L147-S151 PolarHBondContact O-OG 3.45Å
148L92.7Very high91.8Very high8 Ų812.4 Ų12.44%0.0427%0.065CC..Hα-helixtrans-66-51.7-177.8-83.3168.2000111.7L105 T108 N146 S151 S152 T197L105-L148 HydrophobicContact CD2-CD2 3.28Å; L105-L148 HydrophobicContact CD2-CG 3.58Å; T108-L148 HydrophobicContact CG2-CD2 3.84Å; N146-L148 VanDerWaalsContact C-N 3.34Å; N146-L148 PolarHBondContact O-N 3.2Å; L148-S151 PolarHBondContact O-N 3.43Å; L148-S152 PolarHBondContact O-N 2.84Å; L148-T197 HydrophobicContact CB-CG2 4.06Å; L148-T197 HydrophobicContact CD1-CG2 4.09Å
149D93.3Very high91.5Very high0 Ų012.5 Ų12.50%07%0.065CC..Hα-helixtrans-63.4-46.3179.4-61.83.5000110.1Y32 N146 S151 S152 L153 F195 I196 T197Y32-D149 HydrophobicContact CE1-CB 4.4Å; Y32-D149 PolarHBondContact OH-OD2 3.35Å; N146-D149 WeakPolarHBondContact ND2-CB 3.43Å; N146-D149 PolarHBondContact ND2-OD2 3.4Å; N146-D149 VanDerWaalsContact OD1-CB 3.26Å; N146-D149 WeakPolarHBondContact OD1-CB 3.45Å; N146-D149 PolarHBondContact OD1-OD1 3.21Å; N146-D149 PolarHBondContact OD1-OD2 3.01Å; N146-D149 VanDerWaalsContact OD1-OD2 3.1Å; D149-S151 VanDerWaalsContact C-N 3.33Å; D149-S151 PolarHBondContact O-N 3.28Å; D149-S152 PolarHBondContact O-N 2.97Å; D149-S152 VanDerWaalsContact O-N 3.15Å; D149-S152 PolarHBondContact O-OG 2.62Å; D149-L153 WeakPolarHBondContact O-CD1 3.44Å; D149-L153 WeakPolarHBondContact O-CG 3.32Å; D149-L153 PolarHBondContact O-N 3.06Å; D149-F195 VanDerWaalsContact CG-O 3.28Å; D149-I196 VanDerWaalsContact OD1-CA 3.3Å; D149-I196 WeakPolarHBondContact OD1-CA 3.5Å; D149-T197 WeakPolarHBondContact OD1-CG2 3.34Å; D149-T197 PolarHBondContact OD1-N 2.93Å; D149-T197 PolarHBondContact OD1-OG1 3.11Å; D149-T197 PolarHBondContact OD2-N 2.86Å; D149-T197 PolarHBondContact OD2-OG1 3.49Å
150A93.9Very high91.2Very high0 Ų010.8 Ų10.80%06%0.056CC..Hα-helixtrans-55-49.4177.600000111I51 I53 T56 I58 N146 S152 L153 V154I51-A150 HydrophobicContact CG2-CB 4.38Å; I53-A150 HydrophobicContact CD1-CB 3.73Å; I53-A150 HydrophobicContact CG1-CB 4.48Å; T56-A150 HydrophobicContact CG2-CB 4.08Å; I58-A150 HydrophobicContact CD1-CB 3.62Å; N146-A150 WeakPolarHBondContact O-CB 3.38Å; N146-A150 PolarHBondContact O-N 2.99Å; A150-S152 VanDerWaalsContact C-N 3.34Å; A150-S152 PolarHBondContact O-N 3.21Å; A150-L153 WeakPolarHBondContact O-CB 3.24Å; A150-L153 PolarHBondContact O-N 3.12Å; A150-V154 WeakPolarHBondContact O-CG2 3.07Å; A150-V154 PolarHBondContact O-N 3.5Å
151S94.1Very high90.8Very high0 Ų011.2 Ų11.20%06%0.059CC..Hα-helixtrans-59.3-45.4177.8-58.90000111.4L147 L148 D149 L153 V154 V155L147-S151 VanDerWaalsContact O-CB 3.27Å; L147-S151 WeakPolarHBondContact O-CB 3.34Å; L147-S151 PolarHBondContact O-N 3.09Å; L147-S151 PolarHBondContact O-OG 3.45Å; L148-S151 PolarHBondContact O-N 3.43Å; D149-S151 VanDerWaalsContact C-N 3.33Å; D149-S151 PolarHBondContact O-N 3.28Å; S151-L153 VanDerWaalsContact C-N 3.33Å; S151-L153 PolarHBondContact O-N 3.04Å; S151-V154 PolarHBondContact O-N 3.43Å; S151-V155 VanDerWaalsContact O-CG2 3.28Å; S151-V155 WeakPolarHBondContact O-CG2 3.24Å; S151-V155 PolarHBondContact O-N 3.39Å
152S93.1Very high90.4Very high0 Ų09.2 Ų9.20%05%0.049CC..Hα-helixtrans-62.7-39.3179.979.50000113L148 D149 A150 K156 F195L148-S152 PolarHBondContact O-N 2.84Å; D149-S152 PolarHBondContact O-N 2.97Å; D149-S152 VanDerWaalsContact O-N 3.15Å; D149-S152 PolarHBondContact O-OG 2.62Å; A150-S152 VanDerWaalsContact C-N 3.34Å; A150-S152 PolarHBondContact O-N 3.21Å; S152-K156 VanDerWaalsContact O-CB 3.31Å; S152-K156 WeakPolarHBondContact O-CB 3.44Å; S152-K156 PolarHBondContact O-N 3.36Å; S152-F195 PolarHBondContact OG-N 2.69Å
153L93.3Very high89.8Confident2 Ų26.1 Ų6.11%0.014%0.037CC..Hα-helixtrans-64.6-44.7176.6-77.8157.6000111L35 I51 I53 D149 A150 S151 K156 A157 L194 L265L35-L153 HydrophobicContact CD1-CD1 3.84Å; I51-L153 HydrophobicContact CD1-CB 3.48Å; I51-L153 VanDerWaalsContact CD1-CB 3.48Å; I51-L153 HydrophobicContact CD1-CD1 4.06Å; I51-L153 HydrophobicContact CD1-CG 4.34Å; I53-L153 HydrophobicContact CD1-CD1 3.94Å; D149-L153 WeakPolarHBondContact O-CD1 3.44Å; D149-L153 WeakPolarHBondContact O-CG 3.32Å; D149-L153 PolarHBondContact O-N 3.06Å; A150-L153 WeakPolarHBondContact O-CB 3.24Å; A150-L153 PolarHBondContact O-N 3.12Å; S151-L153 VanDerWaalsContact C-N 3.33Å; S151-L153 PolarHBondContact O-N 3.04Å; L153-K156 PolarHBondContact O-N 2.93Å; L153-A157 WeakPolarHBondContact O-CB 3.48Å; L153-A157 PolarHBondContact O-N 3.14Å; L153-L194 HydrophobicContact CD2-CD1 3.42Å; L153-L194 VanDerWaalsContact CD2-CD1 3.42Å; L153-L194 HydrophobicContact CD2-CG 4.43Å; L153-L194 HydrophobicContact CG-CD1 4.01Å; L153-L265 HydrophobicContact CD2-CD1 3.56Å
154V94Very high88.9Confident0 Ų09.8 Ų9.80%05%0.053CC..Hα-helixtrans-67.1-43.9179.6-156.20000111.1A49 I51 I58 C60 A150 S151 K156 A157 A158A49-V154 HydrophobicContact CB-CG1 3.99Å; A49-V154 VanDerWaalsContact O-CG1 3.3Å; A49-V154 WeakPolarHBondContact O-CG1 3.43Å; I51-V154 HydrophobicContact CB-CG2 3.47Å; I51-V154 VanDerWaalsContact CB-CG2 3.47Å; I51-V154 HydrophobicContact CD1-CG2 4.4Å; I51-V154 HydrophobicContact CG2-CB 4.49Å; I51-V154 HydrophobicContact CG2-CG2 3.11Å; I58-V154 HydrophobicContact CB-CG2 3.99Å; I58-V154 HydrophobicContact CG2-CG2 4.04Å; C60-V154 HydrophobicContact CB-CB 3.99Å; C60-V154 HydrophobicContact CB-CG1 3.35Å; A150-V154 WeakPolarHBondContact O-CG2 3.07Å; A150-V154 PolarHBondContact O-N 3.5Å; S151-V154 PolarHBondContact O-N 3.43Å; V154-K156 VanDerWaalsContact C-N 3.3Å; V154-K156 PolarHBondContact O-N 3.13Å; V154-A157 PolarHBondContact O-N 3.39Å; V154-A158 WeakPolarHBondContact O-CB 3.39Å; V154-A158 PolarHBondContact O-N 2.92Å
155V92.9Very high87.6Confident0 Ų011.2 Ų11.20%06%0.063CC..Hα-helixtrans-59.8-45.6177.5178.70000110Y113 I136 L138 S151 A157 A158 L159Y113-V155 HydrophobicContact CE1-CG1 4.32Å; Y113-V155 HydrophobicContact CE2-CG1 3.93Å; Y113-V155 WeakPolarHBondContact OH-CG1 3.36Å; I136-V155 HydrophobicContact CD1-CG1 3.9Å; I136-V155 HydrophobicContact CG2-CG1 3.92Å; I136-V155 HydrophobicContact CG2-CG2 3.89Å; L138-V155 HydrophobicContact CD1-CG2 3.65Å; L138-V155 HydrophobicContact CD2-CG2 3.71Å; L138-V155 HydrophobicContact CG-CG2 3.96Å; S151-V155 VanDerWaalsContact O-CG2 3.28Å; S151-V155 WeakPolarHBondContact O-CG2 3.24Å; S151-V155 PolarHBondContact O-N 3.39Å; V155-A157 PolarHBondContact O-N 3.42Å; V155-A158 PolarHBondContact O-N 3.06Å; V155-L159 HydrophobicContact CG1-CD1 3.79Å; V155-L159 HydrophobicContact CG1-CG 4.18Å; V155-L159 WeakPolarHBondContact O-CB 3.41Å; V155-L159 VanDerWaalsContact O-CG 3.31Å; V155-L159 WeakPolarHBondContact O-CG 3.22Å; V155-L159 PolarHBondContact O-N 3.3Å
156K91.6Very high86.2Confident3 Ų312.8 Ų12.81%0.0137%0.07CC..Hα-helixtrans-60.2-46.4177.2-178.1165.1-176157.90112S152 L153 V154 L159 L160 L192 N262 L265S152-K156 VanDerWaalsContact O-CB 3.31Å; S152-K156 WeakPolarHBondContact O-CB 3.44Å; S152-K156 PolarHBondContact O-N 3.36Å; L153-K156 PolarHBondContact O-N 2.93Å; V154-K156 VanDerWaalsContact C-N 3.3Å; V154-K156 PolarHBondContact O-N 3.13Å; K156-L159 PolarHBondContact O-N 3.4Å; K156-L160 HydrophobicContact CG-CD1 4.07Å; K156-L160 WeakPolarHBondContact O-CB 3.41Å; K156-L160 VanDerWaalsContact O-CG 3.27Å; K156-L160 WeakPolarHBondContact O-CG 3.48Å; K156-L160 PolarHBondContact O-N 3.5Å; K156-L192 HydrophobicContact CD-CB 4.04Å; K156-L192 HydrophobicContact CG-CB 3.98Å; K156-L192 HydrophobicContact CG-CD1 4.11Å; K156-L192 PolarHBondContact NZ-O 3.13Å; K156-N262 PolarHBondContact NZ-OD1 3.48Å; K156-L265 HydrophobicContact CG-CD2 4.32Å
157A92.1Very high84.4Confident0 Ų015.7 Ų15.70%09%0.09CC..Hα-helixtrans-62.1-43.5177.200000112.2I37 A49 L153 V154 V155 L160 N161 L269I37-A157 HydrophobicContact CG2-CB 3.96Å; A49-A157 HydrophobicContact CB-CB 3.91Å; L153-A157 WeakPolarHBondContact O-CB 3.48Å; L153-A157 PolarHBondContact O-N 3.14Å; V154-A157 PolarHBondContact O-N 3.39Å; V155-A157 PolarHBondContact O-N 3.42Å; A157-L160 PolarHBondContact O-N 2.9Å; A157-N161 WeakPolarHBondContact O-CB 3.42Å; A157-N161 PolarHBondContact O-N 2.99Å; A157-L269 HydrophobicContact CB-CD2 4.48Å
158A91.8Very high81.7Confident0 Ų020.4 Ų20.40%012%0.115CC..Hα-helixtrans-67-39.4179.500000112.2A49 C60 V62 V154 V155 N161 A162A49-A158 HydrophobicContact CB-CB 3.96Å; C60-A158 HydrophobicContact CB-CB 4.01Å; V62-A158 HydrophobicContact CG2-CB 3.68Å; V154-A158 WeakPolarHBondContact O-CB 3.39Å; V154-A158 PolarHBondContact O-N 2.92Å; V155-A158 PolarHBondContact O-N 3.06Å; A158-N161 PolarHBondContact O-N 2.93Å; A158-A162 WeakPolarHBondContact O-CB 3.47Å; A158-A162 PolarHBondContact O-N 2.86Å
159L88.9Confident79.1Confident5 Ų523.6 Ų23.63%0.02613%0.132CC..Hα-helixtrans-66.8-44.8175.1-73.5175.2000111.9V62 Y113 I134 I136 V155 K156 N161 A162 T163 L192V62-L159 HydrophobicContact CG1-CD2 4.1Å; V62-L159 HydrophobicContact CG2-CD2 4.17Å; Y113-L159 HydrophobicContact CE1-CD1 3.63Å; I134-L159 HydrophobicContact CG2-CD2 4.24Å; I136-L159 HydrophobicContact CD1-CD1 4.22Å; I136-L159 HydrophobicContact CD1-CD2 4.11Å; I136-L159 HydrophobicContact CD1-CG 4.42Å; V155-L159 HydrophobicContact CG1-CD1 3.79Å; V155-L159 HydrophobicContact CG1-CG 4.18Å; V155-L159 WeakPolarHBondContact O-CB 3.41Å; V155-L159 VanDerWaalsContact O-CG 3.31Å; V155-L159 WeakPolarHBondContact O-CG 3.22Å; V155-L159 PolarHBondContact O-N 3.3Å; K156-L159 PolarHBondContact O-N 3.4Å; L159-N161 PolarHBondContact O-N 2.89Å; L159-A162 PolarHBondContact O-N 3.49Å; L159-A162 VanDerWaalsContact O-N 3.14Å; L159-T163 WeakPolarHBondContact O-CG2 3.38Å; L159-T163 PolarHBondContact O-N 2.85Å; L159-T163 PolarHBondContact O-OG1 3.12Å; L159-L192 HydrophobicContact CB-CD1 3.87Å; L159-L192 HydrophobicContact CD1-CD1 4.37Å; L159-L192 HydrophobicContact CD1-CD2 3.78Å
160L87.1Confident76.7Confident22 Ų2226 Ų2612%0.11514%0.144CC..Hα-helixtrans-62.7-27.6176.2-73.3173.9000113K156 A157 T163 Q164 L192 L265 L269 R273K156-L160 HydrophobicContact CG-CD1 4.07Å; K156-L160 WeakPolarHBondContact O-CB 3.41Å; K156-L160 VanDerWaalsContact O-CG 3.27Å; K156-L160 WeakPolarHBondContact O-CG 3.48Å; K156-L160 PolarHBondContact O-N 3.5Å; A157-L160 PolarHBondContact O-N 2.9Å; L160-T163 PolarHBondContact O-OG1 3.46Å; L160-T163 VanDerWaalsContact O-OG1 3.06Å; L160-Q164 WeakPolarHBondContact O-CG 3.38Å; L160-L192 HydrophobicContact CD2-CD1 3.99Å; L160-L192 HydrophobicContact CG-CD1 3.92Å; L160-L265 HydrophobicContact CD1-CD2 3.72Å; L160-L269 HydrophobicContact CB-CD1 3.99Å; L160-L269 HydrophobicContact CD1-CD1 3.61Å; L160-L269 HydrophobicContact CG-CD1 4.47Å; L160-R273 PolarHBondContact O-NH2 3.19Å
161N86Confident73.8Confident11 Ų1129 Ų296%0.05917%0.166CC..Hα-helixtrans-78-42.4172.9-176.433.4000111.4T39 N40 S48 A157 A158 L159 T163 Q164 S165T39-N161 HydrophobicContact CG2-CB 4.31Å; N40-N161 PolarHBondContact N-ND2 3.01Å; N40-N161 PolarHBondContact ND2-OD1 2.77Å; N40-N161 VanDerWaalsContact ND2-OD1 3.13Å; N40-N161 PolarHBondContact OD1-ND2 2.97Å; N40-N161 PolarHBondContact OD1-OD1 2.83Å; S48-N161 PolarHBondContact N-ND2 3.49Å; S48-N161 PolarHBondContact O-ND2 3.39Å; A157-N161 WeakPolarHBondContact O-CB 3.42Å; A157-N161 PolarHBondContact O-N 2.99Å; A158-N161 PolarHBondContact O-N 2.93Å; L159-N161 PolarHBondContact O-N 2.89Å; N161-T163 PolarHBondContact O-N 3.31Å; N161-Q164 PolarHBondContact O-N 3.48Å; N161-S165 PolarHBondContact O-N 2.74Å
162A83.9Confident71Confident3 Ų333 Ų333%0.02519%0.19CC..Hα-helixtrans-61.5-42.7177.400000113T46 V62 A158 L159 Q164 S165 N166T46-A162 HydrophobicContact CG2-CB 4.27Å; V62-A162 HydrophobicContact CB-CB 4.35Å; V62-A162 HydrophobicContact CG1-CB 4.04Å; A158-A162 WeakPolarHBondContact O-CB 3.47Å; A158-A162 PolarHBondContact O-N 2.86Å; L159-A162 PolarHBondContact O-N 3.49Å; L159-A162 VanDerWaalsContact O-N 3.14Å; A162-Q164 PolarHBondContact O-N 3.45Å; A162-S165 PolarHBondContact O-N 3.46Å; A162-N166 WeakPolarHBondContact O-CB 3.26Å; A162-N166 PolarHBondContact O-N 3.13Å
163T76.4Confident68.3Low35 Ų3539.6 Ų39.622%0.21522%0.219CC..Hα-helixtrans-60-35178.951.90000112.1L159 L160 N161 F187L159-T163 WeakPolarHBondContact O-CG2 3.38Å; L159-T163 PolarHBondContact O-N 2.85Å; L159-T163 PolarHBondContact O-OG1 3.12Å; L160-T163 PolarHBondContact O-OG1 3.46Å; L160-T163 VanDerWaalsContact O-OG1 3.06Å; N161-T163 PolarHBondContact O-N 3.31Å; T163-F187 HydrophobicContact CG2-CB 4.11Å; T163-F187 HydrophobicContact CG2-CD1 3.6Å; T163-F187 HydrophobicContact CG2-CG 4.31Å; T163-F187 WeakPolarHBondContact CG2-O 3.47Å
164Q68.8Low65.7Low80 Ų8047 Ų4737%0.37425%0.253SS..Hα-helixtrans-80.5-40.9-180-66.8-169.9-9.900112.7L160 N161 A162 N166 S167L160-Q164 WeakPolarHBondContact O-CG 3.38Å; N161-Q164 PolarHBondContact O-N 3.48Å; A162-Q164 PolarHBondContact O-N 3.45Å; Q164-N166 VanDerWaalsContact C-N 3.25Å; Q164-N166 PolarHBondContact O-N 3.37Å; Q164-S167 WeakPolarHBondContact O-CB 3.37Å; Q164-S167 PolarHBondContact O-N 2.81Å; Q164-S167 VanDerWaalsContact O-N 3.14Å; Q164-S167 PolarHBondContact O-OG 2.68Å
165S58.9Low63Low40 Ų4053.4 Ų53.428%0.2829%0.288SS..Hα-helixtrans-60.5-37.5173.7-169.90000111.6T46 N161 A162 S167 L168 L169T46-S165 WeakPolarHBondContact O-CB 3.42Å; N161-S165 PolarHBondContact O-N 2.74Å; A162-S165 PolarHBondContact O-N 3.46Å; S165-S167 VanDerWaalsContact C-N 3.28Å; S165-S167 PolarHBondContact O-N 2.92Å; S165-L168 WeakPolarHBondContact O-CB 3.46Å; S165-L168 PolarHBondContact O-N 3.15Å; S165-L169 PolarHBondContact O-N 3.27Å
166N56.9Low60.4Low36 Ų3660.3 Ų60.319%0.19333%0.325CS..Hα-helixtrans-65-28176.3-81.8-19.2000114.2T46 M64 A162 Q164 L168 L169 L170T46-N166 WeakPolarHBondContact CG2-OD1 3.28Å; M64-N166 PolarHBondContact SD-ND2 3.42Å; A162-N166 WeakPolarHBondContact O-CB 3.26Å; A162-N166 PolarHBondContact O-N 3.13Å; Q164-N166 VanDerWaalsContact C-N 3.25Å; Q164-N166 PolarHBondContact O-N 3.37Å; N166-L168 PolarHBondContact O-N 3.3Å; N166-L169 PolarHBondContact O-N 3.43Å; N166-L170 WeakPolarHBondContact O-CB 3.24Å; N166-L170 WeakPolarHBondContact O-CD1 3.4Å; N166-L170 VanDerWaalsContact O-CG 3.32Å; N166-L170 WeakPolarHBondContact O-CG 3.32Å; N166-L170 PolarHBondContact O-N 2.83Å
167S51.3Low57.7Low62 Ų6262.8 Ų62.843%0.43434%0.342SS..Hα-helixtrans-60.1-31.1172.576.80000111.7Q164 S165Q164-S167 WeakPolarHBondContact O-CB 3.37Å; Q164-S167 PolarHBondContact O-N 2.81Å; Q164-S167 VanDerWaalsContact O-N 3.14Å; Q164-S167 PolarHBondContact O-OG 2.68Å; S165-S167 VanDerWaalsContact C-N 3.28Å; S165-S167 PolarHBondContact O-N 2.92Å
168L35.3Very low55Low122 Ų12272.8 Ų72.864%0.63939%0.389SS*.Hα-helixtrans-79.1-42.1175.9-61.7172.4000111.9S165 N166 L170 S171S165-L168 WeakPolarHBondContact O-CB 3.46Å; S165-L168 PolarHBondContact O-N 3.15Å; N166-L168 PolarHBondContact O-N 3.3Å; L168-L170 VanDerWaalsContact C-N 3.26Å; L168-L170 PolarHBondContact O-N 2.85Å; L168-S171 PolarHBondContact O-N 2.9Å; L168-S171 PolarHBondContact O-OG 3.04Å
169L37.8Very low52.2Low75 Ų7577.5 Ų77.539%0.39342%0.422SS..Hα-helixtrans-64.3-32177.1-78.9170.3000112.7S165 N166 S171 V172 F173S165-L169 PolarHBondContact O-N 3.27Å; N166-L169 PolarHBondContact O-N 3.43Å; L169-S171 PolarHBondContact O-N 3.29Å; L169-V172 PolarHBondContact O-N 3.03Å; L169-F173 WeakPolarHBondContact O-CD2 3.16Å; L169-F173 PolarHBondContact O-N 3.01Å
170L43.6Very low49.6Very low49 Ų4983 Ų8326%0.25745%0.451SS..Hα-helixtrans-58.4-32.8175.3-84.9161.8000113.5N166 L168 V172 Q174 V184N166-L170 WeakPolarHBondContact O-CB 3.24Å; N166-L170 WeakPolarHBondContact O-CD1 3.4Å; N166-L170 VanDerWaalsContact O-CG 3.32Å; N166-L170 WeakPolarHBondContact O-CG 3.32Å; N166-L170 PolarHBondContact O-N 2.83Å; L168-L170 VanDerWaalsContact C-N 3.26Å; L168-L170 PolarHBondContact O-N 2.85Å; L170-V172 VanDerWaalsContact C-N 3.32Å; L170-V172 PolarHBondContact O-N 2.74Å; L170-Q174 PolarHBondContact O-N 2.86Å; L170-V184 HydrophobicContact CD1-CB 4.24Å; L170-V184 HydrophobicContact CD1-CG1 4.39Å; L170-V184 HydrophobicContact CD2-CB 3.45Å; L170-V184 VanDerWaalsContact CD2-CB 3.45Å; L170-V184 HydrophobicContact CD2-CG1 4.24Å; L170-V184 HydrophobicContact CD2-CG2 3.65Å; L170-V184 HydrophobicContact CG-CB 4.37Å
171S32.7Very low46.9Very low65 Ų6591.6 Ų91.646%0.45549%0.49SS..Hα-helixtrans-70.1-27.517673.20000113.3L168 L169L168-S171 PolarHBondContact O-N 2.9Å; L168-S171 PolarHBondContact O-OG 3.04Å; L169-S171 PolarHBondContact O-N 3.29Å
172V34.4Very low44.4Very low84 Ų8493.2 Ų93.251%0.50951%0.506SS..Hα-helixtrans-82.4-35.8-177.4-176.70000111.3L169 L170 N175L169-V172 PolarHBondContact O-N 3.03Å; L170-V172 VanDerWaalsContact C-N 3.32Å; L170-V172 PolarHBondContact O-N 2.74Å; V172-N175 PolarHBondContact O-N 2.89Å
173F36.6Very low41.9Very low138 Ų13896.1 Ų96.161%0.60554%0.536SS*.Hα-helixtrans-74.9-26.7177.5-75.2-73.7000113.8L169 N175 N176L169-F173 WeakPolarHBondContact O-CD2 3.16Å; L169-F173 PolarHBondContact O-N 3.01Å; F173-N175 PolarHBondContact O-N 2.97Å; F173-N176 PolarHBondContact O-N 2.71Å
174Q39.7Very low40.3Very low157 Ų15797.1 Ų97.173%0.73454%0.542SS*.THydrogen-bonded Turntrans-62.3-23.1173.1-79.9-176.7-16.300113L170L170-Q174 PolarHBondContact O-N 2.86Å
175N36.3Very low39.1Very low134 Ų13499.7 Ų99.772%0.71755%0.554SS**THydrogen-bonded Turntrans-86.2-10.6-177.7-73.7-21000114.8V172 F173V172-N175 PolarHBondContact O-N 2.89Å; F173-N175 PolarHBondContact O-N 2.97Å
176N37.9Very low38.6Very low146 Ų146103.9 Ų103.978%0.78157%0.569SS**THydrogen-bonded Turntrans-121.34.7-170.1-84.1-15.8000116.1F173F173-N176 PolarHBondContact O-N 2.71Å
177S35.5Very low38.4Very low55 Ų55103.6 Ų103.639%0.38557%0.566SS.*  trans-155.6108.2174.254.20000112.8S179S177-S179 PolarHBondContact O-N 3.06Å
178E35.5Very low38.8Very low209 Ų209107 Ų10798%0.97758%0.575SS**THydrogen-bonded Turntrans-68.619.2174.3-65.1-174.9147.700114.4
179S32.7Very low40.1Very low100 Ų100101.5 Ų101.570%0.69955%0.548SS*.THydrogen-bonded Turntrans-147.620.9-169.666.60000116.4S177S177-S179 PolarHBondContact O-N 3.06Å
180L35.2Very low41.5Very low121 Ų121103.4 Ų103.463%0.63456%0.559SS**  trans-129.271.7167.5-77164.5000109.7A182L180-A182 PolarHBondContact O-N 2.86Å
181E29.7Very low43Very low201 Ų201104 Ų10494%0.93956%0.56SS**  trans-68.628.7165.6-64.6-166.4156.900113G183E181-G183 VanDerWaalsContact C-N 3.3Å; E181-G183 PolarHBondContact O-N 3.42Å; E181-G183 VanDerWaalsContact O-N 3.17Å
182A32.8Very low45.5Very low46 Ų46100.9 Ų100.938%0.3854%0.539SS..  trans-86.282.8165.800000106.7I125 L180 V184I125-A182 HydrophobicContact CG2-CB 4.3Å; L180-A182 PolarHBondContact O-N 2.86Å; A182-V184 PolarHBondContact O-N 3.47Å
183G32.8Very low48.1Very low64 Ų6497 Ų9766%0.6652%0.515SS*.  trans-47.8113.2173.700000109.2E181 Q185E181-G183 VanDerWaalsContact C-N 3.3Å; E181-G183 PolarHBondContact O-N 3.42Å; E181-G183 VanDerWaalsContact O-N 3.17Å; G183-Q185 VanDerWaalsContact C-N 3.28Å; G183-Q185 PolarHBondContact O-N 2.99Å
184V41.8Very low50.7Low56 Ų5690.4 Ų90.434%0.33949%0.486SS..  trans-67.499.5174.5-178.40000105.5L170 A182 Q186L170-V184 HydrophobicContact CD1-CB 4.24Å; L170-V184 HydrophobicContact CD1-CG1 4.39Å; L170-V184 HydrophobicContact CD2-CB 3.45Å; L170-V184 VanDerWaalsContact CD2-CB 3.45Å; L170-V184 HydrophobicContact CD2-CG1 4.24Å; L170-V184 HydrophobicContact CD2-CG2 3.65Å; L170-V184 HydrophobicContact CG-CB 4.37Å; A182-V184 PolarHBondContact O-N 3.47Å; V184-Q186 PolarHBondContact O-N 2.86Å
185Q44.4Very low53.2Low133 Ų13383 Ų8362%0.62145%0.452SS*.  trans-65.5130.1179.9-73.1-177.8-14.500107.8P122 G183 F187P122-Q185 HydrophobicContact CB-CB 3.48Å; P122-Q185 VanDerWaalsContact CB-CB 3.48Å; G183-Q185 VanDerWaalsContact C-N 3.28Å; G183-Q185 PolarHBondContact O-N 2.99Å; Q185-F187 PolarHBondContact O-N 3.44Å
186Q47.3Very low56Low128 Ų12876.6 Ų76.660%0.59842%0.418SS*.  trans-54.8123.9-179.7-70.1172.3-9.800109.2V184 H188V184-Q186 PolarHBondContact O-N 2.86Å; Q186-H188 PolarHBondContact O-N 3.21Å; Q186-H188 PolarHBondContact O-ND1 3.32Å
187F53.9Low58.7Low30 Ų3069.9 Ų69.913%0.13238%0.382CS..  trans-66.5104.3165.8-176.5-89.7000107.1I118 L120 L123 T163 Q185 G189 L192I118-F187 HydrophobicContact CG2-CE2 3.47Å; I118-F187 VanDerWaalsContact CG2-CE2 3.47Å; I118-F187 HydrophobicContact CG2-CZ 3.47Å; I118-F187 VanDerWaalsContact CG2-CZ 3.47Å; L120-F187 HydrophobicContact CD2-CE2 4.26Å; L123-F187 HydrophobicContact CD1-CD2 4.45Å; T163-F187 HydrophobicContact CG2-CB 4.11Å; T163-F187 HydrophobicContact CG2-CD1 3.6Å; T163-F187 HydrophobicContact CG2-CG 4.31Å; T163-F187 WeakPolarHBondContact CG2-O 3.47Å; Q185-F187 PolarHBondContact O-N 3.44Å; F187-G189 PolarHBondContact O-N 2.85Å; F187-L192 HydrophobicContact CE1-CD2 3.96Å; F187-L192 HydrophobicContact CZ-CD2 4.21Å
188H58.7Low61.5Low133 Ų13367.2 Ų67.262%0.61636%0.363SS*.  trans-72.2100.4178-73.965000107.4Q186 D190Q186-H188 PolarHBondContact O-N 3.21Å; Q186-H188 PolarHBondContact O-ND1 3.32Å; H188-D190 PolarHBondContact O-N 2.89Å
189G62.4Low64.2Low7 Ų757.4 Ų57.47%0.07232%0.317CS..G310 helixtrans-70.510.9179.800000114.5F187 M191 L192F187-G189 PolarHBondContact O-N 2.85Å; G189-M191 VanDerWaalsContact C-N 3.3Å; G189-M191 PolarHBondContact O-N 3.16Å; G189-L192 WeakPolarHBondContact O-CG 3.47Å
190D66.7Low67Low116 Ų11654.7 Ų54.762%0.6229%0.293SS*.G310 helixtrans-69.5-27.5-169.9-65.7-7.7000112.5H188 P227H188-D190 PolarHBondContact O-N 2.89Å; D190-P227 VanDerWaalsContact O-CG 3.32Å; D190-P227 WeakPolarHBondContact O-CG 3.45Å
191M76.8Confident69.6Low60 Ų6049 Ų4930%0.29626%0.263SS..G310 helixtrans-114.739.7-176.7-66.7-61.9-7200113G189 Y226 D228G189-M191 VanDerWaalsContact C-N 3.3Å; G189-M191 PolarHBondContact O-N 3.16Å; M191-Y226 HydrophobicContact CE-CD1 4.24Å; M191-Y226 HydrophobicContact CE-CG 4.12Å; M191-Y226 WeakPolarHBondContact O-CD1 3.42Å; M191-D228 HydrophobicContact CE-CB 4.48Å
192L84.2Confident72.3Confident1 Ų141.1 Ų41.11%0.00524%0.236CC..  trans-73.3129175.4-72.7172.9000111.9Y113 I118 K156 L159 L160 F187 G189Y113-L192 HydrophobicContact CE1-CD2 4.08Å; I118-L192 HydrophobicContact CD1-CD2 4.41Å; K156-L192 HydrophobicContact CD-CB 4.04Å; K156-L192 HydrophobicContact CG-CB 3.98Å; K156-L192 HydrophobicContact CG-CD1 4.11Å; K156-L192 PolarHBondContact NZ-O 3.13Å; L159-L192 HydrophobicContact CB-CD1 3.87Å; L159-L192 HydrophobicContact CD1-CD1 4.37Å; L159-L192 HydrophobicContact CD1-CD2 3.78Å; L160-L192 HydrophobicContact CD2-CD1 3.99Å; L160-L192 HydrophobicContact CG-CD1 3.92Å; F187-L192 HydrophobicContact CE1-CD2 3.96Å; F187-L192 HydrophobicContact CZ-CD2 4.21Å; G189-L192 WeakPolarHBondContact O-CG 3.47Å
193P88.3Confident74.8Confident1 Ų147.6 Ų47.61%0.00626%0.256CS..  trans-68.2144-179.727.5-33.5000111.6Y113 I118 V224 Y226Y113-P193 HydrophobicContact CD1-CG 4.33Å; Y113-P193 HydrophobicContact CE1-CG 4.04Å; Y113-P193 HydrophobicContact CE2-CG 4.45Å; I118-P193 HydrophobicContact CD1-CG 4.29Å; P193-V224 HydrophobicContact CB-CG1 3.36Å; P193-Y226 HydrophobicContact CB-CD1 4.46Å; P193-Y226 HydrophobicContact CB-CE1 3.93Å
194L91.4Very high77.5Confident0 Ų045.6 Ų45.60%023%0.233CC..EExtended strand (participates in β ladder)trans-124.1136.5171.2-178.2146.8000108.8L153 I196 V224 I225 L261 N262L153-L194 HydrophobicContact CD2-CD1 3.42Å; L153-L194 VanDerWaalsContact CD2-CD1 3.42Å; L153-L194 HydrophobicContact CD2-CG 4.43Å; L153-L194 HydrophobicContact CG-CD1 4.01Å; L194-I196 HydrophobicContact CD2-CD1 3.92Å; L194-I196 HydrophobicContact CD2-CG1 3.48Å; L194-I196 VanDerWaalsContact CD2-CG1 3.48Å; L194-V224 CarbonylContact O-C 3.49Å; L194-V224 WeakPolarHBondContact O-CA 3.27Å; L194-I225 PolarHBondContact N-O 3.02Å; L194-I225 PolarHBondContact O-N 2.83Å; L194-L261 HydrophobicContact CD1-CB 4.41Å; L194-L261 HydrophobicContact CD2-CD1 4.4Å; L194-N262 WeakPolarHBondContact CD1-OD1 3.45Å
195F93.5Very high79.9Confident2 Ų244.9 Ų44.91%0.00922%0.224CC..EExtended strand (participates in β ladder)trans-89.7139.3176.1-79.1-91.3000110.7T108 L109 A112 D149 S152 L223 V224T108-F195 HydrophobicContact CG2-CD1 4.39Å; T108-F195 HydrophobicContact CG2-CE1 3.51Å; T108-F195 HydrophobicContact CG2-CZ 3.6Å; T108-F195 WeakPolarHBondContact O-CZ 3.49Å; L109-F195 HydrophobicContact CD2-CD2 3.97Å; L109-F195 HydrophobicContact CD2-CE2 3.73Å; A112-F195 HydrophobicContact CB-CE1 4.49Å; A112-F195 HydrophobicContact CB-CE2 3.47Å; A112-F195 VanDerWaalsContact CB-CE2 3.47Å; A112-F195 HydrophobicContact CB-CZ 3.37Å; D149-F195 VanDerWaalsContact CG-O 3.28Å; S152-F195 PolarHBondContact OG-N 2.69Å; F195-L223 CarbonylContact C-O 3.59Å; F195-L223 WeakPolarHBondContact CA-O 3.26Å; F195-V224 HydrophobicContact CD1-CG2 3.83Å; F195-V224 HydrophobicContact CD2-CG2 4.47Å; F195-V224 HydrophobicContact CE1-CG2 3.41Å; F195-V224 VanDerWaalsContact CE1-CG2 3.41Å; F195-V224 HydrophobicContact CE2-CG2 4.11Å; F195-V224 HydrophobicContact CG-CG2 4.38Å; F195-V224 HydrophobicContact CZ-CG2 3.59Å
196I94.7Very high82.2Confident0 Ų038.6 Ų38.60%020%0.195CC..EExtended strand (participates in β ladder)trans-130.3122.2169.7-58.9-179.4000108.5D149 L194 V198 I207 L223 I225 A254D149-I196 VanDerWaalsContact OD1-CA 3.3Å; D149-I196 WeakPolarHBondContact OD1-CA 3.5Å; L194-I196 HydrophobicContact CD2-CD1 3.92Å; L194-I196 HydrophobicContact CD2-CG1 3.48Å; L194-I196 VanDerWaalsContact CD2-CG1 3.48Å; I196-V198 HydrophobicContact CG2-CG2 4.43Å; I196-I207 HydrophobicContact CG2-CG2 4.18Å; I196-L223 PolarHBondContact N-O 3.47Å; I196-L223 PolarHBondContact O-N 3.46Å; I196-I225 HydrophobicContact CB-CD1 4.08Å; I196-I225 HydrophobicContact CD1-CD1 3.33Å; I196-I225 HydrophobicContact CG1-CD1 3.91Å; I196-A254 HydrophobicContact CB-CB 4.28Å; I196-A254 VanDerWaalsContact CD1-O 3.29Å; I196-A254 WeakPolarHBondContact CD1-O 3.42Å; I196-A254 HydrophobicContact CG2-CB 4Å
197T94Very high84.4Confident4 Ų432.7 Ų32.73%0.02517%0.168CC..EExtended strand (participates in β ladder)trans-97.1124.1174.159.10000110.6N146 L148 D149 L221N146-T197 PolarHBondContact OD1-OG1 3.26Å; L148-T197 HydrophobicContact CB-CG2 4.06Å; L148-T197 HydrophobicContact CD1-CG2 4.09Å; D149-T197 WeakPolarHBondContact OD1-CG2 3.34Å; D149-T197 PolarHBondContact OD1-N 2.93Å; D149-T197 PolarHBondContact OD1-OG1 3.11Å; D149-T197 PolarHBondContact OD2-N 2.86Å; D149-T197 PolarHBondContact OD2-OG1 3.49Å; T197-L221 CarbonylContact C-O 3.6Å; T197-L221 WeakPolarHBondContact CA-O 3.23Å
198V94.5Very high86.2Confident0 Ų031.3 Ų31.30%016%0.162CC..EExtended strand (participates in β ladder)trans-106.7118.6172.2-172.60000108.4I196 L206 I207 R220 L221 M250 A254I196-V198 HydrophobicContact CG2-CG2 4.43Å; V198-L206 CarbonylContact C-O 3.55Å; V198-L206 WeakPolarHBondContact CA-O 3.46Å; V198-I207 HydrophobicContact CG2-CG1 4.28Å; V198-R220 CarbonylContact O-C 3.54Å; V198-R220 WeakPolarHBondContact O-CA 3.44Å; V198-L221 PolarHBondContact N-O 3.06Å; V198-L221 PolarHBondContact O-N 3.32Å; V198-M250 HydrophobicContact CB-CB 4.32Å; V198-M250 HydrophobicContact CB-CG 4.41Å; V198-M250 HydrophobicContact CG1-CB 4.06Å; V198-M250 HydrophobicContact CG1-CG 3.79Å; V198-M250 HydrophobicContact CG1-SD 4.42Å; V198-A254 HydrophobicContact CG2-CB 3.93Å
199H92.8Very high87.7Confident3 Ų325 Ų251%0.01413%0.132CC..EExtended strand (participates in β ladder)trans-94.8132.9177.8-69.282.7000110Y205 L206 A209 E214 S217H199-Y205 WeakPolarHBondContact O-CA 3.39Å; H199-L206 HydrophobicContact CB-CB 4.47Å; H199-L206 PolarHBondContact N-O 2.74Å; H199-L206 PolarHBondContact O-N 3.16Å; H199-A209 HydrophobicContact CB-CB 4.27Å; H199-E214 IonicContact CE1-OE1 3.99Å; H199-S217 PolarHBondContact CD2-OG 2.73Å
200K91.5Very high89Confident42 Ų4225.8 Ų25.818%0.18314%0.137CC..EExtended strand (participates in β ladder)trans-96.2115.7171.4-166.7178.7179.11680109.5Y205 L218 S219 M250K200-Y205 HydrophobicContact CD-CE1 4.43Å; K200-Y205 HydrophobicContact CG-CD1 4.27Å; K200-Y205 HydrophobicContact CG-CE1 4.21Å; K200-L218 PolarHBondContact O-N 2.87Å; K200-S219 WeakPolarHBondContact CB-O 3.44Å; K200-S219 VanDerWaalsContact CB-OG 3.23Å; K200-S219 WeakPolarHBondContact CB-OG 3.39Å; K200-S219 PolarHBondContact N-O 3.35Å; K200-M250 HydrophobicContact CB-CE 3.67Å; K200-M250 HydrophobicContact CD-CE 3.72Å; K200-M250 HydrophobicContact CG-CE 3.87Å
201I89.7Confident90.1Very high1 Ų122.8 Ų22.81%0.00512%0.118CC..EExtended strand (participates in β ladder)trans-121.9112.1173.9-53.5-170000107.4V15 V18 K203 A204 L206 E213 C216V15-I201 HydrophobicContact CB-CG2 4.32Å; V15-I201 HydrophobicContact CG1-CG2 4.43Å; V15-I201 HydrophobicContact CG2-CG2 3.82Å; V18-I201 HydrophobicContact CG1-CB 4.04Å; V18-I201 HydrophobicContact CG1-CG2 4.3Å; I201-K203 PolarHBondContact O-N 2.82Å; I201-A204 PolarHBondContact N-O 3.05Å; I201-A204 VanDerWaalsContact N-O 3.09Å; I201-A204 PolarHBondContact O-N 2.89Å; I201-L206 HydrophobicContact CD1-CD1 3.57Å; I201-L206 HydrophobicContact CG1-CD1 4.22Å; I201-E213 HydrophobicContact CD1-CB 3.93Å; I201-E213 HydrophobicContact CD1-CG 4.48Å; I201-E213 VanDerWaalsContact CD1-O 3.25Å; I201-E213 WeakPolarHBondContact CD1-O 3.43Å; I201-C216 HydrophobicContact CD1-CB 4.44Å
202G85.5Confident90.6Very high37 Ų3724 Ų2438%0.38112%0.123SC..THydrogen-bonded Turntrans58.2-119.5-171.900000111.3
203K85.9Confident90.9Very high181 Ų18124 Ų2479%0.78712%0.123SC*.THydrogen-bonded Turntrans-96.2-9.4176.1-65.4179.3-178.2174.30114.4I201I201-K203 PolarHBondContact O-N 2.82Å
204A89.9Confident90.9Very high22 Ų2226.3 Ų26.318%0.18213%0.134CC..EExtended strand (participates in β ladder)trans-96.8156.9-175.600000112V18 I201V18-A204 HydrophobicContact CG1-CB 3.72Å; I201-A204 PolarHBondContact N-O 3.05Å; I201-A204 VanDerWaalsContact N-O 3.09Å; I201-A204 PolarHBondContact O-N 2.89Å
205Y91.7Very high90.8Very high41 Ų4127.8 Ų27.816%0.16115%0.146CC..EExtended strand (participates in β ladder)trans-113.6128.4176.7-48.5-52.7000109.1H199 K200 S246 E249 M250 L253H199-Y205 WeakPolarHBondContact O-CA 3.39Å; K200-Y205 HydrophobicContact CD-CE1 4.43Å; K200-Y205 HydrophobicContact CG-CD1 4.27Å; K200-Y205 HydrophobicContact CG-CE1 4.21Å; Y205-S246 WeakPolarHBondContact OH-CA 3.29Å; Y205-S246 VanDerWaalsContact OH-CB 3.24Å; Y205-S246 WeakPolarHBondContact OH-CB 3.44Å; Y205-S246 PolarHBondContact OH-OG 3.45Å; Y205-E249 HydrophobicContact CE2-CB 3.89Å; Y205-E249 WeakPolarHBondContact CE2-OE2 3.3Å; Y205-E249 PolarHBondContact OH-OE2 3.29Å; Y205-M250 HydrophobicContact CD1-CE 3.43Å; Y205-M250 VanDerWaalsContact CD1-CE 3.43Å; Y205-M250 HydrophobicContact CD1-CG 3.78Å; Y205-M250 HydrophobicContact CD1-SD 4.44Å; Y205-M250 HydrophobicContact CE1-CE 3.29Å; Y205-M250 HydrophobicContact CE1-CG 3.96Å; Y205-M250 HydrophobicContact CE1-SD 4.49Å; Y205-M250 HydrophobicContact CG-CG 4.1Å; Y205-L253 HydrophobicContact CD2-CD1 3.76Å; Y205-L253 HydrophobicContact CG-CD1 4.31Å
206L92.5Very high90.5Very high2 Ų227.8 Ų27.81%0.0115%0.147CC..EExtended strand (participates in β ladder)trans-118.5146179.6-65.3-177.4000110.9V18 P29 V198 H199 I201 E213V18-L206 HydrophobicContact CB-CD1 4.43Å; V18-L206 HydrophobicContact CG1-CD1 3.76Å; V18-L206 HydrophobicContact CG1-CD2 3.9Å; V18-L206 HydrophobicContact CG1-CG 3.82Å; V18-L206 HydrophobicContact CG2-CD1 3.74Å; P29-L206 HydrophobicContact CB-CD2 3.67Å; P29-L206 WeakPolarHBondContact O-CA 3.4Å; V198-L206 CarbonylContact C-O 3.55Å; V198-L206 WeakPolarHBondContact CA-O 3.46Å; H199-L206 HydrophobicContact CB-CB 4.47Å; H199-L206 PolarHBondContact N-O 2.74Å; H199-L206 PolarHBondContact O-N 3.16Å; I201-L206 HydrophobicContact CD1-CD1 3.57Å; I201-L206 HydrophobicContact CG1-CD1 4.22Å; L206-E213 HydrophobicContact CD1-CG 4.39Å
207I92.9Very high90.2Very high4 Ų428.6 Ų28.62%0.02115%0.152CC..EExtended strand (participates in β ladder)trans-115145170.5-60.6170.6000108.1R23 P29 Y32 I196 V198 V257R23-I207 PolarHBondContact NH1-O 3.06Å; P29-I207 PolarHBondContact O-N 3.43Å; Y32-I207 HydrophobicContact CD2-CG2 4.06Å; Y32-I207 HydrophobicContact CE1-CG2 4.47Å; Y32-I207 HydrophobicContact CE2-CG2 3.23Å; Y32-I207 VanDerWaalsContact CZ-CG2 3.47Å; Y32-I207 WeakPolarHBondContact OH-CG2 3.42Å; I196-I207 HydrophobicContact CG2-CG2 4.18Å; V198-I207 HydrophobicContact CG2-CG1 4.28Å; I207-V257 HydrophobicContact CD1-CB 3.97Å; I207-V257 HydrophobicContact CD1-CG1 4.18Å; I207-V257 HydrophobicContact CD1-CG2 3.6Å; I207-V257 HydrophobicContact CG2-CG1 4.44Å
208D92.7Very high89.9Confident0 Ų032.5 Ų32.50%017%0.173CC..SBendtrans54.661.1-177.1-173.845.9000113.3R23 R27 Y32 R33 N146R23-D208 PolarHBondContact NH2-O 3.39Å; R27-D208 IonicContact CZ-OD2 2.69Å; R27-D208 IonicContact NH1-OD2 3.46Å; R27-D208 PolarHBondContact NH1-OD2 2.86Å; Y32-D208 HydrophobicContact CD1-CB 3.52Å; Y32-D208 HydrophobicContact CD2-CB 4.47Å; Y32-D208 HydrophobicContact CE1-CB 3.7Å; Y32-D208 HydrophobicContact CG-CB 3.93Å; R33-D208 WeakPolarHBondContact CB-OD2 3.38Å; R33-D208 WeakPolarHBondContact CG-OD2 3.46Å; R33-D208 IonicContact CZ-OD1 3.09Å; R33-D208 IonicContact CZ-OD2 3.33Å; R33-D208 PolarHBondContact N-OD2 3.1Å; R33-D208 IonicContact NE-OD1 3.92Å; R33-D208 PolarHBondContact NE-OD1 2.79Å; R33-D208 IonicContact NE-OD2 2.71Å; R33-D208 PolarHBondContact NE-OD2 2.88Å; R33-D208 IonicContact NH2-OD1 2.89Å; R33-D208 PolarHBondContact NH2-OD1 2.88Å; R33-D208 IonicContact NH2-OD2 3.57Å; N146-D208 WeakPolarHBondContact CB-OD1 3.18Å; N146-D208 WeakPolarHBondContact ND2-CA 3.27Å; N146-D208 PolarHBondContact ND2-OD1 3.21Å
209A91.1Very high89.6Confident0 Ų032.7 Ų32.70%017%0.174CC..  trans-67.3140.3179.200000111.7H199 E213 E214H199-A209 HydrophobicContact CB-CB 4.27Å; A209-E213 VanDerWaalsContact CA-OE2 3.23Å; A209-E213 WeakPolarHBondContact CA-OE2 3.39Å; A209-E213 HydrophobicContact CB-CB 3.83Å; A209-E214 HydrophobicContact CB-CG 3.72Å
210S89.6Confident89.6Confident24 Ų2434 Ų3417%0.16818%0.179CC..  trans-69.3165.7166.9750000110.6E212 E213 E214S210-E212 PolarHBondContact O-N 2.88Å; S210-E212 VanDerWaalsContact O-N 3.16Å; S210-E212 PolarHBondContact OG-N 2.89Å; S210-E213 PolarHBondContact N-OE2 3.45Å; S210-E213 PolarHBondContact O-N 3.04Å; S210-E213 VanDerWaalsContact O-N 3.11Å; S210-E213 WeakPolarHBondContact OG-CG 3.38Å; S210-E213 PolarHBondContact OG-N 2.71Å; S210-E214 WeakPolarHBondContact O-CG 3.29Å; S210-E214 PolarHBondContact O-N 2.68Å
211K88.5Confident89.6Confident53 Ų5332.1 Ų32.123%0.2317%0.17CC..Hα-helixtrans-51.1-39.6174.2-75-179.4164158.20113.5V4 G143 A215V4-K211 HydrophobicContact CG2-CB 4.04Å; G143-K211 WeakPolarHBondContact O-CE 3.43Å; G143-K211 PolarHBondContact O-NZ 3.28Å; K211-A215 WeakPolarHBondContact O-CB 3.48Å; K211-A215 PolarHBondContact O-N 3.35Å
212E88.7Confident89.8Confident85 Ų8532.1 Ų32.140%0.39717%0.171SC..Hα-helixtrans-70.7-42.1-178.8-62.5174179.900111.2V4 L6 L14 S210 A215 C216V4-E212 HydrophobicContact CG1-CG 4.26Å; L6-E212 HydrophobicContact CD2-CB 4.26Å; L6-E212 HydrophobicContact CD2-CG 4.28Å; L14-E212 HydrophobicContact CD1-CB 4Å; S210-E212 PolarHBondContact O-N 2.88Å; S210-E212 VanDerWaalsContact O-N 3.16Å; S210-E212 PolarHBondContact OG-N 2.89Å; E212-A215 PolarHBondContact O-N 2.79Å; E212-C216 PolarHBondContact O-N 2.78Å; E212-C216 VanDerWaalsContact O-N 3.13Å; E212-C216 PolarHBondContact O-SG 3.11Å
213E89.8Confident90.2Very high2 Ų230.4 Ų30.41%0.00915%0.152CC..Hα-helixtrans-65.3-41.8174.7-70.5172.7161.200111.1R23 I201 L206 A209 S210 A215 C216 S217R23-E213 IonicContact CZ-OE1 3.75Å; R23-E213 IonicContact CZ-OE2 3.6Å; R23-E213 IonicContact NE-OE1 3.02Å; R23-E213 PolarHBondContact NE-OE1 2.68Å; R23-E213 IonicContact NE-OE2 3.65Å; R23-E213 IonicContact NH2-OE1 3.56Å; R23-E213 IonicContact NH2-OE2 2.74Å; R23-E213 PolarHBondContact NH2-OE2 3.12Å; I201-E213 HydrophobicContact CD1-CB 3.93Å; I201-E213 HydrophobicContact CD1-CG 4.48Å; I201-E213 VanDerWaalsContact CD1-O 3.25Å; I201-E213 WeakPolarHBondContact CD1-O 3.43Å; L206-E213 HydrophobicContact CD1-CG 4.39Å; A209-E213 VanDerWaalsContact CA-OE2 3.23Å; A209-E213 WeakPolarHBondContact CA-OE2 3.39Å; A209-E213 HydrophobicContact CB-CB 3.83Å; S210-E213 PolarHBondContact N-OE2 3.45Å; S210-E213 PolarHBondContact O-N 3.04Å; S210-E213 VanDerWaalsContact O-N 3.11Å; S210-E213 WeakPolarHBondContact OG-CG 3.38Å; S210-E213 PolarHBondContact OG-N 2.71Å; E213-A215 VanDerWaalsContact C-N 3.35Å; E213-A215 PolarHBondContact O-N 2.75Å; E213-C216 PolarHBondContact O-N 3.32Å; E213-C216 VanDerWaalsContact O-N 3.14Å; E213-S217 PolarHBondContact O-N 3.05Å
214E88.8Confident90.5Very high49 Ų4921.8 Ų21.823%0.22912%0.115CC..Hα-helixtrans-60.1-43174.7-72.9-169.7175.200111.7N146 H199 A209 S210 C216 S217N146-E214 WeakPolarHBondContact CA-OE1 3.26Å; N146-E214 PolarHBondContact N-OE1 3.15Å; H199-E214 IonicContact CE1-OE1 3.99Å; A209-E214 HydrophobicContact CB-CG 3.72Å; S210-E214 WeakPolarHBondContact O-CG 3.29Å; S210-E214 PolarHBondContact O-N 2.68Å; E214-C216 PolarHBondContact O-N 3.37Å; E214-S217 WeakPolarHBondContact O-CB 3.1Å; E214-S217 PolarHBondContact O-N 3.01Å; E214-S217 VanDerWaalsContact O-N 3.11Å; E214-S217 PolarHBondContact O-OG 3.21Å
215A88.2Confident90.6Very high31 Ų3120.7 Ų20.726%0.25611%0.106SC..Hα-helixtrans-66.9-25.217700000113.2V4 L6 R11 K211 E212 E213V4-A215 HydrophobicContact CB-CB 4.15Å; V4-A215 HydrophobicContact CG2-CB 4.36Å; L6-A215 HydrophobicContact CD1-CB 3.62Å; R11-A215 PolarHBondContact NH1-O 2.95Å; K211-A215 WeakPolarHBondContact O-CB 3.48Å; K211-A215 PolarHBondContact O-N 3.35Å; E212-A215 PolarHBondContact O-N 2.79Å; E213-A215 VanDerWaalsContact C-N 3.35Å; E213-A215 PolarHBondContact O-N 2.75Å
216C88.3Confident90.5Very high3 Ų318.8 Ų18.82%0.0210%0.099CC..Hα-helixtrans-83-21.9172.8-650000112.9R11 I201 E212 E213 E214R11-C216 PolarHBondContact NH2-O 3.01Å; I201-C216 HydrophobicContact CD1-CB 4.44Å; E212-C216 PolarHBondContact O-N 2.78Å; E212-C216 VanDerWaalsContact O-N 3.13Å; E212-C216 PolarHBondContact O-SG 3.11Å; E213-C216 PolarHBondContact O-N 3.32Å; E213-C216 VanDerWaalsContact O-N 3.14Å; E214-C216 PolarHBondContact O-N 3.37Å
217S88.7Confident90.2Very high17 Ų1721 Ų2112%0.11911%0.113CC..  trans-68.6137.2-178.579.80000112.2H199 E213 E214H199-S217 PolarHBondContact CD2-OG 2.73Å; E213-S217 PolarHBondContact O-N 3.05Å; E214-S217 WeakPolarHBondContact O-CB 3.1Å; E214-S217 PolarHBondContact O-N 3.01Å; E214-S217 VanDerWaalsContact O-N 3.11Å; E214-S217 PolarHBondContact O-OG 3.21Å
218L86.2Confident89.9Confident86 Ų8625 Ų2545%0.4513%0.134SC..SBendtrans-97.1-29178.8-64.7175.8000112.5K200 G238 C239 C240K200-L218 PolarHBondContact O-N 2.87Å; L218-G238 CarbonylContact O-C 3.57Å; L218-G238 WeakPolarHBondContact O-CA 3.48Å; L218-C239 PolarHBondContact O-N 3.27Å; L218-C240 HydrophobicContact CB-CB 4.19Å; L218-C240 VanDerWaalsContact CB-SG 3.6Å
219S89.6Confident89.4Confident3 Ų325.4 Ų25.42%0.02114%0.139CC..EExtended strand (participates in β ladder)trans-142.9140176.461.70000109.5K200 D237 C242K200-S219 WeakPolarHBondContact CB-O 3.44Å; K200-S219 VanDerWaalsContact CB-OG 3.23Å; K200-S219 WeakPolarHBondContact CB-OG 3.39Å; K200-S219 PolarHBondContact N-O 3.35Å; S219-D237 CarbonylContact C-O 3.57Å; S219-D237 WeakPolarHBondContact CA-O 3.49Å; S219-C242 PolarHBondContact OG-SG 3.47Å
220R91.4Very high89.3Confident32 Ų3227.1 Ų27.112%0.12115%0.151CC..EExtended strand (participates in β ladder)trans-123.7141.6172.168.2-175.4-178.5-154.8-11.9109.1V198 D237V198-R220 CarbonylContact O-C 3.54Å; V198-R220 WeakPolarHBondContact O-CA 3.44Å; R220-D237 HydrophobicContact CG-CB 3.48Å; R220-D237 VanDerWaalsContact CG-CB 3.48Å; R220-D237 IonicContact CZ-OD2 3.18Å; R220-D237 PolarHBondContact N-O 3.43Å; R220-D237 IonicContact NE-OD2 2.9Å; R220-D237 PolarHBondContact NE-OD2 2.89Å; R220-D237 IonicContact NH2-OD2 3.04Å; R220-D237 PolarHBondContact NH2-OD2 3.22Å; R220-D237 PolarHBondContact O-N 2.9Å; R220-D237 VanDerWaalsContact O-O 3.1Å
221L93.2Very high89.1Confident2 Ų229.4 Ų29.41%0.0116%0.161CC..EExtended strand (participates in β ladder)trans-117.9112.9177.7-169.470.1000108.2T197 V198 L223 L234 Q236 I247 M250T197-L221 CarbonylContact C-O 3.6Å; T197-L221 WeakPolarHBondContact CA-O 3.23Å; V198-L221 PolarHBondContact N-O 3.06Å; V198-L221 PolarHBondContact O-N 3.32Å; L221-L223 HydrophobicContact CD2-CD1 3.92Å; L221-L223 HydrophobicContact CD2-CD2 4.22Å; L221-L223 HydrophobicContact CD2-CG 4.17Å; L221-L223 HydrophobicContact CG-CD1 4.35Å; L221-L223 HydrophobicContact CG-CD2 4.23Å; L221-L223 HydrophobicContact CG-CG 4.1Å; L221-L234 HydrophobicContact CD1-CD1 3.95Å; L221-L234 HydrophobicContact CD1-CD2 3.54Å; L221-L234 HydrophobicContact CD1-CG 3.61Å; L221-L234 HydrophobicContact CD2-CD1 4.34Å; L221-L234 HydrophobicContact CG-CD1 4.48Å; L221-L234 HydrophobicContact CG-CG 4.3Å; L221-Q236 HydrophobicContact CD1-CB 3.96Å; L221-Q236 HydrophobicContact CD1-CG 4.42Å; L221-I247 HydrophobicContact CD2-CG2 4.2Å; L221-M250 HydrophobicContact CB-SD 3.99Å; L221-M250 HydrophobicContact CD2-CB 3.68Å; L221-M250 HydrophobicContact CD2-CG 4.5Å; L221-M250 HydrophobicContact CD2-SD 3.95Å
222S93.2Very high89Confident1 Ų128 Ų281%0.00716%0.162CC..EExtended strand (participates in β ladder)trans-97.7122176-44.50000108.6E235S222-E235 PolarHBondContact N-O 3.03Å; S222-E235 PolarHBondContact O-N 2.79Å
223L93.7Very high88.9Confident0 Ų025.4 Ų25.40%015%0.153CC..EExtended strand (participates in β ladder)trans-120.9134.9-177.4-65.4167.4000109.9F195 I196 L221 I225 I231 L234 A254F195-L223 CarbonylContact C-O 3.59Å; F195-L223 WeakPolarHBondContact CA-O 3.26Å; I196-L223 PolarHBondContact N-O 3.47Å; I196-L223 PolarHBondContact O-N 3.46Å; L221-L223 HydrophobicContact CD2-CD1 3.92Å; L221-L223 HydrophobicContact CD2-CD2 4.22Å; L221-L223 HydrophobicContact CD2-CG 4.17Å; L221-L223 HydrophobicContact CG-CD1 4.35Å; L221-L223 HydrophobicContact CG-CD2 4.23Å; L221-L223 HydrophobicContact CG-CG 4.1Å; L223-I225 HydrophobicContact CB-CD1 4.46Å; L223-I231 HydrophobicContact CD2-CG2 4.08Å; L223-L234 HydrophobicContact CD2-CB 3.66Å; L223-L234 HydrophobicContact CD2-CD1 3.54Å; L223-L234 HydrophobicContact CD2-CG 3.5Å; L223-A254 HydrophobicContact CB-CB 4.42Å; L223-A254 HydrophobicContact CD1-CB 3.42Å; L223-A254 VanDerWaalsContact CD1-CB 3.42Å
224V92.8Very high88.9Confident0 Ų029.2 Ų29.20%017%0.173CC..EExtended strand (participates in β ladder)trans-85.8125.4168.3176.40000108.9A112 P193 L194 F195 Y226 I231 G232 S233A112-V224 HydrophobicContact CB-CG2 3.91Å; P193-V224 HydrophobicContact CB-CG1 3.36Å; L194-V224 CarbonylContact O-C 3.49Å; L194-V224 WeakPolarHBondContact O-CA 3.27Å; F195-V224 HydrophobicContact CD1-CG2 3.83Å; F195-V224 HydrophobicContact CD2-CG2 4.47Å; F195-V224 HydrophobicContact CE1-CG2 3.41Å; F195-V224 VanDerWaalsContact CE1-CG2 3.41Å; F195-V224 HydrophobicContact CE2-CG2 4.11Å; F195-V224 HydrophobicContact CG-CG2 4.38Å; F195-V224 HydrophobicContact CZ-CG2 3.59Å; V224-Y226 HydrophobicContact CG1-CE2 4.23Å; V224-I231 CarbonylContact O-C 3.48Å; V224-I231 WeakPolarHBondContact O-CA 3.18Å; V224-G232 PolarHBondContact O-N 2.9Å; V224-S233 VanDerWaalsContact CG2-OG 3.27Å; V224-S233 WeakPolarHBondContact CG2-OG 3.41Å; V224-S233 PolarHBondContact N-O 3.4Å
225I91.9Very high88.9Confident0 Ų029.3 Ų29.30%017%0.173CC..EExtended strand (participates in β ladder)trans-124.5128.4179.6-67.6155.8000109.9L194 I196 L223 A254L194-I225 PolarHBondContact N-O 3.02Å; L194-I225 PolarHBondContact O-N 2.83Å; I196-I225 HydrophobicContact CB-CD1 4.08Å; I196-I225 HydrophobicContact CD1-CD1 3.33Å; I196-I225 HydrophobicContact CG1-CD1 3.91Å; L223-I225 HydrophobicContact CB-CD1 4.46Å; I225-A254 HydrophobicContact CD1-CB 3.67Å; I225-A254 WeakPolarHBondContact CD1-O 3.34Å
226Y89.4Confident89Confident0 Ų031.7 Ų31.70%018%0.179CC..  trans-89.6163.6174.9-63.6-79.3000111.2F117 M191 P193 V224 D228 G229 S230F117-Y226 HydrophobicContact CB-CD1 4.48Å; F117-Y226 HydrophobicContact CB-CE1 3.64Å; F117-Y226 HydrophobicContact CB-CE2 4.4Å; F117-Y226 HydrophobicContact CD1-CE2 4.46Å; F117-Y226 HydrophobicContact CD2-CE1 4.45Å; F117-Y226 AromaticContact CD2-CE2 3.73Å; F117-Y226 HydrophobicContact CD2-CE2 3.73Å; F117-Y226 AromaticContact CD2-CZ 3.55Å; F117-Y226 WeakPolarHBondContact CD2-OH 3.46Å; F117-Y226 HydrophobicContact CE2-CE2 4.05Å; F117-Y226 HydrophobicContact CG-CE1 4.08Å; F117-Y226 AromaticContact CG-CE2 3.95Å; F117-Y226 HydrophobicContact CG-CE2 3.95Å; F117-Y226 AromaticContact CG-CZ 3.61Å; M191-Y226 HydrophobicContact CE-CD1 4.24Å; M191-Y226 HydrophobicContact CE-CG 4.12Å; M191-Y226 WeakPolarHBondContact O-CD1 3.42Å; P193-Y226 HydrophobicContact CB-CD1 4.46Å; P193-Y226 HydrophobicContact CB-CE1 3.93Å; V224-Y226 HydrophobicContact CG1-CE2 4.23Å; Y226-D228 WeakPolarHBondContact CB-OD1 3.43Å; Y226-D228 PolarHBondContact O-N 2.9Å; Y226-G229 WeakPolarHBondContact O-CA 3.43Å; Y226-G229 PolarHBondContact O-N 3.2Å; Y226-S230 WeakPolarHBondContact CB-OG 3.37Å; Y226-S230 VanDerWaalsContact CD2-OG 3.26Å; Y226-S230 WeakPolarHBondContact CD2-OG 3.46Å; Y226-S230 PolarHBondContact N-O 3.24Å
227P86.6Confident88.9Confident49 Ų4933.7 Ų33.732%0.31819%0.189SC..THydrogen-bonded Turntrans-61.1-27.5-178.6-30.742.6000115D190 G229D190-P227 VanDerWaalsContact O-CG 3.32Å; D190-P227 WeakPolarHBondContact O-CG 3.45Å; P227-G229 PolarHBondContact O-N 2.95Å
228D85.5Confident88.6Confident87 Ų8735.1 Ų35.147%0.46521%0.206SC..THydrogen-bonded Turntrans-70.5-17172.366.1-16.7000113.1M191 Y226 S230 K259M191-D228 HydrophobicContact CE-CB 4.48Å; Y226-D228 WeakPolarHBondContact CB-OD1 3.43Å; Y226-D228 PolarHBondContact O-N 2.9Å; D228-S230 VanDerWaalsContact CG-OG 3.25Å; D228-S230 WeakPolarHBondContact OD1-CB 3.41Å; D228-S230 PolarHBondContact OD1-N 2.85Å; D228-S230 PolarHBondContact OD1-OG 3.14Å; D228-S230 WeakPolarHBondContact OD2-CB 3.25Å; D228-S230 PolarHBondContact OD2-OG 3.21Å; D228-K259 VanDerWaalsContact O-CE 3.26Å; D228-K259 WeakPolarHBondContact O-CE 3.31Å; D228-K259 PolarHBondContact O-NZ 3.23Å
229G83.1Confident88Confident10 Ų1037.2 Ų37.210%0.10323%0.227CC..  trans90.74.4-173.900000115.5Y226 P227 S255Y226-G229 WeakPolarHBondContact O-CA 3.43Å; Y226-G229 PolarHBondContact O-N 3.2Å; P227-G229 PolarHBondContact O-N 2.95Å; G229-S255 PolarHBondContact O-OG 3.38Å
230S87.6Confident87.3Confident35 Ų3539.4 Ų39.425%0.24524%0.242CC..  trans-63.8142.3170.6630000109Y226 D228Y226-S230 WeakPolarHBondContact CB-OG 3.37Å; Y226-S230 VanDerWaalsContact CD2-OG 3.26Å; Y226-S230 WeakPolarHBondContact CD2-OG 3.46Å; Y226-S230 PolarHBondContact N-O 3.24Å; D228-S230 VanDerWaalsContact CG-OG 3.25Å; D228-S230 WeakPolarHBondContact OD1-CB 3.41Å; D228-S230 PolarHBondContact OD1-N 2.85Å; D228-S230 PolarHBondContact OD1-OG 3.14Å; D228-S230 WeakPolarHBondContact OD2-CB 3.25Å; D228-S230 PolarHBondContact OD2-OG 3.21Å
231I86.9Confident86.8Confident73 Ų7343.3 Ų43.337%0.37427%0.274SS..EExtended strand (participates in β ladder)trans-97.9125.8178.9-59.1166.3000106.6L223 V224L223-I231 HydrophobicContact CD2-CG2 4.08Å; V224-I231 CarbonylContact O-C 3.48Å; V224-I231 WeakPolarHBondContact O-CA 3.18Å
232G84.7Confident86.1Confident24 Ų2444.2 Ų44.225%0.24728%0.28CS..EExtended strand (participates in β ladder)trans-84.7-129.3174.500000111.5V224V224-G232 PolarHBondContact O-N 2.9Å
233S86.7Confident85.8Confident30 Ų3050.6 Ų50.621%0.2131%0.31CS..EExtended strand (participates in β ladder)trans-68.8151.1176.150.20000112V224V224-S233 VanDerWaalsContact CG2-OG 3.27Å; V224-S233 WeakPolarHBondContact CG2-OG 3.41Å; V224-S233 PolarHBondContact N-O 3.4Å
234L90.1Very high85.7Confident82 Ų8257 Ų5743%0.42934%0.343SS..EExtended strand (participates in β ladder)trans-122.9123.8174.9176.9159.5000107.6L221 L223 Q236 I247L221-L234 HydrophobicContact CD1-CD1 3.95Å; L221-L234 HydrophobicContact CD1-CD2 3.54Å; L221-L234 HydrophobicContact CD1-CG 3.61Å; L221-L234 HydrophobicContact CD2-CD1 4.34Å; L221-L234 HydrophobicContact CG-CD1 4.48Å; L221-L234 HydrophobicContact CG-CG 4.3Å; L223-L234 HydrophobicContact CD2-CB 3.66Å; L223-L234 HydrophobicContact CD2-CD1 3.54Å; L223-L234 HydrophobicContact CD2-CG 3.5Å; L234-Q236 HydrophobicContact CD2-CB 4.45Å; L234-I247 HydrophobicContact CD1-CG2 4Å
235E89.3Confident85.6Confident51 Ų5163.7 Ų63.724%0.23838%0.375CS..EExtended strand (participates in β ladder)trans-118.9114.1175.1-66.7-175.9178.300108.5T108 S222T108-E235 WeakPolarHBondContact CG2-OE2 3.35Å; T108-E235 PolarHBondContact OG1-OE2 2.9Å; S222-E235 PolarHBondContact N-O 3.03Å; S222-E235 PolarHBondContact O-N 2.79Å
236Q89.5Confident85.5Confident81 Ų8164.1 Ų64.138%0.37938%0.378SS..EExtended strand (participates in β ladder)trans-96.9124173.3-177-176.7-1500108.9L221 L234 C240L221-Q236 HydrophobicContact CD1-CB 3.96Å; L221-Q236 HydrophobicContact CD1-CG 4.42Å; L234-Q236 HydrophobicContact CD2-CB 4.45Å; Q236-C240 PolarHBondContact NE2-O 3.24Å
237D87.3Confident85.6Confident45 Ų4565.6 Ų65.624%0.24139%0.385CS..EExtended strand (participates in β ladder)trans-120.1151.5175.1-79.5-24.7000109.9R104 S219 R220R104-D237 IonicContact NH1-OD2 3.43Å; R104-D237 PolarHBondContact NH1-OD2 3.46Å; S219-D237 CarbonylContact C-O 3.57Å; S219-D237 WeakPolarHBondContact CA-O 3.49Å; R220-D237 HydrophobicContact CG-CB 3.48Å; R220-D237 VanDerWaalsContact CG-CB 3.48Å; R220-D237 IonicContact CZ-OD2 3.18Å; R220-D237 PolarHBondContact N-O 3.43Å; R220-D237 IonicContact NE-OD2 2.9Å; R220-D237 PolarHBondContact NE-OD2 2.89Å; R220-D237 IonicContact NH2-OD2 3.04Å; R220-D237 PolarHBondContact NH2-OD2 3.22Å; R220-D237 PolarHBondContact O-N 2.9Å; R220-D237 VanDerWaalsContact O-O 3.1Å
238G81.9Confident86Confident46 Ų4666.3 Ų66.347%0.47439%0.389SS..EExtended strand (participates in β ladder)trans120-179.6175.800000113.2L218L218-G238 CarbonylContact O-C 3.57Å; L218-G238 WeakPolarHBondContact O-CA 3.48Å
239C73.1Confident86.3Confident130 Ų13066.7 Ų66.788%0.87839%0.387SS*.SBendtrans-95.3-11.5-170-63.30000113.6L218L218-C239 PolarHBondContact O-N 3.27Å
240C74.7Confident86.7Confident50 Ų5066.3 Ų66.334%0.33838%0.383SS..SBendtrans-100.9141.7-175-74.60000113.3L218 Q236L218-C240 HydrophobicContact CB-CB 4.19Å; L218-C240 VanDerWaalsContact CB-SG 3.6Å; Q236-C240 PolarHBondContact NE2-O 3.24Å
241S81.1Confident87Confident114 Ų11465.7 Ų65.780%0.79738%0.379SS*.PPolyproline II helixtrans-70.1127.8164.157.50000109.8
242C79.2Confident87.3Confident21 Ų2167.8 Ų67.814%0.14239%0.387CS..PPolyproline II helixtrans-94.1134.6170-71.90000109.2S219 I247S219-C242 PolarHBondContact OG-SG 3.47Å; C242-I247 HydrophobicContact CB-CD1 4Å; C242-I247 HydrophobicContact CB-CG1 3.71Å
243Q87.6Confident87.7Confident135 Ų13569.8 Ų69.863%0.63139%0.392SS*.PPolyproline II helixtrans-64.7148.1167.7-71174.8-26.400109E245 S246 I247Q243-E245 PolarHBondContact O-N 3.13Å; Q243-S246 WeakPolarHBondContact O-CB 3.17Å; Q243-S246 PolarHBondContact O-N 3.11Å; Q243-S246 VanDerWaalsContact O-N 3.07Å; Q243-I247 PolarHBondContact O-N 2.68Å; Q243-I247 VanDerWaalsContact O-N 3.15Å
244L90.4Very high88Confident133 Ų13368.4 Ų68.470%0.69638%0.382SS*.Hα-helixtrans-57.3-38.3-179.4-177.562.2000111.7S246 I247 V248L244-S246 VanDerWaalsContact C-N 3.35Å; L244-S246 PolarHBondContact O-N 2.96Å; L244-I247 PolarHBondContact O-N 3.48Å; L244-I247 VanDerWaalsContact O-N 3.11Å; L244-V248 WeakPolarHBondContact O-CG2 3.29Å; L244-V248 PolarHBondContact O-N 3.38Å
245E91.7Very high88.2Confident142 Ų14265.5 Ų65.566%0.66437%0.369SS*.Hα-helixtrans-56.4-47.8175.7-65174.5-178.200111.4Q243 I247 V248 E249Q243-E245 PolarHBondContact O-N 3.13Å; E245-I247 VanDerWaalsContact C-N 3.31Å; E245-I247 PolarHBondContact O-N 2.83Å; E245-V248 PolarHBondContact O-N 2.8Å; E245-E249 WeakPolarHBondContact O-CG 3.44Å; E245-E249 PolarHBondContact O-N 2.81Å
246S89.9Confident88.4Confident9 Ų967.5 Ų67.56%0.06338%0.38CS..Hα-helixtrans-61.2-38.6175.6-590000112.6Y205 Q243 L244 V248 E249 M250Y205-S246 WeakPolarHBondContact OH-CA 3.29Å; Y205-S246 VanDerWaalsContact OH-CB 3.24Å; Y205-S246 WeakPolarHBondContact OH-CB 3.44Å; Y205-S246 PolarHBondContact OH-OG 3.45Å; Q243-S246 WeakPolarHBondContact O-CB 3.17Å; Q243-S246 PolarHBondContact O-N 3.11Å; Q243-S246 VanDerWaalsContact O-N 3.07Å; L244-S246 VanDerWaalsContact C-N 3.35Å; L244-S246 PolarHBondContact O-N 2.96Å; S246-V248 VanDerWaalsContact C-N 3.35Å; S246-E249 PolarHBondContact O-N 3.35Å; S246-M250 WeakPolarHBondContact O-CB 3.35Å; S246-M250 WeakPolarHBondContact O-CG 3.41Å; S246-M250 PolarHBondContact O-N 3.14Å
247I91.5Very high88.6Confident31 Ų3164.3 Ų64.316%0.15937%0.366CS..Hα-helixtrans-66.3-41.2179.1-62.8171.1000110.2L221 L234 C242 Q243 L244 E245 M250 S251L221-I247 HydrophobicContact CD2-CG2 4.2Å; L234-I247 HydrophobicContact CD1-CG2 4Å; C242-I247 HydrophobicContact CB-CD1 4Å; C242-I247 HydrophobicContact CB-CG1 3.71Å; Q243-I247 PolarHBondContact O-N 2.68Å; Q243-I247 VanDerWaalsContact O-N 3.15Å; L244-I247 PolarHBondContact O-N 3.48Å; L244-I247 VanDerWaalsContact O-N 3.11Å; E245-I247 VanDerWaalsContact C-N 3.31Å; E245-I247 PolarHBondContact O-N 2.83Å; I247-M250 PolarHBondContact O-N 2.81Å; I247-S251 WeakPolarHBondContact O-CB 3.36Å; I247-S251 PolarHBondContact O-N 2.88Å; I247-S251 PolarHBondContact O-OG 3.02Å
248V93.5Very high88.8Confident64 Ų6462.2 Ų62.239%0.38836%0.355SS..Hα-helixtrans-62.8-46.8176.2175.30000110.3L244 E245 S246 S251 Q252L244-V248 WeakPolarHBondContact O-CG2 3.29Å; L244-V248 PolarHBondContact O-N 3.38Å; E245-V248 PolarHBondContact O-N 2.8Å; S246-V248 VanDerWaalsContact C-N 3.35Å; V248-S251 WeakPolarHBondContact CA-OG 3.27Å; V248-S251 PolarHBondContact O-N 3.28Å; V248-S251 PolarHBondContact O-OG 2.76Å; V248-Q252 WeakPolarHBondContact O-CG 3.38Å; V248-Q252 PolarHBondContact O-N 2.9Å
249E92Very high89.3Confident94 Ų9464.8 Ų64.844%0.43935%0.353SS..Hα-helixtrans-59.4-48.1176-70.4174.116700112.2Y205 E245 S246 S251 Q252 L253Y205-E249 HydrophobicContact CE2-CB 3.89Å; Y205-E249 WeakPolarHBondContact CE2-OE2 3.3Å; Y205-E249 PolarHBondContact OH-OE2 3.29Å; E245-E249 WeakPolarHBondContact O-CG 3.44Å; E245-E249 PolarHBondContact O-N 2.81Å; S246-E249 PolarHBondContact O-N 3.35Å; E249-S251 VanDerWaalsContact C-N 3.3Å; E249-S251 PolarHBondContact O-N 3.03Å; E249-Q252 PolarHBondContact O-N 2.92Å; E249-L253 WeakPolarHBondContact O-CG 3.41Å; E249-L253 PolarHBondContact O-N 2.93Å
250M92.2Very high90.3Very high2 Ų265.5 Ų65.51%0.0134%0.341CS..Hα-helixtrans-59.1-41.9176.5-71175.6-170.700111.7V198 K200 Y205 L221 S246 I247 L253 A254V198-M250 HydrophobicContact CB-CB 4.32Å; V198-M250 HydrophobicContact CB-CG 4.41Å; V198-M250 HydrophobicContact CG1-CB 4.06Å; V198-M250 HydrophobicContact CG1-CG 3.79Å; V198-M250 HydrophobicContact CG1-SD 4.42Å; K200-M250 HydrophobicContact CB-CE 3.67Å; K200-M250 HydrophobicContact CD-CE 3.72Å; K200-M250 HydrophobicContact CG-CE 3.87Å; Y205-M250 HydrophobicContact CD1-CE 3.43Å; Y205-M250 VanDerWaalsContact CD1-CE 3.43Å; Y205-M250 HydrophobicContact CD1-CG 3.78Å; Y205-M250 HydrophobicContact CD1-SD 4.44Å; Y205-M250 HydrophobicContact CE1-CE 3.29Å; Y205-M250 HydrophobicContact CE1-CG 3.96Å; Y205-M250 HydrophobicContact CE1-SD 4.49Å; Y205-M250 HydrophobicContact CG-CG 4.1Å; L221-M250 HydrophobicContact CB-SD 3.99Å; L221-M250 HydrophobicContact CD2-CB 3.68Å; L221-M250 HydrophobicContact CD2-CG 4.5Å; L221-M250 HydrophobicContact CD2-SD 3.95Å; S246-M250 WeakPolarHBondContact O-CB 3.35Å; S246-M250 WeakPolarHBondContact O-CG 3.41Å; S246-M250 PolarHBondContact O-N 3.14Å; I247-M250 PolarHBondContact O-N 2.81Å; M250-L253 PolarHBondContact O-N 3.18Å; M250-A254 WeakPolarHBondContact O-CB 3.27Å; M250-A254 PolarHBondContact O-N 3.09Å
251S93.1Very high91.1Very high22 Ų2264.4 Ų64.415%0.15433%0.332CS..Hα-helixtrans-67.8-37-179.871.10000113.4I247 V248 E249 S255I247-S251 WeakPolarHBondContact O-CB 3.36Å; I247-S251 PolarHBondContact O-N 2.88Å; I247-S251 PolarHBondContact O-OG 3.02Å; V248-S251 WeakPolarHBondContact CA-OG 3.27Å; V248-S251 PolarHBondContact O-N 3.28Å; V248-S251 PolarHBondContact O-OG 2.76Å; E249-S251 VanDerWaalsContact C-N 3.3Å; E249-S251 PolarHBondContact O-N 3.03Å; S251-S255 WeakPolarHBondContact O-CB 3.38Å; S251-S255 PolarHBondContact O-N 2.96Å
252Q93.5Very high91.6Very high118 Ų11859.1 Ų59.155%0.55130%0.295SS*.Hα-helixtrans-66.5-45.4174.2-71.71761.700111.1V248 E249 A254 S255 I256V248-Q252 WeakPolarHBondContact O-CG 3.38Å; V248-Q252 PolarHBondContact O-N 2.9Å; E249-Q252 PolarHBondContact O-N 2.92Å; Q252-A254 VanDerWaalsContact C-N 3.34Å; Q252-A254 PolarHBondContact O-N 3.38Å; Q252-S255 PolarHBondContact O-N 2.8Å; Q252-I256 WeakPolarHBondContact O-CG1 3.49Å; Q252-I256 PolarHBondContact O-N 2.9Å; Q252-I256 VanDerWaalsContact O-N 3.08Å
253L92.8Very high92.2Very high66 Ų6664.5 Ų64.535%0.34632%0.317SS..Hα-helixtrans-58.6-47.1175.6-73.2174.7000111.2Y205 E249 M250 I256 V257Y205-L253 HydrophobicContact CD2-CD1 3.76Å; Y205-L253 HydrophobicContact CG-CD1 4.31Å; E249-L253 WeakPolarHBondContact O-CG 3.41Å; E249-L253 PolarHBondContact O-N 2.93Å; M250-L253 PolarHBondContact O-N 3.18Å; L253-I256 PolarHBondContact O-N 3.48Å; L253-V257 WeakPolarHBondContact O-CG2 3.42Å; L253-V257 PolarHBondContact O-N 3.3Å; L253-V257 VanDerWaalsContact O-N 3.09Å
254A93.7Very high92.5Very high0 Ų060.2 Ų60.20%031%0.305CS..Hα-helixtrans-59.9-48.5176.600000111I196 V198 L223 I225 M250 Q252 I256 V257 G258I196-A254 HydrophobicContact CB-CB 4.28Å; I196-A254 VanDerWaalsContact CD1-O 3.29Å; I196-A254 WeakPolarHBondContact CD1-O 3.42Å; I196-A254 HydrophobicContact CG2-CB 4Å; V198-A254 HydrophobicContact CG2-CB 3.93Å; L223-A254 HydrophobicContact CB-CB 4.42Å; L223-A254 HydrophobicContact CD1-CB 3.42Å; L223-A254 VanDerWaalsContact CD1-CB 3.42Å; I225-A254 HydrophobicContact CD1-CB 3.67Å; I225-A254 WeakPolarHBondContact CD1-O 3.34Å; M250-A254 WeakPolarHBondContact O-CB 3.27Å; M250-A254 PolarHBondContact O-N 3.09Å; Q252-A254 VanDerWaalsContact C-N 3.34Å; Q252-A254 PolarHBondContact O-N 3.38Å; A254-I256 VanDerWaalsContact C-N 3.31Å; A254-I256 PolarHBondContact O-N 3.08Å; A254-V257 PolarHBondContact O-N 3.22Å; A254-G258 PolarHBondContact O-N 3.23Å
255S93.6Very high92.5Very high22 Ų2254.2 Ų54.215%0.15427%0.273CS..Hα-helixtrans-57.1-42.5179.9-175.30000112.6G229 S251 Q252 G258 K259G229-S255 PolarHBondContact O-OG 3.38Å; S251-S255 WeakPolarHBondContact O-CB 3.38Å; S251-S255 PolarHBondContact O-N 2.96Å; Q252-S255 PolarHBondContact O-N 2.8Å; S255-G258 PolarHBondContact O-N 3.46Å; S255-K259 WeakPolarHBondContact O-CG 3.33Å; S255-K259 PolarHBondContact O-N 3.05Å
256I93.7Very high92.4Very high93 Ų9350.2 Ų50.248%0.47726%0.258SS..Hα-helixtrans-63.1-48.3178-66.5165000110.8Q252 L253 A254 G258 K260Q252-I256 WeakPolarHBondContact O-CG1 3.49Å; Q252-I256 PolarHBondContact O-N 2.9Å; Q252-I256 VanDerWaalsContact O-N 3.08Å; L253-I256 PolarHBondContact O-N 3.48Å; A254-I256 VanDerWaalsContact C-N 3.31Å; A254-I256 PolarHBondContact O-N 3.08Å; I256-G258 VanDerWaalsContact C-N 3.34Å; I256-K260 WeakPolarHBondContact O-CG 3.23Å; I256-K260 PolarHBondContact O-N 2.88Å
257V93.3Very high92.5Very high14 Ų1455.4 Ų55.49%0.08528%0.28CS..Hα-helixtrans-70-35.3-178.2176.30000111.2Y32 I207 L253 A254 K260 L261Y32-V257 HydrophobicContact CD2-CG1 4.13Å; Y32-V257 HydrophobicContact CE2-CG1 3.59Å; I207-V257 HydrophobicContact CD1-CB 3.97Å; I207-V257 HydrophobicContact CD1-CG1 4.18Å; I207-V257 HydrophobicContact CD1-CG2 3.6Å; I207-V257 HydrophobicContact CG2-CG1 4.44Å; L253-V257 WeakPolarHBondContact O-CG2 3.42Å; L253-V257 PolarHBondContact O-N 3.3Å; L253-V257 VanDerWaalsContact O-N 3.09Å; A254-V257 PolarHBondContact O-N 3.22Å; V257-K260 WeakPolarHBondContact O-CB 3.36Å; V257-K260 PolarHBondContact O-N 3.32Å; V257-L261 HydrophobicContact CG1-CD1 4.34Å; V257-L261 HydrophobicContact CG1-CG 4.34Å; V257-L261 PolarHBondContact O-N 3.36Å
258G92.8Very high92.4Very high0 Ų057.1 Ų57.10%029%0.292CS..Hα-helixtrans-65.4-42177.500000114.2A254 S255 I256 K260 L261 N262A254-G258 PolarHBondContact O-N 3.23Å; S255-G258 PolarHBondContact O-N 3.46Å; I256-G258 VanDerWaalsContact C-N 3.34Å; G258-K260 VanDerWaalsContact C-N 3.32Å; G258-K260 PolarHBondContact O-N 2.88Å; G258-L261 PolarHBondContact O-N 2.84Å; G258-N262 VanDerWaalsContact O-CB 3.24Å; G258-N262 WeakPolarHBondContact O-CB 3.17Å; G258-N262 PolarHBondContact O-N 2.98Å; G258-N262 PolarHBondContact O-ND2 3.44Å
259K92.8Very high92.2Very high100 Ų10054.2 Ų54.244%0.43527%0.274SS..Hα-helixtrans-59.3-45.4171.8-74.1-177.7-178.3-167.30111.4D228 S255 H263D228-K259 VanDerWaalsContact O-CE 3.26Å; D228-K259 WeakPolarHBondContact O-CE 3.31Å; D228-K259 PolarHBondContact O-NZ 3.23Å; S255-K259 WeakPolarHBondContact O-CG 3.33Å; S255-K259 PolarHBondContact O-N 3.05Å; K259-H263 WeakPolarHBondContact O-CB 3.43Å; K259-H263 PolarHBondContact O-N 3.04Å
260K93Very high92Very high145 Ų14554.3 Ų54.363%0.6328%0.275SS*.Hα-helixtrans-62.7-47.6179-71.1178-179.9-178.60111.5I256 V257 G258 H263 A264I256-K260 WeakPolarHBondContact O-CG 3.23Å; I256-K260 PolarHBondContact O-N 2.88Å; V257-K260 WeakPolarHBondContact O-CB 3.36Å; V257-K260 PolarHBondContact O-N 3.32Å; G258-K260 VanDerWaalsContact C-N 3.32Å; G258-K260 PolarHBondContact O-N 2.88Å; K260-H263 PolarHBondContact O-N 3.45Å; K260-A264 VanDerWaalsContact O-CB 3.28Å; K260-A264 WeakPolarHBondContact O-CB 3.17Å; K260-A264 PolarHBondContact O-N 3.44Å
261L92.4Very high92Very high27 Ų2758.3 Ų58.314%0.14130%0.296CS..Hα-helixtrans-63.5-44.5177.9-77.9-175.8000112.4Y32 L194 V257 G258 H263 A264 L265Y32-L261 HydrophobicContact CD2-CD1 3.94Å; Y32-L261 HydrophobicContact CD2-CD2 4.14Å; Y32-L261 HydrophobicContact CD2-CG 4.34Å; Y32-L261 HydrophobicContact CE1-CD1 4.09Å; Y32-L261 HydrophobicContact CE2-CD1 3.36Å; Y32-L261 HydrophobicContact CE2-CD2 4.4Å; Y32-L261 HydrophobicContact CE2-CG 4.15Å; Y32-L261 HydrophobicContact CG-CD2 4.42Å; Y32-L261 VanDerWaalsContact CZ-CD1 3.47Å; L194-L261 HydrophobicContact CD1-CB 4.41Å; L194-L261 HydrophobicContact CD2-CD1 4.4Å; V257-L261 HydrophobicContact CG1-CD1 4.34Å; V257-L261 HydrophobicContact CG1-CG 4.34Å; V257-L261 PolarHBondContact O-N 3.36Å; G258-L261 PolarHBondContact O-N 2.84Å; L261-H263 PolarHBondContact O-N 2.99Å; L261-A264 PolarHBondContact O-N 3.46Å; L261-L265 VanDerWaalsContact O-CB 3.32Å; L261-L265 WeakPolarHBondContact O-CB 3.42Å; L261-L265 PolarHBondContact O-N 3.18Å
262N91.8Very high91.7Very high4 Ų458.6 Ų58.62%0.02130%0.295CS..Hα-helixtrans-59.6-46.7176.9-82.5-37.7000111.4K156 L194 G258 L265 V266K156-N262 PolarHBondContact NZ-OD1 3.48Å; L194-N262 WeakPolarHBondContact CD1-OD1 3.45Å; G258-N262 VanDerWaalsContact O-CB 3.24Å; G258-N262 WeakPolarHBondContact O-CB 3.17Å; G258-N262 PolarHBondContact O-N 2.98Å; G258-N262 PolarHBondContact O-ND2 3.44Å; N262-L265 PolarHBondContact O-N 3.03Å; N262-V266 WeakPolarHBondContact O-CG2 3.41Å; N262-V266 PolarHBondContact O-N 3.26Å; N262-V266 VanDerWaalsContact O-N 3.12Å
263H91.8Very high91.3Very high134 Ų13456.2 Ų56.262%0.6228%0.28SS*.Hα-helixtrans-64.8-42.9177.4-177.365.4000112.2K259 K260 L261 V266 K267K259-H263 WeakPolarHBondContact O-CB 3.43Å; K259-H263 PolarHBondContact O-N 3.04Å; K260-H263 PolarHBondContact O-N 3.45Å; L261-H263 PolarHBondContact O-N 2.99Å; H263-V266 PolarHBondContact O-N 2.89Å; H263-K267 WeakPolarHBondContact O-CB 3.37Å; H263-K267 PolarHBondContact O-N 3.44Å
264A92.5Very high91Very high45 Ų4559 Ų5937%0.37229%0.292SS..Hα-helixtrans-61.6-44.717700000111.7K260 L261 K267 T268K260-A264 VanDerWaalsContact O-CB 3.28Å; K260-A264 WeakPolarHBondContact O-CB 3.17Å; K260-A264 PolarHBondContact O-N 3.44Å; L261-A264 PolarHBondContact O-N 3.46Å; A264-K267 PolarHBondContact O-N 3.1Å; A264-T268 WeakPolarHBondContact O-CB 3.48Å; A264-T268 PolarHBondContact O-N 3.15Å; A264-T268 PolarHBondContact O-OG1 3.43Å
265L91Very high90.8Very high6 Ų666.3 Ų66.33%0.03133%0.33CS..Hα-helixtrans-61.2-48.7178.8-178.1150.2000111.6I37 L153 K156 L160 L261 N262 K267 T268 L269I37-L265 HydrophobicContact CD1-CD1 3.97Å; I37-L265 HydrophobicContact CD1-CG 4.21Å; L153-L265 HydrophobicContact CD2-CD1 3.56Å; K156-L265 HydrophobicContact CG-CD2 4.32Å; L160-L265 HydrophobicContact CD1-CD2 3.72Å; L261-L265 VanDerWaalsContact O-CB 3.32Å; L261-L265 WeakPolarHBondContact O-CB 3.42Å; L261-L265 PolarHBondContact O-N 3.18Å; N262-L265 PolarHBondContact O-N 3.03Å; L265-K267 VanDerWaalsContact C-N 3.33Å; L265-K267 PolarHBondContact O-N 3.09Å; L265-T268 PolarHBondContact O-N 2.87Å; L265-L269 HydrophobicContact CD2-CD1 3.55Å; L265-L269 HydrophobicContact CD2-CG 4.24Å; L265-L269 HydrophobicContact CG-CD1 4.37Å; L265-L269 WeakPolarHBondContact O-CG 3.34Å; L265-L269 PolarHBondContact O-N 3.32Å
266V89.5Confident90Very high58 Ų5871.1 Ų71.135%0.35235%0.345SS..Hα-helixtrans-60.4-45.1178.9173.50000110.7N262 H263 T268 L269 E270N262-V266 WeakPolarHBondContact O-CG2 3.41Å; N262-V266 PolarHBondContact O-N 3.26Å; N262-V266 VanDerWaalsContact O-N 3.12Å; H263-V266 PolarHBondContact O-N 2.89Å; V266-T268 PolarHBondContact O-N 3.42Å; V266-L269 PolarHBondContact O-N 3.5Å; V266-E270 WeakPolarHBondContact O-CG 3.33Å; V266-E270 PolarHBondContact O-N 2.85Å
267K91.7Very high88.8Confident118 Ų11873.6 Ų73.651%0.51337%0.37SS..Hα-helixtrans-61.9-43.5177.5-173.9179.8179.9-178.40112.4H263 A264 L265 E270 L271H263-K267 WeakPolarHBondContact O-CB 3.37Å; H263-K267 PolarHBondContact O-N 3.44Å; A264-K267 PolarHBondContact O-N 3.1Å; L265-K267 VanDerWaalsContact C-N 3.33Å; L265-K267 PolarHBondContact O-N 3.09Å; K267-E270 PolarHBondContact O-N 3.02Å; K267-L271 HydrophobicContact CG-CD1 4.42Å; K267-L271 WeakPolarHBondContact O-CG 3.48Å; K267-L271 PolarHBondContact O-N 2.99Å
268T90.6Very high88.6Confident67 Ų6776.6 Ų76.641%0.41139%0.385SS..Hα-helixtrans-63.7-42.2177.9-610000111.3A264 L265 V266 E270 L271 E272A264-T268 WeakPolarHBondContact O-CB 3.48Å; A264-T268 PolarHBondContact O-N 3.15Å; A264-T268 PolarHBondContact O-OG1 3.43Å; L265-T268 PolarHBondContact O-N 2.87Å; V266-T268 PolarHBondContact O-N 3.42Å; T268-E270 VanDerWaalsContact C-N 3.35Å; T268-E270 PolarHBondContact O-N 3.05Å; T268-L271 PolarHBondContact O-N 3.3Å; T268-E272 WeakPolarHBondContact O-CB 3.2Å; T268-E272 PolarHBondContact O-N 3.38Å
269L88.5Confident88.4Confident3 Ų380.6 Ų80.62%0.01641%0.405CS..Hα-helixtrans-65.1-37.4176.2-69.2-179.6000112.3I37 T39 A157 L160 L265 V266 R273I37-L269 HydrophobicContact CG2-CD2 4.33Å; T39-L269 HydrophobicContact CG2-CD2 3.4Å; T39-L269 VanDerWaalsContact CG2-CD2 3.4Å; A157-L269 HydrophobicContact CB-CD2 4.48Å; L160-L269 HydrophobicContact CB-CD1 3.99Å; L160-L269 HydrophobicContact CD1-CD1 3.61Å; L160-L269 HydrophobicContact CG-CD1 4.47Å; L265-L269 HydrophobicContact CD2-CD1 3.55Å; L265-L269 HydrophobicContact CD2-CG 4.24Å; L265-L269 HydrophobicContact CG-CD1 4.37Å; L265-L269 WeakPolarHBondContact O-CG 3.34Å; L265-L269 PolarHBondContact O-N 3.32Å; V266-L269 PolarHBondContact O-N 3.5Å; L269-R273 VanDerWaalsContact O-CD 3.28Å; L269-R273 WeakPolarHBondContact O-CD 3.43Å; L269-R273 WeakPolarHBondContact O-CG 3.24Å; L269-R273 PolarHBondContact O-N 3.25Å; L269-R273 VanDerWaalsContact O-N 3.09Å
270E88.4Confident88.2Confident97 Ų9779.6 Ų79.645%0.45340%0.403SS..Hα-helixtrans-63.5-43.3172.9-74.1172.8-175.500112.1V266 K267 T268 R273 Q274V266-E270 WeakPolarHBondContact O-CG 3.33Å; V266-E270 PolarHBondContact O-N 2.85Å; K267-E270 PolarHBondContact O-N 3.02Å; T268-E270 VanDerWaalsContact C-N 3.35Å; T268-E270 PolarHBondContact O-N 3.05Å; E270-R273 PolarHBondContact O-N 3.41Å; E270-Q274 WeakPolarHBondContact O-CG 3.39Å; E270-Q274 PolarHBondContact O-N 2.9Å
271L91.1Very high87.9Confident85 Ų8575.7 Ų75.745%0.44539%0.39SS..Hα-helixtrans-64.7-44.4176.3-70.9172.2000112K267 T268 R273 Q274 L275K267-L271 HydrophobicContact CG-CD1 4.42Å; K267-L271 WeakPolarHBondContact O-CG 3.48Å; K267-L271 PolarHBondContact O-N 2.99Å; T268-L271 PolarHBondContact O-N 3.3Å; L271-R273 VanDerWaalsContact C-N 3.25Å; L271-R273 PolarHBondContact O-N 3.19Å; L271-Q274 PolarHBondContact O-N 3.42Å; L271-L275 WeakPolarHBondContact O-CG 3.41Å; L271-L275 PolarHBondContact O-N 3.44Å
272E88Confident87.6Confident28 Ų2878.8 Ų78.813%0.13141%0.406CS..Hα-helixtrans-58.3-40.5176.4-171.9-170.6179.500111.2T39 T268 L275 R276T39-E272 WeakPolarHBondContact CG2-OE2 3.3Å; T39-E272 PolarHBondContact N-OE1 2.87Å; T39-E272 PolarHBondContact OG1-OE1 2.99Å; T39-E272 PolarHBondContact OG1-OE2 2.74Å; T268-E272 WeakPolarHBondContact O-CB 3.2Å; T268-E272 PolarHBondContact O-N 3.38Å; E272-L275 PolarHBondContact O-N 3.07Å; E272-R276 WeakPolarHBondContact O-CG 3.36Å; E272-R276 PolarHBondContact O-N 3.15Å; E272-R276 IonicContact OE1-CZ 3.01Å; E272-R276 IonicContact OE1-NE 3.75Å; E272-R276 IonicContact OE1-NH1 3.16Å; E272-R276 PolarHBondContact OE1-NH1 3.25Å; E272-R276 VanDerWaalsContact OE1-NH1 3.16Å; E272-R276 IonicContact OE1-NH2 2.85Å; E272-R276 PolarHBondContact OE1-NH2 2.71Å
273R83.6Confident87.3Confident68 Ų6883.7 Ų83.726%0.25743%0.431SS..Hα-helixtrans-64.4-43.8176.1-71.2162.8-168.4165.3-6.9112.2L160 L269 E270 L271 L275 R276 S277L160-R273 PolarHBondContact O-NH2 3.19Å; L269-R273 VanDerWaalsContact O-CD 3.28Å; L269-R273 WeakPolarHBondContact O-CD 3.43Å; L269-R273 WeakPolarHBondContact O-CG 3.24Å; L269-R273 PolarHBondContact O-N 3.25Å; L269-R273 VanDerWaalsContact O-N 3.09Å; E270-R273 PolarHBondContact O-N 3.41Å; L271-R273 VanDerWaalsContact C-N 3.25Å; L271-R273 PolarHBondContact O-N 3.19Å; R273-L275 PolarHBondContact O-N 3.11Å; R273-R276 PolarHBondContact O-N 3.37Å; R273-S277 PolarHBondContact O-N 2.97Å; R273-S277 PolarHBondContact O-OG 3.16Å
274Q87.8Confident87Confident126 Ų12680.1 Ų80.159%0.58942%0.418SS*.Hα-helixtrans-62.2-30.7177-71.3173.85.700112.4E270 L271 R276 S277E270-Q274 WeakPolarHBondContact O-CG 3.39Å; E270-Q274 PolarHBondContact O-N 2.9Å; L271-Q274 PolarHBondContact O-N 3.42Å; Q274-R276 VanDerWaalsContact C-N 3.33Å; Q274-S277 PolarHBondContact O-OG 3.23Å; Q274-S277 VanDerWaalsContact O-OG 3.09Å
275L88.2Confident86.6Confident152 Ų15282.8 Ų82.880%0.79642%0.421SS*.Hα-helixtrans-77.1-19.9175.8-68.1171.3000113.1L271 E272 R273L271-L275 WeakPolarHBondContact O-CG 3.41Å; L271-L275 PolarHBondContact O-N 3.44Å; E272-L275 PolarHBondContact O-N 3.07Å; R273-L275 PolarHBondContact O-N 3.11Å
276R76.7Confident86.2Confident124 Ų12489.3 Ų89.347%0.46845%0.454SS..Hα-helixtrans-92-26178.9-75177.6171.4170.9-2.8114T39 N40 E272 R273 Q274T39-R276 PolarHBondContact O-NH1 2.91Å; T39-R276 PolarHBondContact O-NH2 3.2Å; T39-R276 PolarHBondContact OG1-NH1 2.95Å; N40-R276 PolarHBondContact ND2-NH1 2.87Å; E272-R276 WeakPolarHBondContact O-CG 3.36Å; E272-R276 PolarHBondContact O-N 3.15Å; E272-R276 IonicContact OE1-CZ 3.01Å; E272-R276 IonicContact OE1-NE 3.75Å; E272-R276 IonicContact OE1-NH1 3.16Å; E272-R276 PolarHBondContact OE1-NH1 3.25Å; E272-R276 VanDerWaalsContact OE1-NH1 3.16Å; E272-R276 IonicContact OE1-NH2 2.85Å; E272-R276 PolarHBondContact OE1-NH2 2.71Å; R273-R276 PolarHBondContact O-N 3.37Å; Q274-R276 VanDerWaalsContact C-N 3.33Å
277S70.3Confident85.9Confident145 Ų14592.1 Ų92.1100%1.01446%0.463SS*.  trans-780175.960.90000111.9R273 Q274R273-S277 PolarHBondContact O-N 2.97Å; R273-S277 PolarHBondContact O-OG 3.16Å; Q274-S277 PolarHBondContact O-OG 3.23Å; Q274-S277 VanDerWaalsContact O-OG 3.09Å

Retrieved 277 of 277 residues in 81.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).