A0A087XUA8_POEFO Loading...

Mitochondrial glycine transporter

May play a role as pro-apoptotic protein that induces caspase-dependent apoptosis. Mitochondrial glycine transporter that imports glycine into the mitochondrial matrix. Plays an important role in providing glycine for the first enzymatic step in heme biosynthesis, the condensation of glycine with succinyl-CoA to produce 5-aminolevulinate (ALA) in the miochondrial matrix. Required during erythropoiesis.

AlphaFold DB , UniProt , Accession A0A087XUA8, Species POEFO (Poecilia formosa, Amazon molly), Gene SLC25A38, Length 285 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.3Very low62.6Low220 Ų220108.1 Ų108.1100%1.08458%0.581SS**  0-16.90-141.6163.588.700113.3S4M1-S4 PolarHBondContact O-OG 2.92Å
2E47.5Very low64Low179 Ų179102.5 Ų102.584%0.83656%0.561SS**  trans-84.4-21.5-179.2-64.6-169.4135.300115.7S4E2-S4 VanDerWaalsContact C-N 3.29Å; E2-S4 PolarHBondContact O-N 3.4Å
3L51.2Low65.6Low101 Ų101100 Ų10053%0.52954%0.541SS..G310 helixtrans-74.1-17.1-179.6-12596.1000113.7L5 K11L3-L5 VanDerWaalsContact C-N 3.31Å; L3-L5 PolarHBondContact O-N 2.84Å; L3-K11 WeakPolarHBondContact O-CE 3.39Å
4S50.5Low67.1Low80 Ų8097.2 Ų97.256%0.55953%0.529SS*.G310 helixtrans-69.7-29.1-177.954.70000112.4M1 E2 K11M1-S4 PolarHBondContact O-OG 2.92Å; E2-S4 VanDerWaalsContact C-N 3.29Å; E2-S4 PolarHBondContact O-N 3.4Å; S4-K11 PolarHBondContact O-NZ 2.84Å
5L51.6Low68.3Low161 Ų16195.9 Ų95.984%0.84353%0.529SS*.G310 helixtrans-88.5-6.5-179.2-77.7158.9000114.5L3L3-L5 VanDerWaalsContact C-N 3.31Å; L3-L5 PolarHBondContact O-N 2.84Å
6A62.9Low69.4Low25 Ų2591.4 Ų91.421%0.20751%0.511CS..SBendtrans-74.1143.7-17800000112.8I10 K11A6-I10 HydrophobicContact CB-CB 4.16Å; A6-I10 HydrophobicContact CB-CG2 4.08Å; A6-K11 HydrophobicContact CB-CG 4.35Å; A6-K11 WeakPolarHBondContact O-CE 3.18Å; A6-K11 PolarHBondContact O-NZ 3.24Å
7H73.4Confident70.5Confident110 Ų11086.6 Ų86.651%0.50949%0.485SS..  trans-51.3141.2174.3-166.8-88.5000110.7A9 I10 K11H7-A9 PolarHBondContact ND1-N 3.47Å; H7-A9 PolarHBondContact O-N 3.04Å; H7-I10 HydrophobicContact CB-CD1 4.21Å; H7-I10 HydrophobicContact CB-CG1 4.38Å; H7-I10 WeakPolarHBondContact O-CB 3.33Å; H7-I10 PolarHBondContact O-N 3.34Å; H7-K11 PolarHBondContact O-N 2.83Å
8P74.7Confident71.6Confident90 Ų9090.1 Ų90.158%0.58450%0.495SS*.Hα-helixtrans-52.8-31-17617.3-32.2000114.1K11 A12P8-K11 PolarHBondContact O-N 3.09Å; P8-A12 WeakPolarHBondContact O-CB 3.48Å; P8-A12 PolarHBondContact O-N 3.05Å
9A72.6Confident72.5Confident51 Ų5188.8 Ų88.842%0.42149%0.493SS..Hα-helixtrans-63.8-39174.200000113.5H7 A12 F13H7-A9 PolarHBondContact ND1-N 3.47Å; H7-A9 PolarHBondContact O-N 3.04Å; A9-A12 PolarHBondContact O-N 3.07Å; A9-F13 WeakPolarHBondContact O-CB 3.3Å; A9-F13 PolarHBondContact O-N 2.97Å
10I79.8Confident73.2Confident93 Ų9385.3 Ų85.348%0.47748%0.477SS..Hα-helixtrans-70.1-41.8179.1-62.1172.7000109.9A6 H7 A12 F13 V14A6-I10 HydrophobicContact CB-CB 4.16Å; A6-I10 HydrophobicContact CB-CG2 4.08Å; H7-I10 HydrophobicContact CB-CD1 4.21Å; H7-I10 HydrophobicContact CB-CG1 4.38Å; H7-I10 WeakPolarHBondContact O-CB 3.33Å; H7-I10 PolarHBondContact O-N 3.34Å; I10-A12 PolarHBondContact O-N 3.44Å; I10-F13 PolarHBondContact O-N 2.85Å; I10-V14 HydrophobicContact CG2-CG2 4.37Å; I10-V14 WeakPolarHBondContact O-CG2 3.01Å; I10-V14 PolarHBondContact O-N 2.94Å
11K80.9Confident74.1Confident79 Ų7982.6 Ų82.634%0.34346%0.464SS..Hα-helixtrans-58.4-49.3173.9-67.7174.8176.5165.50110.9L3 S4 A6 H7 P8 F13 V14 C15L3-K11 WeakPolarHBondContact O-CE 3.39Å; S4-K11 PolarHBondContact O-NZ 2.84Å; A6-K11 HydrophobicContact CB-CG 4.35Å; A6-K11 WeakPolarHBondContact O-CE 3.18Å; A6-K11 PolarHBondContact O-NZ 3.24Å; H7-K11 PolarHBondContact O-N 2.83Å; P8-K11 PolarHBondContact O-N 3.09Å; K11-F13 VanDerWaalsContact C-N 3.32Å; K11-F13 PolarHBondContact O-N 3.4Å; K11-V14 PolarHBondContact O-N 3.28Å; K11-C15 WeakPolarHBondContact O-CB 3.31Å; K11-C15 PolarHBondContact O-N 3.49Å; K11-C15 PolarHBondContact O-SG 3.4Å
12A79.5Confident76.4Confident41 Ų4174.2 Ų74.234%0.33943%0.426SS..Hα-helixtrans-61.2-39.5177.300000112.4P8 A9 I10 G16P8-A12 WeakPolarHBondContact O-CB 3.48Å; P8-A12 PolarHBondContact O-N 3.05Å; A9-A12 PolarHBondContact O-N 3.07Å; I10-A12 PolarHBondContact O-N 3.44Å; A12-G16 WeakPolarHBondContact O-CA 3.3Å; A12-G16 PolarHBondContact O-N 3.5Å
13F85.3Confident78.4Confident70 Ų7066.3 Ų66.331%0.30739%0.39SS..Hα-helixtrans-64.5-48.9176.4172.6-102000112.7A9 I10 K11 G16 S17 I81 V84 G85A9-F13 WeakPolarHBondContact O-CB 3.3Å; A9-F13 PolarHBondContact O-N 2.97Å; I10-F13 PolarHBondContact O-N 2.85Å; K11-F13 VanDerWaalsContact C-N 3.32Å; K11-F13 PolarHBondContact O-N 3.4Å; F13-G16 PolarHBondContact O-N 2.85Å; F13-S17 WeakPolarHBondContact CE2-OG 3.44Å; F13-S17 WeakPolarHBondContact O-CB 3.36Å; F13-S17 PolarHBondContact O-N 3.23Å; F13-S17 PolarHBondContact O-OG 3.49Å; F13-I81 WeakPolarHBondContact CE2-O 3.37Å; F13-I81 HydrophobicContact CZ-CG2 4.23Å; F13-V84 HydrophobicContact CD2-CG1 4.14Å; F13-G85 VanDerWaalsContact CD2-CA 3.46Å; F13-G85 VanDerWaalsContact CE2-CA 3.47Å
14V87Confident80.3Confident61 Ų6161.8 Ų61.837%0.3737%0.367SS..Hα-helixtrans-65.5-50-179172.40000110.4I10 K11 G16 S17 F18I10-V14 HydrophobicContact CG2-CG2 4.37Å; I10-V14 WeakPolarHBondContact O-CG2 3.01Å; I10-V14 PolarHBondContact O-N 2.94Å; K11-V14 PolarHBondContact O-N 3.28Å; V14-G16 VanDerWaalsContact C-N 3.34Å; V14-G16 PolarHBondContact O-N 3.4Å; V14-S17 PolarHBondContact O-N 3.37Å; V14-F18 WeakPolarHBondContact O-CB 3.46Å; V14-F18 PolarHBondContact O-N 3.19Å
15C85.1Confident82.4Confident78 Ų7861.9 Ų61.953%0.52736%0.361SS..Hα-helixtrans-61.5-43.2177.7-66.60000111.5K11 S19K11-C15 WeakPolarHBondContact O-CB 3.31Å; K11-C15 PolarHBondContact O-N 3.49Å; K11-C15 PolarHBondContact O-SG 3.4Å; C15-S19 WeakPolarHBondContact O-CB 3.44Å; C15-S19 PolarHBondContact O-N 3.5Å
16G85.3Confident84.4Confident24 Ų2459.1 Ų59.125%0.24735%0.346CS..Hα-helixtrans-65.2-40.3177.700000113A12 F13 V14 G20A12-G16 WeakPolarHBondContact O-CA 3.3Å; A12-G16 PolarHBondContact O-N 3.5Å; F13-G16 PolarHBondContact O-N 2.85Å; V14-G16 VanDerWaalsContact C-N 3.34Å; V14-G16 PolarHBondContact O-N 3.4Å; G16-G20 WeakPolarHBondContact O-CA 3.38Å; G16-G20 PolarHBondContact O-N 3.14Å
17S88.6Confident85.9Confident10 Ų1058.1 Ų58.17%0.0734%0.337CS..Hα-helixtrans-68.6-44.5177.6-62.90000111.6F13 V14 T21F13-S17 WeakPolarHBondContact CE2-OG 3.44Å; F13-S17 WeakPolarHBondContact O-CB 3.36Å; F13-S17 PolarHBondContact O-N 3.23Å; F13-S17 PolarHBondContact O-OG 3.49Å; V14-S17 PolarHBondContact O-N 3.37Å; S17-T21 VanDerWaalsContact O-CB 3.28Å; S17-T21 WeakPolarHBondContact O-CB 3.23Å; S17-T21 PolarHBondContact O-N 3.31Å; S17-T21 PolarHBondContact O-OG1 3.17Å
18F90.1Very high86.9Confident148 Ų14852.9 Ų52.965%0.64931%0.313SS*.Hα-helixtrans-64.5-52.5177.6-175-101.8000111.3V14 G20 T21 C22V14-F18 WeakPolarHBondContact O-CB 3.46Å; V14-F18 PolarHBondContact O-N 3.19Å; F18-G20 VanDerWaalsContact C-N 3.31Å; F18-G20 PolarHBondContact O-N 3.44Å; F18-T21 PolarHBondContact O-N 3.23Å; F18-T21 VanDerWaalsContact O-N 3.15Å; F18-C22 PolarHBondContact O-N 3.05Å; F18-C22 PolarHBondContact O-SG 2.91Å
19S88.7Confident87.8Confident66 Ų6649.7 Ų49.746%0.46229%0.292SS..Hα-helixtrans-57.9-43.4176.5178.70000112C15 T21 S23C15-S19 WeakPolarHBondContact O-CB 3.44Å; C15-S19 PolarHBondContact O-N 3.5Å; S19-T21 PolarHBondContact O-N 2.89Å; S19-S23 VanDerWaalsContact O-CB 3.3Å; S19-S23 WeakPolarHBondContact O-CB 3.03Å; S19-S23 PolarHBondContact O-N 3.39Å; S19-S23 PolarHBondContact O-OG 3.23Å
20G87.3Confident88.8Confident18 Ų1848.7 Ų48.719%0.18628%0.28CS..Hα-helixtrans-63.4-38.9177.200000113G16 F18 T24G16-G20 WeakPolarHBondContact O-CA 3.38Å; G16-G20 PolarHBondContact O-N 3.14Å; F18-G20 VanDerWaalsContact C-N 3.31Å; F18-G20 PolarHBondContact O-N 3.44Å; G20-T24 VanDerWaalsContact O-CB 3.22Å; G20-T24 WeakPolarHBondContact O-CB 3.37Å; G20-T24 PolarHBondContact O-N 3.3Å; G20-T24 PolarHBondContact O-OG1 3.5Å
21T91.6Very high89.5Confident30 Ų3044.8 Ų44.818%0.18426%0.26CS..Hα-helixtrans-69.8-47.4178.1-58.60000111S17 F18 S19 S23 T24 L25 F77S17-T21 VanDerWaalsContact O-CB 3.28Å; S17-T21 WeakPolarHBondContact O-CB 3.23Å; S17-T21 PolarHBondContact O-N 3.31Å; S17-T21 PolarHBondContact O-OG1 3.17Å; F18-T21 PolarHBondContact O-N 3.23Å; F18-T21 VanDerWaalsContact O-N 3.15Å; S19-T21 PolarHBondContact O-N 2.89Å; T21-S23 PolarHBondContact O-N 3.4Å; T21-T24 WeakPolarHBondContact O-CB 3.41Å; T21-T24 PolarHBondContact O-N 3.25Å; T21-L25 PolarHBondContact O-N 2.95Å; T21-F77 HydrophobicContact CG2-CD1 3.67Å; T21-F77 HydrophobicContact CG2-CD2 4.4Å; T21-F77 HydrophobicContact CG2-CE1 3.34Å; T21-F77 HydrophobicContact CG2-CE2 4.13Å; T21-F77 HydrophobicContact CG2-CG 4.19Å; T21-F77 HydrophobicContact CG2-CZ 3.58Å
22C91.6Very high90.1Very high44 Ų4441 Ų4130%0.29724%0.244SC..Hα-helixtrans-60.2-46.2175.4-67.70000111.9F18 T24 L25 L26F18-C22 PolarHBondContact O-N 3.05Å; F18-C22 PolarHBondContact O-SG 2.91Å; C22-T24 VanDerWaalsContact C-N 3.29Å; C22-T24 PolarHBondContact O-N 3.36Å; C22-L25 PolarHBondContact O-N 3.4Å; C22-L26 WeakPolarHBondContact O-CB 3.34Å; C22-L26 PolarHBondContact O-N 3.49Å
23S89.9Confident90.8Very high12 Ų1239.2 Ų39.28%0.08423%0.228CC..Hα-helixtrans-61.5-40.3176.8-58.30000111.5S19 T21 L26 F27S19-S23 VanDerWaalsContact O-CB 3.3Å; S19-S23 WeakPolarHBondContact O-CB 3.03Å; S19-S23 PolarHBondContact O-N 3.39Å; S19-S23 PolarHBondContact O-OG 3.23Å; T21-S23 PolarHBondContact O-N 3.4Å; S23-L26 PolarHBondContact O-N 3.09Å; S23-F27 WeakPolarHBondContact O-CB 3.27Å; S23-F27 WeakPolarHBondContact O-CD2 3.28Å; S23-F27 WeakPolarHBondContact O-CG 3.48Å; S23-F27 PolarHBondContact O-N 2.91Å
24T91.1Very high91.2Very high6 Ų637 Ų374%0.03722%0.218CC..Hα-helixtrans-64.4-45.8177.2-65.40000111.2G20 T21 C22 L26 F27 Q28 F77G20-T24 VanDerWaalsContact O-CB 3.22Å; G20-T24 WeakPolarHBondContact O-CB 3.37Å; G20-T24 PolarHBondContact O-N 3.3Å; G20-T24 PolarHBondContact O-OG1 3.5Å; T21-T24 WeakPolarHBondContact O-CB 3.41Å; T21-T24 PolarHBondContact O-N 3.25Å; C22-T24 VanDerWaalsContact C-N 3.29Å; C22-T24 PolarHBondContact O-N 3.36Å; T24-L26 VanDerWaalsContact C-N 3.33Å; T24-L26 PolarHBondContact O-N 3.27Å; T24-F27 PolarHBondContact O-N 3.46Å; T24-Q28 WeakPolarHBondContact O-CA 3.36Å; T24-Q28 VanDerWaalsContact O-CB 3.3Å; T24-Q28 WeakPolarHBondContact O-CB 3.37Å; T24-Q28 PolarHBondContact O-N 3.38Å; T24-F77 HydrophobicContact CG2-CD1 4.21Å; T24-F77 HydrophobicContact CG2-CE1 4.15Å
25L93.9Very high91.5Very high83 Ų8334.3 Ų34.344%0.43520%0.202SC..Hα-helixtrans-58.1-45.7176.4175.772000111.4T21 C22 W70 I73 F77T21-L25 PolarHBondContact O-N 2.95Å; C22-L25 PolarHBondContact O-N 3.4Å; L25-W70 PolarHBondContact O-NE1 2.99Å; L25-I73 HydrophobicContact CB-CD1 4.38Å; L25-I73 HydrophobicContact CD1-CD1 3.26Å; L25-I73 HydrophobicContact CG-CD1 4.4Å; L25-F77 HydrophobicContact CB-CZ 4.42Å
26L93.6Very high91.8Very high102 Ų10232.2 Ų32.253%0.53418%0.183SC..Hα-helixtrans-68.2-39.7-177.4-173.165000112.3C22 S23 T24 M269C22-L26 WeakPolarHBondContact O-CB 3.34Å; C22-L26 PolarHBondContact O-N 3.49Å; S23-L26 PolarHBondContact O-N 3.09Å; T24-L26 VanDerWaalsContact C-N 3.33Å; T24-L26 PolarHBondContact O-N 3.27Å; L26-M269 HydrophobicContact CD2-SD 4.09Å
27F93.9Very high92Very high5 Ų531.6 Ų31.62%0.02217%0.174CC..Hα-helixtrans-104.36.5-172.9-54.1-53.8000114.5S23 T24 P29 L30 D31 R262 M265 M266 M269S23-F27 WeakPolarHBondContact O-CB 3.27Å; S23-F27 WeakPolarHBondContact O-CD2 3.28Å; S23-F27 WeakPolarHBondContact O-CG 3.48Å; S23-F27 PolarHBondContact O-N 2.91Å; T24-F27 PolarHBondContact O-N 3.46Å; F27-P29 VanDerWaalsContact C-CD 3.42Å; F27-P29 VanDerWaalsContact C-N 3.32Å; F27-L30 HydrophobicContact CD1-CD1 4.44Å; F27-L30 PolarHBondContact O-N 3.17Å; F27-L30 VanDerWaalsContact O-N 3.11Å; F27-D31 PolarHBondContact O-N 2.83Å; F27-R262 HydrophobicContact CB-CG 4.12Å; F27-M265 HydrophobicContact CD1-CB 4.18Å; F27-M265 HydrophobicContact CD1-CE 4.26Å; F27-M265 HydrophobicContact CD1-SD 4.28Å; F27-M265 HydrophobicContact CE1-CB 3.47Å; F27-M265 VanDerWaalsContact CE1-CB 3.47Å; F27-M265 HydrophobicContact CE1-CE 3.71Å; F27-M265 HydrophobicContact CE1-CG 4.36Å; F27-M265 HydrophobicContact CE1-SD 4.07Å; F27-M265 HydrophobicContact CZ-CB 3.79Å; F27-M266 HydrophobicContact CD2-CG 3.57Å; F27-M266 HydrophobicContact CE2-CB 4.33Å; F27-M266 HydrophobicContact CE2-CG 3.51Å; F27-M266 HydrophobicContact CZ-CG 4.47Å; F27-M269 HydrophobicContact CE2-SD 3.95Å; F27-M269 HydrophobicContact CZ-CB 4.4Å; F27-M269 HydrophobicContact CZ-SD 4.22Å
28Q94.4Very high92Very high0 Ų031.1 Ų31.10%017%0.171CC..Hα-helixtrans-54.2-40.1175.8-173.965.331.700113T24 L30 D31 L32 K71 S76 E135T24-Q28 WeakPolarHBondContact O-CA 3.36Å; T24-Q28 VanDerWaalsContact O-CB 3.3Å; T24-Q28 WeakPolarHBondContact O-CB 3.37Å; T24-Q28 PolarHBondContact O-N 3.38Å; Q28-L30 VanDerWaalsContact C-N 3.25Å; Q28-L30 PolarHBondContact O-N 3.33Å; Q28-D31 WeakPolarHBondContact O-CB 3.21Å; Q28-D31 PolarHBondContact O-N 3.29Å; Q28-D31 VanDerWaalsContact O-N 3.12Å; Q28-L32 PolarHBondContact O-N 2.8Å; Q28-K71 PolarHBondContact NE2-O 3.03Å; Q28-S76 PolarHBondContact OE1-OG 3.43Å; Q28-E135 PolarHBondContact NE2-OE1 3.5Å
29P94.6Very high91.9Very high23 Ų2324.4 Ų24.415%0.14914%0.142CC..Hα-helixtrans-57.1-37.1176.7-28.637.4000113.6F27 L32 V33 L69 W70F27-P29 VanDerWaalsContact C-CD 3.42Å; F27-P29 VanDerWaalsContact C-N 3.32Å; P29-L32 PolarHBondContact O-N 3.47Å; P29-V33 WeakPolarHBondContact O-CB 3.37Å; P29-V33 VanDerWaalsContact O-CG2 3.27Å; P29-V33 WeakPolarHBondContact O-CG2 3.49Å; P29-V33 PolarHBondContact O-N 3.5Å; P29-L69 WeakPolarHBondContact CA-O 3.34Å; P29-L69 HydrophobicContact CB-CB 4Å; P29-L69 HydrophobicContact CB-CD1 4.49Å; P29-L69 HydrophobicContact CG-CB 4.03Å; P29-W70 HydrophobicContact CG-CD2 4.36Å; P29-W70 HydrophobicContact CG-CH2 4.19Å; P29-W70 HydrophobicContact CG-CZ2 3.93Å; P29-W70 HydrophobicContact CG-CZ3 4.5Å
30L94Very high91.2Very high29 Ų2923 Ų2315%0.15213%0.132CC..Hα-helixtrans-71.5-37.4178-64.8177.8000112.1F27 Q28 K34 L261 R262 M265F27-L30 HydrophobicContact CD1-CD1 4.44Å; F27-L30 PolarHBondContact O-N 3.17Å; F27-L30 VanDerWaalsContact O-N 3.11Å; Q28-L30 VanDerWaalsContact C-N 3.25Å; Q28-L30 PolarHBondContact O-N 3.33Å; L30-K34 WeakPolarHBondContact O-CB 3.29Å; L30-K34 PolarHBondContact O-N 2.9Å; L30-L261 HydrophobicContact CD1-CD2 4.35Å; L30-L261 HydrophobicContact CD1-CG 4.12Å; L30-L261 HydrophobicContact CD2-CD2 3.83Å; L30-L261 HydrophobicContact CD2-CG 4.46Å; L30-R262 HydrophobicContact CB-CB 4.25Å; L30-R262 HydrophobicContact CD1-CB 3.88Å; L30-M265 HydrophobicContact CD1-SD 3.74Å
31D93.1Very high89.9Confident12 Ų1222.2 Ų22.26%0.06412%0.124CC..Hα-helixtrans-61.8-45.9173.4-85.1-2.3000110.7F27 Q28 K34 T35 K131 R262F27-D31 PolarHBondContact O-N 2.83Å; Q28-D31 WeakPolarHBondContact O-CB 3.21Å; Q28-D31 PolarHBondContact O-N 3.29Å; Q28-D31 VanDerWaalsContact O-N 3.12Å; D31-K34 PolarHBondContact O-N 3.43Å; D31-T35 WeakPolarHBondContact O-CB 3.47Å; D31-T35 PolarHBondContact O-N 3.02Å; D31-T35 PolarHBondContact O-OG1 3.45Å; D31-T35 VanDerWaalsContact O-OG1 3.06Å; D31-K131 IonicContact OD2-NZ 3.32Å; D31-K131 PolarHBondContact OD2-NZ 3.14Å; D31-R262 WeakPolarHBondContact OD1-CD 3.29Å; D31-R262 IonicContact OD1-CZ 3.01Å; D31-R262 IonicContact OD1-NE 3.7Å; D31-R262 PolarHBondContact OD1-NE 3.35Å; D31-R262 IonicContact OD2-NE 2.67Å; D31-R262 IonicContact OD2-NH2 3.28Å
32L94.2Very high88.1Confident0 Ų021.7 Ų21.70%012%0.121CC..Hα-helixtrans-62-51.1178-175.7147000111.7Q28 P29 K34 T35 R36 V60 G68 K71Q28-L32 PolarHBondContact O-N 2.8Å; P29-L32 PolarHBondContact O-N 3.47Å; L32-K34 VanDerWaalsContact C-N 3.3Å; L32-K34 PolarHBondContact O-N 3.3Å; L32-T35 PolarHBondContact O-N 2.91Å; L32-R36 HydrophobicContact CD2-CG 3.91Å; L32-R36 HydrophobicContact CG-CG 4.34Å; L32-R36 WeakPolarHBondContact O-CB 3.21Å; L32-R36 VanDerWaalsContact O-CG 3.24Å; L32-R36 WeakPolarHBondContact O-CG 3.31Å; L32-R36 PolarHBondContact O-N 3.24Å; L32-V60 HydrophobicContact CD2-CG1 4.18Å; L32-V60 HydrophobicContact CD2-CG2 3.82Å; L32-G68 WeakPolarHBondContact CD1-O 3.41Å; L32-K71 HydrophobicContact CD1-CB 3.73Å
33V93.6Very high86.2Confident3 Ų322.7 Ų22.72%0.01814%0.139CC..Hα-helixtrans-60.7-42-179.41700000110.9P29 L37 M53 V56 L57P29-V33 WeakPolarHBondContact O-CB 3.37Å; P29-V33 VanDerWaalsContact O-CG2 3.27Å; P29-V33 WeakPolarHBondContact O-CG2 3.49Å; P29-V33 PolarHBondContact O-N 3.5Å; V33-L37 HydrophobicContact CG1-CD1 3.87Å; V33-L37 HydrophobicContact CG1-CG 4.38Å; V33-L37 WeakPolarHBondContact O-CB 3.25Å; V33-L37 VanDerWaalsContact O-CG 3.25Å; V33-L37 WeakPolarHBondContact O-CG 3.41Å; V33-L37 PolarHBondContact O-N 3.38Å; V33-M53 HydrophobicContact CG1-CG 3.53Å; V33-V56 HydrophobicContact CG1-CG1 4.3Å; V33-V56 HydrophobicContact CG2-CG1 4.48Å; V33-L57 HydrophobicContact CG2-CB 4.34Å; V33-L57 HydrophobicContact CG2-CD1 4.33Å
34K94.1Very high84.2Confident22 Ų2225.1 Ų25.110%0.09615%0.149CC..Hα-helixtrans-58.6-53.1174.1178.8-161.2167.2-160.90111.3L30 D31 L32 R36 L37 Q38 D222 P258 R259L30-K34 WeakPolarHBondContact O-CB 3.29Å; L30-K34 PolarHBondContact O-N 2.9Å; D31-K34 PolarHBondContact O-N 3.43Å; L32-K34 VanDerWaalsContact C-N 3.3Å; L32-K34 PolarHBondContact O-N 3.3Å; K34-R36 VanDerWaalsContact C-N 3.34Å; K34-R36 PolarHBondContact O-N 2.91Å; K34-L37 PolarHBondContact O-N 2.91Å; K34-Q38 VanDerWaalsContact CE-NE2 3.33Å; K34-Q38 WeakPolarHBondContact O-CG 3.25Å; K34-Q38 PolarHBondContact O-N 3.22Å; K34-D222 WeakPolarHBondContact CE-OD2 3.46Å; K34-D222 IonicContact NZ-OD1 2.88Å; K34-D222 PolarHBondContact NZ-OD1 2.8Å; K34-D222 IonicContact NZ-OD2 2.88Å; K34-D222 PolarHBondContact NZ-OD2 2.81Å; K34-P258 HydrophobicContact CB-CB 4.07Å; K34-P258 HydrophobicContact CB-CG 3.8Å; K34-P258 HydrophobicContact CG-CG 4.27Å; K34-R259 HydrophobicContact CD-CB 4.21Å
35T92.3Very high82.3Confident5 Ų532.9 Ų32.93%0.03119%0.186CC..Hα-helixtrans-60.2-45.8-178-62.90000110.3D31 L32 L37 Q38 T39 E135 C136 T226D31-T35 WeakPolarHBondContact O-CB 3.47Å; D31-T35 PolarHBondContact O-N 3.02Å; D31-T35 PolarHBondContact O-OG1 3.45Å; D31-T35 VanDerWaalsContact O-OG1 3.06Å; L32-T35 PolarHBondContact O-N 2.91Å; T35-L37 PolarHBondContact O-N 3.42Å; T35-Q38 PolarHBondContact O-N 3.11Å; T35-T39 HydrophobicContact CG2-CG2 4.09Å; T35-T39 WeakPolarHBondContact O-CB 3.27Å; T35-T39 WeakPolarHBondContact O-CG2 3.34Å; T35-T39 PolarHBondContact O-N 3.45Å; T35-T39 PolarHBondContact O-OG1 2.98Å; T35-T39 VanDerWaalsContact O-OG1 3.07Å; T35-E135 HydrophobicContact CG2-CB 3.71Å; T35-E135 PolarHBondContact OG1-OE2 2.93Å; T35-C136 HydrophobicContact CG2-CB 4.17Å; T35-T226 HydrophobicContact CG2-CG2 4.1Å
36R91.3Very high80.2Confident34 Ų3434.7 Ų34.713%0.12820%0.202CC..Hα-helixtrans-61-43.8176.6-66.5-73.3-179.4145.220.7112.6L32 K34 Q38 T39 S40 V56 E64 E135 C136L32-R36 HydrophobicContact CD2-CG 3.91Å; L32-R36 HydrophobicContact CG-CG 4.34Å; L32-R36 WeakPolarHBondContact O-CB 3.21Å; L32-R36 VanDerWaalsContact O-CG 3.24Å; L32-R36 WeakPolarHBondContact O-CG 3.31Å; L32-R36 PolarHBondContact O-N 3.24Å; K34-R36 VanDerWaalsContact C-N 3.34Å; K34-R36 PolarHBondContact O-N 2.91Å; R36-Q38 VanDerWaalsContact C-N 3.28Å; R36-Q38 PolarHBondContact O-N 3.19Å; R36-T39 PolarHBondContact O-N 3.43Å; R36-T39 PolarHBondContact O-OG1 3.47Å; R36-S40 VanDerWaalsContact O-CB 3.24Å; R36-S40 WeakPolarHBondContact O-CB 3.21Å; R36-S40 PolarHBondContact O-N 3.29Å; R36-S40 PolarHBondContact O-OG 3.19Å; R36-V56 HydrophobicContact CB-CG1 3.59Å; R36-V56 HydrophobicContact CG-CG1 4.3Å; R36-E64 IonicContact CZ-OE1 3.47Å; R36-E64 IonicContact NH1-OE1 2.87Å; R36-E64 IonicContact NH2-OE1 3.72Å; R36-E64 PolarHBondContact NH2-OE1 2.88Å; R36-E64 IonicContact NH2-OE2 3.79Å; R36-E135 WeakPolarHBondContact CD-O 3.18Å; R36-E135 WeakPolarHBondContact CG-O 3.31Å; R36-E135 PolarHBondContact NE-O 3.4Å; R36-C136 VanDerWaalsContact CD-O 3.28Å; R36-C136 WeakPolarHBondContact CD-O 3.2Å; R36-C136 PolarHBondContact NE-O 3.16Å; R36-C136 VanDerWaalsContact NE-O 3.15Å; R36-C136 VanDerWaalsContact NH1-C 3.34Å; R36-C136 PolarHBondContact NH1-O 3.49Å
37L90.5Very high78.2Confident11 Ų1133.9 Ų33.96%0.05822%0.218CC..Hα-helixtrans-61.3-37.6176.3-78.2169000112.6V33 K34 T35 V51 M53 V56 P258V33-L37 HydrophobicContact CG1-CD1 3.87Å; V33-L37 HydrophobicContact CG1-CG 4.38Å; V33-L37 WeakPolarHBondContact O-CB 3.25Å; V33-L37 VanDerWaalsContact O-CG 3.25Å; V33-L37 WeakPolarHBondContact O-CG 3.41Å; V33-L37 PolarHBondContact O-N 3.38Å; K34-L37 PolarHBondContact O-N 2.91Å; T35-L37 PolarHBondContact O-N 3.42Å; L37-V51 WeakPolarHBondContact CD2-O 2.92Å; L37-M53 HydrophobicContact CD1-CB 4.05Å; L37-M53 HydrophobicContact CD1-CG 4.13Å; L37-V56 HydrophobicContact CD2-CB 4.38Å; L37-V56 HydrophobicContact CD2-CG2 3.47Å; L37-V56 VanDerWaalsContact CD2-CG2 3.47Å; L37-V56 HydrophobicContact CG-CB 4.45Å; L37-V56 HydrophobicContact CG-CG2 3.87Å; L37-P258 HydrophobicContact CD1-CG 4.05Å
38Q89.4Confident76.5Confident0 Ų037.1 Ų37.10%024%0.242CC..Hα-helixtrans-72.8-40.3177.5-71.1177.4-17.600111.5K34 T35 R36 D222 V223 T226 H227 R254K34-Q38 VanDerWaalsContact CE-NE2 3.33Å; K34-Q38 WeakPolarHBondContact O-CG 3.25Å; K34-Q38 PolarHBondContact O-N 3.22Å; T35-Q38 PolarHBondContact O-N 3.11Å; R36-Q38 VanDerWaalsContact C-N 3.28Å; R36-Q38 PolarHBondContact O-N 3.19Å; Q38-D222 PolarHBondContact NE2-OD2 3.1Å; Q38-V223 HydrophobicContact CG-CG2 4.23Å; Q38-T226 HydrophobicContact CB-CG2 3.84Å; Q38-T226 PolarHBondContact OE1-OG1 3.27Å; Q38-H227 PolarHBondContact O-NE2 3.38Å; Q38-R254 WeakPolarHBondContact CG-O 3.38Å; Q38-R254 PolarHBondContact NE2-O 3.25Å
39T86Confident74.7Confident8 Ų842.1 Ų42.15%0.04928%0.277CS..Hα-helixtrans-86.2-23.7-174.6610000114.2T35 R36 Q41 S42 C136 T226 V230T35-T39 HydrophobicContact CG2-CG2 4.09Å; T35-T39 WeakPolarHBondContact O-CB 3.27Å; T35-T39 WeakPolarHBondContact O-CG2 3.34Å; T35-T39 PolarHBondContact O-N 3.45Å; T35-T39 PolarHBondContact O-OG1 2.98Å; T35-T39 VanDerWaalsContact O-OG1 3.07Å; R36-T39 PolarHBondContact O-N 3.43Å; R36-T39 PolarHBondContact O-OG1 3.47Å; T39-Q41 PolarHBondContact O-N 3.3Å; T39-S42 PolarHBondContact O-N 2.85Å; T39-S42 PolarHBondContact O-OG 3.48Å; T39-C136 HydrophobicContact CG2-CB 3.8Å; T39-T226 HydrophobicContact CG2-CG2 3.5Å; T39-T226 VanDerWaalsContact CG2-CG2 3.5Å; T39-V230 HydrophobicContact CG2-CB 4.22Å; T39-V230 HydrophobicContact CG2-CG1 4.34Å; T39-V230 HydrophobicContact CG2-CG2 3.64Å
40S74.1Confident73.3Confident36 Ų3648.8 Ų48.825%0.25230%0.299SS..G310 helixtrans-55-21.5174.4-80.80000112.2R36 M44R36-S40 VanDerWaalsContact O-CB 3.24Å; R36-S40 WeakPolarHBondContact O-CB 3.21Å; R36-S40 PolarHBondContact O-N 3.29Å; R36-S40 PolarHBondContact O-OG 3.19Å; S40-M44 WeakPolarHBondContact O-CE 3.47Å
41Q61.4Low72.4Confident1 Ų149.4 Ų49.41%0.00530%0.304CS..G310 helixtrans-69-32.7174.7-69.1-178.2-32.300113.6T39 G43 H227 Y242T39-Q41 PolarHBondContact O-N 3.3Å; Q41-G43 PolarHBondContact O-N 2.89Å; Q41-G43 VanDerWaalsContact O-N 3.1Å; Q41-H227 PolarHBondContact OE1-NE2 2.97Å; Q41-Y242 PolarHBondContact O-OH 3.19Å
42S53.7Low71.9Confident20 Ų2050.3 Ų50.314%0.1432%0.316CS..G310 helixtrans-72.8-2.7-171.3-43.30000114.7T39 H227 N231T39-S42 PolarHBondContact O-N 2.85Å; T39-S42 PolarHBondContact O-OG 3.48Å; S42-H227 PolarHBondContact OG-CE1 2.92Å; S42-H227 VanDerWaalsContact OG-CE1 3.27Å; S42-H227 PolarHBondContact OG-ND1 3.21Å; S42-N231 WeakPolarHBondContact CB-ND2 3.31Å; S42-N231 PolarHBondContact OG-ND2 2.88Å
43G50.5Low71.6Confident64 Ų6453.6 Ų53.666%0.6633%0.332SS*.G310 helixtrans-133.70.2-178.900000114.9Q41Q41-G43 PolarHBondContact O-N 2.89Å; Q41-G43 VanDerWaalsContact O-N 3.1Å
44M49.5Very low71.3Confident63 Ų6358.1 Ų58.131%0.3136%0.36SS..PPolyproline II helixtrans-89.8131.1179.7-113.175.293.300110.7S40 V51S40-M44 WeakPolarHBondContact O-CE 3.47Å; M44-V51 HydrophobicContact CE-CG2 3.81Å
45Q50.2Low71Confident170 Ų17059.6 Ų59.679%0.79437%0.373SS*.PPolyproline II helixtrans-56.2145.3168.2-70.2-178.6-9.300110.4G47 S48Q45-G47 PolarHBondContact O-N 2.95Å; Q45-G47 VanDerWaalsContact O-N 3.13Å; Q45-S48 PolarHBondContact O-N 3.09Å
46P49Very low70.8Confident120 Ų12060 Ų6078%0.77938%0.376SS*.THydrogen-bonded Turntrans-55.2120.1174-17.628.6000109.6
47G52.7Low70.7Confident85 Ų8561.8 Ų61.888%0.87639%0.387SS*.THydrogen-bonded Turntrans108.1-4.5178.600000116.6Q45Q45-G47 PolarHBondContact O-N 2.95Å; Q45-G47 VanDerWaalsContact O-N 3.13Å
48S58.2Low70.7Confident74 Ų7466.9 Ų66.952%0.51741%0.414SS..  trans-67.9142.9173.6-1720000112.2Q45Q45-S48 PolarHBondContact O-N 3.09Å
49S57.4Low70.6Confident105 Ų10568.3 Ų68.373%0.73443%0.429SS*.  trans-53.7139.2-175.5-1720000112.1V51S49-V51 PolarHBondContact O-N 3.17Å; S49-V51 VanDerWaalsContact O-N 3.07Å
50R64.3Low70.7Confident163 Ų16368.3 Ų68.362%0.61543%0.429SS*.  trans-66.4111.5-175.8-59.3-177.5-168.4-173.63.7109.5G52 E250R50-G52 PolarHBondContact O-N 2.85Å; R50-E250 IonicContact CZ-OE1 2.68Å; R50-E250 IonicContact CZ-OE2 3.85Å; R50-E250 IonicContact NH1-OE1 2.66Å; R50-E250 PolarHBondContact NH1-OE1 3Å; R50-E250 IonicContact NH1-OE2 2.71Å; R50-E250 PolarHBondContact NH1-OE2 2.9Å; R50-E250 IonicContact NH2-OE2 3.76Å
51V74.7Confident71.5Confident41 Ų4169.2 Ų69.225%0.24843%0.433CS..  trans-69.5114.4176.2-171.70000109.4L37 M44 S49 S55 V56L37-V51 WeakPolarHBondContact CD2-O 2.92Å; M44-V51 HydrophobicContact CE-CG2 3.81Å; S49-V51 PolarHBondContact O-N 3.17Å; S49-V51 VanDerWaalsContact O-N 3.07Å; V51-S55 WeakPolarHBondContact CG1-OG 3.45Å; V51-V56 HydrophobicContact CG1-CG2 3.57Å
52G83.3Confident72.9Confident32 Ų3280 Ų8033%0.3347%0.473SS..  trans-79.8163.9176.700000113.1R50 T54 S55 V56R50-G52 PolarHBondContact O-N 2.85Å; G52-T54 VanDerWaalsContact C-N 3.3Å; G52-T54 PolarHBondContact O-N 3.41Å; G52-S55 PolarHBondContact N-OG 3.03Å; G52-S55 PolarHBondContact O-N 3Å; G52-S55 VanDerWaalsContact O-N 3.16Å; G52-S55 PolarHBondContact O-OG 2.91Å; G52-V56 PolarHBondContact O-N 2.91Å; G52-V56 VanDerWaalsContact O-N 3.07Å
53M86.6Confident74.6Confident69 Ų6984.1 Ų84.134%0.3450%0.498SS..Hα-helixtrans-56.5-42.8179.2-172.2178.173.100112.8V33 L37 V56 L57 V257 P258V33-M53 HydrophobicContact CG1-CG 3.53Å; L37-M53 HydrophobicContact CD1-CB 4.05Å; L37-M53 HydrophobicContact CD1-CG 4.13Å; M53-V56 PolarHBondContact O-N 2.89Å; M53-L57 PolarHBondContact O-N 3.22Å; M53-V257 HydrophobicContact CE-CG1 4.41Å; M53-V257 HydrophobicContact SD-CG1 4.08Å; M53-P258 HydrophobicContact SD-CB 4.22Å; M53-P258 HydrophobicContact SD-CG 4.47Å
54T87.3Confident76.3Confident98 Ų9883.8 Ų83.860%0.60148%0.479SS*.Hα-helixtrans-64.5-40.9178.150.20000111.7G52 V56 L57 L58G52-T54 VanDerWaalsContact C-N 3.3Å; G52-T54 PolarHBondContact O-N 3.41Å; T54-V56 PolarHBondContact O-N 3.16Å; T54-L57 PolarHBondContact O-N 3.33Å; T54-L58 WeakPolarHBondContact O-CB 3.44Å; T54-L58 VanDerWaalsContact O-CG 3.29Å; T54-L58 WeakPolarHBondContact O-CG 3.5Å; T54-L58 PolarHBondContact O-N 2.74Å
55S88Confident78.3Confident53 Ų5390.4 Ų90.437%0.37150%0.501SS..Hα-helixtrans-66.1-36176.660.70000113V51 G52 G59V51-S55 WeakPolarHBondContact CG1-OG 3.45Å; G52-S55 PolarHBondContact N-OG 3.03Å; G52-S55 PolarHBondContact O-N 3Å; G52-S55 VanDerWaalsContact O-N 3.16Å; G52-S55 PolarHBondContact O-OG 2.91Å; S55-G59 WeakPolarHBondContact O-CA 3.04Å; S55-G59 PolarHBondContact O-N 3.16Å
56V88.6Confident80.1Confident13 Ų1387.4 Ų87.48%0.07949%0.49CS..Hα-helixtrans-65.5-46.3172.5172.50000110.9V33 R36 L37 V51 G52 M53 T54 G59 V60V33-V56 HydrophobicContact CG1-CG1 4.3Å; V33-V56 HydrophobicContact CG2-CG1 4.48Å; R36-V56 HydrophobicContact CB-CG1 3.59Å; R36-V56 HydrophobicContact CG-CG1 4.3Å; L37-V56 HydrophobicContact CD2-CB 4.38Å; L37-V56 HydrophobicContact CD2-CG2 3.47Å; L37-V56 VanDerWaalsContact CD2-CG2 3.47Å; L37-V56 HydrophobicContact CG-CB 4.45Å; L37-V56 HydrophobicContact CG-CG2 3.87Å; V51-V56 HydrophobicContact CG1-CG2 3.57Å; G52-V56 PolarHBondContact O-N 2.91Å; G52-V56 VanDerWaalsContact O-N 3.07Å; M53-V56 PolarHBondContact O-N 2.89Å; T54-V56 PolarHBondContact O-N 3.16Å; V56-G59 PolarHBondContact O-N 2.89Å; V56-V60 HydrophobicContact CG1-CG2 4.38Å; V56-V60 WeakPolarHBondContact O-CG2 3.35Å; V56-V60 PolarHBondContact O-N 3.23Å
57L89.5Confident82.1Confident72 Ų7288.7 Ų88.738%0.37749%0.489SS..Hα-helixtrans-63.3-49-179.2-177.1135.5000111.7V33 M53 T54 G59 V60 V61V33-L57 HydrophobicContact CG2-CB 4.34Å; V33-L57 HydrophobicContact CG2-CD1 4.33Å; M53-L57 PolarHBondContact O-N 3.22Å; T54-L57 PolarHBondContact O-N 3.33Å; L57-G59 VanDerWaalsContact C-N 3.32Å; L57-G59 PolarHBondContact O-N 3.37Å; L57-V60 PolarHBondContact O-N 3.49Å; L57-V61 WeakPolarHBondContact O-CG2 3.27Å; L57-V61 PolarHBondContact O-N 3.5Å
58L89.7Confident83.8Confident118 Ų11885 Ų8562%0.61845%0.451SS*.Hα-helixtrans-62.8-39.6175.8-71.3168.3000111.6T54 V61 R62T54-L58 WeakPolarHBondContact O-CB 3.44Å; T54-L58 VanDerWaalsContact O-CG 3.29Å; T54-L58 WeakPolarHBondContact O-CG 3.5Å; T54-L58 PolarHBondContact O-N 2.74Å; L58-V61 PolarHBondContact O-N 3.43Å; L58-R62 VanDerWaalsContact O-CB 3.27Å; L58-R62 WeakPolarHBondContact O-CB 3.35Å; L58-R62 PolarHBondContact O-N 2.82Å
59G87.6Confident85.3Confident30 Ų3082.1 Ų82.131%0.30943%0.43SS..Hα-helixtrans-57.3-52174.800000111.7S55 V56 L57 V61 R62 T63S55-G59 WeakPolarHBondContact O-CA 3.04Å; S55-G59 PolarHBondContact O-N 3.16Å; V56-G59 PolarHBondContact O-N 2.89Å; L57-G59 VanDerWaalsContact C-N 3.32Å; L57-G59 PolarHBondContact O-N 3.37Å; G59-V61 PolarHBondContact O-N 3.47Å; G59-R62 PolarHBondContact O-N 3.06Å; G59-T63 WeakPolarHBondContact O-CG2 3.32Å; G59-T63 PolarHBondContact O-N 3.24Å; G59-T63 PolarHBondContact O-OG1 2.89Å
60V88.6Confident87.1Confident8 Ų881.3 Ų81.35%0.04841%0.41CS..Hα-helixtrans-61.9-44.2179.6175.70000111.3L32 V56 L57 R62 T63 E64 R65 L69L32-V60 HydrophobicContact CD2-CG1 4.18Å; L32-V60 HydrophobicContact CD2-CG2 3.82Å; V56-V60 HydrophobicContact CG1-CG2 4.38Å; V56-V60 WeakPolarHBondContact O-CG2 3.35Å; V56-V60 PolarHBondContact O-N 3.23Å; L57-V60 PolarHBondContact O-N 3.49Å; V60-R62 VanDerWaalsContact C-N 3.29Å; V60-R62 PolarHBondContact O-N 3.08Å; V60-T63 PolarHBondContact O-N 3.01Å; V60-E64 HydrophobicContact CG1-CB 4.33Å; V60-E64 WeakPolarHBondContact O-CA 3.31Å; V60-E64 WeakPolarHBondContact O-CB 3.37Å; V60-E64 PolarHBondContact O-N 3.35Å; V60-R65 PolarHBondContact O-N 2.9Å; V60-L69 HydrophobicContact CB-CD2 4.32Å; V60-L69 HydrophobicContact CG1-CD2 3.94Å; V60-L69 HydrophobicContact CG1-CG 4.42Å
61V91.7Very high88.3Confident55 Ų5576.2 Ų76.233%0.33339%0.393SS..Hα-helixtrans-63.4-37.2178.2172.60000111.3L57 L58 G59 R65 L69L57-V61 WeakPolarHBondContact O-CG2 3.27Å; L57-V61 PolarHBondContact O-N 3.5Å; L58-V61 PolarHBondContact O-N 3.43Å; G59-V61 PolarHBondContact O-N 3.47Å; V61-R65 WeakPolarHBondContact O-CA 3.43Å; V61-R65 PolarHBondContact O-N 2.99Å; V61-L69 HydrophobicContact CG2-CD1 4.21Å; V61-L69 HydrophobicContact CG2-CG 4.48Å
62R90.8Very high89.1Confident226 Ų22674.4 Ų74.485%0.85338%0.383SS*.Hα-helixtrans-73.5-38.4178.9-171175.2179.8171.40.5112.9L58 G59 V60L58-R62 VanDerWaalsContact O-CB 3.27Å; L58-R62 WeakPolarHBondContact O-CB 3.35Å; L58-R62 PolarHBondContact O-N 2.82Å; G59-R62 PolarHBondContact O-N 3.06Å; V60-R62 VanDerWaalsContact C-N 3.29Å; V60-R62 PolarHBondContact O-N 3.08Å
63T88.6Confident89.5Confident108 Ų10874.9 Ų74.966%0.66338%0.377SS*.Hα-helixtrans-92.6-40.9-175.158.40000113.8G59 V60G59-T63 WeakPolarHBondContact O-CG2 3.32Å; G59-T63 PolarHBondContact O-N 3.24Å; G59-T63 PolarHBondContact O-OG1 2.89Å; V60-T63 PolarHBondContact O-N 3.01Å
64E86.6Confident89.9Confident57 Ų5774.2 Ų74.227%0.26638%0.379SS..Hα-helixtrans-110.64.1-172.7-59.7-172.2-123.800112.7R36 V60 G68 K71R36-E64 IonicContact CZ-OE1 3.47Å; R36-E64 IonicContact NH1-OE1 2.87Å; R36-E64 IonicContact NH2-OE1 3.72Å; R36-E64 PolarHBondContact NH2-OE1 2.88Å; R36-E64 IonicContact NH2-OE2 3.79Å; V60-E64 HydrophobicContact CG1-CB 4.33Å; V60-E64 WeakPolarHBondContact O-CA 3.31Å; V60-E64 WeakPolarHBondContact O-CB 3.37Å; V60-E64 PolarHBondContact O-N 3.35Å; E64-G68 PolarHBondContact O-N 3.45Å; E64-K71 VanDerWaalsContact OE2-CD 3.26Å; E64-K71 WeakPolarHBondContact OE2-CD 3.32Å; E64-K71 IonicContact OE2-NZ 2.68Å; E64-K71 PolarHBondContact OE2-NZ 3.5Å
65R90.9Very high90.2Very high201 Ų20169.5 Ų69.576%0.75835%0.35SS*.THydrogen-bonded Turntrans62.9176.8-173.2-48.8176.381.7-174.15.5111.9V60 V61 L67 G68V60-R65 PolarHBondContact O-N 2.9Å; V61-R65 WeakPolarHBondContact O-CA 3.43Å; V61-R65 PolarHBondContact O-N 2.99Å; R65-L67 VanDerWaalsContact C-N 3.28Å; R65-L67 PolarHBondContact O-N 2.85Å; R65-G68 PolarHBondContact O-N 2.84Å
66L89Confident90.5Very high108 Ų10867 Ų6757%0.56533%0.333SS*.G310 helixtrans-58.8-38-176.9-17365.9000113G68 L69L66-G68 PolarHBondContact O-N 3.48Å; L66-L69 HydrophobicContact CD1-CD1 4Å; L66-L69 WeakPolarHBondContact O-CB 3.18Å; L66-L69 PolarHBondContact O-N 3Å
67L89.1Confident90.8Very high147 Ų14769.3 Ų69.377%0.7734%0.342SS*.G310 helixtrans-66.5-19.3177.8-65.8176.4000113.1R65 L69 W70R65-L67 VanDerWaalsContact C-N 3.28Å; R65-L67 PolarHBondContact O-N 2.85Å; L67-L69 PolarHBondContact O-N 3.47Å; L67-W70 PolarHBondContact O-N 2.96Å
68G88.4Confident91Very high7 Ų768.9 Ų68.97%0.07234%0.342CS..G310 helixtrans-58.2-26.2173.800000113.4L32 E64 R65 L66 W70 K71L32-G68 WeakPolarHBondContact CD1-O 3.41Å; E64-G68 PolarHBondContact O-N 3.45Å; R65-G68 PolarHBondContact O-N 2.84Å; L66-G68 PolarHBondContact O-N 3.48Å; G68-W70 PolarHBondContact O-N 3.34Å; G68-K71 VanDerWaalsContact O-CB 3.22Å; G68-K71 WeakPolarHBondContact O-CB 3.24Å; G68-K71 PolarHBondContact O-N 2.88Å; G68-K71 VanDerWaalsContact O-N 3.15Å
69L91.4Very high91.2Very high13 Ų1366.4 Ų66.47%0.06833%0.325CS..G310 helixtrans-65.6-21.6176.5-65.8173.4000113.6P29 V60 V61 L66 L67P29-L69 WeakPolarHBondContact CA-O 3.34Å; P29-L69 HydrophobicContact CB-CB 4Å; P29-L69 HydrophobicContact CB-CD1 4.49Å; P29-L69 HydrophobicContact CG-CB 4.03Å; V60-L69 HydrophobicContact CB-CD2 4.32Å; V60-L69 HydrophobicContact CG1-CD2 3.94Å; V60-L69 HydrophobicContact CG1-CG 4.42Å; V61-L69 HydrophobicContact CG2-CD1 4.21Å; V61-L69 HydrophobicContact CG2-CG 4.48Å; L66-L69 HydrophobicContact CD1-CD1 4Å; L66-L69 WeakPolarHBondContact O-CB 3.18Å; L66-L69 PolarHBondContact O-N 3Å; L67-L69 PolarHBondContact O-N 3.47Å
70W94.2Very high91.5Very high88 Ų8865.7 Ų65.733%0.33331%0.314SS..G310 helixtrans-94.18.2177-77.6-91.7000113.5L25 P29 L67 G68 G72 I73L25-W70 PolarHBondContact O-NE1 2.99Å; P29-W70 HydrophobicContact CG-CD2 4.36Å; P29-W70 HydrophobicContact CG-CH2 4.19Å; P29-W70 HydrophobicContact CG-CZ2 3.93Å; P29-W70 HydrophobicContact CG-CZ3 4.5Å; L67-W70 PolarHBondContact O-N 2.96Å; G68-W70 PolarHBondContact O-N 3.34Å; W70-G72 PolarHBondContact O-N 3.08Å; W70-I73 WeakPolarHBondContact O-CB 3.34Å; W70-I73 WeakPolarHBondContact O-CG2 3.44Å; W70-I73 PolarHBondContact O-N 3.36Å
71K90.2Very high91.6Very high57 Ų5768.7 Ų68.725%0.24833%0.329CS..THydrogen-bonded Turntrans-60.5130.6174.6-167.6176.3-169.2168.80110.1Q28 L32 E64 G68Q28-K71 PolarHBondContact NE2-O 3.03Å; L32-K71 HydrophobicContact CD1-CB 3.73Å; E64-K71 VanDerWaalsContact OE2-CD 3.26Å; E64-K71 WeakPolarHBondContact OE2-CD 3.32Å; E64-K71 IonicContact OE2-NZ 2.68Å; E64-K71 PolarHBondContact OE2-NZ 3.5Å; G68-K71 VanDerWaalsContact O-CB 3.22Å; G68-K71 WeakPolarHBondContact O-CB 3.24Å; G68-K71 PolarHBondContact O-N 2.88Å; G68-K71 VanDerWaalsContact O-N 3.15Å
72G90.3Very high91.7Very high3 Ų368.6 Ų68.63%0.03133%0.33CS..THydrogen-bonded Turntrans96.1-0.7-172.500000114.8W70 S74 P75 S76W70-G72 PolarHBondContact O-N 3.08Å; G72-S74 VanDerWaalsContact C-N 3.33Å; G72-S74 PolarHBondContact O-N 3.02Å; G72-P75 WeakPolarHBondContact O-CD 3.41Å; G72-P75 WeakPolarHBondContact O-CG 3.17Å; G72-S76 WeakPolarHBondContact O-CB 3.39Å; G72-S76 PolarHBondContact O-N 2.98Å; G72-S76 PolarHBondContact O-OG 2.89Å
73I93.5Very high91.8Very high42 Ų4258.6 Ų58.622%0.21530%0.297CS..Hα-helixtrans-60.4-39.5178.1-165167.3000113.6L25 W70 S76 F77L25-I73 HydrophobicContact CB-CD1 4.38Å; L25-I73 HydrophobicContact CD1-CD1 3.26Å; L25-I73 HydrophobicContact CG-CD1 4.4Å; W70-I73 WeakPolarHBondContact O-CB 3.34Å; W70-I73 WeakPolarHBondContact O-CG2 3.44Å; W70-I73 PolarHBondContact O-N 3.36Å; I73-S76 WeakPolarHBondContact O-CB 3.47Å; I73-S76 PolarHBondContact O-N 3.42Å; I73-F77 HydrophobicContact CD1-CE1 4.1Å; I73-F77 HydrophobicContact CD1-CE2 4.06Å; I73-F77 HydrophobicContact CD1-CZ 3.57Å; I73-F77 HydrophobicContact CG1-CD1 4.24Å; I73-F77 HydrophobicContact CG1-CD2 4.39Å; I73-F77 HydrophobicContact CG1-CE1 3.74Å; I73-F77 HydrophobicContact CG1-CE2 3.91Å; I73-F77 HydrophobicContact CG1-CZ 3.58Å; I73-F77 PolarHBondContact O-N 2.94Å
74S93.3Very high91.9Very high54 Ų5454.8 Ų54.838%0.37827%0.273SS..Hα-helixtrans-62.6-52.5179.549.70000112.7G72 S76 F77 V78G72-S74 VanDerWaalsContact C-N 3.33Å; G72-S74 PolarHBondContact O-N 3.02Å; S74-S76 PolarHBondContact O-N 3.3Å; S74-F77 PolarHBondContact O-N 3.04Å; S74-V78 WeakPolarHBondContact O-CG2 3.47Å; S74-V78 PolarHBondContact O-N 3.18Å; S74-V78 VanDerWaalsContact O-N 3.14Å
75P94.3Very high92.1Very high0 Ų052.8 Ų52.80%027%0.268CS..Hα-helixtrans-65.8-27.1172.925.7-33.7000112.5G72 R79 I127 I130 K131 F134 V144G72-P75 WeakPolarHBondContact O-CD 3.41Å; G72-P75 WeakPolarHBondContact O-CG 3.17Å; P75-R79 VanDerWaalsContact O-CB 3.23Å; P75-R79 WeakPolarHBondContact O-CB 3.46Å; P75-R79 PolarHBondContact O-N 2.92Å; P75-I127 HydrophobicContact CB-CG2 4.41Å; P75-I127 WeakPolarHBondContact O-CG2 3.41Å; P75-I130 HydrophobicContact CB-CG2 4.25Å; P75-K131 HydrophobicContact CB-CB 4.03Å; P75-K131 HydrophobicContact CG-CB 4.25Å; P75-F134 HydrophobicContact CG-CB 4.16Å; P75-F134 HydrophobicContact CG-CD1 4.49Å; P75-F134 HydrophobicContact CG-CD2 4.16Å; P75-F134 HydrophobicContact CG-CG 4.03Å; P75-V144 HydrophobicContact CB-CG2 3.95Å; P75-V144 HydrophobicContact CG-CG2 4.4Å
76S94Very high92.2Very high0 Ų045.1 Ų45.10%024%0.241CC..Hα-helixtrans-62.8-41.6173.7-630000112.9Q28 G72 I73 S74 R79 T80 K131Q28-S76 PolarHBondContact OE1-OG 3.43Å; G72-S76 WeakPolarHBondContact O-CB 3.39Å; G72-S76 PolarHBondContact O-N 2.98Å; G72-S76 PolarHBondContact O-OG 2.89Å; I73-S76 WeakPolarHBondContact O-CB 3.47Å; I73-S76 PolarHBondContact O-N 3.42Å; S74-S76 PolarHBondContact O-N 3.3Å; S76-R79 PolarHBondContact O-N 3.26Å; S76-T80 VanDerWaalsContact O-CB 3.28Å; S76-T80 WeakPolarHBondContact O-CB 3.46Å; S76-T80 PolarHBondContact O-N 2.92Å; S76-T80 PolarHBondContact O-OG1 3.49Å; S76-K131 WeakPolarHBondContact OG-CE 3.47Å
77F94.8Very high92.4Very high61 Ų6143.1 Ų43.127%0.26823%0.227SC..Hα-helixtrans-68.9-46.9176.3-69.4-9.4000111.8T21 T24 L25 I73 S74 R79 T80 I81T21-F77 HydrophobicContact CG2-CD1 3.67Å; T21-F77 HydrophobicContact CG2-CD2 4.4Å; T21-F77 HydrophobicContact CG2-CE1 3.34Å; T21-F77 HydrophobicContact CG2-CE2 4.13Å; T21-F77 HydrophobicContact CG2-CG 4.19Å; T21-F77 HydrophobicContact CG2-CZ 3.58Å; T24-F77 HydrophobicContact CG2-CD1 4.21Å; T24-F77 HydrophobicContact CG2-CE1 4.15Å; L25-F77 HydrophobicContact CB-CZ 4.42Å; I73-F77 HydrophobicContact CD1-CE1 4.1Å; I73-F77 HydrophobicContact CD1-CE2 4.06Å; I73-F77 HydrophobicContact CD1-CZ 3.57Å; I73-F77 HydrophobicContact CG1-CD1 4.24Å; I73-F77 HydrophobicContact CG1-CD2 4.39Å; I73-F77 HydrophobicContact CG1-CE1 3.74Å; I73-F77 HydrophobicContact CG1-CE2 3.91Å; I73-F77 HydrophobicContact CG1-CZ 3.58Å; I73-F77 PolarHBondContact O-N 2.94Å; S74-F77 PolarHBondContact O-N 3.04Å; F77-R79 PolarHBondContact O-N 2.92Å; F77-T80 PolarHBondContact O-N 3.39Å; F77-T80 VanDerWaalsContact O-N 3.09Å; F77-I81 PolarHBondContact O-N 2.95Å; F77-I81 VanDerWaalsContact O-N 3.08Å
78V94.9Very high92.4Very high64 Ų6440 Ų4039%0.38821%0.207SC..Hα-helixtrans-60-28.1176.71780000111.7S74 P82 I127S74-V78 WeakPolarHBondContact O-CG2 3.47Å; S74-V78 PolarHBondContact O-N 3.18Å; S74-V78 VanDerWaalsContact O-N 3.14Å; V78-P82 WeakPolarHBondContact O-CD 3.47Å; V78-P82 VanDerWaalsContact O-CG 3.25Å; V78-P82 WeakPolarHBondContact O-CG 3.39Å; V78-I127 HydrophobicContact CB-CG2 4.11Å; V78-I127 HydrophobicContact CG1-CD1 3.98Å; V78-I127 HydrophobicContact CG1-CG1 4.2Å; V78-I127 HydrophobicContact CG1-CG2 3.95Å
79R94.1Very high92.5Very high66 Ų6643.5 Ų43.525%0.24923%0.231CC..Hα-helixtrans-80.9-41.5174.2-170-173.462.575.29.3112.7P75 S76 F77 G83 M124 I127 T128P75-R79 VanDerWaalsContact O-CB 3.23Å; P75-R79 WeakPolarHBondContact O-CB 3.46Å; P75-R79 PolarHBondContact O-N 2.92Å; S76-R79 PolarHBondContact O-N 3.26Å; F77-R79 PolarHBondContact O-N 2.92Å; R79-G83 WeakPolarHBondContact O-CA 3.28Å; R79-G83 PolarHBondContact O-N 3.47Å; R79-G83 VanDerWaalsContact O-N 3.13Å; R79-M124 HydrophobicContact CG-CB 4.43Å; R79-I127 HydrophobicContact CB-CB 4.37Å; R79-I127 HydrophobicContact CB-CG2 3.73Å; R79-I127 HydrophobicContact CG-CG2 4.47Å; R79-T128 WeakPolarHBondContact CD-OG1 3.46Å
80T92.2Very high92.6Very high15 Ų1543.8 Ų43.89%0.09223%0.234CC..Hα-helixtrans-76.5-48.2-168.2-58.60000111.6S76 F77 G83 V84S76-T80 VanDerWaalsContact O-CB 3.28Å; S76-T80 WeakPolarHBondContact O-CB 3.46Å; S76-T80 PolarHBondContact O-N 2.92Å; S76-T80 PolarHBondContact O-OG1 3.49Å; F77-T80 PolarHBondContact O-N 3.39Å; F77-T80 VanDerWaalsContact O-N 3.09Å; T80-G83 PolarHBondContact O-N 3.19Å; T80-V84 VanDerWaalsContact O-CG2 3.3Å; T80-V84 WeakPolarHBondContact O-CG2 3.47Å; T80-V84 PolarHBondContact O-N 3.3Å
81I92Very high92.4Very high70 Ų7042.8 Ų42.836%0.35923%0.23SC..Hα-helixtrans-63.4-54.8-174.8-60.6162.2000110.8F13 F77 G83 V84F13-I81 WeakPolarHBondContact CE2-O 3.37Å; F13-I81 HydrophobicContact CZ-CG2 4.23Å; F77-I81 PolarHBondContact O-N 2.95Å; F77-I81 VanDerWaalsContact O-N 3.08Å; I81-G83 VanDerWaalsContact C-N 3.33Å; I81-G83 PolarHBondContact O-N 3.43Å; I81-V84 PolarHBondContact O-N 2.85Å
82P92.9Very high92.4Very high54 Ų5444.2 Ų44.235%0.35124%0.238SC..Hα-helixtrans-69.4-32.6178.2-19.937.3000112.1V78 V84 G85 I86 M124V78-P82 WeakPolarHBondContact O-CD 3.47Å; V78-P82 VanDerWaalsContact O-CG 3.25Å; V78-P82 WeakPolarHBondContact O-CG 3.39Å; P82-V84 VanDerWaalsContact C-N 3.34Å; P82-V84 PolarHBondContact O-N 3.4Å; P82-G85 PolarHBondContact O-N 3.04Å; P82-I86 WeakPolarHBondContact O-CG1 3.39Å; P82-I86 PolarHBondContact O-N 3.31Å; P82-M124 HydrophobicContact CB-CE 3.43Å; P82-M124 VanDerWaalsContact CB-CE 3.43Å; P82-M124 HydrophobicContact CB-SD 4.19Å; P82-M124 HydrophobicContact CG-CE 4.45Å
83G92.3Very high92.4Very high15 Ų1547.5 Ų47.516%0.15526%0.26CS..Hα-helixtrans-62.5-37.5179.500000113.5R79 T80 I81 Y87R79-G83 WeakPolarHBondContact O-CA 3.28Å; R79-G83 PolarHBondContact O-N 3.47Å; R79-G83 VanDerWaalsContact O-N 3.13Å; T80-G83 PolarHBondContact O-N 3.19Å; I81-G83 VanDerWaalsContact C-N 3.33Å; I81-G83 PolarHBondContact O-N 3.43Å; G83-Y87 WeakPolarHBondContact O-CB 3.35Å; G83-Y87 PolarHBondContact O-N 3.46Å
84V91Very high92.2Very high28 Ų2847.8 Ų47.817%0.1726%0.262CS..Hα-helixtrans-63.7-44.8173.6170.60000110.6F13 T80 I81 P82 Y87 F88F13-V84 HydrophobicContact CD2-CG1 4.14Å; T80-V84 VanDerWaalsContact O-CG2 3.3Å; T80-V84 WeakPolarHBondContact O-CG2 3.47Å; T80-V84 PolarHBondContact O-N 3.3Å; I81-V84 PolarHBondContact O-N 2.85Å; P82-V84 VanDerWaalsContact C-N 3.34Å; P82-V84 PolarHBondContact O-N 3.4Å; V84-Y87 PolarHBondContact O-N 3.33Å; V84-F88 HydrophobicContact CG1-CD2 3.65Å; V84-F88 HydrophobicContact CG1-CE2 3.63Å; V84-F88 VanDerWaalsContact O-CD2 3.26Å; V84-F88 WeakPolarHBondContact O-CD2 3.35Å; V84-F88 PolarHBondContact O-N 3.42Å; V84-F88 VanDerWaalsContact O-N 3.07Å
85G90.8Very high92Very high15 Ų1549 Ų4916%0.15526%0.261CS..Hα-helixtrans-60.2-53.717800000112.1F13 P82 Y87 F88 S89F13-G85 VanDerWaalsContact CD2-CA 3.46Å; F13-G85 VanDerWaalsContact CE2-CA 3.47Å; P82-G85 PolarHBondContact O-N 3.04Å; G85-Y87 VanDerWaalsContact C-N 3.3Å; G85-Y87 PolarHBondContact O-N 2.95Å; G85-F88 PolarHBondContact O-N 3.4Å; G85-S89 WeakPolarHBondContact O-CB 3.4Å; G85-S89 PolarHBondContact O-N 3.16Å; G85-S89 PolarHBondContact O-OG 2.94Å; G85-S89 VanDerWaalsContact O-OG 3.1Å
86I93.8Very high91.7Very high40 Ų4054.2 Ų54.221%0.20529%0.285CS..Hα-helixtrans-59.1-43.2179.8-62.9176.2000110.8P82 S89 S90 V119 A120 V123 M124P82-I86 WeakPolarHBondContact O-CG1 3.39Å; P82-I86 PolarHBondContact O-N 3.31Å; I86-S89 PolarHBondContact O-N 2.75Å; I86-S90 VanDerWaalsContact O-CB 3.24Å; I86-S90 WeakPolarHBondContact O-CB 3.5Å; I86-S90 PolarHBondContact O-N 2.71Å; I86-S90 PolarHBondContact O-OG 2.71Å; I86-V119 HydrophobicContact CG2-CG1 4.2Å; I86-A120 HydrophobicContact CB-CB 4.38Å; I86-A120 HydrophobicContact CG2-CB 3.97Å; I86-V123 HydrophobicContact CD1-CB 3.94Å; I86-V123 HydrophobicContact CD1-CG1 3.53Å; I86-M124 HydrophobicContact CD1-CE 3.25Å; I86-M124 HydrophobicContact CG1-CE 4.4Å
87Y92.4Very high91.4Very high66 Ų6660.9 Ų60.926%0.25932%0.316SS..Hα-helixtrans-59.1-51.2178172-102.3000112.1G83 V84 G85 Y91 A116 R117G83-Y87 WeakPolarHBondContact O-CB 3.35Å; G83-Y87 PolarHBondContact O-N 3.46Å; V84-Y87 PolarHBondContact O-N 3.33Å; G85-Y87 VanDerWaalsContact C-N 3.3Å; G85-Y87 PolarHBondContact O-N 2.95Å; Y87-Y91 WeakPolarHBondContact O-CB 3.32Å; Y87-Y91 PolarHBondContact O-N 2.89Å; Y87-A116 HydrophobicContact CD2-CB 3.86Å; Y87-A116 HydrophobicContact CE2-CB 3.83Å; Y87-R117 HydrophobicContact CD2-CG 4.04Å; Y87-R117 HydrophobicContact CE2-CG 3.74Å
88F89.8Confident91Very high82 Ų8264.3 Ų64.336%0.3633%0.331SS..Hα-helixtrans-67.8-39.3-178.9-77.7-61.2000112.5V84 G85 Y91 H92V84-F88 HydrophobicContact CG1-CD2 3.65Å; V84-F88 HydrophobicContact CG1-CE2 3.63Å; V84-F88 VanDerWaalsContact O-CD2 3.26Å; V84-F88 WeakPolarHBondContact O-CD2 3.35Å; V84-F88 PolarHBondContact O-N 3.42Å; V84-F88 VanDerWaalsContact O-N 3.07Å; G85-F88 PolarHBondContact O-N 3.4Å; F88-Y91 PolarHBondContact O-N 2.9Å; F88-H92 WeakPolarHBondContact O-CB 3.38Å; F88-H92 PolarHBondContact O-N 2.89Å
89S90.9Very high90.4Very high80 Ų8063.2 Ų63.256%0.55932%0.321SS*.Hα-helixtrans-63-47.9175.3-65.40000111.7G85 I86 H92 S93G85-S89 WeakPolarHBondContact O-CB 3.4Å; G85-S89 PolarHBondContact O-N 3.16Å; G85-S89 PolarHBondContact O-OG 2.94Å; G85-S89 VanDerWaalsContact O-OG 3.1Å; I86-S89 PolarHBondContact O-N 2.75Å; S89-H92 PolarHBondContact O-N 3.32Å; S89-S93 VanDerWaalsContact O-CB 3.31Å; S89-S93 WeakPolarHBondContact O-CB 3.4Å; S89-S93 PolarHBondContact O-N 2.86Å
90S92.5Very high89.4Confident19 Ų1967.6 Ų67.613%0.13334%0.344CS..Hα-helixtrans-64.9-40.9176.6-62.90000111.8I86 S93 L94 V119I86-S90 VanDerWaalsContact O-CB 3.24Å; I86-S90 WeakPolarHBondContact O-CB 3.5Å; I86-S90 PolarHBondContact O-N 2.71Å; I86-S90 PolarHBondContact O-OG 2.71Å; S90-S93 PolarHBondContact O-N 3.09Å; S90-L94 VanDerWaalsContact O-CB 3.29Å; S90-L94 WeakPolarHBondContact O-CB 3.21Å; S90-L94 WeakPolarHBondContact O-CG 3.35Å; S90-L94 PolarHBondContact O-N 3.39Å; S90-V119 WeakPolarHBondContact OG-CG1 3.2Å
91Y90.4Very high88.3Confident67 Ų6774.5 Ų74.526%0.26338%0.38SS..Hα-helixtrans-61.2-46.2176-177.9-90.6000111.5Y87 F88 K95 L112 A116Y87-Y91 WeakPolarHBondContact O-CB 3.32Å; Y87-Y91 PolarHBondContact O-N 2.89Å; F88-Y91 PolarHBondContact O-N 2.9Å; Y91-K95 HydrophobicContact CE1-CD 4.3Å; Y91-K95 WeakPolarHBondContact O-CB 3.44Å; Y91-K95 PolarHBondContact O-N 3.07Å; Y91-L112 HydrophobicContact CD2-CD2 4.09Å; Y91-L112 HydrophobicContact CD2-CG 3.81Å; Y91-L112 HydrophobicContact CE1-CD2 4.24Å; Y91-L112 HydrophobicContact CE2-CB 4.4Å; Y91-L112 HydrophobicContact CE2-CD2 3.49Å; Y91-L112 VanDerWaalsContact CE2-CD2 3.49Å; Y91-L112 HydrophobicContact CE2-CG 3.58Å; Y91-A116 HydrophobicContact CD2-CB 4.42Å
92H89.4Confident87.5Confident87 Ų8775 Ų7540%0.40339%0.391SS..Hα-helixtrans-65.9-45.2179.3-166.970.5000111.8F88 S89 K95 Q96F88-H92 WeakPolarHBondContact O-CB 3.38Å; F88-H92 PolarHBondContact O-N 2.89Å; S89-H92 PolarHBondContact O-N 3.32Å; H92-K95 PolarHBondContact O-N 3.09Å; H92-Q96 VanDerWaalsContact CD2-CD 3.45Å; H92-Q96 PolarHBondContact CD2-OE1 3.32Å; H92-Q96 VanDerWaalsContact CD2-OE1 3.22Å; H92-Q96 PolarHBondContact NE2-NE2 3.42Å; H92-Q96 VanDerWaalsContact NE2-NE2 3.11Å; H92-Q96 PolarHBondContact NE2-OE1 3.27Å; H92-Q96 WeakPolarHBondContact O-CB 3.38Å; H92-Q96 WeakPolarHBondContact O-CG 3.38Å; H92-Q96 PolarHBondContact O-N 2.94Å
93S90.3Very high86.7Confident73 Ų7384 Ų8451%0.5142%0.417SS..Hα-helixtrans-61.6-47.6178.1178.40000112.1S89 S90 K95 Q96 H97S89-S93 VanDerWaalsContact O-CB 3.31Å; S89-S93 WeakPolarHBondContact O-CB 3.4Å; S89-S93 PolarHBondContact O-N 2.86Å; S90-S93 PolarHBondContact O-N 3.09Å; S93-K95 VanDerWaalsContact C-N 3.33Å; S93-K95 PolarHBondContact O-N 3.41Å; S93-Q96 PolarHBondContact O-N 3.25Å; S93-H97 WeakPolarHBondContact O-CB 3.36Å; S93-H97 PolarHBondContact O-N 3.23Å
94L90.5Very high86Confident47 Ų4784.7 Ų84.725%0.24642%0.419CS..Hα-helixtrans-63.5-39.5175.6-70.2169.9000111.3S90 H97 F98 L112 A116S90-L94 VanDerWaalsContact O-CB 3.29Å; S90-L94 WeakPolarHBondContact O-CB 3.21Å; S90-L94 WeakPolarHBondContact O-CG 3.35Å; S90-L94 PolarHBondContact O-N 3.39Å; L94-H97 PolarHBondContact O-N 2.88Å; L94-F98 HydrophobicContact CD2-CD2 4.33Å; L94-F98 HydrophobicContact CD2-CE2 3.89Å; L94-F98 VanDerWaalsContact O-CD2 3.3Å; L94-F98 WeakPolarHBondContact O-CD2 3.26Å; L94-F98 PolarHBondContact O-N 3.43Å; L94-L112 HydrophobicContact CB-CD1 3.24Å; L94-L112 HydrophobicContact CD1-CD1 4.38Å; L94-L112 HydrophobicContact CG-CD1 4.44Å; L94-A116 HydrophobicContact CD1-CB 4.36Å
95K88.8Confident85.7Confident81 Ų8185.1 Ų85.135%0.35243%0.429SS..Hα-helixtrans-64.2-46.8178.3-170.3-175.8173.3-168.60111.3Y91 H92 S93 H97 F99 L112Y91-K95 HydrophobicContact CE1-CD 4.3Å; Y91-K95 WeakPolarHBondContact O-CB 3.44Å; Y91-K95 PolarHBondContact O-N 3.07Å; H92-K95 PolarHBondContact O-N 3.09Å; S93-K95 VanDerWaalsContact C-N 3.33Å; S93-K95 PolarHBondContact O-N 3.41Å; K95-H97 VanDerWaalsContact C-N 3.32Å; K95-H97 PolarHBondContact O-N 3.41Å; K95-F99 HydrophobicContact CG-CB 4.49Å; K95-F99 CarbonylContact O-C 3.51Å; K95-F99 WeakPolarHBondContact O-CA 3.41Å; K95-F99 WeakPolarHBondContact O-CB 3.46Å; K95-F99 PolarHBondContact O-N 3.32Å; K95-L112 HydrophobicContact CB-CD1 4.29Å; K95-L112 HydrophobicContact CB-CD2 3.84Å; K95-L112 HydrophobicContact CG-CD2 4.02Å
96Q88.2Confident85.3Confident108 Ų10888.3 Ų88.351%0.50545%0.454SS..Hα-helixtrans-65.3-36.7179.2-75.3-178.4-47.900111.9H92 S93 Q100H92-Q96 VanDerWaalsContact CD2-CD 3.45Å; H92-Q96 PolarHBondContact CD2-OE1 3.32Å; H92-Q96 VanDerWaalsContact CD2-OE1 3.22Å; H92-Q96 PolarHBondContact NE2-NE2 3.42Å; H92-Q96 VanDerWaalsContact NE2-NE2 3.11Å; H92-Q96 PolarHBondContact NE2-OE1 3.27Å; H92-Q96 WeakPolarHBondContact O-CB 3.38Å; H92-Q96 WeakPolarHBondContact O-CG 3.38Å; H92-Q96 PolarHBondContact O-N 2.94Å; S93-Q96 PolarHBondContact O-N 3.25Å; Q96-Q100 WeakPolarHBondContact O-CG 3.34Å
97H88.2Confident84.8Confident141 Ų14189.8 Ų89.865%0.65347%0.473SS*.Hα-helixtrans-72.1-41.7-179.5-167.571.5000112.7S93 L94 K95S93-H97 WeakPolarHBondContact O-CB 3.36Å; S93-H97 PolarHBondContact O-N 3.23Å; L94-H97 PolarHBondContact O-N 2.88Å; K95-H97 VanDerWaalsContact C-N 3.32Å; K95-H97 PolarHBondContact O-N 3.41Å
98F85.3Confident84.6Confident132 Ų13290.7 Ų90.758%0.57948%0.479SS*.Hα-helixtrans-99.8-22.1-172.7-69.5-72.7000115L94L94-F98 HydrophobicContact CD2-CD2 4.33Å; L94-F98 HydrophobicContact CD2-CE2 3.89Å; L94-F98 VanDerWaalsContact O-CD2 3.3Å; L94-F98 WeakPolarHBondContact O-CD2 3.26Å; L94-F98 PolarHBondContact O-N 3.43Å
99F82.1Confident84.4Confident41 Ų4188.5 Ų88.518%0.1848%0.476CS..Hα-helixtrans-139.329.4-166.9-57.7-74.2000113.8K95 D101 S102 P104 Q108K95-F99 HydrophobicContact CG-CB 4.49Å; K95-F99 CarbonylContact O-C 3.51Å; K95-F99 WeakPolarHBondContact O-CA 3.41Å; K95-F99 WeakPolarHBondContact O-CB 3.46Å; K95-F99 PolarHBondContact O-N 3.32Å; F99-D101 VanDerWaalsContact C-N 3.31Å; F99-D101 PolarHBondContact O-N 3.07Å; F99-S102 PolarHBondContact O-N 2.83Å; F99-P104 HydrophobicContact CD1-CB 4.39Å; F99-P104 HydrophobicContact CG-CB 4.39Å; F99-Q108 HydrophobicContact CE1-CB 4.03Å; F99-Q108 VanDerWaalsContact CE1-CD 3.41Å; F99-Q108 HydrophobicContact CE1-CG 3.91Å; F99-Q108 HydrophobicContact CZ-CB 3.76Å; F99-Q108 HydrophobicContact CZ-CG 3.86Å
100Q73Confident84.3Confident158 Ų15887.5 Ų87.574%0.73847%0.467SS*.THydrogen-bonded Turntrans-19.9-63.4-175.1-71.7-179.6-11.500114.9Q96Q96-Q100 WeakPolarHBondContact O-CG 3.34Å
101D69.7Low84.2Confident160 Ų16093.6 Ų93.686%0.85650%0.495SS*.THydrogen-bonded Turntrans-118.3-0.8-179.2-66.9-51.9000115.3F99F99-D101 VanDerWaalsContact C-N 3.31Å; F99-D101 PolarHBondContact O-N 3.07Å
102S75.9Confident84.3Confident82 Ų8290.8 Ų90.857%0.57348%0.484SS*.SBendtrans-92.7134.2-178.5-70.20000111.6F99 P104F99-S102 PolarHBondContact O-N 2.83Å; S102-P104 VanDerWaalsContact O-CD 3.3Å; S102-P104 WeakPolarHBondContact O-CD 3.35Å
103R75.3Confident84.3Confident242 Ų24287 Ų8791%0.91347%0.468SS*.  trans-70.5115.7169.3-68.1-176.8-179.2177.71107.9G105R103-G105 PolarHBondContact O-N 3.33Å
104P78.1Confident84.4Confident30 Ų3083.9 Ų83.920%0.19545%0.448CS..  trans-63.5135.7-177.725.2-32.7000109.8F99 S102 Q108 A109F99-P104 HydrophobicContact CD1-CB 4.39Å; F99-P104 HydrophobicContact CG-CB 4.39Å; S102-P104 VanDerWaalsContact O-CD 3.3Å; S102-P104 WeakPolarHBondContact O-CD 3.35Å; P104-Q108 HydrophobicContact CB-CB 3.77Å; P104-A109 HydrophobicContact CG-CB 4.47Å
105G84.4Confident84.6Confident37 Ų3783 Ų8338%0.38145%0.45SS..  trans-62.2169171.100000111.5R103 A107 Q108 A109R103-G105 PolarHBondContact O-N 3.33Å; G105-A107 VanDerWaalsContact C-N 3.32Å; G105-A107 PolarHBondContact O-N 3.4Å; G105-Q108 PolarHBondContact O-N 3.05Å; G105-Q108 VanDerWaalsContact O-N 3.09Å; G105-A109 WeakPolarHBondContact O-CB 3.46Å; G105-A109 PolarHBondContact O-N 2.93Å
106A82.3Confident84.8Confident82 Ų8279.1 Ų79.168%0.67843%0.433SS*.Hα-helixtrans-54.9-44.3-175.900000113.3A109 V110A106-A109 PolarHBondContact O-N 3.1Å; A106-V110 WeakPolarHBondContact O-CG2 3.22Å; A106-V110 PolarHBondContact O-N 2.96Å
107A84.2Confident85.1Confident71 Ų7177 Ų7759%0.58742%0.42SS*.Hα-helixtrans-65.1-43177.400000112.5G105 A109 V110 M111G105-A107 VanDerWaalsContact C-N 3.32Å; G105-A107 PolarHBondContact O-N 3.4Å; A107-A109 VanDerWaalsContact C-N 3.35Å; A107-A109 PolarHBondContact O-N 3.06Å; A107-V110 PolarHBondContact O-N 3.33Å; A107-M111 WeakPolarHBondContact O-CG 2.9Å; A107-M111 PolarHBondContact O-N 3.07Å
108Q87.3Confident85.4Confident84 Ų8472.5 Ų72.539%0.39340%0.403SS..Hα-helixtrans-65.2-38.5177.3-69.4170.3-18.100111.5F99 P104 G105 M111 L112F99-Q108 HydrophobicContact CE1-CB 4.03Å; F99-Q108 VanDerWaalsContact CE1-CD 3.41Å; F99-Q108 HydrophobicContact CE1-CG 3.91Å; F99-Q108 HydrophobicContact CZ-CB 3.76Å; F99-Q108 HydrophobicContact CZ-CG 3.86Å; P104-Q108 HydrophobicContact CB-CB 3.77Å; G105-Q108 PolarHBondContact O-N 3.05Å; G105-Q108 VanDerWaalsContact O-N 3.09Å; Q108-M111 PolarHBondContact O-N 3.25Å; Q108-L112 WeakPolarHBondContact O-CB 3.39Å; Q108-L112 PolarHBondContact O-N 3.44Å
109A86.6Confident85.9Confident36 Ų3669.2 Ų69.230%0.29839%0.393SS..Hα-helixtrans-64.9-39175.300000112P104 G105 A106 A107 G113P104-A109 HydrophobicContact CG-CB 4.47Å; G105-A109 WeakPolarHBondContact O-CB 3.46Å; G105-A109 PolarHBondContact O-N 2.93Å; A106-A109 PolarHBondContact O-N 3.1Å; A107-A109 VanDerWaalsContact C-N 3.35Å; A107-A109 PolarHBondContact O-N 3.06Å; A109-G113 PolarHBondContact O-N 3.25Å
110V88.7Confident86.5Confident60 Ų6067.8 Ų67.836%0.36439%0.39SS..Hα-helixtrans-65.8-44.1173.8171.80000111.1A106 A107 G113 G114A106-V110 WeakPolarHBondContact O-CG2 3.22Å; A106-V110 PolarHBondContact O-N 2.96Å; A107-V110 PolarHBondContact O-N 3.33Å; V110-G113 PolarHBondContact O-N 3.18Å; V110-G114 PolarHBondContact O-N 3.4Å
111M89.8Confident87.5Confident146 Ų14660.9 Ų60.972%0.71936%0.36SS*.Hα-helixtrans-63.3-44.9176.4-71.5-179.4177.100111.9A107 Q108 G114 G115A107-M111 WeakPolarHBondContact O-CG 2.9Å; A107-M111 PolarHBondContact O-N 3.07Å; Q108-M111 PolarHBondContact O-N 3.25Å; M111-G114 PolarHBondContact O-N 2.85Å; M111-G115 PolarHBondContact O-N 3.02Å
112L91.4Very high88.7Confident9 Ų955.7 Ų55.75%0.04734%0.335CS..Hα-helixtrans-61.1-48.8177.3177.865.2000111.4Y91 L94 K95 Q108 G115 A116Y91-L112 HydrophobicContact CD2-CD2 4.09Å; Y91-L112 HydrophobicContact CD2-CG 3.81Å; Y91-L112 HydrophobicContact CE1-CD2 4.24Å; Y91-L112 HydrophobicContact CE2-CB 4.4Å; Y91-L112 HydrophobicContact CE2-CD2 3.49Å; Y91-L112 VanDerWaalsContact CE2-CD2 3.49Å; Y91-L112 HydrophobicContact CE2-CG 3.58Å; L94-L112 HydrophobicContact CB-CD1 3.24Å; L94-L112 HydrophobicContact CD1-CD1 4.38Å; L94-L112 HydrophobicContact CG-CD1 4.44Å; K95-L112 HydrophobicContact CB-CD1 4.29Å; K95-L112 HydrophobicContact CB-CD2 3.84Å; K95-L112 HydrophobicContact CG-CD2 4.02Å; Q108-L112 WeakPolarHBondContact O-CB 3.39Å; Q108-L112 PolarHBondContact O-N 3.44Å; L112-G115 PolarHBondContact O-N 3.32Å; L112-A116 WeakPolarHBondContact O-CB 3.16Å; L112-A116 PolarHBondContact O-N 2.91Å
113G90.9Very high89.7Confident7 Ų755.6 Ų55.67%0.07233%0.33CS..Hα-helixtrans-62.5-41.3175.200000112.3A109 V110 A116 R117A109-G113 PolarHBondContact O-N 3.25Å; V110-G113 PolarHBondContact O-N 3.18Å; G113-A116 PolarHBondContact O-N 3.38Å; G113-R117 WeakPolarHBondContact O-CB 3.25Å; G113-R117 WeakPolarHBondContact O-CG 3.32Å; G113-R117 PolarHBondContact O-N 3.3Å
114G92.6Very high90.6Very high8 Ų845.1 Ų45.18%0.08229%0.292CS..Hα-helixtrans-64.3-42176.600000113.2V110 M111 R117 T118V110-G114 PolarHBondContact O-N 3.4Å; M111-G114 PolarHBondContact O-N 2.85Å; G114-R117 PolarHBondContact O-N 3.5Å; G114-T118 WeakPolarHBondContact O-CB 3.37Å; G114-T118 PolarHBondContact O-N 3.47Å; G114-T118 PolarHBondContact O-OG1 3.47Å
115G93.8Very high91.4Very high27 Ų2743.7 Ų43.728%0.27828%0.283SS..Hα-helixtrans-62.5-49.7174.300000111.7M111 L112 R117 T118 V119M111-G115 PolarHBondContact O-N 3.02Å; L112-G115 PolarHBondContact O-N 3.32Å; G115-R117 VanDerWaalsContact C-N 3.3Å; G115-R117 PolarHBondContact O-N 2.97Å; G115-T118 WeakPolarHBondContact O-CB 3.18Å; G115-T118 PolarHBondContact O-N 2.9Å; G115-T118 VanDerWaalsContact O-N 3.08Å; G115-V119 PolarHBondContact O-N 3.03Å
116A93.6Very high92Very high0 Ų043 Ų430%027%0.271CS..Hα-helixtrans-59.9-39.6175.500000112.5Y87 Y91 L94 L112 G113 T118 V119 A120Y87-A116 HydrophobicContact CD2-CB 3.86Å; Y87-A116 HydrophobicContact CE2-CB 3.83Å; Y91-A116 HydrophobicContact CD2-CB 4.42Å; L94-A116 HydrophobicContact CD1-CB 4.36Å; L112-A116 WeakPolarHBondContact O-CB 3.16Å; L112-A116 PolarHBondContact O-N 2.91Å; G113-A116 PolarHBondContact O-N 3.38Å; A116-T118 VanDerWaalsContact C-N 3.32Å; A116-T118 PolarHBondContact O-N 2.84Å; A116-V119 PolarHBondContact O-N 2.89Å; A116-A120 WeakPolarHBondContact O-CB 3.43Å; A116-A120 PolarHBondContact O-N 3.49Å
117R93.4Very high92.6Very high63 Ų6340.1 Ų40.124%0.23825%0.245CC..Hα-helixtrans-65.5-34.5174.8-72-93.5-95146.7-2.5112.3Y87 G113 G114 G115 G121 D171Y87-R117 HydrophobicContact CD2-CG 4.04Å; Y87-R117 HydrophobicContact CE2-CG 3.74Å; G113-R117 WeakPolarHBondContact O-CB 3.25Å; G113-R117 WeakPolarHBondContact O-CG 3.32Å; G113-R117 PolarHBondContact O-N 3.3Å; G114-R117 PolarHBondContact O-N 3.5Å; G115-R117 VanDerWaalsContact C-N 3.3Å; G115-R117 PolarHBondContact O-N 2.97Å; R117-G121 WeakPolarHBondContact O-CA 3.44Å; R117-G121 PolarHBondContact O-N 3Å; R117-D171 VanDerWaalsContact CZ-O 3.24Å; R117-D171 PolarHBondContact NE-O 3.41Å; R117-D171 IonicContact NH1-OD1 2.81Å; R117-D171 PolarHBondContact NH2-O 3.19Å
118T95.7Very high93.1Very high47 Ų4737.5 Ų37.529%0.28822%0.221SC..Hα-helixtrans-66.1-49.1176.5-59.60000110.5G114 G115 A116 G121 V122 L168 V172G114-T118 WeakPolarHBondContact O-CB 3.37Å; G114-T118 PolarHBondContact O-N 3.47Å; G114-T118 PolarHBondContact O-OG1 3.47Å; G115-T118 WeakPolarHBondContact O-CB 3.18Å; G115-T118 PolarHBondContact O-N 2.9Å; G115-T118 VanDerWaalsContact O-N 3.08Å; A116-T118 VanDerWaalsContact C-N 3.32Å; A116-T118 PolarHBondContact O-N 2.84Å; T118-G121 PolarHBondContact O-N 2.82Å; T118-V122 HydrophobicContact CG2-CG2 4.48Å; T118-V122 VanDerWaalsContact O-CG2 3.31Å; T118-V122 WeakPolarHBondContact O-CG2 3.48Å; T118-V122 PolarHBondContact O-N 3.49Å; T118-L168 HydrophobicContact CG2-CD1 4.25Å; T118-L168 HydrophobicContact CG2-CD2 3.92Å; T118-V172 WeakPolarHBondContact OG1-CG2 3.34Å
119V95.8Very high93.5Very high63 Ų6333.5 Ų33.538%0.38220%0.202SC..Hα-helixtrans-59.7-51.9177.3178.10000110.8I86 S90 G115 A116 G121 V122 V123I86-V119 HydrophobicContact CG2-CG1 4.2Å; S90-V119 WeakPolarHBondContact OG-CG1 3.2Å; G115-V119 PolarHBondContact O-N 3.03Å; A116-V119 PolarHBondContact O-N 2.89Å; V119-G121 VanDerWaalsContact C-N 3.28Å; V119-G121 PolarHBondContact O-N 3.21Å; V119-V122 PolarHBondContact O-N 3.44Å; V119-V123 WeakPolarHBondContact O-CG2 3.22Å; V119-V123 PolarHBondContact O-N 3.44Å
120A94.3Very high93.9Very high12 Ų1231.8 Ų31.810%0.09919%0.188CC..Hα-helixtrans-59.7-40.1177.600000112.2I86 A116 M124I86-A120 HydrophobicContact CB-CB 4.38Å; I86-A120 HydrophobicContact CG2-CB 3.97Å; A116-A120 WeakPolarHBondContact O-CB 3.43Å; A116-A120 PolarHBondContact O-N 3.49Å; A120-M124 WeakPolarHBondContact O-CB 3.35Å; A120-M124 WeakPolarHBondContact O-CG 3.47Å; A120-M124 PolarHBondContact O-N 3.46Å
121G93.4Very high94.2Very high12 Ų1229.8 Ų29.812%0.12418%0.175CC..Hα-helixtrans-65.1-42.1179.100000113.3R117 T118 V119 L125R117-G121 WeakPolarHBondContact O-CA 3.44Å; R117-G121 PolarHBondContact O-N 3Å; T118-G121 PolarHBondContact O-N 2.82Å; V119-G121 VanDerWaalsContact C-N 3.28Å; V119-G121 PolarHBondContact O-N 3.21Å; G121-L125 WeakPolarHBondContact O-CA 3.31Å; G121-L125 WeakPolarHBondContact O-CB 3.34Å; G121-L125 PolarHBondContact O-N 2.87Å; G121-L125 VanDerWaalsContact O-N 3.07Å
122V95.8Very high94.4Very high52 Ų5223.2 Ų23.232%0.31514%0.143SC..Hα-helixtrans-66.8-49.7177.11710000110.6T118 V119 M124 L125 L164T118-V122 HydrophobicContact CG2-CG2 4.48Å; T118-V122 VanDerWaalsContact O-CG2 3.31Å; T118-V122 WeakPolarHBondContact O-CG2 3.48Å; T118-V122 PolarHBondContact O-N 3.49Å; V119-V122 PolarHBondContact O-N 3.44Å; V122-M124 VanDerWaalsContact C-N 3.34Å; V122-M124 PolarHBondContact O-N 3.3Å; V122-L125 WeakPolarHBondContact O-CB 3.49Å; V122-L125 PolarHBondContact O-N 3.06Å; V122-L164 HydrophobicContact CG2-CD1 3.77Å; V122-L164 HydrophobicContact CG2-CD2 4.47Å
123V96Very high94.5Very high80 Ų8022.8 Ų22.849%0.48514%0.14SC..Hα-helixtrans-66-38.3-177.8-178.40000111.5I86 V119 L125I86-V123 HydrophobicContact CD1-CB 3.94Å; I86-V123 HydrophobicContact CD1-CG1 3.53Å; V119-V123 WeakPolarHBondContact O-CG2 3.22Å; V119-V123 PolarHBondContact O-N 3.44Å; V123-L125 VanDerWaalsContact C-N 3.32Å; V123-L125 PolarHBondContact O-N 3.24Å
124M95.4Very high94.6Very high21 Ų2123 Ų2310%0.10314%0.139CC..THydrogen-bonded Turntrans-87.75.3179.2-66.9-67.1139.600113.8R79 P82 I86 A120 V122 I127 T128R79-M124 HydrophobicContact CG-CB 4.43Å; P82-M124 HydrophobicContact CB-CE 3.43Å; P82-M124 VanDerWaalsContact CB-CE 3.43Å; P82-M124 HydrophobicContact CB-SD 4.19Å; P82-M124 HydrophobicContact CG-CE 4.45Å; I86-M124 HydrophobicContact CD1-CE 3.25Å; I86-M124 HydrophobicContact CG1-CE 4.4Å; A120-M124 WeakPolarHBondContact O-CB 3.35Å; A120-M124 WeakPolarHBondContact O-CG 3.47Å; A120-M124 PolarHBondContact O-N 3.46Å; V122-M124 VanDerWaalsContact C-N 3.34Å; V122-M124 PolarHBondContact O-N 3.3Å; M124-I127 PolarHBondContact O-N 2.98Å; M124-T128 WeakPolarHBondContact O-CB 3.44Å; M124-T128 PolarHBondContact O-N 3.21Å; M124-T128 PolarHBondContact O-OG1 2.81Å
125L94.8Very high94.6Very high0 Ų022.7 Ų22.70%014%0.136CC..Hα-helixtrans-63.4-44-176.7-165.761.7000113G121 V122 V123 I127 T128 V129 F161 L164 T167G121-L125 WeakPolarHBondContact O-CA 3.31Å; G121-L125 WeakPolarHBondContact O-CB 3.34Å; G121-L125 PolarHBondContact O-N 2.87Å; G121-L125 VanDerWaalsContact O-N 3.07Å; V122-L125 WeakPolarHBondContact O-CB 3.49Å; V122-L125 PolarHBondContact O-N 3.06Å; V123-L125 VanDerWaalsContact C-N 3.32Å; V123-L125 PolarHBondContact O-N 3.24Å; L125-I127 VanDerWaalsContact C-N 3.31Å; L125-I127 PolarHBondContact O-N 3.26Å; L125-T128 CarbonylContact O-C 3.59Å; L125-T128 WeakPolarHBondContact O-CA 3.41Å; L125-T128 VanDerWaalsContact O-CB 3.29Å; L125-T128 WeakPolarHBondContact O-CB 3.44Å; L125-T128 PolarHBondContact O-N 3.33Å; L125-V129 PolarHBondContact O-N 3.49Å; L125-F161 HydrophobicContact CB-CD1 4.22Å; L125-F161 HydrophobicContact CB-CE1 4.48Å; L125-F161 HydrophobicContact CD2-CB 4.04Å; L125-F161 HydrophobicContact CD2-CD1 3.93Å; L125-F161 HydrophobicContact CD2-CG 4.37Å; L125-L164 HydrophobicContact CD2-CB 3.47Å; L125-L164 VanDerWaalsContact CD2-CB 3.47Å; L125-L164 HydrophobicContact CD2-CD1 3.67Å; L125-L164 HydrophobicContact CD2-CG 4.07Å; L125-T167 HydrophobicContact CD1-CG2 4.19Å
126P95.5Very high94.5Very high22 Ų2221.6 Ų21.614%0.14312%0.124CC..Hα-helixtrans-54.7-46.1176.7-29.237.8000112.9T128 V129 I130 L148 L160 F161P126-T128 VanDerWaalsContact C-N 3.29Å; P126-T128 PolarHBondContact O-N 3.02Å; P126-V129 PolarHBondContact O-N 3.4Å; P126-I130 WeakPolarHBondContact O-CG1 2.8Å; P126-I130 PolarHBondContact O-N 2.95Å; P126-L148 HydrophobicContact CB-CD2 4.04Å; P126-L160 HydrophobicContact CB-CB 4Å; P126-L160 HydrophobicContact CB-CD1 4.23Å; P126-L160 HydrophobicContact CB-CD2 4.38Å; P126-L160 HydrophobicContact CB-CG 4.45Å; P126-L160 HydrophobicContact CG-CB 4.2Å; P126-F161 HydrophobicContact CG-CE1 4.27Å; P126-F161 HydrophobicContact CG-CE2 4.12Å; P126-F161 HydrophobicContact CG-CZ 3.82Å
127I95.9Very high94Very high23 Ų2322.6 Ų22.612%0.11813%0.134CC..Hα-helixtrans-68.5-33.1178.7-48.9-57.2000111P75 V78 R79 M124 L125 I130 K131 V144 L148P75-I127 HydrophobicContact CB-CG2 4.41Å; P75-I127 WeakPolarHBondContact O-CG2 3.41Å; V78-I127 HydrophobicContact CB-CG2 4.11Å; V78-I127 HydrophobicContact CG1-CD1 3.98Å; V78-I127 HydrophobicContact CG1-CG1 4.2Å; V78-I127 HydrophobicContact CG1-CG2 3.95Å; R79-I127 HydrophobicContact CB-CB 4.37Å; R79-I127 HydrophobicContact CB-CG2 3.73Å; R79-I127 HydrophobicContact CG-CG2 4.47Å; M124-I127 PolarHBondContact O-N 2.98Å; L125-I127 VanDerWaalsContact C-N 3.31Å; L125-I127 PolarHBondContact O-N 3.26Å; I127-I130 PolarHBondContact O-N 3.08Å; I127-K131 WeakPolarHBondContact O-CB 3.27Å; I127-K131 PolarHBondContact O-N 2.93Å; I127-V144 HydrophobicContact CD1-CG1 4.34Å; I127-L148 HydrophobicContact CD1-CD1 3.91Å; I127-L148 HydrophobicContact CD1-CD2 4.46Å
128T94.9Very high93.6Very high15 Ų1526 Ų269%0.09215%0.147CC..Hα-helixtrans-64.7-43.5175.2-59.60000111.6R79 M124 L125 P126 K131 T132 K225R79-T128 WeakPolarHBondContact CD-OG1 3.46Å; M124-T128 WeakPolarHBondContact O-CB 3.44Å; M124-T128 PolarHBondContact O-N 3.21Å; M124-T128 PolarHBondContact O-OG1 2.81Å; L125-T128 CarbonylContact O-C 3.59Å; L125-T128 WeakPolarHBondContact O-CA 3.41Å; L125-T128 VanDerWaalsContact O-CB 3.29Å; L125-T128 WeakPolarHBondContact O-CB 3.44Å; L125-T128 PolarHBondContact O-N 3.33Å; P126-T128 VanDerWaalsContact C-N 3.29Å; P126-T128 PolarHBondContact O-N 3.02Å; T128-K131 PolarHBondContact O-N 3.33Å; T128-T132 WeakPolarHBondContact O-CG2 3.02Å; T128-T132 PolarHBondContact O-N 3.43Å; T128-T132 PolarHBondContact O-OG1 3.15Å; T128-K225 VanDerWaalsContact CG2-NZ 3.29Å
129V94.9Very high93.2Very high0 Ų026.4 Ų26.40%014%0.144CC..Hα-helixtrans-59.9-49.7173.9173.70000110L125 P126 K131 T132 R133 L160 Q229L125-V129 PolarHBondContact O-N 3.49Å; P126-V129 PolarHBondContact O-N 3.4Å; V129-K131 VanDerWaalsContact C-N 3.35Å; V129-K131 PolarHBondContact O-N 3.31Å; V129-T132 PolarHBondContact O-N 3.5Å; V129-T132 VanDerWaalsContact O-N 3.17Å; V129-T132 PolarHBondContact O-OG1 2.93Å; V129-R133 WeakPolarHBondContact O-CG 3.13Å; V129-R133 PolarHBondContact O-N 3.44Å; V129-L160 VanDerWaalsContact CG2-O 3.26Å; V129-L160 WeakPolarHBondContact CG2-O 3.23Å; V129-Q229 HydrophobicContact CG2-CB 4.37Å; V129-Q229 HydrophobicContact CG2-CG 3.99Å
130I95.3Very high92.7Very high0 Ų029.1 Ų29.10%017%0.165CC..Hα-helixtrans-59.5-44178.1-62-50.7000111.6P75 P126 I127 T132 R133 F134 V144 A147 L148 V151 L160P75-I130 HydrophobicContact CB-CG2 4.25Å; P126-I130 WeakPolarHBondContact O-CG1 2.8Å; P126-I130 PolarHBondContact O-N 2.95Å; I127-I130 PolarHBondContact O-N 3.08Å; I130-T132 PolarHBondContact O-N 3.2Å; I130-R133 PolarHBondContact O-N 2.91Å; I130-F134 HydrophobicContact CG2-CD2 3.58Å; I130-F134 HydrophobicContact CG2-CE2 3.5Å; I130-F134 VanDerWaalsContact O-CD2 3.31Å; I130-F134 WeakPolarHBondContact O-CD2 3.43Å; I130-F134 PolarHBondContact O-N 3.08Å; I130-V144 HydrophobicContact CG2-CG1 4.29Å; I130-A147 HydrophobicContact CD1-CB 3.95Å; I130-A147 HydrophobicContact CG1-CB 4.46Å; I130-A147 HydrophobicContact CG2-CB 3.77Å; I130-L148 HydrophobicContact CD1-CD2 4.35Å; I130-L148 HydrophobicContact CG1-CD2 3.7Å; I130-L148 HydrophobicContact CG1-CG 4.01Å; I130-V151 HydrophobicContact CD1-CG2 3.89Å; I130-L160 HydrophobicContact CD1-CD2 4.05Å; I130-L160 HydrophobicContact CG1-CD2 4.36Å
131K94.8Very high92.4Very high18 Ų1830.2 Ų30.28%0.07817%0.167CC..Hα-helixtrans-52.9-52.4174.2179.5-175.6-172.5-840111.3D31 P75 S76 I127 T128 V129 R133 F134 E135D31-K131 IonicContact OD2-NZ 3.32Å; D31-K131 PolarHBondContact OD2-NZ 3.14Å; P75-K131 HydrophobicContact CB-CB 4.03Å; P75-K131 HydrophobicContact CG-CB 4.25Å; S76-K131 WeakPolarHBondContact OG-CE 3.47Å; I127-K131 WeakPolarHBondContact O-CB 3.27Å; I127-K131 PolarHBondContact O-N 2.93Å; T128-K131 PolarHBondContact O-N 3.33Å; V129-K131 VanDerWaalsContact C-N 3.35Å; V129-K131 PolarHBondContact O-N 3.31Å; K131-R133 VanDerWaalsContact C-N 3.29Å; K131-R133 PolarHBondContact O-N 3.2Å; K131-F134 PolarHBondContact O-N 3.37Å; K131-E135 WeakPolarHBondContact CE-OE1 3.36Å; K131-E135 WeakPolarHBondContact CG-OE1 3.49Å; K131-E135 IonicContact NZ-OE1 3.81Å; K131-E135 PolarHBondContact NZ-OE1 3.16Å; K131-E135 IonicContact NZ-OE2 3.82Å; K131-E135 PolarHBondContact NZ-OE2 3.02Å; K131-E135 WeakPolarHBondContact O-CG 3.38Å; K131-E135 PolarHBondContact O-N 3.45Å
132T94.2Very high92Very high8 Ų836.7 Ų36.75%0.04920%0.204CC..Hα-helixtrans-62.4-35.5-178.858.50000112.9T128 V129 I130 E135 C136 Q229T128-T132 WeakPolarHBondContact O-CG2 3.02Å; T128-T132 PolarHBondContact O-N 3.43Å; T128-T132 PolarHBondContact O-OG1 3.15Å; V129-T132 PolarHBondContact O-N 3.5Å; V129-T132 VanDerWaalsContact O-N 3.17Å; V129-T132 PolarHBondContact O-OG1 2.93Å; I130-T132 PolarHBondContact O-N 3.2Å; T132-E135 PolarHBondContact O-N 2.84Å; T132-C136 WeakPolarHBondContact O-CB 3.4Å; T132-C136 PolarHBondContact O-N 3.06Å; T132-Q229 WeakPolarHBondContact OG1-CB 3.43Å
133R93.4Very high91.8Very high0 Ų036.5 Ų36.50%021%0.205CC..Hα-helixtrans-71.4-37.7176.9-68-173.1-178.5-160.54.1113.2V129 I130 K131 E135 C136 G137 Y139 Y141 E155 Q229V129-R133 WeakPolarHBondContact O-CG 3.13Å; V129-R133 PolarHBondContact O-N 3.44Å; I130-R133 PolarHBondContact O-N 2.91Å; K131-R133 VanDerWaalsContact C-N 3.29Å; K131-R133 PolarHBondContact O-N 3.2Å; R133-E135 VanDerWaalsContact C-N 3.34Å; R133-C136 PolarHBondContact O-SG 3.35Å; R133-G137 PolarHBondContact O-N 3.02Å; R133-Y139 HydrophobicContact CB-CD2 3.87Å; R133-Y139 HydrophobicContact CB-CE2 4.4Å; R133-Y139 HydrophobicContact CG-CD2 4.04Å; R133-Y139 HydrophobicContact CG-CE2 4.06Å; R133-Y141 HydrophobicContact CB-CE2 3.96Å; R133-E155 IonicContact CZ-OE1 3.74Å; R133-E155 IonicContact CZ-OE2 2.71Å; R133-E155 VanDerWaalsContact CZ-OE2 3.28Å; R133-E155 VanDerWaalsContact NH1-CD 3.25Å; R133-E155 IonicContact NH1-OE1 2.79Å; R133-E155 PolarHBondContact NH1-OE1 3.12Å; R133-E155 IonicContact NH1-OE2 3.53Å; R133-E155 PolarHBondContact NH1-OE2 3.02Å; R133-E155 IonicContact NH2-OE1 2.72Å; R133-E155 IonicContact NH2-OE2 3.72Å; R133-E155 PolarHBondContact NH2-OE2 3.23Å; R133-Q229 PolarHBondContact NE-O 3.44Å
134F93.3Very high91.7Very high12 Ų1233.5 Ų33.55%0.05319%0.187CC..Hα-helixtrans-61.1-45.6171-92.1-104.8000111P75 I130 K131 G137 Y141 A147P75-F134 HydrophobicContact CG-CB 4.16Å; P75-F134 HydrophobicContact CG-CD1 4.49Å; P75-F134 HydrophobicContact CG-CD2 4.16Å; P75-F134 HydrophobicContact CG-CG 4.03Å; I130-F134 HydrophobicContact CG2-CD2 3.58Å; I130-F134 HydrophobicContact CG2-CE2 3.5Å; I130-F134 VanDerWaalsContact O-CD2 3.31Å; I130-F134 WeakPolarHBondContact O-CD2 3.43Å; I130-F134 PolarHBondContact O-N 3.08Å; K131-F134 PolarHBondContact O-N 3.37Å; F134-G137 PolarHBondContact O-N 3.06Å; F134-Y141 AromaticContact CD2-CD2 3.91Å; F134-Y141 HydrophobicContact CD2-CD2 3.91Å; F134-Y141 WeakPolarHBondContact CE1-O 3.34Å; F134-Y141 VanDerWaalsContact CE2-CB 3.42Å; F134-Y141 AromaticContact CE2-CD2 3.79Å; F134-Y141 HydrophobicContact CE2-CD2 3.79Å; F134-Y141 AromaticContact CE2-CG 3.98Å; F134-Y141 HydrophobicContact CE2-CG 3.98Å; F134-Y141 HydrophobicContact CZ-CG 4.36Å; F134-A147 HydrophobicContact CE2-CB 3.75Å; F134-A147 HydrophobicContact CZ-CB 4.46Å
135E92.7Very high91.6Very high2 Ų236.5 Ų36.51%0.00921%0.21CC..Hα-helixtrans-71.1-30-178.1-74173.3179.500113.4Q28 T35 R36 K131 T132 R133 G137Q28-E135 PolarHBondContact NE2-OE1 3.5Å; T35-E135 HydrophobicContact CG2-CB 3.71Å; T35-E135 PolarHBondContact OG1-OE2 2.93Å; R36-E135 WeakPolarHBondContact CD-O 3.18Å; R36-E135 WeakPolarHBondContact CG-O 3.31Å; R36-E135 PolarHBondContact NE-O 3.4Å; K131-E135 WeakPolarHBondContact CE-OE1 3.36Å; K131-E135 WeakPolarHBondContact CG-OE1 3.49Å; K131-E135 IonicContact NZ-OE1 3.81Å; K131-E135 PolarHBondContact NZ-OE1 3.16Å; K131-E135 IonicContact NZ-OE2 3.82Å; K131-E135 PolarHBondContact NZ-OE2 3.02Å; K131-E135 WeakPolarHBondContact O-CG 3.38Å; K131-E135 PolarHBondContact O-N 3.45Å; T132-E135 PolarHBondContact O-N 2.84Å; R133-E135 VanDerWaalsContact C-N 3.34Å; E135-G137 VanDerWaalsContact C-N 3.29Å
136C90.3Very high91.5Very high3 Ų338.1 Ų38.12%0.0223%0.226CC..Hα-helixtrans-74.5-21.1176.684.10000113.3T35 R36 T39 T132 R133 R138 V230T35-C136 HydrophobicContact CG2-CB 4.17Å; R36-C136 VanDerWaalsContact CD-O 3.28Å; R36-C136 WeakPolarHBondContact CD-O 3.2Å; R36-C136 PolarHBondContact NE-O 3.16Å; R36-C136 VanDerWaalsContact NE-O 3.15Å; R36-C136 VanDerWaalsContact NH1-C 3.34Å; R36-C136 PolarHBondContact NH1-O 3.49Å; T39-C136 HydrophobicContact CG2-CB 3.8Å; T132-C136 WeakPolarHBondContact O-CB 3.4Å; T132-C136 PolarHBondContact O-N 3.06Å; R133-C136 PolarHBondContact O-SG 3.35Å; C136-R138 PolarHBondContact O-N 3.05Å; C136-R138 PolarHBondContact SG-N 3.27Å; C136-V230 HydrophobicContact CB-CG1 4.27Å; C136-V230 HydrophobicContact CB-CG2 3.81Å
137G84Confident91.4Very high22 Ų2237.1 Ų37.123%0.22722%0.22CC..  trans50.822.618000000117.3R133 F134 E135R133-G137 PolarHBondContact O-N 3.02Å; F134-G137 PolarHBondContact O-N 3.06Å; E135-G137 VanDerWaalsContact C-N 3.29Å
138R86.3Confident91.3Very high134 Ų13438.1 Ų38.151%0.50623%0.225SC..SBendtrans-74.1-19.7163.2-64.6177.869-175.6-0.1112.2C136 N231C136-R138 PolarHBondContact O-N 3.05Å; C136-R138 PolarHBondContact SG-N 3.27Å; R138-N231 PolarHBondContact NH1-OD1 3.4Å
139Y86.3Confident91.3Very high56 Ų5645.3 Ų45.322%0.2225%0.251CS..SBendtrans-112.7136.8-179.4-58.5-86.7000110.2R133 Y141 V230R133-Y139 HydrophobicContact CB-CD2 3.87Å; R133-Y139 HydrophobicContact CB-CE2 4.4Å; R133-Y139 HydrophobicContact CG-CD2 4.04Å; R133-Y139 HydrophobicContact CG-CE2 4.06Å; Y139-Y141 HydrophobicContact CD1-CE2 4.27Å; Y139-Y141 AromaticContact CD1-CZ 3.95Å; Y139-Y141 WeakPolarHBondContact CD1-OH 3.25Å; Y139-Y141 HydrophobicContact CD2-CE2 4.48Å; Y139-Y141 AromaticContact CG-CE2 3.79Å; Y139-Y141 HydrophobicContact CG-CE2 3.79Å; Y139-Y141 AromaticContact CG-CZ 3.97Å; Y139-V230 HydrophobicContact CE2-CG1 4.36Å; Y139-V230 PolarHBondContact OH-O 3.5Å
140S84.9Confident91.3Very high119 Ų11947.8 Ų47.883%0.83227%0.268SS*.  trans-10192.1174.2-165.80000109.5
141Y87.6Confident91.2Very high36 Ų3647.8 Ų47.814%0.14127%0.268CS..  trans-108.2133.2176.7-63.3-54.5000110.3R133 F134 Y139 A147R133-Y141 HydrophobicContact CB-CE2 3.96Å; F134-Y141 AromaticContact CD2-CD2 3.91Å; F134-Y141 HydrophobicContact CD2-CD2 3.91Å; F134-Y141 WeakPolarHBondContact CE1-O 3.34Å; F134-Y141 VanDerWaalsContact CE2-CB 3.42Å; F134-Y141 AromaticContact CE2-CD2 3.79Å; F134-Y141 HydrophobicContact CE2-CD2 3.79Å; F134-Y141 AromaticContact CE2-CG 3.98Å; F134-Y141 HydrophobicContact CE2-CG 3.98Å; F134-Y141 HydrophobicContact CZ-CG 4.36Å; Y139-Y141 HydrophobicContact CD1-CE2 4.27Å; Y139-Y141 AromaticContact CD1-CZ 3.95Å; Y139-Y141 WeakPolarHBondContact CD1-OH 3.25Å; Y139-Y141 HydrophobicContact CD2-CE2 4.48Å; Y139-Y141 AromaticContact CG-CE2 3.79Å; Y139-Y141 HydrophobicContact CG-CE2 3.79Å; Y139-Y141 AromaticContact CG-CZ 3.97Å; Y141-A147 HydrophobicContact CD1-CB 3.71Å; Y141-A147 HydrophobicContact CD2-CB 3.82Å; Y141-A147 HydrophobicContact CE1-CB 4.16Å; Y141-A147 HydrophobicContact CE2-CB 4.24Å; Y141-A147 HydrophobicContact CG-CB 3.54Å
142V85.3Confident91.1Very high147 Ų14749.4 Ų49.489%0.89128%0.281SS*.SBendtrans-84.4-39.6179.2-177.10000111.4
143S92.6Very high91Very high48 Ų4858.8 Ų58.834%0.33632%0.316SS..  trans-139.4156.5-176.369.40000112.1S145 G146 A147S143-S145 PolarHBondContact OG-OG 3.34Å; S143-G146 PolarHBondContact O-N 2.68Å; S143-G146 PolarHBondContact OG-N 3.04Å; S143-A147 WeakPolarHBondContact O-CB 3.45Å; S143-A147 PolarHBondContact O-N 3.05Å
144V93.3Very high90.9Very high17 Ų1762.8 Ų62.810%0.10334%0.343CS..Hα-helixtrans-63.8-42.6178.4-179.20000110.9P75 I127 I130 A147 L148P75-V144 HydrophobicContact CB-CG2 3.95Å; P75-V144 HydrophobicContact CG-CG2 4.4Å; I127-V144 HydrophobicContact CD1-CG1 4.34Å; I130-V144 HydrophobicContact CG2-CG1 4.29Å; V144-A147 PolarHBondContact O-N 2.86Å; V144-L148 HydrophobicContact CG1-CD1 4.33Å; V144-L148 WeakPolarHBondContact O-CG 3.29Å; V144-L148 PolarHBondContact O-N 3.39Å
145S93.5Very high90.8Very high85 Ų8564.8 Ų64.859%0.59435%0.353SS*.Hα-helixtrans-66.6-40.117755.20000112.2S143 L148 R149S143-S145 PolarHBondContact OG-OG 3.34Å; S145-L148 PolarHBondContact O-N 2.9Å; S145-R149 WeakPolarHBondContact O-CB 3.39Å; S145-R149 PolarHBondContact O-N 3.48Å
146G93.3Very high90.7Very high33 Ų3365.6 Ų65.634%0.3436%0.362SS..Hα-helixtrans-62.7-42.5173.700000111.9S143 R149 S150S143-G146 PolarHBondContact O-N 2.68Å; S143-G146 PolarHBondContact OG-N 3.04Å; G146-R149 PolarHBondContact O-N 3.25Å; G146-S150 VanDerWaalsContact O-CB 3.24Å; G146-S150 WeakPolarHBondContact O-CB 3.37Å; G146-S150 PolarHBondContact O-N 2.88Å
147A93.1Very high90.7Very high1 Ų169.6 Ų69.61%0.00839%0.388CS..Hα-helixtrans-64.4-46.9176.300000112I130 F134 Y141 S143 V144 R149 S150 V151I130-A147 HydrophobicContact CD1-CB 3.95Å; I130-A147 HydrophobicContact CG1-CB 4.46Å; I130-A147 HydrophobicContact CG2-CB 3.77Å; F134-A147 HydrophobicContact CE2-CB 3.75Å; F134-A147 HydrophobicContact CZ-CB 4.46Å; Y141-A147 HydrophobicContact CD1-CB 3.71Å; Y141-A147 HydrophobicContact CD2-CB 3.82Å; Y141-A147 HydrophobicContact CE1-CB 4.16Å; Y141-A147 HydrophobicContact CE2-CB 4.24Å; Y141-A147 HydrophobicContact CG-CB 3.54Å; S143-A147 WeakPolarHBondContact O-CB 3.45Å; S143-A147 PolarHBondContact O-N 3.05Å; V144-A147 PolarHBondContact O-N 2.86Å; A147-R149 PolarHBondContact O-N 3.13Å; A147-S150 PolarHBondContact O-N 3.32Å; A147-V151 WeakPolarHBondContact O-CG2 3.46Å; A147-V151 PolarHBondContact O-N 3.33Å
148L94.4Very high91Very high44 Ų4473.9 Ų73.923%0.2341%0.41CS..Hα-helixtrans-56.8-48.8174.7-76168.8000111.4P126 I127 I130 V144 S145 S150 V151 C152 L160P126-L148 HydrophobicContact CB-CD2 4.04Å; I127-L148 HydrophobicContact CD1-CD1 3.91Å; I127-L148 HydrophobicContact CD1-CD2 4.46Å; I130-L148 HydrophobicContact CD1-CD2 4.35Å; I130-L148 HydrophobicContact CG1-CD2 3.7Å; I130-L148 HydrophobicContact CG1-CG 4.01Å; V144-L148 HydrophobicContact CG1-CD1 4.33Å; V144-L148 WeakPolarHBondContact O-CG 3.29Å; V144-L148 PolarHBondContact O-N 3.39Å; S145-L148 PolarHBondContact O-N 2.9Å; L148-S150 VanDerWaalsContact C-N 3.34Å; L148-S150 PolarHBondContact O-N 3.48Å; L148-V151 PolarHBondContact O-N 2.94Å; L148-C152 WeakPolarHBondContact O-CB 3.42Å; L148-C152 PolarHBondContact O-N 3.23Å; L148-C152 PolarHBondContact O-SG 3.47Å; L148-C152 VanDerWaalsContact O-SG 3.38Å; L148-L160 HydrophobicContact CD2-CD1 3.99Å; L148-L160 HydrophobicContact CD2-CD2 3.82Å
149R94.8Very high91.2Very high166 Ų16667.9 Ų67.963%0.62639%0.389SS*.Hα-helixtrans-62.1-42.2178.3-175.9-176.7-69.1174.6-2.3111.7S145 G146 A147 R153S145-R149 WeakPolarHBondContact O-CB 3.39Å; S145-R149 PolarHBondContact O-N 3.48Å; G146-R149 PolarHBondContact O-N 3.25Å; A147-R149 PolarHBondContact O-N 3.13Å; R149-R153 WeakPolarHBondContact O-CB 3.4Å; R149-R153 WeakPolarHBondContact O-CG 3.3Å; R149-R153 PolarHBondContact O-N 2.88Å; R149-R153 VanDerWaalsContact O-N 3.08Å
150S93.6Very high91.5Very high52 Ų5265.8 Ų65.836%0.36438%0.381SS..Hα-helixtrans-60.8-52.6178.31750000110.5G146 A147 L148 C152 R153 S154G146-S150 VanDerWaalsContact O-CB 3.24Å; G146-S150 WeakPolarHBondContact O-CB 3.37Å; G146-S150 PolarHBondContact O-N 2.88Å; A147-S150 PolarHBondContact O-N 3.32Å; L148-S150 VanDerWaalsContact C-N 3.34Å; L148-S150 PolarHBondContact O-N 3.48Å; S150-C152 PolarHBondContact O-N 2.85Å; S150-R153 PolarHBondContact O-N 3.26Å; S150-R153 VanDerWaalsContact O-N 3.16Å; S150-S154 WeakPolarHBondContact O-CB 3.33Å; S150-S154 PolarHBondContact O-N 3.16Å; S150-S154 PolarHBondContact O-OG 2.93Å
151V92.9Very high91.9Very high0 Ų064.6 Ų64.60%036%0.361CS..Hα-helixtrans-60.9-46.2-179.9176.20000111.3I130 A147 L148 R153 S154 E155 G156 A159 L160I130-V151 HydrophobicContact CD1-CG2 3.89Å; A147-V151 WeakPolarHBondContact O-CG2 3.46Å; A147-V151 PolarHBondContact O-N 3.33Å; L148-V151 PolarHBondContact O-N 2.94Å; V151-R153 VanDerWaalsContact C-N 3.25Å; V151-R153 PolarHBondContact O-N 2.9Å; V151-S154 PolarHBondContact O-N 3.3Å; V151-E155 HydrophobicContact CG1-CB 4.39Å; V151-E155 PolarHBondContact O-N 3.45Å; V151-G156 PolarHBondContact O-N 2.92Å; V151-A159 HydrophobicContact CG1-CB 3.97Å; V151-L160 HydrophobicContact CB-CD2 4.08Å; V151-L160 HydrophobicContact CG1-CD2 3.74Å; V151-L160 HydrophobicContact CG1-CG 4.04Å
152C93.4Very high92Very high52 Ų5263.7 Ų63.735%0.35136%0.36SS..Hα-helixtrans-58.7-36.3177.3-75.30000113.1L148 S150 G156 L160L148-C152 WeakPolarHBondContact O-CB 3.42Å; L148-C152 PolarHBondContact O-N 3.23Å; L148-C152 PolarHBondContact O-SG 3.47Å; L148-C152 VanDerWaalsContact O-SG 3.38Å; S150-C152 PolarHBondContact O-N 2.85Å; C152-G156 VanDerWaalsContact O-CA 3.32Å; C152-G156 WeakPolarHBondContact O-CA 3.16Å; C152-G156 PolarHBondContact O-N 3.38Å; C152-L160 WeakPolarHBondContact SG-CD1 3.44Å
153R93.2Very high92.2Very high206 Ų20657 Ų5778%0.77732%0.321SS*.Hα-helixtrans-81.8-38.5-179.1-75.4-175.2174.1-177.3-3.5113.3R149 S150 V151R149-R153 WeakPolarHBondContact O-CB 3.4Å; R149-R153 WeakPolarHBondContact O-CG 3.3Å; R149-R153 PolarHBondContact O-N 2.88Å; R149-R153 VanDerWaalsContact O-N 3.08Å; S150-R153 PolarHBondContact O-N 3.26Å; S150-R153 VanDerWaalsContact O-N 3.16Å; V151-R153 VanDerWaalsContact C-N 3.25Å; V151-R153 PolarHBondContact O-N 2.9Å
154S91.2Very high92.3Very high83 Ų8357.1 Ų57.158%0.5832%0.317SS*.Hα-helixtrans-90.2-33.7-174.260.20000113.8S150 V151S150-S154 WeakPolarHBondContact O-CB 3.33Å; S150-S154 PolarHBondContact O-N 3.16Å; S150-S154 PolarHBondContact O-OG 2.93Å; V151-S154 PolarHBondContact O-N 3.3Å
155E90.6Very high92.2Very high55 Ų5562.5 Ų62.526%0.25734%0.343SS..THydrogen-bonded Turntrans-120.1-10.5-172.7-62.1166.7-143.800112.8R133 V151 A159 P232R133-E155 IonicContact CZ-OE1 3.74Å; R133-E155 IonicContact CZ-OE2 2.71Å; R133-E155 VanDerWaalsContact CZ-OE2 3.28Å; R133-E155 VanDerWaalsContact NH1-CD 3.25Å; R133-E155 IonicContact NH1-OE1 2.79Å; R133-E155 PolarHBondContact NH1-OE1 3.12Å; R133-E155 IonicContact NH1-OE2 3.53Å; R133-E155 PolarHBondContact NH1-OE2 3.02Å; R133-E155 IonicContact NH2-OE1 2.72Å; R133-E155 IonicContact NH2-OE2 3.72Å; R133-E155 PolarHBondContact NH2-OE2 3.23Å; V151-E155 HydrophobicContact CG1-CB 4.39Å; V151-E155 PolarHBondContact O-N 3.45Å; E155-A159 HydrophobicContact CB-CB 3.69Å; E155-P232 HydrophobicContact CG-CG 4.23Å; E155-P232 WeakPolarHBondContact OE2-CB 3.43Å; E155-P232 WeakPolarHBondContact OE2-CG 3.42Å
156G90.8Very high92.2Very high19 Ų1958.6 Ų58.620%0.19632%0.316CS..  trans88.9161.7-176.200000113.5V151 C152 T158 A159V151-G156 PolarHBondContact O-N 2.92Å; C152-G156 VanDerWaalsContact O-CA 3.32Å; C152-G156 WeakPolarHBondContact O-CA 3.16Å; C152-G156 PolarHBondContact O-N 3.38Å; G156-T158 VanDerWaalsContact C-N 3.28Å; G156-T158 PolarHBondContact O-N 3.49Å; G156-A159 WeakPolarHBondContact O-CB 3.28Å; G156-A159 PolarHBondContact O-N 3.41Å
157P89.9Confident92.2Very high86 Ų8657.1 Ų57.156%0.55830%0.3SS*.G310 helixtrans-67.9-26.4-176.526.9-34.8000113.3A159 L160P157-A159 PolarHBondContact O-N 3.37Å; P157-L160 WeakPolarHBondContact O-CB 3.46Å; P157-L160 PolarHBondContact O-N 3.46Å
158T89.8Confident92.3Very high113 Ų11359 Ų5969%0.69331%0.31SS*.G310 helixtrans-66-26.4177.749.90000112.5G156 L160 F161G156-T158 VanDerWaalsContact C-N 3.28Å; G156-T158 PolarHBondContact O-N 3.49Å; T158-L160 PolarHBondContact O-N 2.87Å; T158-F161 PolarHBondContact O-N 3.16Å
159A90.4Very high92.3Very high8 Ų861.7 Ų61.77%0.06632%0.324CS..G310 helixtrans-61.8-28176.300000112.7V151 E155 G156 P157 F161 S162 P232V151-A159 HydrophobicContact CG1-CB 3.97Å; E155-A159 HydrophobicContact CB-CB 3.69Å; G156-A159 WeakPolarHBondContact O-CB 3.28Å; G156-A159 PolarHBondContact O-N 3.41Å; P157-A159 PolarHBondContact O-N 3.37Å; A159-F161 PolarHBondContact O-N 2.91Å; A159-S162 VanDerWaalsContact O-CB 3.25Å; A159-S162 WeakPolarHBondContact O-CB 3.4Å; A159-S162 PolarHBondContact O-N 2.87Å; A159-S162 PolarHBondContact O-OG 3.45Å; A159-P232 HydrophobicContact CB-CB 4.23Å
160L92.4Very high92.2Very high12 Ų1255.8 Ų55.86%0.06330%0.302CS..G310 helixtrans-70.1-14.8175.2-67.2174.7000113.6P126 V129 I130 L148 V151 C152 P157 T158P126-L160 HydrophobicContact CB-CB 4Å; P126-L160 HydrophobicContact CB-CD1 4.23Å; P126-L160 HydrophobicContact CB-CD2 4.38Å; P126-L160 HydrophobicContact CB-CG 4.45Å; P126-L160 HydrophobicContact CG-CB 4.2Å; V129-L160 VanDerWaalsContact CG2-O 3.26Å; V129-L160 WeakPolarHBondContact CG2-O 3.23Å; I130-L160 HydrophobicContact CD1-CD2 4.05Å; I130-L160 HydrophobicContact CG1-CD2 4.36Å; L148-L160 HydrophobicContact CD2-CD1 3.99Å; L148-L160 HydrophobicContact CD2-CD2 3.82Å; V151-L160 HydrophobicContact CB-CD2 4.08Å; V151-L160 HydrophobicContact CG1-CD2 3.74Å; V151-L160 HydrophobicContact CG1-CG 4.04Å; C152-L160 WeakPolarHBondContact SG-CD1 3.44Å; P157-L160 WeakPolarHBondContact O-CB 3.46Å; P157-L160 PolarHBondContact O-N 3.46Å; T158-L160 PolarHBondContact O-N 2.87Å
161F92.9Very high92.1Very high94 Ų9454.3 Ų54.341%0.41229%0.29SS..G310 helixtrans-105.911.1175.5-65.1-92.2000112.8L125 P126 T158 A159 G163 L164L125-F161 HydrophobicContact CB-CD1 4.22Å; L125-F161 HydrophobicContact CB-CE1 4.48Å; L125-F161 HydrophobicContact CD2-CB 4.04Å; L125-F161 HydrophobicContact CD2-CD1 3.93Å; L125-F161 HydrophobicContact CD2-CG 4.37Å; P126-F161 HydrophobicContact CG-CE1 4.27Å; P126-F161 HydrophobicContact CG-CE2 4.12Å; P126-F161 HydrophobicContact CG-CZ 3.82Å; T158-F161 PolarHBondContact O-N 3.16Å; A159-F161 PolarHBondContact O-N 2.91Å; F161-G163 PolarHBondContact O-N 3.2Å; F161-L164 PolarHBondContact O-N 2.81Å
162S90.8Very high92.1Very high16 Ų1656.5 Ų56.511%0.11230%0.303CS..THydrogen-bonded Turntrans-58.7135173.859.80000111.1A159 L164 Q229A159-S162 VanDerWaalsContact O-CB 3.25Å; A159-S162 WeakPolarHBondContact O-CB 3.4Å; A159-S162 PolarHBondContact O-N 2.87Å; A159-S162 PolarHBondContact O-OG 3.45Å; S162-L164 VanDerWaalsContact C-N 3.33Å; S162-L164 PolarHBondContact O-N 3Å; S162-Q229 WeakPolarHBondContact O-CG 3.14Å
163G89.9Confident92.1Very high6 Ų656.1 Ų56.16%0.06230%0.3CS..THydrogen-bonded Turntrans73.519.6178.700000114.6F161 M165 A166 T167 V228F161-G163 PolarHBondContact O-N 3.2Å; G163-M165 PolarHBondContact O-N 3.48Å; G163-A166 PolarHBondContact O-N 2.94Å; G163-T167 WeakPolarHBondContact O-CB 3.49Å; G163-T167 PolarHBondContact O-N 3.42Å; G163-T167 PolarHBondContact O-OG1 3.3Å; G163-V228 VanDerWaalsContact N-CG1 3.26Å
164L93.1Very high91.9Very high52 Ų5247.5 Ų47.527%0.27227%0.268SS..Hα-helixtrans-53-52.2173.6176.358.5000111.6V122 L125 F161 S162 A166 T167 L168V122-L164 HydrophobicContact CG2-CD1 3.77Å; V122-L164 HydrophobicContact CG2-CD2 4.47Å; L125-L164 HydrophobicContact CD2-CB 3.47Å; L125-L164 VanDerWaalsContact CD2-CB 3.47Å; L125-L164 HydrophobicContact CD2-CD1 3.67Å; L125-L164 HydrophobicContact CD2-CG 4.07Å; F161-L164 PolarHBondContact O-N 2.81Å; S162-L164 VanDerWaalsContact C-N 3.33Å; S162-L164 PolarHBondContact O-N 3Å; L164-A166 PolarHBondContact O-N 3.36Å; L164-T167 WeakPolarHBondContact O-CA 3.39Å; L164-T167 WeakPolarHBondContact O-CB 3.22Å; L164-T167 PolarHBondContact O-N 2.92Å; L164-T167 VanDerWaalsContact O-N 3.07Å; L164-L168 HydrophobicContact CD1-CD1 3.89Å; L164-L168 HydrophobicContact CD1-CD2 4.31Å; L164-L168 HydrophobicContact CD1-CG 3.86Å; L164-L168 HydrophobicContact CG-CD1 4.09Å; L164-L168 HydrophobicContact CG-CG 4.39Å; L164-L168 WeakPolarHBondContact O-CG 3.35Å; L164-L168 PolarHBondContact O-N 3.04Å
165M92.7Very high91.7Very high129 Ų12945.8 Ų45.864%0.63526%0.256SS*.Hα-helixtrans-57.6-48.5-178.9179.8-174.2152.800111.9G163 T167 L168 L169G163-M165 PolarHBondContact O-N 3.48Å; M165-T167 VanDerWaalsContact C-N 3.28Å; M165-T167 PolarHBondContact O-N 3.28Å; M165-L168 PolarHBondContact O-N 3.33Å; M165-L169 WeakPolarHBondContact O-CB 3.5Å; M165-L169 PolarHBondContact O-N 2.96Å
166A93.3Very high91.7Very high3 Ų344.1 Ų44.13%0.02525%0.254CS..Hα-helixtrans-64.7-33.5177.200000112.3G163 L164 R170 V224 K225 T236G163-A166 PolarHBondContact O-N 2.94Å; L164-A166 PolarHBondContact O-N 3.36Å; A166-R170 WeakPolarHBondContact O-CB 3.2Å; A166-R170 PolarHBondContact O-N 3.07Å; A166-R170 VanDerWaalsContact O-N 3.09Å; A166-V224 HydrophobicContact CB-CB 4.43Å; A166-V224 HydrophobicContact CB-CG1 4.11Å; A166-K225 HydrophobicContact CB-CB 3.76Å; A166-T236 HydrophobicContact CB-CG2 4.49Å
167T93.9Very high91.8Very high2 Ų244.6 Ų44.61%0.01225%0.252CS..Hα-helixtrans-65.6-47.4174-620000112L125 G163 L164 M165 R170 D171 K225 Q229L125-T167 HydrophobicContact CD1-CG2 4.19Å; G163-T167 WeakPolarHBondContact O-CB 3.49Å; G163-T167 PolarHBondContact O-N 3.42Å; G163-T167 PolarHBondContact O-OG1 3.3Å; L164-T167 WeakPolarHBondContact O-CA 3.39Å; L164-T167 WeakPolarHBondContact O-CB 3.22Å; L164-T167 PolarHBondContact O-N 2.92Å; L164-T167 VanDerWaalsContact O-N 3.07Å; M165-T167 VanDerWaalsContact C-N 3.28Å; M165-T167 PolarHBondContact O-N 3.28Å; T167-R170 PolarHBondContact O-N 3.37Å; T167-D171 WeakPolarHBondContact O-CB 3.09Å; T167-D171 PolarHBondContact O-N 3.39Å; T167-K225 HydrophobicContact CG2-CD 4.45Å; T167-K225 VanDerWaalsContact OG1-CD 3.23Å; T167-K225 WeakPolarHBondContact OG1-CD 3.37Å; T167-K225 WeakPolarHBondContact OG1-CE 3.42Å; T167-K225 WeakPolarHBondContact OG1-CG 3.27Å; T167-K225 PolarHBondContact OG1-NZ 2.76Å; T167-Q229 PolarHBondContact OG1-NE2 2.98Å
168L94.8Very high91.9Very high40 Ų4044.2 Ų44.221%0.20924%0.24CC..Hα-helixtrans-65.2-43.6178.4-66.7179.8000111.4T118 L164 M165 R170 D171 V172 P173T118-L168 HydrophobicContact CG2-CD1 4.25Å; T118-L168 HydrophobicContact CG2-CD2 3.92Å; L164-L168 HydrophobicContact CD1-CD1 3.89Å; L164-L168 HydrophobicContact CD1-CD2 4.31Å; L164-L168 HydrophobicContact CD1-CG 3.86Å; L164-L168 HydrophobicContact CG-CD1 4.09Å; L164-L168 HydrophobicContact CG-CG 4.39Å; L164-L168 WeakPolarHBondContact O-CG 3.35Å; L164-L168 PolarHBondContact O-N 3.04Å; M165-L168 PolarHBondContact O-N 3.33Å; L168-R170 PolarHBondContact O-N 3.41Å; L168-D171 PolarHBondContact O-N 3.01Å; L168-D171 VanDerWaalsContact O-N 3.16Å; L168-V172 HydrophobicContact CB-CG2 4.38Å; L168-V172 HydrophobicContact CD2-CG2 4.27Å; L168-V172 WeakPolarHBondContact O-CB 3.47Å; L168-V172 WeakPolarHBondContact O-CG2 3.36Å; L168-V172 PolarHBondContact O-N 3.25Å; L168-P173 WeakPolarHBondContact O-CD 3.49Å
169L94.2Very high92Very high102 Ų10242.2 Ų42.253%0.53423%0.227SC..Hα-helixtrans-62-27.5176.7-173.262.5000112.6M165 P173 A221M165-L169 WeakPolarHBondContact O-CB 3.5Å; M165-L169 PolarHBondContact O-N 2.96Å; L169-P173 WeakPolarHBondContact O-CD 3.35Å; L169-P173 WeakPolarHBondContact O-CG 3.37Å; L169-A221 HydrophobicContact CB-CB 4.18Å; L169-A221 HydrophobicContact CD2-CB 4.06Å; L169-A221 HydrophobicContact CG-CB 4.01Å
170R92.6Very high92Very high41 Ų4146.2 Ų46.216%0.15525%0.245CC..Hα-helixtrans-79.5-44.1172.6-176.1-161.869.8175.42.1112.4A166 T167 L168 A221 D222 K225A166-R170 WeakPolarHBondContact O-CB 3.2Å; A166-R170 PolarHBondContact O-N 3.07Å; A166-R170 VanDerWaalsContact O-N 3.09Å; T167-R170 PolarHBondContact O-N 3.37Å; L168-R170 PolarHBondContact O-N 3.41Å; R170-A221 HydrophobicContact CB-CB 4.13Å; R170-D222 WeakPolarHBondContact CD-OD1 3.36Å; R170-D222 HydrophobicContact CG-CB 4.01Å; R170-D222 IonicContact CZ-OD1 2.96Å; R170-D222 IonicContact NE-OD1 3.58Å; R170-D222 IonicContact NH1-OD1 3.72Å; R170-D222 PolarHBondContact NH1-OD1 3.13Å; R170-K225 VanDerWaalsContact CZ-NZ 3.3Å
171D91.8Very high92.1Very high22 Ų2247.9 Ų47.912%0.11825%0.252CS..Hα-helixtrans-89.6-40.8-165.5-73.7-23.8000113.8R117 T167 L168R117-D171 VanDerWaalsContact CZ-O 3.24Å; R117-D171 PolarHBondContact NE-O 3.41Å; R117-D171 IonicContact NH1-OD1 2.81Å; R117-D171 PolarHBondContact NH2-O 3.19Å; T167-D171 WeakPolarHBondContact O-CB 3.09Å; T167-D171 PolarHBondContact O-N 3.39Å; L168-D171 PolarHBondContact O-N 3.01Å; L168-D171 VanDerWaalsContact O-N 3.16Å
172V93.1Very high92.1Very high45 Ų4546 Ų4627%0.27324%0.243SC..Hα-helixtrans-66-51.7-177.2175.90000112.4T118 L168 F174T118-V172 WeakPolarHBondContact OG1-CG2 3.34Å; L168-V172 HydrophobicContact CB-CG2 4.38Å; L168-V172 HydrophobicContact CD2-CG2 4.27Å; L168-V172 WeakPolarHBondContact O-CB 3.47Å; L168-V172 WeakPolarHBondContact O-CG2 3.36Å; L168-V172 PolarHBondContact O-N 3.25Å; V172-F174 VanDerWaalsContact C-N 3.26Å; V172-F174 PolarHBondContact O-N 2.99Å
173P92.3Very high92.1Very high44 Ų4448.4 Ų48.429%0.28626%0.26SS..Hα-helixtrans-75.4-16.6-176.730.6-35.4000113L168 L169 S175 G176 I177 T218L168-P173 WeakPolarHBondContact O-CD 3.49Å; L169-P173 WeakPolarHBondContact O-CD 3.35Å; L169-P173 WeakPolarHBondContact O-CG 3.37Å; P173-S175 VanDerWaalsContact C-N 3.31Å; P173-S175 PolarHBondContact O-N 3.35Å; P173-G176 PolarHBondContact O-N 3.35Å; P173-G176 VanDerWaalsContact O-N 3.14Å; P173-I177 HydrophobicContact CB-CD1 3.86Å; P173-I177 HydrophobicContact CB-CG1 4.46Å; P173-I177 HydrophobicContact CG-CD1 4.42Å; P173-I177 VanDerWaalsContact O-CG1 3.31Å; P173-I177 WeakPolarHBondContact O-CG1 3.29Å; P173-I177 PolarHBondContact O-N 2.99Å; P173-T218 HydrophobicContact CG-CG2 4.35Å
174F89.8Confident92.2Very high26 Ų2653.6 Ų53.611%0.11428%0.282CS..Hα-helixtrans-52.6-46.1-174.9-178.7-92.5000112.9V172 I177 Y178 A214V172-F174 VanDerWaalsContact C-N 3.26Å; V172-F174 PolarHBondContact O-N 2.99Å; F174-I177 PolarHBondContact O-N 3.3Å; F174-Y178 VanDerWaalsContact O-CB 3.27Å; F174-Y178 WeakPolarHBondContact O-CB 3.19Å; F174-Y178 PolarHBondContact O-N 3.5Å; F174-A214 HydrophobicContact CD2-CB 4.15Å; F174-A214 HydrophobicContact CE2-CB 3.88Å; F174-A214 HydrophobicContact CZ-CB 4.42Å
175S86.5Confident92.2Very high47 Ų4751.9 Ų51.933%0.32928%0.276SS..Hα-helixtrans-67.1-40.4-177.6-55.30000112.2P173 Y178 V179P173-S175 VanDerWaalsContact C-N 3.31Å; P173-S175 PolarHBondContact O-N 3.35Å; S175-Y178 PolarHBondContact O-N 2.98Å; S175-V179 WeakPolarHBondContact O-CG2 3.46Å; S175-V179 PolarHBondContact O-N 3.13Å
176G90.2Very high92Very high20 Ų2049.9 Ų49.921%0.20626%0.263CS..Hα-helixtrans-66.3-45.117700000112.1P173 Y178 V179 M180P173-G176 PolarHBondContact O-N 3.35Å; P173-G176 VanDerWaalsContact O-N 3.14Å; G176-Y178 VanDerWaalsContact C-N 3.34Å; G176-Y178 PolarHBondContact O-N 3.25Å; G176-V179 PolarHBondContact O-N 2.86Å; G176-M180 WeakPolarHBondContact O-CB 3.44Å; G176-M180 PolarHBondContact O-N 3.26Å
177I93.4Very high91.8Very high29 Ų2953.7 Ų53.715%0.14930%0.295CS..Hα-helixtrans-62.8-41.9176.7-63.1163.8000110.8P173 F174 M180 F181 A214 V217 T218P173-I177 HydrophobicContact CB-CD1 3.86Å; P173-I177 HydrophobicContact CB-CG1 4.46Å; P173-I177 HydrophobicContact CG-CD1 4.42Å; P173-I177 VanDerWaalsContact O-CG1 3.31Å; P173-I177 WeakPolarHBondContact O-CG1 3.29Å; P173-I177 PolarHBondContact O-N 2.99Å; F174-I177 PolarHBondContact O-N 3.3Å; I177-M180 PolarHBondContact O-N 3.46Å; I177-F181 HydrophobicContact CG2-CD2 3.5Å; I177-F181 HydrophobicContact CG2-CE2 3.36Å; I177-F181 VanDerWaalsContact O-CD2 3.29Å; I177-F181 WeakPolarHBondContact O-CD2 3.38Å; I177-F181 PolarHBondContact O-N 3.43Å; I177-A214 HydrophobicContact CB-CB 4.26Å; I177-A214 HydrophobicContact CG2-CB 3.76Å; I177-V217 HydrophobicContact CD1-CB 4.42Å; I177-V217 HydrophobicContact CD1-CG1 3.74Å; I177-V217 HydrophobicContact CG2-CB 4.45Å; I177-T218 HydrophobicContact CD1-CG2 3.88Å
178Y92Very high91.5Very high78 Ų7858.4 Ų58.431%0.30633%0.328SS..Hα-helixtrans-59.1-50.2175.6175.1-91.4000111.5F174 S175 G176 M180 F181 Y182 A210F174-Y178 VanDerWaalsContact O-CB 3.27Å; F174-Y178 WeakPolarHBondContact O-CB 3.19Å; F174-Y178 PolarHBondContact O-N 3.5Å; S175-Y178 PolarHBondContact O-N 2.98Å; G176-Y178 VanDerWaalsContact C-N 3.34Å; G176-Y178 PolarHBondContact O-N 3.25Å; Y178-M180 VanDerWaalsContact C-N 3.33Å; Y178-M180 PolarHBondContact O-N 3.17Å; Y178-F181 PolarHBondContact O-N 3.42Å; Y178-Y182 WeakPolarHBondContact O-CB 3.29Å; Y178-Y182 PolarHBondContact O-N 3.4Å; Y178-A210 HydrophobicContact CD2-CB 3.98Å; Y178-A210 HydrophobicContact CE2-CB 3.96Å
179V91Very high91.2Very high71 Ų7158.6 Ų58.643%0.4333%0.329SS..Hα-helixtrans-61.9-43.2178.8171.50000110.8S175 G176 F181 Y182 S183S175-V179 WeakPolarHBondContact O-CG2 3.46Å; S175-V179 PolarHBondContact O-N 3.13Å; G176-V179 PolarHBondContact O-N 2.86Å; V179-F181 PolarHBondContact O-N 3.49Å; V179-Y182 PolarHBondContact O-N 3.04Å; V179-S183 WeakPolarHBondContact O-CB 3.49Å; V179-S183 PolarHBondContact O-N 3.43Å; V179-S183 PolarHBondContact O-OG 3.33Å
180M92.4Very high90.8Very high92 Ų9257.3 Ų57.345%0.45333%0.327SS..Hα-helixtrans-57-52.3177.3-176.4-171.878.400111.8G176 I177 Y178 Q184G176-M180 WeakPolarHBondContact O-CB 3.44Å; G176-M180 PolarHBondContact O-N 3.26Å; I177-M180 PolarHBondContact O-N 3.46Å; Y178-M180 VanDerWaalsContact C-N 3.33Å; Y178-M180 PolarHBondContact O-N 3.17Å; M180-Q184 WeakPolarHBondContact O-CG 3Å; M180-Q184 PolarHBondContact O-N 2.81Å
181F94.4Very high90.1Very high46 Ų4663.7 Ų63.720%0.20236%0.358CS..Hα-helixtrans-68-35.9178.7-75.8-57.7000112.6I177 Y178 V179 Q184 A185 A210 L213 V217I177-F181 HydrophobicContact CG2-CD2 3.5Å; I177-F181 HydrophobicContact CG2-CE2 3.36Å; I177-F181 VanDerWaalsContact O-CD2 3.29Å; I177-F181 WeakPolarHBondContact O-CD2 3.38Å; I177-F181 PolarHBondContact O-N 3.43Å; Y178-F181 PolarHBondContact O-N 3.42Å; V179-F181 PolarHBondContact O-N 3.49Å; F181-Q184 PolarHBondContact O-N 3.44Å; F181-A185 VanDerWaalsContact O-CB 3.23Å; F181-A185 WeakPolarHBondContact O-CB 3.34Å; F181-A185 PolarHBondContact O-N 3.47Å; F181-A210 HydrophobicContact CB-CB 3.81Å; F181-L213 HydrophobicContact CB-CD1 4.44Å; F181-L213 HydrophobicContact CD1-CB 4.23Å; F181-L213 HydrophobicContact CD1-CD1 3.65Å; F181-L213 HydrophobicContact CD2-CB 3.62Å; F181-L213 HydrophobicContact CE1-CB 4.29Å; F181-L213 HydrophobicContact CE1-CD1 3.94Å; F181-L213 HydrophobicContact CE2-CB 3.68Å; F181-L213 HydrophobicContact CG-CB 3.92Å; F181-L213 HydrophobicContact CG-CD1 3.98Å; F181-L213 HydrophobicContact CZ-CB 4.04Å; F181-L213 HydrophobicContact CZ-CD1 4.49Å; F181-V217 HydrophobicContact CE2-CG2 4.07Å; F181-V217 HydrophobicContact CZ-CG2 4.32Å
182Y91.9Very high89.2Confident56 Ų5670.2 Ų70.222%0.2239%0.388CS..Hα-helixtrans-64.7-46.9177.4178.7-95.1000111.4Y178 V179 A185 K186 N203 C206Y178-Y182 WeakPolarHBondContact O-CB 3.29Å; Y178-Y182 PolarHBondContact O-N 3.4Å; V179-Y182 PolarHBondContact O-N 3.04Å; Y182-A185 PolarHBondContact O-N 2.68Å; Y182-K186 HydrophobicContact CE1-CD 4.07Å; Y182-K186 VanDerWaalsContact O-CB 3.27Å; Y182-K186 WeakPolarHBondContact O-CB 3.49Å; Y182-K186 PolarHBondContact O-N 2.81Å; Y182-N203 PolarHBondContact OH-OD1 3.02Å; Y182-C206 HydrophobicContact CD2-CB 4.06Å; Y182-C206 HydrophobicContact CE2-CB 3.93Å
183S90.8Very high88.4Confident66 Ų6671.4 Ų71.446%0.46239%0.392SS..Hα-helixtrans-62.2-42.5176.7-70.10000111.9V179 K186 A187V179-S183 WeakPolarHBondContact O-CB 3.49Å; V179-S183 PolarHBondContact O-N 3.43Å; V179-S183 PolarHBondContact O-OG 3.33Å; S183-K186 PolarHBondContact O-N 3.37Å; S183-A187 VanDerWaalsContact O-CB 3.31Å; S183-A187 WeakPolarHBondContact O-CB 3.49Å; S183-A187 PolarHBondContact O-N 2.77Å
184Q93Very high87.3Confident114 Ų11471.8 Ų71.853%0.53340%0.396SS..Hα-helixtrans-66.4-45.9175.7-74.5-161.470.100112.3M180 F181 K186 A187 S188M180-Q184 WeakPolarHBondContact O-CG 3Å; M180-Q184 PolarHBondContact O-N 2.81Å; F181-Q184 PolarHBondContact O-N 3.44Å; Q184-K186 VanDerWaalsContact C-N 3.29Å; Q184-K186 PolarHBondContact O-N 3.48Å; Q184-A187 PolarHBondContact O-N 2.91Å; Q184-S188 PolarHBondContact O-N 3.37Å; Q184-S188 VanDerWaalsContact O-N 3.14Å; Q184-S188 PolarHBondContact O-OG 3.27Å
185A91.1Very high86.3Confident17 Ų1775.4 Ų75.414%0.1442%0.424CS..Hα-helixtrans-57.8-45.6176.700000110.9F181 Y182 S188 L189 C206 L209F181-A185 VanDerWaalsContact O-CB 3.23Å; F181-A185 WeakPolarHBondContact O-CB 3.34Å; F181-A185 PolarHBondContact O-N 3.47Å; Y182-A185 PolarHBondContact O-N 2.68Å; A185-S188 PolarHBondContact O-N 2.98Å; A185-L189 WeakPolarHBondContact O-CD1 3.38Å; A185-C206 HydrophobicContact CB-CB 4.03Å; A185-L209 HydrophobicContact CB-CD2 4.39Å
186K88.8Confident85.9Confident86 Ų8675.4 Ų75.437%0.37442%0.424SS..Hα-helixtrans-67.2-35.8178.8-169.6171.8-176.8168.50113.2Y182 S183 Q184 S188 L189 N203Y182-K186 HydrophobicContact CE1-CD 4.07Å; Y182-K186 VanDerWaalsContact O-CB 3.27Å; Y182-K186 WeakPolarHBondContact O-CB 3.49Å; Y182-K186 PolarHBondContact O-N 2.81Å; S183-K186 PolarHBondContact O-N 3.37Å; Q184-K186 VanDerWaalsContact C-N 3.29Å; Q184-K186 PolarHBondContact O-N 3.48Å; K186-S188 VanDerWaalsContact C-N 3.26Å; K186-S188 PolarHBondContact O-N 3.01Å; K186-L189 PolarHBondContact O-N 2.95Å; K186-N203 WeakPolarHBondContact CE-OD1 3.05Å; K186-N203 PolarHBondContact NZ-OD1 3.42Å
187A88.8Confident85.2Confident84 Ų8480.4 Ų80.469%0.69446%0.456SS*.Hα-helixtrans-67-28.7176.700000112.6S183 Q184 L189S183-A187 VanDerWaalsContact O-CB 3.31Å; S183-A187 WeakPolarHBondContact O-CB 3.49Å; S183-A187 PolarHBondContact O-N 2.77Å; Q184-A187 PolarHBondContact O-N 2.91Å; A187-L189 VanDerWaalsContact C-N 3.27Å; A187-L189 PolarHBondContact O-N 3.02Å
188S89Confident84.5Confident100 Ų10082.4 Ų82.470%0.69947%0.473SS*.THydrogen-bonded Turntrans-79-5.2175.6-57.40000113.9Q184 A185 K186Q184-S188 PolarHBondContact O-N 3.37Å; Q184-S188 VanDerWaalsContact O-N 3.14Å; Q184-S188 PolarHBondContact O-OG 3.27Å; A185-S188 PolarHBondContact O-N 2.98Å; K186-S188 VanDerWaalsContact C-N 3.26Å; K186-S188 PolarHBondContact O-N 3.01Å
189L87.9Confident84.1Confident45 Ų4579.4 Ų79.424%0.23646%0.464CS..SBendtrans-81.3133.8177.2-94.367.5000110.7A185 K186 A187 I193 A202 C206A185-L189 WeakPolarHBondContact O-CD1 3.38Å; K186-L189 PolarHBondContact O-N 2.95Å; A187-L189 VanDerWaalsContact C-N 3.27Å; A187-L189 PolarHBondContact O-N 3.02Å; L189-I193 HydrophobicContact CD2-CG2 4.48Å; L189-A202 HydrophobicContact CD2-CB 3.6Å; L189-C206 VanDerWaalsContact CD1-SG 3.55Å
190P85.1Confident83.7Confident74 Ų7478.4 Ų78.448%0.48146%0.459SS..  trans-53.2141.3169.5-25.832.8000112.3E192 I193 S194P190-E192 PolarHBondContact O-N 3.5Å; P190-I193 HydrophobicContact CB-CD1 4.33Å; P190-I193 HydrophobicContact CB-CG1 4.38Å; P190-I193 HydrophobicContact CG-CD1 4.04Å; P190-I193 PolarHBondContact O-N 3.2Å; P190-I193 VanDerWaalsContact O-N 3.09Å; P190-S194 PolarHBondContact O-N 2.92Å
191Q77.9Confident83.4Confident175 Ų17578 Ų7882%0.81846%0.462SS*.Hα-helixtrans-61-32.5-177.1-144.7172.5-0.400111.8I193 S194 S195Q191-I193 VanDerWaalsContact C-N 3.34Å; Q191-I193 PolarHBondContact O-N 2.88Å; Q191-S194 PolarHBondContact O-N 2.97Å; Q191-S195 PolarHBondContact O-N 3.39Å; Q191-S195 PolarHBondContact O-OG 3.4Å
192E74.1Confident83.1Confident160 Ų16076.6 Ų76.675%0.74846%0.458SS*.Hα-helixtrans-61.4-36.1176-63.8-178.5172.600113.6P190 S194 S195 S196P190-E192 PolarHBondContact O-N 3.5Å; E192-S194 VanDerWaalsContact C-N 3.34Å; E192-S195 PolarHBondContact O-OG 3.03Å; E192-S196 WeakPolarHBondContact O-CB 3.39Å; E192-S196 PolarHBondContact O-N 3.28Å
193I75.5Confident83Confident70 Ų7076.4 Ų76.436%0.35946%0.461SS..Hα-helixtrans-76.9-27.7178.9-61.6176.2000110.7L189 P190 Q191 S196 A199 A202L189-I193 HydrophobicContact CD2-CG2 4.48Å; P190-I193 HydrophobicContact CB-CD1 4.33Å; P190-I193 HydrophobicContact CB-CG1 4.38Å; P190-I193 HydrophobicContact CG-CD1 4.04Å; P190-I193 PolarHBondContact O-N 3.2Å; P190-I193 VanDerWaalsContact O-N 3.09Å; Q191-I193 VanDerWaalsContact C-N 3.34Å; Q191-I193 PolarHBondContact O-N 2.88Å; I193-S196 PolarHBondContact O-OG 3.25Å; I193-A199 WeakPolarHBondContact O-CA 3.15Å; I193-A202 HydrophobicContact CG2-CB 3.85Å
194S69.6Low82.9Confident51 Ų5175.8 Ų75.836%0.35745%0.45SS..Hα-helixtrans-75-24.7179-65.40000113.3P190 Q191 E192 A199P190-S194 PolarHBondContact O-N 2.92Å; Q191-S194 PolarHBondContact O-N 2.97Å; E192-S194 VanDerWaalsContact C-N 3.34Å; S194-A199 VanDerWaalsContact O-CB 3.28Å; S194-A199 WeakPolarHBondContact O-CB 3.38Å
195S68.9Low82.9Confident102 Ų10273.4 Ų73.471%0.71345%0.446SS*.Hα-helixtrans-101.5-5.8177.953.60000114.2Q191 E192Q191-S195 PolarHBondContact O-N 3.39Å; Q191-S195 PolarHBondContact O-OG 3.4Å; E192-S195 PolarHBondContact O-OG 3.03Å
196S77.6Confident82.9Confident47 Ų4772.9 Ų72.933%0.32944%0.441SS..SBendtrans-84.7168.8-179.272.40000112.7E192 I193 S198 A199E192-S196 WeakPolarHBondContact O-CB 3.39Å; E192-S196 PolarHBondContact O-N 3.28Å; I193-S196 PolarHBondContact O-OG 3.25Å; S196-S198 PolarHBondContact O-N 2.75Å; S196-S198 PolarHBondContact OG-N 3.37Å; S196-A199 VanDerWaalsContact O-CB 3.27Å; S196-A199 WeakPolarHBondContact O-CB 3.26Å; S196-A199 PolarHBondContact O-N 2.99Å
197S75.8Confident83Confident125 Ų12569.3 Ų69.387%0.87443%0.429SS*.THydrogen-bonded Turntrans-54.8-21.2170.9-174.90000112.9P200S197-P200 VanDerWaalsContact O-CD 3.25Å; S197-P200 WeakPolarHBondContact O-CD 3.5Å
198S79.8Confident83.3Confident71 Ų7166.8 Ų66.850%0.49741%0.405SS..THydrogen-bonded Turntrans-83.4-5177.9-520000114.8S196 P200 V201 A202S196-S198 PolarHBondContact O-N 2.75Å; S196-S198 PolarHBondContact OG-N 3.37Å; S198-P200 VanDerWaalsContact C-N 3.3Å; S198-V201 PolarHBondContact O-N 2.88Å; S198-V201 VanDerWaalsContact O-N 3.16Å; S198-A202 PolarHBondContact O-N 3.09Å
199A82.5Confident83.5Confident15 Ų1566.3 Ų66.312%0.12439%0.394CS..Hα-helixtrans-51.6-38.8-179.900000114.3I193 S194 S196 A202 N203I193-A199 WeakPolarHBondContact O-CA 3.15Å; S194-A199 VanDerWaalsContact O-CB 3.28Å; S194-A199 WeakPolarHBondContact O-CB 3.38Å; S196-A199 VanDerWaalsContact O-CB 3.27Å; S196-A199 WeakPolarHBondContact O-CB 3.26Å; S196-A199 PolarHBondContact O-N 2.99Å; A199-A202 PolarHBondContact O-N 3.42Å; A199-N203 WeakPolarHBondContact O-CB 3.43Å; A199-N203 VanDerWaalsContact O-CG 3.3Å; A199-N203 PolarHBondContact O-N 2.96Å; A199-N203 PolarHBondContact O-ND2 2.98Å
200P83.3Confident83.9Confident51 Ų5164.2 Ų64.233%0.33138%0.383SS..Hα-helixtrans-69.2-38.8180-18.232.4000113.6S197 S198 A202 N203 F204 W271S197-P200 VanDerWaalsContact O-CD 3.25Å; S197-P200 WeakPolarHBondContact O-CD 3.5Å; S198-P200 VanDerWaalsContact C-N 3.3Å; P200-A202 VanDerWaalsContact C-N 3.32Å; P200-N203 PolarHBondContact O-N 2.71Å; P200-F204 WeakPolarHBondContact O-CB 2.97Å; P200-F204 PolarHBondContact O-N 2.89Å; P200-W271 HydrophobicContact CB-CH2 3.11Å; P200-W271 HydrophobicContact CB-CZ2 3.92Å; P200-W271 HydrophobicContact CB-CZ3 3.77Å; P200-W271 HydrophobicContact CG-CH2 4.36Å
201V86.1Confident84.2Confident84 Ų8461 Ų6151%0.50936%0.363SS..Hα-helixtrans-66.2-37.7174.6178.60000111S198 F204 S205S198-V201 PolarHBondContact O-N 2.88Å; S198-V201 VanDerWaalsContact O-N 3.16Å; V201-F204 WeakPolarHBondContact O-CB 3.42Å; V201-F204 PolarHBondContact O-N 2.86Å; V201-S205 WeakPolarHBondContact O-CB 3.46Å; V201-S205 PolarHBondContact O-N 3.08Å; V201-S205 PolarHBondContact O-OG 2.69Å
202A88.1Confident85.1Confident16 Ų1654.3 Ų54.313%0.13234%0.335CS..Hα-helixtrans-66.4-45.3176.900000111.4L189 I193 S198 A199 P200 F204 S205 C206L189-A202 HydrophobicContact CD2-CB 3.6Å; I193-A202 HydrophobicContact CG2-CB 3.85Å; S198-A202 PolarHBondContact O-N 3.09Å; A199-A202 PolarHBondContact O-N 3.42Å; P200-A202 VanDerWaalsContact C-N 3.32Å; A202-F204 VanDerWaalsContact C-N 3.34Å; A202-F204 PolarHBondContact O-N 3.42Å; A202-S205 PolarHBondContact O-N 3.18Å; A202-C206 PolarHBondContact O-N 3.3Å; A202-C206 PolarHBondContact O-SG 3.06Å
203N89.1Confident86.1Confident51 Ų5149.5 Ų49.527%0.27331%0.313SS..Hα-helixtrans-61.9-40.5173.6-76.2-54.5000112Y182 K186 A199 P200 C206 G207Y182-N203 PolarHBondContact OH-OD1 3.02Å; K186-N203 WeakPolarHBondContact CE-OD1 3.05Å; K186-N203 PolarHBondContact NZ-OD1 3.42Å; A199-N203 WeakPolarHBondContact O-CB 3.43Å; A199-N203 VanDerWaalsContact O-CG 3.3Å; A199-N203 PolarHBondContact O-N 2.96Å; A199-N203 PolarHBondContact O-ND2 2.98Å; P200-N203 PolarHBondContact O-N 2.71Å; N203-C206 PolarHBondContact O-N 2.74Å; N203-G207 PolarHBondContact O-N 3.41Å
204F90Very high87Confident54 Ų5446.1 Ų46.124%0.23730%0.296CS..Hα-helixtrans-59.4-48.3174.5173.7-99.4000111.6P200 V201 A202 C206 G207 V208 A267 A268 W271P200-F204 WeakPolarHBondContact O-CB 2.97Å; P200-F204 PolarHBondContact O-N 2.89Å; V201-F204 WeakPolarHBondContact O-CB 3.42Å; V201-F204 PolarHBondContact O-N 2.86Å; A202-F204 VanDerWaalsContact C-N 3.34Å; A202-F204 PolarHBondContact O-N 3.42Å; F204-C206 PolarHBondContact O-N 3.47Å; F204-G207 WeakPolarHBondContact O-CA 3.22Å; F204-G207 PolarHBondContact O-N 3.02Å; F204-G207 VanDerWaalsContact O-N 3.09Å; F204-V208 HydrophobicContact CD1-CG2 4.32Å; F204-V208 HydrophobicContact CE1-CG2 3.81Å; F204-V208 HydrophobicContact CE2-CG2 4.12Å; F204-V208 HydrophobicContact CZ-CG2 3.7Å; F204-V208 PolarHBondContact O-N 3.17Å; F204-A267 VanDerWaalsContact CE2-C 3.49Å; F204-A267 HydrophobicContact CE2-CB 3.96Å; F204-A267 WeakPolarHBondContact CE2-O 3.07Å; F204-A267 HydrophobicContact CZ-CB 4.47Å; F204-A268 HydrophobicContact CZ-CB 4.06Å; F204-W271 HydrophobicContact CB-CD2 4.38Å; F204-W271 HydrophobicContact CB-CE3 4.22Å; F204-W271 HydrophobicContact CD2-CB 3.62Å; F204-W271 HydrophobicContact CD2-CD2 4.17Å; F204-W271 HydrophobicContact CD2-CE3 4.33Å; F204-W271 AromaticContact CD2-CG 3.85Å; F204-W271 HydrophobicContact CD2-CG 3.85Å; F204-W271 HydrophobicContact CE2-CB 3.63Å; F204-W271 HydrophobicContact CE2-CG 4.16Å; F204-W271 HydrophobicContact CG-CD2 4.41Å; F204-W271 HydrophobicContact CG-CG 4.35Å
205S91.1Very high88.2Confident63 Ų6343.7 Ų43.744%0.44128%0.279SS..Hα-helixtrans-62.1-42.3179-57.40000111.9V201 A202 G207 V208 L209V201-S205 WeakPolarHBondContact O-CB 3.46Å; V201-S205 PolarHBondContact O-N 3.08Å; V201-S205 PolarHBondContact O-OG 2.69Å; A202-S205 PolarHBondContact O-N 3.18Å; S205-G207 VanDerWaalsContact C-N 3.31Å; S205-G207 PolarHBondContact O-N 3.01Å; S205-V208 PolarHBondContact O-N 3.06Å; S205-L209 WeakPolarHBondContact O-CB 3.24Å; S205-L209 PolarHBondContact O-N 3.32Å
206C91.6Very high89.4Confident7 Ų741.7 Ų41.75%0.04726%0.26CS..Hα-helixtrans-59.9-41.5172.6-65.80000111.7Y182 A185 L189 A202 N203 F204 L209 A210Y182-C206 HydrophobicContact CD2-CB 4.06Å; Y182-C206 HydrophobicContact CE2-CB 3.93Å; A185-C206 HydrophobicContact CB-CB 4.03Å; L189-C206 VanDerWaalsContact CD1-SG 3.55Å; A202-C206 PolarHBondContact O-N 3.3Å; A202-C206 PolarHBondContact O-SG 3.06Å; N203-C206 PolarHBondContact O-N 2.74Å; F204-C206 PolarHBondContact O-N 3.47Å; C206-L209 PolarHBondContact O-N 2.89Å; C206-A210 VanDerWaalsContact O-CB 3.25Å; C206-A210 WeakPolarHBondContact O-CB 3.28Å; C206-A210 PolarHBondContact O-N 3.35Å
207G92.1Very high90.3Very high11 Ų1143.4 Ų43.411%0.11327%0.269CS..Hα-helixtrans-63-43.9176.100000113N203 F204 S205 G211N203-G207 PolarHBondContact O-N 3.41Å; F204-G207 WeakPolarHBondContact O-CA 3.22Å; F204-G207 PolarHBondContact O-N 3.02Å; F204-G207 VanDerWaalsContact O-N 3.09Å; S205-G207 VanDerWaalsContact C-N 3.31Å; S205-G207 PolarHBondContact O-N 3.01Å; G207-G211 PolarHBondContact O-N 2.68Å
208V93.9Very high91.2Very high30 Ų3037.7 Ų37.718%0.18223%0.229CC..Hα-helixtrans-62.4-49.4175.7171.80000110.6F204 S205 A210 G211 V212 T264 A267F204-V208 HydrophobicContact CD1-CG2 4.32Å; F204-V208 HydrophobicContact CE1-CG2 3.81Å; F204-V208 HydrophobicContact CE2-CG2 4.12Å; F204-V208 HydrophobicContact CZ-CG2 3.7Å; F204-V208 PolarHBondContact O-N 3.17Å; S205-V208 PolarHBondContact O-N 3.06Å; V208-A210 PolarHBondContact O-N 2.66Å; V208-G211 PolarHBondContact O-N 3.37Å; V208-V212 HydrophobicContact CG1-CG2 4.48Å; V208-V212 WeakPolarHBondContact O-CG2 3.3Å; V208-V212 PolarHBondContact O-N 3.22Å; V208-T264 HydrophobicContact CG1-CG2 3.91Å; V208-T264 HydrophobicContact CG2-CG2 4.47Å; V208-A267 HydrophobicContact CG2-CB 4.03Å
209L94.6Very high91.9Very high91 Ų9134.4 Ų34.448%0.47621%0.205SC..Hα-helixtrans-58.8-49.1179179.460.3000111.4A185 S205 C206 G211 V212 L213A185-L209 HydrophobicContact CB-CD2 4.39Å; S205-L209 WeakPolarHBondContact O-CB 3.24Å; S205-L209 PolarHBondContact O-N 3.32Å; C206-L209 PolarHBondContact O-N 2.89Å; L209-G211 VanDerWaalsContact C-N 3.31Å; L209-G211 PolarHBondContact O-N 3.05Å; L209-V212 PolarHBondContact O-N 2.95Å; L209-L213 HydrophobicContact CD1-CD1 4Å; L209-L213 HydrophobicContact CD1-CG 4.16Å; L209-L213 HydrophobicContact CG-CD1 4.03Å; L209-L213 WeakPolarHBondContact O-CG 3.41Å; L209-L213 PolarHBondContact O-N 3.45Å
210A94.5Very high92.6Very high0 Ų035.7 Ų35.70%021%0.212CC..Hα-helixtrans-60.1-40.9176.800000112.2Y178 F181 C206 V208 A214Y178-A210 HydrophobicContact CD2-CB 3.98Å; Y178-A210 HydrophobicContact CE2-CB 3.96Å; F181-A210 HydrophobicContact CB-CB 3.81Å; C206-A210 VanDerWaalsContact O-CB 3.25Å; C206-A210 WeakPolarHBondContact O-CB 3.28Å; C206-A210 PolarHBondContact O-N 3.35Å; V208-A210 PolarHBondContact O-N 2.66Å; A210-A214 WeakPolarHBondContact O-CB 3.23Å; A210-A214 PolarHBondContact O-N 2.92Å
211G93.3Very high93.1Very high7 Ų733.8 Ų33.87%0.07220%0.201CC..Hα-helixtrans-64.4-39.2177.100000113.6G207 V208 L209 S215G207-G211 PolarHBondContact O-N 2.68Å; V208-G211 PolarHBondContact O-N 3.37Å; L209-G211 VanDerWaalsContact C-N 3.31Å; L209-G211 PolarHBondContact O-N 3.05Å; G211-S215 VanDerWaalsContact O-CB 3.28Å; G211-S215 WeakPolarHBondContact O-CB 3.28Å; G211-S215 PolarHBondContact O-N 3.2Å; G211-S215 VanDerWaalsContact O-N 3.09Å; G211-S215 PolarHBondContact O-OG 3.29Å
212V95.5Very high93.5Very high35 Ų3529.9 Ų29.921%0.21218%0.177CC..Hα-helixtrans-67.5-52.3175.31700000110.2V208 L209 A214 S215 L216 C260V208-V212 HydrophobicContact CG1-CG2 4.48Å; V208-V212 WeakPolarHBondContact O-CG2 3.3Å; V208-V212 PolarHBondContact O-N 3.22Å; L209-V212 PolarHBondContact O-N 2.95Å; V212-A214 PolarHBondContact O-N 3.49Å; V212-S215 WeakPolarHBondContact O-CA 3.32Å; V212-S215 WeakPolarHBondContact O-CB 3.38Å; V212-S215 PolarHBondContact O-N 3.4Å; V212-L216 HydrophobicContact CG1-CD1 4.14Å; V212-L216 HydrophobicContact CG1-CG 4.48Å; V212-L216 WeakPolarHBondContact O-CG 3Å; V212-L216 PolarHBondContact O-N 3.42Å; V212-C260 HydrophobicContact CG2-CB 4.28Å
213L95.5Very high93.8Very high58 Ų5829.1 Ų29.130%0.30417%0.171SC..Hα-helixtrans-60.4-45.4-179.7-67.9174.9000111.9F181 L209 S215 L216 V217F181-L213 HydrophobicContact CB-CD1 4.44Å; F181-L213 HydrophobicContact CD1-CB 4.23Å; F181-L213 HydrophobicContact CD1-CD1 3.65Å; F181-L213 HydrophobicContact CD2-CB 3.62Å; F181-L213 HydrophobicContact CE1-CB 4.29Å; F181-L213 HydrophobicContact CE1-CD1 3.94Å; F181-L213 HydrophobicContact CE2-CB 3.68Å; F181-L213 HydrophobicContact CG-CB 3.92Å; F181-L213 HydrophobicContact CG-CD1 3.98Å; F181-L213 HydrophobicContact CZ-CB 4.04Å; F181-L213 HydrophobicContact CZ-CD1 4.49Å; L209-L213 HydrophobicContact CD1-CD1 4Å; L209-L213 HydrophobicContact CD1-CG 4.16Å; L209-L213 HydrophobicContact CG-CD1 4.03Å; L209-L213 WeakPolarHBondContact O-CG 3.41Å; L209-L213 PolarHBondContact O-N 3.45Å; L213-S215 PolarHBondContact O-N 2.78Å; L213-L216 PolarHBondContact O-N 2.93Å; L213-V217 WeakPolarHBondContact O-CG2 3.25Å; L213-V217 PolarHBondContact O-N 2.95Å
214A94.2Very high94.1Very high0 Ų027 Ų270%016%0.16CC..Hα-helixtrans-61.3-34.5174.900000112.6F174 I177 A210 V212 T218F174-A214 HydrophobicContact CD2-CB 4.15Å; F174-A214 HydrophobicContact CE2-CB 3.88Å; F174-A214 HydrophobicContact CZ-CB 4.42Å; I177-A214 HydrophobicContact CB-CB 4.26Å; I177-A214 HydrophobicContact CG2-CB 3.76Å; A210-A214 WeakPolarHBondContact O-CB 3.23Å; A210-A214 PolarHBondContact O-N 2.92Å; V212-A214 PolarHBondContact O-N 3.49Å; A214-T218 PolarHBondContact O-N 3.09Å; A214-T218 VanDerWaalsContact O-N 3.16Å; A214-T218 PolarHBondContact O-OG1 2.92Å
215S94.1Very high94.3Very high0 Ų024.6 Ų24.60%015%0.149CC..Hα-helixtrans-70.7-37.3176.4-64.20000112.5G211 V212 L213 T218 Q219 R259G211-S215 VanDerWaalsContact O-CB 3.28Å; G211-S215 WeakPolarHBondContact O-CB 3.28Å; G211-S215 PolarHBondContact O-N 3.2Å; G211-S215 VanDerWaalsContact O-N 3.09Å; G211-S215 PolarHBondContact O-OG 3.29Å; V212-S215 WeakPolarHBondContact O-CA 3.32Å; V212-S215 WeakPolarHBondContact O-CB 3.38Å; V212-S215 PolarHBondContact O-N 3.4Å; L213-S215 PolarHBondContact O-N 2.78Å; S215-T218 CarbonylContact O-C 3.41Å; S215-Q219 WeakPolarHBondContact O-CB 3.28Å; S215-Q219 PolarHBondContact O-N 3.47Å; S215-R259 PolarHBondContact O-NH1 3.42Å
216L95.3Very high94.4Very high59 Ų5921.8 Ų21.831%0.30913%0.13SC..Hα-helixtrans-67.4-45.2175.9-68.6174.5000111.6V212 L213 T218 Q219 A256V212-L216 HydrophobicContact CG1-CD1 4.14Å; V212-L216 HydrophobicContact CG1-CG 4.48Å; V212-L216 WeakPolarHBondContact O-CG 3Å; V212-L216 PolarHBondContact O-N 3.42Å; L213-L216 PolarHBondContact O-N 2.93Å; L216-T218 VanDerWaalsContact C-N 3.28Å; L216-T218 PolarHBondContact O-N 2.69Å; L216-Q219 WeakPolarHBondContact O-CB 3.38Å; L216-Q219 PolarHBondContact O-N 3.15Å; L216-Q219 VanDerWaalsContact O-N 3.08Å; L216-A256 HydrophobicContact CD2-CB 4.09Å
217V95.6Very high94.4Very high84 Ų8421.5 Ų21.551%0.50913%0.127SC..Hα-helixtrans-60.9-39.5177.21740000111.3I177 F181 L213 Q219I177-V217 HydrophobicContact CD1-CB 4.42Å; I177-V217 HydrophobicContact CD1-CG1 3.74Å; I177-V217 HydrophobicContact CG2-CB 4.45Å; F181-V217 HydrophobicContact CE2-CG2 4.07Å; F181-V217 HydrophobicContact CZ-CG2 4.32Å; L213-V217 WeakPolarHBondContact O-CG2 3.25Å; L213-V217 PolarHBondContact O-N 2.95Å; V217-Q219 VanDerWaalsContact C-N 3.31Å; V217-Q219 PolarHBondContact O-N 3.36Å
218T95.3Very high94.4Very high5 Ų521.1 Ų21.13%0.03112%0.123CC..THydrogen-bonded Turntrans-91.412.6178.459.30000113.2P173 I177 A214 S215 L216 D222 R259P173-T218 HydrophobicContact CG-CG2 4.35Å; I177-T218 HydrophobicContact CD1-CG2 3.88Å; A214-T218 PolarHBondContact O-N 3.09Å; A214-T218 VanDerWaalsContact O-N 3.16Å; A214-T218 PolarHBondContact O-OG1 2.92Å; S215-T218 CarbonylContact O-C 3.41Å; L216-T218 VanDerWaalsContact C-N 3.28Å; L216-T218 PolarHBondContact O-N 2.69Å; T218-D222 PolarHBondContact O-N 3.46Å; T218-R259 PolarHBondContact O-NH1 3.18Å; T218-R259 PolarHBondContact OG1-NH2 3.14Å
219Q95.2Very high94.3Very high1 Ų119.7 Ų19.71%0.00511%0.114CC..Hα-helixtrans-70.7-45.9-179.4-172.264.58.900113.4S215 L216 V217 A221 D222 V223 F252 F253 R254 A256S215-Q219 WeakPolarHBondContact O-CB 3.28Å; S215-Q219 PolarHBondContact O-N 3.47Å; L216-Q219 WeakPolarHBondContact O-CB 3.38Å; L216-Q219 PolarHBondContact O-N 3.15Å; L216-Q219 VanDerWaalsContact O-N 3.08Å; V217-Q219 VanDerWaalsContact C-N 3.31Å; V217-Q219 PolarHBondContact O-N 3.36Å; Q219-A221 VanDerWaalsContact C-N 3.34Å; Q219-A221 PolarHBondContact O-N 2.94Å; Q219-D222 WeakPolarHBondContact O-CB 3.11Å; Q219-D222 PolarHBondContact O-N 3.38Å; Q219-V223 PolarHBondContact O-N 2.95Å; Q219-F252 WeakPolarHBondContact CG-O 3.44Å; Q219-F253 HydrophobicContact CB-CD1 4.27Å; Q219-F253 HydrophobicContact CB-CE1 4.43Å; Q219-F253 HydrophobicContact CG-CD1 4.19Å; Q219-R254 PolarHBondContact NE2-O 2.92Å; Q219-A256 HydrophobicContact CG-CB 4.2Å
220P95.6Very high94.1Very high42 Ų4215.4 Ų15.427%0.2739%0.092SC..Hα-helixtrans-58.5-44.5-179.4-26.536.4000112.7D222 V223 V224 F252 F253P220-D222 VanDerWaalsContact C-N 3.26Å; P220-D222 PolarHBondContact O-N 3.42Å; P220-V223 PolarHBondContact O-N 3.01Å; P220-V224 VanDerWaalsContact O-CG2 3.31Å; P220-V224 WeakPolarHBondContact O-CG2 3.24Å; P220-V224 PolarHBondContact O-N 3.39Å; P220-F252 HydrophobicContact CB-CB 4.03Å; P220-F252 HydrophobicContact CB-CD1 3.91Å; P220-F252 HydrophobicContact CB-CG 4.27Å; P220-F252 HydrophobicContact CG-CB 4.21Å; P220-F253 HydrophobicContact CG-CZ 4.49Å
221A95.1Very high93.7Very high12 Ų1216.6 Ų16.610%0.09910%0.098CC..Hα-helixtrans-61.7-35.117700000112.5L169 R170 Q219 K225L169-A221 HydrophobicContact CB-CB 4.18Å; L169-A221 HydrophobicContact CD2-CB 4.06Å; L169-A221 HydrophobicContact CG-CB 4.01Å; R170-A221 HydrophobicContact CB-CB 4.13Å; Q219-A221 VanDerWaalsContact C-N 3.34Å; Q219-A221 PolarHBondContact O-N 2.94Å; A221-K225 VanDerWaalsContact O-CB 3.22Å; A221-K225 WeakPolarHBondContact O-CB 3.38Å; A221-K225 PolarHBondContact O-N 3.36Å
222D94.7Very high92.8Very high1 Ų118.3 Ų18.31%0.00511%0.108CC..Hα-helixtrans-71.3-39.3177.5-177.486.6000112.6K34 Q38 R170 T218 Q219 P220 K225 T226 R259K34-D222 WeakPolarHBondContact CE-OD2 3.46Å; K34-D222 IonicContact NZ-OD1 2.88Å; K34-D222 PolarHBondContact NZ-OD1 2.8Å; K34-D222 IonicContact NZ-OD2 2.88Å; K34-D222 PolarHBondContact NZ-OD2 2.81Å; Q38-D222 PolarHBondContact NE2-OD2 3.1Å; R170-D222 WeakPolarHBondContact CD-OD1 3.36Å; R170-D222 HydrophobicContact CG-CB 4.01Å; R170-D222 IonicContact CZ-OD1 2.96Å; R170-D222 IonicContact NE-OD1 3.58Å; R170-D222 IonicContact NH1-OD1 3.72Å; R170-D222 PolarHBondContact NH1-OD1 3.13Å; T218-D222 PolarHBondContact O-N 3.46Å; Q219-D222 WeakPolarHBondContact O-CB 3.11Å; Q219-D222 PolarHBondContact O-N 3.38Å; P220-D222 VanDerWaalsContact C-N 3.26Å; P220-D222 PolarHBondContact O-N 3.42Å; D222-K225 WeakPolarHBondContact O-CB 3.25Å; D222-K225 PolarHBondContact O-N 3.07Å; D222-T226 PolarHBondContact O-N 3.08Å; D222-T226 PolarHBondContact O-OG1 2.68Å; D222-T226 VanDerWaalsContact O-OG1 3.06Å; D222-R259 IonicContact OD2-NH1 3.79Å
223V94.1Very high91.9Very high0 Ų025.3 Ų25.30%014%0.138CC..Hα-helixtrans-64.2-48.4173.8177.70000110.6Q38 Q219 P220 K225 T226 H227 I243 F252 R254Q38-V223 HydrophobicContact CG-CG2 4.23Å; Q219-V223 PolarHBondContact O-N 2.95Å; P220-V223 PolarHBondContact O-N 3.01Å; V223-K225 VanDerWaalsContact C-N 3.32Å; V223-K225 PolarHBondContact O-N 3.32Å; V223-T226 PolarHBondContact O-N 2.84Å; V223-T226 VanDerWaalsContact O-N 3.16Å; V223-H227 PolarHBondContact O-CD2 3.01Å; V223-H227 PolarHBondContact O-N 3.2Å; V223-I243 HydrophobicContact CG1-CD1 3.92Å; V223-F252 WeakPolarHBondContact CG2-O 3.45Å; V223-R254 WeakPolarHBondContact CG2-O 3.21Å
224V94.1Very high91.3Very high7 Ų724.8 Ų24.84%0.04214%0.136CC..Hα-helixtrans-59-45178.4174.10000110.9A166 P220 T226 H227 V228 T236 A239 V240 I243 F252A166-V224 HydrophobicContact CB-CB 4.43Å; A166-V224 HydrophobicContact CB-CG1 4.11Å; P220-V224 VanDerWaalsContact O-CG2 3.31Å; P220-V224 WeakPolarHBondContact O-CG2 3.24Å; P220-V224 PolarHBondContact O-N 3.39Å; V224-T226 PolarHBondContact O-N 2.86Å; V224-H227 PolarHBondContact O-N 3.18Å; V224-V228 HydrophobicContact CG1-CG2 4.43Å; V224-V228 WeakPolarHBondContact O-CG2 3.49Å; V224-V228 PolarHBondContact O-N 3.47Å; V224-V228 VanDerWaalsContact O-N 3.08Å; V224-T236 HydrophobicContact CG1-CG2 3.67Å; V224-A239 HydrophobicContact CG1-CB 4.28Å; V224-V240 HydrophobicContact CG1-CG2 4.07Å; V224-V240 HydrophobicContact CG2-CG2 3.65Å; V224-I243 HydrophobicContact CG2-CD1 3.95Å; V224-F252 HydrophobicContact CG2-CD1 4.27Å; V224-F252 HydrophobicContact CG2-CE1 3.88Å
225K94Very high91Very high4 Ų433.4 Ų33.42%0.01717%0.168CC..Hα-helixtrans-52.7-54.3173.7171.4-169.6175.1157.10110.9T128 A166 T167 R170 A221 D222 V223 H227 V228 Q229T128-K225 VanDerWaalsContact CG2-NZ 3.29Å; A166-K225 HydrophobicContact CB-CB 3.76Å; T167-K225 HydrophobicContact CG2-CD 4.45Å; T167-K225 VanDerWaalsContact OG1-CD 3.23Å; T167-K225 WeakPolarHBondContact OG1-CD 3.37Å; T167-K225 WeakPolarHBondContact OG1-CE 3.42Å; T167-K225 WeakPolarHBondContact OG1-CG 3.27Å; T167-K225 PolarHBondContact OG1-NZ 2.76Å; R170-K225 VanDerWaalsContact CZ-NZ 3.3Å; A221-K225 VanDerWaalsContact O-CB 3.22Å; A221-K225 WeakPolarHBondContact O-CB 3.38Å; A221-K225 PolarHBondContact O-N 3.36Å; D222-K225 WeakPolarHBondContact O-CB 3.25Å; D222-K225 PolarHBondContact O-N 3.07Å; V223-K225 VanDerWaalsContact C-N 3.32Å; V223-K225 PolarHBondContact O-N 3.32Å; K225-H227 VanDerWaalsContact C-N 3.31Å; K225-H227 PolarHBondContact O-N 2.92Å; K225-V228 PolarHBondContact O-N 2.87Å; K225-Q229 VanDerWaalsContact CE-CD 3.43Å; K225-Q229 HydrophobicContact CG-CG 4.14Å; K225-Q229 WeakPolarHBondContact O-CB 3.45Å; K225-Q229 VanDerWaalsContact O-CG 3.27Å; K225-Q229 WeakPolarHBondContact O-CG 3.49Å; K225-Q229 PolarHBondContact O-N 3.46Å
226T93.3Very high90.7Very high4 Ų435 Ų353%0.02518%0.179CC..Hα-helixtrans-61.1-40.3-175.1-61.30000111.9T35 Q38 T39 D222 V223 V224 V230T35-T226 HydrophobicContact CG2-CG2 4.1Å; Q38-T226 HydrophobicContact CB-CG2 3.84Å; Q38-T226 PolarHBondContact OE1-OG1 3.27Å; T39-T226 HydrophobicContact CG2-CG2 3.5Å; T39-T226 VanDerWaalsContact CG2-CG2 3.5Å; D222-T226 PolarHBondContact O-N 3.08Å; D222-T226 PolarHBondContact O-OG1 2.68Å; D222-T226 VanDerWaalsContact O-OG1 3.06Å; V223-T226 PolarHBondContact O-N 2.84Å; V223-T226 VanDerWaalsContact O-N 3.16Å; V224-T226 PolarHBondContact O-N 2.86Å; T226-V230 WeakPolarHBondContact O-CB 3.46Å; T226-V230 WeakPolarHBondContact O-CG2 3.47Å; T226-V230 PolarHBondContact O-N 3.47Å
227H91.7Very high90.4Very high0 Ų037.4 Ų37.40%020%0.195CC..Hα-helixtrans-62.5-44.1175.8-88-96.9000113Q38 Q41 S42 V223 V224 K225 N231 A239Q38-H227 PolarHBondContact O-NE2 3.38Å; Q41-H227 PolarHBondContact OE1-NE2 2.97Å; S42-H227 PolarHBondContact OG-CE1 2.92Å; S42-H227 VanDerWaalsContact OG-CE1 3.27Å; S42-H227 PolarHBondContact OG-ND1 3.21Å; V223-H227 PolarHBondContact O-CD2 3.01Å; V223-H227 PolarHBondContact O-N 3.2Å; V224-H227 PolarHBondContact O-N 3.18Å; K225-H227 VanDerWaalsContact C-N 3.31Å; K225-H227 PolarHBondContact O-N 2.92Å; H227-N231 WeakPolarHBondContact O-CB 3.47Å; H227-N231 PolarHBondContact O-N 3.45Å; H227-N231 PolarHBondContact O-ND2 2.87Å; H227-A239 HydrophobicContact CB-CB 4.41Å
228V92.4Very high90.1Very high4 Ų437.3 Ų37.32%0.02419%0.189CC..Hα-helixtrans-70.7-38.7179.81740000111.7G163 V224 K225 V230 N231 A239G163-V228 VanDerWaalsContact N-CG1 3.26Å; V224-V228 HydrophobicContact CG1-CG2 4.43Å; V224-V228 WeakPolarHBondContact O-CG2 3.49Å; V224-V228 PolarHBondContact O-N 3.47Å; V224-V228 VanDerWaalsContact O-N 3.08Å; K225-V228 PolarHBondContact O-N 2.87Å; V228-V230 VanDerWaalsContact C-N 3.3Å; V228-V230 PolarHBondContact O-N 2.97Å; V228-N231 CarbonylContact O-C 3.34Å; V228-N231 PolarHBondContact O-N 3.09Å; V228-A239 HydrophobicContact CG2-CB 3.63Å
229Q92.6Very high89.8Confident0 Ų037 Ų370%019%0.188CC..Hα-helixtrans-70.8-27.4-179.1-68.9-168.8-30.800113.3V129 T132 R133 S162 T167 K225V129-Q229 HydrophobicContact CG2-CB 4.37Å; V129-Q229 HydrophobicContact CG2-CG 3.99Å; T132-Q229 WeakPolarHBondContact OG1-CB 3.43Å; R133-Q229 PolarHBondContact NE-O 3.44Å; S162-Q229 WeakPolarHBondContact O-CG 3.14Å; T167-Q229 PolarHBondContact OG1-NE2 2.98Å; K225-Q229 VanDerWaalsContact CE-CD 3.43Å; K225-Q229 HydrophobicContact CG-CG 4.14Å; K225-Q229 WeakPolarHBondContact O-CB 3.45Å; K225-Q229 VanDerWaalsContact O-CG 3.27Å; K225-Q229 WeakPolarHBondContact O-CG 3.49Å; K225-Q229 PolarHBondContact O-N 3.46Å
230V90.2Very high89.7Confident0 Ų039.9 Ų39.90%021%0.205CC..Hα-helixtrans-85.6-32175.4172.90000112T39 C136 Y139 T226 V228T39-V230 HydrophobicContact CG2-CB 4.22Å; T39-V230 HydrophobicContact CG2-CG1 4.34Å; T39-V230 HydrophobicContact CG2-CG2 3.64Å; C136-V230 HydrophobicContact CB-CG1 4.27Å; C136-V230 HydrophobicContact CB-CG2 3.81Å; Y139-V230 HydrophobicContact CE2-CG1 4.36Å; Y139-V230 PolarHBondContact OH-O 3.5Å; T226-V230 WeakPolarHBondContact O-CB 3.46Å; T226-V230 WeakPolarHBondContact O-CG2 3.47Å; T226-V230 PolarHBondContact O-N 3.47Å; V228-V230 VanDerWaalsContact C-N 3.3Å; V228-V230 PolarHBondContact O-N 2.97Å
231N86.7Confident89.5Confident25 Ų2547 Ų4713%0.13423%0.227CC..  trans-115.796.1179.1-54.4-71.8000110.1S42 R138 H227 V228 Q233 L234S42-N231 WeakPolarHBondContact CB-ND2 3.31Å; S42-N231 PolarHBondContact OG-ND2 2.88Å; R138-N231 PolarHBondContact NH1-OD1 3.4Å; H227-N231 WeakPolarHBondContact O-CB 3.47Å; H227-N231 PolarHBondContact O-N 3.45Å; H227-N231 PolarHBondContact O-ND2 2.87Å; V228-N231 CarbonylContact O-C 3.34Å; V228-N231 PolarHBondContact O-N 3.09Å; N231-Q233 PolarHBondContact O-N 2.9Å; N231-Q233 VanDerWaalsContact O-N 3.09Å; N231-L234 HydrophobicContact CB-CB 4.35Å; N231-L234 HydrophobicContact CB-CD1 3.7Å; N231-L234 HydrophobicContact CB-CG 3.97Å; N231-L234 PolarHBondContact O-N 3.32Å; N231-L234 VanDerWaalsContact O-N 3.08Å
232P72.8Confident89.1Confident44 Ų4449.7 Ų49.729%0.28624%0.235SC..THydrogen-bonded Turntrans-61.9-23.4-173.327.7-39000114.2E155 A159E155-P232 HydrophobicContact CG-CG 4.23Å; E155-P232 WeakPolarHBondContact OE2-CB 3.43Å; E155-P232 WeakPolarHBondContact OE2-CG 3.42Å; A159-P232 HydrophobicContact CB-CB 4.23Å
233Q77.7Confident88.8Confident181 Ų18149.7 Ų49.785%0.84624%0.235SC*.THydrogen-bonded Turntrans-79.2-18.8-179.6-66.2-179.8-20.500113.2N231N231-Q233 PolarHBondContact O-N 2.9Å; N231-Q233 VanDerWaalsContact O-N 3.09Å
234L82.9Confident88.6Confident48 Ų4856.2 Ų56.225%0.25126%0.26SS..  trans-83.4121.9-177.3-72.1176.5000110.9N231 E238N231-L234 HydrophobicContact CB-CB 4.35Å; N231-L234 HydrophobicContact CB-CD1 3.7Å; N231-L234 HydrophobicContact CB-CG 3.97Å; N231-L234 PolarHBondContact O-N 3.32Å; N231-L234 VanDerWaalsContact O-N 3.08Å; L234-E238 HydrophobicContact CD2-CB 4.32Å
235R87.1Confident88.3Confident180 Ų18060.7 Ų60.768%0.67929%0.288SS*.  trans-71.3158.4166.7-63.6179.8174.3-173.9-0.3110.3T237 E238 A239R235-T237 VanDerWaalsContact C-N 3.29Å; R235-T237 PolarHBondContact O-N 2.94Å; R235-E238 HydrophobicContact CB-CB 4.42Å; R235-E238 HydrophobicContact CB-CG 4.18Å; R235-E238 PolarHBondContact N-OE2 2.88Å; R235-E238 PolarHBondContact O-N 3.25Å; R235-A239 PolarHBondContact O-N 3.43Å
236T87.9Confident87.9Confident35 Ų3562.1 Ų62.122%0.21530%0.3CS..Hα-helixtrans-58.7-39.7179.9-56.10000112.4A166 V224 A239 V240A166-T236 HydrophobicContact CB-CG2 4.49Å; V224-T236 HydrophobicContact CG1-CG2 3.67Å; T236-A239 PolarHBondContact O-N 3.06Å; T236-V240 WeakPolarHBondContact O-CG2 3.22Å; T236-V240 PolarHBondContact O-N 2.99Å; T236-V240 VanDerWaalsContact O-N 3.08Å
237T89.1Confident87.3Confident108 Ų10864.5 Ų64.566%0.66331%0.311SS*.Hα-helixtrans-67.3-41.2177.448.50000112.4R235 V240 R241R235-T237 VanDerWaalsContact C-N 3.29Å; R235-T237 PolarHBondContact O-N 2.94Å; T237-V240 PolarHBondContact O-N 3.12Å; T237-R241 PolarHBondContact O-N 3.3Å
238E89.9Confident87.1Confident82 Ų8265.7 Ų65.738%0.38332%0.324SS..Hα-helixtrans-64.9-41.3176.1-68.2163.8-175.100111.2L234 R235 V240 R241 Y242L234-E238 HydrophobicContact CD2-CB 4.32Å; R235-E238 HydrophobicContact CB-CB 4.42Å; R235-E238 HydrophobicContact CB-CG 4.18Å; R235-E238 PolarHBondContact N-OE2 2.88Å; R235-E238 PolarHBondContact O-N 3.25Å; E238-V240 PolarHBondContact O-N 3.11Å; E238-R241 PolarHBondContact O-N 2.67Å; E238-Y242 VanDerWaalsContact O-CB 3.25Å; E238-Y242 WeakPolarHBondContact O-CB 3.16Å; E238-Y242 PolarHBondContact O-N 2.71Å
239A89.6Confident87Confident0 Ų071.4 Ų71.40%035%0.353CS..Hα-helixtrans-61.5-43.6174.700000111.7V224 H227 V228 R235 T236 Y242 I243V224-A239 HydrophobicContact CG1-CB 4.28Å; H227-A239 HydrophobicContact CB-CB 4.41Å; V228-A239 HydrophobicContact CG2-CB 3.63Å; R235-A239 PolarHBondContact O-N 3.43Å; T236-A239 PolarHBondContact O-N 3.06Å; A239-Y242 PolarHBondContact O-N 2.94Å; A239-I243 WeakPolarHBondContact O-CB 3.49Å; A239-I243 VanDerWaalsContact O-CD1 3.32Å; A239-I243 WeakPolarHBondContact O-CD1 3.33Å; A239-I243 WeakPolarHBondContact O-CG1 3.5Å; A239-I243 PolarHBondContact O-N 3.34Å
240V91.9Very high86.7Confident61 Ų6176.3 Ų76.337%0.3738%0.376SS..Hα-helixtrans-60-48.41751710000110.8V224 T236 T237 E238 Y242 I243 Y244 F252V224-V240 HydrophobicContact CG1-CG2 4.07Å; V224-V240 HydrophobicContact CG2-CG2 3.65Å; T236-V240 WeakPolarHBondContact O-CG2 3.22Å; T236-V240 PolarHBondContact O-N 2.99Å; T236-V240 VanDerWaalsContact O-N 3.08Å; T237-V240 PolarHBondContact O-N 3.12Å; E238-V240 PolarHBondContact O-N 3.11Å; V240-Y242 PolarHBondContact O-N 3.26Å; V240-I243 PolarHBondContact O-N 3.4Å; V240-Y244 WeakPolarHBondContact O-CB 3.35Å; V240-Y244 PolarHBondContact O-N 2.96Å; V240-F252 HydrophobicContact CG1-CE1 4.42Å; V240-F252 HydrophobicContact CG1-CZ 4.07Å
241R90.8Very high86.6Confident191 Ų19176.4 Ų76.472%0.72138%0.377SS*.Hα-helixtrans-59.7-48178.3-173.4177.6-176.1171.61.7110.9T237 E238 Y244 T245T237-R241 PolarHBondContact O-N 3.3Å; E238-R241 PolarHBondContact O-N 2.67Å; R241-Y244 PolarHBondContact O-N 3.01Å; R241-T245 HydrophobicContact CG-CG2 4.28Å; R241-T245 WeakPolarHBondContact O-CG2 3.36Å; R241-T245 PolarHBondContact O-N 2.87Å; R241-T245 PolarHBondContact O-OG1 3.35Å
242Y87.6Confident86.8Confident69 Ų6976.2 Ų76.227%0.27138%0.375SS..Hα-helixtrans-59.1-48.1179.5174.4-101.2000112.5Q41 E238 A239 V240 Y244 T245 A246Q41-Y242 PolarHBondContact O-OH 3.19Å; E238-Y242 VanDerWaalsContact O-CB 3.25Å; E238-Y242 WeakPolarHBondContact O-CB 3.16Å; E238-Y242 PolarHBondContact O-N 2.71Å; A239-Y242 PolarHBondContact O-N 2.94Å; V240-Y242 PolarHBondContact O-N 3.26Å; Y242-Y244 VanDerWaalsContact C-N 3.32Å; Y242-Y244 PolarHBondContact O-N 2.97Å; Y242-T245 PolarHBondContact O-N 2.91Å; Y242-T245 PolarHBondContact O-OG1 2.99Å; Y242-A246 WeakPolarHBondContact O-CB 3.3Å; Y242-A246 PolarHBondContact O-N 2.92Å
243I88.9Confident87.7Confident0 Ų078.9 Ų78.90%038%0.382CS..Hα-helixtrans-60.2-46.2178.7-67159.6000110V223 V224 A239 V240 H247 F252V223-I243 HydrophobicContact CG1-CD1 3.92Å; V224-I243 HydrophobicContact CG2-CD1 3.95Å; A239-I243 WeakPolarHBondContact O-CB 3.49Å; A239-I243 VanDerWaalsContact O-CD1 3.32Å; A239-I243 WeakPolarHBondContact O-CD1 3.33Å; A239-I243 WeakPolarHBondContact O-CG1 3.5Å; A239-I243 PolarHBondContact O-N 3.34Å; V240-I243 PolarHBondContact O-N 3.4Å; I243-H247 PolarHBondContact O-N 2.84Å; I243-F252 HydrophobicContact CB-CE1 4.15Å; I243-F252 HydrophobicContact CB-CE2 4.4Å; I243-F252 HydrophobicContact CB-CZ 3.98Å; I243-F252 HydrophobicContact CD1-CE1 4.21Å; I243-F252 HydrophobicContact CG2-CD1 4.01Å; I243-F252 HydrophobicContact CG2-CD2 3.94Å; I243-F252 HydrophobicContact CG2-CE1 3.89Å; I243-F252 HydrophobicContact CG2-CE2 3.81Å; I243-F252 HydrophobicContact CG2-CG 4.04Å; I243-F252 HydrophobicContact CG2-CZ 3.78Å
244Y90.3Very high88.2Confident138 Ų13872 Ų7254%0.54135%0.348SS..Hα-helixtrans-65.4-45.8-179.5-174.8-100.3000112.4V240 R241 Y242 G248 L249 F252V240-Y244 WeakPolarHBondContact O-CB 3.35Å; V240-Y244 PolarHBondContact O-N 2.96Å; R241-Y244 PolarHBondContact O-N 3.01Å; Y242-Y244 VanDerWaalsContact C-N 3.32Å; Y242-Y244 PolarHBondContact O-N 2.97Å; Y244-G248 WeakPolarHBondContact O-CA 3.39Å; Y244-G248 PolarHBondContact O-N 2.9Å; Y244-L249 HydrophobicContact CD2-CD2 4.21Å; Y244-L249 HydrophobicContact CE2-CD2 3.94Å; Y244-L249 HydrophobicContact CE2-CG 4.23Å; Y244-F252 HydrophobicContact CD2-CE2 4.32Å
245T88.1Confident88.5Confident100 Ų10070.1 Ų70.161%0.61334%0.34SS*.Hα-helixtrans-70.7-35.7-178.753.60000112.8R241 Y242R241-T245 HydrophobicContact CG-CG2 4.28Å; R241-T245 WeakPolarHBondContact O-CG2 3.36Å; R241-T245 PolarHBondContact O-N 2.87Å; R241-T245 PolarHBondContact O-OG1 3.35Å; Y242-T245 PolarHBondContact O-N 2.91Å; Y242-T245 PolarHBondContact O-OG1 2.99Å
246A83.8Confident88.7Confident34 Ų3462.2 Ų62.228%0.28131%0.314SS..Hα-helixtrans-85.5-30.7-17600000113.4Y242Y242-A246 WeakPolarHBondContact O-CB 3.3Å; Y242-A246 PolarHBondContact O-N 2.92Å
247H82.1Confident89Confident54 Ų5465.1 Ų65.125%0.2533%0.331CS..Hα-helixtrans-135.90.2-170.1-58.888.8000114.4I243 G251I243-H247 PolarHBondContact O-N 2.84Å; H247-G251 PolarHBondContact O-N 2.87Å
248G87.4Confident89.2Confident26 Ų2660.1 Ų60.127%0.26830%0.3SS..THydrogen-bonded Turntrans62.6-155.5-175.700000113.3Y244 E250 G251Y244-G248 WeakPolarHBondContact O-CA 3.39Å; Y244-G248 PolarHBondContact O-N 2.9Å; G248-E250 VanDerWaalsContact C-N 3.33Å; G248-E250 PolarHBondContact O-N 3.28Å; G248-G251 PolarHBondContact O-N 3.42Å
249L88.9Confident89.3Confident124 Ų12456.8 Ų56.865%0.64928%0.284SS*.G310 helixtrans-67.5-31.4-179.4-67.5174.9000113.2Y244 G251 F252Y244-L249 HydrophobicContact CD2-CD2 4.21Å; Y244-L249 HydrophobicContact CE2-CD2 3.94Å; Y244-L249 HydrophobicContact CE2-CG 4.23Å; L249-G251 PolarHBondContact O-N 2.89Å; L249-F252 PolarHBondContact O-N 3.46Å
250E87.1Confident89.5Confident103 Ų10357.7 Ų57.748%0.48129%0.291SS..G310 helixtrans-63.1-28.5178.4-166.1-173145.900111.9R50 G248 F252 F253 R254R50-E250 IonicContact CZ-OE1 2.68Å; R50-E250 IonicContact CZ-OE2 3.85Å; R50-E250 IonicContact NH1-OE1 2.66Å; R50-E250 PolarHBondContact NH1-OE1 3Å; R50-E250 IonicContact NH1-OE2 2.71Å; R50-E250 PolarHBondContact NH1-OE2 2.9Å; R50-E250 IonicContact NH2-OE2 3.76Å; G248-E250 VanDerWaalsContact C-N 3.33Å; G248-E250 PolarHBondContact O-N 3.28Å; E250-F252 PolarHBondContact O-N 2.98Å; E250-F253 PolarHBondContact O-N 3.26Å; E250-R254 PolarHBondContact O-N 3.44Å
251G87.2Confident89.6Confident1 Ų158.2 Ų58.21%0.0129%0.291CS..G310 helixtrans-54.5-38.3175.700000113.3H247 G248 L249 F253 R254H247-G251 PolarHBondContact O-N 2.87Å; G248-G251 PolarHBondContact O-N 3.42Å; L249-G251 PolarHBondContact O-N 2.89Å; G251-F253 PolarHBondContact O-N 3.44Å; G251-R254 PolarHBondContact O-N 2.89Å
252F91.4Very high89.7Confident22 Ų2250.6 Ų50.610%0.09626%0.262CS..G310 helixtrans-72.3-14.5179.6-67.4-80.2000114Q219 P220 V223 V224 V240 I243 Y244 L249 E250Q219-F252 WeakPolarHBondContact CG-O 3.44Å; P220-F252 HydrophobicContact CB-CB 4.03Å; P220-F252 HydrophobicContact CB-CD1 3.91Å; P220-F252 HydrophobicContact CB-CG 4.27Å; P220-F252 HydrophobicContact CG-CB 4.21Å; V223-F252 WeakPolarHBondContact CG2-O 3.45Å; V224-F252 HydrophobicContact CG2-CD1 4.27Å; V224-F252 HydrophobicContact CG2-CE1 3.88Å; V240-F252 HydrophobicContact CG1-CE1 4.42Å; V240-F252 HydrophobicContact CG1-CZ 4.07Å; I243-F252 HydrophobicContact CB-CE1 4.15Å; I243-F252 HydrophobicContact CB-CE2 4.4Å; I243-F252 HydrophobicContact CB-CZ 3.98Å; I243-F252 HydrophobicContact CD1-CE1 4.21Å; I243-F252 HydrophobicContact CG2-CD1 4.01Å; I243-F252 HydrophobicContact CG2-CD2 3.94Å; I243-F252 HydrophobicContact CG2-CE1 3.89Å; I243-F252 HydrophobicContact CG2-CE2 3.81Å; I243-F252 HydrophobicContact CG2-CG 4.04Å; I243-F252 HydrophobicContact CG2-CZ 3.78Å; Y244-F252 HydrophobicContact CD2-CE2 4.32Å; L249-F252 PolarHBondContact O-N 3.46Å; E250-F252 PolarHBondContact O-N 2.98Å
253F91.8Very high89.8Confident100 Ų10050.9 Ų50.944%0.43926%0.263SS..G310 helixtrans-1053.3179.2-69.6-86.9000113.1Q219 P220 E250 G251 G255 A256Q219-F253 HydrophobicContact CB-CD1 4.27Å; Q219-F253 HydrophobicContact CB-CE1 4.43Å; Q219-F253 HydrophobicContact CG-CD1 4.19Å; P220-F253 HydrophobicContact CG-CZ 4.49Å; E250-F253 PolarHBondContact O-N 3.26Å; G251-F253 PolarHBondContact O-N 3.44Å; F253-G255 PolarHBondContact O-N 2.92Å; F253-A256 WeakPolarHBondContact O-CB 3.38Å; F253-A256 PolarHBondContact O-N 3.16Å
254R88.6Confident90Very high36 Ų3653.1 Ų53.114%0.13628%0.277CS..THydrogen-bonded Turntrans-61.8135.9172.5-80.5-137179.3157.34.2111.8Q38 Q219 V223 E250 G251 A256Q38-R254 WeakPolarHBondContact CG-O 3.38Å; Q38-R254 PolarHBondContact NE2-O 3.25Å; Q219-R254 PolarHBondContact NE2-O 2.92Å; V223-R254 WeakPolarHBondContact CG2-O 3.21Å; E250-R254 PolarHBondContact O-N 3.44Å; G251-R254 PolarHBondContact O-N 2.89Å; R254-A256 VanDerWaalsContact C-N 3.28Å; R254-A256 PolarHBondContact O-N 3.45Å
255G89.1Confident90.1Very high8 Ų850.4 Ų50.48%0.08227%0.27CS..THydrogen-bonded Turntrans777.6-173.100000114.4F253 P258 R259F253-G255 PolarHBondContact O-N 2.92Å; G255-P258 WeakPolarHBondContact O-CD 3.28Å; G255-P258 WeakPolarHBondContact O-CG 3.34Å; G255-R259 WeakPolarHBondContact O-CB 3.11Å; G255-R259 PolarHBondContact O-N 3.28Å
256A92.3Very high90.2Very high14 Ų1448.5 Ų48.512%0.11626%0.255CS..Hα-helixtrans-62-43.2175.500000111.8L216 Q219 F253 R254 R259 C260L216-A256 HydrophobicContact CD2-CB 4.09Å; Q219-A256 HydrophobicContact CG-CB 4.2Å; F253-A256 WeakPolarHBondContact O-CB 3.38Å; F253-A256 PolarHBondContact O-N 3.16Å; R254-A256 VanDerWaalsContact C-N 3.28Å; R254-A256 PolarHBondContact O-N 3.45Å; A256-R259 WeakPolarHBondContact O-CB 3.24Å; A256-R259 PolarHBondContact O-N 2.95Å; A256-C260 WeakPolarHBondContact O-CB 3.48Å; A256-C260 PolarHBondContact O-N 3.08Å; A256-C260 PolarHBondContact O-SG 3.47Å
257V93Very high90.4Very high97 Ų9748.5 Ų48.559%0.58825%0.254SS*.Hα-helixtrans-57-58.7178.7176.40000112.4M53 R259 C260 L261M53-V257 HydrophobicContact CE-CG1 4.41Å; M53-V257 HydrophobicContact SD-CG1 4.08Å; V257-R259 PolarHBondContact O-N 3.35Å; V257-C260 PolarHBondContact O-N 2.96Å; V257-L261 WeakPolarHBondContact O-CB 3.47Å; V257-L261 PolarHBondContact O-N 2.92Å
258P92.8Very high90.8Very high2 Ų247.7 Ų47.71%0.01326%0.257CS..Hα-helixtrans-63.1-30.4179.623.9-34.4000112.5K34 L37 M53 G255 R262K34-P258 HydrophobicContact CB-CB 4.07Å; K34-P258 HydrophobicContact CB-CG 3.8Å; K34-P258 HydrophobicContact CG-CG 4.27Å; L37-P258 HydrophobicContact CD1-CG 4.05Å; M53-P258 HydrophobicContact SD-CB 4.22Å; M53-P258 HydrophobicContact SD-CG 4.47Å; G255-P258 WeakPolarHBondContact O-CD 3.28Å; G255-P258 WeakPolarHBondContact O-CG 3.34Å; P258-R262 VanDerWaalsContact O-CB 3.29Å; P258-R262 WeakPolarHBondContact O-CB 3.49Å; P258-R262 PolarHBondContact O-N 3.36Å
259R93.1Very high90.9Very high12 Ų1248.8 Ų48.85%0.04526%0.256CS..Hα-helixtrans-65.8-47.9174.1-175.3-176.6180170.3-3.1112K34 S215 T218 D222 G255 A256 V257 R262 R263K34-R259 HydrophobicContact CD-CB 4.21Å; S215-R259 PolarHBondContact O-NH1 3.42Å; T218-R259 PolarHBondContact O-NH1 3.18Å; T218-R259 PolarHBondContact OG1-NH2 3.14Å; D222-R259 IonicContact OD2-NH1 3.79Å; G255-R259 WeakPolarHBondContact O-CB 3.11Å; G255-R259 PolarHBondContact O-N 3.28Å; A256-R259 WeakPolarHBondContact O-CB 3.24Å; A256-R259 PolarHBondContact O-N 2.95Å; V257-R259 PolarHBondContact O-N 3.35Å; R259-R262 PolarHBondContact O-N 3.17Å; R259-R263 WeakPolarHBondContact O-CG 3.43Å; R259-R263 PolarHBondContact O-N 3.27Å; R259-R263 VanDerWaalsContact O-N 3.13Å
260C94.2Very high90.8Very high20 Ų2046 Ų4614%0.13525%0.25CS..Hα-helixtrans-64.9-44.9178.6-65.40000110.4V212 A256 V257 R262 R263 T264V212-C260 HydrophobicContact CG2-CB 4.28Å; A256-C260 WeakPolarHBondContact O-CB 3.48Å; A256-C260 PolarHBondContact O-N 3.08Å; A256-C260 PolarHBondContact O-SG 3.47Å; V257-C260 PolarHBondContact O-N 2.96Å; C260-R262 VanDerWaalsContact C-N 3.35Å; C260-R262 PolarHBondContact O-N 3.43Å; C260-R263 WeakPolarHBondContact O-CB 3.12Å; C260-R263 PolarHBondContact O-N 3.2Å; C260-T264 PolarHBondContact O-N 3.46Å; C260-T264 PolarHBondContact O-OG1 3.49Å
261L94.2Very high90.8Very high71 Ų7143.7 Ų43.737%0.37224%0.237SC..Hα-helixtrans-56.5-48.3176.8-177.658.9000111.6L30 V257 R263 T264 M265L30-L261 HydrophobicContact CD1-CD2 4.35Å; L30-L261 HydrophobicContact CD1-CG 4.12Å; L30-L261 HydrophobicContact CD2-CD2 3.83Å; L30-L261 HydrophobicContact CD2-CG 4.46Å; V257-L261 WeakPolarHBondContact O-CB 3.47Å; V257-L261 PolarHBondContact O-N 2.92Å; L261-R263 VanDerWaalsContact C-N 3.28Å; L261-R263 PolarHBondContact O-N 3.07Å; L261-T264 PolarHBondContact O-N 3.16Å; L261-M265 HydrophobicContact CD1-CG 4.1Å; L261-M265 HydrophobicContact CD1-SD 4.12Å; L261-M265 HydrophobicContact CG-CG 4.4Å; L261-M265 HydrophobicContact CG-SD 4Å; L261-M265 WeakPolarHBondContact O-CB 3.34Å; L261-M265 VanDerWaalsContact O-CG 3.29Å; L261-M265 WeakPolarHBondContact O-CG 3.24Å; L261-M265 PolarHBondContact O-N 3.34Å
262R92.2Very high90.8Very high31 Ų3147.1 Ų47.112%0.11726%0.259CS..Hα-helixtrans-57.8-40.5175.7-179.1-175.3-177.6-65.8-0.8112.3F27 L30 D31 P258 R259 C260 M266F27-R262 HydrophobicContact CB-CG 4.12Å; L30-R262 HydrophobicContact CB-CB 4.25Å; L30-R262 HydrophobicContact CD1-CB 3.88Å; D31-R262 WeakPolarHBondContact OD1-CD 3.29Å; D31-R262 IonicContact OD1-CZ 3.01Å; D31-R262 IonicContact OD1-NE 3.7Å; D31-R262 PolarHBondContact OD1-NE 3.35Å; D31-R262 IonicContact OD2-NE 2.67Å; D31-R262 IonicContact OD2-NH2 3.28Å; P258-R262 VanDerWaalsContact O-CB 3.29Å; P258-R262 WeakPolarHBondContact O-CB 3.49Å; P258-R262 PolarHBondContact O-N 3.36Å; R259-R262 PolarHBondContact O-N 3.17Å; C260-R262 VanDerWaalsContact C-N 3.35Å; C260-R262 PolarHBondContact O-N 3.43Å; R262-M266 PolarHBondContact NH1-SD 2.77Å; R262-M266 WeakPolarHBondContact O-CB 3.35Å; R262-M266 WeakPolarHBondContact O-CG 3.38Å; R262-M266 PolarHBondContact O-N 3.02Å
263R90.4Very high90.5Very high75 Ų7549.5 Ų49.528%0.28328%0.275SS..Hα-helixtrans-66.6-46.8177.8-71.7-62.4-167.7-146.23.3111.7R259 C260 L261 M266 A267R259-R263 WeakPolarHBondContact O-CG 3.43Å; R259-R263 PolarHBondContact O-N 3.27Å; R259-R263 VanDerWaalsContact O-N 3.13Å; C260-R263 WeakPolarHBondContact O-CB 3.12Å; C260-R263 PolarHBondContact O-N 3.2Å; L261-R263 VanDerWaalsContact C-N 3.28Å; L261-R263 PolarHBondContact O-N 3.07Å; R263-M266 PolarHBondContact O-N 2.95Å; R263-A267 PolarHBondContact O-N 2.66Å
264T92.3Very high90.1Very high48 Ų4850.5 Ų50.529%0.29428%0.276SS..Hα-helixtrans-61.2-45.8177.7-56.70000111.2V208 C260 L261 M266 A267 A268V208-T264 HydrophobicContact CG1-CG2 3.91Å; V208-T264 HydrophobicContact CG2-CG2 4.47Å; C260-T264 PolarHBondContact O-N 3.46Å; C260-T264 PolarHBondContact O-OG1 3.49Å; L261-T264 PolarHBondContact O-N 3.16Å; T264-M266 PolarHBondContact O-N 3.33Å; T264-A267 PolarHBondContact O-N 3.07Å; T264-A268 WeakPolarHBondContact O-CB 3.48Å; T264-A268 PolarHBondContact O-N 2.95Å
265M92.3Very high89.9Confident80 Ų8052 Ų5239%0.39429%0.285SS..Hα-helixtrans-65.6-38.4178-67.9-179.881.600112.6F27 L30 L261 A268 M269F27-M265 HydrophobicContact CD1-CB 4.18Å; F27-M265 HydrophobicContact CD1-CE 4.26Å; F27-M265 HydrophobicContact CD1-SD 4.28Å; F27-M265 HydrophobicContact CE1-CB 3.47Å; F27-M265 VanDerWaalsContact CE1-CB 3.47Å; F27-M265 HydrophobicContact CE1-CE 3.71Å; F27-M265 HydrophobicContact CE1-CG 4.36Å; F27-M265 HydrophobicContact CE1-SD 4.07Å; F27-M265 HydrophobicContact CZ-CB 3.79Å; L30-M265 HydrophobicContact CD1-SD 3.74Å; L261-M265 HydrophobicContact CD1-CG 4.1Å; L261-M265 HydrophobicContact CD1-SD 4.12Å; L261-M265 HydrophobicContact CG-CG 4.4Å; L261-M265 HydrophobicContact CG-SD 4Å; L261-M265 WeakPolarHBondContact O-CB 3.34Å; L261-M265 VanDerWaalsContact O-CG 3.29Å; L261-M265 WeakPolarHBondContact O-CG 3.24Å; L261-M265 PolarHBondContact O-N 3.34Å; M265-A268 PolarHBondContact O-N 3.38Å; M265-M269 WeakPolarHBondContact O-CB 3.27Å; M265-M269 PolarHBondContact O-N 2.67Å
266M89.3Confident89.7Confident61 Ų6157.1 Ų57.130%0.331%0.307SS..Hα-helixtrans-62.7-42.6173-86.9-16852.100112.4F27 R262 R263 T264 M269 A270F27-M266 HydrophobicContact CD2-CG 3.57Å; F27-M266 HydrophobicContact CE2-CB 4.33Å; F27-M266 HydrophobicContact CE2-CG 3.51Å; F27-M266 HydrophobicContact CZ-CG 4.47Å; R262-M266 PolarHBondContact NH1-SD 2.77Å; R262-M266 WeakPolarHBondContact O-CB 3.35Å; R262-M266 WeakPolarHBondContact O-CG 3.38Å; R262-M266 PolarHBondContact O-N 3.02Å; R263-M266 PolarHBondContact O-N 2.95Å; T264-M266 PolarHBondContact O-N 3.33Å; M266-M269 PolarHBondContact O-N 3.31Å; M266-A270 PolarHBondContact O-N 2.72Å
267A88.4Confident89.2Confident33 Ų3362.3 Ų62.327%0.27333%0.33SS..Hα-helixtrans-62-48.4175.400000110.2F204 V208 R263 T264 M269 A270 W271F204-A267 VanDerWaalsContact CE2-C 3.49Å; F204-A267 HydrophobicContact CE2-CB 3.96Å; F204-A267 WeakPolarHBondContact CE2-O 3.07Å; F204-A267 HydrophobicContact CZ-CB 4.47Å; V208-A267 HydrophobicContact CG2-CB 4.03Å; R263-A267 PolarHBondContact O-N 2.66Å; T264-A267 PolarHBondContact O-N 3.07Å; A267-M269 VanDerWaalsContact C-N 3.31Å; A267-M269 PolarHBondContact O-N 3.05Å; A267-A270 PolarHBondContact O-N 3.27Å; A267-A270 VanDerWaalsContact O-N 3.12Å; A267-W271 PolarHBondContact O-N 3.07Å
268A90.1Very high88.5Confident38 Ų3860.1 Ų60.131%0.31431%0.314SS..Hα-helixtrans-57.8-42.9178.600000111.9F204 T264 M265 W271 T272F204-A268 HydrophobicContact CZ-CB 4.06Å; T264-A268 WeakPolarHBondContact O-CB 3.48Å; T264-A268 PolarHBondContact O-N 2.95Å; M265-A268 PolarHBondContact O-N 3.38Å; A268-W271 WeakPolarHBondContact O-CB 3.47Å; A268-W271 PolarHBondContact O-N 3.32Å; A268-T272 WeakPolarHBondContact O-CG2 3.29Å; A268-T272 PolarHBondContact O-N 3.36Å; A268-T272 PolarHBondContact O-OG1 3.15Å
269M90.4Very high87.9Confident49 Ų4962.1 Ų62.124%0.24133%0.331CS..Hα-helixtrans-61.9-43.6174.6-179.1-174.8174.400112.2L26 F27 M265 M266 A267 W271 T272 V273L26-M269 HydrophobicContact CD2-SD 4.09Å; F27-M269 HydrophobicContact CE2-SD 3.95Å; F27-M269 HydrophobicContact CZ-CB 4.4Å; F27-M269 HydrophobicContact CZ-SD 4.22Å; M265-M269 WeakPolarHBondContact O-CB 3.27Å; M265-M269 PolarHBondContact O-N 2.67Å; M266-M269 PolarHBondContact O-N 3.31Å; A267-M269 VanDerWaalsContact C-N 3.31Å; A267-M269 PolarHBondContact O-N 3.05Å; M269-W271 VanDerWaalsContact C-N 3.29Å; M269-W271 PolarHBondContact O-N 3.07Å; M269-T272 PolarHBondContact O-N 3.42Å; M269-T272 PolarHBondContact O-OG1 2.87Å; M269-V273 WeakPolarHBondContact O-CB 3.4Å; M269-V273 VanDerWaalsContact O-CG2 3.24Å; M269-V273 WeakPolarHBondContact O-CG2 3.33Å; M269-V273 PolarHBondContact O-N 3.35Å
270A87.1Confident87.2Confident64 Ų6469.1 Ų69.153%0.52936%0.364SS..Hα-helixtrans-63.3-39.2177.400000111.6M266 A267 Y274M266-A270 PolarHBondContact O-N 2.72Å; A267-A270 PolarHBondContact O-N 3.27Å; A267-A270 VanDerWaalsContact O-N 3.12Å; A270-Y274 WeakPolarHBondContact O-CB 3.35Å; A270-Y274 PolarHBondContact O-N 3.43Å
271W85.9Confident86.5Confident55 Ų5573 Ų7321%0.20839%0.386CS..Hα-helixtrans-64.7-49.2176.6178.1-96.6000112.5P200 F204 A267 A268 M269 V273 Y274 E275P200-W271 HydrophobicContact CB-CH2 3.11Å; P200-W271 HydrophobicContact CB-CZ2 3.92Å; P200-W271 HydrophobicContact CB-CZ3 3.77Å; P200-W271 HydrophobicContact CG-CH2 4.36Å; F204-W271 HydrophobicContact CB-CD2 4.38Å; F204-W271 HydrophobicContact CB-CE3 4.22Å; F204-W271 HydrophobicContact CD2-CB 3.62Å; F204-W271 HydrophobicContact CD2-CD2 4.17Å; F204-W271 HydrophobicContact CD2-CE3 4.33Å; F204-W271 AromaticContact CD2-CG 3.85Å; F204-W271 HydrophobicContact CD2-CG 3.85Å; F204-W271 HydrophobicContact CE2-CB 3.63Å; F204-W271 HydrophobicContact CE2-CG 4.16Å; F204-W271 HydrophobicContact CG-CD2 4.41Å; F204-W271 HydrophobicContact CG-CG 4.35Å; A267-W271 PolarHBondContact O-N 3.07Å; A268-W271 WeakPolarHBondContact O-CB 3.47Å; A268-W271 PolarHBondContact O-N 3.32Å; M269-W271 VanDerWaalsContact C-N 3.29Å; M269-W271 PolarHBondContact O-N 3.07Å; W271-V273 VanDerWaalsContact C-N 3.33Å; W271-V273 PolarHBondContact O-N 2.83Å; W271-Y274 HydrophobicContact CE3-CD1 4.34Å; W271-Y274 HydrophobicContact CH2-CD1 4.07Å; W271-Y274 HydrophobicContact CH2-CE1 4.1Å; W271-Y274 AromaticContact CZ3-CD1 3.88Å; W271-Y274 HydrophobicContact CZ3-CD1 3.88Å; W271-Y274 HydrophobicContact CZ3-CE1 4.1Å; W271-Y274 WeakPolarHBondContact O-CB 3.18Å; W271-Y274 PolarHBondContact O-N 2.88Å; W271-Y274 VanDerWaalsContact O-N 3.16Å; W271-E275 HydrophobicContact CH2-CG 4.39Å; W271-E275 HydrophobicContact CZ2-CG 3.67Å; W271-E275 PolarHBondContact NE1-OE2 3.38Å; W271-E275 PolarHBondContact O-N 3.02Å
272T87.3Confident84.8Confident74 Ų7472.6 Ų72.645%0.45440%0.4SS..Hα-helixtrans-63.1-40.7179.7540000111.7A268 M269 Y274 E275 Q276A268-T272 WeakPolarHBondContact O-CG2 3.29Å; A268-T272 PolarHBondContact O-N 3.36Å; A268-T272 PolarHBondContact O-OG1 3.15Å; M269-T272 PolarHBondContact O-N 3.42Å; M269-T272 PolarHBondContact O-OG1 2.87Å; T272-Y274 VanDerWaalsContact C-N 3.35Å; T272-E275 PolarHBondContact O-N 2.85Å; T272-Q276 VanDerWaalsContact O-CG 3.28Å; T272-Q276 WeakPolarHBondContact O-CG 3.47Å; T272-Q276 PolarHBondContact O-N 2.96Å
273V86.3Confident83.2Confident72 Ų7276.5 Ų76.544%0.43642%0.422SS..Hα-helixtrans-61.9-44.1174.3171.70000110.9M269 W271 Q276 M277M269-V273 WeakPolarHBondContact O-CB 3.4Å; M269-V273 VanDerWaalsContact O-CG2 3.24Å; M269-V273 WeakPolarHBondContact O-CG2 3.33Å; M269-V273 PolarHBondContact O-N 3.35Å; W271-V273 VanDerWaalsContact C-N 3.33Å; W271-V273 PolarHBondContact O-N 2.83Å; V273-Q276 PolarHBondContact O-N 3.46Å; V273-M277 HydrophobicContact CG1-CG 4.42Å; V273-M277 HydrophobicContact CG1-SD 4.1Å; V273-M277 WeakPolarHBondContact O-CG 3.49Å; V273-M277 PolarHBondContact O-N 2.93Å
274Y83.3Confident81.1Confident121 Ų12178.5 Ų78.548%0.47543%0.433SS..Hα-helixtrans-58.5-48.4175.9171-97.8000111.9A270 W271 T272 Q276 M277 M278A270-Y274 WeakPolarHBondContact O-CB 3.35Å; A270-Y274 PolarHBondContact O-N 3.43Å; W271-Y274 HydrophobicContact CE3-CD1 4.34Å; W271-Y274 HydrophobicContact CH2-CD1 4.07Å; W271-Y274 HydrophobicContact CH2-CE1 4.1Å; W271-Y274 AromaticContact CZ3-CD1 3.88Å; W271-Y274 HydrophobicContact CZ3-CD1 3.88Å; W271-Y274 HydrophobicContact CZ3-CE1 4.1Å; W271-Y274 WeakPolarHBondContact O-CB 3.18Å; W271-Y274 PolarHBondContact O-N 2.88Å; W271-Y274 VanDerWaalsContact O-N 3.16Å; T272-Y274 VanDerWaalsContact C-N 3.35Å; Y274-Q276 VanDerWaalsContact C-N 3.34Å; Y274-Q276 PolarHBondContact O-N 2.9Å; Y274-M277 PolarHBondContact O-N 3.4Å; Y274-M278 HydrophobicContact CD1-CG 4.33Å; Y274-M278 HydrophobicContact CD2-CG 4.2Å; Y274-M278 HydrophobicContact CE1-CG 3.9Å; Y274-M278 HydrophobicContact CE2-CG 3.76Å; Y274-M278 HydrophobicContact CE2-SD 4.09Å; Y274-M278 HydrophobicContact CG-CG 4.47Å; Y274-M278 VanDerWaalsContact O-CG 3.32Å; Y274-M278 WeakPolarHBondContact O-CG 3.22Å; Y274-M278 PolarHBondContact O-N 2.79Å
275E83.9Confident78.6Confident66 Ų6685.1 Ų85.131%0.30848%0.481SS..Hα-helixtrans-61.2-41.6178.5-76.3-154.48300113W271 T272 M278 A279 K284W271-E275 HydrophobicContact CH2-CG 4.39Å; W271-E275 HydrophobicContact CZ2-CG 3.67Å; W271-E275 PolarHBondContact NE1-OE2 3.38Å; W271-E275 PolarHBondContact O-N 3.02Å; T272-E275 PolarHBondContact O-N 2.85Å; E275-M278 PolarHBondContact O-N 2.79Å; E275-A279 WeakPolarHBondContact O-CB 3.26Å; E275-A279 PolarHBondContact O-N 2.93Å; E275-K284 IonicContact OE1-NZ 3.68Å; E275-K284 PolarHBondContact OE1-NZ 3.35Å
276Q85.2Confident77.9Confident117 Ų11785.4 Ų85.455%0.54749%0.485SS..Hα-helixtrans-64.8-43.8177.6-71.4-63-23.600111.1T272 V273 Y274 A279 H280T272-Q276 VanDerWaalsContact O-CG 3.28Å; T272-Q276 WeakPolarHBondContact O-CG 3.47Å; T272-Q276 PolarHBondContact O-N 2.96Å; V273-Q276 PolarHBondContact O-N 3.46Å; Y274-Q276 VanDerWaalsContact C-N 3.34Å; Y274-Q276 PolarHBondContact O-N 2.9Å; Q276-A279 PolarHBondContact O-N 3.2Å; Q276-H280 PolarHBondContact O-N 3.46Å; Q276-H280 PolarHBondContact O-ND1 3.02Å
277M82.3Confident77.3Confident123 Ų12386.6 Ų86.661%0.60650%0.495SS*.Hα-helixtrans-61.4-45.7175.7-72.9-176.670.300111.5V273 Y274 A279 H280 V281V273-M277 HydrophobicContact CG1-CG 4.42Å; V273-M277 HydrophobicContact CG1-SD 4.1Å; V273-M277 WeakPolarHBondContact O-CG 3.49Å; V273-M277 PolarHBondContact O-N 2.93Å; Y274-M277 PolarHBondContact O-N 3.4Å; M277-A279 VanDerWaalsContact C-N 3.3Å; M277-A279 PolarHBondContact O-N 3.15Å; M277-H280 PolarHBondContact O-N 3.44Å; M277-V281 VanDerWaalsContact O-CG2 3.28Å; M277-V281 WeakPolarHBondContact O-CG2 3.19Å; M277-V281 PolarHBondContact O-N 3.41Å
278M78.6Confident76.7Confident51 Ų5189.6 Ų89.625%0.25151%0.507SS..Hα-helixtrans-62-37.4178-71.7-63.6-69.100112.7Y274 E275 G282 L283Y274-M278 HydrophobicContact CD1-CG 4.33Å; Y274-M278 HydrophobicContact CD2-CG 4.2Å; Y274-M278 HydrophobicContact CE1-CG 3.9Å; Y274-M278 HydrophobicContact CE2-CG 3.76Å; Y274-M278 HydrophobicContact CE2-SD 4.09Å; Y274-M278 HydrophobicContact CG-CG 4.47Å; Y274-M278 VanDerWaalsContact O-CG 3.32Å; Y274-M278 WeakPolarHBondContact O-CG 3.22Å; Y274-M278 PolarHBondContact O-N 2.79Å; E275-M278 PolarHBondContact O-N 2.79Å; M278-G282 PolarHBondContact O-N 3.18Å; M278-L283 HydrophobicContact CE-CB 3.52Å; M278-L283 HydrophobicContact CE-CD1 3.96Å; M278-L283 HydrophobicContact CE-CG 4.39Å; M278-L283 PolarHBondContact O-N 3.24Å; M278-L283 HydrophobicContact SD-CB 4.41Å; M278-L283 HydrophobicContact SD-CD1 4.15Å
279A78.5Confident75.9Confident44 Ų4492.6 Ų92.636%0.36452%0.519SS..Hα-helixtrans-65.2-44.6175.300000112.1E275 Q276 M277 V281 G282 K284E275-A279 WeakPolarHBondContact O-CB 3.26Å; E275-A279 PolarHBondContact O-N 2.93Å; Q276-A279 PolarHBondContact O-N 3.2Å; M277-A279 VanDerWaalsContact C-N 3.3Å; M277-A279 PolarHBondContact O-N 3.15Å; A279-V281 VanDerWaalsContact C-N 3.32Å; A279-V281 PolarHBondContact O-N 3Å; A279-G282 PolarHBondContact O-N 3.41Å; A279-G282 VanDerWaalsContact O-N 3.17Å; A279-K284 HydrophobicContact CB-CD 4.06Å
280H78.9Confident75Confident159 Ų15995.4 Ų95.474%0.73654%0.536SS*.Hα-helixtrans-68.6-29.1179.5-75.378000113.3Q276 M277 G282Q276-H280 PolarHBondContact O-N 3.46Å; Q276-H280 PolarHBondContact O-ND1 3.02Å; M277-H280 PolarHBondContact O-N 3.44Å; H280-G282 PolarHBondContact O-N 3.24Å
281V79.4Confident74.2Confident101 Ų10197.5 Ų97.561%0.61254%0.537SS*.THydrogen-bonded Turntrans-81-3176.7-179.30000111.8M277 A279 L283M277-V281 VanDerWaalsContact O-CG2 3.28Å; M277-V281 WeakPolarHBondContact O-CG2 3.19Å; M277-V281 PolarHBondContact O-N 3.41Å; A279-V281 VanDerWaalsContact C-N 3.32Å; A279-V281 PolarHBondContact O-N 3Å; V281-L283 VanDerWaalsContact C-N 3.26Å; V281-L283 HydrophobicContact CB-CD1 4.3Å; V281-L283 HydrophobicContact CG1-CD1 3.61Å; V281-L283 HydrophobicContact CG1-CG 3.96Å; V281-L283 PolarHBondContact O-N 3.28Å
282G59Low73.3Confident63 Ų63100.5 Ų100.565%0.64956%0.56SS**THydrogen-bonded Turntrans72.218.5177.800000113.9M278 A279 H280M278-G282 PolarHBondContact O-N 3.18Å; A279-G282 PolarHBondContact O-N 3.41Å; A279-G282 VanDerWaalsContact O-N 3.17Å; H280-G282 PolarHBondContact O-N 3.24Å
283L59.1Low72.3Confident112 Ų112102.5 Ų102.559%0.58657%0.568SS**  trans-92.83.4-180-71.2167.9000113.1M278 V281 S285M278-L283 HydrophobicContact CE-CB 3.52Å; M278-L283 HydrophobicContact CE-CD1 3.96Å; M278-L283 HydrophobicContact CE-CG 4.39Å; M278-L283 PolarHBondContact O-N 3.24Å; M278-L283 HydrophobicContact SD-CB 4.41Å; M278-L283 HydrophobicContact SD-CD1 4.15Å; V281-L283 VanDerWaalsContact C-N 3.26Å; V281-L283 HydrophobicContact CB-CD1 4.3Å; V281-L283 HydrophobicContact CG1-CD1 3.61Å; V281-L283 HydrophobicContact CG1-CG 3.96Å; V281-L283 PolarHBondContact O-N 3.28Å; L283-S285 PolarHBondContact O-N 3.27Å
284K45Very low71.1Confident117 Ų117105.1 Ų105.151%0.50958%0.579SS.*  trans-80.199166.2-80.8-165.8172.3-168.10107.9E275 A279E275-K284 IonicContact OE1-NZ 3.68Å; E275-K284 PolarHBondContact OE1-NZ 3.35Å; A279-K284 HydrophobicContact CB-CD 4.06Å
285S39.9Very low70Confident187 Ų187103.6 Ų103.6100%1.30859%0.589SS**  trans-74.10160.2-165.70000110.8L283L283-S285 PolarHBondContact O-N 3.27Å

Retrieved 285 of 285 residues in 154.9 ms (Link to these results)