Z4YKJ7_MOUSE Loading...

Amino acid transporter

AlphaFold DB , UniProt , Accession Z4YKJ7, Species MOUSE (Mus musculus, Mouse), Gene Slc1a7, Length 569 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
1M47.7Very low46.3Very low211 Ų211129.3 Ų129.3100%1.03967%0.672SS**  0-45.90-100.4-179.6-85.900111.8W3 C4 Q5M1-W3 PolarHBondContact O-N 3.41Å; M1-C4 PolarHBondContact O-N 2.91Å; M1-Q5 PolarHBondContact O-N 3.3Å
2E44.8Very low47.3Very low156 Ų156126.1 Ų126.173%0.72966%0.662SS**Hα-helixtrans-60.5-37.2179.6-68.6178144.400114.8C4 Q5 Q6E2-C4 PolarHBondContact O-N 3.12Å; E2-Q5 PolarHBondContact O-N 3.25Å; E2-Q6 PolarHBondContact O-N 3.41Å; E2-Q6 VanDerWaalsContact O-N 3.15Å
3W36.7Very low48Very low225 Ų225124.8 Ų124.885%0.85266%0.655SS**Hα-helixtrans-64.7-32.7177.5-86.273.5000114.3M1 A7M1-W3 PolarHBondContact O-N 3.41Å; W3-A7 WeakPolarHBondContact O-CB 3.34Å; W3-A7 PolarHBondContact O-N 3.48Å
4C43.4Very low49Very low107 Ų107123.1 Ų123.172%0.72365%0.647SS**Hα-helixtrans-74.5-29175.5-81.10000112.4M1 E2 G8M1-C4 PolarHBondContact O-N 2.91Å; E2-C4 PolarHBondContact O-N 3.12Å; C4-G8 PolarHBondContact O-N 3.44Å; C4-G8 VanDerWaalsContact O-N 3.11Å
5Q44.9Very low49.4Very low149 Ų149118.7 Ų118.770%0.69664%0.635SS**Hα-helixtrans-72.5-39.2176.4-109.7167.2-39.900111.9M1 E2 L9M1-Q5 PolarHBondContact O-N 3.3Å; E2-Q5 PolarHBondContact O-N 3.25Å; Q5-L9 PolarHBondContact O-N 3.48Å; Q5-L9 VanDerWaalsContact O-N 3.15Å
6Q44.3Very low50Low140 Ų140116.9 Ų116.965%0.65463%0.63SS**Hα-helixtrans-69.5-40.2176.4-111.3162.2-23.800112.9E2 L9 S10E2-Q6 PolarHBondContact O-N 3.41Å; E2-Q6 VanDerWaalsContact O-N 3.15Å; Q6-L9 PolarHBondContact O-N 3.11Å; Q6-S10 PolarHBondContact O-N 3.27Å; Q6-S10 VanDerWaalsContact O-N 3.15Å
7A44.1Very low50.8Low58 Ų58116.3 Ų116.348%0.47963%0.625SS.*Hα-helixtrans-67.7-37.6175.800000112.6W3 S10 M11W3-A7 WeakPolarHBondContact O-CB 3.34Å; W3-A7 PolarHBondContact O-N 3.48Å; A7-S10 PolarHBondContact O-OG 3.47Å; A7-M11 WeakPolarHBondContact O-CB 3.47Å; A7-M11 PolarHBondContact O-N 3.39Å
8G48.1Very low51.4Low36 Ų36112.9 Ų112.937%0.37162%0.616SS.*Hα-helixtrans-65-37174.200000113C4 V12C4-G8 PolarHBondContact O-N 3.44Å; C4-G8 VanDerWaalsContact O-N 3.11Å; G8-V12 VanDerWaalsContact O-CG2 3.24Å; G8-V12 WeakPolarHBondContact O-CG2 3.24Å; G8-V12 PolarHBondContact O-N 3.4Å; G8-V12 VanDerWaalsContact O-N 3.13Å
9L50.9Low51.9Low131 Ų131117.6 Ų117.669%0.68662%0.624SS**Hα-helixtrans-70.6-40.3179.1-154.779.8000112.3Q5 Q6 L13Q5-L9 PolarHBondContact O-N 3.48Å; Q5-L9 VanDerWaalsContact O-N 3.15Å; Q6-L9 PolarHBondContact O-N 3.11Å; L9-L13 WeakPolarHBondContact O-CB 3.46Å; L9-L13 PolarHBondContact O-N 3.36Å
10S52.3Low52.2Low64 Ų64113.4 Ų113.445%0.44861%0.61SS.*Hα-helixtrans-68.3-38.8177.688.20000111.8Q6 A7 V12 L13 D14Q6-S10 PolarHBondContact O-N 3.27Å; Q6-S10 VanDerWaalsContact O-N 3.15Å; A7-S10 PolarHBondContact O-OG 3.47Å; S10-V12 PolarHBondContact O-N 3.42Å; S10-L13 PolarHBondContact O-N 3.15Å; S10-D14 WeakPolarHBondContact O-CB 3.5Å; S10-D14 PolarHBondContact O-N 3.11Å
11M52.5Low52.8Low145 Ų145117.3 Ų117.371%0.71462%0.616SS**Hα-helixtrans-68-35.6178.6-140.1177.682.500112.3A7 A15A7-M11 WeakPolarHBondContact O-CB 3.47Å; A7-M11 PolarHBondContact O-N 3.39Å; M11-A15 VanDerWaalsContact O-CB 3.24Å; M11-A15 WeakPolarHBondContact O-CB 3.24Å; M11-A15 PolarHBondContact O-N 2.87Å
12V57.3Low53.3Low91 Ų91111.4 Ų111.455%0.55259%0.592SS**Hα-helixtrans-68.6-41.5171.9171.30000110.8G8 S10 A15 V16G8-V12 VanDerWaalsContact O-CG2 3.24Å; G8-V12 WeakPolarHBondContact O-CG2 3.24Å; G8-V12 PolarHBondContact O-N 3.4Å; G8-V12 VanDerWaalsContact O-N 3.13Å; S10-V12 PolarHBondContact O-N 3.42Å; V12-A15 PolarHBondContact O-N 3.47Å; V12-V16 HydrophobicContact CG1-CG2 4.23Å; V12-V16 VanDerWaalsContact O-CB 3.28Å; V12-V16 WeakPolarHBondContact O-CB 3.39Å; V12-V16 WeakPolarHBondContact O-CG2 3.46Å; V12-V16 PolarHBondContact O-N 3.15Å
13L56.6Low54Low109 Ų109107.4 Ų107.457%0.57158%0.578SS**Hα-helixtrans-63.5-43.7177.6-160.580.8000111.6L9 S10 V16 L17L9-L13 WeakPolarHBondContact O-CB 3.46Å; L9-L13 PolarHBondContact O-N 3.36Å; S10-L13 PolarHBondContact O-N 3.15Å; L13-V16 PolarHBondContact O-N 3.39Å; L13-L17 HydrophobicContact CD2-CD1 4.39Å; L13-L17 HydrophobicContact CG-CD1 4.17Å; L13-L17 VanDerWaalsContact O-CB 3.31Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 VanDerWaalsContact O-CG 3.29Å; L13-L17 WeakPolarHBondContact O-CG 2.88Å; L13-L17 PolarHBondContact O-N 3.21Å
14D61.8Low55Low101 Ų101100 Ų10054%0.5456%0.56SS.*Hα-helixtrans-68.2-38.2177.3-76-29.3000112S10 L17 A18S10-D14 WeakPolarHBondContact O-CB 3.5Å; S10-D14 PolarHBondContact O-N 3.11Å; D14-L17 PolarHBondContact O-N 3.21Å; D14-A18 WeakPolarHBondContact O-CB 3.17Å; D14-A18 PolarHBondContact O-N 3.12Å
15A56.2Low55.8Low57 Ų57103.3 Ų103.347%0.47156%0.562SS.*Hα-helixtrans-66.8-37.5173.300000112.1M11 V12 R19M11-A15 VanDerWaalsContact O-CB 3.24Å; M11-A15 WeakPolarHBondContact O-CB 3.24Å; M11-A15 PolarHBondContact O-N 2.87Å; V12-A15 PolarHBondContact O-N 3.47Å; A15-R19 WeakPolarHBondContact O-CB 3.12Å; A15-R19 PolarHBondContact O-N 2.84Å
16V59.1Low56.1Low91 Ų91103.8 Ų103.855%0.55256%0.564SS**Hα-helixtrans-69-41.3174.6168.60000110.9V12 L13 G20V12-V16 HydrophobicContact CG1-CG2 4.23Å; V12-V16 VanDerWaalsContact O-CB 3.28Å; V12-V16 WeakPolarHBondContact O-CB 3.39Å; V12-V16 WeakPolarHBondContact O-CG2 3.46Å; V12-V16 PolarHBondContact O-N 3.15Å; L13-V16 PolarHBondContact O-N 3.39Å; V16-G20 PolarHBondContact O-N 3.13Å
17L62.9Low57Low106 Ų106100.1 Ų100.156%0.55555%0.549SS*.Hα-helixtrans-66.4-41175-79.3163.8000111.6L13 D14 G20 R21L13-L17 HydrophobicContact CD2-CD1 4.39Å; L13-L17 HydrophobicContact CG-CD1 4.17Å; L13-L17 VanDerWaalsContact O-CB 3.31Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 VanDerWaalsContact O-CG 3.29Å; L13-L17 WeakPolarHBondContact O-CG 2.88Å; L13-L17 PolarHBondContact O-N 3.21Å; D14-L17 PolarHBondContact O-N 3.21Å; L17-G20 PolarHBondContact O-N 3.17Å; L17-R21 WeakPolarHBondContact O-CB 3.44Å; L17-R21 PolarHBondContact O-N 3.49Å
18A62.4Low58.1Low56 Ų5698.6 Ų98.646%0.46354%0.539SS..Hα-helixtrans-67.6-41.1176.100000112.2D14 R21 T22D14-A18 WeakPolarHBondContact O-CB 3.17Å; D14-A18 PolarHBondContact O-N 3.12Å; A18-R21 PolarHBondContact O-N 2.99Å; A18-T22 PolarHBondContact O-N 2.98Å; A18-T22 PolarHBondContact O-OG1 3.44Å
19R59.3Low58.6Low201 Ų201100 Ų10076%0.75854%0.538SS*.Hα-helixtrans-61.9-44.9169-101.5-177.4168.7-169.1-2.6111A15 R21 T22 V23A15-R19 WeakPolarHBondContact O-CB 3.12Å; A15-R19 PolarHBondContact O-N 2.84Å; R19-R21 VanDerWaalsContact C-N 3.33Å; R19-R21 PolarHBondContact O-N 2.97Å; R19-T22 PolarHBondContact O-N 3.45Å; R19-V23 WeakPolarHBondContact O-CB 3.28Å; R19-V23 VanDerWaalsContact O-CG2 3.23Å; R19-V23 WeakPolarHBondContact O-CG2 3.31Å; R19-V23 PolarHBondContact O-N 3.15Å
20G58.5Low59Low34 Ų3496 Ų9635%0.35152%0.517SS..Hα-helixtrans-58.8-42.5176.800000112.4V16 L17 T22 V23 C24V16-G20 PolarHBondContact O-N 3.13Å; L17-G20 PolarHBondContact O-N 3.17Å; G20-T22 PolarHBondContact O-N 3.06Å; G20-V23 PolarHBondContact O-N 3.29Å; G20-C24 WeakPolarHBondContact O-CB 3.19Å; G20-C24 PolarHBondContact O-N 3.32Å
21R65.6Low59.8Low196 Ų19695.3 Ų95.374%0.7451%0.508SS*.Hα-helixtrans-65.5-39.2176.5-137.8176.4-163.7177.95.1112.2L17 A18 R19 K25L17-R21 WeakPolarHBondContact O-CB 3.44Å; L17-R21 PolarHBondContact O-N 3.49Å; A18-R21 PolarHBondContact O-N 2.99Å; R19-R21 VanDerWaalsContact C-N 3.33Å; R19-R21 PolarHBondContact O-N 2.97Å; R21-K25 WeakPolarHBondContact O-CG 3.47Å; R21-K25 PolarHBondContact O-N 3.05Å
22T57.7Low60.9Low86 Ų8692.2 Ų92.253%0.52849%0.493SS..Hα-helixtrans-69.3-41.3177.2-51.60000111.5A18 R19 G20 K25 H26A18-T22 PolarHBondContact O-N 2.98Å; A18-T22 PolarHBondContact O-OG1 3.44Å; R19-T22 PolarHBondContact O-N 3.45Å; G20-T22 PolarHBondContact O-N 3.06Å; T22-K25 PolarHBondContact O-N 2.89Å; T22-H26 PolarHBondContact O-N 2.86Å
23V58.5Low61.3Low73 Ų7388.2 Ų88.244%0.44247%0.469SS..Hα-helixtrans-65.9-42.7175.3171.30000111.2R19 G20 K25 H26 N27 I31R19-V23 WeakPolarHBondContact O-CB 3.28Å; R19-V23 VanDerWaalsContact O-CG2 3.23Å; R19-V23 WeakPolarHBondContact O-CG2 3.31Å; R19-V23 PolarHBondContact O-N 3.15Å; G20-V23 PolarHBondContact O-N 3.29Å; V23-K25 VanDerWaalsContact C-N 3.31Å; V23-K25 PolarHBondContact O-N 3.24Å; V23-H26 PolarHBondContact O-N 3.4Å; V23-N27 WeakPolarHBondContact O-CB 3.29Å; V23-N27 PolarHBondContact O-N 2.84Å; V23-I31 HydrophobicContact CG1-CD1 4.26Å
24C58.3Low62Low70 Ų7085.2 Ų85.247%0.47346%0.455SS..Hα-helixtrans-63.1-33.7173.8-92.30000113G20 G28G20-C24 WeakPolarHBondContact O-CB 3.19Å; G20-C24 PolarHBondContact O-N 3.32Å; C24-G28 WeakPolarHBondContact O-CA 3.4Å; C24-G28 PolarHBondContact O-N 2.81Å
25K60.3Low62.9Low175 Ų17584.7 Ų84.776%0.76145%0.452SS*.Hα-helixtrans-70.4-35.7175.9-79.9-176.4175.4-172.20113.1R21 T22 V23R21-K25 WeakPolarHBondContact O-CG 3.47Å; R21-K25 PolarHBondContact O-N 3.05Å; T22-K25 PolarHBondContact O-N 2.89Å; V23-K25 VanDerWaalsContact C-N 3.31Å; V23-K25 PolarHBondContact O-N 3.24Å
26H52.3Low64.1Low160 Ų16082.5 Ų82.574%0.74143%0.433SS*.Hα-helixtrans-86.9-32.8-179.3-87.773.4000113.9T22 V23T22-H26 PolarHBondContact O-N 2.86Å; V23-H26 PolarHBondContact O-N 3.4Å
27N62.4Low64.8Low62 Ų6278.9 Ų78.933%0.33241%0.411SS..SBendtrans-117.221.9-175.7-60-59.2000112.5V23 L29 L30 I31V23-N27 WeakPolarHBondContact O-CB 3.29Å; V23-N27 PolarHBondContact O-N 2.84Å; N27-L29 VanDerWaalsContact C-N 3.32Å; N27-L29 PolarHBondContact O-N 2.79Å; N27-L30 HydrophobicContact CB-CB 4.48Å; N27-L30 WeakPolarHBondContact O-CB 3.44Å; N27-L30 PolarHBondContact O-N 2.9Å; N27-L30 VanDerWaalsContact O-N 3.13Å; N27-I31 HydrophobicContact CB-CD1 4.15Å; N27-I31 HydrophobicContact CB-CG1 4.41Å; N27-I31 WeakPolarHBondContact O-CG1 3.09Å; N27-I31 PolarHBondContact O-N 3.13Å
28G65.9Low65.7Low26 Ų2678 Ų7827%0.26841%0.406SS..Hα-helixtrans-56-43.9-171.600000113.4C24 L30 I31 L32C24-G28 WeakPolarHBondContact O-CA 3.4Å; C24-G28 PolarHBondContact O-N 2.81Å; G28-L30 PolarHBondContact O-N 3.43Å; G28-I31 PolarHBondContact O-N 3.43Å; G28-L32 WeakPolarHBondContact O-CB 3.37Å; G28-L32 PolarHBondContact O-N 2.96Å
29L60.1Low67Low67 Ų6778.9 Ų78.935%0.35141%0.406SS..Hα-helixtrans-64-43178.8-171.766.6000112N27 L32 S33 G274 W275 P278N27-L29 VanDerWaalsContact C-N 3.32Å; N27-L29 PolarHBondContact O-N 2.79Å; L29-L32 PolarHBondContact O-N 3.39Å; L29-S33 PolarHBondContact O-N 3.12Å; L29-S33 PolarHBondContact O-OG 2.95Å; L29-S33 VanDerWaalsContact O-OG 3.07Å; L29-G274 WeakPolarHBondContact CD1-O 3.29Å; L29-W275 HydrophobicContact CD1-CE3 4.49Å; L29-P278 HydrophobicContact CD1-CG 3.85Å
30L58.2Low68.3Low47 Ų4769.3 Ų69.325%0.24637%0.37CS..Hα-helixtrans-61.4-49.4177.3179.2163.2000111.4N27 G28 L32 S33 V34 A349 R465N27-L30 HydrophobicContact CB-CB 4.48Å; N27-L30 WeakPolarHBondContact O-CB 3.44Å; N27-L30 PolarHBondContact O-N 2.9Å; N27-L30 VanDerWaalsContact O-N 3.13Å; G28-L30 PolarHBondContact O-N 3.43Å; L30-L32 VanDerWaalsContact C-N 3.31Å; L30-L32 PolarHBondContact O-N 3.42Å; L30-S33 PolarHBondContact O-N 3.24Å; L30-V34 HydrophobicContact CD2-CG2 4.25Å; L30-V34 WeakPolarHBondContact O-CG2 3.34Å; L30-V34 PolarHBondContact O-N 3.37Å; L30-A349 HydrophobicContact CD1-CB 3.99Å; L30-A349 WeakPolarHBondContact CD1-O 3.26Å; L30-R465 VanDerWaalsContact CD1-NH1 3.25Å
31I69.4Low69.5Low49 Ų4969.8 Ų69.825%0.25137%0.367SS..Hα-helixtrans-63-43.2-179.4-66.7166.1000109.8V23 N27 G28 V34 L35V23-I31 HydrophobicContact CG1-CD1 4.26Å; N27-I31 HydrophobicContact CB-CD1 4.15Å; N27-I31 HydrophobicContact CB-CG1 4.41Å; N27-I31 WeakPolarHBondContact O-CG1 3.09Å; N27-I31 PolarHBondContact O-N 3.13Å; G28-I31 PolarHBondContact O-N 3.43Å; I31-V34 PolarHBondContact O-N 3.5Å; I31-L35 HydrophobicContact CG2-CD1 3.85Å; I31-L35 HydrophobicContact CG2-CG 4.45Å; I31-L35 WeakPolarHBondContact O-CB 3.3Å; I31-L35 VanDerWaalsContact O-CG 3.32Å; I31-L35 WeakPolarHBondContact O-CG 3.4Å; I31-L35 PolarHBondContact O-N 3.28Å
32L75.4Confident70.7Confident80 Ų8066.1 Ų66.142%0.41936%0.361SS..Hα-helixtrans-62.6-43.6178-165.864.9000111.2G28 L29 L30 L35 S36 P278G28-L32 WeakPolarHBondContact O-CB 3.37Å; G28-L32 PolarHBondContact O-N 2.96Å; L29-L32 PolarHBondContact O-N 3.39Å; L30-L32 VanDerWaalsContact C-N 3.31Å; L30-L32 PolarHBondContact O-N 3.42Å; L32-L35 PolarHBondContact O-N 3.14Å; L32-S36 WeakPolarHBondContact O-CB 3.39Å; L32-S36 PolarHBondContact O-N 3.43Å; L32-S36 PolarHBondContact O-OG 2.86Å; L32-P278 HydrophobicContact CB-CB 4.15Å; L32-P278 HydrophobicContact CB-CG 4.17Å; L32-P278 HydrophobicContact CD2-CB 3.78Å; L32-P278 HydrophobicContact CD2-CG 3.77Å; L32-P278 HydrophobicContact CG-CB 3.55Å; L32-P278 HydrophobicContact CG-CG 3.91Å
33S66.1Low72.3Confident6 Ų664.5 Ų64.54%0.04235%0.35CS..Hα-helixtrans-62.1-43175.9-64.30000113.2L29 L30 S36 V37L29-S33 PolarHBondContact O-N 3.12Å; L29-S33 PolarHBondContact O-OG 2.95Å; L29-S33 VanDerWaalsContact O-OG 3.07Å; L30-S33 PolarHBondContact O-N 3.24Å; S33-S36 WeakPolarHBondContact O-CB 3.23Å; S33-S36 PolarHBondContact O-N 3.41Å; S33-V37 WeakPolarHBondContact O-CG2 3.26Å; S33-V37 PolarHBondContact O-N 2.87Å; S33-V37 VanDerWaalsContact O-N 3.09Å
34V71Confident73.7Confident46 Ų4661 Ų6128%0.27933%0.329SS..Hα-helixtrans-63.3-46.1176.9174.30000110.5L30 I31 S36 V37 I38 W461L30-V34 HydrophobicContact CD2-CG2 4.25Å; L30-V34 WeakPolarHBondContact O-CG2 3.34Å; L30-V34 PolarHBondContact O-N 3.37Å; I31-V34 PolarHBondContact O-N 3.5Å; V34-S36 VanDerWaalsContact C-N 3.32Å; V34-S36 PolarHBondContact O-N 2.98Å; V34-V37 PolarHBondContact O-N 3.09Å; V34-I38 HydrophobicContact CG1-CD1 4.09Å; V34-I38 WeakPolarHBondContact O-CG1 3.43Å; V34-I38 PolarHBondContact O-N 3.44Å; V34-I38 VanDerWaalsContact O-N 3.16Å; V34-W461 HydrophobicContact CB-CH2 4.46Å; V34-W461 HydrophobicContact CG1-CH2 4.42Å; V34-W461 HydrophobicContact CG2-CE3 4.49Å; V34-W461 HydrophobicContact CG2-CH2 3.81Å; V34-W461 HydrophobicContact CG2-CZ3 3.54Å
35L81.2Confident75.1Confident90 Ų9063 Ų6347%0.47133%0.329SS..Hα-helixtrans-60.5-42.9176.3-74169.4000111.2I31 L32 V37 I38 V39I31-L35 HydrophobicContact CG2-CD1 3.85Å; I31-L35 HydrophobicContact CG2-CG 4.45Å; I31-L35 WeakPolarHBondContact O-CB 3.3Å; I31-L35 VanDerWaalsContact O-CG 3.32Å; I31-L35 WeakPolarHBondContact O-CG 3.4Å; I31-L35 PolarHBondContact O-N 3.28Å; L32-L35 PolarHBondContact O-N 3.14Å; L35-V37 VanDerWaalsContact C-N 3.3Å; L35-V37 PolarHBondContact O-N 3.26Å; L35-I38 PolarHBondContact O-N 3.01Å; L35-V39 WeakPolarHBondContact O-CB 3.14Å; L35-V39 VanDerWaalsContact O-CG2 3.24Å; L35-V39 WeakPolarHBondContact O-CG2 3.38Å; L35-V39 PolarHBondContact O-N 3.46Å
36S80.8Confident76.5Confident11 Ų1160.5 Ų60.58%0.07732%0.318CS..Hα-helixtrans-59.1-38.4177-74.10000113.4L32 S33 V34 G40 P278 V282L32-S36 WeakPolarHBondContact O-CB 3.39Å; L32-S36 PolarHBondContact O-N 3.43Å; L32-S36 PolarHBondContact O-OG 2.86Å; S33-S36 WeakPolarHBondContact O-CB 3.23Å; S33-S36 PolarHBondContact O-N 3.41Å; V34-S36 VanDerWaalsContact C-N 3.32Å; V34-S36 PolarHBondContact O-N 2.98Å; S36-G40 PolarHBondContact O-N 3.5Å; S36-P278 WeakPolarHBondContact CB-O 3.18Å; S36-P278 VanDerWaalsContact OG-C 3.22Å; S36-P278 WeakPolarHBondContact OG-CA 3.48Å; S36-P278 WeakPolarHBondContact OG-CB 3.41Å; S36-P278 PolarHBondContact OG-O 3.01Å; S36-V282 WeakPolarHBondContact O-CG2 3.48Å
37V74Confident78.3Confident15 Ų1554.1 Ų54.19%0.09129%0.29CS..Hα-helixtrans-66.5-47.1175.8172.10000110.7S33 V34 L35 V39 G40 C41 I281 I285 W461S33-V37 WeakPolarHBondContact O-CG2 3.26Å; S33-V37 PolarHBondContact O-N 2.87Å; S33-V37 VanDerWaalsContact O-N 3.09Å; V34-V37 PolarHBondContact O-N 3.09Å; L35-V37 VanDerWaalsContact C-N 3.3Å; L35-V37 PolarHBondContact O-N 3.26Å; V37-V39 PolarHBondContact O-N 3.46Å; V37-G40 PolarHBondContact O-N 3.15Å; V37-C41 WeakPolarHBondContact O-CB 3.23Å; V37-C41 PolarHBondContact O-N 3.48Å; V37-C41 PolarHBondContact O-SG 3.47Å; V37-C41 VanDerWaalsContact O-SG 3.37Å; V37-I281 HydrophobicContact CG2-CG2 3.8Å; V37-I285 HydrophobicContact CB-CD1 4.15Å; V37-I285 HydrophobicContact CG1-CD1 3.96Å; V37-I285 HydrophobicContact CG2-CD1 3.86Å; V37-W461 HydrophobicContact CB-CZ2 4.36Å; V37-W461 HydrophobicContact CG1-CZ2 4.17Å; V37-W461 HydrophobicContact CG2-CD2 3.88Å; V37-W461 HydrophobicContact CG2-CG 3.83Å; V37-W461 HydrophobicContact CG2-CZ2 4.25Å
38I82.3Confident79.4Confident88 Ų8854.7 Ų54.745%0.45129%0.287SS..Hα-helixtrans-60.8-48.1178.8-64.4167.6000110V34 L35 C41 L42V34-I38 HydrophobicContact CG1-CD1 4.09Å; V34-I38 WeakPolarHBondContact O-CG1 3.43Å; V34-I38 PolarHBondContact O-N 3.44Å; V34-I38 VanDerWaalsContact O-N 3.16Å; L35-I38 PolarHBondContact O-N 3.01Å; I38-C41 PolarHBondContact O-N 3.29Å; I38-L42 HydrophobicContact CG2-CD1 3.96Å; I38-L42 HydrophobicContact CG2-CG 4.48Å; I38-L42 WeakPolarHBondContact O-CB 3.42Å; I38-L42 VanDerWaalsContact O-CG 3.29Å; I38-L42 WeakPolarHBondContact O-CG 3.35Å; I38-L42 PolarHBondContact O-N 3.33Å
39V89.9Confident80.4Confident74 Ų7458.2 Ų58.245%0.44830%0.304SS..Hα-helixtrans-62.6-44.2177.9172.50000110.9L35 V37 C41 L42 L43 V282L35-V39 WeakPolarHBondContact O-CB 3.14Å; L35-V39 VanDerWaalsContact O-CG2 3.24Å; L35-V39 WeakPolarHBondContact O-CG2 3.38Å; L35-V39 PolarHBondContact O-N 3.46Å; V37-V39 PolarHBondContact O-N 3.46Å; V39-C41 PolarHBondContact O-N 2.95Å; V39-L42 PolarHBondContact O-N 3.12Å; V39-L43 WeakPolarHBondContact O-CB 3.48Å; V39-L43 PolarHBondContact O-N 2.82Å; V39-V282 HydrophobicContact CG1-CG1 4.08Å; V39-V282 HydrophobicContact CG1-CG2 4.46Å
40G86.9Confident81.6Confident0 Ų060.5 Ų60.50%031%0.313CS..Hα-helixtrans-60.7-43.8176.700000112.6S36 V37 G44 V282 A286S36-G40 PolarHBondContact O-N 3.5Å; V37-G40 PolarHBondContact O-N 3.15Å; G40-G44 PolarHBondContact O-N 3.15Å; G40-V282 WeakPolarHBondContact CA-O 3.1Å; G40-A286 WeakPolarHBondContact O-CA 3.4Å; G40-A286 VanDerWaalsContact O-CB 3.31Å; G40-A286 WeakPolarHBondContact O-CB 3.47Å
41C83.7Confident82.8Confident44 Ų4469.5 Ų69.530%0.29734%0.343SS..Hα-helixtrans-61.4-51.3174.4-74.30000111.8V37 I38 V39 L43 G44 F45 I289V37-C41 WeakPolarHBondContact O-CB 3.23Å; V37-C41 PolarHBondContact O-N 3.48Å; V37-C41 PolarHBondContact O-SG 3.47Å; V37-C41 VanDerWaalsContact O-SG 3.37Å; I38-C41 PolarHBondContact O-N 3.29Å; V39-C41 PolarHBondContact O-N 2.95Å; C41-L43 VanDerWaalsContact C-N 3.35Å; C41-L43 PolarHBondContact O-N 3.17Å; C41-G44 PolarHBondContact O-N 3.29Å; C41-F45 WeakPolarHBondContact O-CD2 3.46Å; C41-F45 PolarHBondContact O-N 2.92Å; C41-I289 HydrophobicContact CB-CD1 4.42Å
42L89.6Confident83.6Confident119 Ų11969.7 Ų69.762%0.62334%0.344SS*.Hα-helixtrans-60.5-44.7180-69.8173.6000111.7I38 V39 F46I38-L42 HydrophobicContact CG2-CD1 3.96Å; I38-L42 HydrophobicContact CG2-CG 4.48Å; I38-L42 WeakPolarHBondContact O-CB 3.42Å; I38-L42 VanDerWaalsContact O-CG 3.29Å; I38-L42 WeakPolarHBondContact O-CG 3.35Å; I38-L42 PolarHBondContact O-N 3.33Å; V39-L42 PolarHBondContact O-N 3.12Å; L42-F46 VanDerWaalsContact O-CB 3.29Å; L42-F46 WeakPolarHBondContact O-CB 3.22Å; L42-F46 PolarHBondContact O-N 2.98Å
43L91.7Very high84.3Confident53 Ų5368 Ų6828%0.27734%0.34SS..Hα-helixtrans-65.6-42.3178.7-175.460.9000111.5V39 C41 F46 L47 F60 V282 A286V39-L43 WeakPolarHBondContact O-CB 3.48Å; V39-L43 PolarHBondContact O-N 2.82Å; C41-L43 VanDerWaalsContact C-N 3.35Å; C41-L43 PolarHBondContact O-N 3.17Å; L43-F46 PolarHBondContact O-N 3.34Å; L43-L47 HydrophobicContact CD1-CD1 3.96Å; L43-L47 HydrophobicContact CD1-CG 4.02Å; L43-L47 HydrophobicContact CG-CD1 3.85Å; L43-L47 HydrophobicContact CG-CG 4.31Å; L43-L47 WeakPolarHBondContact O-CB 3.42Å; L43-L47 VanDerWaalsContact O-CG 3.29Å; L43-L47 WeakPolarHBondContact O-CG 3.42Å; L43-L47 PolarHBondContact O-N 2.93Å; L43-F60 HydrophobicContact CD2-CE2 4.14Å; L43-F60 HydrophobicContact CD2-CZ 3.72Å; L43-F60 HydrophobicContact CG-CZ 4.12Å; L43-V282 HydrophobicContact CD2-CG1 4.1Å; L43-A286 HydrophobicContact CB-CB 4.34Å; L43-A286 HydrophobicContact CD2-CB 4.48Å; L43-A286 HydrophobicContact CG-CB 4.39Å
44G87.7Confident85.3Confident0 Ų073.1 Ų73.10%037%0.372CS..Hα-helixtrans-61-47.5176.300000112.6G40 C41 F46 L47 R48G40-G44 PolarHBondContact O-N 3.15Å; C41-G44 PolarHBondContact O-N 3.29Å; G44-F46 VanDerWaalsContact C-N 3.34Å; G44-F46 PolarHBondContact O-N 3.4Å; G44-L47 PolarHBondContact O-N 3.42Å; G44-R48 WeakPolarHBondContact O-CB 3.49Å; G44-R48 PolarHBondContact O-N 2.83Å
45F87.9Confident86.2Confident110 Ų11077.7 Ų77.748%0.48239%0.391SS..Hα-helixtrans-65-37.7176.4-78.5-64.9000112.6C41 I289 P295C41-F45 WeakPolarHBondContact O-CD2 3.46Å; C41-F45 PolarHBondContact O-N 2.92Å; F45-I289 HydrophobicContact CD1-CG2 4.23Å; F45-I289 HydrophobicContact CD2-CD1 4.48Å; F45-I289 HydrophobicContact CE1-CG2 4.35Å; F45-I289 HydrophobicContact CE2-CD1 4.31Å; F45-I289 HydrophobicContact CG-CG2 4.43Å; F45-P295 HydrophobicContact CE1-CB 3.68Å; F45-P295 HydrophobicContact CE1-CG 4.29Å; F45-P295 HydrophobicContact CZ-CB 4.21Å
46F90.8Very high86.6Confident123 Ų12378 Ų7854%0.53939%0.39SS..Hα-helixtrans-65.8-49.3175.9176.2-101.5000112.1L42 L43 G44 R48 T49L42-F46 VanDerWaalsContact O-CB 3.29Å; L42-F46 WeakPolarHBondContact O-CB 3.22Å; L42-F46 PolarHBondContact O-N 2.98Å; L43-F46 PolarHBondContact O-N 3.34Å; G44-F46 VanDerWaalsContact C-N 3.34Å; G44-F46 PolarHBondContact O-N 3.4Å; F46-R48 PolarHBondContact O-N 2.97Å; F46-T49 PolarHBondContact O-N 2.96Å; F46-T49 VanDerWaalsContact O-N 3.11Å; F46-T49 PolarHBondContact O-OG1 2.77Å
47L90.1Very high86.9Confident27 Ų2778.7 Ų78.714%0.14139%0.393CS..Hα-helixtrans-65.2-28.1-180-71.3174.8000112.2L43 G44 T49 Q50 L52 F60 L290L43-L47 HydrophobicContact CD1-CD1 3.96Å; L43-L47 HydrophobicContact CD1-CG 4.02Å; L43-L47 HydrophobicContact CG-CD1 3.85Å; L43-L47 HydrophobicContact CG-CG 4.31Å; L43-L47 WeakPolarHBondContact O-CB 3.42Å; L43-L47 VanDerWaalsContact O-CG 3.29Å; L43-L47 WeakPolarHBondContact O-CG 3.42Å; L43-L47 PolarHBondContact O-N 2.93Å; G44-L47 PolarHBondContact O-N 3.42Å; L47-T49 PolarHBondContact O-N 3.07Å; L47-Q50 WeakPolarHBondContact O-CB 3.13Å; L47-Q50 PolarHBondContact O-N 3.43Å; L47-L52 HydrophobicContact CB-CD1 3.97Å; L47-L52 HydrophobicContact CD2-CD1 4.32Å; L47-F60 HydrophobicContact CD1-CD1 4.31Å; L47-F60 HydrophobicContact CD1-CD2 4.02Å; L47-F60 HydrophobicContact CD1-CE1 3.76Å; L47-F60 HydrophobicContact CD1-CE2 3.44Å; L47-F60 VanDerWaalsContact CD1-CE2 3.44Å; L47-F60 HydrophobicContact CD1-CG 4.42Å; L47-F60 HydrophobicContact CD1-CZ 3.3Å; L47-L290 HydrophobicContact CB-CD1 4.08Å; L47-L290 HydrophobicContact CB-CD2 3.74Å; L47-L290 HydrophobicContact CB-CG 4.39Å; L47-L290 HydrophobicContact CD1-CD1 4.25Å
48R83.8Confident87.4Confident73 Ų7381 Ų8128%0.27541%0.41SS..Hα-helixtrans-61-32.4174.8-167.9-176.1-176.281.97.6112.4G44 F46 Q50 R51 I289 L290 M292 D293 P295G44-R48 WeakPolarHBondContact O-CB 3.49Å; G44-R48 PolarHBondContact O-N 2.83Å; F46-R48 PolarHBondContact O-N 2.97Å; R48-Q50 PolarHBondContact O-N 3.01Å; R48-R51 PolarHBondContact O-N 3.25Å; R48-I289 PolarHBondContact NH1-O 3.29Å; R48-L290 HydrophobicContact CB-CD2 4.02Å; R48-L290 VanDerWaalsContact N-CD2 3.3Å; R48-M292 PolarHBondContact NH1-O 3.37Å; R48-M292 PolarHBondContact NH2-O 3.5Å; R48-D293 VanDerWaalsContact NH2-C 3.34Å; R48-D293 PolarHBondContact NH2-O 2.89Å; R48-P295 VanDerWaalsContact CZ-CG 3.45Å
49T86.9Confident87.9Confident100 Ų10085.3 Ų85.361%0.61342%0.421SS*.THydrogen-bonded Turntrans-68.3-17.2177.371.90000112.6F46 L47F46-T49 PolarHBondContact O-N 2.96Å; F46-T49 VanDerWaalsContact O-N 3.11Å; F46-T49 PolarHBondContact O-OG1 2.77Å; L47-T49 PolarHBondContact O-N 3.07Å
50Q87.3Confident87.9Confident115 Ų11584 Ų8454%0.53741%0.41SS..THydrogen-bonded Turntrans-90-4.5-176.8-55.7-61-26.400113.9L47 R48 L52L47-Q50 WeakPolarHBondContact O-CB 3.13Å; L47-Q50 PolarHBondContact O-N 3.43Å; R48-Q50 PolarHBondContact O-N 3.01Å; Q50-L52 PolarHBondContact O-N 3.29Å
51R83.1Confident87.7Confident236 Ų23685.3 Ų85.389%0.89142%0.416SS*.  trans45.258-179.9-65.4-166176.4-162.1-0.5113.8R48R48-R51 PolarHBondContact O-N 3.25Å
52L85.7Confident88Confident53 Ų5388.8 Ų88.828%0.27743%0.426SS..  trans-59.6150.1176.2-68.7154.4000112.3L47 Q50 E56 I57 L290L47-L52 HydrophobicContact CB-CD1 3.97Å; L47-L52 HydrophobicContact CD2-CD1 4.32Å; Q50-L52 PolarHBondContact O-N 3.29Å; L52-E56 HydrophobicContact CB-CB 4.38Å; L52-E56 HydrophobicContact CD2-CB 4.07Å; L52-I57 HydrophobicContact CB-CD1 4.45Å; L52-I57 HydrophobicContact CB-CG1 3.93Å; L52-L290 HydrophobicContact CD1-CD1 4Å; L52-L290 HydrophobicContact CD1-CD2 4.33Å
53S90.1Very high87.9Confident45 Ų4584.2 Ų84.232%0.31540%0.403SS..  trans-72.7158.1172.469.50000111.9Q55 E56 I57S53-Q55 VanDerWaalsContact C-N 3.25Å; S53-Q55 PolarHBondContact O-N 3.42Å; S53-E56 VanDerWaalsContact CB-OE2 3.3Å; S53-E56 WeakPolarHBondContact CB-OE2 3.36Å; S53-E56 PolarHBondContact N-OE2 3.34Å; S53-E56 PolarHBondContact O-N 3.05Å; S53-E56 VanDerWaalsContact O-N 3.15Å; S53-E56 VanDerWaalsContact OG-CG 3.25Å; S53-E56 WeakPolarHBondContact OG-CG 3.43Å; S53-E56 PolarHBondContact OG-N 2.84Å; S53-E56 PolarHBondContact OG-OE2 2.93Å; S53-I57 WeakPolarHBondContact O-CG1 3.2Å; S53-I57 PolarHBondContact O-N 3.39Å
54P86.4Confident87Confident113 Ų11381.8 Ų81.873%0.73439%0.391SS*.Hα-helixtrans-58-34178.9-26.135000114.3S58P54-S58 PolarHBondContact O-N 3.2Å; P54-S58 VanDerWaalsContact O-N 3.1Å
55Q89.5Confident86.4Confident142 Ų14285.4 Ų85.466%0.66441%0.408SS*.Hα-helixtrans-68.6-42177.3-71.5-178.7-9.200111.7S53 I57 S58 Y59S53-Q55 VanDerWaalsContact C-N 3.25Å; S53-Q55 PolarHBondContact O-N 3.42Å; Q55-I57 VanDerWaalsContact C-N 3.34Å; Q55-I57 PolarHBondContact O-N 2.87Å; Q55-S58 WeakPolarHBondContact O-CB 3.41Å; Q55-S58 PolarHBondContact O-N 2.81Å; Q55-Y59 PolarHBondContact O-N 2.79Å
56E90.1Very high86Confident96 Ų9683.2 Ų83.245%0.44940%0.401SS..Hα-helixtrans-65.9-37.8177.1-68.6164.1138.300111.7L52 S53 S58 Y59 F60L52-E56 HydrophobicContact CB-CB 4.38Å; L52-E56 HydrophobicContact CD2-CB 4.07Å; S53-E56 VanDerWaalsContact CB-OE2 3.3Å; S53-E56 WeakPolarHBondContact CB-OE2 3.36Å; S53-E56 PolarHBondContact N-OE2 3.34Å; S53-E56 PolarHBondContact O-N 3.05Å; S53-E56 VanDerWaalsContact O-N 3.15Å; S53-E56 VanDerWaalsContact OG-CG 3.25Å; S53-E56 WeakPolarHBondContact OG-CG 3.43Å; S53-E56 PolarHBondContact OG-N 2.84Å; S53-E56 PolarHBondContact OG-OE2 2.93Å; E56-S58 VanDerWaalsContact C-N 3.33Å; E56-S58 PolarHBondContact O-N 3.49Å; E56-Y59 PolarHBondContact O-N 3.43Å; E56-F60 VanDerWaalsContact O-CB 3.29Å; E56-F60 WeakPolarHBondContact O-CB 3.33Å; E56-F60 PolarHBondContact O-N 2.83Å
57I86.8Confident85.1Confident27 Ų2777.6 Ų77.614%0.13838%0.377CS..Hα-helixtrans-61.1-44174-65.2169000110.3L52 S53 Q55 F60 Q61 L290 E291L52-I57 HydrophobicContact CB-CD1 4.45Å; L52-I57 HydrophobicContact CB-CG1 3.93Å; S53-I57 WeakPolarHBondContact O-CG1 3.2Å; S53-I57 PolarHBondContact O-N 3.39Å; Q55-I57 VanDerWaalsContact C-N 3.34Å; Q55-I57 PolarHBondContact O-N 2.87Å; I57-F60 PolarHBondContact O-N 2.91Å; I57-Q61 HydrophobicContact CG2-CG 4.46Å; I57-Q61 WeakPolarHBondContact O-CB 3.41Å; I57-Q61 WeakPolarHBondContact O-CG 3.39Å; I57-Q61 PolarHBondContact O-N 2.89Å; I57-L290 HydrophobicContact CD1-CB 4.26Å; I57-L290 HydrophobicContact CG1-CB 4.28Å; I57-L290 HydrophobicContact CG1-CD1 4.4Å; I57-L290 HydrophobicContact CG2-CB 4.2Å; I57-E291 HydrophobicContact CG2-CG 4.25Å
58S84.7Confident83.9Confident64 Ų6477.7 Ų77.745%0.44838%0.377SS..Hα-helixtrans-61.5-44.9177.1-179.40000112.2P54 Q55 E56 F60 Q61 F62P54-S58 PolarHBondContact O-N 3.2Å; P54-S58 VanDerWaalsContact O-N 3.1Å; Q55-S58 WeakPolarHBondContact O-CB 3.41Å; Q55-S58 PolarHBondContact O-N 2.81Å; E56-S58 VanDerWaalsContact C-N 3.33Å; E56-S58 PolarHBondContact O-N 3.49Å; S58-F60 PolarHBondContact O-N 3.47Å; S58-Q61 PolarHBondContact O-N 3.42Å; S58-F62 PolarHBondContact O-N 2.89Å
59Y92.3Very high83.4Confident178 Ų17881.7 Ų81.770%0.69839%0.392SS*.Hα-helixtrans-65.8-38.6176.5-64.6-22000112.9Q55 E56 Q61 F62Q55-Y59 PolarHBondContact O-N 2.79Å; E56-Y59 PolarHBondContact O-N 3.43Å; Y59-Q61 VanDerWaalsContact C-N 3.32Å; Y59-Q61 PolarHBondContact O-N 3.09Å; Y59-F62 WeakPolarHBondContact O-CB 3.29Å; Y59-F62 PolarHBondContact O-N 3.2Å
60F90.2Very high82.6Confident46 Ų4679.5 Ų79.520%0.20238%0.375CS..Hα-helixtrans-64.9-36.3176.8177.5-97.6000112.3L43 L47 E56 I57 S58 F62 P63 F283 A286 L290L43-F60 HydrophobicContact CD2-CE2 4.14Å; L43-F60 HydrophobicContact CD2-CZ 3.72Å; L43-F60 HydrophobicContact CG-CZ 4.12Å; L47-F60 HydrophobicContact CD1-CD1 4.31Å; L47-F60 HydrophobicContact CD1-CD2 4.02Å; L47-F60 HydrophobicContact CD1-CE1 3.76Å; L47-F60 HydrophobicContact CD1-CE2 3.44Å; L47-F60 VanDerWaalsContact CD1-CE2 3.44Å; L47-F60 HydrophobicContact CD1-CG 4.42Å; L47-F60 HydrophobicContact CD1-CZ 3.3Å; E56-F60 VanDerWaalsContact O-CB 3.29Å; E56-F60 WeakPolarHBondContact O-CB 3.33Å; E56-F60 PolarHBondContact O-N 2.83Å; I57-F60 PolarHBondContact O-N 2.91Å; S58-F60 PolarHBondContact O-N 3.47Å; F60-F62 VanDerWaalsContact C-N 3.31Å; F60-F62 PolarHBondContact O-N 2.69Å; F60-P63 WeakPolarHBondContact O-CD 3.19Å; F60-F283 HydrophobicContact CD2-CD1 4.26Å; F60-F283 HydrophobicContact CD2-CE1 4.45Å; F60-F283 HydrophobicContact CE1-CD1 4.3Å; F60-F283 AromaticContact CE2-CD1 3.82Å; F60-F283 HydrophobicContact CE2-CD1 3.82Å; F60-F283 AromaticContact CE2-CE1 3.91Å; F60-F283 HydrophobicContact CE2-CE1 3.91Å; F60-F283 AromaticContact CZ-CD1 3.83Å; F60-F283 HydrophobicContact CZ-CD1 3.83Å; F60-F283 HydrophobicContact CZ-CE1 4.28Å; F60-F283 WeakPolarHBondContact O-CD1 3.48Å; F60-A286 HydrophobicContact CE1-CB 3.59Å; F60-A286 HydrophobicContact CZ-CB 3.83Å; F60-L290 HydrophobicContact CD1-CD1 3.97Å; F60-L290 HydrophobicContact CE1-CD1 4.2Å
61Q83.6Confident81.3Confident28 Ų2875.7 Ų75.713%0.13136%0.359CS..Hα-helixtrans-74.1-16.1179.5-81.1-179.713.500115I57 S58 Y59 P63 G64 E65 G287 E291I57-Q61 HydrophobicContact CG2-CG 4.46Å; I57-Q61 WeakPolarHBondContact O-CB 3.41Å; I57-Q61 WeakPolarHBondContact O-CG 3.39Å; I57-Q61 PolarHBondContact O-N 2.89Å; S58-Q61 PolarHBondContact O-N 3.42Å; Y59-Q61 VanDerWaalsContact C-N 3.32Å; Y59-Q61 PolarHBondContact O-N 3.09Å; Q61-P63 VanDerWaalsContact C-CD 3.46Å; Q61-P63 VanDerWaalsContact O-N 3.17Å; Q61-G64 WeakPolarHBondContact O-CA 3.49Å; Q61-G64 PolarHBondContact O-N 2.93Å; Q61-E65 PolarHBondContact O-N 3.01Å; Q61-G287 VanDerWaalsContact CG-CA 3.49Å; Q61-G287 PolarHBondContact NE2-O 3.13Å; Q61-E291 PolarHBondContact NE2-OE1 3.3Å; Q61-E291 PolarHBondContact OE1-OE1 2.97Å; Q61-E291 VanDerWaalsContact OE1-OE1 3.09Å
62F89.1Confident80.3Confident116 Ų11670.1 Ų70.151%0.50934%0.341SS..Hα-helixtrans-50.4-42.3-171.3179.3-103.6000115S58 Y59 F60 G64 E65 L66S58-F62 PolarHBondContact O-N 2.89Å; Y59-F62 WeakPolarHBondContact O-CB 3.29Å; Y59-F62 PolarHBondContact O-N 3.2Å; F60-F62 VanDerWaalsContact C-N 3.31Å; F60-F62 PolarHBondContact O-N 2.69Å; F62-G64 VanDerWaalsContact C-N 3.3Å; F62-G64 PolarHBondContact O-N 3.32Å; F62-E65 WeakPolarHBondContact O-CB 3.41Å; F62-E65 PolarHBondContact O-N 3.33Å; F62-L66 PolarHBondContact O-N 3.19Å
63P87.8Confident79.9Confident23 Ų2373.6 Ų73.615%0.14936%0.357CS..Hα-helixtrans-62.3-35.5175.4-23.735.6000113.8F60 Q61 L67 Y276 F279 F283F60-P63 WeakPolarHBondContact O-CD 3.19Å; Q61-P63 VanDerWaalsContact C-CD 3.46Å; Q61-P63 VanDerWaalsContact O-N 3.17Å; P63-L67 PolarHBondContact O-N 3.39Å; P63-Y276 WeakPolarHBondContact CA-OH 3.05Å; P63-Y276 PolarHBondContact O-OH 3Å; P63-Y276 VanDerWaalsContact O-OH 3.07Å; P63-F279 HydrophobicContact CB-CD1 4.41Å; P63-F279 HydrophobicContact CB-CE1 3.81Å; P63-F279 HydrophobicContact CG-CE1 4.39Å; P63-F283 HydrophobicContact CB-CB 4.08Å; P63-F283 HydrophobicContact CB-CD2 3.65Å; P63-F283 HydrophobicContact CB-CE2 4.26Å; P63-F283 HydrophobicContact CB-CG 3.84Å; P63-F283 HydrophobicContact CG-CB 4.35Å; P63-F283 HydrophobicContact CG-CD1 4.1Å; P63-F283 HydrophobicContact CG-CD2 3.97Å; P63-F283 HydrophobicContact CG-CE1 4.41Å; P63-F283 HydrophobicContact CG-CE2 4.31Å; P63-F283 HydrophobicContact CG-CG 3.86Å
64G73.5Confident79Confident2 Ų272 Ų722%0.02135%0.345CS..Hα-helixtrans-69-39.2173.900000111.9Q61 F62 L67 M68 G280Q61-G64 WeakPolarHBondContact O-CA 3.49Å; Q61-G64 PolarHBondContact O-N 2.93Å; F62-G64 VanDerWaalsContact C-N 3.3Å; F62-G64 PolarHBondContact O-N 3.32Å; G64-L67 WeakPolarHBondContact O-CB 3.26Å; G64-L67 PolarHBondContact O-N 3.4Å; G64-M68 PolarHBondContact O-N 2.96Å; G64-G280 WeakPolarHBondContact CA-O 3.49Å
65E74.9Confident78.1Confident76 Ų7667.2 Ų67.236%0.35531%0.313SS..Hα-helixtrans-63-42.2174-166.2-165.2151.500111.7Q61 F62 L67 M68 R69Q61-E65 PolarHBondContact O-N 3.01Å; F62-E65 WeakPolarHBondContact O-CB 3.41Å; F62-E65 PolarHBondContact O-N 3.33Å; E65-L67 VanDerWaalsContact C-N 3.31Å; E65-L67 PolarHBondContact O-N 3.39Å; E65-M68 WeakPolarHBondContact O-CB 3.28Å; E65-M68 PolarHBondContact O-N 3.25Å; E65-M68 VanDerWaalsContact O-N 3.11Å; E65-R69 WeakPolarHBondContact O-CG 3.39Å; E65-R69 PolarHBondContact O-N 3.08Å; E65-R69 IonicContact OE1-CZ 3.18Å; E65-R69 IonicContact OE1-NE 3.8Å; E65-R69 PolarHBondContact OE1-NE 3.29Å; E65-R69 IonicContact OE1-NH2 3.74Å; E65-R69 PolarHBondContact OE1-NH2 3.14Å
66L80.3Confident77.6Confident65 Ų6563.1 Ų63.134%0.3430%0.295SS..Hα-helixtrans-60-42177.7-173.764000111.4F62 M68 R69 M70F62-L66 PolarHBondContact O-N 3.19Å; L66-M68 VanDerWaalsContact C-N 3.32Å; L66-M68 PolarHBondContact O-N 3Å; L66-R69 PolarHBondContact O-N 3.47Å; L66-M70 HydrophobicContact CG-SD 4.38Å; L66-M70 WeakPolarHBondContact O-CG 3.22Å; L66-M70 PolarHBondContact O-N 3.37Å
67L71.3Confident77.2Confident4 Ų460.5 Ų60.52%0.02129%0.287CS..Hα-helixtrans-56-47.9173.5174.362.9000111P63 G64 E65 R69 M70 L71 Y276 F277 I281P63-L67 PolarHBondContact O-N 3.39Å; G64-L67 WeakPolarHBondContact O-CB 3.26Å; G64-L67 PolarHBondContact O-N 3.4Å; E65-L67 VanDerWaalsContact C-N 3.31Å; E65-L67 PolarHBondContact O-N 3.39Å; L67-R69 VanDerWaalsContact C-N 3.33Å; L67-R69 PolarHBondContact O-N 3.16Å; L67-M70 PolarHBondContact O-N 3.3Å; L67-L71 HydrophobicContact CD1-CD1 4.38Å; L67-L71 HydrophobicContact CD1-CG 4.36Å; L67-L71 HydrophobicContact CG-CD1 4.41Å; L67-L71 WeakPolarHBondContact O-CG 3.3Å; L67-L71 PolarHBondContact O-N 3.48Å; L67-Y276 HydrophobicContact CB-CD1 4.11Å; L67-Y276 HydrophobicContact CB-CE1 3.85Å; L67-Y276 HydrophobicContact CD1-CD1 4.02Å; L67-F277 HydrophobicContact CD1-CB 4.47Å; L67-F277 HydrophobicContact CD1-CD2 4.04Å; L67-F277 HydrophobicContact CD2-CD2 3.79Å; L67-F277 HydrophobicContact CD2-CE2 4.19Å; L67-F277 HydrophobicContact CG-CD2 4.49Å; L67-I281 HydrophobicContact CD2-CG1 4.44Å
68M64.4Low76.4Confident29 Ų2959.8 Ų59.814%0.14328%0.283CS..Hα-helixtrans-63.2-38.1179.4-66.1-55.4-69.800112.6G64 E65 L66 L71 K72 L284 I457G64-M68 PolarHBondContact O-N 2.96Å; E65-M68 WeakPolarHBondContact O-CB 3.28Å; E65-M68 PolarHBondContact O-N 3.25Å; E65-M68 VanDerWaalsContact O-N 3.11Å; L66-M68 VanDerWaalsContact C-N 3.32Å; L66-M68 PolarHBondContact O-N 3Å; M68-L71 PolarHBondContact O-N 2.98Å; M68-K72 WeakPolarHBondContact O-CB 3.12Å; M68-K72 VanDerWaalsContact O-CG 3.29Å; M68-K72 WeakPolarHBondContact O-CG 3.42Å; M68-K72 PolarHBondContact O-N 3.17Å; M68-L284 HydrophobicContact CG-CD1 3.72Å; M68-L284 HydrophobicContact SD-CD1 3.78Å; M68-I457 HydrophobicContact CE-CD1 3.48Å; M68-I457 VanDerWaalsContact CE-CD1 3.48Å; M68-I457 HydrophobicContact SD-CD1 3.53Å; M68-I457 VanDerWaalsContact SD-CD1 3.53Å
69R72.6Confident75.7Confident157 Ų15756.9 Ų56.959%0.59226%0.263SS*.Hα-helixtrans-65.8-42.1175.3-70178.3178.1-132.64.5111.9E65 L66 L67 K72 M73E65-R69 WeakPolarHBondContact O-CG 3.39Å; E65-R69 PolarHBondContact O-N 3.08Å; E65-R69 IonicContact OE1-CZ 3.18Å; E65-R69 IonicContact OE1-NE 3.8Å; E65-R69 PolarHBondContact OE1-NE 3.29Å; E65-R69 IonicContact OE1-NH2 3.74Å; E65-R69 PolarHBondContact OE1-NH2 3.14Å; L66-R69 PolarHBondContact O-N 3.47Å; L67-R69 VanDerWaalsContact C-N 3.33Å; L67-R69 PolarHBondContact O-N 3.16Å; R69-K72 PolarHBondContact O-N 2.83Å; R69-M73 PolarHBondContact O-N 3.49Å
70M70.1Confident75.3Confident54 Ų5450.3 Ų50.327%0.26624%0.241SC..Hα-helixtrans-60.3-45.5175.9-70.6172.367.400111.5L66 L67 M73 L74 A273 Y276L66-M70 HydrophobicContact CG-SD 4.38Å; L66-M70 WeakPolarHBondContact O-CG 3.22Å; L66-M70 PolarHBondContact O-N 3.37Å; L67-M70 PolarHBondContact O-N 3.3Å; M70-M73 PolarHBondContact O-N 3.14Å; M70-L74 WeakPolarHBondContact O-CG 3.39Å; M70-A273 HydrophobicContact CE-CB 3.74Å; M70-Y276 HydrophobicContact SD-CD1 3.87Å; M70-Y276 HydrophobicContact SD-CE1 4.27Å; M70-Y276 HydrophobicContact SD-CG 4.35Å
71L60.8Low74.9Confident36 Ų3648.1 Ų48.119%0.18823%0.232CC..Hα-helixtrans-64.5-43.3177-64.7178.3000111.7L67 M68 M73 L74 I75 V437L67-L71 HydrophobicContact CD1-CD1 4.38Å; L67-L71 HydrophobicContact CD1-CG 4.36Å; L67-L71 HydrophobicContact CG-CD1 4.41Å; L67-L71 WeakPolarHBondContact O-CG 3.3Å; L67-L71 PolarHBondContact O-N 3.48Å; M68-L71 PolarHBondContact O-N 2.98Å; L71-M73 VanDerWaalsContact C-N 3.31Å; L71-M73 PolarHBondContact O-N 3.25Å; L71-L74 PolarHBondContact O-N 3.45Å; L71-I75 WeakPolarHBondContact O-CG1 3.43Å; L71-V437 HydrophobicContact CB-CG2 4.5Å
72K62.3Low74.4Confident118 Ų11847.1 Ų47.151%0.51323%0.227SC..Hα-helixtrans-61.8-35.4178.2-77177-178.6-179.60113.6M68 R69 L74 I75M68-K72 WeakPolarHBondContact O-CB 3.12Å; M68-K72 VanDerWaalsContact O-CG 3.29Å; M68-K72 WeakPolarHBondContact O-CG 3.42Å; M68-K72 PolarHBondContact O-N 3.17Å; R69-K72 PolarHBondContact O-N 2.83Å; K72-L74 VanDerWaalsContact C-N 3.29Å; K72-L74 PolarHBondContact O-N 2.94Å; K72-I75 HydrophobicContact CB-CD1 4.24Å; K72-I75 HydrophobicContact CG-CD1 4.23Å; K72-I75 WeakPolarHBondContact O-CD1 3.44Å; K72-I75 VanDerWaalsContact O-CG1 3.24Å; K72-I75 WeakPolarHBondContact O-CG1 3.2Å; K72-I75 PolarHBondContact O-N 3.33Å
73M78Confident73.7Confident126 Ų12641.7 Ų41.762%0.62120%0.204SC*.Hα-helixtrans-64.5-33.6177.6-178.1-172.27100112.5R69 M70 L71 I75 P77R69-M73 PolarHBondContact O-N 3.49Å; M70-M73 PolarHBondContact O-N 3.14Å; L71-M73 VanDerWaalsContact C-N 3.31Å; L71-M73 PolarHBondContact O-N 3.25Å; M73-I75 VanDerWaalsContact C-N 3.33Å; M73-P77 WeakPolarHBondContact O-CD 3.48Å
74L70.4Confident73.5Confident11 Ų1141.2 Ų41.26%0.05820%0.2CC..Hα-helixtrans-80.2-15.9-174.6-62.7170.1000113.2M70 L71 K72 P77 L78 V266 I269 V270 A273M70-L74 WeakPolarHBondContact O-CG 3.39Å; L71-L74 PolarHBondContact O-N 3.45Å; K72-L74 VanDerWaalsContact C-N 3.29Å; K72-L74 PolarHBondContact O-N 2.94Å; L74-P77 WeakPolarHBondContact O-CD 3.27Å; L74-L78 WeakPolarHBondContact O-CB 3.29Å; L74-L78 PolarHBondContact O-N 3.12Å; L74-V266 HydrophobicContact CD2-CG1 4.25Å; L74-I269 HydrophobicContact CD2-CB 4.13Å; L74-I269 HydrophobicContact CD2-CG2 3.64Å; L74-V270 HydrophobicContact CD1-CG2 3.78Å; L74-A273 HydrophobicContact CD1-CB 4.35Å
75I67.4Low73.7Confident14 Ų1441.6 Ų41.67%0.07220%0.202CC..Hα-helixtrans-58.6-57.8-175.5-50.5175.1000111.3L71 K72 M73 L78 V79 M229 V437L71-I75 WeakPolarHBondContact O-CG1 3.43Å; K72-I75 HydrophobicContact CB-CD1 4.24Å; K72-I75 HydrophobicContact CG-CD1 4.23Å; K72-I75 WeakPolarHBondContact O-CD1 3.44Å; K72-I75 VanDerWaalsContact O-CG1 3.24Å; K72-I75 WeakPolarHBondContact O-CG1 3.2Å; K72-I75 PolarHBondContact O-N 3.33Å; M73-I75 VanDerWaalsContact C-N 3.33Å; I75-L78 PolarHBondContact O-N 2.8Å; I75-V79 HydrophobicContact CG2-CG2 3.97Å; I75-V79 WeakPolarHBondContact O-CB 3.37Å; I75-V79 VanDerWaalsContact O-CG2 3.25Å; I75-V79 WeakPolarHBondContact O-CG2 3.22Å; I75-V79 PolarHBondContact O-N 3.05Å; I75-M229 HydrophobicContact CB-CE 3.79Å; I75-M229 HydrophobicContact CD1-CE 4.25Å; I75-M229 HydrophobicContact CG2-CE 3.44Å; I75-M229 VanDerWaalsContact CG2-CE 3.44Å; I75-V437 HydrophobicContact CB-CG1 3.92Å; I75-V437 HydrophobicContact CD1-CB 4.01Å; I75-V437 HydrophobicContact CD1-CG1 3.48Å; I75-V437 VanDerWaalsContact CD1-CG1 3.48Å; I75-V437 HydrophobicContact CD1-CG2 3.79Å; I75-V437 HydrophobicContact CG1-CB 4.01Å; I75-V437 HydrophobicContact CG1-CG1 3.29Å; I75-V437 HydrophobicContact CG1-CG2 3.66Å; I75-V437 HydrophobicContact CG2-CG1 3.5Å
76L78.2Confident73.6Confident55 Ų5538.9 Ų38.929%0.28819%0.194SC..Hα-helixtrans-57.9-56-172.5177.963.8000113.1L78 V80 T165 M229 I234L76-L78 VanDerWaalsContact C-N 3.27Å; L76-L78 PolarHBondContact O-N 3.09Å; L76-V80 HydrophobicContact CD1-CG2 4.07Å; L76-V80 WeakPolarHBondContact O-CG2 3.32Å; L76-V80 PolarHBondContact O-N 3.39Å; L76-V80 VanDerWaalsContact O-N 3.16Å; L76-T165 HydrophobicContact CD1-CG2 4.01Å; L76-T165 HydrophobicContact CD2-CG2 3.75Å; L76-M229 HydrophobicContact CB-SD 3.87Å; L76-M229 HydrophobicContact CD1-SD 3.97Å; L76-M229 HydrophobicContact CG-SD 4.4Å; L76-I234 HydrophobicContact CD1-CD1 3.59Å; L76-I234 HydrophobicContact CD1-CG1 4.46Å; L76-I234 HydrophobicContact CD1-CG2 4.14Å
77P81.4Confident73.3Confident41 Ų4136.7 Ų36.727%0.26618%0.183SC..Hα-helixtrans-66.4-32-178.127.9-36.3000111.9M73 L74 S81 V266M73-P77 WeakPolarHBondContact O-CD 3.48Å; L74-P77 WeakPolarHBondContact O-CD 3.27Å; P77-S81 WeakPolarHBondContact O-CB 3.03Å; P77-S81 PolarHBondContact O-N 3.26Å; P77-S81 VanDerWaalsContact O-N 3.12Å; P77-S81 PolarHBondContact O-OG 3.42Å; P77-V266 HydrophobicContact CB-CG2 3.91Å; P77-V266 HydrophobicContact CG-CG1 4.48Å; P77-V266 HydrophobicContact CG-CG2 4.19Å
78L71.6Confident73.7Confident12 Ų1237 Ų376%0.06319%0.186CC..Hα-helixtrans-69-51.4178.6-172.461.8000111.7L74 I75 L76 V80 S81 S82 N263 V266 M267 A429 I431L74-L78 WeakPolarHBondContact O-CB 3.29Å; L74-L78 PolarHBondContact O-N 3.12Å; I75-L78 PolarHBondContact O-N 2.8Å; L76-L78 VanDerWaalsContact C-N 3.27Å; L76-L78 PolarHBondContact O-N 3.09Å; L78-V80 PolarHBondContact O-N 3.22Å; L78-S81 PolarHBondContact O-N 2.95Å; L78-S81 PolarHBondContact O-OG 2.96Å; L78-S82 WeakPolarHBondContact O-CB 3.47Å; L78-S82 PolarHBondContact O-N 3.38Å; L78-S82 PolarHBondContact O-OG 2.91Å; L78-N263 WeakPolarHBondContact CD1-OD1 3.48Å; L78-V266 HydrophobicContact CB-CG1 4.02Å; L78-V266 HydrophobicContact CD1-CG1 4.08Å; L78-M267 HydrophobicContact CD1-CG 4.45Å; L78-M267 HydrophobicContact CD1-SD 4.1Å; L78-A429 HydrophobicContact CD1-CB 4.15Å; L78-A429 HydrophobicContact CD2-CB 3.38Å; L78-A429 HydrophobicContact CG-CB 3.83Å; L78-I431 HydrophobicContact CD2-CD1 3.86Å
79V69.9Low73.9Confident4 Ų438.6 Ų38.62%0.02420%0.2CC..Hα-helixtrans-58.9-48.2-179.9170.40000110.7I75 S82 L83 I234 V235I75-V79 HydrophobicContact CG2-CG2 3.97Å; I75-V79 WeakPolarHBondContact O-CB 3.37Å; I75-V79 VanDerWaalsContact O-CG2 3.25Å; I75-V79 WeakPolarHBondContact O-CG2 3.22Å; I75-V79 PolarHBondContact O-N 3.05Å; V79-S82 PolarHBondContact O-OG 2.95Å; V79-L83 HydrophobicContact CG1-CD1 3.68Å; V79-L83 VanDerWaalsContact O-CB 3.28Å; V79-L83 WeakPolarHBondContact O-CB 3.41Å; V79-L83 VanDerWaalsContact O-CG 3.27Å; V79-L83 WeakPolarHBondContact O-CG 3.3Å; V79-L83 PolarHBondContact O-N 2.86Å; V79-L83 VanDerWaalsContact O-N 3.11Å; V79-I234 HydrophobicContact CG1-CG2 4.34Å; V79-V235 HydrophobicContact CG1-CG2 3.6Å
80V83.3Confident73.6Confident40 Ų4032.8 Ų32.824%0.24218%0.18CC..Hα-helixtrans-63.9-51.1-177.9173.80000111.2L76 L78 M84 I234 S238L76-V80 HydrophobicContact CD1-CG2 4.07Å; L76-V80 WeakPolarHBondContact O-CG2 3.32Å; L76-V80 PolarHBondContact O-N 3.39Å; L76-V80 VanDerWaalsContact O-N 3.16Å; L78-V80 PolarHBondContact O-N 3.22Å; V80-M84 HydrophobicContact CG1-SD 3.68Å; V80-M84 VanDerWaalsContact O-CB 3.28Å; V80-M84 WeakPolarHBondContact O-CB 3.49Å; V80-M84 WeakPolarHBondContact O-CG 3.43Å; V80-M84 PolarHBondContact O-N 3.31Å; V80-M84 VanDerWaalsContact O-N 3.13Å; V80-I234 HydrophobicContact CG2-CG2 3.47Å; V80-I234 VanDerWaalsContact CG2-CG2 3.47Å; V80-S238 WeakPolarHBondContact CA-OG 3.43Å
81S81.5Confident73Confident0 Ų033.7 Ų33.70%019%0.186CC..Hα-helixtrans-71.1-40.4-174.863.80000113P77 L78 S85 C259 N263P77-S81 WeakPolarHBondContact O-CB 3.03Å; P77-S81 PolarHBondContact O-N 3.26Å; P77-S81 VanDerWaalsContact O-N 3.12Å; P77-S81 PolarHBondContact O-OG 3.42Å; L78-S81 PolarHBondContact O-N 2.95Å; L78-S81 PolarHBondContact O-OG 2.96Å; S81-S85 WeakPolarHBondContact O-CB 3.38Å; S81-S85 PolarHBondContact O-N 3.42Å; S81-S85 VanDerWaalsContact O-N 3.09Å; S81-S85 PolarHBondContact O-OG 2.84Å; S81-C259 WeakPolarHBondContact CB-O 3.26Å; S81-N263 WeakPolarHBondContact OG-CA 3.44Å; S81-N263 WeakPolarHBondContact OG-CB 3.47Å
82S73.7Confident72.7Confident6 Ų633.4 Ų33.44%0.04219%0.189CC..Hα-helixtrans-68.8-43.9179.463.90000112.5L78 V79 S85 G86L78-S82 WeakPolarHBondContact O-CB 3.47Å; L78-S82 PolarHBondContact O-N 3.38Å; L78-S82 PolarHBondContact O-OG 2.91Å; V79-S82 PolarHBondContact O-OG 2.95Å; S82-S85 PolarHBondContact O-OG 3.06Å; S82-G86 WeakPolarHBondContact O-CA 3.3Å; S82-G86 PolarHBondContact O-N 3.39Å
83L73.1Confident72.2Confident2 Ų236.9 Ų36.91%0.0120%0.204CC..Hα-helixtrans-69.2-43.8178.9-70.6173.4000112.1V79 L87 V235 I426V79-L83 HydrophobicContact CG1-CD1 3.68Å; V79-L83 VanDerWaalsContact O-CB 3.28Å; V79-L83 WeakPolarHBondContact O-CB 3.41Å; V79-L83 VanDerWaalsContact O-CG 3.27Å; V79-L83 WeakPolarHBondContact O-CG 3.3Å; V79-L83 PolarHBondContact O-N 2.86Å; V79-L83 VanDerWaalsContact O-N 3.11Å; L83-L87 WeakPolarHBondContact O-CB 3.46Å; L83-L87 WeakPolarHBondContact O-CG 3.34Å; L83-L87 PolarHBondContact O-N 3.07Å; L83-V235 HydrophobicContact CD1-CB 4.03Å; L83-V235 HydrophobicContact CD1-CG1 3.8Å; L83-V235 HydrophobicContact CD1-CG2 3.92Å; L83-I426 HydrophobicContact CD2-CG2 3.78Å
84M84.1Confident70.8Confident14 Ų1436.9 Ų36.97%0.06921%0.212CC..Hα-helixtrans-62.5-48.4179.2-73.5177.663.900111.2V80 A88 S238 M241 G242 L245 L255 C259V80-M84 HydrophobicContact CG1-SD 3.68Å; V80-M84 VanDerWaalsContact O-CB 3.28Å; V80-M84 WeakPolarHBondContact O-CB 3.49Å; V80-M84 WeakPolarHBondContact O-CG 3.43Å; V80-M84 PolarHBondContact O-N 3.31Å; V80-M84 VanDerWaalsContact O-N 3.13Å; M84-A88 WeakPolarHBondContact O-CB 3.2Å; M84-A88 PolarHBondContact O-N 3.17Å; M84-S238 WeakPolarHBondContact CG-O 3.24Å; M84-M241 HydrophobicContact CE-CB 4.32Å; M84-M241 HydrophobicContact CE-CG 3.64Å; M84-M241 HydrophobicContact CG-CB 4.46Å; M84-M241 HydrophobicContact SD-CG 4.47Å; M84-G242 WeakPolarHBondContact O-CA 3.36Å; M84-L245 HydrophobicContact CE-CD1 3.68Å; M84-L255 HydrophobicContact CE-CD2 4.24Å; M84-L255 HydrophobicContact CE-CG 4.47Å; M84-C259 HydrophobicContact CB-CB 4.42Å
85S78.1Confident70.1Confident9 Ų937.9 Ų37.96%0.06322%0.22CC..Hα-helixtrans-70.6-40.7179.259.40000112.9S81 S82 A88 S89S81-S85 WeakPolarHBondContact O-CB 3.38Å; S81-S85 PolarHBondContact O-N 3.42Å; S81-S85 VanDerWaalsContact O-N 3.09Å; S81-S85 PolarHBondContact O-OG 2.84Å; S82-S85 PolarHBondContact O-OG 3.06Å; S85-A88 PolarHBondContact O-N 3.32Å; S85-S89 PolarHBondContact O-N 3.46Å; S85-S89 VanDerWaalsContact O-N 3.13Å
86G71.9Confident69.9Low19 Ų1939.9 Ų39.920%0.19624%0.235CC..Hα-helixtrans-61.2-48.7179.200000112S82 S89S82-G86 WeakPolarHBondContact O-CA 3.3Å; S82-G86 PolarHBondContact O-N 3.39Å; G86-S89 PolarHBondContact O-OG 3.11Å
87L75.8Confident70Confident20 Ų2043.9 Ų43.911%0.10525%0.246CC..Hα-helixtrans-78.7-25.7-179.1-67.2167.6000113.4L83 S89 L90 A239 I243 I385L83-L87 WeakPolarHBondContact O-CB 3.46Å; L83-L87 WeakPolarHBondContact O-CG 3.34Å; L83-L87 PolarHBondContact O-N 3.07Å; L87-S89 VanDerWaalsContact C-N 3.33Å; L87-L90 HydrophobicContact CD2-CD1 3.69Å; L87-L90 WeakPolarHBondContact O-CB 3.46Å; L87-L90 PolarHBondContact O-N 3.13Å; L87-A239 HydrophobicContact CD1-CB 3.42Å; L87-A239 VanDerWaalsContact CD1-CB 3.42Å; L87-I243 HydrophobicContact CB-CG1 4.12Å; L87-I385 HydrophobicContact CD2-CD1 3.88Å
88A78.9Confident70Confident10 Ų1042.5 Ų42.58%0.08324%0.236CC..Hα-helixtrans-71.4-28173.300000113.2M84 S85 L90 G242 L245 G246 V256M84-A88 WeakPolarHBondContact O-CB 3.2Å; M84-A88 PolarHBondContact O-N 3.17Å; S85-A88 PolarHBondContact O-N 3.32Å; A88-L90 PolarHBondContact O-N 2.87Å; A88-G242 WeakPolarHBondContact CA-O 3.43Å; A88-G242 VanDerWaalsContact CB-O 3.29Å; A88-G242 WeakPolarHBondContact CB-O 3.32Å; A88-G242 PolarHBondContact N-O 3.48Å; A88-L245 HydrophobicContact CB-CB 4.06Å; A88-G246 VanDerWaalsContact O-CA 3.3Å; A88-G246 WeakPolarHBondContact O-CA 3.35Å; A88-V256 HydrophobicContact CB-CB 4.4Å; A88-V256 HydrophobicContact CB-CG1 4.06Å; A88-V256 HydrophobicContact CB-CG2 3.42Å; A88-V256 VanDerWaalsContact CB-CG2 3.42Å
89S68.7Low70.4Confident63 Ų6342.3 Ų42.344%0.44124%0.237SC..THydrogen-bonded Turntrans-69.4-10.2175.775.60000113.8S85 G86 L87 D91S85-S89 PolarHBondContact O-N 3.46Å; S85-S89 VanDerWaalsContact O-N 3.13Å; G86-S89 PolarHBondContact O-OG 3.11Å; L87-S89 VanDerWaalsContact C-N 3.33Å; S89-D91 PolarHBondContact O-N 3.2Å
90L65.7Low71Confident34 Ų3447.8 Ų47.818%0.17827%0.265CS..SBendtrans-76.687.9175.2-59.7175.5000109.6L87 A88 A92 V103 F377 V381L87-L90 HydrophobicContact CD2-CD1 3.69Å; L87-L90 WeakPolarHBondContact O-CB 3.46Å; L87-L90 PolarHBondContact O-N 3.13Å; A88-L90 PolarHBondContact O-N 2.87Å; L90-A92 PolarHBondContact O-N 3Å; L90-V103 HydrophobicContact CD1-CG2 4.06Å; L90-F377 HydrophobicContact CD2-CE1 4.37Å; L90-F377 HydrophobicContact CD2-CE2 4.02Å; L90-F377 HydrophobicContact CD2-CZ 3.5Å; L90-F377 VanDerWaalsContact CD2-CZ 3.5Å; L90-V381 HydrophobicContact CD2-CG1 4.35Å; L90-V381 HydrophobicContact CD2-CG2 4.03Å
91D58.3Low71.2Confident73 Ų7348.5 Ų48.539%0.3927%0.267SS..  trans-59.9117.3179.7-177.416.8000112.1S89 K93 T94S89-D91 PolarHBondContact O-N 3.2Å; D91-K93 VanDerWaalsContact C-N 3.35Å; D91-K93 PolarHBondContact O-N 3.29Å; D91-K93 PolarHBondContact OD1-N 3.48Å; D91-T94 PolarHBondContact OD2-OG1 2.93Å
92A55Low71.5Confident30 Ų3048.5 Ų48.525%0.24827%0.267CS..THydrogen-bonded Turntrans-77.5-14.6-175.300000113.9L90 S96 R247L90-A92 PolarHBondContact O-N 3Å; A92-S96 WeakPolarHBondContact O-CB 3.32Å; A92-R247 HydrophobicContact CB-CG 4.3Å
93K52Low72.1Confident191 Ų19149.8 Ų49.883%0.8328%0.275SS*.THydrogen-bonded Turntrans-106.2-27.2-170-77.1180178.3175.30115.3D91D91-K93 VanDerWaalsContact C-N 3.35Å; D91-K93 PolarHBondContact O-N 3.29Å; D91-K93 PolarHBondContact OD1-N 3.48Å
94T47.4Very low72.9Confident127 Ų12752.2 Ų52.278%0.77930%0.295SS*.THydrogen-bonded Turntrans-124.5-17.7-173.90.40000114.7D91D91-T94 PolarHBondContact OD2-OG1 2.93Å
95S56.1Low73.3Confident32 Ų3252.5 Ų52.522%0.22430%0.296CS..SBendtrans-129.321.2-178.4-163.80000112.9R97 L98 G99S95-R97 VanDerWaalsContact C-N 3.32Å; S95-R97 PolarHBondContact O-N 2.88Å; S95-L98 PolarHBondContact O-N 3.09Å; S95-G99 PolarHBondContact O-N 2.98Å
96S64Low74Confident55 Ų5552.1 Ų52.139%0.38529%0.293SS..Hα-helixtrans-62.2-37-17163.40000112.9A92 I100A92-S96 WeakPolarHBondContact O-CB 3.32Å; S96-I100 VanDerWaalsContact O-CB 3.28Å; S96-I100 WeakPolarHBondContact O-CB 3.44Å; S96-I100 WeakPolarHBondContact O-CD1 3.42Å; S96-I100 WeakPolarHBondContact O-CG1 3.33Å; S96-I100 PolarHBondContact O-N 3.48Å
97R78.9Confident74.9Confident140 Ų14054.8 Ų54.853%0.52830%0.302SS..Hα-helixtrans-70.9-47.2-179.6-171.3177.5173.3-156.7-1.5112.6S95 G99 L101 D489S95-R97 VanDerWaalsContact C-N 3.32Å; S95-R97 PolarHBondContact O-N 2.88Å; R97-G99 VanDerWaalsContact C-N 3.31Å; R97-G99 PolarHBondContact O-N 3.33Å; R97-L101 WeakPolarHBondContact O-CB 3.49Å; R97-L101 PolarHBondContact O-N 3.19Å; R97-D489 IonicContact CZ-OD1 3.27Å; R97-D489 IonicContact CZ-OD2 3.57Å; R97-D489 IonicContact NE-OD2 2.83Å; R97-D489 IonicContact NH1-OD1 2.72Å; R97-D489 PolarHBondContact NH1-OD1 2.9Å; R97-D489 IonicContact NH1-OD2 3.43Å; R97-D489 PolarHBondContact NH1-OD2 3.22Å
98L83Confident75.8Confident11 Ų1160.7 Ų60.76%0.05832%0.323CS..Hα-helixtrans-61.1-44.1175.7177.567.7000110.2S95 T102 F377 V378 M482 C486 F490S95-L98 PolarHBondContact O-N 3.09Å; L98-T102 VanDerWaalsContact O-CB 3.26Å; L98-T102 WeakPolarHBondContact O-CB 3.42Å; L98-T102 PolarHBondContact O-N 2.88Å; L98-T102 PolarHBondContact O-OG1 2.99Å; L98-F377 HydrophobicContact CD2-CB 4.17Å; L98-F377 HydrophobicContact CD2-CD1 3.74Å; L98-F377 HydrophobicContact CD2-CE1 4.41Å; L98-F377 HydrophobicContact CD2-CG 4.02Å; L98-F377 HydrophobicContact CG-CD1 3.93Å; L98-F377 HydrophobicContact CG-CE1 4.19Å; L98-V378 HydrophobicContact CD1-CG2 4.48Å; L98-M482 HydrophobicContact CD1-CB 3.77Å; L98-M482 HydrophobicContact CD1-CG 4.2Å; L98-M482 HydrophobicContact CD1-SD 4.48Å; L98-C486 HydrophobicContact CD1-CB 4.49Å; L98-F490 HydrophobicContact CD2-CZ 4.22Å
99G79.2Confident76.6Confident8 Ų860.2 Ų60.28%0.08232%0.319CS..Hα-helixtrans-59.2-56.4177.100000113.8S95 R97 L101 T102 V103 F377S95-G99 PolarHBondContact O-N 2.98Å; R97-G99 VanDerWaalsContact C-N 3.31Å; R97-G99 PolarHBondContact O-N 3.33Å; G99-L101 VanDerWaalsContact C-N 3.31Å; G99-L101 PolarHBondContact O-N 2.82Å; G99-T102 PolarHBondContact O-N 2.75Å; G99-V103 WeakPolarHBondContact O-CG2 3.27Å; G99-V103 PolarHBondContact O-N 3.14Å; G99-F377 VanDerWaalsContact CA-CZ 3.48Å
100I82.1Confident77.8Confident120 Ų12057.3 Ų57.362%0.61530%0.299SS*.Hα-helixtrans-60-43.9-179-69.1164.4000110.7S96 T102 A104S96-I100 VanDerWaalsContact O-CB 3.28Å; S96-I100 WeakPolarHBondContact O-CB 3.44Å; S96-I100 WeakPolarHBondContact O-CD1 3.42Å; S96-I100 WeakPolarHBondContact O-CG1 3.33Å; S96-I100 PolarHBondContact O-N 3.48Å; I100-T102 PolarHBondContact O-N 2.8Å; I100-A104 WeakPolarHBondContact O-CB 3.49Å; I100-A104 PolarHBondContact O-N 2.86Å
101L88.1Confident79.2Confident55 Ų5559.6 Ų59.629%0.28831%0.307SS..Hα-helixtrans-65.4-40.1179.9-169.471.8000111.8R97 G99 Y105 M482 I485R97-L101 WeakPolarHBondContact O-CB 3.49Å; R97-L101 PolarHBondContact O-N 3.19Å; G99-L101 VanDerWaalsContact C-N 3.31Å; G99-L101 PolarHBondContact O-N 2.82Å; L101-Y105 VanDerWaalsContact O-CB 3.28Å; L101-Y105 WeakPolarHBondContact O-CB 3.06Å; L101-Y105 PolarHBondContact O-N 3.39Å; L101-M482 HydrophobicContact CB-SD 4.02Å; L101-M482 HydrophobicContact CD2-CE 4.32Å; L101-M482 HydrophobicContact CD2-SD 3.51Å; L101-M482 VanDerWaalsContact CD2-SD 3.51Å; L101-M482 HydrophobicContact CG-CE 3.97Å; L101-M482 HydrophobicContact CG-SD 3.65Å; L101-M482 WeakPolarHBondContact O-CE 3.04Å; L101-I485 HydrophobicContact CD2-CB 3.91Å; L101-I485 HydrophobicContact CD2-CD1 3.8Å; L101-I485 HydrophobicContact CD2-CG1 4.47Å; L101-I485 HydrophobicContact CD2-CG2 3.46Å; L101-I485 VanDerWaalsContact CD2-CG2 3.46Å
102T88.2Confident81Confident0 Ų058.3 Ų58.30%030%0.3CS..Hα-helixtrans-64.2-50177.2-58.90000111.2L98 G99 I100 A104 Y105 Y106 V378L98-T102 VanDerWaalsContact O-CB 3.26Å; L98-T102 WeakPolarHBondContact O-CB 3.42Å; L98-T102 PolarHBondContact O-N 2.88Å; L98-T102 PolarHBondContact O-OG1 2.99Å; G99-T102 PolarHBondContact O-N 2.75Å; I100-T102 PolarHBondContact O-N 2.8Å; T102-A104 PolarHBondContact O-N 2.97Å; T102-Y105 WeakPolarHBondContact O-CB 3.31Å; T102-Y105 PolarHBondContact O-N 3.4Å; T102-Y106 HydrophobicContact CG2-CD2 3.88Å; T102-Y106 HydrophobicContact CG2-CE1 4.42Å; T102-Y106 HydrophobicContact CG2-CE2 3.35Å; T102-Y106 WeakPolarHBondContact O-CD2 3.3Å; T102-Y106 VanDerWaalsContact O-CG 3.31Å; T102-Y106 PolarHBondContact O-N 3.27Å; T102-V378 HydrophobicContact CG2-CB 4.47Å; T102-V378 HydrophobicContact CG2-CG1 4.02Å; T102-V378 HydrophobicContact CG2-CG2 4.21Å
103V85.4Confident83Confident33 Ų3356.9 Ų56.920%0.229%0.289CS..Hα-helixtrans-63.3-43.5178.5173.60000111.1L90 G99 Y105 Y106 L107L90-V103 HydrophobicContact CD1-CG2 4.06Å; G99-V103 WeakPolarHBondContact O-CG2 3.27Å; G99-V103 PolarHBondContact O-N 3.14Å; V103-Y105 VanDerWaalsContact C-N 3.32Å; V103-Y105 PolarHBondContact O-N 3.38Å; V103-Y106 PolarHBondContact O-N 3.05Å; V103-L107 HydrophobicContact CG1-CD1 4.1Å; V103-L107 HydrophobicContact CG1-CG 4.36Å; V103-L107 WeakPolarHBondContact O-CG 3.44Å; V103-L107 PolarHBondContact O-N 3.37Å
104A89.4Confident85.1Confident53 Ų5347.8 Ų47.844%0.43825%0.249SC..Hα-helixtrans-61.7-40.5176.900000112I100 T102 W108I100-A104 WeakPolarHBondContact O-CB 3.49Å; I100-A104 PolarHBondContact O-N 2.86Å; T102-A104 PolarHBondContact O-N 2.97Å; A104-W108 WeakPolarHBondContact O-CB 3.42Å; A104-W108 PolarHBondContact O-N 3.49Å
105Y93.6Very high87.5Confident20 Ų2044 Ų448%0.07823%0.226CC..Hα-helixtrans-63-44.9174.9175.9-87.4000111.9L101 T102 V103 W108 T109 L324 A478 I481 M482L101-Y105 VanDerWaalsContact O-CB 3.28Å; L101-Y105 WeakPolarHBondContact O-CB 3.06Å; L101-Y105 PolarHBondContact O-N 3.39Å; T102-Y105 WeakPolarHBondContact O-CB 3.31Å; T102-Y105 PolarHBondContact O-N 3.4Å; V103-Y105 VanDerWaalsContact C-N 3.32Å; V103-Y105 PolarHBondContact O-N 3.38Å; Y105-W108 PolarHBondContact O-N 2.97Å; Y105-T109 HydrophobicContact CD1-CG2 4.26Å; Y105-T109 HydrophobicContact CD2-CG2 4.43Å; Y105-T109 HydrophobicContact CE1-CG2 3.71Å; Y105-T109 HydrophobicContact CE2-CG2 3.95Å; Y105-T109 PolarHBondContact O-N 3.02Å; Y105-T109 PolarHBondContact O-OG1 3.03Å; Y105-L324 HydrophobicContact CD2-CD2 4.33Å; Y105-L324 HydrophobicContact CE2-CD2 3.43Å; Y105-L324 VanDerWaalsContact CE2-CD2 3.43Å; Y105-L324 HydrophobicContact CE2-CG 4.11Å; Y105-A478 HydrophobicContact CD1-CB 3.75Å; Y105-A478 HydrophobicContact CE1-CB 3.51Å; Y105-I481 HydrophobicContact CD2-CD1 4.47Å; Y105-I481 HydrophobicContact CE2-CD1 3.45Å; Y105-I481 VanDerWaalsContact CE2-CD1 3.45Å; Y105-I481 WeakPolarHBondContact OH-CD1 3.35Å; Y105-M482 HydrophobicContact CD1-CE 4.45Å; Y105-M482 HydrophobicContact CD2-CE 4.32Å; Y105-M482 HydrophobicContact CG-CE 3.85Å
106Y92.3Very high89.4Confident1 Ų143.3 Ų43.30%0.00422%0.22CC..Hα-helixtrans-61.6-50.7177-66.7-28.2000112T102 V103 W108 T109 T110 V378 V381 G382 I385 N386 A478T102-Y106 HydrophobicContact CG2-CD2 3.88Å; T102-Y106 HydrophobicContact CG2-CE1 4.42Å; T102-Y106 HydrophobicContact CG2-CE2 3.35Å; T102-Y106 WeakPolarHBondContact O-CD2 3.3Å; T102-Y106 VanDerWaalsContact O-CG 3.31Å; T102-Y106 PolarHBondContact O-N 3.27Å; V103-Y106 PolarHBondContact O-N 3.05Å; Y106-W108 PolarHBondContact O-N 3.49Å; Y106-T109 WeakPolarHBondContact CA-OG1 3.32Å; Y106-T109 PolarHBondContact O-N 3.42Å; Y106-T109 PolarHBondContact O-OG1 3.02Å; Y106-T109 VanDerWaalsContact O-OG1 3.09Å; Y106-T110 WeakPolarHBondContact O-CB 3.38Å; Y106-T110 PolarHBondContact O-N 3.43Å; Y106-T110 PolarHBondContact O-OG1 3.41Å; Y106-T110 VanDerWaalsContact O-OG1 3.05Å; Y106-V378 WeakPolarHBondContact OH-CG1 3.22Å; Y106-V378 PolarHBondContact OH-O 2.85Å; Y106-V381 HydrophobicContact CE2-CG1 4.19Å; Y106-G382 VanDerWaalsContact CE2-CA 3.45Å; Y106-G382 WeakPolarHBondContact OH-CA 3.3Å; Y106-I385 HydrophobicContact CD2-CB 4.46Å; Y106-I385 HydrophobicContact CD2-CG2 4.37Å; Y106-N386 HydrophobicContact CD1-CB 3.41Å; Y106-N386 VanDerWaalsContact CD1-CB 3.41Å; Y106-N386 WeakPolarHBondContact CD1-ND2 3.11Å; Y106-N386 WeakPolarHBondContact CD1-OD1 3.4Å; Y106-N386 HydrophobicContact CD2-CB 3.89Å; Y106-N386 HydrophobicContact CE1-CB 3.62Å; Y106-N386 VanDerWaalsContact CE1-CG 3.49Å; Y106-N386 WeakPolarHBondContact CE1-ND2 3.37Å; Y106-N386 HydrophobicContact CE2-CB 4.08Å; Y106-N386 HydrophobicContact CG-CB 3.55Å; Y106-A478 HydrophobicContact CD1-CB 4.27Å; Y106-A478 HydrophobicContact CE1-CB 3.39Å
107L90.5Very high91Very high75 Ų7540.7 Ų40.739%0.39320%0.202SC..Hα-helixtrans-57.5-39.5177.1-67.7176.9000112.4V103 F111 I426V103-L107 HydrophobicContact CG1-CD1 4.1Å; V103-L107 HydrophobicContact CG1-CG 4.36Å; V103-L107 WeakPolarHBondContact O-CG 3.44Å; V103-L107 PolarHBondContact O-N 3.37Å; L107-F111 VanDerWaalsContact O-CB 3.29Å; L107-F111 WeakPolarHBondContact O-CB 3.41Å; L107-F111 PolarHBondContact O-N 2.93Å; L107-I426 HydrophobicContact CD2-CD1 3.59Å
108W93.9Very high91.8Very high143 Ų14335 Ų3554%0.54218%0.182SC..Hα-helixtrans-68.3-45.7178.1-178.1-106.1000112.9A104 Y105 Y106 F111 L112A104-W108 WeakPolarHBondContact O-CB 3.42Å; A104-W108 PolarHBondContact O-N 3.49Å; Y105-W108 PolarHBondContact O-N 2.97Å; Y106-W108 PolarHBondContact O-N 3.49Å; W108-F111 PolarHBondContact O-N 3.47Å; W108-L112 HydrophobicContact CZ2-CD1 4.46Å; W108-L112 HydrophobicContact CZ2-CD2 4.37Å; W108-L112 HydrophobicContact CZ2-CG 4.49Å; W108-L112 WeakPolarHBondContact O-CG 3.38Å; W108-L112 PolarHBondContact O-N 2.92Å
109T95.8Very high92.5Very high1 Ų138.8 Ų38.81%0.00620%0.201CC..Hα-helixtrans-68.1-39.6-179.543.60000112.3Y105 Y106 L112 A113 H316 L321 L324Y105-T109 HydrophobicContact CD1-CG2 4.26Å; Y105-T109 HydrophobicContact CD2-CG2 4.43Å; Y105-T109 HydrophobicContact CE1-CG2 3.71Å; Y105-T109 HydrophobicContact CE2-CG2 3.95Å; Y105-T109 PolarHBondContact O-N 3.02Å; Y105-T109 PolarHBondContact O-OG1 3.03Å; Y106-T109 WeakPolarHBondContact CA-OG1 3.32Å; Y106-T109 PolarHBondContact O-N 3.42Å; Y106-T109 PolarHBondContact O-OG1 3.02Å; Y106-T109 VanDerWaalsContact O-OG1 3.09Å; T109-L112 PolarHBondContact O-N 3.26Å; T109-A113 PolarHBondContact O-N 3.33Å; T109-H316 PolarHBondContact O-CE1 3.48Å; T109-L321 HydrophobicContact CG2-CD2 3.86Å; T109-L324 HydrophobicContact CG2-CD2 3.58Å
110T94.9Very high93.3Very high2 Ų240 Ų401%0.01221%0.205CC..Hα-helixtrans-65-43.5174.3-59.60000111.7Y106 L112 A113 V114 D388 A391 T422 S425Y106-T110 WeakPolarHBondContact O-CB 3.38Å; Y106-T110 PolarHBondContact O-N 3.43Å; Y106-T110 PolarHBondContact O-OG1 3.41Å; Y106-T110 VanDerWaalsContact O-OG1 3.05Å; T110-L112 VanDerWaalsContact C-N 3.35Å; T110-L112 PolarHBondContact O-N 3.16Å; T110-A113 WeakPolarHBondContact O-CB 3.48Å; T110-A113 PolarHBondContact O-N 3.16Å; T110-A113 VanDerWaalsContact O-N 3.17Å; T110-V114 WeakPolarHBondContact O-CG2 3.48Å; T110-V114 PolarHBondContact O-N 3.06Å; T110-D388 WeakPolarHBondContact CA-OD1 3.34Å; T110-D388 WeakPolarHBondContact CB-OD1 3.27Å; T110-D388 PolarHBondContact N-OD1 3.22Å; T110-D388 PolarHBondContact OG1-OD1 3.11Å; T110-A391 HydrophobicContact CG2-CB 3.46Å; T110-A391 VanDerWaalsContact CG2-CB 3.46Å; T110-T422 HydrophobicContact CG2-CG2 3.98Å; T110-S425 VanDerWaalsContact CG2-OG 3.31Å; T110-S425 WeakPolarHBondContact CG2-OG 3.5Å
111F94.4Very high93.9Very high81 Ų8134.3 Ų34.336%0.35518%0.176SC..Hα-helixtrans-60.6-42.6173.9179.1-103.4000112.1L107 W108 A113 V114 V115L107-F111 VanDerWaalsContact O-CB 3.29Å; L107-F111 WeakPolarHBondContact O-CB 3.41Å; L107-F111 PolarHBondContact O-N 2.93Å; W108-F111 PolarHBondContact O-N 3.47Å; F111-A113 VanDerWaalsContact C-N 3.33Å; F111-A113 PolarHBondContact O-N 3.26Å; F111-V114 WeakPolarHBondContact O-CB 3.31Å; F111-V114 PolarHBondContact O-N 3.47Å; F111-V115 HydrophobicContact CD1-CG2 4.36Å; F111-V115 HydrophobicContact CE1-CG2 3.93Å; F111-V115 HydrophobicContact CE2-CG2 4.41Å; F111-V115 HydrophobicContact CZ-CG2 3.96Å; F111-V115 WeakPolarHBondContact O-CG2 3.49Å; F111-V115 PolarHBondContact O-N 3.34Å
112L96.4Very high94.1Very high46 Ų4634.6 Ų34.624%0.24118%0.182CC..Hα-helixtrans-61-40.8173.8-75.6176.5000112.2W108 T109 T110 V114 V115 V116 I320W108-L112 HydrophobicContact CZ2-CD1 4.46Å; W108-L112 HydrophobicContact CZ2-CD2 4.37Å; W108-L112 HydrophobicContact CZ2-CG 4.49Å; W108-L112 WeakPolarHBondContact O-CG 3.38Å; W108-L112 PolarHBondContact O-N 2.92Å; T109-L112 PolarHBondContact O-N 3.26Å; T110-L112 VanDerWaalsContact C-N 3.35Å; T110-L112 PolarHBondContact O-N 3.16Å; L112-V114 VanDerWaalsContact C-N 3.32Å; L112-V114 PolarHBondContact O-N 3.33Å; L112-V115 PolarHBondContact O-N 2.84Å; L112-V116 WeakPolarHBondContact O-CG2 3.19Å; L112-V116 PolarHBondContact O-N 3.44Å; L112-I320 HydrophobicContact CD1-CG2 4.47Å
113A97.4Very high94.3Very high0 Ų040.7 Ų40.70%021%0.214CC..Hα-helixtrans-60.5-42.817700000111.6T109 T110 F111 V116 G117 D388 L392T109-A113 PolarHBondContact O-N 3.33Å; T110-A113 WeakPolarHBondContact O-CB 3.48Å; T110-A113 PolarHBondContact O-N 3.16Å; T110-A113 VanDerWaalsContact O-N 3.17Å; F111-A113 VanDerWaalsContact C-N 3.33Å; F111-A113 PolarHBondContact O-N 3.26Å; A113-V116 PolarHBondContact O-N 2.78Å; A113-G117 PolarHBondContact O-N 2.81Å; A113-D388 HydrophobicContact CB-CB 4.02Å; A113-D388 WeakPolarHBondContact CB-O 3.46Å; A113-L392 HydrophobicContact CB-CB 4.17Å; A113-L392 WeakPolarHBondContact O-CD1 3.44Å; A113-L392 WeakPolarHBondContact O-CG 3.21Å
114V96.9Very high94.6Very high0 Ų041.6 Ų41.60%022%0.217CC..Hα-helixtrans-61.4-47.3175.4169.30000111.4T110 F111 L112 V116 G117 I118 A391 A395 S418 A421T110-V114 WeakPolarHBondContact O-CG2 3.48Å; T110-V114 PolarHBondContact O-N 3.06Å; F111-V114 WeakPolarHBondContact O-CB 3.31Å; F111-V114 PolarHBondContact O-N 3.47Å; L112-V114 VanDerWaalsContact C-N 3.32Å; L112-V114 PolarHBondContact O-N 3.33Å; V114-V116 VanDerWaalsContact C-N 3.3Å; V114-V116 PolarHBondContact O-N 2.76Å; V114-G117 WeakPolarHBondContact O-CA 3.3Å; V114-G117 PolarHBondContact O-N 3.15Å; V114-G117 VanDerWaalsContact O-N 3.1Å; V114-I118 HydrophobicContact CG1-CD1 3.87Å; V114-I118 HydrophobicContact CG1-CG1 4.44Å; V114-I118 WeakPolarHBondContact O-CG1 3.42Å; V114-I118 PolarHBondContact O-N 3.37Å; V114-A391 HydrophobicContact CG2-CB 3.49Å; V114-A391 VanDerWaalsContact CG2-CB 3.49Å; V114-A395 HydrophobicContact CG1-CB 3.98Å; V114-S418 VanDerWaalsContact CG1-OG 3.29Å; V114-S418 WeakPolarHBondContact CG1-OG 3.44Å; V114-A421 HydrophobicContact CG2-CB 4.14Å
115V96.5Very high94.7Very high48 Ų4843.5 Ų43.529%0.29122%0.217SC..Hα-helixtrans-59.1-43177.4171.50000111F111 L112 G117 I118 I119F111-V115 HydrophobicContact CD1-CG2 4.36Å; F111-V115 HydrophobicContact CE1-CG2 3.93Å; F111-V115 HydrophobicContact CE2-CG2 4.41Å; F111-V115 HydrophobicContact CZ-CG2 3.96Å; F111-V115 WeakPolarHBondContact O-CG2 3.49Å; F111-V115 PolarHBondContact O-N 3.34Å; L112-V115 PolarHBondContact O-N 2.84Å; V115-G117 VanDerWaalsContact C-N 3.33Å; V115-G117 PolarHBondContact O-N 3.2Å; V115-I118 PolarHBondContact O-N 3.36Å; V115-I119 HydrophobicContact CG1-CD1 3.78Å; V115-I119 HydrophobicContact CG1-CG1 4.43Å; V115-I119 WeakPolarHBondContact O-CB 3.31Å; V115-I119 VanDerWaalsContact O-CG1 3.26Å; V115-I119 WeakPolarHBondContact O-CG1 3.41Å; V115-I119 PolarHBondContact O-N 3.43Å
116V97.4Very high94.4Very high17 Ų1742.6 Ų42.610%0.10321%0.213CC..Hα-helixtrans-61.3-43.4175.4172.60000111L112 A113 V114 I119 M120 V315 I320 L392L112-V116 WeakPolarHBondContact O-CG2 3.19Å; L112-V116 PolarHBondContact O-N 3.44Å; A113-V116 PolarHBondContact O-N 2.78Å; V114-V116 VanDerWaalsContact C-N 3.3Å; V114-V116 PolarHBondContact O-N 2.76Å; V116-I119 PolarHBondContact O-N 2.97Å; V116-M120 VanDerWaalsContact O-CB 3.3Å; V116-M120 WeakPolarHBondContact O-CB 3.45Å; V116-M120 PolarHBondContact O-N 3.13Å; V116-V315 HydrophobicContact CG1-CB 4.32Å; V116-V315 HydrophobicContact CG1-CG1 4Å; V116-I320 HydrophobicContact CG2-CD1 3.23Å; V116-L392 HydrophobicContact CB-CD1 4.4Å; V116-L392 HydrophobicContact CG1-CD1 4.18Å
117G97.1Very high93.9Very high0 Ų042.5 Ų42.50%021%0.213CC..Hα-helixtrans-57.5-50.6174.800000112.3A113 V114 V115 I119 M120 V121 V396A113-G117 PolarHBondContact O-N 2.81Å; V114-G117 WeakPolarHBondContact O-CA 3.3Å; V114-G117 PolarHBondContact O-N 3.15Å; V114-G117 VanDerWaalsContact O-N 3.1Å; V115-G117 VanDerWaalsContact C-N 3.33Å; V115-G117 PolarHBondContact O-N 3.2Å; G117-I119 PolarHBondContact O-N 3.01Å; G117-M120 PolarHBondContact O-N 3.28Å; G117-V121 WeakPolarHBondContact O-CG1 3.27Å; G117-V121 PolarHBondContact O-N 3.27Å; G117-V396 WeakPolarHBondContact O-CG2 3.31Å
118I96.1Very high93Very high22 Ų2240.1 Ų40.111%0.11321%0.206CC..Hα-helixtrans-60.2-44.5178.7-65.6171.3000111V114 V115 V121 S122 A395 I399 I414V114-I118 HydrophobicContact CG1-CD1 3.87Å; V114-I118 HydrophobicContact CG1-CG1 4.44Å; V114-I118 WeakPolarHBondContact O-CG1 3.42Å; V114-I118 PolarHBondContact O-N 3.37Å; V115-I118 PolarHBondContact O-N 3.36Å; I118-V121 WeakPolarHBondContact O-CG1 3.39Å; I118-S122 VanDerWaalsContact O-CB 3.24Å; I118-S122 WeakPolarHBondContact O-CB 3.02Å; I118-S122 PolarHBondContact O-N 2.82Å; I118-S122 PolarHBondContact O-OG 3.27Å; I118-A395 HydrophobicContact CG1-CB 4Å; I118-I399 HydrophobicContact CB-CD1 4.28Å; I118-I399 HydrophobicContact CG1-CD1 3.87Å; I118-I399 HydrophobicContact CG2-CD1 4.08Å; I118-I414 HydrophobicContact CD1-CG2 4.13Å; I118-I414 HydrophobicContact CG2-CG2 3.86Å
119I96.1Very high91.3Very high90 Ų9035 Ų3546%0.46219%0.194SC..Hα-helixtrans-61.5-47.3176.3-69.8168.2000110.1V115 V116 G117 S122 I123V115-I119 HydrophobicContact CG1-CD1 3.78Å; V115-I119 HydrophobicContact CG1-CG1 4.43Å; V115-I119 WeakPolarHBondContact O-CB 3.31Å; V115-I119 VanDerWaalsContact O-CG1 3.26Å; V115-I119 WeakPolarHBondContact O-CG1 3.41Å; V115-I119 PolarHBondContact O-N 3.43Å; V116-I119 PolarHBondContact O-N 2.97Å; G117-I119 PolarHBondContact O-N 3.01Å; I119-S122 PolarHBondContact O-N 3.44Å; I119-I123 HydrophobicContact CG2-CD1 3.62Å; I119-I123 HydrophobicContact CG2-CG1 4.44Å; I119-I123 VanDerWaalsContact O-CG1 3.29Å; I119-I123 WeakPolarHBondContact O-CG1 3.49Å; I119-I123 PolarHBondContact O-N 3.29Å
120M95.8Very high89.3Confident34 Ų3436.6 Ų36.617%0.16721%0.207CC..Hα-helixtrans-64-45.5-176.3-163.361.168.600112.2V116 G117 S122 I123 I124 T308 C311 V315V116-M120 VanDerWaalsContact O-CB 3.3Å; V116-M120 WeakPolarHBondContact O-CB 3.45Å; V116-M120 PolarHBondContact O-N 3.13Å; G117-M120 PolarHBondContact O-N 3.28Å; M120-S122 VanDerWaalsContact C-N 3.33Å; M120-S122 PolarHBondContact O-N 2.93Å; M120-I123 PolarHBondContact O-N 3.36Å; M120-I124 HydrophobicContact CG-CD1 3.89Å; M120-I124 WeakPolarHBondContact O-CB 3.34Å; M120-I124 WeakPolarHBondContact O-CG1 3.28Å; M120-I124 PolarHBondContact O-N 2.88Å; M120-I124 HydrophobicContact SD-CD1 3.77Å; M120-I124 HydrophobicContact SD-CG1 4.39Å; M120-T308 HydrophobicContact CB-CG2 4.25Å; M120-T308 HydrophobicContact CG-CG2 3.88Å; M120-C311 HydrophobicContact CE-CB 4.41Å; M120-C311 HydrophobicContact CG-CB 4.41Å; M120-C311 HydrophobicContact SD-CB 4.2Å; M120-V315 HydrophobicContact CE-CG2 3.93Å
121V95.4Very high87.2Confident0 Ų039.3 Ų39.30%022%0.22CC..Hα-helixtrans-70.5-29.5178.971.20000112.7G117 I118 H125 P126 T308 V396 I399G117-V121 WeakPolarHBondContact O-CG1 3.27Å; G117-V121 PolarHBondContact O-N 3.27Å; I118-V121 WeakPolarHBondContact O-CG1 3.39Å; V121-H125 VanDerWaalsContact O-CA 3.28Å; V121-H125 WeakPolarHBondContact O-CA 3.43Å; V121-H125 PolarHBondContact O-N 3.44Å; V121-P126 HydrophobicContact CG2-CG 3.84Å; V121-T308 HydrophobicContact CB-CG2 3.98Å; V121-T308 HydrophobicContact CG2-CG2 4.38Å; V121-V396 HydrophobicContact CB-CB 4.48Å; V121-V396 HydrophobicContact CB-CG1 4.1Å; V121-V396 HydrophobicContact CB-CG2 4.31Å; V121-V396 HydrophobicContact CG2-CG1 4.11Å; V121-I399 HydrophobicContact CB-CG2 4.49Å; V121-I399 HydrophobicContact CG1-CB 3.82Å; V121-I399 HydrophobicContact CG1-CD1 3.61Å; V121-I399 HydrophobicContact CG1-CG1 4.3Å; V121-I399 HydrophobicContact CG1-CG2 3.72Å; V121-I399 HydrophobicContact CG2-CB 4.16Å; V121-I399 HydrophobicContact CG2-CG2 3.92Å
122S91.6Very high84.9Confident61 Ų6145.2 Ų45.243%0.42725%0.245SC..Hα-helixtrans-71.9-37.9175.5-59.20000111.8I118 I119 M120I118-S122 VanDerWaalsContact O-CB 3.24Å; I118-S122 WeakPolarHBondContact O-CB 3.02Å; I118-S122 PolarHBondContact O-N 2.82Å; I118-S122 PolarHBondContact O-OG 3.27Å; I119-S122 PolarHBondContact O-N 3.44Å; M120-S122 VanDerWaalsContact C-N 3.33Å; M120-S122 PolarHBondContact O-N 2.93Å
123I92.9Very high82.4Confident128 Ų12851.1 Ų51.166%0.65627%0.272SS*.Hα-helixtrans-73.2-48.2178-68.3169.6000111.4I119 M120I119-I123 HydrophobicContact CG2-CD1 3.62Å; I119-I123 HydrophobicContact CG2-CG1 4.44Å; I119-I123 VanDerWaalsContact O-CG1 3.29Å; I119-I123 WeakPolarHBondContact O-CG1 3.49Å; I119-I123 PolarHBondContact O-N 3.29Å; M120-I123 PolarHBondContact O-N 3.36Å
124I92.4Very high79.6Confident52 Ų5257 Ų5727%0.26731%0.307SS..Hα-helixtrans-77.9-32.3-175.3-63.1176.4000111.3M120 F304 T308M120-I124 HydrophobicContact CG-CD1 3.89Å; M120-I124 WeakPolarHBondContact O-CB 3.34Å; M120-I124 WeakPolarHBondContact O-CG1 3.28Å; M120-I124 PolarHBondContact O-N 2.88Å; M120-I124 HydrophobicContact SD-CD1 3.77Å; M120-I124 HydrophobicContact SD-CG1 4.39Å; I124-F304 HydrophobicContact CG2-CD1 4.17Å; I124-T308 HydrophobicContact CD1-CG2 4.18Å; I124-T308 WeakPolarHBondContact CG2-OG1 3.38Å
125H90.6Very high76.7Confident93 Ų9362.9 Ų62.943%0.43134%0.344SS..  trans50.957.2178.9-151.190.4000113.8V121 G127 G128 A129 Q403V121-H125 VanDerWaalsContact O-CA 3.28Å; V121-H125 WeakPolarHBondContact O-CA 3.43Å; V121-H125 PolarHBondContact O-N 3.44Å; H125-G127 VanDerWaalsContact C-N 3.29Å; H125-G127 PolarHBondContact O-N 2.87Å; H125-G128 PolarHBondContact O-N 3.32Å; H125-A129 PolarHBondContact O-N 3.09Å; H125-Q403 PolarHBondContact CE1-NE2 2.8Å; H125-Q403 PolarHBondContact ND1-NE2 2.88Å
126P88.4Confident74Confident0 Ų068.4 Ų68.40%037%0.367CS..THydrogen-bonded Turntrans-62.4-28.1-169.323.3-33.2000114.8V121 F304 F400V121-P126 HydrophobicContact CG2-CG 3.84Å; P126-F304 HydrophobicContact CB-CB 3.81Å; P126-F400 HydrophobicContact CB-CD2 3.93Å; P126-F400 HydrophobicContact CB-CE2 4.23Å; P126-F400 HydrophobicContact CG-CB 4.46Å; P126-F400 HydrophobicContact CG-CD2 3.82Å
127G80.6Confident71.2Confident0 Ų076.1 Ų76.10%040%0.401CS..THydrogen-bonded Turntrans-75.3-32.3-179.600000114H125 K301H125-G127 VanDerWaalsContact C-N 3.29Å; H125-G127 PolarHBondContact O-N 2.87Å; G127-K301 WeakPolarHBondContact O-CE 3.49Å
128G72.8Confident68.5Low24 Ų2480.3 Ų80.325%0.24743%0.431CS..THydrogen-bonded Turntrans-85.1-15179.500000114.7H125 A130 Q131H125-G128 PolarHBondContact O-N 3.32Å; G128-A130 PolarHBondContact O-N 2.81Å; G128-Q131 PolarHBondContact O-N 3.37Å
129A58.6Low66Low37 Ų3782.6 Ų82.631%0.30646%0.46SS..THydrogen-bonded Turntrans-62.6-4.5-177.400000115.6H125 K300 F304H125-A129 PolarHBondContact O-N 3.09Å; A129-K300 PolarHBondContact O-NZ 2.8Å; A129-F304 HydrophobicContact CB-CD2 4.37Å
130A52.5Low63.8Low33 Ų3384.6 Ų84.627%0.27347%0.465SS..THydrogen-bonded Turntrans-126.410175.900000113.8G128 K301G128-A130 PolarHBondContact O-N 2.81Å; A130-K301 HydrophobicContact CB-CD 4.16Å; A130-K301 HydrophobicContact CB-CG 3.63Å
131Q51.3Low61.7Low59 Ų5988.1 Ų88.128%0.27649%0.491SS..  trans-101.523.9-171-122173.620.200114.8G128 E133 N406G128-Q131 PolarHBondContact O-N 3.37Å; Q131-E133 PolarHBondContact O-N 3.32Å; Q131-E133 VanDerWaalsContact O-N 3.13Å; Q131-N406 PolarHBondContact NE2-ND2 2.94Å; Q131-N406 VanDerWaalsContact NE2-ND2 3.11Å; Q131-N406 PolarHBondContact NE2-OD1 2.98Å; Q131-N406 PolarHBondContact OE1-OD1 3.13Å
132K45.5Very low59.7Low206 Ų20691 Ų9190%0.89651%0.508SS*.SBendtrans-71.9-3.2-178.2-131.7-179.3-176.8-176.70114.4
133E43.8Very low58.3Low170 Ų17089.4 Ų89.479%0.79449%0.494SS*.SBendtrans-142.3133.3175.4-61.7-169.1177.900110.6Q131Q131-E133 PolarHBondContact O-N 3.32Å; Q131-E133 VanDerWaalsContact O-N 3.13Å
134T39.1Very low57.2Low122 Ų12286.5 Ų86.575%0.74849%0.485SS*.  trans85.680.6177.7-7.40000117E136T134-E136 PolarHBondContact O-N 3.01Å
135T36.3Very low56Low124 Ų12485.4 Ų85.476%0.76148%0.482SS*.  trans-83.588.1162.7-52.50000109.2Q137T135-Q137 HydrophobicContact CG2-CG 4.09Å
136E40.1Very low55.2Low165 Ų16583.7 Ų83.777%0.77148%0.484SS*.  trans-97.1107.9152.1-75.8-160.2163.800107.7T134 S138T134-E136 PolarHBondContact O-N 3.01Å; E136-S138 VanDerWaalsContact C-N 3.33Å; E136-S138 PolarHBondContact O-N 3.01Å
137Q38.9Very low54.6Low178 Ų17884.8 Ų84.883%0.83249%0.49SS*.  trans-68.291.1172.6-75.2177.2-18.300108.6T135 G139T135-Q137 HydrophobicContact CG2-CG 4.09Å; Q137-G139 PolarHBondContact O-N 2.92Å
138S40Very low54.1Low88 Ų8884.9 Ų84.962%0.61549%0.491SS*.  trans-7180.9163.11730000108.4E136 K140E136-S138 VanDerWaalsContact C-N 3.33Å; E136-S138 PolarHBondContact O-N 3.01Å; S138-K140 VanDerWaalsContact C-N 3.26Å; S138-K140 PolarHBondContact O-N 3.36Å
139G43.1Very low54Low71 Ų7187.7 Ų87.773%0.73250%0.5SS*.  trans-66.876.817600000112.2Q137Q137-G139 PolarHBondContact O-N 2.92Å
140K49.3Very low55.1Low131 Ų13190 Ų9057%0.5751%0.506SS*.  trans-79122.7152.5-69.3-179-176.4171.10106.2S138 V142 Y407S138-K140 VanDerWaalsContact C-N 3.26Å; S138-K140 PolarHBondContact O-N 3.36Å; K140-V142 PolarHBondContact O-N 3.22Å; K140-Y407 HydrophobicContact CB-CE1 4.28Å
141P51.6Low56.3Low109 Ų10988.7 Ų88.771%0.70850%0.495SS*.  trans-61.6113.7-18023.8-30.7000108.3M143P141-M143 PolarHBondContact O-N 3.15Å
142V54.6Low57.4Low61 Ų6186.3 Ų86.337%0.3748%0.484SS..PPolyproline II helixtrans-63.8132.5168-1790000106.5K140 Y407K140-V142 PolarHBondContact O-N 3.22Å; V142-Y407 HydrophobicContact CG2-CD1 4Å
143M61.2Low59.1Low26 Ų2680 Ų8013%0.12846%0.462CS..PPolyproline II helixtrans-56.9145.1-178.8-159.8157.4109.800110P141 S145 D147 A148 D151P141-M143 PolarHBondContact O-N 3.15Å; M143-S145 PolarHBondContact O-N 3.36Å; M143-D147 HydrophobicContact CE-CB 3.79Å; M143-D147 WeakPolarHBondContact CE-O 3.21Å; M143-D147 HydrophobicContact CG-CB 3.81Å; M143-D147 HydrophobicContact SD-CB 4.45Å; M143-A148 HydrophobicContact CE-CB 4.02Å; M143-D151 HydrophobicContact CE-CB 3.88Å; M143-D151 WeakPolarHBondContact CE-OD2 3.47Å
144S70.5Confident61Low67 Ų6776.4 Ų76.447%0.46944%0.442SS..PPolyproline II helixtrans-54.8136.1171.31770000109.5A146 D147 A148S144-A146 PolarHBondContact O-N 3.49Å; S144-D147 WeakPolarHBondContact O-CA 3.28Å; S144-D147 WeakPolarHBondContact O-CB 3.47Å; S144-D147 PolarHBondContact O-N 2.67Å; S144-A148 PolarHBondContact O-N 3.39Å
145S67.5Low62.8Low29 Ų2971.4 Ų71.420%0.20341%0.41CS..Hα-helixtrans-57.5-33.5-178.7-450000112.6M143 A148 L149 D410M143-S145 PolarHBondContact O-N 3.36Å; S145-A148 PolarHBondContact O-N 3.26Å; S145-L149 PolarHBondContact O-N 3.5Å; S145-D410 WeakPolarHBondContact CB-OD2 3.31Å; S145-D410 VanDerWaalsContact OG-CB 3.26Å; S145-D410 WeakPolarHBondContact OG-CB 3.35Å; S145-D410 PolarHBondContact OG-OD2 3.17Å
146A73.4Confident64.9Low57 Ų5768.3 Ų68.347%0.47139%0.388SS..Hα-helixtrans-64.7-45.7173.900000111.2S144 A148 L149 L150S144-A146 PolarHBondContact O-N 3.49Å; A146-A148 VanDerWaalsContact C-N 3.29Å; A146-A148 PolarHBondContact O-N 2.82Å; A146-L149 PolarHBondContact O-N 2.94Å; A146-L150 WeakPolarHBondContact O-CB 3.5Å; A146-L150 WeakPolarHBondContact O-CG 3.4Å; A146-L150 PolarHBondContact O-N 2.81Å
147D76.6Confident67.2Low24 Ų2467.6 Ų67.613%0.12838%0.383CS..Hα-helixtrans-63.5-37.4176.4-72.4-21.4000110.6M143 S144 L150 D151 T171 S221M143-D147 HydrophobicContact CE-CB 3.79Å; M143-D147 WeakPolarHBondContact CE-O 3.21Å; M143-D147 HydrophobicContact CG-CB 3.81Å; M143-D147 HydrophobicContact SD-CB 4.45Å; S144-D147 WeakPolarHBondContact O-CA 3.28Å; S144-D147 WeakPolarHBondContact O-CB 3.47Å; S144-D147 PolarHBondContact O-N 2.67Å; D147-L150 PolarHBondContact O-N 2.95Å; D147-D151 VanDerWaalsContact O-CB 3.3Å; D147-D151 WeakPolarHBondContact O-CB 3.49Å; D147-D151 VanDerWaalsContact O-CG 3.28Å; D147-D151 PolarHBondContact O-N 3.5Å; D147-T171 HydrophobicContact CB-CG2 4.31Å; D147-S221 PolarHBondContact OD2-OG 3.22Å
148A70.4Confident69.4Low1 Ų161 Ų611%0.00836%0.355CS..Hα-helixtrans-65-43.4177.500000112.5M143 S144 S145 A146 D151 L152M143-A148 HydrophobicContact CE-CB 4.02Å; S144-A148 PolarHBondContact O-N 3.39Å; S145-A148 PolarHBondContact O-N 3.26Å; A146-A148 VanDerWaalsContact C-N 3.29Å; A146-A148 PolarHBondContact O-N 2.82Å; A148-D151 PolarHBondContact O-N 3.38Å; A148-L152 WeakPolarHBondContact O-CB 3.33Å; A148-L152 PolarHBondContact O-N 3.05Å
149L70.6Confident71.8Confident84 Ų8462 Ų6244%0.4437%0.368SS..Hα-helixtrans-66.5-40.6175.3-173.368.3000111.7S145 A146 L152 V153S145-L149 PolarHBondContact O-N 3.5Å; A146-L149 PolarHBondContact O-N 2.94Å; L149-L152 HydrophobicContact CD1-CD2 4.32Å; L149-L152 WeakPolarHBondContact O-CB 3.48Å; L149-L152 PolarHBondContact O-N 3.03Å; L149-V153 WeakPolarHBondContact O-CG2 3.26Å; L149-V153 PolarHBondContact O-N 2.83Å; L149-V153 VanDerWaalsContact O-N 3.13Å
150L80.9Confident74.1Confident84 Ų8462.3 Ų62.344%0.4435%0.353SS..Hα-helixtrans-67.1-39.7177.6-69.4174.1000111.6A146 D147 L152 V153 R154A146-L150 WeakPolarHBondContact O-CB 3.5Å; A146-L150 WeakPolarHBondContact O-CG 3.4Å; A146-L150 PolarHBondContact O-N 2.81Å; D147-L150 PolarHBondContact O-N 2.95Å; L150-L152 VanDerWaalsContact C-N 3.34Å; L150-V153 PolarHBondContact O-N 3.26Å; L150-R154 VanDerWaalsContact CB-NH1 3.34Å; L150-R154 VanDerWaalsContact O-CG 3.27Å; L150-R154 WeakPolarHBondContact O-CG 3.27Å; L150-R154 PolarHBondContact O-N 3.42Å
151D78.4Confident76.1Confident7 Ų759.1 Ų59.14%0.03734%0.342CS..Hα-helixtrans-66.7-36.7175.1-78.23.9000112.1M143 D147 A148 R154 N155 Y169 R170 T171M143-D151 HydrophobicContact CE-CB 3.88Å; M143-D151 WeakPolarHBondContact CE-OD2 3.47Å; D147-D151 VanDerWaalsContact O-CB 3.3Å; D147-D151 WeakPolarHBondContact O-CB 3.49Å; D147-D151 VanDerWaalsContact O-CG 3.28Å; D147-D151 PolarHBondContact O-N 3.5Å; A148-D151 PolarHBondContact O-N 3.38Å; D151-R154 PolarHBondContact O-N 2.97Å; D151-R154 IonicContact OD1-CZ 3.94Å; D151-R154 IonicContact OD1-NH1 2.79Å; D151-R154 PolarHBondContact OD1-NH1 3.27Å; D151-N155 VanDerWaalsContact O-CB 3.31Å; D151-N155 WeakPolarHBondContact O-CB 3.14Å; D151-N155 PolarHBondContact O-N 2.94Å; D151-N155 PolarHBondContact O-ND2 3.37Å; D151-Y169 WeakPolarHBondContact OD1-CD1 3.36Å; D151-Y169 VanDerWaalsContact OD1-CE1 3.23Å; D151-Y169 WeakPolarHBondContact OD1-CE1 3.37Å; D151-R170 WeakPolarHBondContact OD2-CA 3.36Å; D151-T171 VanDerWaalsContact CG-OG1 3.29Å; D151-T171 PolarHBondContact OD1-OG1 3.44Å; D151-T171 WeakPolarHBondContact OD2-CB 3.38Å; D151-T171 PolarHBondContact OD2-N 3.42Å; D151-T171 PolarHBondContact OD2-OG1 3.41Å
152L73.9Confident78.1Confident9 Ų958.7 Ų58.75%0.04734%0.337CS..Hα-helixtrans-55-53.6171179.372.3000110.4A148 L149 L150 R154 N155 M156 L232 T416 T420A148-L152 WeakPolarHBondContact O-CB 3.33Å; A148-L152 PolarHBondContact O-N 3.05Å; L149-L152 HydrophobicContact CD1-CD2 4.32Å; L149-L152 WeakPolarHBondContact O-CB 3.48Å; L149-L152 PolarHBondContact O-N 3.03Å; L150-L152 VanDerWaalsContact C-N 3.34Å; L152-R154 PolarHBondContact O-N 2.92Å; L152-N155 PolarHBondContact O-N 3.26Å; L152-N155 VanDerWaalsContact O-N 3.17Å; L152-M156 WeakPolarHBondContact O-CG 3.26Å; L152-M156 PolarHBondContact O-N 2.97Å; L152-L232 HydrophobicContact CD1-CD2 3.39Å; L152-L232 HydrophobicContact CG-CD2 4.26Å; L152-T416 HydrophobicContact CD1-CG2 4.26Å; L152-T416 HydrophobicContact CD2-CG2 4.17Å; L152-T420 HydrophobicContact CD1-CG2 3.24Å; L152-T420 HydrophobicContact CG-CG2 4.5Å
153V80.8Confident79.8Confident72 Ų7259.2 Ų59.244%0.43634%0.336SS..Hα-helixtrans-63.2-40.5-179.51760000111.8L149 L150 N155 M156L149-V153 WeakPolarHBondContact O-CG2 3.26Å; L149-V153 PolarHBondContact O-N 2.83Å; L149-V153 VanDerWaalsContact O-N 3.13Å; L150-V153 PolarHBondContact O-N 3.26Å; V153-N155 VanDerWaalsContact C-N 3.3Å; V153-N155 PolarHBondContact O-N 2.89Å; V153-M156 WeakPolarHBondContact O-CB 3.45Å; V153-M156 PolarHBondContact O-N 3.16Å
154R83.7Confident80.9Confident95 Ų9558.1 Ų58.136%0.35833%0.331SS..Hα-helixtrans-62-39.6174.9-71.5171.3-170123.52.3111.7L150 D151 L152 M156 F157 Y169L150-R154 VanDerWaalsContact CB-NH1 3.34Å; L150-R154 VanDerWaalsContact O-CG 3.27Å; L150-R154 WeakPolarHBondContact O-CG 3.27Å; L150-R154 PolarHBondContact O-N 3.42Å; D151-R154 PolarHBondContact O-N 2.97Å; D151-R154 IonicContact OD1-CZ 3.94Å; D151-R154 IonicContact OD1-NH1 2.79Å; D151-R154 PolarHBondContact OD1-NH1 3.27Å; L152-R154 PolarHBondContact O-N 2.92Å; R154-M156 VanDerWaalsContact C-N 3.32Å; R154-F157 CarbonylContact O-C 3.59Å; R154-F157 VanDerWaalsContact O-C 3.3Å; R154-F157 PolarHBondContact O-N 3.24Å; R154-F157 VanDerWaalsContact O-O 3.12Å; R154-Y169 HydrophobicContact CB-CD1 4.21Å; R154-Y169 HydrophobicContact CB-CG 4.32Å
155N76.9Confident81.5Confident17 Ų1757.1 Ų57.19%0.09132%0.322CS..Hα-helixtrans-73.2-23.6177.4-76-48.2000112.8D151 L152 V153 F157 Y169 N230 G233D151-N155 VanDerWaalsContact O-CB 3.31Å; D151-N155 WeakPolarHBondContact O-CB 3.14Å; D151-N155 PolarHBondContact O-N 2.94Å; D151-N155 PolarHBondContact O-ND2 3.37Å; L152-N155 PolarHBondContact O-N 3.26Å; L152-N155 VanDerWaalsContact O-N 3.17Å; V153-N155 VanDerWaalsContact C-N 3.3Å; V153-N155 PolarHBondContact O-N 2.89Å; N155-F157 PolarHBondContact O-N 3.43Å; N155-Y169 PolarHBondContact ND2-O 2.83Å; N155-Y169 WeakPolarHBondContact OD1-CB 3.44Å; N155-Y169 PolarHBondContact OD1-N 2.99Å; N155-N230 PolarHBondContact O-ND2 2.94Å; N155-N230 PolarHBondContact O-OD1 2.96Å; N155-N230 PolarHBondContact OD1-ND2 3.26Å; N155-G233 WeakPolarHBondContact O-CA 3.36Å; N155-G233 PolarHBondContact O-N 3.21Å
156M80.9Confident82.1Confident60 Ų6060.8 Ų60.830%0.29634%0.335SS..Hα-helixtrans-63-31171-68.3176.46800112.8L152 V153 R154 L232 I236L152-M156 WeakPolarHBondContact O-CG 3.26Å; L152-M156 PolarHBondContact O-N 2.97Å; V153-M156 WeakPolarHBondContact O-CB 3.45Å; V153-M156 PolarHBondContact O-N 3.16Å; R154-M156 VanDerWaalsContact C-N 3.32Å; M156-L232 HydrophobicContact CG-CD2 3.71Å; M156-L232 HydrophobicContact CG-CG 4.09Å; M156-I236 HydrophobicContact CB-CD1 3.45Å; M156-I236 VanDerWaalsContact CB-CD1 3.45Å; M156-I236 HydrophobicContact CE-CD1 3.52Å; M156-I236 HydrophobicContact CG-CD1 3.4Å; M156-I236 VanDerWaalsContact CG-CD1 3.4Å; M156-I236 HydrophobicContact SD-CD1 4.27Å
157F87.4Confident82.5Confident150 Ų15061.3 Ų61.366%0.65833%0.326SS*.SBendtrans-12476.8-179.6-60.5-80.4000110.4R154 N155R154-F157 CarbonylContact O-C 3.59Å; R154-F157 VanDerWaalsContact O-C 3.3Å; R154-F157 PolarHBondContact O-N 3.24Å; R154-F157 VanDerWaalsContact O-O 3.12Å; N155-F157 PolarHBondContact O-N 3.43Å
158P85.9Confident82.4Confident39 Ų3961 Ų6125%0.25332%0.324SS..  trans-63.2141.1-178.226.2-33.2000111.1N160 A164P158-N160 PolarHBondContact O-N 3.27Å; P158-A164 HydrophobicContact CB-CB 3.76Å; P158-A164 HydrophobicContact CG-CB 4.01Å
159A89.4Confident82.8Confident108 Ų10864.2 Ų64.289%0.89334%0.336SS*.SBendtrans-62.8-28.1177.600000112.7
160N93.1Very high83.2Confident78 Ų7865.2 Ų65.242%0.41733%0.334SS..  trans-145.9129.2176.8-176.5-57.7000110.2P158 V162 E163 A164P158-N160 PolarHBondContact O-N 3.27Å; N160-V162 WeakPolarHBondContact OD1-CA 3.38Å; N160-V162 WeakPolarHBondContact OD1-CB 3.21Å; N160-V162 PolarHBondContact OD1-N 3.46Å; N160-E163 HydrophobicContact CB-CB 3.86Å; N160-E163 PolarHBondContact OD1-N 3.04Å; N160-A164 WeakPolarHBondContact O-CB 3.37Å; N160-A164 PolarHBondContact O-N 3.32Å
161L90.3Very high83.2Confident64 Ų6461.6 Ų61.634%0.33532%0.316SS..Hα-helixtrans-71.3-34.6-177.3-171.867.9000112.9A164 T165 I234 F237L161-A164 WeakPolarHBondContact O-CB 3.46Å; L161-A164 PolarHBondContact O-N 3.48Å; L161-T165 WeakPolarHBondContact O-CG2 3.4Å; L161-T165 PolarHBondContact O-N 2.67Å; L161-I234 HydrophobicContact CD1-CG1 4.45Å; L161-F237 HydrophobicContact CD1-CB 4.01Å; L161-F237 HydrophobicContact CD1-CD1 3.81Å; L161-F237 HydrophobicContact CD1-CD2 4.46Å; L161-F237 HydrophobicContact CD1-CE1 4.46Å; L161-F237 HydrophobicContact CD1-CG 3.81Å; L161-F237 HydrophobicContact CD2-CD1 3.53Å; L161-F237 HydrophobicContact CD2-CD2 4.35Å; L161-F237 HydrophobicContact CD2-CE1 3.31Å; L161-F237 HydrophobicContact CD2-CE2 4.16Å; L161-F237 HydrophobicContact CD2-CG 4.06Å; L161-F237 HydrophobicContact CD2-CZ 3.65Å; L161-F237 HydrophobicContact CG-CD1 4.34Å
162V93.6Very high83.3Confident100 Ų10067.9 Ų67.961%0.60634%0.343SS*.Hα-helixtrans-69-44.8176.4-177.20000109.6N160 A164 T165 F166N160-V162 WeakPolarHBondContact OD1-CA 3.38Å; N160-V162 WeakPolarHBondContact OD1-CB 3.21Å; N160-V162 PolarHBondContact OD1-N 3.46Å; V162-A164 VanDerWaalsContact C-N 3.28Å; V162-A164 PolarHBondContact O-N 3.23Å; V162-T165 WeakPolarHBondContact O-CB 3.47Å; V162-T165 PolarHBondContact O-N 3.44Å; V162-T165 VanDerWaalsContact O-N 3.07Å; V162-T165 PolarHBondContact O-OG1 3.08Å; V162-F166 HydrophobicContact CG1-CE1 4.48Å; V162-F166 WeakPolarHBondContact O-CD1 3.35Å; V162-F166 VanDerWaalsContact O-CE1 3.26Å; V162-F166 WeakPolarHBondContact O-CE1 3.32Å
163E90.4Very high83.3Confident72 Ų7269.7 Ų69.734%0.33635%0.354SS..Hα-helixtrans-60.4-39.2174.3-175.3171.6-162.300111.9N160 T165 F166 K167N160-E163 HydrophobicContact CB-CB 3.86Å; N160-E163 PolarHBondContact OD1-N 3.04Å; E163-T165 PolarHBondContact O-N 3.11Å; E163-F166 HydrophobicContact CB-CZ 4.42Å; E163-F166 HydrophobicContact CG-CE2 4.46Å; E163-F166 HydrophobicContact CG-CZ 4.37Å; E163-F166 PolarHBondContact O-N 3.36Å; E163-K167 HydrophobicContact CG-CB 3.93Å; E163-K167 HydrophobicContact CG-CD 4.08Å; E163-K167 PolarHBondContact O-N 3.46Å; E163-K167 WeakPolarHBondContact OE1-CD 3.46Å
164A84.2Confident83Confident3 Ų367.7 Ų67.73%0.02534%0.342CS..Hα-helixtrans-58-20.6176.100000113.5P158 N160 L161 V162 F166 K167 M229 N230 I234P158-A164 HydrophobicContact CB-CB 3.76Å; P158-A164 HydrophobicContact CG-CB 4.01Å; N160-A164 WeakPolarHBondContact O-CB 3.37Å; N160-A164 PolarHBondContact O-N 3.32Å; L161-A164 WeakPolarHBondContact O-CB 3.46Å; L161-A164 PolarHBondContact O-N 3.48Å; V162-A164 VanDerWaalsContact C-N 3.28Å; V162-A164 PolarHBondContact O-N 3.23Å; A164-F166 VanDerWaalsContact C-N 3.26Å; A164-F166 PolarHBondContact O-N 3.11Å; A164-K167 WeakPolarHBondContact CA-O 3.43Å; A164-M229 CarbonylContact O-C 3.07Å; A164-N230 HydrophobicContact CB-CB 4.11Å; A164-N230 PolarHBondContact O-N 3.35Å; A164-I234 HydrophobicContact CB-CG1 4.44Å
165T82.8Confident82.6Confident46 Ų4667 Ų6728%0.28235%0.35SS..THydrogen-bonded Turntrans-71.2-19176.468.80000113.6L76 L161 V162 E163 M229 I234L76-T165 HydrophobicContact CD1-CG2 4.01Å; L76-T165 HydrophobicContact CD2-CG2 3.75Å; L161-T165 WeakPolarHBondContact O-CG2 3.4Å; L161-T165 PolarHBondContact O-N 2.67Å; V162-T165 WeakPolarHBondContact O-CB 3.47Å; V162-T165 PolarHBondContact O-N 3.44Å; V162-T165 VanDerWaalsContact O-N 3.07Å; V162-T165 PolarHBondContact O-OG1 3.08Å; E163-T165 PolarHBondContact O-N 3.11Å; T165-M229 WeakPolarHBondContact O-CB 3.31Å; T165-M229 WeakPolarHBondContact O-CG 3.45Å; T165-I234 HydrophobicContact CG2-CD1 4.41Å
166F80.9Confident82.4Confident107 Ų10769.3 Ų69.347%0.46937%0.365SS..THydrogen-bonded Turntrans-138-7.5-177.459.9-91.9000115.3V162 E163 A164 G228V162-F166 HydrophobicContact CG1-CE1 4.48Å; V162-F166 WeakPolarHBondContact O-CD1 3.35Å; V162-F166 VanDerWaalsContact O-CE1 3.26Å; V162-F166 WeakPolarHBondContact O-CE1 3.32Å; E163-F166 HydrophobicContact CB-CZ 4.42Å; E163-F166 HydrophobicContact CG-CE2 4.46Å; E163-F166 HydrophobicContact CG-CZ 4.37Å; E163-F166 PolarHBondContact O-N 3.36Å; A164-F166 VanDerWaalsContact C-N 3.26Å; A164-F166 PolarHBondContact O-N 3.11Å; F166-G228 CarbonylContact C-O 3.52Å; F166-G228 VanDerWaalsContact C-O 3.24Å; F166-G228 CarbonylContact O-C 3.3Å; F166-G228 PolarHBondContact O-N 3.05Å
167K81.8Confident82Confident67 Ų6771.6 Ų71.629%0.29138%0.377SS..EExtended strand (participates in β ladder)trans-134151.7175.3-75.6174.3-177.7-179.40112.2E163 A164 G228 N230E163-K167 HydrophobicContact CG-CB 3.93Å; E163-K167 HydrophobicContact CG-CD 4.08Å; E163-K167 PolarHBondContact O-N 3.46Å; E163-K167 WeakPolarHBondContact OE1-CD 3.46Å; A164-K167 WeakPolarHBondContact CA-O 3.43Å; K167-G228 CarbonylContact C-O 3.57Å; K167-G228 WeakPolarHBondContact CA-O 3.46Å; K167-G228 PolarHBondContact N-O 3.22Å; K167-G228 VanDerWaalsContact N-O 3.12Å; K167-N230 WeakPolarHBondContact O-CB 3.42Å
168Q73.4Confident80.9Confident18 Ų1869.5 Ų69.58%0.08437%0.368CS..EExtended strand (participates in β ladder)trans-132.7151.5172.569-171.9-4.300111.1T225 S226 G228 N230 T444Q168-T225 WeakPolarHBondContact O-CA 3.32Å; Q168-S226 WeakPolarHBondContact CG-OG 3.33Å; Q168-S226 PolarHBondContact N-O 3.21Å; Q168-S226 PolarHBondContact NE2-OG 2.92Å; Q168-S226 PolarHBondContact O-N 2.7Å; Q168-G228 PolarHBondContact N-O 3.45Å; Q168-N230 HydrophobicContact CB-CB 3.79Å; Q168-T444 PolarHBondContact OE1-OG1 3.23Å
169Y80.1Confident79.6Confident69 Ų6971.8 Ų71.827%0.27138%0.384SS..EExtended strand (participates in β ladder)trans-73.1131.8177.8-168.9-84.5000110D151 R154 N155 P223D151-Y169 WeakPolarHBondContact OD1-CD1 3.36Å; D151-Y169 VanDerWaalsContact OD1-CE1 3.23Å; D151-Y169 WeakPolarHBondContact OD1-CE1 3.37Å; R154-Y169 HydrophobicContact CB-CD1 4.21Å; R154-Y169 HydrophobicContact CB-CG 4.32Å; N155-Y169 PolarHBondContact ND2-O 2.83Å; N155-Y169 WeakPolarHBondContact OD1-CB 3.44Å; N155-Y169 PolarHBondContact OD1-N 2.99Å; Y169-P223 HydrophobicContact CE2-CB 4.24Å; Y169-P223 WeakPolarHBondContact OH-CA 3.33Å; Y169-P223 WeakPolarHBondContact OH-CB 3.22Å
170R78.5Confident77.9Confident104 Ų10471.1 Ų71.139%0.39237%0.371SS..  trans-145.7120.9175.8-171.7174.7-177.4160.65.3110.5D151 K172 G224 G447D151-R170 WeakPolarHBondContact OD2-CA 3.36Å; R170-K172 PolarHBondContact O-N 3.5Å; R170-G224 CarbonylContact C-O 3.56Å; R170-G224 PolarHBondContact N-O 2.9Å; R170-G224 CarbonylContact O-C 3.5Å; R170-G224 WeakPolarHBondContact O-CA 3.44Å; R170-G224 PolarHBondContact O-N 3.05Å; R170-G224 VanDerWaalsContact O-N 3.15Å; R170-G447 PolarHBondContact NH2-O 3.47Å
171T81.7Confident75.9Confident9 Ų979.2 Ų79.26%0.05540%0.396CS..  trans-66.6124.2175.6-65.90000109.3D147 D151D147-T171 HydrophobicContact CB-CG2 4.31Å; D151-T171 VanDerWaalsContact CG-OG1 3.29Å; D151-T171 PolarHBondContact OD1-OG1 3.44Å; D151-T171 WeakPolarHBondContact OD2-CB 3.38Å; D151-T171 PolarHBondContact OD2-N 3.42Å; D151-T171 PolarHBondContact OD2-OG1 3.41Å
172K79.2Confident74Confident139 Ų13979.7 Ų79.760%0.60442%0.416SS*.EExtended strand (participates in β ladder)trans-98.3118.5175.9-171.6178.9-179.9-179.20108.6R170 T174 E222R170-K172 PolarHBondContact O-N 3.5Å; K172-T174 HydrophobicContact CD-CG2 4.3Å; K172-T174 HydrophobicContact CG-CG2 4.22Å; K172-T174 PolarHBondContact O-N 3.48Å; K172-E222 PolarHBondContact N-O 3.07Å; K172-E222 PolarHBondContact O-N 3.11Å
173T74.2Confident71.7Confident46 Ų4677.6 Ų77.628%0.28241%0.409SS..EExtended strand (participates in β ladder)trans-85112.3173.8-46.20000109.2Y219T173-Y219 HydrophobicContact CG2-CD1 3.76Å; T173-Y219 HydrophobicContact CG2-CG 4.11Å
174T75.3Confident69.6Low31 Ų3178.2 Ų78.219%0.1943%0.427CS..EExtended strand (participates in β ladder)trans-103.7128.6175.452.90000109.9K172 V176 K220K172-T174 HydrophobicContact CD-CG2 4.3Å; K172-T174 HydrophobicContact CG-CG2 4.22Å; K172-T174 PolarHBondContact O-N 3.48Å; T174-V176 PolarHBondContact O-N 2.9Å; T174-K220 PolarHBondContact N-O 3.44Å; T174-K220 PolarHBondContact O-N 3.39Å; T174-K220 PolarHBondContact OG1-O 3.19Å
175P74.5Confident68.1Low81 Ų8187.3 Ų87.353%0.52647%0.469SS..EExtended strand (participates in β ladder)trans-72.8114.617428.5-31.4000108.7I217 Y219P175-I217 HydrophobicContact CB-CG2 3.67Å; P175-Y219 HydrophobicContact CB-CD1 4.3Å; P175-Y219 HydrophobicContact CB-CE1 4.15Å
176V73.4Confident66.6Low65 Ų6593.8 Ų93.839%0.39450%0.496SS..EExtended strand (participates in β ladder)trans-95.7110173.2-176.90000107.7T174 K178 V218 K220T174-V176 PolarHBondContact O-N 2.9Å; V176-K178 PolarHBondContact O-N 3.45Å; V176-V218 WeakPolarHBondContact CA-O 3.38Å; V176-V218 WeakPolarHBondContact CB-O 3.39Å; V176-V218 PolarHBondContact N-O 2.97Å; V176-V218 PolarHBondContact O-N 3.4Å; V176-K220 HydrophobicContact CG2-CB 3.76Å; V176-K220 HydrophobicContact CG2-CD 4.3Å
177I71.9Confident65.2Low107 Ų10791.2 Ų91.255%0.54950%0.495SS..EExtended strand (participates in β ladder)trans-69.8111.6172.3-59.2175000107S179 P215I177-S179 PolarHBondContact O-N 3.34Å; I177-P215 HydrophobicContact CG2-CB 3.85Å; I177-P215 HydrophobicContact CG2-CG 4.41Å
178K64.8Low63.7Low107 Ų10793.8 Ų93.847%0.46552%0.518SS..  trans-70.6101166.8-78-179.1-178.2163.10107.5V176 E216 V218V176-K178 PolarHBondContact O-N 3.45Å; K178-E216 PolarHBondContact N-O 2.97Å; K178-E216 IonicContact NZ-OE1 2.85Å; K178-E216 PolarHBondContact NZ-OE1 3.38Å; K178-V218 HydrophobicContact CD-CG2 3.88Å; K178-V218 VanDerWaalsContact CE-CG2 3.45Å; K178-V218 HydrophobicContact CG-CG2 4.27Å
179S57.7Low62.9Low86 Ų86101.6 Ų101.660%0.60155%0.547SS*.  trans-60.1133.2162.2-82.30000108.1I177 R181I177-S179 PolarHBondContact O-N 3.34Å; S179-R181 PolarHBondContact O-N 2.94Å
180P54.9Low61.9Low94 Ų94107.9 Ų107.961%0.6157%0.57SS**  trans-70.874.1175.128.6-31.9000109.4G182 A183P180-G182 PolarHBondContact O-N 3.2Å; P180-A183 HydrophobicContact CB-CB 4.26Å
181R50.5Low61.1Low248 Ų248107.6 Ų107.694%0.93658%0.575SS**SBendtrans-77.677.8166.3-78.3-175.2175175.1-0.8107.3S179S179-R181 PolarHBondContact O-N 2.94Å
182G50.9Low60.3Low74 Ų74110.5 Ų110.576%0.76359%0.593SS**SBendtrans147.7-17.2172.900000115.8P180P180-G182 PolarHBondContact O-N 3.2Å
183A45.5Very low59.8Low57 Ų57109.3 Ų109.347%0.47159%0.592SS.*  trans-108.421.5-176.300000113.7P180 E185P180-A183 HydrophobicContact CB-CB 4.26Å; A183-E185 PolarHBondContact O-N 3.48Å
184A46.4Very low59.4Low85 Ų85112.7 Ų112.770%0.70260%0.6SS**THydrogen-bonded Turntrans-74.4-8.2175.400000113.2
185E52.1Low59.1Low193 Ų193113.2 Ų113.290%0.90261%0.612SS**THydrogen-bonded Turntrans-102.8-16.8-178.6-75-174.7151.700115A183A183-E185 PolarHBondContact O-N 3.48Å
186E50.6Low58.8Low182 Ų182112.9 Ų112.985%0.8561%0.609SS**THydrogen-bonded Turntrans-129.9-1.1-171.1-72.4-171.6161.100116.9
187A50.8Low58.5Low54 Ų54115.6 Ų115.645%0.44662%0.617SS.*SBendtrans-71.4125.9172.300000109.9R189A187-R189 PolarHBondContact O-N 2.92Å
188P51.2Low58.3Low121 Ų121116.8 Ų116.879%0.78662%0.62SS**  trans-65.9104.4179.326.1-31.9000108.7R190P188-R190 PolarHBondContact O-N 3.34Å
189R57.5Low58.3Low181 Ų181119.6 Ų119.668%0.68364%0.64SS**  trans-55.9109.9172.8-68.9-173.8-177.2163.90.9108.2A187 I191A187-R189 PolarHBondContact O-N 2.92Å; R189-I191 VanDerWaalsContact C-N 3.34Å; R189-I191 HydrophobicContact CB-CG1 4.31Å; R189-I191 PolarHBondContact O-N 3.17Å; R189-I191 VanDerWaalsContact O-N 3.09Å
190R57.8Low58.5Low201 Ų201123.8 Ų123.876%0.75866%0.656SS**EExtended strand (participates in β ladder)trans-86.283.3-179.5-133.2-179.9-172.9-178.82.1107.7P188 V192P188-R190 PolarHBondContact O-N 3.34Å; R190-V192 PolarHBondContact O-N 3.46Å
191I61.8Low58.8Low99 Ų99120.7 Ų120.751%0.50864%0.641SS.*EExtended strand (participates in β ladder)trans-77.8113.1178.5-55.6175.5000108.1R189 I193 A208R189-I191 VanDerWaalsContact C-N 3.34Å; R189-I191 HydrophobicContact CB-CG1 4.31Å; R189-I191 PolarHBondContact O-N 3.17Å; R189-I191 VanDerWaalsContact O-N 3.09Å; I191-I193 HydrophobicContact CG2-CG1 4.05Å; I191-A208 HydrophobicContact CG2-CB 3.91Å
192V65.8Low59.3Low70 Ų70114.5 Ų114.542%0.42464%0.636SS.*EExtended strand (participates in β ladder)trans-98.2115.3173.2-178.30000107.7R190 L209 L211R190-V192 PolarHBondContact O-N 3.46Å; V192-L209 PolarHBondContact N-O 3.45Å; V192-L209 VanDerWaalsContact N-O 3.1Å; V192-L209 PolarHBondContact O-N 3.45Å; V192-L211 HydrophobicContact CG2-CD1 3.83Å
193I68.8Low59.6Low114 Ų114120.4 Ų120.459%0.58564%0.635SS**EExtended strand (participates in β ladder)trans-98.4119.4175.9-54176.2000107.6I191 N206 F207 A208I191-I193 HydrophobicContact CG2-CG1 4.05Å; I193-N206 HydrophobicContact CG2-CB 3.95Å; I193-F207 WeakPolarHBondContact CA-O 3.26Å; I193-A208 HydrophobicContact CG1-CB 4.41Å
194Y65.6Low60.6Low116 Ų116121.2 Ų121.246%0.45563%0.634SS.*EExtended strand (participates in β ladder)trans-122.1136170.666.6-83.5000109.8V196 F207 L209Y194-V196 HydrophobicContact CD2-CG2 3.9Å; Y194-V196 HydrophobicContact CE2-CG2 3.71Å; Y194-F207 HydrophobicContact CE1-CB 4.3Å; Y194-F207 PolarHBondContact N-O 3.31Å; Y194-F207 VanDerWaalsContact N-O 3.15Å; Y194-F207 PolarHBondContact O-N 2.92Å; Y194-L209 HydrophobicContact CE1-CD1 4.18Å
195G67.8Low61.7Low43 Ų43122.6 Ų122.644%0.44363%0.626SS.*EExtended strand (participates in β ladder)trans-92.1123.2177.600000109.6Q205 N206G195-Q205 WeakPolarHBondContact CA-O 3.3Å; G195-N206 WeakPolarHBondContact CA-OD1 3.21Å
196V69.1Low62.7Low74 Ų74118.7 Ų118.745%0.44861%0.611SS.*EExtended strand (participates in β ladder)trans-94.7121.4168-176.70000107Y194 Q205 F207Y194-V196 HydrophobicContact CD2-CG2 3.9Å; Y194-V196 HydrophobicContact CE2-CG2 3.71Å; V196-Q205 PolarHBondContact N-O 3.44Å; V196-Q205 PolarHBondContact O-N 3.29Å; V196-F207 HydrophobicContact CB-CE2 4.23Å; V196-F207 HydrophobicContact CG2-CD2 4.05Å; V196-F207 HydrophobicContact CG2-CE2 4.12Å
197Q68.1Low63.8Low121 Ų121114.2 Ų114.257%0.56559%0.589SS**EExtended strand (participates in β ladder)trans-100.3124.5175.9-172.8158.45.400108.6V204Q197-V204 HydrophobicContact CB-CG2 4.32Å; Q197-V204 HydrophobicContact CG-CG2 4.25Å
198E66.6Low64.5Low132 Ų132115.1 Ų115.162%0.61760%0.596SS**PPolyproline II helixtrans-69.6137175.8-75.2179.1161.700110.3N200 G201E198-N200 PolarHBondContact O-N 3.45Å; E198-G201 PolarHBondContact O-N 2.97Å; E198-G201 VanDerWaalsContact O-N 3.13Å
199D63.9Low65.1Low167 Ų167113.2 Ų113.289%0.89358%0.579SS**THydrogen-bonded Turntrans-58.5-1.7-169.3-77.4-29.6000116.2
200N62.4Low65.4Low174 Ų174108.8 Ų108.893%0.9357%0.569SS**THydrogen-bonded Turntrans-148.221.4175.1-105.9-16.9000115E198E198-N200 PolarHBondContact O-N 3.45Å
201G60.8Low65.5Low29 Ų29103.6 Ų103.630%0.29956%0.556SS.*  trans-132.6145.6-179.800000113.5E198 R203E198-G201 PolarHBondContact O-N 2.97Å; E198-G201 VanDerWaalsContact O-N 3.13Å; G201-R203 PolarHBondContact O-N 2.98Å
202S61.7Low65.4Low118 Ų118104.8 Ų104.883%0.82557%0.568SS**SBendtrans-75.99.7173.466.20000113.7
203R57.9Low65.3Low198 Ų198105.7 Ų105.775%0.74758%0.575SS**  trans-95.5113.1-179.6-80.7176.467.8154-2109.6G201G201-R203 PolarHBondContact O-N 2.98Å
204V65.7Low65Low74 Ų74105.9 Ų105.945%0.44858%0.584SS.*EExtended strand (participates in β ladder)trans-92.4123.8170.1-178.30000108.2Q197Q197-V204 HydrophobicContact CB-CG2 4.32Å; Q197-V204 HydrophobicContact CG-CG2 4.25Å
205Q70.6Confident64.9Low114 Ų114104 Ų10453%0.53359%0.586SS.*EExtended strand (participates in β ladder)trans-100.9116.8175.2-145.4169.719.900108.8G195 V196 F207G195-Q205 WeakPolarHBondContact CA-O 3.3Å; V196-Q205 PolarHBondContact N-O 3.44Å; V196-Q205 PolarHBondContact O-N 3.29Å; Q205-F207 HydrophobicContact CB-CE2 3.98Å; Q205-F207 HydrophobicContact CB-CZ 4.32Å; Q205-F207 HydrophobicContact CG-CE2 4.3Å; Q205-F207 HydrophobicContact CG-CZ 4.18Å; Q205-F207 WeakPolarHBondContact O-CD2 3.39Å
206N72.9Confident64.6Low110 Ų110107.7 Ų107.759%0.58859%0.592SS**EExtended strand (participates in β ladder)trans-89.6124.9-177.9-67.9-28.4000109.9I193 G195I193-N206 HydrophobicContact CG2-CB 3.95Å; G195-N206 WeakPolarHBondContact CA-OD1 3.21Å
207F73.1Confident64.6Low88 Ų88108.2 Ų108.239%0.38659%0.591SS.*EExtended strand (participates in β ladder)trans-108.7131.5173.2-62.4-87.1000109.1I193 Y194 V196 Q205I193-F207 WeakPolarHBondContact CA-O 3.26Å; Y194-F207 HydrophobicContact CE1-CB 4.3Å; Y194-F207 PolarHBondContact N-O 3.31Å; Y194-F207 VanDerWaalsContact N-O 3.15Å; Y194-F207 PolarHBondContact O-N 2.92Å; V196-F207 HydrophobicContact CB-CE2 4.23Å; V196-F207 HydrophobicContact CG2-CD2 4.05Å; V196-F207 HydrophobicContact CG2-CE2 4.12Å; Q205-F207 HydrophobicContact CB-CE2 3.98Å; Q205-F207 HydrophobicContact CB-CZ 4.32Å; Q205-F207 HydrophobicContact CG-CE2 4.3Å; Q205-F207 HydrophobicContact CG-CZ 4.18Å; Q205-F207 WeakPolarHBondContact O-CD2 3.39Å
208A66.3Low64.7Low73 Ų73105 Ų10560%0.60358%0.58SS**EExtended strand (participates in β ladder)trans-99.8114.8175.100000109I191 I193I191-A208 HydrophobicContact CG2-CB 3.91Å; I193-A208 HydrophobicContact CG1-CB 4.41Å
209L63Low65Low81 Ų81105.9 Ų105.942%0.42458%0.578SS.*EExtended strand (participates in β ladder)trans-95.3119.3173.4-134.383000108.9V192 Y194 L211V192-L209 PolarHBondContact N-O 3.45Å; V192-L209 VanDerWaalsContact N-O 3.1Å; V192-L209 PolarHBondContact O-N 3.45Å; Y194-L209 HydrophobicContact CE1-CD1 4.18Å; L209-L211 HydrophobicContact CD2-CD2 4.07Å
210D63Low65.6Low89 Ų89103.1 Ų103.148%0.47656%0.559SS.*EExtended strand (participates in β ladder)trans-89.5104.3172.1-162.3-0.6000108.8T212D210-T212 PolarHBondContact O-N 3.22Å
211L60.2Low66.4Low92 Ų9297.5 Ų97.548%0.48253%0.533SS..EExtended strand (participates in β ladder)trans-84.697.8-179.5-69.6170.1000109.5V192 L209V192-L211 HydrophobicContact CG2-CD1 3.83Å; L209-L211 HydrophobicContact CD2-CD2 4.07Å
212T60.8Low67.3Low124 Ų12499.6 Ų99.676%0.76154%0.535SS*.PPolyproline II helixtrans-61.2126.5170.3-50.20000109.4D210D210-T212 PolarHBondContact O-N 3.22Å
213P63.2Low68.3Low88 Ų8899 Ų9957%0.57153%0.528SS*.PPolyproline II helixtrans-59.8144175.823.5-31.5000110.2
214P61.9Low69.4Low118 Ų11890.5 Ų90.577%0.76650%0.502SS*.PPolyproline II helixtrans-59.3137.5178.724.7-32.6000109.6E216P214-E216 PolarHBondContact O-N 2.97Å
215P63.1Low70.2Confident77 Ų7791.2 Ų91.250%0.551%0.507SS..PPolyproline II helixtrans-62.4139.3-179.225.2-32.9000110.8I177 I217I177-P215 HydrophobicContact CG2-CB 3.85Å; I177-P215 HydrophobicContact CG2-CG 4.41Å; P215-I217 PolarHBondContact O-N 2.99Å; P215-I217 VanDerWaalsContact O-N 3.12Å
216E63.2Low70.5Confident120 Ų12086.8 Ų86.856%0.56149%0.488SS*.  trans-67.4109.7171.5-167.4-169135.500108.7K178 P214 V218K178-E216 PolarHBondContact N-O 2.97Å; K178-E216 IonicContact NZ-OE1 2.85Å; K178-E216 PolarHBondContact NZ-OE1 3.38Å; P214-E216 PolarHBondContact O-N 2.97Å; E216-V218 HydrophobicContact CG-CG2 4.41Å
217I68.4Low70.5Confident85 Ų8588.2 Ų88.244%0.43650%0.496SS..EExtended strand (participates in β ladder)trans-87.8115.6176-55.9174.3000107.5P175 P215 Y219P175-I217 HydrophobicContact CB-CG2 3.67Å; P215-I217 PolarHBondContact O-N 2.99Å; P215-I217 VanDerWaalsContact O-N 3.12Å; I217-Y219 HydrophobicContact CG2-CE1 4.48Å; I217-Y219 HydrophobicContact CG2-CE2 4.37Å
218V70.7Confident70.1Confident55 Ų5585.4 Ų85.433%0.33349%0.492SS..EExtended strand (participates in β ladder)trans-105.4125.1170.5179.40000108.7V176 K178 E216V176-V218 WeakPolarHBondContact CA-O 3.38Å; V176-V218 WeakPolarHBondContact CB-O 3.39Å; V176-V218 PolarHBondContact N-O 2.97Å; V176-V218 PolarHBondContact O-N 3.4Å; K178-V218 HydrophobicContact CD-CG2 3.88Å; K178-V218 VanDerWaalsContact CE-CG2 3.45Å; K178-V218 HydrophobicContact CG-CG2 4.27Å; E216-V218 HydrophobicContact CG-CG2 4.41Å
219Y71.9Confident70.2Confident149 Ų14983.7 Ų83.758%0.58447%0.472SS*.EExtended strand (participates in β ladder)trans-79.5127.6176.1-65.4-82.3000110T173 P175 I217T173-Y219 HydrophobicContact CG2-CD1 3.76Å; T173-Y219 HydrophobicContact CG2-CG 4.11Å; P175-Y219 HydrophobicContact CB-CD1 4.3Å; P175-Y219 HydrophobicContact CB-CE1 4.15Å; I217-Y219 HydrophobicContact CG2-CE1 4.48Å; I217-Y219 HydrophobicContact CG2-CE2 4.37Å
220K77.3Confident70.6Confident109 Ų10980.2 Ų80.247%0.47445%0.454SS..EExtended strand (participates in β ladder)trans-111.9128.8173.8-171.4-174.7170.7-148.40109T174 V176 E222T174-K220 PolarHBondContact N-O 3.44Å; T174-K220 PolarHBondContact O-N 3.39Å; T174-K220 PolarHBondContact OG1-O 3.19Å; V176-K220 HydrophobicContact CG2-CB 3.76Å; V176-K220 HydrophobicContact CG2-CD 4.3Å; K220-E222 HydrophobicContact CD-CG 4.35Å; K220-E222 HydrophobicContact CG-CG 4.36Å; K220-E222 IonicContact NZ-OE1 2.83Å; K220-E222 PolarHBondContact NZ-OE1 2.7Å
221S78.5Confident70.8Confident57 Ų5776.3 Ų76.340%0.39943%0.433SS..EExtended strand (participates in β ladder)trans-84.8120.8174.2-63.20000109.2D147D147-S221 PolarHBondContact OD2-OG 3.22Å
222E80Confident71.1Confident72 Ų7272.7 Ų72.734%0.33641%0.414SS..EExtended strand (participates in β ladder)trans-116.3143.3178.6-64.4-168.9148.400111.1K172 K220 G224K172-E222 PolarHBondContact N-O 3.07Å; K172-E222 PolarHBondContact O-N 3.11Å; K220-E222 HydrophobicContact CD-CG 4.35Å; K220-E222 HydrophobicContact CG-CG 4.36Å; K220-E222 IonicContact NZ-OE1 2.83Å; K220-E222 PolarHBondContact NZ-OE1 2.7Å; E222-G224 PolarHBondContact O-N 2.91Å
223P82.3Confident71.8Confident106 Ų10666.8 Ų66.869%0.68838%0.378SS*.  trans-57.7130.2173.4-22.533.3000110.4Y169Y169-P223 HydrophobicContact CE2-CB 4.24Å; Y169-P223 WeakPolarHBondContact OH-CA 3.33Å; Y169-P223 WeakPolarHBondContact OH-CB 3.22Å
224G82.3Confident72.6Confident19 Ų1962.7 Ų62.720%0.19635%0.351CS..  trans-140.1165.617600000111.4R170 E222R170-G224 CarbonylContact C-O 3.56Å; R170-G224 PolarHBondContact N-O 2.9Å; R170-G224 CarbonylContact O-C 3.5Å; R170-G224 WeakPolarHBondContact O-CA 3.44Å; R170-G224 PolarHBondContact O-N 3.05Å; R170-G224 VanDerWaalsContact O-N 3.15Å; E222-G224 PolarHBondContact O-N 2.91Å
225T82.6Confident73.1Confident89 Ų8957.7 Ų57.755%0.54632%0.318SS..EExtended strand (participates in β ladder)trans-120.9149.9169.953.70000108.8Q168Q168-T225 WeakPolarHBondContact O-CA 3.32Å
226S75.1Confident73.8Confident21 Ų2155.7 Ų55.715%0.14730%0.303CS..EExtended strand (participates in β ladder)trans-121.8143.5169.4580000109.3Q168 G228Q168-S226 WeakPolarHBondContact CG-OG 3.33Å; Q168-S226 PolarHBondContact N-O 3.21Å; Q168-S226 PolarHBondContact NE2-OG 2.92Å; Q168-S226 PolarHBondContact O-N 2.7Å; S226-G228 PolarHBondContact O-N 2.91Å
227D73.6Confident75.1Confident141 Ų14154.4 Ų54.475%0.75430%0.296SS*.EExtended strand (participates in β ladder)trans-70.4128.8176.6-63.7-35.8000109.3
228G64.9Low75.8Confident28 Ų2850.3 Ų50.329%0.28928%0.275SS..SBendtrans144143.1-172.400000111.5F166 K167 Q168 S226 N230F166-G228 CarbonylContact C-O 3.52Å; F166-G228 VanDerWaalsContact C-O 3.24Å; F166-G228 CarbonylContact O-C 3.3Å; F166-G228 PolarHBondContact O-N 3.05Å; K167-G228 CarbonylContact C-O 3.57Å; K167-G228 WeakPolarHBondContact CA-O 3.46Å; K167-G228 PolarHBondContact N-O 3.22Å; K167-G228 VanDerWaalsContact N-O 3.12Å; Q168-G228 PolarHBondContact N-O 3.45Å; S226-G228 PolarHBondContact O-N 2.91Å; G228-N230 PolarHBondContact O-N 3.05Å
229M68.5Low76.2Confident38 Ų3848.8 Ų48.819%0.18727%0.268CS..  trans-65.7124.6179.6-176.7168.462.100111I75 L76 A164 T165 V231 I234I75-M229 HydrophobicContact CB-CE 3.79Å; I75-M229 HydrophobicContact CD1-CE 4.25Å; I75-M229 HydrophobicContact CG2-CE 3.44Å; I75-M229 VanDerWaalsContact CG2-CE 3.44Å; L76-M229 HydrophobicContact CB-SD 3.87Å; L76-M229 HydrophobicContact CD1-SD 3.97Å; L76-M229 HydrophobicContact CG-SD 4.4Å; A164-M229 CarbonylContact O-C 3.07Å; T165-M229 WeakPolarHBondContact O-CB 3.31Å; T165-M229 WeakPolarHBondContact O-CG 3.45Å; M229-V231 VanDerWaalsContact C-N 3.25Å; M229-V231 HydrophobicContact CB-CG2 4.22Å; M229-V231 HydrophobicContact CE-CG2 3.51Å; M229-V231 HydrophobicContact CG-CG2 3.93Å; M229-V231 WeakPolarHBondContact O-CG2 3.39Å; M229-V231 PolarHBondContact O-N 3.42Å; M229-V231 HydrophobicContact SD-CG2 4.41Å; M229-I234 HydrophobicContact CG-CD1 3.57Å; M229-I234 HydrophobicContact SD-CD1 3.86Å
230N72Confident76.8Confident7 Ų745.2 Ų45.24%0.03726%0.262CS..  trans-76.278.5167.8178.510000110.1N155 A164 K167 Q168 G228 L232 G233 I234N155-N230 PolarHBondContact O-ND2 2.94Å; N155-N230 PolarHBondContact O-OD1 2.96Å; N155-N230 PolarHBondContact OD1-ND2 3.26Å; A164-N230 HydrophobicContact CB-CB 4.11Å; A164-N230 PolarHBondContact O-N 3.35Å; K167-N230 WeakPolarHBondContact O-CB 3.42Å; Q168-N230 HydrophobicContact CB-CB 3.79Å; G228-N230 PolarHBondContact O-N 3.05Å; N230-L232 VanDerWaalsContact C-N 3.29Å; N230-L232 PolarHBondContact O-N 2.89Å; N230-G233 PolarHBondContact O-N 3.21Å; N230-G233 PolarHBondContact OD1-N 3Å; N230-G233 VanDerWaalsContact OD1-N 3.09Å; N230-I234 WeakPolarHBondContact O-CG1 3.49Å; N230-I234 PolarHBondContact O-N 3.27Å
231V66.4Low77.4Confident8 Ų842.9 Ų42.95%0.04825%0.253CS..Hα-helixtrans-65.9-33.3-177.6-162.70000111.9M229 G233 I234 V235 I441M229-V231 VanDerWaalsContact C-N 3.25Å; M229-V231 HydrophobicContact CB-CG2 4.22Å; M229-V231 HydrophobicContact CE-CG2 3.51Å; M229-V231 HydrophobicContact CG-CG2 3.93Å; M229-V231 WeakPolarHBondContact O-CG2 3.39Å; M229-V231 PolarHBondContact O-N 3.42Å; M229-V231 HydrophobicContact SD-CG2 4.41Å; V231-G233 PolarHBondContact O-N 2.76Å; V231-I234 WeakPolarHBondContact O-CB 3.09Å; V231-I234 PolarHBondContact O-N 3.27Å; V231-V235 HydrophobicContact CG1-CG2 4.18Å; V231-V235 VanDerWaalsContact O-CG2 3.29Å; V231-V235 WeakPolarHBondContact O-CG2 3.47Å; V231-V235 PolarHBondContact O-N 3.25Å; V231-I441 HydrophobicContact CB-CD1 3.45Å; V231-I441 VanDerWaalsContact CB-CD1 3.45Å; V231-I441 HydrophobicContact CB-CG1 3.53Å; V231-I441 HydrophobicContact CB-CG2 4.33Å; V231-I441 HydrophobicContact CG1-CD1 3.32Å; V231-I441 HydrophobicContact CG1-CG1 3.96Å; V231-I441 HydrophobicContact CG2-CD1 4.01Å; V231-I441 HydrophobicContact CG2-CG1 3.65Å
232L65.9Low77.7Confident15 Ų1540.2 Ų40.28%0.07923%0.234CC..Hα-helixtrans-59.2-47.7179178.564.3000111.6L152 M156 N230 I234 V235 I236 A423 I441L152-L232 HydrophobicContact CD1-CD2 3.39Å; L152-L232 HydrophobicContact CG-CD2 4.26Å; M156-L232 HydrophobicContact CG-CD2 3.71Å; M156-L232 HydrophobicContact CG-CG 4.09Å; N230-L232 VanDerWaalsContact C-N 3.29Å; N230-L232 PolarHBondContact O-N 2.89Å; L232-I234 VanDerWaalsContact C-N 3.32Å; L232-I234 PolarHBondContact O-N 3.49Å; L232-V235 PolarHBondContact O-N 2.91Å; L232-I236 HydrophobicContact CD1-CD1 3.99Å; L232-I236 HydrophobicContact CG-CD1 4.14Å; L232-I236 WeakPolarHBondContact O-CG1 3.38Å; L232-I236 PolarHBondContact O-N 3.1Å; L232-A423 HydrophobicContact CD1-CB 4.26Å; L232-I441 HydrophobicContact CB-CG2 4.32Å
233G76.9Confident77.9Confident0 Ų040.1 Ų40.10%024%0.236CC..Hα-helixtrans-62.4-39.4176.300000112.6N155 N230 V231 F237N155-G233 WeakPolarHBondContact O-CA 3.36Å; N155-G233 PolarHBondContact O-N 3.21Å; N230-G233 PolarHBondContact O-N 3.21Å; N230-G233 PolarHBondContact OD1-N 3Å; N230-G233 VanDerWaalsContact OD1-N 3.09Å; V231-G233 PolarHBondContact O-N 2.76Å; G233-F237 VanDerWaalsContact O-CB 3.29Å; G233-F237 WeakPolarHBondContact O-CB 3.2Å; G233-F237 PolarHBondContact O-N 3.05Å
234I79Confident78.2Confident3 Ų339.4 Ų39.42%0.01522%0.224CC..Hα-helixtrans-63.9-46176.4-65.4165000110.9L76 V79 V80 L161 A164 T165 M229 N230 V231 L232 I236 F237 S238L76-I234 HydrophobicContact CD1-CD1 3.59Å; L76-I234 HydrophobicContact CD1-CG1 4.46Å; L76-I234 HydrophobicContact CD1-CG2 4.14Å; V79-I234 HydrophobicContact CG1-CG2 4.34Å; V80-I234 HydrophobicContact CG2-CG2 3.47Å; V80-I234 VanDerWaalsContact CG2-CG2 3.47Å; L161-I234 HydrophobicContact CD1-CG1 4.45Å; A164-I234 HydrophobicContact CB-CG1 4.44Å; T165-I234 HydrophobicContact CG2-CD1 4.41Å; M229-I234 HydrophobicContact CG-CD1 3.57Å; M229-I234 HydrophobicContact SD-CD1 3.86Å; N230-I234 WeakPolarHBondContact O-CG1 3.49Å; N230-I234 PolarHBondContact O-N 3.27Å; V231-I234 WeakPolarHBondContact O-CB 3.09Å; V231-I234 PolarHBondContact O-N 3.27Å; L232-I234 VanDerWaalsContact C-N 3.32Å; L232-I234 PolarHBondContact O-N 3.49Å; I234-I236 PolarHBondContact O-N 2.88Å; I234-F237 PolarHBondContact O-N 3.23Å; I234-S238 VanDerWaalsContact O-CB 3.27Å; I234-S238 WeakPolarHBondContact O-CB 3.41Å; I234-S238 PolarHBondContact O-N 2.76Å; I234-S238 PolarHBondContact O-OG 3.07Å; I234-S238 VanDerWaalsContact O-OG 3.09Å
235V72.8Confident78.5Confident12 Ų1238.8 Ų38.87%0.07322%0.216CC..Hα-helixtrans-58.9-49177.8166.80000110.9V79 L83 V231 L232 S238 A239V79-V235 HydrophobicContact CG1-CG2 3.6Å; L83-V235 HydrophobicContact CD1-CB 4.03Å; L83-V235 HydrophobicContact CD1-CG1 3.8Å; L83-V235 HydrophobicContact CD1-CG2 3.92Å; V231-V235 HydrophobicContact CG1-CG2 4.18Å; V231-V235 VanDerWaalsContact O-CG2 3.29Å; V231-V235 WeakPolarHBondContact O-CG2 3.47Å; V231-V235 PolarHBondContact O-N 3.25Å; L232-V235 PolarHBondContact O-N 2.91Å; V235-S238 PolarHBondContact O-N 3.17Å; V235-A239 WeakPolarHBondContact O-CB 3.36Å; V235-A239 PolarHBondContact O-N 2.93Å
236I77.9Confident78.6Confident36 Ų3635.3 Ų35.319%0.18520%0.199CC..Hα-helixtrans-65.8-42.5-178.1-70.4170.1000111.3M156 L232 I234 A239 T240M156-I236 HydrophobicContact CB-CD1 3.45Å; M156-I236 VanDerWaalsContact CB-CD1 3.45Å; M156-I236 HydrophobicContact CE-CD1 3.52Å; M156-I236 HydrophobicContact CG-CD1 3.4Å; M156-I236 VanDerWaalsContact CG-CD1 3.4Å; M156-I236 HydrophobicContact SD-CD1 4.27Å; L232-I236 HydrophobicContact CD1-CD1 3.99Å; L232-I236 HydrophobicContact CG-CD1 4.14Å; L232-I236 WeakPolarHBondContact O-CG1 3.38Å; L232-I236 PolarHBondContact O-N 3.1Å; I234-I236 PolarHBondContact O-N 2.88Å; I236-A239 PolarHBondContact O-N 3.15Å; I236-T240 WeakPolarHBondContact O-CB 3.48Å; I236-T240 PolarHBondContact O-N 2.83Å; I236-T240 PolarHBondContact O-OG1 3.05Å
237F89.4Confident79Confident92 Ų9242.2 Ų42.240%0.40422%0.221SC..Hα-helixtrans-60.9-53174.8172.9-94.8000111.3L161 G233 I234 A239 T240 M241L161-F237 HydrophobicContact CD1-CB 4.01Å; L161-F237 HydrophobicContact CD1-CD1 3.81Å; L161-F237 HydrophobicContact CD1-CD2 4.46Å; L161-F237 HydrophobicContact CD1-CE1 4.46Å; L161-F237 HydrophobicContact CD1-CG 3.81Å; L161-F237 HydrophobicContact CD2-CD1 3.53Å; L161-F237 HydrophobicContact CD2-CD2 4.35Å; L161-F237 HydrophobicContact CD2-CE1 3.31Å; L161-F237 HydrophobicContact CD2-CE2 4.16Å; L161-F237 HydrophobicContact CD2-CG 4.06Å; L161-F237 HydrophobicContact CD2-CZ 3.65Å; L161-F237 HydrophobicContact CG-CD1 4.34Å; G233-F237 VanDerWaalsContact O-CB 3.29Å; G233-F237 WeakPolarHBondContact O-CB 3.2Å; G233-F237 PolarHBondContact O-N 3.05Å; I234-F237 PolarHBondContact O-N 3.23Å; F237-A239 VanDerWaalsContact C-N 3.28Å; F237-A239 PolarHBondContact O-N 2.97Å; F237-T240 PolarHBondContact O-N 3.23Å; F237-M241 WeakPolarHBondContact O-CB 3.23Å; F237-M241 PolarHBondContact O-N 2.9Å
238S84.3Confident79.7Confident0 Ų040.3 Ų40.30%021%0.209CC..Hα-helixtrans-61.4-37-179.9-69.40000112.2V80 M84 I234 V235 G242V80-S238 WeakPolarHBondContact CA-OG 3.43Å; M84-S238 WeakPolarHBondContact CG-O 3.24Å; I234-S238 VanDerWaalsContact O-CB 3.27Å; I234-S238 WeakPolarHBondContact O-CB 3.41Å; I234-S238 PolarHBondContact O-N 2.76Å; I234-S238 PolarHBondContact O-OG 3.07Å; I234-S238 VanDerWaalsContact O-OG 3.09Å; V235-S238 PolarHBondContact O-N 3.17Å; S238-G242 PolarHBondContact O-N 2.7Å
239A77.8Confident80.6Confident22 Ų2240.9 Ų40.918%0.18222%0.215CC..Hα-helixtrans-66.9-47.1175.900000112.4L87 V235 I236 F237 M241 G242 I243L87-A239 HydrophobicContact CD1-CB 3.42Å; L87-A239 VanDerWaalsContact CD1-CB 3.42Å; V235-A239 WeakPolarHBondContact O-CB 3.36Å; V235-A239 PolarHBondContact O-N 2.93Å; I236-A239 PolarHBondContact O-N 3.15Å; F237-A239 VanDerWaalsContact C-N 3.28Å; F237-A239 PolarHBondContact O-N 2.97Å; A239-M241 VanDerWaalsContact C-N 3.33Å; A239-M241 PolarHBondContact O-N 3.27Å; A239-G242 PolarHBondContact O-N 3.38Å; A239-I243 VanDerWaalsContact O-CG1 3.32Å; A239-I243 WeakPolarHBondContact O-CG1 3.11Å; A239-I243 PolarHBondContact O-N 3.49Å
240T86.1Confident81.5Confident75 Ų7546.1 Ų46.146%0.4624%0.243SC..Hα-helixtrans-60.5-45.8176.4-55.80000110.5I236 F237 I243 M244I236-T240 WeakPolarHBondContact O-CB 3.48Å; I236-T240 PolarHBondContact O-N 2.83Å; I236-T240 PolarHBondContact O-OG1 3.05Å; F237-T240 PolarHBondContact O-N 3.23Å; T240-I243 PolarHBondContact O-N 3.33Å; T240-M244 WeakPolarHBondContact O-CG 3.47Å; T240-M244 PolarHBondContact O-N 2.9Å
241M89.8Confident82.4Confident60 Ų6050.4 Ų50.430%0.29627%0.274SS..Hα-helixtrans-63.7-43.2178.6-16864.4-170.700111.8M84 F237 A239 I243 M244 L245 L255M84-M241 HydrophobicContact CE-CB 4.32Å; M84-M241 HydrophobicContact CE-CG 3.64Å; M84-M241 HydrophobicContact CG-CB 4.46Å; M84-M241 HydrophobicContact SD-CG 4.47Å; F237-M241 WeakPolarHBondContact O-CB 3.23Å; F237-M241 PolarHBondContact O-N 2.9Å; A239-M241 VanDerWaalsContact C-N 3.33Å; A239-M241 PolarHBondContact O-N 3.27Å; M241-I243 PolarHBondContact O-N 2.8Å; M241-M244 PolarHBondContact O-N 3.27Å; M241-L245 HydrophobicContact CE-CD1 4.34Å; M241-L245 HydrophobicContact CE-CD2 4Å; M241-L245 HydrophobicContact CE-CG 4.06Å; M241-L245 HydrophobicContact CG-CD1 4.19Å; M241-L245 HydrophobicContact CG-CG 4.43Å; M241-L245 WeakPolarHBondContact O-CB 3.41Å; M241-L245 VanDerWaalsContact O-CG 3.28Å; M241-L245 WeakPolarHBondContact O-CG 3.49Å; M241-L245 PolarHBondContact O-N 3.21Å; M241-L255 HydrophobicContact CE-CD2 4.05Å
242G84.8Confident83.5Confident0 Ų050.1 Ų50.10%027%0.272CS..Hα-helixtrans-57.4-47.7174.700000112.4M84 A88 S238 A239 M244 L245 G246M84-G242 WeakPolarHBondContact O-CA 3.36Å; A88-G242 WeakPolarHBondContact CA-O 3.43Å; A88-G242 VanDerWaalsContact CB-O 3.29Å; A88-G242 WeakPolarHBondContact CB-O 3.32Å; A88-G242 PolarHBondContact N-O 3.48Å; S238-G242 PolarHBondContact O-N 2.7Å; A239-G242 PolarHBondContact O-N 3.38Å; G242-M244 VanDerWaalsContact C-N 3.34Å; G242-M244 PolarHBondContact O-N 3.26Å; G242-L245 PolarHBondContact O-N 2.96Å; G242-G246 PolarHBondContact O-N 3.37Å
243I82.8Confident84.7Confident71 Ų7152.6 Ų52.636%0.36429%0.288SS..Hα-helixtrans-63.2-40.9177.4-62.7163.4000111.2L87 A239 T240 M241 G246 R247L87-I243 HydrophobicContact CB-CG1 4.12Å; A239-I243 VanDerWaalsContact O-CG1 3.32Å; A239-I243 WeakPolarHBondContact O-CG1 3.11Å; A239-I243 PolarHBondContact O-N 3.49Å; T240-I243 PolarHBondContact O-N 3.33Å; M241-I243 PolarHBondContact O-N 2.8Å; I243-G246 PolarHBondContact O-N 3.49Å; I243-R247 WeakPolarHBondContact O-CG 3.25Å; I243-R247 PolarHBondContact O-N 3.21Å; I243-R247 VanDerWaalsContact O-N 3.14Å
244M89.1Confident85.5Confident91 Ų9157 Ų5745%0.44832%0.317SS..Hα-helixtrans-64.4-42.9176.7-68.9-56.2100.200111.5T240 M241 G242 G246 R247 M248T240-M244 WeakPolarHBondContact O-CG 3.47Å; T240-M244 PolarHBondContact O-N 2.9Å; M241-M244 PolarHBondContact O-N 3.27Å; G242-M244 VanDerWaalsContact C-N 3.34Å; G242-M244 PolarHBondContact O-N 3.26Å; M244-G246 PolarHBondContact O-N 2.82Å; M244-R247 CarbonylContact O-C 3.24Å; M244-R247 WeakPolarHBondContact O-CA 3.5Å; M244-R247 WeakPolarHBondContact O-CB 3.45Å; M244-R247 PolarHBondContact O-N 2.88Å; M244-M248 WeakPolarHBondContact O-CG 3.28Å; M244-M248 PolarHBondContact O-N 3.34Å
245L89.1Confident86.3Confident5 Ų560.1 Ų60.13%0.02633%0.333CS..Hα-helixtrans-61.6-42.2176.9-73.1171.2000112.4M84 A88 M241 G242 R247 M248 L255 V256M84-L245 HydrophobicContact CE-CD1 3.68Å; A88-L245 HydrophobicContact CB-CB 4.06Å; M241-L245 HydrophobicContact CE-CD1 4.34Å; M241-L245 HydrophobicContact CE-CD2 4Å; M241-L245 HydrophobicContact CE-CG 4.06Å; M241-L245 HydrophobicContact CG-CD1 4.19Å; M241-L245 HydrophobicContact CG-CG 4.43Å; M241-L245 WeakPolarHBondContact O-CB 3.41Å; M241-L245 VanDerWaalsContact O-CG 3.28Å; M241-L245 WeakPolarHBondContact O-CG 3.49Å; M241-L245 PolarHBondContact O-N 3.21Å; G242-L245 PolarHBondContact O-N 2.96Å; L245-R247 PolarHBondContact O-N 3.36Å; L245-M248 HydrophobicContact CD2-SD 4.09Å; L245-M248 PolarHBondContact O-N 2.86Å; L245-L255 HydrophobicContact CD1-CB 4.35Å; L245-L255 HydrophobicContact CD1-CD2 3.84Å; L245-L255 HydrophobicContact CD1-CG 4.06Å; L245-L255 HydrophobicContact CD2-CB 4.12Å; L245-L255 HydrophobicContact CD2-CD2 3.88Å; L245-L255 HydrophobicContact CD2-CG 4.43Å; L245-L255 HydrophobicContact CG-CD2 4.45Å; L245-V256 HydrophobicContact CB-CG2 3.92Å; L245-V256 HydrophobicContact CD1-CG2 4.37Å
246G83.5Confident87Confident17 Ų1760.4 Ų60.418%0.17534%0.335CS..Hα-helixtrans-61.5-32.2173.200000112.8A88 G242 I243 M244A88-G246 VanDerWaalsContact O-CA 3.3Å; A88-G246 WeakPolarHBondContact O-CA 3.35Å; G242-G246 PolarHBondContact O-N 3.37Å; I243-G246 PolarHBondContact O-N 3.49Å; M244-G246 PolarHBondContact O-N 2.82Å
247R85Confident87.6Confident166 Ų16661.1 Ų61.163%0.62634%0.343SS*.Hα-helixtrans-78.1-22.2176.3-74.5-164.9133.584.36.4114.6A92 I243 M244 L245 G249A92-R247 HydrophobicContact CB-CG 4.3Å; I243-R247 WeakPolarHBondContact O-CG 3.25Å; I243-R247 PolarHBondContact O-N 3.21Å; I243-R247 VanDerWaalsContact O-N 3.14Å; M244-R247 CarbonylContact O-C 3.24Å; M244-R247 WeakPolarHBondContact O-CA 3.5Å; M244-R247 WeakPolarHBondContact O-CB 3.45Å; M244-R247 PolarHBondContact O-N 2.88Å; L245-R247 PolarHBondContact O-N 3.36Å; R247-G249 PolarHBondContact O-N 3.09Å
248M87.9Confident87.9Confident101 Ų10162.6 Ų62.650%0.49835%0.35SS..THydrogen-bonded Turntrans-73.1-11.3177.6-71.6172.66900113.1M244 L245 D250 S251M244-M248 WeakPolarHBondContact O-CG 3.28Å; M244-M248 PolarHBondContact O-N 3.34Å; L245-M248 HydrophobicContact CD2-SD 4.09Å; L245-M248 PolarHBondContact O-N 2.86Å; M248-D250 PolarHBondContact O-N 3.4Å; M248-S251 PolarHBondContact O-N 3.41Å
249G83.4Confident88Confident39 Ų3962.9 Ų62.940%0.40235%0.351SS..G310 helixtrans58.7-132.1-177.900000111R247 S251 G252 T253R247-G249 PolarHBondContact O-N 3.09Å; G249-S251 PolarHBondContact O-N 3.16Å; G249-S251 VanDerWaalsContact O-N 3.15Å; G249-G252 PolarHBondContact O-N 3.24Å; G249-T253 PolarHBondContact O-N 3.41Å; G249-T253 PolarHBondContact O-OG1 2.74Å
250D87.1Confident88.3Confident148 Ų14865.8 Ų65.879%0.79136%0.361SS*.G310 helixtrans-58.9-31.1-174-58.3-34.3000114M248 G252 T253M248-D250 PolarHBondContact O-N 3.4Å; D250-G252 VanDerWaalsContact C-N 3.27Å; D250-G252 PolarHBondContact O-N 2.73Å; D250-T253 PolarHBondContact O-N 3.01Å; D250-T253 PolarHBondContact O-OG1 3.13Å
251S91.8Very high88.5Confident98 Ų9866 Ų6669%0.68536%0.364SS*.G310 helixtrans-69.2-25.2176.8-56.40000113.1M248 G249M248-S251 PolarHBondContact O-N 3.41Å; G249-S251 PolarHBondContact O-N 3.16Å; G249-S251 VanDerWaalsContact O-N 3.15Å
252G89.9Confident88.4Confident1 Ų165.9 Ų65.91%0.0137%0.365CS..THydrogen-bonded Turntrans-84.8-22.9177.600000113.6G249 D250 P254 L255 V256G249-G252 PolarHBondContact O-N 3.24Å; D250-G252 VanDerWaalsContact C-N 3.27Å; D250-G252 PolarHBondContact O-N 2.73Å; G252-P254 VanDerWaalsContact C-CD 3.46Å; G252-L255 PolarHBondContact O-N 2.62Å; G252-L255 VanDerWaalsContact O-N 3.14Å; G252-V256 WeakPolarHBondContact O-CG2 2.96Å; G252-V256 PolarHBondContact O-N 3.02Å; G252-V256 VanDerWaalsContact O-N 3.16Å
253T89.6Confident88Confident67 Ų6767.6 Ų67.641%0.41137%0.374SS..Hα-helixtrans-51.3-45-173.9-550000114.4G249 D250 L255 V256 S257G249-T253 PolarHBondContact O-N 3.41Å; G249-T253 PolarHBondContact O-OG1 2.74Å; D250-T253 PolarHBondContact O-N 3.01Å; D250-T253 PolarHBondContact O-OG1 3.13Å; T253-L255 VanDerWaalsContact C-N 3.3Å; T253-L255 PolarHBondContact O-N 3.04Å; T253-V256 PolarHBondContact O-N 3.22Å; T253-S257 PolarHBondContact O-N 3.05Å; T253-S257 PolarHBondContact O-OG 3.3Å; T253-S257 VanDerWaalsContact O-OG 3.12Å
254P95.4Very high87.7Confident92 Ų9270.3 Ų70.360%0.59739%0.385SS*.Hα-helixtrans-58.7-40.7-179.2-24.935.2000113.2G252 F258G252-P254 VanDerWaalsContact C-CD 3.46Å; P254-F258 PolarHBondContact O-N 3.38Å
255L94.1Very high87.4Confident69 Ų6969 Ų6936%0.36139%0.385SS..Hα-helixtrans-75.5-35.4-179.3-168.359.4000111.7M84 M241 L245 G252 T253 F258 C259M84-L255 HydrophobicContact CE-CD2 4.24Å; M84-L255 HydrophobicContact CE-CG 4.47Å; M241-L255 HydrophobicContact CE-CD2 4.05Å; L245-L255 HydrophobicContact CD1-CB 4.35Å; L245-L255 HydrophobicContact CD1-CD2 3.84Å; L245-L255 HydrophobicContact CD1-CG 4.06Å; L245-L255 HydrophobicContact CD2-CB 4.12Å; L245-L255 HydrophobicContact CD2-CD2 3.88Å; L245-L255 HydrophobicContact CD2-CG 4.43Å; L245-L255 HydrophobicContact CG-CD2 4.45Å; G252-L255 PolarHBondContact O-N 2.62Å; G252-L255 VanDerWaalsContact O-N 3.14Å; T253-L255 VanDerWaalsContact C-N 3.3Å; T253-L255 PolarHBondContact O-N 3.04Å; L255-F258 HydrophobicContact CD1-CD1 4.16Å; L255-F258 PolarHBondContact O-N 2.81Å; L255-C259 PolarHBondContact O-N 3.17Å; L255-C259 PolarHBondContact O-SG 3.02Å; L255-C259 VanDerWaalsContact O-SG 3.34Å
256V88.9Confident86.7Confident19 Ų1969.1 Ų69.112%0.11539%0.386CS..Hα-helixtrans-62.3-46.8173.6177.60000110.7A88 L245 G252 T253 F258 C259 Q260A88-V256 HydrophobicContact CB-CB 4.4Å; A88-V256 HydrophobicContact CB-CG1 4.06Å; A88-V256 HydrophobicContact CB-CG2 3.42Å; A88-V256 VanDerWaalsContact CB-CG2 3.42Å; L245-V256 HydrophobicContact CB-CG2 3.92Å; L245-V256 HydrophobicContact CD1-CG2 4.37Å; G252-V256 WeakPolarHBondContact O-CG2 2.96Å; G252-V256 PolarHBondContact O-N 3.02Å; G252-V256 VanDerWaalsContact O-N 3.16Å; T253-V256 PolarHBondContact O-N 3.22Å; V256-F258 VanDerWaalsContact C-N 3.34Å; V256-F258 PolarHBondContact O-N 3.4Å; V256-C259 PolarHBondContact O-N 3.14Å; V256-Q260 WeakPolarHBondContact O-CG 3.34Å; V256-Q260 PolarHBondContact O-N 3.39Å
257S90.1Very high85.9Confident50 Ų5071 Ų7135%0.3539%0.391SS..Hα-helixtrans-61.5-41.6176.5-62.20000111.8T253 C259 Q260 C261T253-S257 PolarHBondContact O-N 3.05Å; T253-S257 PolarHBondContact O-OG 3.3Å; T253-S257 VanDerWaalsContact O-OG 3.12Å; S257-C259 PolarHBondContact O-N 3.24Å; S257-Q260 PolarHBondContact O-N 3.27Å; S257-C261 PolarHBondContact O-N 3.18Å; S257-C261 PolarHBondContact O-SG 3.43Å; S257-C261 VanDerWaalsContact O-SG 3.33Å
258F94.9Very high85.4Confident124 Ų12470.1 Ų70.154%0.54439%0.392SS..Hα-helixtrans-58-48.4172.6171.5-95.6000111.8P254 L255 V256 Q260 C261 L262P254-F258 PolarHBondContact O-N 3.38Å; L255-F258 HydrophobicContact CD1-CD1 4.16Å; L255-F258 PolarHBondContact O-N 2.81Å; V256-F258 VanDerWaalsContact C-N 3.34Å; V256-F258 PolarHBondContact O-N 3.4Å; F258-Q260 VanDerWaalsContact C-N 3.31Å; F258-Q260 PolarHBondContact O-N 3.43Å; F258-C261 PolarHBondContact O-N 3.39Å; F258-L262 HydrophobicContact CE1-CD2 4.2Å; F258-L262 HydrophobicContact CZ-CD2 4.42Å; F258-L262 WeakPolarHBondContact O-CB 3.26Å; F258-L262 PolarHBondContact O-N 3.37Å
259C87.7Confident84.9Confident5 Ų569.5 Ų69.53%0.03439%0.389CS..Hα-helixtrans-61.5-38.2177.5-71.30000112.2S81 M84 L255 V256 S257 L262 N263S81-C259 WeakPolarHBondContact CB-O 3.26Å; M84-C259 HydrophobicContact CB-CB 4.42Å; L255-C259 PolarHBondContact O-N 3.17Å; L255-C259 PolarHBondContact O-SG 3.02Å; L255-C259 VanDerWaalsContact O-SG 3.34Å; V256-C259 PolarHBondContact O-N 3.14Å; S257-C259 PolarHBondContact O-N 3.24Å; C259-L262 PolarHBondContact O-N 3.21Å; C259-N263 WeakPolarHBondContact O-CB 3.5Å; C259-N263 PolarHBondContact O-N 2.98Å
260Q84.2Confident83.9Confident84 Ų8468.7 Ų68.739%0.39338%0.377SS..Hα-helixtrans-63.4-49.2175-72173.1-11.900111.6V256 S257 F258 L262 N263 E264V256-Q260 WeakPolarHBondContact O-CG 3.34Å; V256-Q260 PolarHBondContact O-N 3.39Å; S257-Q260 PolarHBondContact O-N 3.27Å; F258-Q260 VanDerWaalsContact C-N 3.31Å; F258-Q260 PolarHBondContact O-N 3.43Å; Q260-L262 VanDerWaalsContact C-N 3.31Å; Q260-L262 PolarHBondContact O-N 3.16Å; Q260-N263 PolarHBondContact O-N 3.35Å; Q260-E264 PolarHBondContact O-N 2.94Å
261C89.2Confident83Confident78 Ų7864.5 Ų64.553%0.52736%0.363SS..Hα-helixtrans-59.7-40.7176.8-69.70000112.2S257 F258 S265S257-C261 PolarHBondContact O-N 3.18Å; S257-C261 PolarHBondContact O-SG 3.43Å; S257-C261 VanDerWaalsContact O-SG 3.33Å; F258-C261 PolarHBondContact O-N 3.39Å; C261-S265 WeakPolarHBondContact O-CB 3.41Å; C261-S265 PolarHBondContact O-N 3.38Å; C261-S265 PolarHBondContact O-OG 3.12Å
262L87.4Confident82.2Confident58 Ų5864.9 Ų64.930%0.30436%0.361SS..Hα-helixtrans-64.1-47.2176.118059.5000111F258 C259 Q260 E264 S265 V266F258-L262 HydrophobicContact CE1-CD2 4.2Å; F258-L262 HydrophobicContact CZ-CD2 4.42Å; F258-L262 WeakPolarHBondContact O-CB 3.26Å; F258-L262 PolarHBondContact O-N 3.37Å; C259-L262 PolarHBondContact O-N 3.21Å; Q260-L262 VanDerWaalsContact C-N 3.31Å; Q260-L262 PolarHBondContact O-N 3.16Å; L262-E264 PolarHBondContact O-N 3.47Å; L262-S265 PolarHBondContact O-N 3.31Å; L262-V266 HydrophobicContact CD1-CG2 4.13Å; L262-V266 HydrophobicContact CG-CG2 4.44Å; L262-V266 VanDerWaalsContact O-CG2 3.25Å; L262-V266 WeakPolarHBondContact O-CG2 3.29Å; L262-V266 PolarHBondContact O-N 3.42Å
263N77.6Confident81.2Confident37 Ų3765.2 Ų65.220%0.19836%0.363CS..Hα-helixtrans-58-49177.5-175.235.4000111.3L78 S81 C259 Q260 S265 V266 M267L78-N263 WeakPolarHBondContact CD1-OD1 3.48Å; S81-N263 WeakPolarHBondContact OG-CA 3.44Å; S81-N263 WeakPolarHBondContact OG-CB 3.47Å; C259-N263 WeakPolarHBondContact O-CB 3.5Å; C259-N263 PolarHBondContact O-N 2.98Å; Q260-N263 PolarHBondContact O-N 3.35Å; N263-S265 VanDerWaalsContact C-N 3.32Å; N263-S265 PolarHBondContact O-N 2.96Å; N263-V266 PolarHBondContact O-N 2.93Å; N263-M267 WeakPolarHBondContact O-CB 3.5Å; N263-M267 WeakPolarHBondContact O-CG 3.24Å; N263-M267 PolarHBondContact O-N 2.97Å
264E76.9Confident80.1Confident127 Ų12763 Ų6359%0.59335%0.354SS*.Hα-helixtrans-60.6-39.5176.5-73.1-173.6-170.600112.9Q260 L262 M267 K268Q260-E264 PolarHBondContact O-N 2.94Å; L262-E264 PolarHBondContact O-N 3.47Å; E264-M267 PolarHBondContact O-N 3.22Å; E264-K268 PolarHBondContact O-N 3.49Å; E264-K268 VanDerWaalsContact O-N 3.16Å
265S81.8Confident79.2Confident64 Ų6467.1 Ų67.145%0.44836%0.358SS..Hα-helixtrans-65.2-45.5177.4-60.70000111.4C261 L262 N263 M267 K268 I269C261-S265 WeakPolarHBondContact O-CB 3.41Å; C261-S265 PolarHBondContact O-N 3.38Å; C261-S265 PolarHBondContact O-OG 3.12Å; L262-S265 PolarHBondContact O-N 3.31Å; N263-S265 VanDerWaalsContact C-N 3.32Å; N263-S265 PolarHBondContact O-N 2.96Å; S265-M267 VanDerWaalsContact C-N 3.3Å; S265-M267 PolarHBondContact O-N 3.4Å; S265-K268 WeakPolarHBondContact O-CB 3.38Å; S265-K268 PolarHBondContact O-N 3.33Å; S265-I269 PolarHBondContact O-N 3.2Å
266V75.3Confident78.4Confident7 Ų766.5 Ų66.54%0.04235%0.351CS..Hα-helixtrans-62.3-39.4176.4175.40000110.7L74 P77 L78 L262 N263 K268 I269 V270L74-V266 HydrophobicContact CD2-CG1 4.25Å; P77-V266 HydrophobicContact CB-CG2 3.91Å; P77-V266 HydrophobicContact CG-CG1 4.48Å; P77-V266 HydrophobicContact CG-CG2 4.19Å; L78-V266 HydrophobicContact CB-CG1 4.02Å; L78-V266 HydrophobicContact CD1-CG1 4.08Å; L262-V266 HydrophobicContact CD1-CG2 4.13Å; L262-V266 HydrophobicContact CG-CG2 4.44Å; L262-V266 VanDerWaalsContact O-CG2 3.25Å; L262-V266 WeakPolarHBondContact O-CG2 3.29Å; L262-V266 PolarHBondContact O-N 3.42Å; N263-V266 PolarHBondContact O-N 2.93Å; V266-K268 VanDerWaalsContact C-N 3.29Å; V266-K268 PolarHBondContact O-N 3.03Å; V266-I269 WeakPolarHBondContact O-CA 3.34Å; V266-I269 WeakPolarHBondContact O-CB 3.44Å; V266-I269 PolarHBondContact O-N 2.88Å; V266-V270 HydrophobicContact CG1-CG2 4.46Å; V266-V270 WeakPolarHBondContact O-CG2 3.34Å; V266-V270 PolarHBondContact O-N 2.68Å
267M65.9Low77.6Confident56 Ų5666.8 Ų66.828%0.27635%0.35SS..Hα-helixtrans-61.7-34.3176.1-72.5-68.9-65.400113L78 N263 E264 S265 V270 A271 I431L78-M267 HydrophobicContact CD1-CG 4.45Å; L78-M267 HydrophobicContact CD1-SD 4.1Å; N263-M267 WeakPolarHBondContact O-CB 3.5Å; N263-M267 WeakPolarHBondContact O-CG 3.24Å; N263-M267 PolarHBondContact O-N 2.97Å; E264-M267 PolarHBondContact O-N 3.22Å; S265-M267 VanDerWaalsContact C-N 3.3Å; S265-M267 PolarHBondContact O-N 3.4Å; M267-V270 WeakPolarHBondContact O-CB 3.41Å; M267-V270 PolarHBondContact O-N 3Å; M267-A271 PolarHBondContact O-N 3.4Å; M267-I431 HydrophobicContact CE-CG2 3.3Å; M267-I431 HydrophobicContact SD-CG2 3.57Å; M267-I431 VanDerWaalsContact SD-CG2 3.57Å
268K74.9Confident76.9Confident149 Ų14964.5 Ų64.565%0.64833%0.334SS*.Hα-helixtrans-66.3-39.3171.5-68.2175.4-175.3173.60111.7E264 S265 V266 A271 V272E264-K268 PolarHBondContact O-N 3.49Å; E264-K268 VanDerWaalsContact O-N 3.16Å; S265-K268 WeakPolarHBondContact O-CB 3.38Å; S265-K268 PolarHBondContact O-N 3.33Å; V266-K268 VanDerWaalsContact C-N 3.29Å; V266-K268 PolarHBondContact O-N 3.03Å; K268-A271 PolarHBondContact O-N 3.45Å; K268-V272 WeakPolarHBondContact O-CG2 2.99Å; K268-V272 PolarHBondContact O-N 3.48Å; K268-V272 VanDerWaalsContact O-N 3.14Å
269I76.3Confident76.5Confident87 Ų8763.7 Ų63.745%0.44633%0.331SS..Hα-helixtrans-64.3-43.1175.3-57.4170.1000110.4L74 S265 V266 A271 V272 A273L74-I269 HydrophobicContact CD2-CB 4.13Å; L74-I269 HydrophobicContact CD2-CG2 3.64Å; S265-I269 PolarHBondContact O-N 3.2Å; V266-I269 WeakPolarHBondContact O-CA 3.34Å; V266-I269 WeakPolarHBondContact O-CB 3.44Å; V266-I269 PolarHBondContact O-N 2.88Å; I269-A271 VanDerWaalsContact C-N 3.3Å; I269-A271 PolarHBondContact O-N 3.34Å; I269-V272 PolarHBondContact O-N 3.44Å; I269-A273 PolarHBondContact O-N 2.93Å
270V63.6Low76.1Confident22 Ų2263.4 Ų63.413%0.13333%0.329CS..Hα-helixtrans-55.7-45.3173.5170.50000110.8L74 V266 M267 V272 A273 G274 I431L74-V270 HydrophobicContact CD1-CG2 3.78Å; V266-V270 HydrophobicContact CG1-CG2 4.46Å; V266-V270 WeakPolarHBondContact O-CG2 3.34Å; V266-V270 PolarHBondContact O-N 2.68Å; M267-V270 WeakPolarHBondContact O-CB 3.41Å; M267-V270 PolarHBondContact O-N 3Å; V270-V272 VanDerWaalsContact C-N 3.32Å; V270-V272 PolarHBondContact O-N 2.71Å; V270-A273 PolarHBondContact O-N 2.92Å; V270-G274 PolarHBondContact O-N 2.89Å; V270-I431 HydrophobicContact CB-CD1 4.46Å; V270-I431 HydrophobicContact CG1-CB 4.34Å; V270-I431 HydrophobicContact CG1-CD1 3.62Å; V270-I431 HydrophobicContact CG1-CG2 4.33Å; V270-I431 HydrophobicContact CG2-CD1 3.98Å
271A66.8Low75.6Confident61 Ų6159.5 Ų59.550%0.50431%0.311SS..Hα-helixtrans-61.9-3917900000112.5M267 K268 I269 G274 W275M267-A271 PolarHBondContact O-N 3.4Å; K268-A271 PolarHBondContact O-N 3.45Å; I269-A271 VanDerWaalsContact C-N 3.3Å; I269-A271 PolarHBondContact O-N 3.34Å; A271-G274 PolarHBondContact O-N 3.1Å; A271-W275 VanDerWaalsContact O-CD1 3.28Å
272V76.5Confident75.4Confident106 Ų10656.5 Ų56.564%0.64229%0.29SS*.Hα-helixtrans-66.2-46.4174.2175.60000111K268 I269 V270 G274 W275K268-V272 WeakPolarHBondContact O-CG2 2.99Å; K268-V272 PolarHBondContact O-N 3.48Å; K268-V272 VanDerWaalsContact O-N 3.14Å; I269-V272 PolarHBondContact O-N 3.44Å; V270-V272 VanDerWaalsContact C-N 3.32Å; V270-V272 PolarHBondContact O-N 2.71Å; V272-G274 PolarHBondContact O-N 3.38Å; V272-W275 WeakPolarHBondContact O-CB 3.4Å; V272-W275 PolarHBondContact O-N 3.3Å
273A68.8Low75.3Confident7 Ų755.7 Ų55.76%0.05828%0.284CS..Hα-helixtrans-59.7-34175.200000112.2M70 L74 I269 V270 W275 Y276 F277M70-A273 HydrophobicContact CE-CB 3.74Å; L74-A273 HydrophobicContact CD1-CB 4.35Å; I269-A273 PolarHBondContact O-N 2.93Å; V270-A273 PolarHBondContact O-N 2.92Å; A273-W275 PolarHBondContact O-N 3.03Å; A273-Y276 WeakPolarHBondContact O-CB 3.3Å; A273-Y276 PolarHBondContact O-N 3.48Å; A273-F277 PolarHBondContact O-N 3.18Å
274G66.1Low75.1Confident21 Ų2154.4 Ų54.422%0.21628%0.277CS..Hα-helixtrans-58.7-25.9173.900000114L29 V270 A271 V272 F277L29-G274 WeakPolarHBondContact CD1-O 3.29Å; V270-G274 PolarHBondContact O-N 2.89Å; A271-G274 PolarHBondContact O-N 3.1Å; V272-G274 PolarHBondContact O-N 3.38Å; G274-F277 WeakPolarHBondContact O-CB 3.33Å; G274-F277 PolarHBondContact O-N 3.03Å
275W75.7Confident75.1Confident179 Ų17948.5 Ų48.568%0.67825%0.25SC*.Hα-helixtrans-76.1-27.8173.5-74.599.1000113.4L29 A271 V272 A273 F277 P278L29-W275 HydrophobicContact CD1-CE3 4.49Å; A271-W275 VanDerWaalsContact O-CD1 3.28Å; V272-W275 WeakPolarHBondContact O-CB 3.4Å; V272-W275 PolarHBondContact O-N 3.3Å; A273-W275 PolarHBondContact O-N 3.03Å; W275-F277 VanDerWaalsContact C-N 3.27Å; W275-P278 WeakPolarHBondContact O-CD 3.2Å
276Y79Confident75.2Confident55 Ų5545.5 Ų45.522%0.21623%0.229CC..Hα-helixtrans-74.4-23.7172.6-174.5-105.1000112P63 L67 M70 A273 F279 G280P63-Y276 WeakPolarHBondContact CA-OH 3.05Å; P63-Y276 PolarHBondContact O-OH 3Å; P63-Y276 VanDerWaalsContact O-OH 3.07Å; L67-Y276 HydrophobicContact CB-CD1 4.11Å; L67-Y276 HydrophobicContact CB-CE1 3.85Å; L67-Y276 HydrophobicContact CD1-CD1 4.02Å; M70-Y276 HydrophobicContact SD-CD1 3.87Å; M70-Y276 HydrophobicContact SD-CE1 4.27Å; M70-Y276 HydrophobicContact SD-CG 4.35Å; A273-Y276 WeakPolarHBondContact O-CB 3.3Å; A273-Y276 PolarHBondContact O-N 3.48Å; Y276-F279 HydrophobicContact CD2-CD1 4.14Å; Y276-F279 AromaticContact CE2-CD1 3.46Å; Y276-F279 HydrophobicContact CE2-CD1 3.46Å; Y276-F279 VanDerWaalsContact CE2-CD1 3.46Å; Y276-F279 AromaticContact CE2-CE1 3.95Å; Y276-F279 HydrophobicContact CE2-CE1 3.95Å; Y276-F279 AromaticContact CZ-CD1 3.78Å; Y276-F279 WeakPolarHBondContact O-CB 3.5Å; Y276-F279 PolarHBondContact O-N 3.22Å; Y276-G280 PolarHBondContact O-N 3.37Å
277F70.5Confident75.4Confident25 Ų2545.1 Ų45.111%0.1123%0.227CC..Hα-helixtrans-52-48.6-173.1178.5-112.6000115.1L67 A273 G274 W275 F279 G280 I281 Q433L67-F277 HydrophobicContact CD1-CB 4.47Å; L67-F277 HydrophobicContact CD1-CD2 4.04Å; L67-F277 HydrophobicContact CD2-CD2 3.79Å; L67-F277 HydrophobicContact CD2-CE2 4.19Å; L67-F277 HydrophobicContact CG-CD2 4.49Å; A273-F277 PolarHBondContact O-N 3.18Å; G274-F277 WeakPolarHBondContact O-CB 3.33Å; G274-F277 PolarHBondContact O-N 3.03Å; W275-F277 VanDerWaalsContact C-N 3.27Å; F277-F279 VanDerWaalsContact C-N 3.28Å; F277-F279 PolarHBondContact O-N 3.04Å; F277-G280 PolarHBondContact O-N 3.34Å; F277-I281 HydrophobicContact CD1-CD1 4.16Å; F277-I281 HydrophobicContact CD2-CD1 4.22Å; F277-I281 HydrophobicContact CD2-CG1 4.23Å; F277-I281 HydrophobicContact CE1-CD1 3.45Å; F277-I281 VanDerWaalsContact CE1-CD1 3.45Å; F277-I281 HydrophobicContact CE1-CG1 4.42Å; F277-I281 HydrophobicContact CE2-CD1 3.4Å; F277-I281 VanDerWaalsContact CE2-CD1 3.4Å; F277-I281 HydrophobicContact CE2-CG1 3.66Å; F277-I281 HydrophobicContact CZ-CD1 3.04Å; F277-I281 HydrophobicContact CZ-CG1 3.88Å; F277-I281 PolarHBondContact O-N 2.9Å; F277-Q433 HydrophobicContact CE2-CG 4.23Å; F277-Q433 HydrophobicContact CZ-CG 3.94Å; F277-Q433 VanDerWaalsContact CZ-OE1 3.28Å
278P76.3Confident75.6Confident2 Ų244.2 Ų44.21%0.01322%0.221CC..Hα-helixtrans-64.5-34.1179.1-2236.8000112.3L29 L32 S36 W275L29-P278 HydrophobicContact CD1-CG 3.85Å; L32-P278 HydrophobicContact CB-CB 4.15Å; L32-P278 HydrophobicContact CB-CG 4.17Å; L32-P278 HydrophobicContact CD2-CB 3.78Å; L32-P278 HydrophobicContact CD2-CG 3.77Å; L32-P278 HydrophobicContact CG-CB 3.55Å; L32-P278 HydrophobicContact CG-CG 3.91Å; S36-P278 WeakPolarHBondContact CB-O 3.18Å; S36-P278 VanDerWaalsContact OG-C 3.22Å; S36-P278 WeakPolarHBondContact OG-CA 3.48Å; S36-P278 WeakPolarHBondContact OG-CB 3.41Å; S36-P278 PolarHBondContact OG-O 3.01Å; W275-P278 WeakPolarHBondContact O-CD 3.2Å
279F85.3Confident75.8Confident107 Ų10737.9 Ų37.947%0.46919%0.194SC..Hα-helixtrans-68.3-49176.3178.8-101.3000111.1P63 Y276 F277 I281 V282 F283P63-F279 HydrophobicContact CB-CD1 4.41Å; P63-F279 HydrophobicContact CB-CE1 3.81Å; P63-F279 HydrophobicContact CG-CE1 4.39Å; Y276-F279 HydrophobicContact CD2-CD1 4.14Å; Y276-F279 AromaticContact CE2-CD1 3.46Å; Y276-F279 HydrophobicContact CE2-CD1 3.46Å; Y276-F279 VanDerWaalsContact CE2-CD1 3.46Å; Y276-F279 AromaticContact CE2-CE1 3.95Å; Y276-F279 HydrophobicContact CE2-CE1 3.95Å; Y276-F279 AromaticContact CZ-CD1 3.78Å; Y276-F279 WeakPolarHBondContact O-CB 3.5Å; Y276-F279 PolarHBondContact O-N 3.22Å; F277-F279 VanDerWaalsContact C-N 3.28Å; F277-F279 PolarHBondContact O-N 3.04Å; F279-I281 VanDerWaalsContact C-N 3.33Å; F279-I281 PolarHBondContact O-N 3.45Å; F279-V282 PolarHBondContact O-N 2.84Å; F279-F283 HydrophobicContact CD1-CE2 4.38Å; F279-F283 AromaticContact CD2-CE2 3.97Å; F279-F283 HydrophobicContact CD2-CE2 3.97Å; F279-F283 HydrophobicContact CE1-CD2 4.38Å; F279-F283 AromaticContact CE1-CE2 3.96Å; F279-F283 HydrophobicContact CE1-CE2 3.96Å; F279-F283 AromaticContact CE2-CE2 3.49Å; F279-F283 HydrophobicContact CE2-CE2 3.49Å; F279-F283 VanDerWaalsContact CE2-CE2 3.49Å; F279-F283 HydrophobicContact CE2-CZ 4.09Å; F279-F283 HydrophobicContact CG-CE2 4.4Å; F279-F283 HydrophobicContact CZ-CD2 4.33Å; F279-F283 AromaticContact CZ-CE2 3.48Å; F279-F283 HydrophobicContact CZ-CE2 3.48Å; F279-F283 VanDerWaalsContact CZ-CE2 3.48Å; F279-F283 HydrophobicContact CZ-CZ 4.05Å; F279-F283 WeakPolarHBondContact O-CD2 3.37Å
280G79.3Confident76Confident0 Ų034.7 Ų34.70%018%0.178CC..Hα-helixtrans-61.4-36.7179.500000113.8G64 Y276 F277 V282 F283 L284G64-G280 WeakPolarHBondContact CA-O 3.49Å; Y276-G280 PolarHBondContact O-N 3.37Å; F277-G280 PolarHBondContact O-N 3.34Å; G280-V282 VanDerWaalsContact C-N 3.31Å; G280-V282 PolarHBondContact O-N 3.28Å; G280-F283 PolarHBondContact O-N 3.05Å; G280-L284 WeakPolarHBondContact O-CB 3.49Å; G280-L284 PolarHBondContact O-N 3.33Å
281I74.9Confident76.6Confident1 Ų138 Ų381%0.00519%0.192CC..Hα-helixtrans-57.9-40.8177-85.6-172.1000112.7V37 L67 F277 F279 F283 L284 I285 W461V37-I281 HydrophobicContact CG2-CG2 3.8Å; L67-I281 HydrophobicContact CD2-CG1 4.44Å; F277-I281 HydrophobicContact CD1-CD1 4.16Å; F277-I281 HydrophobicContact CD2-CD1 4.22Å; F277-I281 HydrophobicContact CD2-CG1 4.23Å; F277-I281 HydrophobicContact CE1-CD1 3.45Å; F277-I281 VanDerWaalsContact CE1-CD1 3.45Å; F277-I281 HydrophobicContact CE1-CG1 4.42Å; F277-I281 HydrophobicContact CE2-CD1 3.4Å; F277-I281 VanDerWaalsContact CE2-CD1 3.4Å; F277-I281 HydrophobicContact CE2-CG1 3.66Å; F277-I281 HydrophobicContact CZ-CD1 3.04Å; F277-I281 HydrophobicContact CZ-CG1 3.88Å; F277-I281 PolarHBondContact O-N 2.9Å; F279-I281 VanDerWaalsContact C-N 3.33Å; F279-I281 PolarHBondContact O-N 3.45Å; I281-F283 VanDerWaalsContact C-N 3.31Å; I281-F283 PolarHBondContact O-N 2.96Å; I281-L284 PolarHBondContact O-N 3.37Å; I281-I285 HydrophobicContact CG2-CD1 3.64Å; I281-I285 HydrophobicContact CG2-CG1 4.21Å; I281-I285 WeakPolarHBondContact O-CB 3.46Å; I281-I285 WeakPolarHBondContact O-CG1 3.29Å; I281-I285 PolarHBondContact O-N 2.93Å; I281-W461 HydrophobicContact CD1-CB 4.42Å
282V83.7Confident76.8Confident16 Ų1636.6 Ų36.610%0.09718%0.175CC..Hα-helixtrans-56-50.8-177.4173.40000109.8S36 V39 G40 L43 F279 G280 A286S36-V282 WeakPolarHBondContact O-CG2 3.48Å; V39-V282 HydrophobicContact CG1-CG1 4.08Å; V39-V282 HydrophobicContact CG1-CG2 4.46Å; G40-V282 WeakPolarHBondContact CA-O 3.1Å; L43-V282 HydrophobicContact CD2-CG1 4.1Å; F279-V282 PolarHBondContact O-N 2.84Å; G280-V282 VanDerWaalsContact C-N 3.31Å; G280-V282 PolarHBondContact O-N 3.28Å; V282-A286 WeakPolarHBondContact O-CB 3.36Å; V282-A286 PolarHBondContact O-N 2.84Å
283F86.1Confident76.5Confident41 Ų4139.1 Ų39.118%0.1819%0.185CC..Hα-helixtrans-74.7-34.2-177.3-63-85.2000112.6F60 P63 F279 G280 I281 G287F60-F283 HydrophobicContact CD2-CD1 4.26Å; F60-F283 HydrophobicContact CD2-CE1 4.45Å; F60-F283 HydrophobicContact CE1-CD1 4.3Å; F60-F283 AromaticContact CE2-CD1 3.82Å; F60-F283 HydrophobicContact CE2-CD1 3.82Å; F60-F283 AromaticContact CE2-CE1 3.91Å; F60-F283 HydrophobicContact CE2-CE1 3.91Å; F60-F283 AromaticContact CZ-CD1 3.83Å; F60-F283 HydrophobicContact CZ-CD1 3.83Å; F60-F283 HydrophobicContact CZ-CE1 4.28Å; F60-F283 WeakPolarHBondContact O-CD1 3.48Å; P63-F283 HydrophobicContact CB-CB 4.08Å; P63-F283 HydrophobicContact CB-CD2 3.65Å; P63-F283 HydrophobicContact CB-CE2 4.26Å; P63-F283 HydrophobicContact CB-CG 3.84Å; P63-F283 HydrophobicContact CG-CB 4.35Å; P63-F283 HydrophobicContact CG-CD1 4.1Å; P63-F283 HydrophobicContact CG-CD2 3.97Å; P63-F283 HydrophobicContact CG-CE1 4.41Å; P63-F283 HydrophobicContact CG-CE2 4.31Å; P63-F283 HydrophobicContact CG-CG 3.86Å; F279-F283 HydrophobicContact CD1-CE2 4.38Å; F279-F283 AromaticContact CD2-CE2 3.97Å; F279-F283 HydrophobicContact CD2-CE2 3.97Å; F279-F283 HydrophobicContact CE1-CD2 4.38Å; F279-F283 AromaticContact CE1-CE2 3.96Å; F279-F283 HydrophobicContact CE1-CE2 3.96Å; F279-F283 AromaticContact CE2-CE2 3.49Å; F279-F283 HydrophobicContact CE2-CE2 3.49Å; F279-F283 VanDerWaalsContact CE2-CE2 3.49Å; F279-F283 HydrophobicContact CE2-CZ 4.09Å; F279-F283 HydrophobicContact CG-CE2 4.4Å; F279-F283 HydrophobicContact CZ-CD2 4.33Å; F279-F283 AromaticContact CZ-CE2 3.48Å; F279-F283 HydrophobicContact CZ-CE2 3.48Å; F279-F283 VanDerWaalsContact CZ-CE2 3.48Å; F279-F283 HydrophobicContact CZ-CZ 4.05Å; F279-F283 WeakPolarHBondContact O-CD2 3.37Å; G280-F283 PolarHBondContact O-N 3.05Å; I281-F283 VanDerWaalsContact C-N 3.31Å; I281-F283 PolarHBondContact O-N 2.96Å; F283-G287 WeakPolarHBondContact O-CA 3.24Å; F283-G287 PolarHBondContact O-N 3.48Å
284L74.2Confident76.8Confident10 Ų1042.5 Ų42.55%0.05220%0.202CC..Hα-helixtrans-64-49.7176.4-166.3155.7000110.8M68 G280 I281 K288 I457M68-L284 HydrophobicContact CG-CD1 3.72Å; M68-L284 HydrophobicContact SD-CD1 3.78Å; G280-L284 WeakPolarHBondContact O-CB 3.49Å; G280-L284 PolarHBondContact O-N 3.33Å; I281-L284 PolarHBondContact O-N 3.37Å; L284-K288 HydrophobicContact CD2-CG 4.46Å; L284-K288 VanDerWaalsContact O-CG 3.28Å; L284-K288 WeakPolarHBondContact O-CG 3.35Å; L284-K288 PolarHBondContact O-N 3.45Å; L284-I457 HydrophobicContact CD1-CD1 3.97Å; L284-I457 HydrophobicContact CD1-CG2 4.06Å; L284-I457 HydrophobicContact CD2-CB 3.81Å; L284-I457 HydrophobicContact CD2-CD1 4.11Å; L284-I457 HydrophobicContact CD2-CG2 3.52Å; L284-I457 HydrophobicContact CG-CG2 4.43Å
285I77.1Confident77Confident3 Ų342.6 Ų42.62%0.01520%0.199CC..Hα-helixtrans-66.7-50.7178.7-66.6-178.7000110.8V37 I281 G287 K288 I289 A458V37-I285 HydrophobicContact CB-CD1 4.15Å; V37-I285 HydrophobicContact CG1-CD1 3.96Å; V37-I285 HydrophobicContact CG2-CD1 3.86Å; I281-I285 HydrophobicContact CG2-CD1 3.64Å; I281-I285 HydrophobicContact CG2-CG1 4.21Å; I281-I285 WeakPolarHBondContact O-CB 3.46Å; I281-I285 WeakPolarHBondContact O-CG1 3.29Å; I281-I285 PolarHBondContact O-N 2.93Å; I285-G287 VanDerWaalsContact C-N 3.29Å; I285-G287 PolarHBondContact O-N 3.28Å; I285-K288 PolarHBondContact O-N 3.43Å; I285-I289 HydrophobicContact CG2-CD1 3.9Å; I285-I289 WeakPolarHBondContact O-CG1 3.26Å; I285-I289 PolarHBondContact O-N 3.49Å; I285-A458 HydrophobicContact CD1-CB 4.12Å; I285-A458 HydrophobicContact CG1-CB 3.89Å; I285-A458 HydrophobicContact CG2-CB 4.47Å
286A84Confident77.1Confident0 Ų042.6 Ų42.60%020%0.204CC..Hα-helixtrans-59.1-44-179.200000111.2G40 L43 F60 V282 I289 L290G40-A286 WeakPolarHBondContact O-CA 3.4Å; G40-A286 VanDerWaalsContact O-CB 3.31Å; G40-A286 WeakPolarHBondContact O-CB 3.47Å; L43-A286 HydrophobicContact CB-CB 4.34Å; L43-A286 HydrophobicContact CD2-CB 4.48Å; L43-A286 HydrophobicContact CG-CB 4.39Å; F60-A286 HydrophobicContact CE1-CB 3.59Å; F60-A286 HydrophobicContact CZ-CB 3.83Å; V282-A286 WeakPolarHBondContact O-CB 3.36Å; V282-A286 PolarHBondContact O-N 2.84Å; A286-I289 PolarHBondContact O-N 3.09Å; A286-L290 WeakPolarHBondContact O-CG 3.48Å; A286-L290 PolarHBondContact O-N 2.79Å
287G77.9Confident76.9Confident0 Ų041.3 Ų41.30%021%0.205CC..Hα-helixtrans-62.2-42.2177.400000113.8Q61 F283 I285 L290 E291Q61-G287 VanDerWaalsContact CG-CA 3.49Å; Q61-G287 PolarHBondContact NE2-O 3.13Å; F283-G287 WeakPolarHBondContact O-CA 3.24Å; F283-G287 PolarHBondContact O-N 3.48Å; I285-G287 VanDerWaalsContact C-N 3.29Å; I285-G287 PolarHBondContact O-N 3.28Å; G287-L290 WeakPolarHBondContact O-CB 3.49Å; G287-L290 PolarHBondContact O-N 3.05Å; G287-L290 VanDerWaalsContact O-N 3.15Å; G287-E291 PolarHBondContact O-N 2.48Å
288K71.4Confident77.2Confident36 Ų3641.9 Ų41.916%0.15721%0.21CC..Hα-helixtrans-67.1-38.2176.5-69.6-69.4147.3-171.80111.9L284 I285 L290 E291 M292 N454L284-K288 HydrophobicContact CD2-CG 4.46Å; L284-K288 VanDerWaalsContact O-CG 3.28Å; L284-K288 WeakPolarHBondContact O-CG 3.35Å; L284-K288 PolarHBondContact O-N 3.45Å; I285-K288 PolarHBondContact O-N 3.43Å; K288-L290 PolarHBondContact O-N 3.09Å; K288-E291 WeakPolarHBondContact CD-OE2 3.38Å; K288-E291 WeakPolarHBondContact CE-OE2 3.47Å; K288-E291 IonicContact NZ-OE1 2.81Å; K288-E291 IonicContact NZ-OE2 2.86Å; K288-E291 PolarHBondContact NZ-OE2 2.99Å; K288-E291 PolarHBondContact O-N 2.85Å; K288-E291 VanDerWaalsContact O-N 3.11Å; K288-M292 WeakPolarHBondContact O-CG 3.43Å; K288-M292 PolarHBondContact O-N 3.49Å; K288-M292 VanDerWaalsContact O-SD 3.39Å; K288-N454 HydrophobicContact CD-CB 3.6Å; K288-N454 VanDerWaalsContact CE-CB 3.41Å; K288-N454 HydrophobicContact CG-CB 4.17Å
289I78.5Confident77.3Confident16 Ų1643.7 Ų43.78%0.08223%0.229CC..Hα-helixtrans-59.1-30.3173.1-67.5168.4000111.9C41 F45 R48 I285 A286 M292C41-I289 HydrophobicContact CB-CD1 4.42Å; F45-I289 HydrophobicContact CD1-CG2 4.23Å; F45-I289 HydrophobicContact CD2-CD1 4.48Å; F45-I289 HydrophobicContact CE1-CG2 4.35Å; F45-I289 HydrophobicContact CE2-CD1 4.31Å; F45-I289 HydrophobicContact CG-CG2 4.43Å; R48-I289 PolarHBondContact NH1-O 3.29Å; I285-I289 HydrophobicContact CG2-CD1 3.9Å; I285-I289 WeakPolarHBondContact O-CG1 3.26Å; I285-I289 PolarHBondContact O-N 3.49Å; A286-I289 PolarHBondContact O-N 3.09Å; I289-M292 HydrophobicContact CG1-SD 4.45Å
290L81.3Confident77.2Confident20 Ų2043.6 Ų43.611%0.10523%0.228CC..Hα-helixtrans-74.2-34.5176.3-67.2170.9000113.4L47 R48 L52 I57 F60 A286 G287 K288L47-L290 HydrophobicContact CB-CD1 4.08Å; L47-L290 HydrophobicContact CB-CD2 3.74Å; L47-L290 HydrophobicContact CB-CG 4.39Å; L47-L290 HydrophobicContact CD1-CD1 4.25Å; R48-L290 HydrophobicContact CB-CD2 4.02Å; R48-L290 VanDerWaalsContact N-CD2 3.3Å; L52-L290 HydrophobicContact CD1-CD1 4Å; L52-L290 HydrophobicContact CD1-CD2 4.33Å; I57-L290 HydrophobicContact CD1-CB 4.26Å; I57-L290 HydrophobicContact CG1-CB 4.28Å; I57-L290 HydrophobicContact CG1-CD1 4.4Å; I57-L290 HydrophobicContact CG2-CB 4.2Å; F60-L290 HydrophobicContact CD1-CD1 3.97Å; F60-L290 HydrophobicContact CE1-CD1 4.2Å; A286-L290 WeakPolarHBondContact O-CG 3.48Å; A286-L290 PolarHBondContact O-N 2.79Å; G287-L290 WeakPolarHBondContact O-CB 3.49Å; G287-L290 PolarHBondContact O-N 3.05Å; G287-L290 VanDerWaalsContact O-N 3.15Å; K288-L290 PolarHBondContact O-N 3.09Å
291E74.9Confident77.4Confident92 Ų9245 Ų4543%0.4323%0.234SC..Hα-helixtrans-75.7-25178.9-73.5177.3179.500113.9I57 Q61 G287 K288I57-E291 HydrophobicContact CG2-CG 4.25Å; Q61-E291 PolarHBondContact NE2-OE1 3.3Å; Q61-E291 PolarHBondContact OE1-OE1 2.97Å; Q61-E291 VanDerWaalsContact OE1-OE1 3.09Å; G287-E291 PolarHBondContact O-N 2.48Å; K288-E291 WeakPolarHBondContact CD-OE2 3.38Å; K288-E291 WeakPolarHBondContact CE-OE2 3.47Å; K288-E291 IonicContact NZ-OE1 2.81Å; K288-E291 IonicContact NZ-OE2 2.86Å; K288-E291 PolarHBondContact NZ-OE2 2.99Å; K288-E291 PolarHBondContact O-N 2.85Å; K288-E291 VanDerWaalsContact O-N 3.11Å
292M71.7Confident77.9Confident32 Ų3245.8 Ų45.816%0.15824%0.239CC..  trans-70.8136.1-175.2-65.6157.3113.800111.2R48 K288 I289 V298 L455R48-M292 PolarHBondContact NH1-O 3.37Å; R48-M292 PolarHBondContact NH2-O 3.5Å; K288-M292 WeakPolarHBondContact O-CG 3.43Å; K288-M292 PolarHBondContact O-N 3.49Å; K288-M292 VanDerWaalsContact O-SD 3.39Å; I289-M292 HydrophobicContact CG1-SD 4.45Å; M292-V298 HydrophobicContact CE-CB 3.3Å; M292-V298 HydrophobicContact CE-CG1 3.01Å; M292-V298 HydrophobicContact CE-CG2 3.97Å; M292-L455 HydrophobicContact CE-CD2 4.45Å
293D69.7Low78.1Confident158 Ų15846.8 Ų46.885%0.84525%0.252SS*.SBendtrans-75.9-38.5176.1-65-51.7000113.1R48R48-D293 VanDerWaalsContact NH2-C 3.34Å; R48-D293 PolarHBondContact NH2-O 2.89Å
294D74.8Confident78.3Confident78 Ų7848.9 Ų48.942%0.41726%0.261SS..  trans-128.698.1174.8-176.95.2000112.6K296 A297 V298D294-K296 PolarHBondContact O-N 3.06Å; D294-K296 WeakPolarHBondContact OD1-CB 3.36Å; D294-K296 PolarHBondContact OD1-N 3.13Å; D294-A297 HydrophobicContact CB-CB 4.12Å; D294-A297 PolarHBondContact O-N 2.72Å; D294-A297 PolarHBondContact OD1-N 3.07Å; D294-A297 WeakPolarHBondContact OD2-CB 3.38Å; D294-A297 PolarHBondContact OD2-N 3.32Å; D294-V298 WeakPolarHBondContact O-CG2 3.34Å; D294-V298 PolarHBondContact O-N 3.17Å; D294-V298 VanDerWaalsContact O-N 3.14Å
295P71.4Confident79.2Confident23 Ų2348.4 Ų48.415%0.14926%0.259CS..Hα-helixtrans-61.6-27.7178.2-24.234000114.2F45 R48 G299F45-P295 HydrophobicContact CE1-CB 3.68Å; F45-P295 HydrophobicContact CE1-CG 4.29Å; F45-P295 HydrophobicContact CZ-CB 4.21Å; R48-P295 VanDerWaalsContact CZ-CG 3.45Å; P295-G299 WeakPolarHBondContact O-CA 3.36Å; P295-G299 PolarHBondContact O-N 3.08Å
296K77.1Confident79.9Confident180 Ų18049.1 Ų49.178%0.78327%0.265SS*.Hα-helixtrans-74.5-47.5-178.7-68.4-177.1-179.1178.50110.5D294 G299 K300D294-K296 PolarHBondContact O-N 3.06Å; D294-K296 WeakPolarHBondContact OD1-CB 3.36Å; D294-K296 PolarHBondContact OD1-N 3.13Å; K296-G299 PolarHBondContact O-N 3.31Å; K296-K300 PolarHBondContact O-N 2.92Å
297A75.3Confident80.4Confident28 Ų2852.9 Ų52.923%0.23129%0.288CS..Hα-helixtrans-62.1-45.4176.900000111.6D294 K300 K301D294-A297 HydrophobicContact CB-CB 4.12Å; D294-A297 PolarHBondContact O-N 2.72Å; D294-A297 PolarHBondContact OD1-N 3.07Å; D294-A297 WeakPolarHBondContact OD2-CB 3.38Å; D294-A297 PolarHBondContact OD2-N 3.32Å; A297-K300 WeakPolarHBondContact O-CB 3.41Å; A297-K300 PolarHBondContact O-N 3.33Å; A297-K301 WeakPolarHBondContact O-CG 3.5Å; A297-K301 PolarHBondContact O-N 3Å
298V76.6Confident81.2Confident36 Ų3652.9 Ų52.922%0.21829%0.288CS..Hα-helixtrans-72.3-37.2-179.8-172.10000111.9M292 D294 K300 K301 L302M292-V298 HydrophobicContact CE-CB 3.3Å; M292-V298 HydrophobicContact CE-CG1 3.01Å; M292-V298 HydrophobicContact CE-CG2 3.97Å; D294-V298 WeakPolarHBondContact O-CG2 3.34Å; D294-V298 PolarHBondContact O-N 3.17Å; D294-V298 VanDerWaalsContact O-N 3.14Å; V298-K300 VanDerWaalsContact C-N 3.25Å; V298-K300 PolarHBondContact O-N 3.23Å; V298-K301 PolarHBondContact O-N 3.29Å; V298-L302 WeakPolarHBondContact O-CB 3.48Å; V298-L302 PolarHBondContact O-N 2.96Å
299G78.9Confident82.4Confident40 Ų4051.2 Ų51.241%0.41228%0.28SS..Hα-helixtrans-57.8-39.1172.100000112.3P295 K296 G303P295-G299 WeakPolarHBondContact O-CA 3.36Å; P295-G299 PolarHBondContact O-N 3.08Å; K296-G299 PolarHBondContact O-N 3.31Å; G299-G303 PolarHBondContact O-N 3.18Å
300K83.2Confident83.2Confident106 Ų10652.6 Ų52.646%0.46129%0.289SS..Hα-helixtrans-63.3-50.9172.7-172.9-172.9179-161.60111.5A129 K296 A297 V298 L302 G303 F304A129-K300 PolarHBondContact O-NZ 2.8Å; K296-K300 PolarHBondContact O-N 2.92Å; A297-K300 WeakPolarHBondContact O-CB 3.41Å; A297-K300 PolarHBondContact O-N 3.33Å; V298-K300 VanDerWaalsContact C-N 3.25Å; V298-K300 PolarHBondContact O-N 3.23Å; K300-L302 VanDerWaalsContact C-N 3.29Å; K300-L302 PolarHBondContact O-N 3.2Å; K300-G303 PolarHBondContact O-N 3.2Å; K300-F304 HydrophobicContact CD-CE2 4.47Å; K300-F304 HydrophobicContact CG-CD2 3.96Å; K300-F304 HydrophobicContact CG-CE2 3.92Å; K300-F304 WeakPolarHBondContact O-CD2 3.46Å; K300-F304 PolarHBondContact O-N 3.41Å
301K83.6Confident83.9Confident28 Ų2854 Ų5412%0.12230%0.301CS..Hα-helixtrans-54.9-46.7177.3-70.5179.3175.8-1710111.2G127 A130 A297 V298 F304 Y305 F400 V404G127-K301 WeakPolarHBondContact O-CE 3.49Å; A130-K301 HydrophobicContact CB-CD 4.16Å; A130-K301 HydrophobicContact CB-CG 3.63Å; A297-K301 WeakPolarHBondContact O-CG 3.5Å; A297-K301 PolarHBondContact O-N 3Å; V298-K301 PolarHBondContact O-N 3.29Å; K301-F304 PolarHBondContact O-N 2.86Å; K301-Y305 WeakPolarHBondContact O-CB 3.29Å; K301-Y305 PolarHBondContact O-N 2.83Å; K301-F400 HydrophobicContact CB-CE2 4.16Å; K301-F400 HydrophobicContact CB-CZ 4.23Å; K301-V404 HydrophobicContact CD-CG2 4.26Å
302L84.7Confident85Confident19 Ų1949.6 Ų49.610%0.09928%0.28CS..Hα-helixtrans-68.6-34.9-179-168.464.2000112.6V298 K300 Y305 A306 L455 I456 A458 V459V298-L302 WeakPolarHBondContact O-CB 3.48Å; V298-L302 PolarHBondContact O-N 2.96Å; K300-L302 VanDerWaalsContact C-N 3.29Å; K300-L302 PolarHBondContact O-N 3.2Å; L302-Y305 HydrophobicContact CD1-CD1 3.87Å; L302-Y305 HydrophobicContact CD1-CE1 4.47Å; L302-Y305 WeakPolarHBondContact O-CB 3.29Å; L302-Y305 PolarHBondContact O-N 3.36Å; L302-A306 WeakPolarHBondContact O-CB 3.38Å; L302-A306 PolarHBondContact O-N 3.48Å; L302-L455 WeakPolarHBondContact CD1-O 3.47Å; L302-I456 HydrophobicContact CD1-CG2 4.19Å; L302-A458 HydrophobicContact CD2-CB 4.45Å; L302-V459 HydrophobicContact CD1-CB 4.48Å; L302-V459 HydrophobicContact CD1-CG2 4.34Å; L302-V459 HydrophobicContact CD2-CB 4.37Å; L302-V459 HydrophobicContact CD2-CG2 3.46Å; L302-V459 VanDerWaalsContact CD2-CG2 3.46Å; L302-V459 HydrophobicContact CG-CB 4.29Å; L302-V459 HydrophobicContact CG-CG2 3.66Å
303G87.6Confident86.2Confident36 Ų3648.3 Ų48.337%0.37127%0.274SS..Hα-helixtrans-63.5-47.6172.200000112.6G299 K300 Y305 A306 V307G299-G303 PolarHBondContact O-N 3.18Å; K300-G303 PolarHBondContact O-N 3.2Å; G303-Y305 VanDerWaalsContact C-N 3.31Å; G303-Y305 PolarHBondContact O-N 3.34Å; G303-A306 PolarHBondContact O-N 3.02Å; G303-V307 WeakPolarHBondContact O-CG2 3.47Å; G303-V307 PolarHBondContact O-N 3.34Å
304F90.3Very high87.5Confident86 Ų8644.1 Ų44.138%0.37725%0.254SS..Hα-helixtrans-62.9-38.4175.3-87.1-81.3000112.2I124 P126 A129 K300 K301 V307 T308I124-F304 HydrophobicContact CG2-CD1 4.17Å; P126-F304 HydrophobicContact CB-CB 3.81Å; A129-F304 HydrophobicContact CB-CD2 4.37Å; K300-F304 HydrophobicContact CD-CE2 4.47Å; K300-F304 HydrophobicContact CG-CD2 3.96Å; K300-F304 HydrophobicContact CG-CE2 3.92Å; K300-F304 WeakPolarHBondContact O-CD2 3.46Å; K300-F304 PolarHBondContact O-N 3.41Å; K301-F304 PolarHBondContact O-N 2.86Å; F304-V307 PolarHBondContact O-N 2.84Å; F304-T308 WeakPolarHBondContact O-CB 3.44Å; F304-T308 PolarHBondContact O-N 3.38Å; F304-T308 PolarHBondContact O-OG1 3.45Å
305Y92.8Very high88.6Confident0 Ų042.5 Ų42.50%025%0.246CC..Hα-helixtrans-58-49.7171.7163-103.2000111.7K301 L302 G303 V307 T308 V309 Y393 V396 A397 F400 I456 L463K301-Y305 WeakPolarHBondContact O-CB 3.29Å; K301-Y305 PolarHBondContact O-N 2.83Å; L302-Y305 HydrophobicContact CD1-CD1 3.87Å; L302-Y305 HydrophobicContact CD1-CE1 4.47Å; L302-Y305 WeakPolarHBondContact O-CB 3.29Å; L302-Y305 PolarHBondContact O-N 3.36Å; G303-Y305 VanDerWaalsContact C-N 3.31Å; G303-Y305 PolarHBondContact O-N 3.34Å; Y305-V307 VanDerWaalsContact C-N 3.34Å; Y305-V307 PolarHBondContact O-N 3.49Å; Y305-T308 WeakPolarHBondContact O-CB 3.21Å; Y305-T308 PolarHBondContact O-N 3.46Å; Y305-T308 VanDerWaalsContact O-N 3.11Å; Y305-V309 HydrophobicContact CD2-CG2 4.21Å; Y305-V309 HydrophobicContact CE1-CG2 4.44Å; Y305-V309 HydrophobicContact CE2-CG2 3.68Å; Y305-V309 PolarHBondContact O-N 2.63Å; Y305-Y393 WeakPolarHBondContact OH-CD2 3.27Å; Y305-Y393 WeakPolarHBondContact OH-CE2 3.44Å; Y305-V396 HydrophobicContact CD2-CG1 4.11Å; Y305-V396 HydrophobicContact CE2-CG1 3.95Å; Y305-A397 HydrophobicContact CE2-CB 3.61Å; Y305-A397 WeakPolarHBondContact OH-CB 3.31Å; Y305-F400 HydrophobicContact CD2-CB 3.82Å; Y305-F400 AromaticContact CD2-CD1 3.64Å; Y305-F400 HydrophobicContact CD2-CD1 3.64Å; Y305-F400 HydrophobicContact CD2-CD2 4.27Å; Y305-F400 HydrophobicContact CD2-CE1 4.25Å; Y305-F400 AromaticContact CD2-CG 3.64Å; Y305-F400 HydrophobicContact CD2-CG 3.64Å; Y305-F400 HydrophobicContact CE2-CB 4.32Å; Y305-F400 HydrophobicContact CE2-CD1 4.18Å; Y305-F400 HydrophobicContact CE2-CG 4.4Å; Y305-F400 AromaticContact CG-CD1 3.89Å; Y305-F400 HydrophobicContact CG-CD1 3.89Å; Y305-F400 HydrophobicContact CG-CD2 4.44Å; Y305-F400 HydrophobicContact CG-CE1 4.02Å; Y305-F400 HydrophobicContact CG-CG 4.1Å; Y305-F400 HydrophobicContact CG-CZ 4.33Å; Y305-I456 HydrophobicContact CD1-CG2 4.24Å; Y305-I456 HydrophobicContact CE1-CB 4.06Å; Y305-I456 HydrophobicContact CE1-CG2 3.79Å; Y305-L463 HydrophobicContact CD1-CD1 4.4Å; Y305-L463 HydrophobicContact CE1-CD1 3.69Å
306A92.2Very high89.8Confident18 Ų1841.4 Ų41.415%0.14924%0.239CC..Hα-helixtrans-60.2-43.8179.100000112.2L302 G303 T308 V309 V310 V459 L463L302-A306 WeakPolarHBondContact O-CB 3.38Å; L302-A306 PolarHBondContact O-N 3.48Å; G303-A306 PolarHBondContact O-N 3.02Å; A306-T308 VanDerWaalsContact C-N 3.34Å; A306-T308 PolarHBondContact O-N 3.38Å; A306-V309 PolarHBondContact O-N 2.98Å; A306-V310 WeakPolarHBondContact O-CG2 2.83Å; A306-V310 PolarHBondContact O-N 2.82Å; A306-V459 HydrophobicContact CB-CG1 3.67Å; A306-L463 HydrophobicContact CB-CD2 4.23Å
307V93.9Very high90.7Very high79 Ų7932.8 Ų32.848%0.47920%0.202SC..Hα-helixtrans-60-44.5174.1171.10000110.9G303 F304 Y305 V309 V310 C311G303-V307 WeakPolarHBondContact O-CG2 3.47Å; G303-V307 PolarHBondContact O-N 3.34Å; F304-V307 PolarHBondContact O-N 2.84Å; Y305-V307 VanDerWaalsContact C-N 3.34Å; Y305-V307 PolarHBondContact O-N 3.49Å; V307-V309 PolarHBondContact O-N 3.33Å; V307-V310 PolarHBondContact O-N 2.92Å; V307-C311 VanDerWaalsContact O-CB 3.26Å; V307-C311 WeakPolarHBondContact O-CB 3.33Å; V307-C311 PolarHBondContact O-N 3.13Å; V307-C311 PolarHBondContact O-SG 3.47Å
308T95.8Very high91.6Very high0 Ų036.2 Ų36.20%022%0.216CC..Hα-helixtrans-58-48.2178.4-56.50000111.4M120 V121 I124 F304 Y305 A306 G312 V396M120-T308 HydrophobicContact CB-CG2 4.25Å; M120-T308 HydrophobicContact CG-CG2 3.88Å; V121-T308 HydrophobicContact CB-CG2 3.98Å; V121-T308 HydrophobicContact CG2-CG2 4.38Å; I124-T308 HydrophobicContact CD1-CG2 4.18Å; I124-T308 WeakPolarHBondContact CG2-OG1 3.38Å; F304-T308 WeakPolarHBondContact O-CB 3.44Å; F304-T308 PolarHBondContact O-N 3.38Å; F304-T308 PolarHBondContact O-OG1 3.45Å; Y305-T308 WeakPolarHBondContact O-CB 3.21Å; Y305-T308 PolarHBondContact O-N 3.46Å; Y305-T308 VanDerWaalsContact O-N 3.11Å; A306-T308 VanDerWaalsContact C-N 3.34Å; A306-T308 PolarHBondContact O-N 3.38Å; T308-G312 PolarHBondContact O-N 3.34Å; T308-V396 HydrophobicContact CG2-CG1 3.79Å
309V96.2Very high92.5Very high0 Ų039.6 Ų39.60%023%0.232CC..Hα-helixtrans-62.5-50.2178.11750000110.6Y305 A306 V307 C311 G312 L313 Y393 V396 L463Y305-V309 HydrophobicContact CD2-CG2 4.21Å; Y305-V309 HydrophobicContact CE1-CG2 4.44Å; Y305-V309 HydrophobicContact CE2-CG2 3.68Å; Y305-V309 PolarHBondContact O-N 2.63Å; A306-V309 PolarHBondContact O-N 2.98Å; V307-V309 PolarHBondContact O-N 3.33Å; V309-C311 PolarHBondContact O-N 3.11Å; V309-G312 PolarHBondContact O-N 3.39Å; V309-L313 HydrophobicContact CG1-CD1 3.92Å; V309-L313 HydrophobicContact CG1-CG 4.28Å; V309-L313 VanDerWaalsContact O-CG 3.31Å; V309-L313 WeakPolarHBondContact O-CG 3.2Å; V309-L313 PolarHBondContact O-N 2.98Å; V309-Y393 HydrophobicContact CG1-CD2 4.29Å; V309-Y393 HydrophobicContact CG2-CD2 4.4Å; V309-V396 HydrophobicContact CG2-CB 4.13Å; V309-V396 HydrophobicContact CG2-CG1 3.6Å; V309-L463 HydrophobicContact CB-CD1 4.23Å; V309-L463 HydrophobicContact CB-CD2 4.22Å; V309-L463 HydrophobicContact CG1-CD1 4.27Å; V309-L463 HydrophobicContact CG1-CD2 4.16Å; V309-L463 HydrophobicContact CG2-CD1 4.28Å
310V95.8Very high93.3Very high45 Ų4539.8 Ų39.827%0.27322%0.223SC..Hα-helixtrans-61.9-43.7-179.1172.70000111.4A306 V307 G312 L313 V314 L463 F466A306-V310 WeakPolarHBondContact O-CG2 2.83Å; A306-V310 PolarHBondContact O-N 2.82Å; V307-V310 PolarHBondContact O-N 2.92Å; V310-G312 VanDerWaalsContact C-N 3.35Å; V310-G312 PolarHBondContact O-N 3.28Å; V310-L313 PolarHBondContact O-N 3.05Å; V310-V314 HydrophobicContact CG1-CG2 4.32Å; V310-V314 WeakPolarHBondContact O-CB 3.15Å; V310-V314 VanDerWaalsContact O-CG2 3.28Å; V310-V314 WeakPolarHBondContact O-CG2 3.46Å; V310-V314 PolarHBondContact O-N 3.48Å; V310-L463 HydrophobicContact CG2-CD2 3.64Å; V310-F466 HydrophobicContact CG2-CD2 4.33Å
311C96.4Very high94Very high50 Ų5034.8 Ų34.834%0.33820%0.201SC..Hα-helixtrans-60.4-44.4175.2-74.30000111.6M120 V307 V309 V314 V315M120-C311 HydrophobicContact CE-CB 4.41Å; M120-C311 HydrophobicContact CG-CB 4.41Å; M120-C311 HydrophobicContact SD-CB 4.2Å; V307-C311 VanDerWaalsContact O-CB 3.26Å; V307-C311 WeakPolarHBondContact O-CB 3.33Å; V307-C311 PolarHBondContact O-N 3.13Å; V307-C311 PolarHBondContact O-SG 3.47Å; V309-C311 PolarHBondContact O-N 3.11Å; C311-V314 PolarHBondContact O-N 3.35Å; C311-V315 VanDerWaalsContact O-CG2 3.31Å; C311-V315 WeakPolarHBondContact O-CG2 3.07Å; C311-V315 PolarHBondContact O-N 3.14Å
312G97.5Very high94.6Very high0 Ų033.8 Ų33.80%020%0.198CC..Hα-helixtrans-59.6-47.5174.900000112.5T308 V309 V310 V314 V315 H316 L392T308-G312 PolarHBondContact O-N 3.34Å; V309-G312 PolarHBondContact O-N 3.39Å; V310-G312 VanDerWaalsContact C-N 3.35Å; V310-G312 PolarHBondContact O-N 3.28Å; G312-V314 VanDerWaalsContact C-N 3.34Å; G312-V314 PolarHBondContact O-N 3.43Å; G312-V315 PolarHBondContact O-N 3.04Å; G312-H316 WeakPolarHBondContact O-CB 3.34Å; G312-H316 PolarHBondContact O-N 3.33Å; G312-L392 VanDerWaalsContact C-CD1 3.48Å; G312-L392 WeakPolarHBondContact O-CD1 3.22Å
313L96.9Very high95.1Very high4 Ų437.4 Ų37.42%0.02122%0.217CC..Hα-helixtrans-62.4-39.3177.3-69.3175.6000112.4V309 V310 G317 G389 L392 F466 R467 I470V309-L313 HydrophobicContact CG1-CD1 3.92Å; V309-L313 HydrophobicContact CG1-CG 4.28Å; V309-L313 VanDerWaalsContact O-CG 3.31Å; V309-L313 WeakPolarHBondContact O-CG 3.2Å; V309-L313 PolarHBondContact O-N 2.98Å; V310-L313 PolarHBondContact O-N 3.05Å; L313-G317 WeakPolarHBondContact O-CA 3.3Å; L313-G317 PolarHBondContact O-N 3.46Å; L313-G389 VanDerWaalsContact CD2-CA 3.43Å; L313-L392 HydrophobicContact CD2-CD1 4.48Å; L313-L392 HydrophobicContact CD2-CD2 4.29Å; L313-L392 HydrophobicContact CG-CD2 4.34Å; L313-F466 HydrophobicContact CD1-CB 3.67Å; L313-R467 HydrophobicContact CD1-CG 4.06Å; L313-I470 HydrophobicContact CB-CG1 4.08Å; L313-I470 HydrophobicContact CD2-CB 4.4Å; L313-I470 HydrophobicContact CD2-CG1 4.15Å
314V96.3Very high95.5Very high71 Ų7137.1 Ų37.143%0.4321%0.207SC..Hα-helixtrans-65.6-45.4175.81650000110.9V310 C311 G312 L318V310-V314 HydrophobicContact CG1-CG2 4.32Å; V310-V314 WeakPolarHBondContact O-CB 3.15Å; V310-V314 VanDerWaalsContact O-CG2 3.28Å; V310-V314 WeakPolarHBondContact O-CG2 3.46Å; V310-V314 PolarHBondContact O-N 3.48Å; C311-V314 PolarHBondContact O-N 3.35Å; G312-V314 VanDerWaalsContact C-N 3.34Å; G312-V314 PolarHBondContact O-N 3.43Å; V314-L318 HydrophobicContact CG1-CD1 4.21Å; V314-L318 WeakPolarHBondContact O-CA 3.47Å; V314-L318 VanDerWaalsContact O-CB 3.3Å; V314-L318 WeakPolarHBondContact O-CB 3.15Å; V314-L318 PolarHBondContact O-N 3.01Å
315V97.4Very high95.8Very high43 Ų4333.7 Ų33.726%0.26119%0.191SC..Iπ-helixtrans-62.4-48.2177.3169.10000110.6V116 M120 C311 G312 L319 I320V116-V315 HydrophobicContact CG1-CB 4.32Å; V116-V315 HydrophobicContact CG1-CG1 4Å; M120-V315 HydrophobicContact CE-CG2 3.93Å; C311-V315 VanDerWaalsContact O-CG2 3.31Å; C311-V315 WeakPolarHBondContact O-CG2 3.07Å; C311-V315 PolarHBondContact O-N 3.14Å; G312-V315 PolarHBondContact O-N 3.04Å; V315-L319 HydrophobicContact CG1-CD1 4.46Å; V315-L319 HydrophobicContact CG2-CD1 4.41Å; V315-L319 WeakPolarHBondContact O-CA 3.26Å; V315-L319 VanDerWaalsContact O-CB 3.22Å; V315-L319 WeakPolarHBondContact O-CB 3.31Å; V315-L319 PolarHBondContact O-N 3.19Å; V315-L319 VanDerWaalsContact O-N 3.13Å; V315-I320 HydrophobicContact CG1-CD1 4.16Å; V315-I320 PolarHBondContact O-N 3.37Å; V315-I320 VanDerWaalsContact O-N 3.09Å
316H97.5Very high96.1Very high0 Ų038.3 Ų38.30%021%0.211CC..Iπ-helixtrans-64.2-52.5178.8-173.964.9000112T109 G312 I320 L321 D388 L392T109-H316 PolarHBondContact O-CE1 3.48Å; G312-H316 WeakPolarHBondContact O-CB 3.34Å; G312-H316 PolarHBondContact O-N 3.33Å; H316-I320 PolarHBondContact O-N 3.36Å; H316-L321 PolarHBondContact O-N 3.26Å; H316-D388 IonicContact CD2-OD2 2.69Å; H316-D388 IonicContact CE1-OD2 3.53Å; H316-D388 WeakPolarHBondContact NE2-CB 3.44Å; H316-D388 IonicContact NE2-OD2 2.68Å; H316-D388 PolarHBondContact NE2-OD2 3.37Å; H316-L392 HydrophobicContact CB-CD1 4.12Å
317G95.2Very high96.3Very high0 Ų041.6 Ų41.60%023%0.226CC..Iπ-helixtrans-73.4-38.9-172.600000115.5L313 P322 L473L313-G317 WeakPolarHBondContact O-CA 3.3Å; L313-G317 PolarHBondContact O-N 3.46Å; G317-P322 WeakPolarHBondContact O-CD 3.43Å; G317-P322 WeakPolarHBondContact O-CG 3.33Å; G317-L473 VanDerWaalsContact O-CD2 3.3Å; G317-L473 WeakPolarHBondContact O-CD2 3.23Å
318L94.2Very high96.3Very high99 Ų9940.7 Ų40.752%0.51822%0.218SC..Iπ-helixtrans-101-17.1-175.4-58-173.2000113.7V314 P322V314-L318 HydrophobicContact CG1-CD1 4.21Å; V314-L318 WeakPolarHBondContact O-CA 3.47Å; V314-L318 VanDerWaalsContact O-CB 3.3Å; V314-L318 WeakPolarHBondContact O-CB 3.15Å; V314-L318 PolarHBondContact O-N 3.01Å; L318-P322 WeakPolarHBondContact O-CG 3.48Å
319L95.8Very high96.3Very high108 Ų10840.9 Ų40.957%0.56522%0.219SC*.Iπ-helixtrans-112.2-57.4178.1-50.9176.6000111.8V315 L323V315-L319 HydrophobicContact CG1-CD1 4.46Å; V315-L319 HydrophobicContact CG2-CD1 4.41Å; V315-L319 WeakPolarHBondContact O-CA 3.26Å; V315-L319 VanDerWaalsContact O-CB 3.22Å; V315-L319 WeakPolarHBondContact O-CB 3.31Å; V315-L319 PolarHBondContact O-N 3.19Å; V315-L319 VanDerWaalsContact O-N 3.13Å; L319-L323 WeakPolarHBondContact O-CB 3.48Å; L319-L323 PolarHBondContact O-N 3.01Å
320I96.9Very high96.2Very high44 Ų4447.8 Ų47.823%0.22625%0.249CC..Iπ-helixtrans-72.5-52.5-169.8-63.1172.6000112.1L112 V116 V315 H316 L323 L324L112-I320 HydrophobicContact CD1-CG2 4.47Å; V116-I320 HydrophobicContact CG2-CD1 3.23Å; V315-I320 HydrophobicContact CG1-CD1 4.16Å; V315-I320 PolarHBondContact O-N 3.37Å; V315-I320 VanDerWaalsContact O-N 3.09Å; H316-I320 PolarHBondContact O-N 3.36Å; I320-L323 PolarHBondContact O-N 2.99Å; I320-L324 WeakPolarHBondContact O-CB 3.36Å; I320-L324 PolarHBondContact O-N 3.35Å
321L96.5Very high96.1Very high0 Ų051.5 Ų51.50%026%0.262CS..Hα-helixtrans-61.8-45.1179.7-62.9177.1000112.5T109 H316 L323 L324 Y325 I470 L477T109-L321 HydrophobicContact CG2-CD2 3.86Å; H316-L321 PolarHBondContact O-N 3.26Å; L321-L323 PolarHBondContact O-N 2.99Å; L321-L324 PolarHBondContact O-N 2.9Å; L321-Y325 PolarHBondContact O-N 3.37Å; L321-I470 HydrophobicContact CD1-CG2 4.41Å; L321-L477 HydrophobicContact CB-CD1 3.66Å
322P96.5Very high96Very high7 Ų753.5 Ų53.55%0.04527%0.269CS..Hα-helixtrans-65.4-36.9175.8-26.340.4000112.7G317 L318 Y325 F326 P333 I337G317-P322 WeakPolarHBondContact O-CD 3.43Å; G317-P322 WeakPolarHBondContact O-CG 3.33Å; L318-P322 WeakPolarHBondContact O-CG 3.48Å; P322-Y325 PolarHBondContact O-N 3.36Å; P322-F326 WeakPolarHBondContact O-CB 3.29Å; P322-F326 PolarHBondContact O-N 3.44Å; P322-P333 HydrophobicContact CB-CB 3.77Å; P322-P333 HydrophobicContact CB-CG 3.8Å; P322-P333 WeakPolarHBondContact O-CG 3.27Å; P322-I337 HydrophobicContact CB-CD1 4.37Å; P322-I337 HydrophobicContact CG-CD1 3.89Å
323L96.5Very high95.9Very high95 Ų9554.1 Ų54.150%0.49727%0.273SS..Hα-helixtrans-63-45.3174.6177.463.7000111L319 I320 L321 Y325 F326 L327L319-L323 WeakPolarHBondContact O-CB 3.48Å; L319-L323 PolarHBondContact O-N 3.01Å; I320-L323 PolarHBondContact O-N 2.99Å; L321-L323 PolarHBondContact O-N 2.99Å; L323-Y325 VanDerWaalsContact C-N 3.34Å; L323-Y325 PolarHBondContact O-N 3.33Å; L323-F326 PolarHBondContact O-N 3.33Å; L323-L327 HydrophobicContact CD1-CD1 4.17Å; L323-L327 HydrophobicContact CD1-CG 4.07Å; L323-L327 HydrophobicContact CG-CD1 3.97Å; L323-L327 HydrophobicContact CG-CG 4.3Å; L323-L327 WeakPolarHBondContact O-CB 3.49Å; L323-L327 VanDerWaalsContact O-CG 3.26Å; L323-L327 WeakPolarHBondContact O-CG 3.4Å; L323-L327 PolarHBondContact O-N 3.41Å
324L95.6Very high95.8Very high31 Ų3159.2 Ų59.216%0.16230%0.299CS..Hα-helixtrans-60.9-44.3177.3-17361.8000111.2Y105 T109 I320 L321 F326 L327 I328Y105-L324 HydrophobicContact CD2-CD2 4.33Å; Y105-L324 HydrophobicContact CE2-CD2 3.43Å; Y105-L324 VanDerWaalsContact CE2-CD2 3.43Å; Y105-L324 HydrophobicContact CE2-CG 4.11Å; T109-L324 HydrophobicContact CG2-CD2 3.58Å; I320-L324 WeakPolarHBondContact O-CB 3.36Å; I320-L324 PolarHBondContact O-N 3.35Å; L321-L324 PolarHBondContact O-N 2.9Å; L324-F326 PolarHBondContact O-N 2.68Å; L324-L327 PolarHBondContact O-N 3.42Å; L324-I328 HydrophobicContact CD1-CD1 3.85Å; L324-I328 HydrophobicContact CD1-CG1 4.43Å; L324-I328 HydrophobicContact CG-CD1 3.98Å; L324-I328 WeakPolarHBondContact O-CG1 3.32Å; L324-I328 PolarHBondContact O-N 3.15Å; L324-I328 VanDerWaalsContact O-N 3.11Å
325Y96.9Very high95.6Very high13 Ų1360.8 Ų60.85%0.05131%0.309CS..Hα-helixtrans-57-48.3173-179.1-83.6000111.8L321 P322 L323 T329 K331 P333 F336 L477 I481L321-Y325 PolarHBondContact O-N 3.37Å; P322-Y325 PolarHBondContact O-N 3.36Å; L323-Y325 VanDerWaalsContact C-N 3.34Å; L323-Y325 PolarHBondContact O-N 3.33Å; Y325-T329 HydrophobicContact CD1-CG2 4.47Å; Y325-T329 WeakPolarHBondContact CD1-OG1 3.37Å; Y325-T329 HydrophobicContact CD2-CG2 4.17Å; Y325-T329 HydrophobicContact CE1-CG2 4.3Å; Y325-T329 WeakPolarHBondContact CE1-OG1 3.15Å; Y325-T329 HydrophobicContact CE2-CG2 3.96Å; Y325-T329 HydrophobicContact CG-CG2 4.41Å; Y325-T329 WeakPolarHBondContact O-CB 3.45Å; Y325-T329 WeakPolarHBondContact O-CG2 3.29Å; Y325-T329 PolarHBondContact O-N 2.63Å; Y325-T329 PolarHBondContact O-OG1 3.49Å; Y325-K331 HydrophobicContact CE1-CB 4.08Å; Y325-P333 HydrophobicContact CD1-CB 3.7Å; Y325-P333 HydrophobicContact CE1-CB 4.42Å; Y325-P333 HydrophobicContact CG-CB 4.28Å; Y325-F336 HydrophobicContact CE1-CB 4.42Å; Y325-F336 HydrophobicContact CE2-CD1 4.46Å; Y325-F336 HydrophobicContact CE2-CD2 4.09Å; Y325-F336 HydrophobicContact CE2-CE2 4.33Å; Y325-F336 HydrophobicContact CE2-CG 4.16Å; Y325-F336 AromaticContact CZ-CD2 3.87Å; Y325-F336 AromaticContact CZ-CG 3.99Å; Y325-F336 VanDerWaalsContact OH-CD2 3.26Å; Y325-F336 WeakPolarHBondContact OH-CD2 3.33Å; Y325-L477 HydrophobicContact CD2-CB 4.39Å; Y325-L477 HydrophobicContact CD2-CD2 3.67Å; Y325-L477 HydrophobicContact CE2-CD2 4.3Å; Y325-L477 HydrophobicContact CG-CD2 3.95Å; Y325-I481 HydrophobicContact CD2-CD1 4.22Å; Y325-I481 HydrophobicContact CD2-CG1 3.72Å; Y325-I481 HydrophobicContact CE2-CG1 4.37Å; Y325-I481 HydrophobicContact CG-CG1 4.42Å
326F97.4Very high95.6Very high97 Ų9759.3 Ų59.343%0.42530%0.299SS..Hα-helixtrans-63.1-43.9178.8176-103.3000112P322 L323 L324 I328 K330 K331 P333P322-F326 WeakPolarHBondContact O-CB 3.29Å; P322-F326 PolarHBondContact O-N 3.44Å; L323-F326 PolarHBondContact O-N 3.33Å; L324-F326 PolarHBondContact O-N 2.68Å; F326-I328 VanDerWaalsContact C-N 3.32Å; F326-I328 PolarHBondContact O-N 3.09Å; F326-K330 WeakPolarHBondContact O-CA 3.44Å; F326-K330 PolarHBondContact O-N 2.93Å; F326-K331 WeakPolarHBondContact CD2-O 3.31Å; F326-P333 HydrophobicContact CB-CG 4.42Å
327L96.6Very high95.4Very high88 Ų8860.5 Ų60.546%0.46131%0.305SS..Hα-helixtrans-62.8-39.6-177.7-73.9175.9000112.1L323 L324 K330L323-L327 HydrophobicContact CD1-CD1 4.17Å; L323-L327 HydrophobicContact CD1-CG 4.07Å; L323-L327 HydrophobicContact CG-CD1 3.97Å; L323-L327 HydrophobicContact CG-CG 4.3Å; L323-L327 WeakPolarHBondContact O-CB 3.49Å; L323-L327 VanDerWaalsContact O-CG 3.26Å; L323-L327 WeakPolarHBondContact O-CG 3.4Å; L323-L327 PolarHBondContact O-N 3.41Å; L324-L327 PolarHBondContact O-N 3.42Å; L327-K330 WeakPolarHBondContact O-CE 3.45Å; L327-K330 PolarHBondContact O-NZ 3.41Å
328I95.5Very high95.3Very high60 Ų6070.3 Ų70.331%0.30834%0.342SS..Hα-helixtrans-82.7-50.6-178.1-62170.2000111.7L324 F326 I481 I485L324-I328 HydrophobicContact CD1-CD1 3.85Å; L324-I328 HydrophobicContact CD1-CG1 4.43Å; L324-I328 HydrophobicContact CG-CD1 3.98Å; L324-I328 WeakPolarHBondContact O-CG1 3.32Å; L324-I328 PolarHBondContact O-N 3.15Å; L324-I328 VanDerWaalsContact O-N 3.11Å; F326-I328 VanDerWaalsContact C-N 3.32Å; F326-I328 PolarHBondContact O-N 3.09Å; I328-I481 HydrophobicContact CD1-CD1 4.38Å; I328-I481 HydrophobicContact CD1-CG2 4.06Å; I328-I481 HydrophobicContact CG2-CG2 3.94Å; I328-I485 HydrophobicContact CG2-CD1 3.97Å; I328-I485 HydrophobicContact CG2-CG1 4.04Å
329T94.8Very high94.9Very high4 Ų466.1 Ų66.13%0.02532%0.323CS..Hα-helixtrans-86.6-16.8-172.869.80000113.6Y325 K331 I481 H484Y325-T329 HydrophobicContact CD1-CG2 4.47Å; Y325-T329 WeakPolarHBondContact CD1-OG1 3.37Å; Y325-T329 HydrophobicContact CD2-CG2 4.17Å; Y325-T329 HydrophobicContact CE1-CG2 4.3Å; Y325-T329 WeakPolarHBondContact CE1-OG1 3.15Å; Y325-T329 HydrophobicContact CE2-CG2 3.96Å; Y325-T329 HydrophobicContact CG-CG2 4.41Å; Y325-T329 WeakPolarHBondContact O-CB 3.45Å; Y325-T329 WeakPolarHBondContact O-CG2 3.29Å; Y325-T329 PolarHBondContact O-N 2.63Å; Y325-T329 PolarHBondContact O-OG1 3.49Å; T329-K331 PolarHBondContact O-N 3.42Å; T329-K331 VanDerWaalsContact O-N 3.13Å; T329-K331 PolarHBondContact OG1-N 3.5Å; T329-I481 HydrophobicContact CG2-CG1 4.03Å; T329-H484 HydrophobicContact CG2-CB 3.82Å
330K94.6Very high94.8Very high145 Ų14561 Ų6163%0.6330%0.296SS*.  trans53.723.3-170-54.5-59.5-174.3-163.30113.6F326 L327F326-K330 WeakPolarHBondContact O-CA 3.44Å; F326-K330 PolarHBondContact O-N 2.93Å; L327-K330 WeakPolarHBondContact O-CE 3.45Å; L327-K330 PolarHBondContact O-NZ 3.41Å
331K92.9Very high94.2Very high122 Ų12263 Ų6353%0.5331%0.307SS..SBendtrans-110.5154.3177.4-67.8-178.5180-175.70111Y325 F326 T329 P333Y325-K331 HydrophobicContact CE1-CB 4.08Å; F326-K331 WeakPolarHBondContact CD2-O 3.31Å; T329-K331 PolarHBondContact O-N 3.42Å; T329-K331 VanDerWaalsContact O-N 3.13Å; T329-K331 PolarHBondContact OG1-N 3.5Å; K331-P333 VanDerWaalsContact O-CD 3.29Å; K331-P333 WeakPolarHBondContact O-CD 3.4Å
332N94.9Very high93Very high92 Ų9268.1 Ų68.149%0.49233%0.331SS..  trans-67.5115.2178.9-174.1-18.5000110.9I334 V335N332-I334 VanDerWaalsContact C-N 3.31Å; N332-I334 PolarHBondContact O-N 3.22Å; N332-I334 WeakPolarHBondContact OD1-CB 3.14Å; N332-I334 PolarHBondContact OD1-N 2.89Å; N332-V335 HydrophobicContact CB-CG2 4.21Å
333P95.3Very high92Very high14 Ų1467.8 Ų67.89%0.09133%0.328CS..Hα-helixtrans-69.3-27.7-178.428.7-35.6000112.7P322 Y325 F326 K331 V335 F336 I337P322-P333 HydrophobicContact CB-CB 3.77Å; P322-P333 HydrophobicContact CB-CG 3.8Å; P322-P333 WeakPolarHBondContact O-CG 3.27Å; Y325-P333 HydrophobicContact CD1-CB 3.7Å; Y325-P333 HydrophobicContact CE1-CB 4.42Å; Y325-P333 HydrophobicContact CG-CB 4.28Å; F326-P333 HydrophobicContact CB-CG 4.42Å; K331-P333 VanDerWaalsContact O-CD 3.29Å; K331-P333 WeakPolarHBondContact O-CD 3.4Å; P333-V335 VanDerWaalsContact C-N 3.3Å; P333-V335 PolarHBondContact O-N 2.87Å; P333-F336 WeakPolarHBondContact O-CB 3.34Å; P333-F336 PolarHBondContact O-N 3.03Å; P333-F336 VanDerWaalsContact O-N 3.12Å; P333-I337 VanDerWaalsContact O-CG1 3.29Å; P333-I337 WeakPolarHBondContact O-CG1 3.48Å; P333-I337 PolarHBondContact O-N 2.92Å
334I94.3Very high91.5Very high111 Ų11163.8 Ų63.857%0.56931%0.307SS*.Hα-helixtrans-65.8-36.9-176.6-54.3-56.9000111.1N332 F336 I337 R338N332-I334 VanDerWaalsContact C-N 3.31Å; N332-I334 PolarHBondContact O-N 3.22Å; N332-I334 WeakPolarHBondContact OD1-CB 3.14Å; N332-I334 PolarHBondContact OD1-N 2.89Å; I334-F336 VanDerWaalsContact C-N 3.32Å; I334-I337 PolarHBondContact O-N 3.29Å; I334-R338 WeakPolarHBondContact O-CB 3.32Å; I334-R338 PolarHBondContact O-N 2.89Å
335V93.5Very high90.4Very high103 Ų10367.3 Ų67.362%0.62433%0.326SS*.Hα-helixtrans-64.7-41.2175.1-1800000110.4N332 P333 R338 G339N332-V335 HydrophobicContact CB-CG2 4.21Å; P333-V335 VanDerWaalsContact C-N 3.3Å; P333-V335 PolarHBondContact O-N 2.87Å; V335-R338 PolarHBondContact O-N 2.92Å; V335-G339 PolarHBondContact O-N 3.23Å
336F95.7Very high89Confident13 Ų1369.1 Ų69.16%0.05734%0.336CS..Hα-helixtrans-64.3-46.7176.7-170.6-84.2000111.7Y325 P333 I334 R338 G339 V340 L364 N368 I370 A476 L477Y325-F336 HydrophobicContact CE1-CB 4.42Å; Y325-F336 HydrophobicContact CE2-CD1 4.46Å; Y325-F336 HydrophobicContact CE2-CD2 4.09Å; Y325-F336 HydrophobicContact CE2-CE2 4.33Å; Y325-F336 HydrophobicContact CE2-CG 4.16Å; Y325-F336 AromaticContact CZ-CD2 3.87Å; Y325-F336 AromaticContact CZ-CG 3.99Å; Y325-F336 VanDerWaalsContact OH-CD2 3.26Å; Y325-F336 WeakPolarHBondContact OH-CD2 3.33Å; P333-F336 WeakPolarHBondContact O-CB 3.34Å; P333-F336 PolarHBondContact O-N 3.03Å; P333-F336 VanDerWaalsContact O-N 3.12Å; I334-F336 VanDerWaalsContact C-N 3.32Å; F336-R338 VanDerWaalsContact C-N 3.29Å; F336-R338 PolarHBondContact O-N 3.46Å; F336-G339 PolarHBondContact O-N 2.91Å; F336-G339 VanDerWaalsContact O-N 3.14Å; F336-V340 PolarHBondContact O-N 3.28Å; F336-L364 HydrophobicContact CE1-CD2 4.07Å; F336-L364 HydrophobicContact CE2-CD2 4.46Å; F336-L364 HydrophobicContact CZ-CD2 3.59Å; F336-N368 VanDerWaalsContact CD1-ND2 3.33Å; F336-N368 WeakPolarHBondContact CD1-ND2 3.29Å; F336-N368 HydrophobicContact CD2-CB 4.15Å; F336-N368 WeakPolarHBondContact CD2-ND2 3.09Å; F336-N368 WeakPolarHBondContact CE1-ND2 3.48Å; F336-N368 HydrophobicContact CE2-CB 3.82Å; F336-N368 WeakPolarHBondContact CE2-ND2 3.34Å; F336-N368 WeakPolarHBondContact CG-ND2 3.14Å; F336-N368 HydrophobicContact CZ-CB 4.37Å; F336-N368 VanDerWaalsContact CZ-ND2 3.3Å; F336-N368 WeakPolarHBondContact CZ-ND2 3.01Å; F336-N368 PolarHBondContact O-ND2 3.43Å; F336-I370 HydrophobicContact CE2-CD1 4.08Å; F336-I370 HydrophobicContact CE2-CG1 4.25Å; F336-A476 HydrophobicContact CE1-CB 4.35Å; F336-A476 VanDerWaalsContact CE1-O 3.26Å; F336-A476 WeakPolarHBondContact CE1-O 3.2Å; F336-A476 VanDerWaalsContact CZ-O 3.22Å; F336-A476 WeakPolarHBondContact CZ-O 2.97Å; F336-L477 HydrophobicContact CD1-CD2 3.68Å; F336-L477 HydrophobicContact CE1-CD2 4.08Å
337I94.4Very high88Confident24 Ų2464.5 Ų64.512%0.12332%0.316CS..Hα-helixtrans-61.7-38.8178.6-66.9171.4000110.9P322 P333 I334 G339 V340 L341 L344 L473 L477P322-I337 HydrophobicContact CB-CD1 4.37Å; P322-I337 HydrophobicContact CG-CD1 3.89Å; P333-I337 VanDerWaalsContact O-CG1 3.29Å; P333-I337 WeakPolarHBondContact O-CG1 3.48Å; P333-I337 PolarHBondContact O-N 2.92Å; I334-I337 PolarHBondContact O-N 3.29Å; I337-G339 PolarHBondContact O-N 3.41Å; I337-V340 CarbonylContact O-C 3.57Å; I337-V340 WeakPolarHBondContact O-CG2 3.46Å; I337-V340 PolarHBondContact O-N 2.9Å; I337-V340 VanDerWaalsContact O-N 3.09Å; I337-L341 PolarHBondContact O-N 3.5Å; I337-L344 HydrophobicContact CG2-CD1 4.12Å; I337-L473 HydrophobicContact CD1-CD1 4.2Å; I337-L473 HydrophobicContact CG1-CD1 3.86Å; I337-L473 HydrophobicContact CG2-CD1 4.46Å; I337-L477 HydrophobicContact CG1-CD2 4.32Å
338R92.6Very high87Confident207 Ų20762.7 Ų62.778%0.78131%0.306SS*.Hα-helixtrans-57.9-37.1176.3-173.7177.9178.3174.9-0.3112.3I334 V335 F336 V340 L341I334-R338 WeakPolarHBondContact O-CB 3.32Å; I334-R338 PolarHBondContact O-N 2.89Å; V335-R338 PolarHBondContact O-N 2.92Å; F336-R338 VanDerWaalsContact C-N 3.29Å; F336-R338 PolarHBondContact O-N 3.46Å; R338-V340 VanDerWaalsContact C-N 3.34Å; R338-L341 WeakPolarHBondContact O-CB 3.36Å; R338-L341 PolarHBondContact O-N 3.19Å
339G86.7Confident85.3Confident11 Ų1161.3 Ų61.311%0.11330%0.303CS..Hα-helixtrans-75.2-19.2178.500000114.6V335 F336 I337 C363 N367 N368V335-G339 PolarHBondContact O-N 3.23Å; F336-G339 PolarHBondContact O-N 2.91Å; F336-G339 VanDerWaalsContact O-N 3.14Å; I337-G339 PolarHBondContact O-N 3.41Å; G339-C363 WeakPolarHBondContact O-CB 3.47Å; G339-N367 WeakPolarHBondContact O-CB 3.29Å; G339-N367 PolarHBondContact O-ND2 3.03Å; G339-N368 VanDerWaalsContact CA-OD1 3.23Å; G339-N368 WeakPolarHBondContact CA-OD1 3.48Å
340V91.9Very high83.8Confident1 Ų163.9 Ų63.91%0.00632%0.319CS..Hα-helixtrans-102.61.4173.3-64.50000114F336 I337 R338 Q342 A343 L344 C363 L364 A476F336-V340 PolarHBondContact O-N 3.28Å; I337-V340 CarbonylContact O-C 3.57Å; I337-V340 WeakPolarHBondContact O-CG2 3.46Å; I337-V340 PolarHBondContact O-N 2.9Å; I337-V340 VanDerWaalsContact O-N 3.09Å; R338-V340 VanDerWaalsContact C-N 3.34Å; V340-Q342 PolarHBondContact O-N 2.94Å; V340-Q342 VanDerWaalsContact O-N 3.12Å; V340-A343 WeakPolarHBondContact O-CB 3.4Å; V340-A343 PolarHBondContact O-N 3.33Å; V340-L344 HydrophobicContact CG2-CD1 4.41Å; V340-L344 PolarHBondContact O-N 3.03Å; V340-C363 HydrophobicContact CB-CB 4.49Å; V340-C363 HydrophobicContact CG1-CB 4.07Å; V340-L364 HydrophobicContact CG1-CD2 3.61Å; V340-L364 HydrophobicContact CG1-CG 4.35Å; V340-A476 HydrophobicContact CB-CB 4.45Å; V340-A476 HydrophobicContact CG1-CB 4.11Å; V340-A476 HydrophobicContact CG2-CB 4.28Å
341L85.6Confident82.7Confident85 Ų8557.3 Ų57.345%0.44529%0.291SS..Hα-helixtrans-53.8-37.4-175.9-177.662.9000113.2I337 R338 A343 L344 L345I337-L341 PolarHBondContact O-N 3.5Å; R338-L341 WeakPolarHBondContact O-CB 3.36Å; R338-L341 PolarHBondContact O-N 3.19Å; L341-A343 VanDerWaalsContact C-N 3.34Å; L341-A343 PolarHBondContact O-N 3.47Å; L341-L344 PolarHBondContact O-N 2.91Å; L341-L345 HydrophobicContact CD1-CG 4.44Å; L341-L345 HydrophobicContact CG-CD1 4.3Å; L341-L345 HydrophobicContact CG-CG 4.5Å; L341-L345 WeakPolarHBondContact O-CG 3.42Å; L341-L345 PolarHBondContact O-N 3.23Å
342Q70.9Confident81.8Confident108 Ų10852 Ų5251%0.50527%0.27SS..Hα-helixtrans-59.6-44.4176.4-178.9178.9-9.200111.9V340 L345 I346 I359V340-Q342 PolarHBondContact O-N 2.94Å; V340-Q342 VanDerWaalsContact O-N 3.12Å; Q342-L345 PolarHBondContact O-N 3.16Å; Q342-I346 HydrophobicContact CG-CD1 4.11Å; Q342-I346 VanDerWaalsContact O-CG1 3.3Å; Q342-I346 WeakPolarHBondContact O-CG1 3.07Å; Q342-I346 PolarHBondContact O-N 3.14Å; Q342-I346 VanDerWaalsContact O-N 3.14Å; Q342-I359 HydrophobicContact CG-CG2 4.29Å
343A76.4Confident81.1Confident0 Ų047.8 Ų47.80%025%0.248CC..Hα-helixtrans-65.9-38.9177.400000111.7V340 L341 I346 A347 I359 T360V340-A343 WeakPolarHBondContact O-CB 3.4Å; V340-A343 PolarHBondContact O-N 3.33Å; L341-A343 VanDerWaalsContact C-N 3.34Å; L341-A343 PolarHBondContact O-N 3.47Å; A343-I346 PolarHBondContact O-N 3.41Å; A343-A347 WeakPolarHBondContact O-CB 3.33Å; A343-A347 PolarHBondContact O-N 3.37Å; A343-I359 HydrophobicContact CB-CG2 4.24Å; A343-T360 WeakPolarHBondContact CB-OG1 3.49Å
344L84.9Confident80Confident11 Ų1149.1 Ų49.16%0.05826%0.257CS..Hα-helixtrans-63.6-42.5177.3-59.9180000112.5I337 V340 L341 I346 A347 L348 M469 V472 L473I337-L344 HydrophobicContact CG2-CD1 4.12Å; V340-L344 HydrophobicContact CG2-CD1 4.41Å; V340-L344 PolarHBondContact O-N 3.03Å; L341-L344 PolarHBondContact O-N 2.91Å; L344-I346 VanDerWaalsContact C-N 3.32Å; L344-I346 PolarHBondContact O-N 2.75Å; L344-A347 PolarHBondContact O-N 3.46Å; L344-L348 WeakPolarHBondContact O-CB 3.43Å; L344-L348 PolarHBondContact O-N 2.9Å; L344-M469 HydrophobicContact CB-CG 4.01Å; L344-M469 HydrophobicContact CB-SD 4.5Å; L344-M469 HydrophobicContact CD2-CG 4.24Å; L344-V472 HydrophobicContact CD2-CB 4.37Å; L344-V472 HydrophobicContact CD2-CG1 4.13Å; L344-L473 HydrophobicContact CD1-CD1 4.16Å; L344-L473 HydrophobicContact CD2-CB 3.75Å; L344-L473 HydrophobicContact CD2-CD1 4.47Å
345L73.3Confident78.4Confident104 Ų10446.7 Ų46.755%0.54525%0.254SS..Hα-helixtrans-64.7-38.1176.2-70.5174000111.9L341 Q342 A349L341-L345 HydrophobicContact CD1-CG 4.44Å; L341-L345 HydrophobicContact CG-CD1 4.3Å; L341-L345 HydrophobicContact CG-CG 4.5Å; L341-L345 WeakPolarHBondContact O-CG 3.42Å; L341-L345 PolarHBondContact O-N 3.23Å; Q342-L345 PolarHBondContact O-N 3.16Å; L345-A349 PolarHBondContact O-N 3.29Å; L345-A349 VanDerWaalsContact O-N 3.14Å
346I67.1Low77.3Confident52 Ų5241.8 Ų41.827%0.26722%0.224SC..Hα-helixtrans-68.7-40.6174.9-65.6167.1000110.1Q342 A343 L344 L348 A349 T350 T356 I359Q342-I346 HydrophobicContact CG-CD1 4.11Å; Q342-I346 VanDerWaalsContact O-CG1 3.3Å; Q342-I346 WeakPolarHBondContact O-CG1 3.07Å; Q342-I346 PolarHBondContact O-N 3.14Å; Q342-I346 VanDerWaalsContact O-N 3.14Å; A343-I346 PolarHBondContact O-N 3.41Å; L344-I346 VanDerWaalsContact C-N 3.32Å; L344-I346 PolarHBondContact O-N 2.75Å; I346-L348 VanDerWaalsContact C-N 3.32Å; I346-L348 PolarHBondContact O-N 3.28Å; I346-A349 CarbonylContact O-C 2.99Å; I346-A349 WeakPolarHBondContact O-CA 3.44Å; I346-A349 WeakPolarHBondContact O-CB 3.38Å; I346-A349 PolarHBondContact O-N 3.49Å; I346-T350 HydrophobicContact CG2-CG2 3.87Å; I346-T350 WeakPolarHBondContact O-CG2 3.39Å; I346-T350 PolarHBondContact O-N 3.41Å; I346-T350 PolarHBondContact O-OG1 2.93Å; I346-T350 VanDerWaalsContact O-OG1 3.06Å; I346-T356 HydrophobicContact CB-CG2 4.43Å; I346-T356 HydrophobicContact CG2-CG2 3.9Å; I346-I359 HydrophobicContact CD1-CB 4.31Å; I346-I359 HydrophobicContact CD1-CG1 4.06Å; I346-I359 HydrophobicContact CD1-CG2 3.83Å
347A75.4Confident76.2Confident0 Ų043.5 Ų43.50%023%0.233CC..Hα-helixtrans-62.8-39.5177.600000112.3A343 L344 A349 S351 T356 T468 V472A343-A347 WeakPolarHBondContact O-CB 3.33Å; A343-A347 PolarHBondContact O-N 3.37Å; L344-A347 PolarHBondContact O-N 3.46Å; A347-A349 VanDerWaalsContact C-N 3.27Å; A347-A349 PolarHBondContact O-N 3.29Å; A347-S351 WeakPolarHBondContact O-CA 3.21Å; A347-S351 PolarHBondContact O-N 3.01Å; A347-T356 HydrophobicContact CB-CG2 3.62Å; A347-T468 HydrophobicContact CB-CG2 4.07Å; A347-V472 HydrophobicContact CB-CB 4.22Å; A347-V472 HydrophobicContact CB-CG2 3.83Å
348L76.9Confident74.7Confident50 Ų5046.5 Ų46.526%0.26226%0.255SS..Hα-helixtrans-62.9-34.2172.4-170.975.9000112.1L344 I346 R465 F466 M469L344-L348 WeakPolarHBondContact O-CB 3.43Å; L344-L348 PolarHBondContact O-N 2.9Å; I346-L348 VanDerWaalsContact C-N 3.32Å; I346-L348 PolarHBondContact O-N 3.28Å; L348-R465 HydrophobicContact CD1-CB 3.83Å; L348-R465 HydrophobicContact CG-CB 4.41Å; L348-R465 WeakPolarHBondContact O-CB 3.34Å; L348-R465 VanDerWaalsContact O-CG 3.3Å; L348-R465 WeakPolarHBondContact O-CG 3.46Å; L348-R465 PolarHBondContact O-NH1 3.2Å; L348-F466 HydrophobicContact CD1-CD1 3.87Å; L348-F466 HydrophobicContact CD1-CE1 3.98Å; L348-F466 HydrophobicContact CD1-CG 4.38Å; L348-M469 HydrophobicContact CB-SD 4.36Å; L348-M469 HydrophobicContact CD1-CB 4.47Å; L348-M469 HydrophobicContact CD1-SD 4.12Å
349A60Low73.7Confident30 Ų3039.1 Ų39.125%0.24823%0.23CC..Hα-helixtrans-76.8-49.617700000111.9L30 L345 I346 A347 R465L30-A349 HydrophobicContact CD1-CB 3.99Å; L30-A349 WeakPolarHBondContact CD1-O 3.26Å; L345-A349 PolarHBondContact O-N 3.29Å; L345-A349 VanDerWaalsContact O-N 3.14Å; I346-A349 CarbonylContact O-C 2.99Å; I346-A349 WeakPolarHBondContact O-CA 3.44Å; I346-A349 WeakPolarHBondContact O-CB 3.38Å; I346-A349 PolarHBondContact O-N 3.49Å; A347-A349 VanDerWaalsContact C-N 3.27Å; A347-A349 PolarHBondContact O-N 3.29Å; A349-R465 PolarHBondContact O-NH1 3.45Å
350T61.8Low73.3Confident58 Ų5838.8 Ų38.836%0.35623%0.226SC..Hα-helixtrans-79.2-23-17360.30000113.7I346 S352 T356I346-T350 HydrophobicContact CG2-CG2 3.87Å; I346-T350 WeakPolarHBondContact O-CG2 3.39Å; I346-T350 PolarHBondContact O-N 3.41Å; I346-T350 PolarHBondContact O-OG1 2.93Å; I346-T350 VanDerWaalsContact O-OG1 3.06Å; T350-S352 PolarHBondContact O-N 3.44Å; T350-S352 PolarHBondContact OG1-N 2.94Å; T350-S352 PolarHBondContact OG1-O 3.25Å; T350-T356 WeakPolarHBondContact OG1-CG2 3.28Å
351S73.1Confident72.5Confident7 Ų741 Ų415%0.04924%0.236CC..  trans53.628.8-168.3-540000113.3A347 P432 D464 R465 T468A347-S351 WeakPolarHBondContact O-CA 3.21Å; A347-S351 PolarHBondContact O-N 3.01Å; S351-P432 VanDerWaalsContact O-CA 3.32Å; S351-P432 WeakPolarHBondContact O-CA 3.25Å; S351-D464 WeakPolarHBondContact CB-OD2 3.47Å; S351-R465 WeakPolarHBondContact OG-CG 3.34Å; S351-T468 WeakPolarHBondContact CA-OG1 3.25Å; S351-T468 PolarHBondContact O-OG1 3.25Å
352S73.3Confident71.8Confident11 Ų1141.9 Ų41.98%0.07724%0.236CC..  trans-138.7116.4180173.40000112.2T350 A355 T356 G430 T468T350-S352 PolarHBondContact O-N 3.44Å; T350-S352 PolarHBondContact OG1-N 2.94Å; T350-S352 PolarHBondContact OG1-O 3.25Å; S352-A355 PolarHBondContact O-N 3.14Å; S352-A355 WeakPolarHBondContact OG-CB 3.42Å; S352-A355 PolarHBondContact OG-N 2.89Å; S352-A355 VanDerWaalsContact OG-N 3.08Å; S352-T356 WeakPolarHBondContact O-CG2 3.48Å; S352-T356 PolarHBondContact O-N 2.89Å; S352-G430 CarbonylContact C-O 3.37Å; S352-G430 WeakPolarHBondContact CA-O 3.29Å; S352-G430 WeakPolarHBondContact CB-O 3.38Å; S352-G430 PolarHBondContact OG-O 3.19Å; S352-T468 VanDerWaalsContact C-CG2 3.42Å; S352-T468 VanDerWaalsContact N-CG2 3.3Å
353S81Confident72.2Confident4 Ų436.9 Ų36.93%0.02821%0.213CC..Hα-helixtrans-64.3-42.8176-55.60000110.5A355 T356 L357 G430 T468S353-A355 PolarHBondContact O-N 3.31Å; S353-T356 PolarHBondContact O-N 3.48Å; S353-T356 VanDerWaalsContact O-N 3.15Å; S353-T356 PolarHBondContact O-OG1 2.96Å; S353-L357 PolarHBondContact O-N 2.82Å; S353-G430 PolarHBondContact N-O 2.98Å; S353-G430 VanDerWaalsContact N-O 3.11Å; S353-T468 VanDerWaalsContact N-CG2 3.3Å
354S71.5Confident72.8Confident41 Ų4136.9 Ų36.929%0.28721%0.213SC..Hα-helixtrans-65.2-38.6179.2-55.20000112.6T356 L357 G430S354-T356 PolarHBondContact O-N 3.19Å; S354-L357 VanDerWaalsContact O-CB 3.3Å; S354-L357 WeakPolarHBondContact O-CB 3.39Å; S354-L357 PolarHBondContact O-N 3.46Å; S354-G430 PolarHBondContact N-O 3.42Å; S354-G430 VanDerWaalsContact N-O 3.11Å; S354-G430 WeakPolarHBondContact OG-CA 3.34Å; S354-G430 PolarHBondContact OG-O 3.5Å
355A61.1Low72.6Confident60 Ų6038.7 Ų38.750%0.49622%0.222SC..Hα-helixtrans-67.1-27.1176.200000112.8S352 S353S352-A355 PolarHBondContact O-N 3.14Å; S352-A355 WeakPolarHBondContact OG-CB 3.42Å; S352-A355 PolarHBondContact OG-N 2.89Å; S352-A355 VanDerWaalsContact OG-N 3.08Å; S353-A355 PolarHBondContact O-N 3.31Å
356T69.6Low73.1Confident1 Ų139 Ų391%0.00622%0.221CC..Hα-helixtrans-86-14.3179.765.10000114.2I346 A347 T350 S352 S353 S354 P358 I359 T360 V472I346-T356 HydrophobicContact CB-CG2 4.43Å; I346-T356 HydrophobicContact CG2-CG2 3.9Å; A347-T356 HydrophobicContact CB-CG2 3.62Å; T350-T356 WeakPolarHBondContact OG1-CG2 3.28Å; S352-T356 WeakPolarHBondContact O-CG2 3.48Å; S352-T356 PolarHBondContact O-N 2.89Å; S353-T356 PolarHBondContact O-N 3.48Å; S353-T356 VanDerWaalsContact O-N 3.15Å; S353-T356 PolarHBondContact O-OG1 2.96Å; S354-T356 PolarHBondContact O-N 3.19Å; T356-P358 VanDerWaalsContact C-CD 3.45Å; T356-I359 PolarHBondContact O-N 3.24Å; T356-T360 PolarHBondContact O-N 3.45Å; T356-T360 PolarHBondContact O-OG1 3.36Å; T356-V472 VanDerWaalsContact OG1-CG2 3.32Å; T356-V472 WeakPolarHBondContact OG1-CG2 3.44Å
357L71.9Confident74.2Confident48 Ų4840.5 Ų40.525%0.25123%0.229SC..Hα-helixtrans-48.6-45.8-173.4-173.571.9000114S353 S354 I359 T360 F361 L379 P380 A383S353-L357 PolarHBondContact O-N 2.82Å; S354-L357 VanDerWaalsContact O-CB 3.3Å; S354-L357 WeakPolarHBondContact O-CB 3.39Å; S354-L357 PolarHBondContact O-N 3.46Å; L357-I359 VanDerWaalsContact C-N 3.33Å; L357-I359 PolarHBondContact O-N 3.49Å; L357-T360 PolarHBondContact O-N 2.88Å; L357-F361 VanDerWaalsContact O-CB 3.32Å; L357-F361 WeakPolarHBondContact O-CB 3.38Å; L357-F361 PolarHBondContact O-N 3.36Å; L357-L379 HydrophobicContact CD1-CB 3.53Å; L357-P380 HydrophobicContact CD2-CB 4.35Å; L357-P380 HydrophobicContact CD2-CG 4.25Å; L357-A383 HydrophobicContact CD1-CB 4.43Å
358P63.3Low74.9Confident88 Ų8841.8 Ų41.857%0.57124%0.236SC*.Hα-helixtrans-64.7-34.7179.3-21.434.7000113.4T356 K362T356-P358 VanDerWaalsContact C-CD 3.45Å; P358-K362 PolarHBondContact O-N 3.25Å
359I71.6Confident75.7Confident51 Ų5146.8 Ų46.826%0.26226%0.258SS..Hα-helixtrans-76.9-40.2179.1-54.6-60.7000110.6Q342 A343 I346 T356 L357 F361 K362 C363Q342-I359 HydrophobicContact CG-CG2 4.29Å; A343-I359 HydrophobicContact CB-CG2 4.24Å; I346-I359 HydrophobicContact CD1-CB 4.31Å; I346-I359 HydrophobicContact CD1-CG1 4.06Å; I346-I359 HydrophobicContact CD1-CG2 3.83Å; T356-I359 PolarHBondContact O-N 3.24Å; L357-I359 VanDerWaalsContact C-N 3.33Å; L357-I359 PolarHBondContact O-N 3.49Å; I359-F361 VanDerWaalsContact C-N 3.27Å; I359-F361 PolarHBondContact O-N 3.34Å; I359-K362 PolarHBondContact O-N 2.83Å; I359-C363 WeakPolarHBondContact O-CB 3.14Å; I359-C363 PolarHBondContact O-N 2.96Å; I359-C363 PolarHBondContact O-SG 2.74Å
360T79.6Confident77.1Confident4 Ų446.2 Ų46.23%0.02525%0.25CS..Hα-helixtrans-57.4-44.6172.2-52.20000110.4A343 T356 L357 C363 L364 L379 V472 A476A343-T360 WeakPolarHBondContact CB-OG1 3.49Å; T356-T360 PolarHBondContact O-N 3.45Å; T356-T360 PolarHBondContact O-OG1 3.36Å; L357-T360 PolarHBondContact O-N 2.88Å; T360-C363 PolarHBondContact O-N 3.47Å; T360-L364 WeakPolarHBondContact O-CG 3.47Å; T360-L364 PolarHBondContact O-N 3.27Å; T360-L379 HydrophobicContact CG2-CD1 3.92Å; T360-L379 HydrophobicContact CG2-CD2 3.89Å; T360-V472 HydrophobicContact CG2-CG1 4.2Å; T360-V472 WeakPolarHBondContact OG1-CG1 3.45Å; T360-A476 HydrophobicContact CG2-CB 4.39Å
361F75Confident78.2Confident49 Ų4946.1 Ų46.122%0.21525%0.248CC..Hα-helixtrans-58.9-48.7176.1-169.6-95.1000112.2L357 I359 C363 L364 L365 R372 A375 R376 L379L357-F361 VanDerWaalsContact O-CB 3.32Å; L357-F361 WeakPolarHBondContact O-CB 3.38Å; L357-F361 PolarHBondContact O-N 3.36Å; I359-F361 VanDerWaalsContact C-N 3.27Å; I359-F361 PolarHBondContact O-N 3.34Å; F361-C363 PolarHBondContact O-N 3.03Å; F361-L364 PolarHBondContact O-N 3.36Å; F361-L365 HydrophobicContact CD1-CD1 3.68Å; F361-L365 HydrophobicContact CD1-CG 4.47Å; F361-L365 HydrophobicContact CE1-CD1 3.22Å; F361-L365 HydrophobicContact CE1-CG 4.23Å; F361-L365 HydrophobicContact CZ-CD1 3.78Å; F361-L365 WeakPolarHBondContact O-CG 3.4Å; F361-L365 PolarHBondContact O-N 3.15Å; F361-L365 VanDerWaalsContact O-N 3.15Å; F361-R372 HydrophobicContact CZ-CG 3.82Å; F361-A375 HydrophobicContact CD2-CB 3.91Å; F361-A375 HydrophobicContact CE2-CB 3.67Å; F361-R376 HydrophobicContact CE2-CB 4.21Å; F361-R376 HydrophobicContact CE2-CG 3.42Å; F361-R376 VanDerWaalsContact CE2-CG 3.42Å; F361-R376 HydrophobicContact CZ-CG 3.51Å; F361-L379 HydrophobicContact CB-CD1 4.12Å; F361-L379 HydrophobicContact CD2-CD1 4.15Å
362K69.1Low78.4Confident103 Ų10352.2 Ų52.245%0.44827%0.27SS..Hα-helixtrans-58.6-48176.1-174.9-179.9177.5178.30111.9P358 I359 L364 L365 E366P358-K362 PolarHBondContact O-N 3.25Å; I359-K362 PolarHBondContact O-N 2.83Å; K362-L364 VanDerWaalsContact C-N 3.32Å; K362-L364 PolarHBondContact O-N 3.2Å; K362-L365 PolarHBondContact O-N 2.77Å; K362-E366 WeakPolarHBondContact CE-OE1 3.25Å; K362-E366 WeakPolarHBondContact CE-OE2 3.33Å; K362-E366 HydrophobicContact CG-CG 4.31Å; K362-E366 WeakPolarHBondContact CG-OE1 3.33Å; K362-E366 IonicContact NZ-OE2 3.77Å; K362-E366 WeakPolarHBondContact O-CB 3.46Å; K362-E366 PolarHBondContact O-N 3.02Å
363C79.4Confident78.5Confident3 Ų356 Ų562%0.0228%0.282CS..Hα-helixtrans-60.4-41.6179.7-67.50000111.9G339 V340 I359 T360 F361 N367 N368G339-C363 WeakPolarHBondContact O-CB 3.47Å; V340-C363 HydrophobicContact CB-CB 4.49Å; V340-C363 HydrophobicContact CG1-CB 4.07Å; I359-C363 WeakPolarHBondContact O-CB 3.14Å; I359-C363 PolarHBondContact O-N 2.96Å; I359-C363 PolarHBondContact O-SG 2.74Å; T360-C363 PolarHBondContact O-N 3.47Å; F361-C363 PolarHBondContact O-N 3.03Å; C363-N367 WeakPolarHBondContact O-CA 3.4Å; C363-N367 VanDerWaalsContact O-CB 3.26Å; C363-N367 WeakPolarHBondContact O-CB 3.18Å; C363-N367 PolarHBondContact O-N 3.27Å; C363-N368 PolarHBondContact O-N 3.29Å
364L89.3Confident78.5Confident0 Ų055.9 Ų55.90%028%0.281CS..Hα-helixtrans-66-38.5178.8-74.3-168.9000113.3F336 V340 T360 F361 K362 N368 H369 I370 A375 L379 A476 A479F336-L364 HydrophobicContact CE1-CD2 4.07Å; F336-L364 HydrophobicContact CE2-CD2 4.46Å; F336-L364 HydrophobicContact CZ-CD2 3.59Å; V340-L364 HydrophobicContact CG1-CD2 3.61Å; V340-L364 HydrophobicContact CG1-CG 4.35Å; T360-L364 WeakPolarHBondContact O-CG 3.47Å; T360-L364 PolarHBondContact O-N 3.27Å; F361-L364 PolarHBondContact O-N 3.36Å; K362-L364 VanDerWaalsContact C-N 3.32Å; K362-L364 PolarHBondContact O-N 3.2Å; L364-N368 HydrophobicContact CD2-CB 4.36Å; L364-N368 CarbonylContact O-C 3.6Å; L364-H369 PolarHBondContact O-N 3.22Å; L364-I370 HydrophobicContact CB-CB 4.26Å; L364-I370 HydrophobicContact CB-CG1 4.36Å; L364-I370 HydrophobicContact CD2-CG1 4.28Å; L364-I370 PolarHBondContact O-N 3.21Å; L364-A375 HydrophobicContact CD1-CB 4.5Å; L364-L379 HydrophobicContact CD1-CD1 3.77Å; L364-L379 HydrophobicContact CD1-CD2 3.89Å; L364-L379 HydrophobicContact CD1-CG 4.02Å; L364-A476 HydrophobicContact CD2-CB 4.26Å; L364-A479 HydrophobicContact CD1-CB 3.56Å
365L80.9Confident78.8Confident48 Ų4853.9 Ų53.925%0.25127%0.268SS..Hα-helixtrans-75-49.5179.7-70.7177.3000112.4F361 K362 H369 I370 R372F361-L365 HydrophobicContact CD1-CD1 3.68Å; F361-L365 HydrophobicContact CD1-CG 4.47Å; F361-L365 HydrophobicContact CE1-CD1 3.22Å; F361-L365 HydrophobicContact CE1-CG 4.23Å; F361-L365 HydrophobicContact CZ-CD1 3.78Å; F361-L365 WeakPolarHBondContact O-CG 3.4Å; F361-L365 PolarHBondContact O-N 3.15Å; F361-L365 VanDerWaalsContact O-N 3.15Å; K362-L365 PolarHBondContact O-N 2.77Å; L365-H369 WeakPolarHBondContact O-CA 3.44Å; L365-H369 PolarHBondContact O-N 3.4Å; L365-I370 WeakPolarHBondContact CD2-O 3.48Å; L365-R372 HydrophobicContact CD1-CG 4.37Å; L365-R372 HydrophobicContact CD2-CB 3.88Å; L365-R372 HydrophobicContact CD2-CG 4.26Å
366E84.7Confident79.3Confident112 Ų11257.9 Ų57.952%0.52327%0.27SS..Hα-helixtrans-83.5-42.3-170.8-66.5179.1-171.800112.3K362 H369K362-E366 WeakPolarHBondContact CE-OE1 3.25Å; K362-E366 WeakPolarHBondContact CE-OE2 3.33Å; K362-E366 HydrophobicContact CG-CG 4.31Å; K362-E366 WeakPolarHBondContact CG-OE1 3.33Å; K362-E366 IonicContact NZ-OE2 3.77Å; K362-E366 WeakPolarHBondContact O-CB 3.46Å; K362-E366 PolarHBondContact O-N 3.02Å; E366-H369 PolarHBondContact O-CE1 3.1Å; E366-H369 PolarHBondContact O-ND1 3.33Å
367N89Confident79.5Confident83 Ų8359.4 Ų59.444%0.44428%0.276SS..THydrogen-bonded Turntrans-94.8-36.4-174-56.6-24.9000112.5G339 C363G339-N367 WeakPolarHBondContact O-CB 3.29Å; G339-N367 PolarHBondContact O-ND2 3.03Å; C363-N367 WeakPolarHBondContact O-CA 3.4Å; C363-N367 VanDerWaalsContact O-CB 3.26Å; C363-N367 WeakPolarHBondContact O-CB 3.18Å; C363-N367 PolarHBondContact O-N 3.27Å
368N91.4Very high80.1Confident26 Ų2657.1 Ų57.114%0.13926%0.264CS..SBendtrans-106.5-4.9-174.4-64.424.6000113.3F336 G339 C363 L364 I370F336-N368 VanDerWaalsContact CD1-ND2 3.33Å; F336-N368 WeakPolarHBondContact CD1-ND2 3.29Å; F336-N368 HydrophobicContact CD2-CB 4.15Å; F336-N368 WeakPolarHBondContact CD2-ND2 3.09Å; F336-N368 WeakPolarHBondContact CE1-ND2 3.48Å; F336-N368 HydrophobicContact CE2-CB 3.82Å; F336-N368 WeakPolarHBondContact CE2-ND2 3.34Å; F336-N368 WeakPolarHBondContact CG-ND2 3.14Å; F336-N368 HydrophobicContact CZ-CB 4.37Å; F336-N368 VanDerWaalsContact CZ-ND2 3.3Å; F336-N368 WeakPolarHBondContact CZ-ND2 3.01Å; F336-N368 PolarHBondContact O-ND2 3.43Å; G339-N368 VanDerWaalsContact CA-OD1 3.23Å; G339-N368 WeakPolarHBondContact CA-OD1 3.48Å; C363-N368 PolarHBondContact O-N 3.29Å; L364-N368 HydrophobicContact CD2-CB 4.36Å; L364-N368 CarbonylContact O-C 3.6Å; N368-I370 VanDerWaalsContact C-N 3.29Å; N368-I370 HydrophobicContact CB-CG1 4.21Å; N368-I370 PolarHBondContact O-N 3.04Å
369H92.1Very high80.9Confident155 Ų15553 Ų5372%0.71824%0.237SC*.  trans52.142.1177.5-51.3-53.7000114L364 L365 E366L364-H369 PolarHBondContact O-N 3.22Å; L365-H369 WeakPolarHBondContact O-CA 3.44Å; L365-H369 PolarHBondContact O-N 3.4Å; E366-H369 PolarHBondContact O-CE1 3.1Å; E366-H369 PolarHBondContact O-ND1 3.33Å
370I90.3Very high80.8Confident18 Ų1853.2 Ų53.29%0.09224%0.243CC..  trans-78.5140.8173.6-61.5-56.8000110F336 L364 L365 N368 R372 I374 A375 A483F336-I370 HydrophobicContact CE2-CD1 4.08Å; F336-I370 HydrophobicContact CE2-CG1 4.25Å; L364-I370 HydrophobicContact CB-CB 4.26Å; L364-I370 HydrophobicContact CB-CG1 4.36Å; L364-I370 HydrophobicContact CD2-CG1 4.28Å; L364-I370 PolarHBondContact O-N 3.21Å; L365-I370 WeakPolarHBondContact CD2-O 3.48Å; N368-I370 VanDerWaalsContact C-N 3.29Å; N368-I370 HydrophobicContact CB-CG1 4.21Å; N368-I370 PolarHBondContact O-N 3.04Å; I370-R372 PolarHBondContact O-N 3.42Å; I370-I374 HydrophobicContact CG2-CB 4.38Å; I370-I374 HydrophobicContact CG2-CG2 4.49Å; I370-A375 HydrophobicContact CG2-CB 4.38Å; I370-A483 HydrophobicContact CD1-CB 3.76Å; I370-A483 HydrophobicContact CG2-CB 4.21Å
371D85Confident80.7Confident56 Ų5653.6 Ų53.630%0.29925%0.245SC..  trans-59.4133176.8-173.7-64.5000110.9R373 I374 A375D371-R373 PolarHBondContact O-N 2.83Å; D371-R373 WeakPolarHBondContact OD1-CB 3.41Å; D371-R373 WeakPolarHBondContact OD1-CG 3.05Å; D371-R373 IonicContact OD1-CZ 3.07Å; D371-R373 PolarHBondContact OD1-N 3.25Å; D371-R373 IonicContact OD1-NE 2.97Å; D371-R373 PolarHBondContact OD1-NE 2.95Å; D371-R373 VanDerWaalsContact OD1-NE 3.09Å; D371-R373 IonicContact OD1-NH2 3.89Å; D371-R373 IonicContact OD2-CZ 3.37Å; D371-R373 IonicContact OD2-NE 3.17Å; D371-R373 PolarHBondContact OD2-NE 3.34Å; D371-R373 IonicContact OD2-NH2 2.7Å; D371-R373 PolarHBondContact OD2-NH2 3.47Å; D371-I374 HydrophobicContact CB-CD1 4.2Å; D371-I374 HydrophobicContact CB-CG1 4.22Å; D371-I374 PolarHBondContact O-N 3.3Å; D371-I374 VanDerWaalsContact O-N 3.12Å; D371-A375 PolarHBondContact O-N 3.05Å
372R76.3Confident81Confident135 Ų13551.2 Ų51.251%0.50923%0.234SC..Hα-helixtrans-57.6-35-176.7-167.4178.2178.8174.91.1112.7F361 L365 I370 I374 R376F361-R372 HydrophobicContact CZ-CG 3.82Å; L365-R372 HydrophobicContact CD1-CG 4.37Å; L365-R372 HydrophobicContact CD2-CB 3.88Å; L365-R372 HydrophobicContact CD2-CG 4.26Å; I370-R372 PolarHBondContact O-N 3.42Å; R372-I374 VanDerWaalsContact C-N 3.35Å; R372-R376 HydrophobicContact CG-CG 4.38Å; R372-R376 VanDerWaalsContact O-CB 3.29Å; R372-R376 WeakPolarHBondContact O-CB 3.5Å; R372-R376 VanDerWaalsContact O-CG 3.27Å; R372-R376 WeakPolarHBondContact O-CG 3.28Å; R372-R376 PolarHBondContact O-N 3.02Å
373R75.4Confident81.3Confident90 Ų9046.6 Ų46.634%0.3422%0.215SC..Hα-helixtrans-64.7-42.4179.8-62.6171.7-73.8-167.5-4.7110.6D371 F377D371-R373 PolarHBondContact O-N 2.83Å; D371-R373 WeakPolarHBondContact OD1-CB 3.41Å; D371-R373 WeakPolarHBondContact OD1-CG 3.05Å; D371-R373 IonicContact OD1-CZ 3.07Å; D371-R373 PolarHBondContact OD1-N 3.25Å; D371-R373 IonicContact OD1-NE 2.97Å; D371-R373 PolarHBondContact OD1-NE 2.95Å; D371-R373 VanDerWaalsContact OD1-NE 3.09Å; D371-R373 IonicContact OD1-NH2 3.89Å; D371-R373 IonicContact OD2-CZ 3.37Å; D371-R373 IonicContact OD2-NE 3.17Å; D371-R373 PolarHBondContact OD2-NE 3.34Å; D371-R373 IonicContact OD2-NH2 2.7Å; D371-R373 PolarHBondContact OD2-NH2 3.47Å; R373-F377 WeakPolarHBondContact O-CB 3.39Å; R373-F377 PolarHBondContact O-N 2.83Å
374I82.9Confident81Confident2 Ų248 Ų481%0.0122%0.223CC..Hα-helixtrans-68.7-48.9178.2-56.4-178.9000110.1I370 D371 R372 R376 F377 V378 M482 A483 F490I370-I374 HydrophobicContact CG2-CB 4.38Å; I370-I374 HydrophobicContact CG2-CG2 4.49Å; D371-I374 HydrophobicContact CB-CD1 4.2Å; D371-I374 HydrophobicContact CB-CG1 4.22Å; D371-I374 PolarHBondContact O-N 3.3Å; D371-I374 VanDerWaalsContact O-N 3.12Å; R372-I374 VanDerWaalsContact C-N 3.35Å; I374-R376 VanDerWaalsContact C-N 3.29Å; I374-R376 PolarHBondContact O-N 3.11Å; I374-F377 PolarHBondContact O-N 3.27Å; I374-F377 VanDerWaalsContact O-N 3.16Å; I374-V378 HydrophobicContact CG2-CG2 3.76Å; I374-V378 WeakPolarHBondContact O-CB 3.36Å; I374-V378 VanDerWaalsContact O-CG2 3.31Å; I374-V378 WeakPolarHBondContact O-CG2 3.19Å; I374-V378 PolarHBondContact O-N 3.49Å; I374-M482 HydrophobicContact CG2-CB 3.99Å; I374-A483 VanDerWaalsContact CD1-CA 3.41Å; I374-A483 HydrophobicContact CD1-CB 3.78Å; I374-F490 HydrophobicContact CD1-CD2 3.83Å; I374-F490 HydrophobicContact CD1-CE2 3.41Å; I374-F490 VanDerWaalsContact CD1-CE2 3.41Å; I374-F490 HydrophobicContact CD1-CZ 4.17Å; I374-F490 HydrophobicContact CG1-CD2 4.29Å; I374-F490 HydrophobicContact CG1-CE2 3.55Å; I374-F490 HydrophobicContact CG1-CZ 3.78Å
375A77.8Confident80.6Confident0 Ų048.4 Ų48.40%023%0.226CC..Hα-helixtrans-61.1-37.1179.700000112.6F361 L364 I370 D371 F377 L379F361-A375 HydrophobicContact CD2-CB 3.91Å; F361-A375 HydrophobicContact CE2-CB 3.67Å; L364-A375 HydrophobicContact CD1-CB 4.5Å; I370-A375 HydrophobicContact CG2-CB 4.38Å; D371-A375 PolarHBondContact O-N 3.05Å; A375-F377 VanDerWaalsContact C-N 3.27Å; A375-F377 PolarHBondContact O-N 3.02Å; A375-L379 WeakPolarHBondContact O-CB 3.49Å; A375-L379 PolarHBondContact O-N 3.25Å
376R70.6Confident81Confident143 Ų14346.1 Ų46.154%0.5421%0.214SC..Hα-helixtrans-69.5-26.6178.9-82.7-177.2162.9173.4-16.8113.1F361 R372 I374 P380F361-R376 HydrophobicContact CE2-CB 4.21Å; F361-R376 HydrophobicContact CE2-CG 3.42Å; F361-R376 VanDerWaalsContact CE2-CG 3.42Å; F361-R376 HydrophobicContact CZ-CG 3.51Å; R372-R376 HydrophobicContact CG-CG 4.38Å; R372-R376 VanDerWaalsContact O-CB 3.29Å; R372-R376 WeakPolarHBondContact O-CB 3.5Å; R372-R376 VanDerWaalsContact O-CG 3.27Å; R372-R376 WeakPolarHBondContact O-CG 3.28Å; R372-R376 PolarHBondContact O-N 3.02Å; I374-R376 VanDerWaalsContact C-N 3.29Å; I374-R376 PolarHBondContact O-N 3.11Å; R376-P380 VanDerWaalsContact O-CD 3.27Å; R376-P380 WeakPolarHBondContact O-CD 3.46Å; R376-P380 VanDerWaalsContact O-CG 3.31Å; R376-P380 WeakPolarHBondContact O-CG 3.38Å
377F74.2Confident81.3Confident33 Ų3341 Ų4115%0.14519%0.19CC..Hα-helixtrans-90-52.3179.6-177.9-90.6000111.3L90 L98 G99 R373 I374 A375 V381L90-F377 HydrophobicContact CD2-CE1 4.37Å; L90-F377 HydrophobicContact CD2-CE2 4.02Å; L90-F377 HydrophobicContact CD2-CZ 3.5Å; L90-F377 VanDerWaalsContact CD2-CZ 3.5Å; L98-F377 HydrophobicContact CD2-CB 4.17Å; L98-F377 HydrophobicContact CD2-CD1 3.74Å; L98-F377 HydrophobicContact CD2-CE1 4.41Å; L98-F377 HydrophobicContact CD2-CG 4.02Å; L98-F377 HydrophobicContact CG-CD1 3.93Å; L98-F377 HydrophobicContact CG-CE1 4.19Å; G99-F377 VanDerWaalsContact CA-CZ 3.48Å; R373-F377 WeakPolarHBondContact O-CB 3.39Å; R373-F377 PolarHBondContact O-N 2.83Å; I374-F377 PolarHBondContact O-N 3.27Å; I374-F377 VanDerWaalsContact O-N 3.16Å; A375-F377 VanDerWaalsContact C-N 3.27Å; A375-F377 PolarHBondContact O-N 3.02Å; F377-V381 WeakPolarHBondContact O-CG2 3.19Å
378V84.5Confident81.6Confident0 Ų037 Ų370%017%0.168CC..Hα-helixtrans-70.4-42.9-169.3176.70000112.2L98 T102 Y106 I374 G382 A478 A479 M482L98-V378 HydrophobicContact CD1-CG2 4.48Å; T102-V378 HydrophobicContact CG2-CB 4.47Å; T102-V378 HydrophobicContact CG2-CG1 4.02Å; T102-V378 HydrophobicContact CG2-CG2 4.21Å; Y106-V378 WeakPolarHBondContact OH-CG1 3.22Å; Y106-V378 PolarHBondContact OH-O 2.85Å; I374-V378 HydrophobicContact CG2-CG2 3.76Å; I374-V378 WeakPolarHBondContact O-CB 3.36Å; I374-V378 VanDerWaalsContact O-CG2 3.31Å; I374-V378 WeakPolarHBondContact O-CG2 3.19Å; I374-V378 PolarHBondContact O-N 3.49Å; V378-G382 PolarHBondContact O-N 3.37Å; V378-A478 HydrophobicContact CG1-CB 4.12Å; V378-A479 HydrophobicContact CB-CB 4.22Å; V378-A479 HydrophobicContact CG1-CB 3.94Å; V378-M482 HydrophobicContact CG2-CB 4.23Å; V378-M482 HydrophobicContact CG2-CG 4.12Å
379L79.9Confident81.7Confident1 Ų135.8 Ų35.81%0.00516%0.162CC..Hα-helixtrans-70.5-47.1-172.8-65.7-178.8000114.1L357 T360 F361 L364 A375 V381 G382 A383 D475 A479L357-L379 HydrophobicContact CD1-CB 3.53Å; T360-L379 HydrophobicContact CG2-CD1 3.92Å; T360-L379 HydrophobicContact CG2-CD2 3.89Å; F361-L379 HydrophobicContact CB-CD1 4.12Å; F361-L379 HydrophobicContact CD2-CD1 4.15Å; L364-L379 HydrophobicContact CD1-CD1 3.77Å; L364-L379 HydrophobicContact CD1-CD2 3.89Å; L364-L379 HydrophobicContact CD1-CG 4.02Å; A375-L379 WeakPolarHBondContact O-CB 3.49Å; A375-L379 PolarHBondContact O-N 3.25Å; L379-V381 VanDerWaalsContact C-N 3.31Å; L379-V381 PolarHBondContact O-N 3.03Å; L379-G382 PolarHBondContact O-N 2.84Å; L379-A383 PolarHBondContact O-N 2.97Å; L379-D475 HydrophobicContact CD2-CB 3.83Å; L379-A479 HydrophobicContact CD2-CB 4.49Å
380P70.1Confident81.8Confident57 Ų5728.6 Ų28.637%0.3713%0.129SC..Hα-helixtrans-64.7-36.8178.8-22.635.6000112.6L357 R376L357-P380 HydrophobicContact CD2-CB 4.35Å; L357-P380 HydrophobicContact CD2-CG 4.25Å; R376-P380 VanDerWaalsContact O-CD 3.27Å; R376-P380 WeakPolarHBondContact O-CD 3.46Å; R376-P380 VanDerWaalsContact O-CG 3.31Å; R376-P380 WeakPolarHBondContact O-CG 3.38Å
381V77Confident82Confident11 Ų1127.8 Ų27.87%0.06713%0.125CC..Hα-helixtrans-65.4-44.1174.6176.60000110.3L90 Y106 F377 L379 T384 I385L90-V381 HydrophobicContact CD2-CG1 4.35Å; L90-V381 HydrophobicContact CD2-CG2 4.03Å; Y106-V381 HydrophobicContact CE2-CG1 4.19Å; F377-V381 WeakPolarHBondContact O-CG2 3.19Å; L379-V381 VanDerWaalsContact C-N 3.31Å; L379-V381 PolarHBondContact O-N 3.03Å; V381-T384 PolarHBondContact O-N 3.35Å; V381-I385 HydrophobicContact CG1-CD1 3.64Å; V381-I385 HydrophobicContact CG1-CG1 4.27Å; V381-I385 WeakPolarHBondContact O-CB 3.4Å; V381-I385 WeakPolarHBondContact O-CG1 3.29Å; V381-I385 PolarHBondContact O-N 2.86Å
382G81.4Confident82.6Confident0 Ų025.1 Ų25.10%011%0.11CC..Hα-helixtrans-60.8-44.9177.600000113.3Y106 V378 L379 T384 I385 N386 D475Y106-G382 VanDerWaalsContact CE2-CA 3.45Å; Y106-G382 WeakPolarHBondContact OH-CA 3.3Å; V378-G382 PolarHBondContact O-N 3.37Å; L379-G382 PolarHBondContact O-N 2.84Å; G382-T384 PolarHBondContact O-N 3.09Å; G382-I385 PolarHBondContact O-N 2.85Å; G382-N386 WeakPolarHBondContact O-CA 3.41Å; G382-N386 WeakPolarHBondContact O-CB 3.39Å; G382-N386 PolarHBondContact O-N 3.24Å; G382-D475 VanDerWaalsContact C-OD2 3.27Å; G382-D475 VanDerWaalsContact CA-OD1 3.27Å; G382-D475 WeakPolarHBondContact CA-OD1 3.36Å
383A76Confident83.5Confident5 Ų518.7 Ų18.74%0.0419%0.086CC..Hα-helixtrans-59-16.5179.400000114.3L357 L379 M387 D475L357-A383 HydrophobicContact CD1-CB 4.43Å; L379-A383 PolarHBondContact O-N 2.97Å; A383-M387 WeakPolarHBondContact O-CE 3.28Å; A383-D475 PolarHBondContact N-OD2 3.36Å
384T73Confident84.4Confident32 Ų3214.4 Ų14.420%0.1967%0.07CC..Hα-helixtrans-104.6-47.9174.6-48.50000112V381 G382V381-T384 PolarHBondContact O-N 3.35Å; G382-T384 PolarHBondContact O-N 3.09Å
385I81.1Confident85Confident9 Ų914.3 Ų14.35%0.0467%0.07CC..Hα-helixtrans-89.1-39.7-169.7-59.9-175.5000112.3L87 Y106 V381 G382 M387 I426L87-I385 HydrophobicContact CD2-CD1 3.88Å; Y106-I385 HydrophobicContact CD2-CB 4.46Å; Y106-I385 HydrophobicContact CD2-CG2 4.37Å; V381-I385 HydrophobicContact CG1-CD1 3.64Å; V381-I385 HydrophobicContact CG1-CG1 4.27Å; V381-I385 WeakPolarHBondContact O-CB 3.4Å; V381-I385 WeakPolarHBondContact O-CG1 3.29Å; V381-I385 PolarHBondContact O-N 2.86Å; G382-I385 PolarHBondContact O-N 2.85Å; I385-M387 PolarHBondContact O-N 2.84Å; I385-I426 HydrophobicContact CB-CG2 4.42Å; I385-I426 HydrophobicContact CG1-CG2 4.28Å; I385-I426 HydrophobicContact CG2-CG1 4.26Å; I385-I426 HydrophobicContact CG2-CG2 4.13Å
386N88.1Confident85.9Confident1 Ų114.3 Ų14.31%0.0057%0.07CC..  trans-93.476.8-166.2-173.543.4000112Y106 G382 D388 D475Y106-N386 HydrophobicContact CD1-CB 3.41Å; Y106-N386 VanDerWaalsContact CD1-CB 3.41Å; Y106-N386 WeakPolarHBondContact CD1-ND2 3.11Å; Y106-N386 WeakPolarHBondContact CD1-OD1 3.4Å; Y106-N386 HydrophobicContact CD2-CB 3.89Å; Y106-N386 HydrophobicContact CE1-CB 3.62Å; Y106-N386 VanDerWaalsContact CE1-CG 3.49Å; Y106-N386 WeakPolarHBondContact CE1-ND2 3.37Å; Y106-N386 HydrophobicContact CE2-CB 4.08Å; Y106-N386 HydrophobicContact CG-CB 3.55Å; G382-N386 WeakPolarHBondContact O-CA 3.41Å; G382-N386 WeakPolarHBondContact O-CB 3.39Å; G382-N386 PolarHBondContact O-N 3.24Å; N386-D388 PolarHBondContact OD1-OD1 3.42Å; N386-D475 VanDerWaalsContact CB-OD1 3.26Å; N386-D475 WeakPolarHBondContact CB-OD1 3.3Å; N386-D475 PolarHBondContact ND2-N 3.42Å; N386-D475 PolarHBondContact ND2-OD1 2.82Å
387M90.9Very high87Confident3 Ų37.5 Ų7.52%0.0154%0.044CC..  trans-108.351.5-173.3-71.8-121171.100112.8A383 I385 G389 T390 A391 S425 A428 A429A383-M387 WeakPolarHBondContact O-CE 3.28Å; I385-M387 PolarHBondContact O-N 2.84Å; M387-G389 VanDerWaalsContact C-N 3.34Å; M387-G389 PolarHBondContact O-N 3.4Å; M387-T390 WeakPolarHBondContact O-CA 3.24Å; M387-T390 WeakPolarHBondContact O-CB 3.44Å; M387-T390 PolarHBondContact O-N 2.98Å; M387-T390 PolarHBondContact SD-OG1 3.33Å; M387-A391 PolarHBondContact O-N 2.96Å; M387-S425 VanDerWaalsContact CB-O 3.23Å; M387-S425 WeakPolarHBondContact CB-O 3.48Å; M387-S425 VanDerWaalsContact CG-O 3.26Å; M387-S425 WeakPolarHBondContact CG-O 3.25Å; M387-A428 HydrophobicContact CE-CB 4.48Å; M387-A428 WeakPolarHBondContact CE-O 3.41Å; M387-A428 HydrophobicContact SD-CB 3.55Å; M387-A428 VanDerWaalsContact SD-CB 3.55Å; M387-A428 VanDerWaalsContact SD-O 3.42Å; M387-A429 VanDerWaalsContact CE-C 3.41Å
388D95.1Very high87.9Confident0 Ų05.9 Ų5.90%04%0.037CC..Hα-helixtrans-48.7-49.3-177.6-73.5-1.1000114.3T110 A113 H316 N386 T390 A391 L392 I470 N471T110-D388 WeakPolarHBondContact CA-OD1 3.34Å; T110-D388 WeakPolarHBondContact CB-OD1 3.27Å; T110-D388 PolarHBondContact N-OD1 3.22Å; T110-D388 PolarHBondContact OG1-OD1 3.11Å; A113-D388 HydrophobicContact CB-CB 4.02Å; A113-D388 WeakPolarHBondContact CB-O 3.46Å; H316-D388 IonicContact CD2-OD2 2.69Å; H316-D388 IonicContact CE1-OD2 3.53Å; H316-D388 WeakPolarHBondContact NE2-CB 3.44Å; H316-D388 IonicContact NE2-OD2 2.68Å; H316-D388 PolarHBondContact NE2-OD2 3.37Å; N386-D388 PolarHBondContact OD1-OD1 3.42Å; D388-T390 VanDerWaalsContact C-N 3.29Å; D388-T390 PolarHBondContact O-N 3.45Å; D388-A391 PolarHBondContact O-N 2.87Å; D388-L392 WeakPolarHBondContact O-CB 3.34Å; D388-L392 PolarHBondContact O-N 3.37Å; D388-I470 HydrophobicContact CB-CG2 4.45Å; D388-N471 PolarHBondContact N-OD1 2.98Å
389G94.4Very high88.4Confident0 Ų06.3 Ų6.30%04%0.039CC..Hα-helixtrans-67-32.7-179.600000112.6L313 M387 Y393 R467 N471L313-G389 VanDerWaalsContact CD2-CA 3.43Å; M387-G389 VanDerWaalsContact C-N 3.34Å; M387-G389 PolarHBondContact O-N 3.4Å; G389-Y393 VanDerWaalsContact O-CB 3.24Å; G389-Y393 WeakPolarHBondContact O-CB 3.45Å; G389-Y393 PolarHBondContact O-N 3.49Å; G389-Y393 VanDerWaalsContact O-N 3.13Å; G389-R467 WeakPolarHBondContact O-CD 3.3Å; G389-R467 WeakPolarHBondContact O-CG 3.44Å; G389-N471 WeakPolarHBondContact CA-OD1 3.28Å; G389-N471 PolarHBondContact N-OD1 3.2Å
390T93.3Very high89Confident5 Ų56.5 Ų6.53%0.0314%0.04CC..Hα-helixtrans-69.5-47.4174.7-49.50000110.6M387 D388 L392 Y393 E394 A428 N471M387-T390 WeakPolarHBondContact O-CA 3.24Å; M387-T390 WeakPolarHBondContact O-CB 3.44Å; M387-T390 PolarHBondContact O-N 2.98Å; M387-T390 PolarHBondContact SD-OG1 3.33Å; D388-T390 VanDerWaalsContact C-N 3.29Å; D388-T390 PolarHBondContact O-N 3.45Å; T390-L392 PolarHBondContact O-N 3.44Å; T390-Y393 WeakPolarHBondContact O-CB 3.35Å; T390-Y393 PolarHBondContact O-N 3.21Å; T390-E394 HydrophobicContact CG2-CG 4.5Å; T390-E394 WeakPolarHBondContact O-CB 3.36Å; T390-E394 WeakPolarHBondContact O-CG 3.32Å; T390-E394 PolarHBondContact O-N 3.25Å; T390-A428 HydrophobicContact CG2-CB 4.04Å; T390-N471 PolarHBondContact OG1-ND2 2.95Å
391A95.4Very high89.9Confident0 Ų03.9 Ų3.90%02%0.023CC..Hα-helixtrans-63.2-43.9-179.800000112.3T110 V114 M387 D388 E394 A395T110-A391 HydrophobicContact CG2-CB 3.46Å; T110-A391 VanDerWaalsContact CG2-CB 3.46Å; V114-A391 HydrophobicContact CG2-CB 3.49Å; V114-A391 VanDerWaalsContact CG2-CB 3.49Å; M387-A391 PolarHBondContact O-N 2.96Å; D388-A391 PolarHBondContact O-N 2.87Å; A391-E394 PolarHBondContact O-N 3.5Å; A391-A395 PolarHBondContact O-N 3.03Å; A391-A395 VanDerWaalsContact O-N 3.09Å
392L97.2Very high90.5Very high0 Ų03.4 Ų3.40%02%0.02CC..Hα-helixtrans-59-49.5174.6-175.7156000110.9A113 V116 G312 L313 H316 D388 T390 E394 A395 V396A113-L392 HydrophobicContact CB-CB 4.17Å; A113-L392 WeakPolarHBondContact O-CD1 3.44Å; A113-L392 WeakPolarHBondContact O-CG 3.21Å; V116-L392 HydrophobicContact CB-CD1 4.4Å; V116-L392 HydrophobicContact CG1-CD1 4.18Å; G312-L392 VanDerWaalsContact C-CD1 3.48Å; G312-L392 WeakPolarHBondContact O-CD1 3.22Å; L313-L392 HydrophobicContact CD2-CD1 4.48Å; L313-L392 HydrophobicContact CD2-CD2 4.29Å; L313-L392 HydrophobicContact CG-CD2 4.34Å; H316-L392 HydrophobicContact CB-CD1 4.12Å; D388-L392 WeakPolarHBondContact O-CB 3.34Å; D388-L392 PolarHBondContact O-N 3.37Å; T390-L392 PolarHBondContact O-N 3.44Å; L392-E394 VanDerWaalsContact C-N 3.3Å; L392-E394 PolarHBondContact O-N 3.41Å; L392-A395 PolarHBondContact O-N 3.25Å; L392-V396 HydrophobicContact CD2-CG2 4.02Å; L392-V396 VanDerWaalsContact O-CG2 3.27Å; L392-V396 WeakPolarHBondContact O-CG2 3.41Å; L392-V396 PolarHBondContact O-N 2.88Å
393Y95.2Very high90.8Very high0 Ų04.4 Ų4.40%03%0.025CC..Hα-helixtrans-57.8-44176.9159.8-88.1000111.9Y305 V309 G389 T390 A395 V396 A397 L436 M439 I456 D460 L463 R467Y305-Y393 WeakPolarHBondContact OH-CD2 3.27Å; Y305-Y393 WeakPolarHBondContact OH-CE2 3.44Å; V309-Y393 HydrophobicContact CG1-CD2 4.29Å; V309-Y393 HydrophobicContact CG2-CD2 4.4Å; G389-Y393 VanDerWaalsContact O-CB 3.24Å; G389-Y393 WeakPolarHBondContact O-CB 3.45Å; G389-Y393 PolarHBondContact O-N 3.49Å; G389-Y393 VanDerWaalsContact O-N 3.13Å; T390-Y393 WeakPolarHBondContact O-CB 3.35Å; T390-Y393 PolarHBondContact O-N 3.21Å; Y393-A395 PolarHBondContact O-N 3.43Å; Y393-V396 PolarHBondContact O-N 3.12Å; Y393-A397 PolarHBondContact O-N 3.38Å; Y393-L436 VanDerWaalsContact OH-CD2 3.22Å; Y393-L436 WeakPolarHBondContact OH-CD2 3.39Å; Y393-M439 HydrophobicContact CD1-CE 3.96Å; Y393-M439 HydrophobicContact CE1-CE 3.41Å; Y393-M439 VanDerWaalsContact CE1-CE 3.41Å; Y393-I456 WeakPolarHBondContact OH-CD1 3.48Å; Y393-D460 WeakPolarHBondContact CE2-OD1 3.39Å; Y393-D460 PolarHBondContact OH-OD1 3.32Å; Y393-D460 VanDerWaalsContact OH-OD1 3.09Å; Y393-L463 HydrophobicContact CE2-CD1 4.5Å; Y393-R467 VanDerWaalsContact CB-CD 3.47Å; Y393-R467 VanDerWaalsContact CD2-NH1 3.26Å
394E94.4Very high91.2Very high0 Ų05.4 Ų5.40%03%0.03CC..Hα-helixtrans-60.7-47.2-178.2-81.7175.7-172.900112.2T390 A391 L392 A397 A398 A421 A424 T438 M439 V442T390-E394 HydrophobicContact CG2-CG 4.5Å; T390-E394 WeakPolarHBondContact O-CB 3.36Å; T390-E394 WeakPolarHBondContact O-CG 3.32Å; T390-E394 PolarHBondContact O-N 3.25Å; A391-E394 PolarHBondContact O-N 3.5Å; L392-E394 VanDerWaalsContact C-N 3.3Å; L392-E394 PolarHBondContact O-N 3.41Å; E394-A397 PolarHBondContact O-N 3.16Å; E394-A398 WeakPolarHBondContact O-CB 3.32Å; E394-A398 PolarHBondContact O-N 3.07Å; E394-A421 HydrophobicContact CB-CB 3.93Å; E394-A421 WeakPolarHBondContact OE2-CA 3.43Å; E394-A424 WeakPolarHBondContact OE2-CB 3.4Å; E394-T438 WeakPolarHBondContact OE1-CB 3.44Å; E394-T438 PolarHBondContact OE1-OG1 3.36Å; E394-M439 VanDerWaalsContact CA-CE 3.48Å; E394-M439 HydrophobicContact CB-CE 4.27Å; E394-M439 HydrophobicContact CG-CE 4.12Å; E394-V442 HydrophobicContact CB-CG2 4.17Å; E394-V442 HydrophobicContact CG-CG2 4.42Å
395A95.7Very high91.6Very high0 Ų06.1 Ų6.10%03%0.033CC..Hα-helixtrans-62.9-44176.500000112V114 I118 A391 L392 Y393 I399 I417 A421V114-A395 HydrophobicContact CG1-CB 3.98Å; I118-A395 HydrophobicContact CG1-CB 4Å; A391-A395 PolarHBondContact O-N 3.03Å; A391-A395 VanDerWaalsContact O-N 3.09Å; L392-A395 PolarHBondContact O-N 3.25Å; Y393-A395 PolarHBondContact O-N 3.43Å; A395-I399 WeakPolarHBondContact O-CG1 3.28Å; A395-I399 PolarHBondContact O-N 2.93Å; A395-I417 HydrophobicContact CB-CG2 4.15Å; A395-A421 HydrophobicContact CB-CB 4.36Å
396V96.4Very high91.6Very high0 Ų09.8 Ų9.80%05%0.053CC..Hα-helixtrans-63.9-45.3178.9173.30000111.2G117 V121 Y305 T308 V309 L392 Y393 F400G117-V396 WeakPolarHBondContact O-CG2 3.31Å; V121-V396 HydrophobicContact CB-CB 4.48Å; V121-V396 HydrophobicContact CB-CG1 4.1Å; V121-V396 HydrophobicContact CB-CG2 4.31Å; V121-V396 HydrophobicContact CG2-CG1 4.11Å; Y305-V396 HydrophobicContact CD2-CG1 4.11Å; Y305-V396 HydrophobicContact CE2-CG1 3.95Å; T308-V396 HydrophobicContact CG2-CG1 3.79Å; V309-V396 HydrophobicContact CG2-CB 4.13Å; V309-V396 HydrophobicContact CG2-CG1 3.6Å; L392-V396 HydrophobicContact CD2-CG2 4.02Å; L392-V396 VanDerWaalsContact O-CG2 3.27Å; L392-V396 WeakPolarHBondContact O-CG2 3.41Å; L392-V396 PolarHBondContact O-N 2.88Å; Y393-V396 PolarHBondContact O-N 3.12Å; V396-F400 VanDerWaalsContact O-CB 3.25Å; V396-F400 WeakPolarHBondContact O-CB 3.4Å; V396-F400 PolarHBondContact O-N 3.12Å
397A93.8Very high91.2Very high0 Ų011.4 Ų11.40%06%0.059CC..Hα-helixtrans-73.4-34.9-178.200000113Y305 Y393 E394 I399 F400 I401 M439 I456Y305-A397 HydrophobicContact CE2-CB 3.61Å; Y305-A397 WeakPolarHBondContact OH-CB 3.31Å; Y393-A397 PolarHBondContact O-N 3.38Å; E394-A397 PolarHBondContact O-N 3.16Å; A397-I399 VanDerWaalsContact C-N 3.35Å; A397-I399 PolarHBondContact O-N 3.13Å; A397-F400 PolarHBondContact O-N 3.3Å; A397-I401 WeakPolarHBondContact O-CB 3.46Å; A397-I401 VanDerWaalsContact O-CG1 3.29Å; A397-I401 WeakPolarHBondContact O-CG1 3.45Å; A397-I401 PolarHBondContact O-N 3.34Å; A397-M439 HydrophobicContact CB-CE 3.16Å; A397-M439 HydrophobicContact CB-SD 4.24Å; A397-I456 HydrophobicContact CB-CD1 3.68Å
398A93.1Very high90.7Very high0 Ų019.5 Ų19.50%010%0.097CC..Hα-helixtrans-59.8-46.5174.100000111.5E394 I401 A402 I417 V442 L443E394-A398 WeakPolarHBondContact O-CB 3.32Å; E394-A398 PolarHBondContact O-N 3.07Å; A398-I401 PolarHBondContact O-N 3.21Å; A398-A402 PolarHBondContact O-N 2.95Å; A398-I417 HydrophobicContact CB-CD1 4.22Å; A398-I417 HydrophobicContact CB-CG1 4.35Å; A398-I417 HydrophobicContact CB-CG2 4.1Å; A398-V442 HydrophobicContact CB-CG1 3.77Å; A398-L443 HydrophobicContact CB-CD2 4Å
399I94Very high90Very high9 Ų921.3 Ų21.35%0.04611%0.106CC..Hα-helixtrans-68.7-39.2177.2-64.4169000111I118 V121 A395 A397 A402 Q403 L409 I417I118-I399 HydrophobicContact CB-CD1 4.28Å; I118-I399 HydrophobicContact CG1-CD1 3.87Å; I118-I399 HydrophobicContact CG2-CD1 4.08Å; V121-I399 HydrophobicContact CB-CG2 4.49Å; V121-I399 HydrophobicContact CG1-CB 3.82Å; V121-I399 HydrophobicContact CG1-CD1 3.61Å; V121-I399 HydrophobicContact CG1-CG1 4.3Å; V121-I399 HydrophobicContact CG1-CG2 3.72Å; V121-I399 HydrophobicContact CG2-CB 4.16Å; V121-I399 HydrophobicContact CG2-CG2 3.92Å; A395-I399 WeakPolarHBondContact O-CG1 3.28Å; A395-I399 PolarHBondContact O-N 2.93Å; A397-I399 VanDerWaalsContact C-N 3.35Å; A397-I399 PolarHBondContact O-N 3.13Å; I399-A402 WeakPolarHBondContact O-CB 3.18Å; I399-A402 PolarHBondContact O-N 3.44Å; I399-Q403 HydrophobicContact CG2-CG 4.37Å; I399-Q403 VanDerWaalsContact O-CG 3.27Å; I399-Q403 WeakPolarHBondContact O-CG 3.49Å; I399-Q403 PolarHBondContact O-N 2.86Å; I399-L409 HydrophobicContact CB-CD1 4.36Å; I399-L409 HydrophobicContact CG1-CD1 3.93Å; I399-L409 HydrophobicContact CG2-CD1 4.39Å; I399-I417 HydrophobicContact CG1-CD1 4.08Å
400F93.1Very high89.4Confident5 Ų525.1 Ų25.12%0.02213%0.126CC..Hα-helixtrans-60.6-46174.7168.5-111.1000112.2P126 K301 Y305 V396 A397 A402 Q403 V404 I456P126-F400 HydrophobicContact CB-CD2 3.93Å; P126-F400 HydrophobicContact CB-CE2 4.23Å; P126-F400 HydrophobicContact CG-CB 4.46Å; P126-F400 HydrophobicContact CG-CD2 3.82Å; K301-F400 HydrophobicContact CB-CE2 4.16Å; K301-F400 HydrophobicContact CB-CZ 4.23Å; Y305-F400 HydrophobicContact CD2-CB 3.82Å; Y305-F400 AromaticContact CD2-CD1 3.64Å; Y305-F400 HydrophobicContact CD2-CD1 3.64Å; Y305-F400 HydrophobicContact CD2-CD2 4.27Å; Y305-F400 HydrophobicContact CD2-CE1 4.25Å; Y305-F400 AromaticContact CD2-CG 3.64Å; Y305-F400 HydrophobicContact CD2-CG 3.64Å; Y305-F400 HydrophobicContact CE2-CB 4.32Å; Y305-F400 HydrophobicContact CE2-CD1 4.18Å; Y305-F400 HydrophobicContact CE2-CG 4.4Å; Y305-F400 AromaticContact CG-CD1 3.89Å; Y305-F400 HydrophobicContact CG-CD1 3.89Å; Y305-F400 HydrophobicContact CG-CD2 4.44Å; Y305-F400 HydrophobicContact CG-CE1 4.02Å; Y305-F400 HydrophobicContact CG-CG 4.1Å; Y305-F400 HydrophobicContact CG-CZ 4.33Å; V396-F400 VanDerWaalsContact O-CB 3.25Å; V396-F400 WeakPolarHBondContact O-CB 3.4Å; V396-F400 PolarHBondContact O-N 3.12Å; A397-F400 PolarHBondContact O-N 3.3Å; F400-A402 VanDerWaalsContact C-N 3.3Å; F400-A402 PolarHBondContact O-N 2.69Å; F400-Q403 WeakPolarHBondContact O-CB 3.27Å; F400-Q403 PolarHBondContact O-N 2.91Å; F400-V404 HydrophobicContact CD1-CG2 4.42Å; F400-V404 HydrophobicContact CD2-CG2 3.84Å; F400-V404 HydrophobicContact CE1-CG2 4.02Å; F400-V404 HydrophobicContact CE2-CG2 3.4Å; F400-V404 VanDerWaalsContact CE2-CG2 3.4Å; F400-V404 HydrophobicContact CG-CG2 4.35Å; F400-V404 HydrophobicContact CZ-CG2 3.51Å; F400-V404 VanDerWaalsContact O-CG2 3.31Å; F400-V404 WeakPolarHBondContact O-CG2 3.45Å; F400-V404 PolarHBondContact O-N 3.17Å; F400-I456 HydrophobicContact CD1-CG2 4.01Å; F400-I456 HydrophobicContact CE1-CG2 3.84Å
401I89.3Confident88.8Confident2 Ų232 Ų321%0.0116%0.156CC..Hα-helixtrans-61.4-41.2176.9-73.3168.2000110.3A397 A398 V404 N405 L443 D452 I456A397-I401 WeakPolarHBondContact O-CB 3.46Å; A397-I401 VanDerWaalsContact O-CG1 3.29Å; A397-I401 WeakPolarHBondContact O-CG1 3.45Å; A397-I401 PolarHBondContact O-N 3.34Å; A398-I401 PolarHBondContact O-N 3.21Å; I401-V404 PolarHBondContact O-N 3.29Å; I401-N405 WeakPolarHBondContact O-CB 3.32Å; I401-N405 PolarHBondContact O-N 2.83Å; I401-N405 PolarHBondContact O-ND2 3.33Å; I401-L443 HydrophobicContact CB-CD2 4.37Å; I401-L443 HydrophobicContact CD1-CD1 3.79Å; I401-L443 HydrophobicContact CD1-CD2 4.01Å; I401-L443 HydrophobicContact CG2-CD2 4.32Å; I401-D452 HydrophobicContact CD1-CB 4.34Å; I401-D452 HydrophobicContact CG1-CB 4.27Å; I401-D452 HydrophobicContact CG2-CB 3.75Å; I401-I456 HydrophobicContact CD1-CD1 4.31Å
402A88.8Confident87.8Confident1 Ų132.9 Ų32.91%0.00817%0.165CC..Hα-helixtrans-58.7-48.8173.400000111.7A398 I399 F400 V404 N405 N406 Y407 L409 L448A398-A402 PolarHBondContact O-N 2.95Å; I399-A402 WeakPolarHBondContact O-CB 3.18Å; I399-A402 PolarHBondContact O-N 3.44Å; F400-A402 VanDerWaalsContact C-N 3.3Å; F400-A402 PolarHBondContact O-N 2.69Å; A402-V404 PolarHBondContact O-N 3.3Å; A402-N405 PolarHBondContact O-N 3.11Å; A402-N406 PolarHBondContact O-N 3.46Å; A402-Y407 PolarHBondContact O-N 3.42Å; A402-L409 HydrophobicContact CB-CD1 3.56Å; A402-L409 HydrophobicContact CB-CD2 3.95Å; A402-L409 HydrophobicContact CB-CG 3.66Å; A402-L448 HydrophobicContact CB-CD1 4.06Å; A402-L448 HydrophobicContact CB-CD2 4.12Å
403Q89.6Confident87.1Confident20 Ų2033 Ų339%0.09317%0.166CC..Hα-helixtrans-61.3-43.2178.2-69.4170.80.500112.6H125 I399 F400 N405 N406H125-Q403 PolarHBondContact CE1-NE2 2.8Å; H125-Q403 PolarHBondContact ND1-NE2 2.88Å; I399-Q403 HydrophobicContact CG2-CG 4.37Å; I399-Q403 VanDerWaalsContact O-CG 3.27Å; I399-Q403 WeakPolarHBondContact O-CG 3.49Å; I399-Q403 PolarHBondContact O-N 2.86Å; F400-Q403 WeakPolarHBondContact O-CB 3.27Å; F400-Q403 PolarHBondContact O-N 2.91Å; Q403-N405 PolarHBondContact O-N 3.18Å; Q403-N406 PolarHBondContact O-N 2.86Å
404V82.9Confident86.7Confident26 Ų2635.3 Ų35.316%0.15818%0.178CC..Hα-helixtrans-63-34.2-179.5170.90000111.8K301 F400 I401 A402K301-V404 HydrophobicContact CD-CG2 4.26Å; F400-V404 HydrophobicContact CD1-CG2 4.42Å; F400-V404 HydrophobicContact CD2-CG2 3.84Å; F400-V404 HydrophobicContact CE1-CG2 4.02Å; F400-V404 HydrophobicContact CE2-CG2 3.4Å; F400-V404 VanDerWaalsContact CE2-CG2 3.4Å; F400-V404 HydrophobicContact CG-CG2 4.35Å; F400-V404 HydrophobicContact CZ-CG2 3.51Å; F400-V404 VanDerWaalsContact O-CG2 3.31Å; F400-V404 WeakPolarHBondContact O-CG2 3.45Å; F400-V404 PolarHBondContact O-N 3.17Å; I401-V404 PolarHBondContact O-N 3.29Å; A402-V404 PolarHBondContact O-N 3.3Å
405N81.3Confident86.3Confident48 Ų4838.6 Ų38.626%0.25719%0.194SC..THydrogen-bonded Turntrans-91.65.1179.7-74.4-70.2000114.5I401 A402 Q403 Y407 D452I401-N405 WeakPolarHBondContact O-CB 3.32Å; I401-N405 PolarHBondContact O-N 2.83Å; I401-N405 PolarHBondContact O-ND2 3.33Å; A402-N405 PolarHBondContact O-N 3.11Å; Q403-N405 PolarHBondContact O-N 3.18Å; N405-Y407 HydrophobicContact CB-CD2 3.36Å; N405-Y407 HydrophobicContact CB-CE2 3.28Å; N405-Y407 HydrophobicContact CB-CG 4.28Å; N405-Y407 PolarHBondContact O-N 3.26Å; N405-D452 PolarHBondContact ND2-OD2 2.97Å; N405-D452 PolarHBondContact OD1-OD2 3.48Å
406N80.9Confident85.6Confident86 Ų8638.6 Ų38.646%0.4619%0.194SC..THydrogen-bonded Turntrans58.829.6-173.9-59.6-64.8000114.4Q131 A402 Q403 E408Q131-N406 PolarHBondContact NE2-ND2 2.94Å; Q131-N406 VanDerWaalsContact NE2-ND2 3.11Å; Q131-N406 PolarHBondContact NE2-OD1 2.98Å; Q131-N406 PolarHBondContact OE1-OD1 3.13Å; A402-N406 PolarHBondContact O-N 3.46Å; Q403-N406 PolarHBondContact O-N 2.86Å; N406-E408 PolarHBondContact O-N 3.1Å
407Y81.4Confident85.3Confident35 Ų3538.6 Ų38.614%0.13719%0.194CC..PPolyproline II helixtrans-80.4117.8168.8-63.4-58.4000109.2K140 V142 A402 N405 L409 L448 P449K140-Y407 HydrophobicContact CB-CE1 4.28Å; V142-Y407 HydrophobicContact CG2-CD1 4Å; A402-Y407 PolarHBondContact O-N 3.42Å; N405-Y407 HydrophobicContact CB-CD2 3.36Å; N405-Y407 HydrophobicContact CB-CE2 3.28Å; N405-Y407 HydrophobicContact CB-CG 4.28Å; N405-Y407 PolarHBondContact O-N 3.26Å; Y407-L409 PolarHBondContact O-N 2.94Å; Y407-L448 HydrophobicContact CD2-CD2 3.31Å; Y407-L448 HydrophobicContact CE2-CD2 3.91Å; Y407-L448 HydrophobicContact CG-CD2 3.87Å; Y407-P449 HydrophobicContact CE2-CG 4.05Å
408E78.6Confident85.2Confident173 Ų17339.1 Ų39.181%0.80820%0.198SC*.PPolyproline II helixtrans-74.9116.8167.7-66.3-172.4167.800108.6N406N406-E408 PolarHBondContact O-N 3.1Å
409L81.6Confident84.8Confident37 Ų3743 Ų4319%0.19422%0.218CC..PPolyproline II helixtrans-87.9123.9175.4-66.3174.7000109.5I399 A402 Y407 Q413 I414 I417I399-L409 HydrophobicContact CB-CD1 4.36Å; I399-L409 HydrophobicContact CG1-CD1 3.93Å; I399-L409 HydrophobicContact CG2-CD1 4.39Å; A402-L409 HydrophobicContact CB-CD1 3.56Å; A402-L409 HydrophobicContact CB-CD2 3.95Å; A402-L409 HydrophobicContact CB-CG 3.66Å; Y407-L409 PolarHBondContact O-N 2.94Å; L409-Q413 HydrophobicContact CD2-CB 4.2Å; L409-I414 HydrophobicContact CB-CG1 4.27Å; L409-I417 HydrophobicContact CD1-CD1 3.79Å; L409-I417 HydrophobicContact CD2-CD1 4.43Å
410D80.9Confident84.3Confident80 Ų8042.6 Ų42.643%0.42822%0.216SC..PPolyproline II helixtrans-74.8160.5170.3-178.647.4000111.5S145 G412 Q413 I414S145-D410 WeakPolarHBondContact CB-OD2 3.31Å; S145-D410 VanDerWaalsContact OG-CB 3.26Å; S145-D410 WeakPolarHBondContact OG-CB 3.35Å; S145-D410 PolarHBondContact OG-OD2 3.17Å; D410-G412 PolarHBondContact O-N 3.35Å; D410-G412 PolarHBondContact OD2-N 3.43Å; D410-Q413 WeakPolarHBondContact O-CB 3.47Å; D410-Q413 PolarHBondContact O-N 3.41Å; D410-I414 PolarHBondContact O-N 2.91Å; D410-I414 VanDerWaalsContact O-N 3.07Å
411F81.2Confident84.2Confident149 Ų14942.4 Ų42.465%0.65422%0.215SC*.Hα-helixtrans-52.2-40176.5-177-107.1000112.7Q413 I414 I415F411-Q413 VanDerWaalsContact C-N 3.33Å; F411-Q413 PolarHBondContact O-N 3.03Å; F411-I414 PolarHBondContact O-N 2.87Å; F411-I415 HydrophobicContact CD1-CD1 3.86Å; F411-I415 HydrophobicContact CE1-CD1 3.35Å; F411-I415 HydrophobicContact CE1-CG1 4.31Å; F411-I415 HydrophobicContact CZ-CD1 3.75Å; F411-I415 HydrophobicContact CZ-CG1 4.36Å; F411-I415 PolarHBondContact O-N 3.45Å; F411-I415 VanDerWaalsContact O-N 3.12Å
412G75.4Confident84.2Confident19 Ų1943.1 Ų43.120%0.19622%0.22CC..Hα-helixtrans-62.9-38176.200000113D410 I415 T416D410-G412 PolarHBondContact O-N 3.35Å; D410-G412 PolarHBondContact OD2-N 3.43Å; G412-I415 PolarHBondContact O-N 2.71Å; G412-T416 PolarHBondContact O-N 2.97Å; G412-T416 PolarHBondContact O-OG1 3.43Å
413Q81.1Confident83.8Confident4 Ų444.2 Ų44.22%0.01923%0.229CC..Hα-helixtrans-70.7-34.5177.7-64.3176.9-65.500112L409 D410 F411 I415 T416 I417 V446L409-Q413 HydrophobicContact CD2-CB 4.2Å; D410-Q413 WeakPolarHBondContact O-CB 3.47Å; D410-Q413 PolarHBondContact O-N 3.41Å; F411-Q413 VanDerWaalsContact C-N 3.33Å; F411-Q413 PolarHBondContact O-N 3.03Å; Q413-I415 VanDerWaalsContact C-N 3.33Å; Q413-T416 PolarHBondContact O-N 3.2Å; Q413-I417 WeakPolarHBondContact O-CG1 3.49Å; Q413-I417 PolarHBondContact O-N 2.9Å; Q413-V446 HydrophobicContact CB-CG1 4.01Å; Q413-V446 HydrophobicContact CG-CG1 4.48Å
414I88.2Confident83.4Confident47 Ų4743.4 Ų43.424%0.24123%0.226CC..Hα-helixtrans-62.9-42173.4-63.8172.8000110.6I118 L409 D410 F411 I417 S418I118-I414 HydrophobicContact CD1-CG2 4.13Å; I118-I414 HydrophobicContact CG2-CG2 3.86Å; L409-I414 HydrophobicContact CB-CG1 4.27Å; D410-I414 PolarHBondContact O-N 2.91Å; D410-I414 VanDerWaalsContact O-N 3.07Å; F411-I414 PolarHBondContact O-N 2.87Å; I414-I417 PolarHBondContact O-N 2.74Å; I414-S418 WeakPolarHBondContact O-CB 3.35Å; I414-S418 PolarHBondContact O-N 2.77Å
415I85.4Confident83.5Confident69 Ų6942.2 Ų42.235%0.35422%0.218SC..Hα-helixtrans-62.8-45173.9-68.5172000110.7F411 G412 Q413 I417 S418 I419F411-I415 HydrophobicContact CD1-CD1 3.86Å; F411-I415 HydrophobicContact CE1-CD1 3.35Å; F411-I415 HydrophobicContact CE1-CG1 4.31Å; F411-I415 HydrophobicContact CZ-CD1 3.75Å; F411-I415 HydrophobicContact CZ-CG1 4.36Å; F411-I415 PolarHBondContact O-N 3.45Å; F411-I415 VanDerWaalsContact O-N 3.12Å; G412-I415 PolarHBondContact O-N 2.71Å; Q413-I415 VanDerWaalsContact C-N 3.33Å; I415-I417 PolarHBondContact O-N 2.62Å; I415-S418 WeakPolarHBondContact O-CB 3.16Å; I415-S418 PolarHBondContact O-N 3.18Å; I415-S418 VanDerWaalsContact O-N 3.1Å; I415-I419 HydrophobicContact CG2-CD1 3.78Å; I415-I419 HydrophobicContact CG2-CG1 4.38Å; I415-I419 WeakPolarHBondContact O-CG1 3.5Å; I415-I419 PolarHBondContact O-N 3.07Å
416T80.6Confident83.4Confident0 Ų041.3 Ų41.30%021%0.213CC..Hα-helixtrans-58.3-47.5176-64.30000111.4L152 G412 Q413 S418 I419 T420 V446L152-T416 HydrophobicContact CD1-CG2 4.26Å; L152-T416 HydrophobicContact CD2-CG2 4.17Å; G412-T416 PolarHBondContact O-N 2.97Å; G412-T416 PolarHBondContact O-OG1 3.43Å; Q413-T416 PolarHBondContact O-N 3.2Å; T416-S418 VanDerWaalsContact C-N 3.27Å; T416-S418 PolarHBondContact O-N 3.1Å; T416-I419 PolarHBondContact O-N 3.24Å; T416-T420 HydrophobicContact CG2-CG2 4.23Å; T416-T420 WeakPolarHBondContact O-CB 3.29Å; T416-T420 VanDerWaalsContact O-CG2 3.29Å; T416-T420 WeakPolarHBondContact O-CG2 3.4Å; T416-T420 PolarHBondContact O-N 3.24Å; T416-T420 PolarHBondContact O-OG1 3.11Å; T416-V446 HydrophobicContact CG2-CG1 3.78Å
417I89.9Confident82.6Confident0 Ų037.4 Ų37.40%019%0.193CC..Hα-helixtrans-55.7-46173.4-71.2165.1000110A395 A398 I399 L409 Q413 I414 I415 I419 T420 A421 V442 V446A395-I417 HydrophobicContact CB-CG2 4.15Å; A398-I417 HydrophobicContact CB-CD1 4.22Å; A398-I417 HydrophobicContact CB-CG1 4.35Å; A398-I417 HydrophobicContact CB-CG2 4.1Å; I399-I417 HydrophobicContact CG1-CD1 4.08Å; L409-I417 HydrophobicContact CD1-CD1 3.79Å; L409-I417 HydrophobicContact CD2-CD1 4.43Å; Q413-I417 WeakPolarHBondContact O-CG1 3.49Å; Q413-I417 PolarHBondContact O-N 2.9Å; I414-I417 PolarHBondContact O-N 2.74Å; I415-I417 PolarHBondContact O-N 2.62Å; I417-I419 PolarHBondContact O-N 3.22Å; I417-T420 WeakPolarHBondContact CA-OG1 3.38Å; I417-T420 PolarHBondContact O-N 3.22Å; I417-T420 PolarHBondContact O-OG1 3.11Å; I417-A421 WeakPolarHBondContact O-CB 3.43Å; I417-A421 PolarHBondContact O-N 2.68Å; I417-V442 HydrophobicContact CG1-CG1 4.46Å; I417-V442 HydrophobicContact CG2-CG1 4Å; I417-V446 HydrophobicContact CD1-CG1 4.2Å; I417-V446 HydrophobicContact CD1-CG2 4.23Å; I417-V446 HydrophobicContact CG1-CB 4.45Å; I417-V446 HydrophobicContact CG1-CG1 3.64Å; I417-V446 HydrophobicContact CG1-CG2 4.03Å
418S91.9Very high82.1Confident11 Ų1135.9 Ų35.98%0.07719%0.188CC..Hα-helixtrans-60.8-47.5-178.3-173.80000113.1V114 I414 I415 T416 T422V114-S418 VanDerWaalsContact CG1-OG 3.29Å; V114-S418 WeakPolarHBondContact CG1-OG 3.44Å; I414-S418 WeakPolarHBondContact O-CB 3.35Å; I414-S418 PolarHBondContact O-N 2.77Å; I415-S418 WeakPolarHBondContact O-CB 3.16Å; I415-S418 PolarHBondContact O-N 3.18Å; I415-S418 VanDerWaalsContact O-N 3.1Å; T416-S418 VanDerWaalsContact C-N 3.27Å; T416-S418 PolarHBondContact O-N 3.1Å; S418-T422 PolarHBondContact O-N 3.23Å; S418-T422 PolarHBondContact O-OG1 3.26Å
419I85.5Confident81.4Confident82 Ų8228.1 Ų28.142%0.42115%0.153SC..Hα-helixtrans-69.1-45.3-179.4-66171.5000110I415 T416 I417 T422 A423I415-I419 HydrophobicContact CG2-CD1 3.78Å; I415-I419 HydrophobicContact CG2-CG1 4.38Å; I415-I419 WeakPolarHBondContact O-CG1 3.5Å; I415-I419 PolarHBondContact O-N 3.07Å; T416-I419 PolarHBondContact O-N 3.24Å; I417-I419 PolarHBondContact O-N 3.22Å; I419-T422 PolarHBondContact O-N 3.34Å; I419-A423 WeakPolarHBondContact O-CB 3.5Å; I419-A423 PolarHBondContact O-N 3.43Å
420T83Confident80.6Confident1 Ų126.6 Ų26.61%0.00615%0.147CC..Hα-helixtrans-68.2-38.7-178.655.60000113.3L152 T416 I417 T422 A423 A424 S445L152-T420 HydrophobicContact CD1-CG2 3.24Å; L152-T420 HydrophobicContact CG-CG2 4.5Å; T416-T420 HydrophobicContact CG2-CG2 4.23Å; T416-T420 WeakPolarHBondContact O-CB 3.29Å; T416-T420 VanDerWaalsContact O-CG2 3.29Å; T416-T420 WeakPolarHBondContact O-CG2 3.4Å; T416-T420 PolarHBondContact O-N 3.24Å; T416-T420 PolarHBondContact O-OG1 3.11Å; I417-T420 WeakPolarHBondContact CA-OG1 3.38Å; I417-T420 PolarHBondContact O-N 3.22Å; I417-T420 PolarHBondContact O-OG1 3.11Å; T420-T422 VanDerWaalsContact C-N 3.33Å; T420-T422 PolarHBondContact O-N 3.18Å; T420-A423 PolarHBondContact O-N 3.25Å; T420-A424 WeakPolarHBondContact O-CA 3.41Å; T420-A424 WeakPolarHBondContact O-CB 3.37Å; T420-A424 PolarHBondContact O-N 2.96Å; T420-S445 PolarHBondContact OG1-OG 3.25Å
421A91.2Very high79.8Confident0 Ų023.9 Ų23.90%013%0.132CC..Hα-helixtrans-63.3-40.417400000111.6V114 E394 A395 I417 A423 S425 V442V114-A421 HydrophobicContact CG2-CB 4.14Å; E394-A421 HydrophobicContact CB-CB 3.93Å; E394-A421 WeakPolarHBondContact OE2-CA 3.43Å; A395-A421 HydrophobicContact CB-CB 4.36Å; I417-A421 WeakPolarHBondContact O-CB 3.43Å; I417-A421 PolarHBondContact O-N 2.68Å; A421-A423 PolarHBondContact O-N 2.91Å; A421-S425 VanDerWaalsContact O-CB 3.3Å; A421-S425 WeakPolarHBondContact O-CB 3.28Å; A421-S425 PolarHBondContact O-N 3.35Å; A421-S425 PolarHBondContact O-OG 3.46Å; A421-V442 HydrophobicContact CB-CG1 4.46Å; A421-V442 HydrophobicContact CB-CG2 4.16Å
422T89.5Confident78.9Confident18 Ų1819.4 Ų19.411%0.1112%0.118CC..Hα-helixtrans-64.3-40.2175.2-52.80000111.7T110 S418 I419 T420 S425 I426T110-T422 HydrophobicContact CG2-CG2 3.98Å; S418-T422 PolarHBondContact O-N 3.23Å; S418-T422 PolarHBondContact O-OG1 3.26Å; I419-T422 PolarHBondContact O-N 3.34Å; T420-T422 VanDerWaalsContact C-N 3.33Å; T420-T422 PolarHBondContact O-N 3.18Å; T422-S425 PolarHBondContact O-OG 3.09Å; T422-I426 WeakPolarHBondContact O-CG1 3.3Å
423A79.8Confident78.5Confident24 Ų2419 Ų1920%0.19811%0.111CC..Hα-helixtrans-74.7-40.6178.900000112.5L232 I419 T420 A421 S425 I426L232-A423 HydrophobicContact CD1-CB 4.26Å; I419-A423 WeakPolarHBondContact O-CB 3.5Å; I419-A423 PolarHBondContact O-N 3.43Å; T420-A423 PolarHBondContact O-N 3.25Å; A421-A423 PolarHBondContact O-N 2.91Å; A423-S425 VanDerWaalsContact C-N 3.35Å; A423-I426 PolarHBondContact O-N 3.07Å
424A79.9Confident77.8Confident3 Ų319.4 Ų19.43%0.02512%0.115CC..Hα-helixtrans-66.5-37.5-179.600000111.3E394 T420 I426 G427 A428 T438 I441 V442E394-A424 WeakPolarHBondContact OE2-CB 3.4Å; T420-A424 WeakPolarHBondContact O-CA 3.41Å; T420-A424 WeakPolarHBondContact O-CB 3.37Å; T420-A424 PolarHBondContact O-N 2.96Å; A424-I426 VanDerWaalsContact C-N 3.26Å; A424-I426 PolarHBondContact O-N 3.24Å; A424-G427 WeakPolarHBondContact O-CA 3.45Å; A424-G427 PolarHBondContact O-N 3.44Å; A424-A428 PolarHBondContact O-N 3.47Å; A424-T438 WeakPolarHBondContact O-CG2 3.42Å; A424-I441 HydrophobicContact CB-CB 4.25Å; A424-I441 HydrophobicContact CB-CD1 3.96Å; A424-I441 HydrophobicContact CB-CG2 4.45Å; A424-V442 HydrophobicContact CB-CG2 3.99Å
425S85.7Confident77Confident0 Ų017.2 Ų17.20%010%0.104CC..Hα-helixtrans-62.4-30.9177.471.10000113.3T110 M387 A421 T422 A423 G427 A428T110-S425 VanDerWaalsContact CG2-OG 3.31Å; T110-S425 WeakPolarHBondContact CG2-OG 3.5Å; M387-S425 VanDerWaalsContact CB-O 3.23Å; M387-S425 WeakPolarHBondContact CB-O 3.48Å; M387-S425 VanDerWaalsContact CG-O 3.26Å; M387-S425 WeakPolarHBondContact CG-O 3.25Å; A421-S425 VanDerWaalsContact O-CB 3.3Å; A421-S425 WeakPolarHBondContact O-CB 3.28Å; A421-S425 PolarHBondContact O-N 3.35Å; A421-S425 PolarHBondContact O-OG 3.46Å; T422-S425 PolarHBondContact O-OG 3.09Å; A423-S425 VanDerWaalsContact C-N 3.35Å; S425-G427 PolarHBondContact O-N 2.84Å; S425-A428 WeakPolarHBondContact O-CB 3.5Å; S425-A428 PolarHBondContact O-N 3.06Å
426I80.1Confident76.4Confident30 Ų3014.3 Ų14.315%0.1549%0.089CC..Hα-helixtrans-66.2-31174.9-58.8167.6000111.2L83 L107 I385 T422 A423 A424L83-I426 HydrophobicContact CD2-CG2 3.78Å; L107-I426 HydrophobicContact CD2-CD1 3.59Å; I385-I426 HydrophobicContact CB-CG2 4.42Å; I385-I426 HydrophobicContact CG1-CG2 4.28Å; I385-I426 HydrophobicContact CG2-CG1 4.26Å; I385-I426 HydrophobicContact CG2-CG2 4.13Å; T422-I426 WeakPolarHBondContact O-CG1 3.3Å; A423-I426 PolarHBondContact O-N 3.07Å; A424-I426 VanDerWaalsContact C-N 3.26Å; A424-I426 PolarHBondContact O-N 3.24Å
427G64.6Low75.7Confident4 Ų415.8 Ų15.84%0.04110%0.098CC..Hα-helixtrans-84.3-8.3176.500000113.8A424 S425 A429A424-G427 WeakPolarHBondContact O-CA 3.45Å; A424-G427 PolarHBondContact O-N 3.44Å; S425-G427 PolarHBondContact O-N 2.84Å; G427-A429 PolarHBondContact O-N 3.39Å
428A70.8Confident75.2Confident2 Ų215.8 Ų15.82%0.01710%0.098CC..SBendtrans-74.5125.1175.400000109M387 T390 A424 S425 A434 T438M387-A428 HydrophobicContact CE-CB 4.48Å; M387-A428 WeakPolarHBondContact CE-O 3.41Å; M387-A428 HydrophobicContact SD-CB 3.55Å; M387-A428 VanDerWaalsContact SD-CB 3.55Å; M387-A428 VanDerWaalsContact SD-O 3.42Å; T390-A428 HydrophobicContact CG2-CB 4.04Å; A424-A428 PolarHBondContact O-N 3.47Å; S425-A428 WeakPolarHBondContact O-CB 3.5Å; S425-A428 PolarHBondContact O-N 3.06Å; A428-A434 HydrophobicContact CB-CB 4.17Å; A428-T438 HydrophobicContact CB-CG2 3.86Å
429A63.9Low74.9Confident10 Ų1015.3 Ų15.38%0.0839%0.094CC..  trans-75.9151.617500000111.1L78 M387 G427 I431 A434L78-A429 HydrophobicContact CD1-CB 4.15Å; L78-A429 HydrophobicContact CD2-CB 3.38Å; L78-A429 HydrophobicContact CG-CB 3.83Å; M387-A429 VanDerWaalsContact CE-C 3.41Å; G427-A429 PolarHBondContact O-N 3.39Å; A429-I431 HydrophobicContact CB-CD1 4.16Å; A429-I431 HydrophobicContact CB-CG1 3.94Å; A429-I431 PolarHBondContact O-N 2.78Å; A429-A434 WeakPolarHBondContact O-CB 3.37Å
430G63.7Low74.3Confident6 Ų613.2 Ų13.26%0.0629%0.085CC..SBendtrans-69.738-179.800000115.2S352 S353 S354S352-G430 CarbonylContact C-O 3.37Å; S352-G430 WeakPolarHBondContact CA-O 3.29Å; S352-G430 WeakPolarHBondContact CB-O 3.38Å; S352-G430 PolarHBondContact OG-O 3.19Å; S353-G430 PolarHBondContact N-O 2.98Å; S353-G430 VanDerWaalsContact N-O 3.11Å; S354-G430 PolarHBondContact N-O 3.42Å; S354-G430 VanDerWaalsContact N-O 3.11Å; S354-G430 WeakPolarHBondContact OG-CA 3.34Å; S354-G430 PolarHBondContact OG-O 3.5Å
431I63.7Low73.8Confident22 Ų2213.6 Ų13.611%0.1139%0.087CC..SBendtrans-114.3160.8-176.361.1174.7000110.6L78 M267 V270 A429 Q433 A434L78-I431 HydrophobicContact CD2-CD1 3.86Å; M267-I431 HydrophobicContact CE-CG2 3.3Å; M267-I431 HydrophobicContact SD-CG2 3.57Å; M267-I431 VanDerWaalsContact SD-CG2 3.57Å; V270-I431 HydrophobicContact CB-CD1 4.46Å; V270-I431 HydrophobicContact CG1-CB 4.34Å; V270-I431 HydrophobicContact CG1-CD1 3.62Å; V270-I431 HydrophobicContact CG1-CG2 4.33Å; V270-I431 HydrophobicContact CG2-CD1 3.98Å; A429-I431 HydrophobicContact CB-CD1 4.16Å; A429-I431 HydrophobicContact CB-CG1 3.94Å; A429-I431 PolarHBondContact O-N 2.78Å; I431-Q433 PolarHBondContact O-N 3.09Å; I431-A434 HydrophobicContact CG1-CB 3.86Å; I431-A434 PolarHBondContact O-N 3.49Å
432P62.5Low73.5Confident55 Ų5513.6 Ų13.636%0.3579%0.087SC..THydrogen-bonded Turntrans-57.7138.1177.2-22.935.3000111S351 A434 D464S351-P432 VanDerWaalsContact O-CA 3.32Å; S351-P432 WeakPolarHBondContact O-CA 3.25Å; P432-A434 PolarHBondContact O-N 3.4Å; P432-A434 VanDerWaalsContact O-N 3.16Å; P432-D464 WeakPolarHBondContact CA-OD2 3.41Å
433Q67.4Low73.1Confident12 Ų1212.7 Ų12.76%0.0568%0.082CC..THydrogen-bonded Turntrans61.412.6176.5-54.2-166.8-51.700117.7F277 I431 G435 L436 D464F277-Q433 HydrophobicContact CE2-CG 4.23Å; F277-Q433 HydrophobicContact CZ-CG 3.94Å; F277-Q433 VanDerWaalsContact CZ-OE1 3.28Å; I431-Q433 PolarHBondContact O-N 3.09Å; Q433-G435 PolarHBondContact O-N 2.84Å; Q433-G435 VanDerWaalsContact O-N 3.08Å; Q433-L436 HydrophobicContact CB-CD1 4.27Å; Q433-L436 HydrophobicContact CG-CD1 4.5Å; Q433-L436 PolarHBondContact O-N 3.37Å; Q433-D464 PolarHBondContact N-OD2 3.49Å
434A66Low72.6Confident11 Ų1113.1 Ų13.19%0.0918%0.082CC..Hα-helixtrans-54.8-30.4174.700000112.8A428 A429 I431 P432 L436 V437 T438A428-A434 HydrophobicContact CB-CB 4.17Å; A429-A434 WeakPolarHBondContact O-CB 3.37Å; I431-A434 HydrophobicContact CG1-CB 3.86Å; I431-A434 PolarHBondContact O-N 3.49Å; P432-A434 PolarHBondContact O-N 3.4Å; P432-A434 VanDerWaalsContact O-N 3.16Å; A434-L436 VanDerWaalsContact C-N 3.3Å; A434-L436 PolarHBondContact O-N 3.5Å; A434-V437 WeakPolarHBondContact O-CB 3.4Å; A434-V437 PolarHBondContact O-N 2.78Å; A434-T438 PolarHBondContact O-N 2.92Å; A434-T438 PolarHBondContact O-OG1 3.31Å
435G72.8Confident72.1Confident1 Ų113.9 Ų13.91%0.019%0.087CC..Hα-helixtrans-63.4-25.9177.800000115.5Q433 V437 T438 M439Q433-G435 PolarHBondContact O-N 2.84Å; Q433-G435 VanDerWaalsContact O-N 3.08Å; G435-V437 VanDerWaalsContact C-N 3.33Å; G435-T438 WeakPolarHBondContact CA-OG1 3.33Å; G435-T438 PolarHBondContact O-OG1 3.33Å; G435-M439 WeakPolarHBondContact O-CB 3.47Å; G435-M439 PolarHBondContact O-N 2.96Å
436L72.4Confident71.5Confident9 Ų914.2 Ų14.25%0.0479%0.089CC..Hα-helixtrans-73.1-31.9177-74.4172.4000112.1Y393 Q433 A434 I453 I456 I457 D460Y393-L436 VanDerWaalsContact OH-CD2 3.22Å; Y393-L436 WeakPolarHBondContact OH-CD2 3.39Å; Q433-L436 HydrophobicContact CB-CD1 4.27Å; Q433-L436 HydrophobicContact CG-CD1 4.5Å; Q433-L436 PolarHBondContact O-N 3.37Å; A434-L436 VanDerWaalsContact C-N 3.3Å; A434-L436 PolarHBondContact O-N 3.5Å; L436-I453 HydrophobicContact CD2-CG2 3.83Å; L436-I456 HydrophobicContact CD2-CD1 4.46Å; L436-I456 HydrophobicContact CD2-CG1 4.38Å; L436-I457 HydrophobicContact CD1-CG1 3.91Å; L436-I457 HydrophobicContact CD1-CG2 4.46Å; L436-I457 HydrophobicContact CD2-CG1 4.02Å; L436-D460 HydrophobicContact CD1-CB 4.15Å; L436-D460 VanDerWaalsContact CD1-OD2 3.26Å; L436-D460 WeakPolarHBondContact CD1-OD2 3.47Å; L436-D460 HydrophobicContact CD2-CB 4.14Å; L436-D460 HydrophobicContact CG-CB 4.35Å; L436-D460 VanDerWaalsContact CG-OD2 3.31Å; L436-D460 WeakPolarHBondContact CG-OD2 3.49Å
437V65.7Low70.9Confident30 Ų3013.8 Ų13.818%0.1829%0.092CC..Hα-helixtrans-68.1-47.2176.9146.10000110.2L71 I75 A434 G435 V440L71-V437 HydrophobicContact CB-CG2 4.5Å; I75-V437 HydrophobicContact CB-CG1 3.92Å; I75-V437 HydrophobicContact CD1-CB 4.01Å; I75-V437 HydrophobicContact CD1-CG1 3.48Å; I75-V437 VanDerWaalsContact CD1-CG1 3.48Å; I75-V437 HydrophobicContact CD1-CG2 3.79Å; I75-V437 HydrophobicContact CG1-CB 4.01Å; I75-V437 HydrophobicContact CG1-CG1 3.29Å; I75-V437 HydrophobicContact CG1-CG2 3.66Å; I75-V437 HydrophobicContact CG2-CG1 3.5Å; A434-V437 WeakPolarHBondContact O-CB 3.4Å; A434-V437 PolarHBondContact O-N 2.78Å; G435-V437 VanDerWaalsContact C-N 3.33Å; V437-V440 WeakPolarHBondContact O-CB 3.29Å; V437-V440 PolarHBondContact O-N 2.9Å
438T80.2Confident71.5Confident1 Ų114.1 Ų14.11%0.0069%0.093CC..Hα-helixtrans-77.3-22.7-177.146.70000112.5E394 A424 A428 A434 G435 V440 I441E394-T438 WeakPolarHBondContact OE1-CB 3.44Å; E394-T438 PolarHBondContact OE1-OG1 3.36Å; A424-T438 WeakPolarHBondContact O-CG2 3.42Å; A428-T438 HydrophobicContact CB-CG2 3.86Å; A434-T438 PolarHBondContact O-N 2.92Å; A434-T438 PolarHBondContact O-OG1 3.31Å; G435-T438 WeakPolarHBondContact CA-OG1 3.33Å; G435-T438 PolarHBondContact O-OG1 3.33Å; T438-V440 PolarHBondContact O-N 3.36Å; T438-I441 HydrophobicContact CG2-CD1 4.17Å; T438-I441 WeakPolarHBondContact O-CB 3.38Å; T438-I441 WeakPolarHBondContact O-CG1 3.29Å; T438-I441 PolarHBondContact O-N 3.38Å
439M84.5Confident71.7Confident0 Ų015.8 Ų15.80%010%0.103CC..Hα-helixtrans-54.4-35.4168.7179.862.273.600113.4Y393 E394 A397 G435 I441 V442 L443 I453 I456Y393-M439 HydrophobicContact CD1-CE 3.96Å; Y393-M439 HydrophobicContact CE1-CE 3.41Å; Y393-M439 VanDerWaalsContact CE1-CE 3.41Å; E394-M439 VanDerWaalsContact CA-CE 3.48Å; E394-M439 HydrophobicContact CB-CE 4.27Å; E394-M439 HydrophobicContact CG-CE 4.12Å; A397-M439 HydrophobicContact CB-CE 3.16Å; A397-M439 HydrophobicContact CB-SD 4.24Å; G435-M439 WeakPolarHBondContact O-CB 3.47Å; G435-M439 PolarHBondContact O-N 2.96Å; M439-I441 PolarHBondContact O-N 3.47Å; M439-V442 PolarHBondContact O-N 3.18Å; M439-V442 VanDerWaalsContact O-N 3.11Å; M439-L443 HydrophobicContact CG-CD1 4.07Å; M439-L443 HydrophobicContact CG-CG 4.16Å; M439-L443 WeakPolarHBondContact O-CG 3.21Å; M439-L443 PolarHBondContact O-N 2.89Å; M439-L443 HydrophobicContact SD-CD2 4.37Å; M439-L443 HydrophobicContact SD-CG 4.1Å; M439-I453 HydrophobicContact CB-CD1 4.27Å; M439-I453 HydrophobicContact CG-CD1 3.93Å; M439-I453 HydrophobicContact CG-CG1 3.95Å; M439-I456 HydrophobicContact CE-CD1 4.26Å
440V73.4Confident72.2Confident38 Ų3817.4 Ų17.423%0.2311%0.112CC..Hα-helixtrans-55.9-39.2177.8175.30000110.6V437 T438 L443 T444 T450 I453V437-V440 WeakPolarHBondContact O-CB 3.29Å; V437-V440 PolarHBondContact O-N 2.9Å; T438-V440 PolarHBondContact O-N 3.36Å; V440-L443 PolarHBondContact O-N 2.96Å; V440-T444 HydrophobicContact CG1-CG2 4.26Å; V440-T444 VanDerWaalsContact O-CG2 3.3Å; V440-T444 WeakPolarHBondContact O-CG2 3.49Å; V440-T444 PolarHBondContact O-N 3.01Å; V440-T444 PolarHBondContact O-OG1 3.49Å; V440-T444 VanDerWaalsContact O-OG1 3.07Å; V440-T450 HydrophobicContact CG1-CG2 3.98Å; V440-I453 HydrophobicContact CB-CD1 4.39Å; V440-I453 HydrophobicContact CG2-CD1 3.5Å; V440-I453 VanDerWaalsContact CG2-CD1 3.5Å
441I71.4Confident72.6Confident9 Ų922.8 Ų22.85%0.04614%0.14CC..Hα-helixtrans-63.2-44.5-179.9-44.8175.3000110.5V231 L232 A424 T438 M439 T444 S445V231-I441 HydrophobicContact CB-CD1 3.45Å; V231-I441 VanDerWaalsContact CB-CD1 3.45Å; V231-I441 HydrophobicContact CB-CG1 3.53Å; V231-I441 HydrophobicContact CB-CG2 4.33Å; V231-I441 HydrophobicContact CG1-CD1 3.32Å; V231-I441 HydrophobicContact CG1-CG1 3.96Å; V231-I441 HydrophobicContact CG2-CD1 4.01Å; V231-I441 HydrophobicContact CG2-CG1 3.65Å; L232-I441 HydrophobicContact CB-CG2 4.32Å; A424-I441 HydrophobicContact CB-CB 4.25Å; A424-I441 HydrophobicContact CB-CD1 3.96Å; A424-I441 HydrophobicContact CB-CG2 4.45Å; T438-I441 HydrophobicContact CG2-CD1 4.17Å; T438-I441 WeakPolarHBondContact O-CB 3.38Å; T438-I441 WeakPolarHBondContact O-CG1 3.29Å; T438-I441 PolarHBondContact O-N 3.38Å; M439-I441 PolarHBondContact O-N 3.47Å; I441-T444 PolarHBondContact O-OG1 3.32Å; I441-S445 WeakPolarHBondContact O-CB 3.38Å; I441-S445 PolarHBondContact O-N 3.02Å; I441-S445 VanDerWaalsContact O-N 3.1Å
442V84.9Confident73.2Confident0 Ų023.1 Ų23.10%014%0.142CC..Hα-helixtrans-70.5-38.5-177.9-176.40000110.7E394 A398 I417 A421 A424 M439 S445 V446E394-V442 HydrophobicContact CB-CG2 4.17Å; E394-V442 HydrophobicContact CG-CG2 4.42Å; A398-V442 HydrophobicContact CB-CG1 3.77Å; I417-V442 HydrophobicContact CG1-CG1 4.46Å; I417-V442 HydrophobicContact CG2-CG1 4Å; A421-V442 HydrophobicContact CB-CG1 4.46Å; A421-V442 HydrophobicContact CB-CG2 4.16Å; A424-V442 HydrophobicContact CB-CG2 3.99Å; M439-V442 PolarHBondContact O-N 3.18Å; M439-V442 VanDerWaalsContact O-N 3.11Å; V442-S445 PolarHBondContact O-OG 3.07Å; V442-V446 WeakPolarHBondContact O-CG2 3.45Å
443L81.9Confident73.9Confident0 Ų020.9 Ų20.90%013%0.127CC..Hα-helixtrans-70.1-43.2176.7-66.3-179.4000112.2A398 I401 M439 V440 S445 V446 G447 L448 T450 I453A398-L443 HydrophobicContact CB-CD2 4Å; I401-L443 HydrophobicContact CB-CD2 4.37Å; I401-L443 HydrophobicContact CD1-CD1 3.79Å; I401-L443 HydrophobicContact CD1-CD2 4.01Å; I401-L443 HydrophobicContact CG2-CD2 4.32Å; M439-L443 HydrophobicContact CG-CD1 4.07Å; M439-L443 HydrophobicContact CG-CG 4.16Å; M439-L443 WeakPolarHBondContact O-CG 3.21Å; M439-L443 PolarHBondContact O-N 2.89Å; M439-L443 HydrophobicContact SD-CD2 4.37Å; M439-L443 HydrophobicContact SD-CG 4.1Å; V440-L443 PolarHBondContact O-N 2.96Å; L443-S445 VanDerWaalsContact C-N 3.3Å; L443-S445 PolarHBondContact O-N 2.51Å; L443-V446 PolarHBondContact O-N 2.95Å; L443-G447 PolarHBondContact O-N 3.33Å; L443-G447 VanDerWaalsContact O-N 3.13Å; L443-L448 HydrophobicContact CB-CB 4.18Å; L443-L448 HydrophobicContact CD2-CB 3.96Å; L443-L448 HydrophobicContact CD2-CD1 3.77Å; L443-L448 PolarHBondContact O-N 3.4Å; L443-T450 HydrophobicContact CB-CG2 4.21Å; L443-I453 HydrophobicContact CD1-CD1 3.78Å; L443-I453 HydrophobicContact CD1-CG1 3.43Å; L443-I453 VanDerWaalsContact CD1-CG1 3.43Å
444T69.1Low74Confident33 Ų3321.8 Ų21.820%0.20213%0.132CC..Hα-helixtrans-68.3-30.8-179.557.50000112.5Q168 V440 I441 V446 G447 T450Q168-T444 PolarHBondContact OE1-OG1 3.23Å; V440-T444 HydrophobicContact CG1-CG2 4.26Å; V440-T444 VanDerWaalsContact O-CG2 3.3Å; V440-T444 WeakPolarHBondContact O-CG2 3.49Å; V440-T444 PolarHBondContact O-N 3.01Å; V440-T444 PolarHBondContact O-OG1 3.49Å; V440-T444 VanDerWaalsContact O-OG1 3.07Å; I441-T444 PolarHBondContact O-OG1 3.32Å; T444-V446 VanDerWaalsContact C-N 3.26Å; T444-V446 PolarHBondContact O-N 3.2Å; T444-G447 PolarHBondContact O-N 3.32Å; T444-G447 VanDerWaalsContact O-N 3.08Å; T444-T450 HydrophobicContact CG2-CG2 3.74Å
445S68.6Low74.3Confident18 Ų1823.2 Ų23.213%0.12614%0.138CC..Hα-helixtrans-63.4-30.1179.277.10000113.7T420 I441 V442 L443T420-S445 PolarHBondContact OG1-OG 3.25Å; I441-S445 WeakPolarHBondContact O-CB 3.38Å; I441-S445 PolarHBondContact O-N 3.02Å; I441-S445 VanDerWaalsContact O-N 3.1Å; V442-S445 PolarHBondContact O-OG 3.07Å; L443-S445 VanDerWaalsContact C-N 3.3Å; L443-S445 PolarHBondContact O-N 2.51Å
446V74.6Confident74.6Confident7 Ų723.1 Ų23.14%0.04214%0.137CC..THydrogen-bonded Turntrans-103.24.7174.4-69.80000113.6Q413 T416 I417 V442 L443 T444 L448Q413-V446 HydrophobicContact CB-CG1 4.01Å; Q413-V446 HydrophobicContact CG-CG1 4.48Å; T416-V446 HydrophobicContact CG2-CG1 3.78Å; I417-V446 HydrophobicContact CD1-CG1 4.2Å; I417-V446 HydrophobicContact CD1-CG2 4.23Å; I417-V446 HydrophobicContact CG1-CB 4.45Å; I417-V446 HydrophobicContact CG1-CG1 3.64Å; I417-V446 HydrophobicContact CG1-CG2 4.03Å; V442-V446 WeakPolarHBondContact O-CG2 3.45Å; L443-V446 PolarHBondContact O-N 2.95Å; T444-V446 VanDerWaalsContact C-N 3.26Å; T444-V446 PolarHBondContact O-N 3.2Å; V446-L448 VanDerWaalsContact C-N 3.34Å; V446-L448 HydrophobicContact CG2-CB 4.35Å; V446-L448 HydrophobicContact CG2-CD1 3.61Å; V446-L448 HydrophobicContact CG2-CG 3.72Å
447G67.4Low74.7Confident21 Ų2122.9 Ų22.922%0.21614%0.136CC..THydrogen-bonded Turntrans7617.5175.900000115R170 L443 T444R170-G447 PolarHBondContact NH2-O 3.47Å; L443-G447 PolarHBondContact O-N 3.33Å; L443-G447 VanDerWaalsContact O-N 3.13Å; T444-G447 PolarHBondContact O-N 3.32Å; T444-G447 VanDerWaalsContact O-N 3.08Å
448L77.6Confident74.9Confident11 Ų1122.6 Ų22.66%0.05814%0.136CC..  trans-74.7147.7176.1-68.7173.1000111.4A402 Y407 L443 V446A402-L448 HydrophobicContact CB-CD1 4.06Å; A402-L448 HydrophobicContact CB-CD2 4.12Å; Y407-L448 HydrophobicContact CD2-CD2 3.31Å; Y407-L448 HydrophobicContact CE2-CD2 3.91Å; Y407-L448 HydrophobicContact CG-CD2 3.87Å; L443-L448 HydrophobicContact CB-CB 4.18Å; L443-L448 HydrophobicContact CD2-CB 3.96Å; L443-L448 HydrophobicContact CD2-CD1 3.77Å; L443-L448 PolarHBondContact O-N 3.4Å; V446-L448 VanDerWaalsContact C-N 3.34Å; V446-L448 HydrophobicContact CG2-CB 4.35Å; V446-L448 HydrophobicContact CG2-CD1 3.61Å; V446-L448 HydrophobicContact CG2-CG 3.72Å
449P74.7Confident74.8Confident37 Ų3724.3 Ų24.324%0.2415%0.147CC..  trans-65.3135.2175.627.2-35000111.7Y407 D452Y407-P449 HydrophobicContact CE2-CG 4.05Å; P449-D452 VanDerWaalsContact CG-OD2 3.23Å; P449-D452 WeakPolarHBondContact CG-OD2 3.49Å
450T74.5Confident74.7Confident44 Ų4424.3 Ų24.327%0.2715%0.147SC..SBendtrans-87.8-14.9-177.653.30000113.2V440 L443 T444 D452 I453V440-T450 HydrophobicContact CG1-CG2 3.98Å; L443-T450 HydrophobicContact CB-CG2 4.21Å; T444-T450 HydrophobicContact CG2-CG2 3.74Å; T450-D452 PolarHBondContact O-N 3.16Å; T450-I453 WeakPolarHBondContact O-CB 3.42Å; T450-I453 VanDerWaalsContact O-CG1 3.28Å; T450-I453 WeakPolarHBondContact O-CG1 3.26Å; T450-I453 PolarHBondContact O-N 3.47Å
451D70.4Confident74.7Confident119 Ų11924.8 Ų24.864%0.63615%0.145SC*.THydrogen-bonded Turntrans-64.6-24.5178-64.1-39.7000112.6I453 N454D451-I453 PolarHBondContact O-N 2.69Å; D451-N454 WeakPolarHBondContact O-CB 3.38Å; D451-N454 PolarHBondContact O-N 3.08Å; D451-N454 PolarHBondContact O-ND2 3.13Å
452D76.5Confident75.1Confident30 Ų3025.6 Ų25.616%0.1615%0.152CC..THydrogen-bonded Turntrans-73.5-12.1178.3-66.6-32.9000113.6I401 N405 P449 T450 N454 L455I401-D452 HydrophobicContact CD1-CB 4.34Å; I401-D452 HydrophobicContact CG1-CB 4.27Å; I401-D452 HydrophobicContact CG2-CB 3.75Å; N405-D452 PolarHBondContact ND2-OD2 2.97Å; N405-D452 PolarHBondContact OD1-OD2 3.48Å; P449-D452 VanDerWaalsContact CG-OD2 3.23Å; P449-D452 WeakPolarHBondContact CG-OD2 3.49Å; T450-D452 PolarHBondContact O-N 3.16Å; D452-N454 PolarHBondContact O-N 3Å; D452-L455 HydrophobicContact CB-CD1 4.23Å; D452-L455 WeakPolarHBondContact O-CB 3.45Å; D452-L455 PolarHBondContact O-N 3.36Å; D452-L455 VanDerWaalsContact O-N 3.07Å
453I77.1Confident75.3Confident7 Ų725.8 Ų25.84%0.03615%0.153CC..Hα-helixtrans-55.7-33.5168.9-65.3174.5000109.7L436 M439 V440 L443 T450 D451 L455 I456 I457L436-I453 HydrophobicContact CD2-CG2 3.83Å; M439-I453 HydrophobicContact CB-CD1 4.27Å; M439-I453 HydrophobicContact CG-CD1 3.93Å; M439-I453 HydrophobicContact CG-CG1 3.95Å; V440-I453 HydrophobicContact CB-CD1 4.39Å; V440-I453 HydrophobicContact CG2-CD1 3.5Å; V440-I453 VanDerWaalsContact CG2-CD1 3.5Å; L443-I453 HydrophobicContact CD1-CD1 3.78Å; L443-I453 HydrophobicContact CD1-CG1 3.43Å; L443-I453 VanDerWaalsContact CD1-CG1 3.43Å; T450-I453 WeakPolarHBondContact O-CB 3.42Å; T450-I453 VanDerWaalsContact O-CG1 3.28Å; T450-I453 WeakPolarHBondContact O-CG1 3.26Å; T450-I453 PolarHBondContact O-N 3.47Å; D451-I453 PolarHBondContact O-N 2.69Å; I453-L455 PolarHBondContact O-N 3.31Å; I453-L455 VanDerWaalsContact O-N 3.1Å; I453-I456 HydrophobicContact CG2-CG1 4.39Å; I453-I456 WeakPolarHBondContact O-CG1 3.23Å; I453-I456 PolarHBondContact O-N 3.42Å; I453-I457 HydrophobicContact CG2-CD1 4.35Å; I453-I457 HydrophobicContact CG2-CG1 4.22Å; I453-I457 WeakPolarHBondContact O-CG1 3.31Å; I453-I457 PolarHBondContact O-N 3.48Å
454N69.4Low75.6Confident32 Ų3226.1 Ų26.117%0.17116%0.155CC..Hα-helixtrans-60.9-25.5-178.9-62.6-45.9000113.6K288 D451 D452 I456K288-N454 HydrophobicContact CD-CB 3.6Å; K288-N454 VanDerWaalsContact CE-CB 3.41Å; K288-N454 HydrophobicContact CG-CB 4.17Å; D451-N454 WeakPolarHBondContact O-CB 3.38Å; D451-N454 PolarHBondContact O-N 3.08Å; D451-N454 PolarHBondContact O-ND2 3.13Å; D452-N454 PolarHBondContact O-N 3Å; N454-I456 VanDerWaalsContact C-N 3.33Å
455L72.8Confident76.3Confident40 Ų4026.1 Ų26.121%0.20915%0.151CC..Hα-helixtrans-66.3-36.4176.7-62.6171000111.8M292 L302 D452 I453M292-L455 HydrophobicContact CE-CD2 4.45Å; L302-L455 WeakPolarHBondContact CD1-O 3.47Å; D452-L455 HydrophobicContact CB-CD1 4.23Å; D452-L455 WeakPolarHBondContact O-CB 3.45Å; D452-L455 PolarHBondContact O-N 3.36Å; D452-L455 VanDerWaalsContact O-N 3.07Å; I453-L455 PolarHBondContact O-N 3.31Å; I453-L455 VanDerWaalsContact O-N 3.1Å
456I80.5Confident77.5Confident0 Ų029 Ų290%016%0.162CC..Hα-helixtrans-87.9-21.6-175.758.8175.5000113L302 Y305 Y393 A397 F400 I401 L436 M439 I453 N454 A458 V459 D460L302-I456 HydrophobicContact CD1-CG2 4.19Å; Y305-I456 HydrophobicContact CD1-CG2 4.24Å; Y305-I456 HydrophobicContact CE1-CB 4.06Å; Y305-I456 HydrophobicContact CE1-CG2 3.79Å; Y393-I456 WeakPolarHBondContact OH-CD1 3.48Å; A397-I456 HydrophobicContact CB-CD1 3.68Å; F400-I456 HydrophobicContact CD1-CG2 4.01Å; F400-I456 HydrophobicContact CE1-CG2 3.84Å; I401-I456 HydrophobicContact CD1-CD1 4.31Å; L436-I456 HydrophobicContact CD2-CD1 4.46Å; L436-I456 HydrophobicContact CD2-CG1 4.38Å; M439-I456 HydrophobicContact CE-CD1 4.26Å; I453-I456 HydrophobicContact CG2-CG1 4.39Å; I453-I456 WeakPolarHBondContact O-CG1 3.23Å; I453-I456 PolarHBondContact O-N 3.42Å; N454-I456 VanDerWaalsContact C-N 3.33Å; I456-A458 PolarHBondContact O-N 2.93Å; I456-A458 VanDerWaalsContact O-N 3.13Å; I456-V459 PolarHBondContact O-N 3.13Å; I456-D460 WeakPolarHBondContact O-CB 3.37Å; I456-D460 PolarHBondContact O-N 3.38Å
457I74.4Confident78.4Confident4 Ų428.7 Ų28.72%0.02116%0.16CC..Hα-helixtrans-53.8-37.1179.7-65.8176.3000112.1M68 L284 L436 I453 V459 D460M68-I457 HydrophobicContact CE-CD1 3.48Å; M68-I457 VanDerWaalsContact CE-CD1 3.48Å; M68-I457 HydrophobicContact SD-CD1 3.53Å; M68-I457 VanDerWaalsContact SD-CD1 3.53Å; L284-I457 HydrophobicContact CD1-CD1 3.97Å; L284-I457 HydrophobicContact CD1-CG2 4.06Å; L284-I457 HydrophobicContact CD2-CB 3.81Å; L284-I457 HydrophobicContact CD2-CD1 4.11Å; L284-I457 HydrophobicContact CD2-CG2 3.52Å; L284-I457 HydrophobicContact CG-CG2 4.43Å; L436-I457 HydrophobicContact CD1-CG1 3.91Å; L436-I457 HydrophobicContact CD1-CG2 4.46Å; L436-I457 HydrophobicContact CD2-CG1 4.02Å; I453-I457 HydrophobicContact CG2-CD1 4.35Å; I453-I457 HydrophobicContact CG2-CG1 4.22Å; I453-I457 WeakPolarHBondContact O-CG1 3.31Å; I453-I457 PolarHBondContact O-N 3.48Å; I457-V459 PolarHBondContact O-N 3.32Å; I457-D460 PolarHBondContact O-N 2.89Å
458A69.8Low79.5Confident23 Ų2327.9 Ų27.919%0.1915%0.151CC..Hα-helixtrans-61.2-26.2-177.700000113.9I285 L302 I456 W461I285-A458 HydrophobicContact CD1-CB 4.12Å; I285-A458 HydrophobicContact CG1-CB 3.89Å; I285-A458 HydrophobicContact CG2-CB 4.47Å; L302-A458 HydrophobicContact CD2-CB 4.45Å; I456-A458 PolarHBondContact O-N 2.93Å; I456-A458 VanDerWaalsContact O-N 3.13Å; A458-W461 PolarHBondContact O-NE1 2.95Å; A458-W461 VanDerWaalsContact O-NE1 3.15Å
459V77.1Confident80.3Confident37 Ų3729.5 Ų29.522%0.22416%0.158CC..Hα-helixtrans-111.4-17.8178.8179.30000112L302 A306 I456 I457 W461 A462 L463L302-V459 HydrophobicContact CD1-CB 4.48Å; L302-V459 HydrophobicContact CD1-CG2 4.34Å; L302-V459 HydrophobicContact CD2-CB 4.37Å; L302-V459 HydrophobicContact CD2-CG2 3.46Å; L302-V459 VanDerWaalsContact CD2-CG2 3.46Å; L302-V459 HydrophobicContact CG-CB 4.29Å; L302-V459 HydrophobicContact CG-CG2 3.66Å; A306-V459 HydrophobicContact CB-CG1 3.67Å; I456-V459 PolarHBondContact O-N 3.13Å; I457-V459 PolarHBondContact O-N 3.32Å; V459-W461 VanDerWaalsContact C-N 3.27Å; V459-W461 PolarHBondContact O-N 2.95Å; V459-A462 PolarHBondContact O-N 3.2Å; V459-L463 HydrophobicContact CG1-CD1 4.05Å; V459-L463 HydrophobicContact CG1-CG 4.03Å; V459-L463 PolarHBondContact O-N 3.44Å
460D82Confident81.4Confident0 Ų028 Ų280%015%0.148CC..Hα-helixtrans-55.8-38.2179.6-172.267.6000112.9Y393 L436 I456 I457 A462 L463 D464 R467Y393-D460 WeakPolarHBondContact CE2-OD1 3.39Å; Y393-D460 PolarHBondContact OH-OD1 3.32Å; Y393-D460 VanDerWaalsContact OH-OD1 3.09Å; L436-D460 HydrophobicContact CD1-CB 4.15Å; L436-D460 VanDerWaalsContact CD1-OD2 3.26Å; L436-D460 WeakPolarHBondContact CD1-OD2 3.47Å; L436-D460 HydrophobicContact CD2-CB 4.14Å; L436-D460 HydrophobicContact CG-CB 4.35Å; L436-D460 VanDerWaalsContact CG-OD2 3.31Å; L436-D460 WeakPolarHBondContact CG-OD2 3.49Å; I456-D460 WeakPolarHBondContact O-CB 3.37Å; I456-D460 PolarHBondContact O-N 3.38Å; I457-D460 PolarHBondContact O-N 2.89Å; D460-A462 PolarHBondContact O-N 3.17Å; D460-L463 PolarHBondContact O-N 3.28Å; D460-L463 VanDerWaalsContact O-N 3.1Å; D460-D464 VanDerWaalsContact O-CB 3.25Å; D460-D464 WeakPolarHBondContact O-CB 3.38Å; D460-D464 PolarHBondContact O-N 3.43Å; D460-R467 IonicContact OD1-CZ 3.98Å; D460-R467 IonicContact OD1-NH1 2.8Å; D460-R467 PolarHBondContact OD1-NH1 3.44Å; D460-R467 IonicContact OD1-NH2 2.75Å; D460-R467 PolarHBondContact OD1-NH2 3.5Å; D460-R467 IonicContact OD2-NH2 3.89Å; D460-R467 PolarHBondContact OD2-NH2 3.05Å
461W74.3Confident82.4Confident49 Ų4926.1 Ų26.119%0.18614%0.137CC..Hα-helixtrans-55.7-30.3178.576.2-87.6000113.7V34 V37 I281 A458 V459V34-W461 HydrophobicContact CB-CH2 4.46Å; V34-W461 HydrophobicContact CG1-CH2 4.42Å; V34-W461 HydrophobicContact CG2-CE3 4.49Å; V34-W461 HydrophobicContact CG2-CH2 3.81Å; V34-W461 HydrophobicContact CG2-CZ3 3.54Å; V37-W461 HydrophobicContact CB-CZ2 4.36Å; V37-W461 HydrophobicContact CG1-CZ2 4.17Å; V37-W461 HydrophobicContact CG2-CD2 3.88Å; V37-W461 HydrophobicContact CG2-CG 3.83Å; V37-W461 HydrophobicContact CG2-CZ2 4.25Å; I281-W461 HydrophobicContact CD1-CB 4.42Å; A458-W461 PolarHBondContact O-NE1 2.95Å; A458-W461 VanDerWaalsContact O-NE1 3.15Å; V459-W461 VanDerWaalsContact C-N 3.27Å; V459-W461 PolarHBondContact O-N 2.95Å
462A79.8Confident83.5Confident25 Ų2520.6 Ų20.621%0.20711%0.107CC..Hα-helixtrans-86.3-42.5177.900000110.8V459 D460 D464 R465 F466V459-A462 PolarHBondContact O-N 3.2Å; D460-A462 PolarHBondContact O-N 3.17Å; A462-D464 VanDerWaalsContact C-N 3.29Å; A462-D464 PolarHBondContact O-N 2.86Å; A462-R465 WeakPolarHBondContact O-CB 3.14Å; A462-R465 PolarHBondContact O-N 3.44Å; A462-F466 WeakPolarHBondContact O-CD2 3.1Å
463L89.4Confident84.5Confident4 Ų419.3 Ų19.32%0.02110%0.101CC..Hα-helixtrans-63.7-36.8178.3-63.1177.4000111.8Y305 A306 V309 V310 Y393 V459 D460 R465 F466 R467Y305-L463 HydrophobicContact CD1-CD1 4.4Å; Y305-L463 HydrophobicContact CE1-CD1 3.69Å; A306-L463 HydrophobicContact CB-CD2 4.23Å; V309-L463 HydrophobicContact CB-CD1 4.23Å; V309-L463 HydrophobicContact CB-CD2 4.22Å; V309-L463 HydrophobicContact CG1-CD1 4.27Å; V309-L463 HydrophobicContact CG1-CD2 4.16Å; V309-L463 HydrophobicContact CG2-CD1 4.28Å; V310-L463 HydrophobicContact CG2-CD2 3.64Å; Y393-L463 HydrophobicContact CE2-CD1 4.5Å; V459-L463 HydrophobicContact CG1-CD1 4.05Å; V459-L463 HydrophobicContact CG1-CG 4.03Å; V459-L463 PolarHBondContact O-N 3.44Å; D460-L463 PolarHBondContact O-N 3.28Å; D460-L463 VanDerWaalsContact O-N 3.1Å; L463-R465 PolarHBondContact O-N 3.03Å; L463-F466 PolarHBondContact O-N 3.36Å; L463-R467 WeakPolarHBondContact O-CG 3.49Å; L463-R467 PolarHBondContact O-N 3.07Å
464D86.7Confident85.4Confident7 Ų719 Ų194%0.03710%0.099CC..Hα-helixtrans-53.5-40.7179.8-166.540.2000112.3S351 P432 Q433 D460 A462 F466 R467 T468S351-D464 WeakPolarHBondContact CB-OD2 3.47Å; P432-D464 WeakPolarHBondContact CA-OD2 3.41Å; Q433-D464 PolarHBondContact N-OD2 3.49Å; D460-D464 VanDerWaalsContact O-CB 3.25Å; D460-D464 WeakPolarHBondContact O-CB 3.38Å; D460-D464 PolarHBondContact O-N 3.43Å; A462-D464 VanDerWaalsContact C-N 3.29Å; A462-D464 PolarHBondContact O-N 2.86Å; D464-F466 VanDerWaalsContact C-N 3.32Å; D464-F466 PolarHBondContact O-N 2.78Å; D464-R467 VanDerWaalsContact CB-NH2 3.31Å; D464-R467 WeakPolarHBondContact O-CB 3.39Å; D464-R467 PolarHBondContact O-N 3.49Å; D464-R467 VanDerWaalsContact O-N 3.13Å; D464-R467 IonicContact OD1-CZ 3.95Å; D464-R467 IonicContact OD1-NE 3.46Å; D464-R467 PolarHBondContact OD1-NE 2.79Å; D464-R467 IonicContact OD1-NH2 3.09Å; D464-R467 PolarHBondContact OD1-NH2 3.15Å; D464-T468 PolarHBondContact O-N 3.34Å; D464-T468 PolarHBondContact O-OG1 2.84Å
465R85.2Confident86.7Confident33 Ų3317.7 Ų17.713%0.1259%0.092CC..Hα-helixtrans-57.6-46.1177.4-62.6172.6-179.7-70.8-11.6112L30 L348 A349 S351 A462 L463 M469L30-R465 VanDerWaalsContact CD1-NH1 3.25Å; L348-R465 HydrophobicContact CD1-CB 3.83Å; L348-R465 HydrophobicContact CG-CB 4.41Å; L348-R465 WeakPolarHBondContact O-CB 3.34Å; L348-R465 VanDerWaalsContact O-CG 3.3Å; L348-R465 WeakPolarHBondContact O-CG 3.46Å; L348-R465 PolarHBondContact O-NH1 3.2Å; A349-R465 PolarHBondContact O-NH1 3.45Å; S351-R465 WeakPolarHBondContact OG-CG 3.34Å; A462-R465 WeakPolarHBondContact O-CB 3.14Å; A462-R465 PolarHBondContact O-N 3.44Å; L463-R465 PolarHBondContact O-N 3.03Å; R465-M469 WeakPolarHBondContact O-CB 3.47Å; R465-M469 PolarHBondContact O-N 3.39Å
466F93.2Very high87.8Confident79 Ų7915.8 Ų15.835%0.3468%0.082SC..Hα-helixtrans-69.5-39.9178.4-63-75.1000110.6V310 L313 L348 A462 L463 D464 M469 I470V310-F466 HydrophobicContact CG2-CD2 4.33Å; L313-F466 HydrophobicContact CD1-CB 3.67Å; L348-F466 HydrophobicContact CD1-CD1 3.87Å; L348-F466 HydrophobicContact CD1-CE1 3.98Å; L348-F466 HydrophobicContact CD1-CG 4.38Å; A462-F466 WeakPolarHBondContact O-CD2 3.1Å; L463-F466 PolarHBondContact O-N 3.36Å; D464-F466 VanDerWaalsContact C-N 3.32Å; D464-F466 PolarHBondContact O-N 2.78Å; F466-M469 HydrophobicContact CD1-CE 4.24Å; F466-M469 PolarHBondContact O-N 3.12Å; F466-I470 WeakPolarHBondContact O-CG1 3.49Å; F466-I470 PolarHBondContact O-N 3.39Å
467R94.3Very high88.6Confident0 Ų015.8 Ų15.80%08%0.082CC..Hα-helixtrans-57.3-51.9174.3-62.1-172.8-57.1-144.6-10.5111.1L313 G389 Y393 D460 L463 D464 M469 I470 N471L313-R467 HydrophobicContact CD1-CG 4.06Å; G389-R467 WeakPolarHBondContact O-CD 3.3Å; G389-R467 WeakPolarHBondContact O-CG 3.44Å; Y393-R467 VanDerWaalsContact CB-CD 3.47Å; Y393-R467 VanDerWaalsContact CD2-NH1 3.26Å; D460-R467 IonicContact OD1-CZ 3.98Å; D460-R467 IonicContact OD1-NH1 2.8Å; D460-R467 PolarHBondContact OD1-NH1 3.44Å; D460-R467 IonicContact OD1-NH2 2.75Å; D460-R467 PolarHBondContact OD1-NH2 3.5Å; D460-R467 IonicContact OD2-NH2 3.89Å; D460-R467 PolarHBondContact OD2-NH2 3.05Å; L463-R467 WeakPolarHBondContact O-CG 3.49Å; L463-R467 PolarHBondContact O-N 3.07Å; D464-R467 VanDerWaalsContact CB-NH2 3.31Å; D464-R467 WeakPolarHBondContact O-CB 3.39Å; D464-R467 PolarHBondContact O-N 3.49Å; D464-R467 VanDerWaalsContact O-N 3.13Å; D464-R467 IonicContact OD1-CZ 3.95Å; D464-R467 IonicContact OD1-NE 3.46Å; D464-R467 PolarHBondContact OD1-NE 2.79Å; D464-R467 IonicContact OD1-NH2 3.09Å; D464-R467 PolarHBondContact OD1-NH2 3.15Å; R467-M469 VanDerWaalsContact C-N 3.32Å; R467-M469 PolarHBondContact O-N 3.04Å; R467-I470 PolarHBondContact O-N 3.1Å; R467-I470 VanDerWaalsContact O-N 3.15Å; R467-N471 VanDerWaalsContact O-CG 3.25Å; R467-N471 PolarHBondContact O-N 2.62Å; R467-N471 PolarHBondContact O-OD1 2.68Å
468T90.9Very high89.6Confident5 Ų515.6 Ų15.63%0.0318%0.081CC..Hα-helixtrans-57.4-46.3178.4-50.20000111.3A347 S351 S352 S353 D464 I470 N471 V472A347-T468 HydrophobicContact CB-CG2 4.07Å; S351-T468 WeakPolarHBondContact CA-OG1 3.25Å; S351-T468 PolarHBondContact O-OG1 3.25Å; S352-T468 VanDerWaalsContact C-CG2 3.42Å; S352-T468 VanDerWaalsContact N-CG2 3.3Å; S353-T468 VanDerWaalsContact N-CG2 3.3Å; D464-T468 PolarHBondContact O-N 3.34Å; D464-T468 PolarHBondContact O-OG1 2.84Å; T468-I470 VanDerWaalsContact C-N 3.29Å; T468-I470 PolarHBondContact O-N 2.69Å; T468-N471 PolarHBondContact O-N 2.82Å; T468-V472 HydrophobicContact CG2-CG2 4.44Å; T468-V472 WeakPolarHBondContact O-CG2 3.21Å; T468-V472 PolarHBondContact O-N 3.03Å
469M93.8Very high90.8Very high44 Ų4414.5 Ų14.522%0.2177%0.072CC..Hα-helixtrans-59.1-41.2178.7-174.4-177.868.100111.8L344 L348 R465 F466 R467 L473L344-M469 HydrophobicContact CB-CG 4.01Å; L344-M469 HydrophobicContact CB-SD 4.5Å; L344-M469 HydrophobicContact CD2-CG 4.24Å; L348-M469 HydrophobicContact CB-SD 4.36Å; L348-M469 HydrophobicContact CD1-CB 4.47Å; L348-M469 HydrophobicContact CD1-SD 4.12Å; R465-M469 WeakPolarHBondContact O-CB 3.47Å; R465-M469 PolarHBondContact O-N 3.39Å; F466-M469 HydrophobicContact CD1-CE 4.24Å; F466-M469 PolarHBondContact O-N 3.12Å; R467-M469 VanDerWaalsContact C-N 3.32Å; R467-M469 PolarHBondContact O-N 3.04Å; M469-L473 WeakPolarHBondContact O-CB 3.4Å; M469-L473 PolarHBondContact O-N 3.23Å
470I96.7Very high91.6Very high5 Ų512.9 Ų12.93%0.0266%0.063CC..Hα-helixtrans-69.2-40176.6-63.9-41.9000111.9L313 L321 D388 F466 R467 T468 V472 L473 G474L313-I470 HydrophobicContact CB-CG1 4.08Å; L313-I470 HydrophobicContact CD2-CB 4.4Å; L313-I470 HydrophobicContact CD2-CG1 4.15Å; L321-I470 HydrophobicContact CD1-CG2 4.41Å; D388-I470 HydrophobicContact CB-CG2 4.45Å; F466-I470 WeakPolarHBondContact O-CG1 3.49Å; F466-I470 PolarHBondContact O-N 3.39Å; R467-I470 PolarHBondContact O-N 3.1Å; R467-I470 VanDerWaalsContact O-N 3.15Å; T468-I470 VanDerWaalsContact C-N 3.29Å; T468-I470 PolarHBondContact O-N 2.69Å; I470-V472 PolarHBondContact O-N 2.86Å; I470-L473 HydrophobicContact CD1-CD2 4.37Å; I470-L473 WeakPolarHBondContact O-CB 3.43Å; I470-L473 PolarHBondContact O-N 3.47Å; I470-G474 PolarHBondContact O-N 2.93Å
471N95.6Very high92.3Very high5 Ų512.9 Ų12.93%0.0276%0.063CC..Hα-helixtrans-59.1-49.4175.7-64.1-7.8000110.7D388 G389 T390 R467 T468 L473 G474 D475D388-N471 PolarHBondContact N-OD1 2.98Å; G389-N471 WeakPolarHBondContact CA-OD1 3.28Å; G389-N471 PolarHBondContact N-OD1 3.2Å; T390-N471 PolarHBondContact OG1-ND2 2.95Å; R467-N471 VanDerWaalsContact O-CG 3.25Å; R467-N471 PolarHBondContact O-N 2.62Å; R467-N471 PolarHBondContact O-OD1 2.68Å; T468-N471 PolarHBondContact O-N 2.82Å; N471-L473 VanDerWaalsContact C-N 3.32Å; N471-L473 PolarHBondContact O-N 2.94Å; N471-G474 PolarHBondContact O-N 2.92Å; N471-G474 VanDerWaalsContact O-N 3.14Å; N471-D475 PolarHBondContact O-N 2.7Å
472V94.9Very high93.2Very high3 Ų310.6 Ų10.62%0.0185%0.054CC..Hα-helixtrans-63.4-37.2178.1175.60000112L344 A347 T356 T360 T468 I470 D475 A476L344-V472 HydrophobicContact CD2-CB 4.37Å; L344-V472 HydrophobicContact CD2-CG1 4.13Å; A347-V472 HydrophobicContact CB-CB 4.22Å; A347-V472 HydrophobicContact CB-CG2 3.83Å; T356-V472 VanDerWaalsContact OG1-CG2 3.32Å; T356-V472 WeakPolarHBondContact OG1-CG2 3.44Å; T360-V472 HydrophobicContact CG2-CG1 4.2Å; T360-V472 WeakPolarHBondContact OG1-CG1 3.45Å; T468-V472 HydrophobicContact CG2-CG2 4.44Å; T468-V472 WeakPolarHBondContact O-CG2 3.21Å; T468-V472 PolarHBondContact O-N 3.03Å; I470-V472 PolarHBondContact O-N 2.86Å; V472-D475 PolarHBondContact O-N 2.83Å; V472-A476 WeakPolarHBondContact O-CB 3.39Å; V472-A476 PolarHBondContact O-N 3.36Å
473L97.2Very high93.8Very high4 Ų410.4 Ų10.42%0.0215%0.053CC..Hα-helixtrans-63.7-43.4173.9177.259.1000111.7G317 I337 L344 M469 I470 N471 A476 L477G317-L473 VanDerWaalsContact O-CD2 3.3Å; G317-L473 WeakPolarHBondContact O-CD2 3.23Å; I337-L473 HydrophobicContact CD1-CD1 4.2Å; I337-L473 HydrophobicContact CG1-CD1 3.86Å; I337-L473 HydrophobicContact CG2-CD1 4.46Å; L344-L473 HydrophobicContact CD1-CD1 4.16Å; L344-L473 HydrophobicContact CD2-CB 3.75Å; L344-L473 HydrophobicContact CD2-CD1 4.47Å; M469-L473 WeakPolarHBondContact O-CB 3.4Å; M469-L473 PolarHBondContact O-N 3.23Å; I470-L473 HydrophobicContact CD1-CD2 4.37Å; I470-L473 WeakPolarHBondContact O-CB 3.43Å; I470-L473 PolarHBondContact O-N 3.47Å; N471-L473 VanDerWaalsContact C-N 3.32Å; N471-L473 PolarHBondContact O-N 2.94Å; L473-A476 PolarHBondContact O-N 3.17Å; L473-L477 HydrophobicContact CD1-CD1 3.85Å; L473-L477 HydrophobicContact CD1-CG 4.02Å; L473-L477 HydrophobicContact CG-CD1 3.96Å; L473-L477 WeakPolarHBondContact O-CB 3.27Å; L473-L477 WeakPolarHBondContact O-CG 3.04Å; L473-L477 PolarHBondContact O-N 3.38Å
474G96.5Very high93.9Very high0 Ų013.8 Ų13.80%07%0.068CC..Hα-helixtrans-57.1-48.1175.100000112.1I470 N471 A476 L477 A478I470-G474 PolarHBondContact O-N 2.93Å; N471-G474 PolarHBondContact O-N 2.92Å; N471-G474 VanDerWaalsContact O-N 3.14Å; G474-A476 PolarHBondContact O-N 2.92Å; G474-L477 PolarHBondContact O-N 2.91Å; G474-A478 VanDerWaalsContact O-CB 3.3Å; G474-A478 WeakPolarHBondContact O-CB 3.38Å; G474-A478 PolarHBondContact O-N 3.32Å
475D95.2Very high94.1Very high5 Ų516.1 Ų16.13%0.0278%0.08CC..Hα-helixtrans-62.3-44.1178.6-65.3-15.5000112.3L379 G382 A383 N386 N471 V472 A478 A479L379-D475 HydrophobicContact CD2-CB 3.83Å; G382-D475 VanDerWaalsContact C-OD2 3.27Å; G382-D475 VanDerWaalsContact CA-OD1 3.27Å; G382-D475 WeakPolarHBondContact CA-OD1 3.36Å; A383-D475 PolarHBondContact N-OD2 3.36Å; N386-D475 VanDerWaalsContact CB-OD1 3.26Å; N386-D475 WeakPolarHBondContact CB-OD1 3.3Å; N386-D475 PolarHBondContact ND2-N 3.42Å; N386-D475 PolarHBondContact ND2-OD1 2.82Å; N471-D475 PolarHBondContact O-N 2.7Å; V472-D475 PolarHBondContact O-N 2.83Å; D475-A478 PolarHBondContact O-N 3.37Å; D475-A479 PolarHBondContact O-N 2.79Å
476A96.4Very high94.1Very high0 Ų014.6 Ų14.60%07%0.074CC..Hα-helixtrans-63.4-45.3178.400000111.8F336 V340 T360 L364 V472 L473 G474 A479 G480F336-A476 HydrophobicContact CE1-CB 4.35Å; F336-A476 VanDerWaalsContact CE1-O 3.26Å; F336-A476 WeakPolarHBondContact CE1-O 3.2Å; F336-A476 VanDerWaalsContact CZ-O 3.22Å; F336-A476 WeakPolarHBondContact CZ-O 2.97Å; V340-A476 HydrophobicContact CB-CB 4.45Å; V340-A476 HydrophobicContact CG1-CB 4.11Å; V340-A476 HydrophobicContact CG2-CB 4.28Å; T360-A476 HydrophobicContact CG2-CB 4.39Å; L364-A476 HydrophobicContact CD2-CB 4.26Å; V472-A476 WeakPolarHBondContact O-CB 3.39Å; V472-A476 PolarHBondContact O-N 3.36Å; L473-A476 PolarHBondContact O-N 3.17Å; G474-A476 PolarHBondContact O-N 2.92Å; A476-A479 PolarHBondContact O-N 3Å; A476-G480 PolarHBondContact O-N 2.9Å; A476-G480 VanDerWaalsContact O-N 3.16Å
477L97.1Very high93.6Very high0 Ų019.6 Ų19.60%09%0.091CC..Hα-helixtrans-66.9-39.3177.7-71.2172.8000111.5L321 Y325 F336 I337 L473 G474 A479 G480 I481L321-L477 HydrophobicContact CB-CD1 3.66Å; Y325-L477 HydrophobicContact CD2-CB 4.39Å; Y325-L477 HydrophobicContact CD2-CD2 3.67Å; Y325-L477 HydrophobicContact CE2-CD2 4.3Å; Y325-L477 HydrophobicContact CG-CD2 3.95Å; F336-L477 HydrophobicContact CD1-CD2 3.68Å; F336-L477 HydrophobicContact CE1-CD2 4.08Å; I337-L477 HydrophobicContact CG1-CD2 4.32Å; L473-L477 HydrophobicContact CD1-CD1 3.85Å; L473-L477 HydrophobicContact CD1-CG 4.02Å; L473-L477 HydrophobicContact CG-CD1 3.96Å; L473-L477 WeakPolarHBondContact O-CB 3.27Å; L473-L477 WeakPolarHBondContact O-CG 3.04Å; L473-L477 PolarHBondContact O-N 3.38Å; G474-L477 PolarHBondContact O-N 2.91Å; L477-A479 PolarHBondContact O-N 2.94Å; L477-G480 PolarHBondContact O-N 2.71Å; L477-I481 WeakPolarHBondContact O-CG1 3.47Å; L477-I481 PolarHBondContact O-N 2.87Å
478A95.6Very high92.5Very high0 Ų027.6 Ų27.60%013%0.126CC..Hα-helixtrans-57.8-47.7173.800000111Y105 Y106 V378 G474 D475 G480 I481 M482Y105-A478 HydrophobicContact CD1-CB 3.75Å; Y105-A478 HydrophobicContact CE1-CB 3.51Å; Y106-A478 HydrophobicContact CD1-CB 4.27Å; Y106-A478 HydrophobicContact CE1-CB 3.39Å; V378-A478 HydrophobicContact CG1-CB 4.12Å; G474-A478 VanDerWaalsContact O-CB 3.3Å; G474-A478 WeakPolarHBondContact O-CB 3.38Å; G474-A478 PolarHBondContact O-N 3.32Å; D475-A478 PolarHBondContact O-N 3.37Å; A478-G480 VanDerWaalsContact C-N 3.27Å; A478-G480 PolarHBondContact O-N 3.01Å; A478-I481 PolarHBondContact O-N 3.27Å; A478-I481 VanDerWaalsContact O-N 3.09Å; A478-M482 WeakPolarHBondContact O-CB 3.36Å; A478-M482 VanDerWaalsContact O-CG 3.27Å; A478-M482 WeakPolarHBondContact O-CG 3.26Å; A478-M482 PolarHBondContact O-N 2.92Å
479A94.3Very high91.5Very high0 Ų029.6 Ų29.60%014%0.136CC..Hα-helixtrans-58.7-39.9177.100000112.1L364 V378 L379 D475 A476 L477 A483L364-A479 HydrophobicContact CD1-CB 3.56Å; V378-A479 HydrophobicContact CB-CB 4.22Å; V378-A479 HydrophobicContact CG1-CB 3.94Å; L379-A479 HydrophobicContact CD2-CB 4.49Å; D475-A479 PolarHBondContact O-N 2.79Å; A476-A479 PolarHBondContact O-N 3Å; L477-A479 PolarHBondContact O-N 2.94Å; A479-A483 VanDerWaalsContact O-CB 3.28Å; A479-A483 WeakPolarHBondContact O-CB 3.42Å; A479-A483 PolarHBondContact O-N 3.5Å
480G95.3Very high90.2Very high3 Ų329.2 Ų29.23%0.03113%0.133CC..Hα-helixtrans-66.5-37.8174.500000114A476 L477 A478 H484A476-G480 PolarHBondContact O-N 2.9Å; A476-G480 VanDerWaalsContact O-N 3.16Å; L477-G480 PolarHBondContact O-N 2.71Å; A478-G480 VanDerWaalsContact C-N 3.27Å; A478-G480 PolarHBondContact O-N 3.01Å; G480-H484 PolarHBondContact O-N 2.86Å
481I95.9Very high88.5Confident0 Ų032.2 Ų32.20%016%0.159CC..Hα-helixtrans-68.5-47.1176-71.6164.3000110.7Y105 Y325 I328 T329 L477 A478 A483 H484 I485Y105-I481 HydrophobicContact CD2-CD1 4.47Å; Y105-I481 HydrophobicContact CE2-CD1 3.45Å; Y105-I481 VanDerWaalsContact CE2-CD1 3.45Å; Y105-I481 WeakPolarHBondContact OH-CD1 3.35Å; Y325-I481 HydrophobicContact CD2-CD1 4.22Å; Y325-I481 HydrophobicContact CD2-CG1 3.72Å; Y325-I481 HydrophobicContact CE2-CG1 4.37Å; Y325-I481 HydrophobicContact CG-CG1 4.42Å; I328-I481 HydrophobicContact CD1-CD1 4.38Å; I328-I481 HydrophobicContact CD1-CG2 4.06Å; I328-I481 HydrophobicContact CG2-CG2 3.94Å; T329-I481 HydrophobicContact CG2-CG1 4.03Å; L477-I481 WeakPolarHBondContact O-CG1 3.47Å; L477-I481 PolarHBondContact O-N 2.87Å; A478-I481 PolarHBondContact O-N 3.27Å; A478-I481 VanDerWaalsContact O-N 3.09Å; I481-A483 VanDerWaalsContact C-N 3.29Å; I481-A483 PolarHBondContact O-N 3.26Å; I481-H484 WeakPolarHBondContact O-CA 3.39Å; I481-H484 WeakPolarHBondContact O-CB 3.5Å; I481-H484 PolarHBondContact O-N 2.84Å; I481-I485 HydrophobicContact CG2-CD1 3.61Å; I481-I485 HydrophobicContact CG2-CG1 4.31Å; I481-I485 WeakPolarHBondContact O-CG1 3.5Å; I481-I485 PolarHBondContact O-N 2.97Å
482M93.4Very high86.4Confident1 Ų138.6 Ų38.61%0.00519%0.188CC..Hα-helixtrans-61.6-39.4177.5-64.9-55.5143.400111.2L98 L101 Y105 I374 V378 A478 H484 I485 C486L98-M482 HydrophobicContact CD1-CB 3.77Å; L98-M482 HydrophobicContact CD1-CG 4.2Å; L98-M482 HydrophobicContact CD1-SD 4.48Å; L101-M482 HydrophobicContact CB-SD 4.02Å; L101-M482 HydrophobicContact CD2-CE 4.32Å; L101-M482 HydrophobicContact CD2-SD 3.51Å; L101-M482 VanDerWaalsContact CD2-SD 3.51Å; L101-M482 HydrophobicContact CG-CE 3.97Å; L101-M482 HydrophobicContact CG-SD 3.65Å; L101-M482 WeakPolarHBondContact O-CE 3.04Å; Y105-M482 HydrophobicContact CD1-CE 4.45Å; Y105-M482 HydrophobicContact CD2-CE 4.32Å; Y105-M482 HydrophobicContact CG-CE 3.85Å; I374-M482 HydrophobicContact CG2-CB 3.99Å; V378-M482 HydrophobicContact CG2-CB 4.23Å; V378-M482 HydrophobicContact CG2-CG 4.12Å; A478-M482 WeakPolarHBondContact O-CB 3.36Å; A478-M482 VanDerWaalsContact O-CG 3.27Å; A478-M482 WeakPolarHBondContact O-CG 3.26Å; A478-M482 PolarHBondContact O-N 2.92Å; M482-H484 VanDerWaalsContact C-N 3.25Å; M482-H484 PolarHBondContact O-N 3Å; M482-I485 PolarHBondContact O-N 3.39Å; M482-C486 VanDerWaalsContact O-CB 3.31Å; M482-C486 WeakPolarHBondContact O-CB 3.33Å; M482-C486 PolarHBondContact O-N 3.43Å
483A91.8Very high84.4Confident21 Ų2142.6 Ų42.617%0.17421%0.21CC..Hα-helixtrans-60.7-33.2172.600000113.7I370 I374 A479 I481I370-A483 HydrophobicContact CD1-CB 3.76Å; I370-A483 HydrophobicContact CG2-CB 4.21Å; I374-A483 VanDerWaalsContact CD1-CA 3.41Å; I374-A483 HydrophobicContact CD1-CB 3.78Å; A479-A483 VanDerWaalsContact O-CB 3.28Å; A479-A483 WeakPolarHBondContact O-CB 3.42Å; A479-A483 PolarHBondContact O-N 3.5Å; I481-A483 VanDerWaalsContact C-N 3.29Å; I481-A483 PolarHBondContact O-N 3.26Å
484H92.4Very high82Confident75 Ų7548.6 Ų48.635%0.34724%0.239SC..Hα-helixtrans-74.2-47.6174.6-173.578.9000112.2T329 G480 I481 M482 R487T329-H484 HydrophobicContact CG2-CB 3.82Å; G480-H484 PolarHBondContact O-N 2.86Å; I481-H484 WeakPolarHBondContact O-CA 3.39Å; I481-H484 WeakPolarHBondContact O-CB 3.5Å; I481-H484 PolarHBondContact O-N 2.84Å; M482-H484 VanDerWaalsContact C-N 3.25Å; M482-H484 PolarHBondContact O-N 3Å; H484-R487 WeakPolarHBondContact O-CB 3.44Å
485I91.1Very high79.3Confident55 Ų5552 Ų5228%0.28227%0.274SS..Hα-helixtrans-69.6-45.3-174.6-62.6169.7000111.2L101 I328 I481 M482 R487L101-I485 HydrophobicContact CD2-CB 3.91Å; L101-I485 HydrophobicContact CD2-CD1 3.8Å; L101-I485 HydrophobicContact CD2-CG1 4.47Å; L101-I485 HydrophobicContact CD2-CG2 3.46Å; L101-I485 VanDerWaalsContact CD2-CG2 3.46Å; I328-I485 HydrophobicContact CG2-CD1 3.97Å; I328-I485 HydrophobicContact CG2-CG1 4.04Å; I481-I485 HydrophobicContact CG2-CD1 3.61Å; I481-I485 HydrophobicContact CG2-CG1 4.31Å; I481-I485 WeakPolarHBondContact O-CG1 3.5Å; I481-I485 PolarHBondContact O-N 2.97Å; M482-I485 PolarHBondContact O-N 3.39Å; I485-R487 VanDerWaalsContact C-N 3.26Å; I485-R487 PolarHBondContact O-N 2.74Å
486C85.6Confident76.7Confident1 Ų157.1 Ų57.11%0.00731%0.306CS..THydrogen-bonded Turntrans-84.85.5-176.9-64.70000113.4L98 M482 K488 D489 F490L98-C486 HydrophobicContact CD1-CB 4.49Å; M482-C486 VanDerWaalsContact O-CB 3.31Å; M482-C486 WeakPolarHBondContact O-CB 3.33Å; M482-C486 PolarHBondContact O-N 3.43Å; C486-K488 PolarHBondContact O-N 3.15Å; C486-K488 VanDerWaalsContact O-N 3.08Å; C486-D489 PolarHBondContact O-N 2.96Å; C486-F490 HydrophobicContact CB-CD2 3.87Å; C486-F490 HydrophobicContact CB-CE2 3.44Å; C486-F490 VanDerWaalsContact CB-CE2 3.44Å; C486-F490 HydrophobicContact CB-CZ 4.48Å; C486-F490 WeakPolarHBondContact O-CD2 3.49Å; C486-F490 PolarHBondContact O-N 2.86Å
487R81.9Confident73.7Confident185 Ų18562.6 Ų62.670%0.69833%0.331SS*.Hα-helixtrans-52.5-35.8-178.5-171.9179.5179.5-168.40.4113.5H484 I485 A491H484-R487 WeakPolarHBondContact O-CB 3.44Å; I485-R487 VanDerWaalsContact C-N 3.26Å; I485-R487 PolarHBondContact O-N 2.74Å; R487-A491 WeakPolarHBondContact O-CB 3.46Å; R487-A491 PolarHBondContact O-N 3.15Å
488K70.9Confident70.7Confident168 Ų16871.8 Ų71.873%0.7337%0.371SS*.Hα-helixtrans-71.7-35.5-179.9-67.8-174.6179.51800112.7C486 A491 Q492C486-K488 PolarHBondContact O-N 3.15Å; C486-K488 VanDerWaalsContact O-N 3.08Å; K488-A491 PolarHBondContact O-N 3.33Å; K488-Q492 PolarHBondContact O-N 3.38Å
489D70.7Confident67.4Low46 Ų4679.8 Ų79.825%0.24641%0.413CS..Hα-helixtrans-69.7-42.7-177.8-55.6-11.2000109.2R97 C486 A491 Q492 D493R97-D489 IonicContact CZ-OD1 3.27Å; R97-D489 IonicContact CZ-OD2 3.57Å; R97-D489 IonicContact NE-OD2 2.83Å; R97-D489 IonicContact NH1-OD1 2.72Å; R97-D489 PolarHBondContact NH1-OD1 2.9Å; R97-D489 IonicContact NH1-OD2 3.43Å; R97-D489 PolarHBondContact NH1-OD2 3.22Å; C486-D489 PolarHBondContact O-N 2.96Å; D489-A491 PolarHBondContact O-N 2.93Å; D489-Q492 PolarHBondContact O-N 3.48Å; D489-D493 PolarHBondContact O-N 2.82Å
490F65.7Low64.3Low37 Ų3786.5 Ų86.516%0.16245%0.448CS..Hα-helixtrans-74.7-21.1176.7-62.8-65.2000114.6L98 I374 C486 Q492 M494L98-F490 HydrophobicContact CD2-CZ 4.22Å; I374-F490 HydrophobicContact CD1-CD2 3.83Å; I374-F490 HydrophobicContact CD1-CE2 3.41Å; I374-F490 VanDerWaalsContact CD1-CE2 3.41Å; I374-F490 HydrophobicContact CD1-CZ 4.17Å; I374-F490 HydrophobicContact CG1-CD2 4.29Å; I374-F490 HydrophobicContact CG1-CE2 3.55Å; I374-F490 HydrophobicContact CG1-CZ 3.78Å; C486-F490 HydrophobicContact CB-CD2 3.87Å; C486-F490 HydrophobicContact CB-CE2 3.44Å; C486-F490 VanDerWaalsContact CB-CE2 3.44Å; C486-F490 HydrophobicContact CB-CZ 4.48Å; C486-F490 WeakPolarHBondContact O-CD2 3.49Å; C486-F490 PolarHBondContact O-N 2.86Å; F490-Q492 VanDerWaalsContact C-N 3.32Å; F490-M494 WeakPolarHBondContact O-CG 3.44Å; F490-M494 PolarHBondContact O-N 2.97Å
491A61.1Low61.5Low67 Ų6792.2 Ų92.255%0.55449%0.485SS*.Hα-helixtrans-74-25.2173.600000112.4R487 K488 D489R487-A491 WeakPolarHBondContact O-CB 3.46Å; R487-A491 PolarHBondContact O-N 3.15Å; K488-A491 PolarHBondContact O-N 3.33Å; D489-A491 PolarHBondContact O-N 2.93Å
492Q52.5Low58.5Low139 Ų13998.1 Ų98.165%0.6553%0.525SS*.Hα-helixtrans-79-37.2176.4-72.5179.8-20.500112.2K488 D489 F490 M494 G495 T496K488-Q492 PolarHBondContact O-N 3.38Å; D489-Q492 PolarHBondContact O-N 3.48Å; F490-Q492 VanDerWaalsContact C-N 3.32Å; Q492-M494 VanDerWaalsContact C-N 3.35Å; Q492-M494 PolarHBondContact O-N 3.49Å; Q492-G495 PolarHBondContact O-N 2.91Å; Q492-G495 VanDerWaalsContact O-N 3.15Å; Q492-T496 PolarHBondContact O-N 3.12Å; Q492-T496 PolarHBondContact O-OG1 3.05Å
493D51.4Low55.4Low88 Ų88107 Ų10747%0.47157%0.566SS.*Hα-helixtrans-62.8-39.3174-84.6-14.9000112.3D489 G495 T496 E497D489-D493 PolarHBondContact O-N 2.82Å; D493-G495 PolarHBondContact O-N 3.26Å; D493-T496 PolarHBondContact O-N 2.83Å; D493-E497 PolarHBondContact O-N 3.49Å
494M46.3Very low52.6Low129 Ų129112.8 Ų112.864%0.63560%0.6SS**THydrogen-bonded Turntrans-67-18.8175.9-68.8-77.7-90.600113.5F490 Q492 T496F490-M494 WeakPolarHBondContact O-CG 3.44Å; F490-M494 PolarHBondContact O-N 2.97Å; Q492-M494 VanDerWaalsContact C-N 3.35Å; Q492-M494 PolarHBondContact O-N 3.49Å; M494-T496 VanDerWaalsContact C-N 3.34Å
495G41.3Very low49.5Very low71 Ų71117.9 Ų117.973%0.73262%0.621SS**THydrogen-bonded Turntrans-83.8-11.1172.500000113.7Q492 D493Q492-G495 PolarHBondContact O-N 2.91Å; Q492-G495 VanDerWaalsContact O-N 3.15Å; D493-G495 PolarHBondContact O-N 3.26Å
496T39.9Very low46.6Very low114 Ų114121.1 Ų121.170%0.69965%0.646SS**THydrogen-bonded Turntrans-119.3-13.5-172.7-34.10000112.5Q492 D493 M494 K498Q492-T496 PolarHBondContact O-N 3.12Å; Q492-T496 PolarHBondContact O-OG1 3.05Å; D493-T496 PolarHBondContact O-N 2.83Å; M494-T496 VanDerWaalsContact C-N 3.34Å; T496-K498 PolarHBondContact O-N 2.85Å; T496-K498 VanDerWaalsContact O-N 3.07Å
497E34.3Very low44.2Very low114 Ų114125.6 Ų125.653%0.53367%0.672SS.*  trans-68.9101.5168.9-86.4-174.6151.200110.8D493 L499D493-E497 PolarHBondContact O-N 3.49Å; E497-L499 PolarHBondContact O-N 3.2Å
498K33.3Very low42Very low193 Ų193121 Ų12184%0.83967%0.666SS**  trans-52.5125.5147.4-80179.7175.9177.70107.1T496 L500T496-K498 PolarHBondContact O-N 2.85Å; T496-K498 VanDerWaalsContact O-N 3.07Å; K498-L500 PolarHBondContact O-N 3.23Å
499L26.2Very low40.4Very low168 Ų168119.8 Ų119.888%0.8867%0.666SS**  trans-42.7111.2171.1-100.790.2000110.1E497E497-L499 PolarHBondContact O-N 3.2Å
500L29Very low38.9Very low142 Ų142125.4 Ų125.474%0.74369%0.691SS**  trans-70.3125.9157.9-80.2155.8000107K498 C502K498-L500 PolarHBondContact O-N 3.23Å; L500-C502 VanDerWaalsContact C-N 3.25Å; L500-C502 PolarHBondContact O-N 3.02Å
501P36Very low37.6Very low122 Ų122129.3 Ų129.379%0.79271%0.709SS**SBendtrans-8076.5-179.232.5-32000109.6
502C34Very low36.7Very low125 Ų125130.6 Ų130.685%0.84571%0.706SS**  trans-151.659.3164.7-91.90000110.5L500L500-C502 VanDerWaalsContact C-N 3.25Å; L500-C502 PolarHBondContact O-N 3.02Å
503E28.4Very low36Very low186 Ų186128 Ų12887%0.86970%0.7SS**  trans-107.2105.9148.7-93.2-165.6138.300107.5K505E503-K505 PolarHBondContact O-N 3.36Å
504T32.1Very low35.3Very low143 Ų143127.4 Ų127.488%0.87771%0.707SS**  trans-67.8100.7164.536.50000108
505K28.1Very low35Very low182 Ų182125.3 Ų125.379%0.79171%0.71SS**  trans-56.5137.1164.4-79.7-179.9175.6177.20109E503 V507E503-K505 PolarHBondContact O-N 3.36Å; K505-V507 PolarHBondContact O-N 3.31Å; K505-V507 VanDerWaalsContact O-N 3.12Å
506P30.4Very low34.9Very low124 Ų124129.3 Ų129.381%0.80571%0.71SS**  trans-68.7111.9169.926.9-29.4000108.5T508P506-T508 PolarHBondContact O-N 2.72Å
507V35.8Very low34.8Very low94 Ų94132.1 Ų132.157%0.5772%0.715SS**  trans-61.4127.5172.6176.30000108K505 E511 I512K505-V507 PolarHBondContact O-N 3.31Å; K505-V507 VanDerWaalsContact O-N 3.12Å; V507-E511 HydrophobicContact CG1-CB 3.93Å; V507-E511 WeakPolarHBondContact CG1-OE2 3.38Å; V507-I512 HydrophobicContact CG1-CD1 4.45Å; V507-I512 HydrophobicContact CG1-CG1 4.02Å
508T35.5Very low34.9Very low90 Ų90134.1 Ų134.155%0.55273%0.729SS**  trans-82145-178.1-7.50000109.3P506 Q510 E511P506-T508 PolarHBondContact O-N 2.72Å; T508-Q510 PolarHBondContact O-N 3.02Å; T508-E511 PolarHBondContact N-OE2 2.78Å; T508-E511 PolarHBondContact O-N 3.01Å
509L36.8Very low35.4Very low141 Ų141128.8 Ų128.874%0.73873%0.729SS**Hα-helixtrans-54.2-23.4-175.5-139.3106000113.8V513L509-V513 WeakPolarHBondContact O-CG2 3.48Å; L509-V513 PolarHBondContact O-N 2.95Å
510Q38Very low35.7Very low164 Ų164126.2 Ų126.277%0.76672%0.724SS**Hα-helixtrans-68.7-31.4174.8-82.7174.9-3900113.9T508 V513 A514T508-Q510 PolarHBondContact O-N 3.02Å; Q510-V513 PolarHBondContact O-N 2.96Å; Q510-A514 PolarHBondContact O-N 2.98Å; Q510-A514 VanDerWaalsContact O-N 3.12Å
511E39.6Very low36Very low119 Ų119126.5 Ų126.556%0.55673%0.731SS**Hα-helixtrans-73.3-31.3177.7-68176.314400111.4V507 T508 A515V507-E511 HydrophobicContact CG1-CB 3.93Å; V507-E511 WeakPolarHBondContact CG1-OE2 3.38Å; T508-E511 PolarHBondContact N-OE2 2.78Å; T508-E511 PolarHBondContact O-N 3.01Å; E511-A515 PolarHBondContact O-N 3.15Å
512I41.5Very low35.7Very low95 Ų95129.3 Ų129.349%0.48773%0.731SS.*Hα-helixtrans-70.2-37.6174.6-60174.4000110.8V507 A515V507-I512 HydrophobicContact CG1-CD1 4.45Å; V507-I512 HydrophobicContact CG1-CG1 4.02Å; I512-A515 PolarHBondContact O-N 3.1Å
513V39Very low35.4Very low85 Ų85128.4 Ų128.452%0.51573%0.726SS.*Hα-helixtrans-74.6-32.4-179.9175.70000111.9L509 Q510 A515 Q516L509-V513 WeakPolarHBondContact O-CG2 3.48Å; L509-V513 PolarHBondContact O-N 2.95Å; Q510-V513 PolarHBondContact O-N 2.96Å; V513-A515 VanDerWaalsContact C-N 3.28Å; V513-A515 PolarHBondContact O-N 3.09Å; V513-Q516 PolarHBondContact O-N 2.9Å
514A35.6Very low35.6Very low75 Ų75127 Ų12762%0.6273%0.73SS**Hα-helixtrans-66.7-29.2175.300000112.9Q510 Q516Q510-A514 PolarHBondContact O-N 2.98Å; Q510-A514 VanDerWaalsContact O-N 3.12Å; A514-Q516 VanDerWaalsContact C-N 3.31Å; A514-Q516 PolarHBondContact O-N 3.38Å
515A41Very low35.7Very low85 Ų85124.3 Ų124.370%0.70272%0.722SS**THydrogen-bonded Turntrans-76.5-14.4176.700000113.8E511 I512 V513E511-A515 PolarHBondContact O-N 3.15Å; I512-A515 PolarHBondContact O-N 3.1Å; V513-A515 VanDerWaalsContact C-N 3.28Å; V513-A515 PolarHBondContact O-N 3.09Å
516Q39.1Very low36Very low155 Ų155124.1 Ų124.172%0.72472%0.724SS**THydrogen-bonded Turntrans-89.5-2.4-177.2-76.5-161.8-42.400115V513 A514 N518V513-Q516 PolarHBondContact O-N 2.9Å; A514-Q516 VanDerWaalsContact C-N 3.31Å; A514-Q516 PolarHBondContact O-N 3.38Å; Q516-N518 PolarHBondContact O-N 2.99Å
517Q36.4Very low36Very low172 Ų172123.4 Ų123.480%0.80473%0.728SS**SBendtrans-83.5-0.8-171.4-103.1-172.2-11.500116.8
518N36.5Very low35.7Very low156 Ų156124.5 Ų124.583%0.83474%0.74SS**SBendtrans-112.196.4171.2-74.5-17.4000109.7Q516 C520Q516-N518 PolarHBondContact O-N 2.99Å; N518-C520 PolarHBondContact O-N 3.17Å; N518-C520 VanDerWaalsContact O-N 3.11Å
519G45.3Very low35.7Very low81 Ų81128.9 Ų128.984%0.83575%0.754SS**  trans-55.4111.9-178.300000112.8
520C31.2Very low35.3Very low114 Ų114130 Ų13077%0.7776%0.76SS**  trans-158.5110.7155.1-140.20000108.1N518N518-C520 PolarHBondContact O-N 3.17Å; N518-C520 VanDerWaalsContact O-N 3.11Å
521V36.8Very low34.8Very low149 Ų149128.4 Ų128.490%0.90376%0.762SS**  trans-83.5117.3174.7176.10000107.7
522K28Very low34.3Very low180 Ų180131.8 Ų131.878%0.78378%0.783SS**  trans-136.1139.8163-78.2-167.1175.4-171.70111.4
523S29.4Very low33.5Very low106 Ų106130.5 Ų130.574%0.74179%0.793SS**  trans-69.6153.5-177.8173.50000112.4A525S523-A525 PolarHBondContact O-N 3.13Å
524V31.8Very low33.4Very low157 Ų157131.9 Ų131.995%0.95280%0.804SS**THydrogen-bonded Turntrans-70.333.3-170.6-1800000114
525A33.5Very low32.9Very low86 Ų86134.3 Ų134.371%0.71181%0.811SS**THydrogen-bonded Turntrans-123.1-3.9-175.300000116S523S523-A525 PolarHBondContact O-N 3.13Å
526E34Very low32.2Very low179 Ų179136.1 Ų136.184%0.83682%0.817SS**  trans-14185.6-178.2-72179.1155.100111
527A30.5Very low31.8Very low108 Ų108133.7 Ų133.789%0.89382%0.815SS**  trans-155.858.6164.100000109.9
528S30.9Very low31.4Very low117 Ų117134.5 Ų134.582%0.81882%0.818SS**  trans-111.2138.7154.6-147.60000106.2
529E35.2Very low30.9Very low183 Ų183135.7 Ų135.786%0.85582%0.818SS**  trans88.295.4-172.2-55.1-171.5153.200116.7
530L27.3Very low30.1Very low165 Ų165139.8 Ų139.886%0.86482%0.819SS**  trans-161.995.2137.5-103.8140.3000111.4
531T27.8Very low30Very low130 Ų130138.9 Ų138.980%0.79881%0.812SS**  trans48.8117.5137.2520000121.7
532L29.4Very low29.3Very low189 Ų189138.7 Ų138.799%0.9981%0.811SS**  trans-98.8137.3159.3-106.4147.6000111
533G25.8Very low29.2Very low68 Ų68139 Ų13970%0.70182%0.815SS**  trans-178.7157.6154.800000112.3
534P36.1Very low28.9Very low114 Ų114140.4 Ų140.474%0.7482%0.819SS**  cis-127149-9.837.8-20.7000115.8
535T25.4Very low28.6Very low127 Ų127142.4 Ų142.478%0.77982%0.818SS**  trans57.4116.113958.70000122.4
536C24.8Very low28.2Very low122 Ų122147.2 Ų147.282%0.82483%0.826SS**  170.9160.2109.8-101.50000112.1
537P32.4Very low27.8Very low105 Ų105146.7 Ų146.768%0.68283%0.829SS**  -117.3173.8-10128.8-8.8000115
538H28.2Very low27.7Very low188 Ų188150.9 Ų150.987%0.8783%0.83SS**  trans107.383.9171.4-61.4-65.7000116.2
539H25.6Very low27.4Very low181 Ų181152.7 Ų152.784%0.83883%0.83SS**  trans-121.5138.1157.7-107.5-53.9000109.2
540I27.8Very low27.8Very low167 Ų167149.3 Ų149.386%0.85682%0.824SS**  trans-141.6144136.9-70.5-166.7000106.8
541P29.3Very low27.8Very low95 Ų95146.1 Ų146.162%0.61782%0.822SS**  trans-119.4173.5-135.841.8-31.3000115.1
542V22.9Very low27.7Very low146 Ų146144.5 Ų144.589%0.88582%0.822SS**  trans-136123.4154.2178.80000108.6
543Q24.9Very low27.5Very low186 Ų186140.5 Ų140.587%0.86982%0.816SS**  trans-84.9146.5177.6-75.8179.9-36.700111.3
544V23.2Very low27.5Very low136 Ų136142 Ų14282%0.82482%0.815SS**  trans-118.7127.1166.3175.10000106.4
545E24.8Very low27.1Very low198 Ų198143.9 Ų143.993%0.92582%0.819SS**  trans-99.5135.6175.1-143.6165.3-178.300108
546Q25.2Very low27.1Very low187 Ų187145 Ų14587%0.87482%0.82SS**  trans-121132.9-176.3-133.5177.3-1.900108.8
547D26.1Very low27.1Very low168 Ų168147.3 Ų147.390%0.89882%0.818SS**  trans-59.9146.4179.6-75.6-51.1000114.5
548E27.9Very low26.7Very low196 Ų196148.7 Ų148.792%0.91683%0.829SS**  trans-118.2139.5158.6-80.1-163147.900111.3
549D25.8Very low26.5Very low156 Ų156145 Ų14583%0.83482%0.82SS**  trans-96.5177.6174.7-108.4-23.1000110.1
550P44.1Very low26.5Very low111 Ų111143.4 Ų143.472%0.72182%0.816SS**  -133.8178.5-62.534.5-12.9000114.5
551A25.9Very low26.4Very low98 Ų98143.8 Ų143.881%0.8181%0.814SS**  trans86.5112.8150.600000122.9
552A25.6Very low26.4Very low97 Ų97147 Ų14780%0.80282%0.824SS**  138.5124.8107.200000117.2
553A26.1Very low26.5Very low105 Ų105144.8 Ų144.887%0.86882%0.815SS**  trans67.3140.4161.500000117.8
554S25Very low26.5Very low99 Ų99144.3 Ų144.369%0.69281%0.813SS**  cis-163.8149.115.851.50000111.1
555L27.6Very low26.8Very low154 Ų154145.5 Ų145.581%0.80681%0.814SS**  trans44.5113.4148.3-73.6148.1000119.7
556D25.8Very low27Very low151 Ų151144.3 Ų144.381%0.80781%0.808SS**  -172.7152.8105-100.9-21.8000113.5
557H25.3Very low27.2Very low170 Ų170140.7 Ų140.779%0.78780%0.799SS**  trans-49.1142.9-173.6-81.9-70.8000117.6
558C24.5Very low27.3Very low133 Ų133139.8 Ų139.890%0.89979%0.794SS**  -160127.1126.7-111.60000111.7
559T23.8Very low27.5Very low111 Ų111141 Ų14168%0.68181%0.814SS**  trans-85.8172.9179.134.30000112.9
560I24.4Very low27.6Very low148 Ų148140.2 Ų140.276%0.75981%0.813SS**  trans99.6132.3159.2-55.1168.6000113.2
561E25.3Very low26.7Very low174 Ų174141.7 Ų141.781%0.81382%0.818SS**  cis-162.1149.7-15.1-111.4172.6168.600105.8
562I29.5Very low26.8Very low164 Ų164144.2 Ų144.284%0.84182%0.819SS**  trans-99121.2167.5-68165.7000106.7
563S25.1Very low26.9Very low99 Ų99146.9 Ų146.969%0.69282%0.82SS**  trans-173.1132.6156.3-75.10000111.2
564E25.8Very low26.9Very low175 Ų175149.6 Ų149.682%0.81882%0.817SS**  trans71.7111.6153.3-60.6177.7177.700119.5
565L28.2Very low27Very low162 Ų162152.9 Ų152.985%0.84883%0.825SS**  -170.1117.8100.2-117.993000111.4
566E29.6Very low27Very low173 Ų173152.9 Ų152.981%0.80883%0.826SS**  trans-65.2144.8153.7-65.8174132.800110
567T30.5Very low27.1Very low111 Ų111153 Ų15368%0.68183%0.828SS**  155.1126.4113.343.80000114
568N27.4Very low27.2Very low148 Ų148151.6 Ų151.679%0.79183%0.831SS**  trans56.2112.1135.3-55.5-23.7000120.8
569V32.8Very low27.5Very low221 Ų221153.3 Ų153.3100%1.33983%0.825SS**  -153.5087.6167.70000108.8

Retrieved 569 of 569 residues in 298.7 ms (Link to these results)