A0A087X0N0_HUMAN Loading...

Trafficking kinesin protein 1

AlphaFold DB , UniProt , Accession A0A087X0N0, Species HUMAN (Homo sapiens, Human), Gene TRAK1, Length 670 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
1M48.4Very low50Low209 Ų209141.1 Ų141.1100%1.0366%0.657SS**  0-180-121.6176.1-96.600113.6
2Q48.1Very low50.5Low167 Ų167139 Ų13978%0.7865%0.653SS**Hα-helixtrans-81.2-33.8174.4-146.7104.814.500113.7F4Q2-F4 VanDerWaalsContact C-N 3.32Å; Q2-F4 PolarHBondContact O-N 3.05Å
3K46.4Very low50.8Low184 Ų184136.5 Ų136.580%0.865%0.647SS**Hα-helixtrans-74.2-14.5-178.7-71.2-168.5174.5-173.10115.6
4F43.3Very low51.3Low156 Ų156138.3 Ų138.368%0.68464%0.644SS**Hα-helixtrans-85.9-31.5176.8-96.2-88.5000111.7Q2 D8Q2-F4 VanDerWaalsContact C-N 3.32Å; Q2-F4 PolarHBondContact O-N 3.05Å; F4-D8 PolarHBondContact O-N 2.93Å; F4-D8 VanDerWaalsContact O-N 3.12Å
5I51.5Low51.7Low111 Ų111139.3 Ų139.357%0.56964%0.641SS**Hα-helixtrans-75.9-33.1-178.2-58.3172000111.3Y9I5-Y9 PolarHBondContact O-N 3.46Å
6E50.1Low52.1Low122 Ų122141.9 Ų141.957%0.5765%0.645SS**Hα-helixtrans-71.1-38.5175.7-128.6166.7-173.200111.4Y9 Y10E6-Y9 PolarHBondContact O-N 3.41Å; E6-Y10 HydrophobicContact CG-CE2 4.11Å; E6-Y10 WeakPolarHBondContact O-CD2 3.05Å; E6-Y10 PolarHBondContact O-N 3.08Å; E6-Y10 VanDerWaalsContact O-N 3.09Å
7A52.8Low52.5Low50 Ų50141.1 Ų141.141%0.41364%0.643SS.*Hα-helixtrans-64.3-44.2175.500000111.7Y9 Y10 E11A7-Y9 VanDerWaalsContact C-N 3.26Å; A7-Y9 PolarHBondContact O-N 3.28Å; A7-Y10 PolarHBondContact O-N 2.99Å; A7-E11 VanDerWaalsContact O-CB 3.27Å; A7-E11 WeakPolarHBondContact O-CB 3.33Å; A7-E11 PolarHBondContact O-N 3.13Å
8D52.2Low52.9Low83 Ų83138.2 Ų138.244%0.44463%0.63SS.*Hα-helixtrans-66-28.2177.7-65.7-13.2000112.3F4 L12F4-D8 PolarHBondContact O-N 2.93Å; F4-D8 VanDerWaalsContact O-N 3.12Å; D8-L12 WeakPolarHBondContact O-CB 3.18Å; D8-L12 PolarHBondContact O-N 3.41Å; D8-L12 VanDerWaalsContact O-N 3.1Å
9Y49.8Very low53.2Low177 Ų177134.2 Ų134.269%0.69462%0.619SS**Hα-helixtrans-75.1-40.9175.4-122.7-88.8000112.4I5 E6 A7 D13I5-Y9 PolarHBondContact O-N 3.46Å; E6-Y9 PolarHBondContact O-N 3.41Å; A7-Y9 VanDerWaalsContact C-N 3.26Å; A7-Y9 PolarHBondContact O-N 3.28Å; Y9-D13 PolarHBondContact O-N 2.94Å; Y9-D13 VanDerWaalsContact O-N 3.16Å
10Y52.1Low53.6Low168 Ų168130.7 Ų130.766%0.65961%0.61SS**Hα-helixtrans-70.2-33.1173.9-75.4-66.5000112.3E6 A7 W14E6-Y10 HydrophobicContact CG-CE2 4.11Å; E6-Y10 WeakPolarHBondContact O-CD2 3.05Å; E6-Y10 PolarHBondContact O-N 3.08Å; E6-Y10 VanDerWaalsContact O-N 3.09Å; A7-Y10 PolarHBondContact O-N 2.99Å; Y10-W14 VanDerWaalsContact O-CB 3.27Å; Y10-W14 WeakPolarHBondContact O-CB 3.17Å; Y10-W14 PolarHBondContact O-N 2.84Å
11E54.9Low54Low125 Ų125129.4 Ų129.458%0.58461%0.608SS**Hα-helixtrans-73.6-32.6178.1-156.5168.7-147.900111.7A7 Y15A7-E11 VanDerWaalsContact O-CB 3.27Å; A7-E11 WeakPolarHBondContact O-CB 3.33Å; A7-E11 PolarHBondContact O-N 3.13Å; E11-Y15 WeakPolarHBondContact O-CB 3.35Å; E11-Y15 PolarHBondContact O-N 2.94Å
12L55.9Low54.9Low116 Ų116123.5 Ų123.561%0.60758%0.583SS**Hα-helixtrans-70.7-41.8171.8-114.976.1000113.4D8 W14 Y15 Y16D8-L12 WeakPolarHBondContact O-CB 3.18Å; D8-L12 PolarHBondContact O-N 3.41Å; D8-L12 VanDerWaalsContact O-N 3.1Å; L12-W14 VanDerWaalsContact C-N 3.35Å; L12-Y15 PolarHBondContact O-N 3.26Å; L12-Y16 WeakPolarHBondContact O-CB 3.49Å; L12-Y16 PolarHBondContact O-N 3.23Å
13D55.1Low55.6Low107 Ų107120.4 Ų120.457%0.57257%0.571SS**Hα-helixtrans-64.9-41.8175.6-111.47.5000110.4Y9 Y15 Y16 E17Y9-D13 PolarHBondContact O-N 2.94Å; Y9-D13 VanDerWaalsContact O-N 3.16Å; D13-Y15 VanDerWaalsContact C-N 3.33Å; D13-Y15 PolarHBondContact O-N 2.82Å; D13-Y16 PolarHBondContact O-N 2.99Å; D13-E17 VanDerWaalsContact O-CB 3.3Å; D13-E17 WeakPolarHBondContact O-CB 3.49Å; D13-E17 PolarHBondContact O-N 2.87Å
14W57.6Low56.8Low161 Ų161114 Ų11461%0.6155%0.55SS*.Hα-helixtrans-63.2-38.6175.2-155.678.3000111.9Y10 L12 E18Y10-W14 VanDerWaalsContact O-CB 3.27Å; Y10-W14 WeakPolarHBondContact O-CB 3.17Å; Y10-W14 PolarHBondContact O-N 2.84Å; L12-W14 VanDerWaalsContact C-N 3.35Å; W14-E18 WeakPolarHBondContact CZ3-OE2 3.38Å; W14-E18 VanDerWaalsContact O-CB 3.23Å; W14-E18 WeakPolarHBondContact O-CB 3.38Å; W14-E18 PolarHBondContact O-N 3.49Å
15Y57.5Low58.1Low153 Ų153109.7 Ų109.760%0.654%0.543SS*.Hα-helixtrans-68.6-36.1174.2-129.3-90.4000112.8E11 L12 D13 C19E11-Y15 WeakPolarHBondContact O-CB 3.35Å; E11-Y15 PolarHBondContact O-N 2.94Å; L12-Y15 PolarHBondContact O-N 3.26Å; D13-Y15 VanDerWaalsContact C-N 3.33Å; D13-Y15 PolarHBondContact O-N 2.82Å; Y15-C19 WeakPolarHBondContact O-CB 3.37Å; Y15-C19 PolarHBondContact O-N 3.46Å; Y15-C19 PolarHBondContact O-SG 2.7Å
16Y58.3Low59Low181 Ų181109.4 Ų109.471%0.7154%0.539SS*.Hα-helixtrans-71.1-38.4176-110.6-90.7000112L12 D13 S20L12-Y16 WeakPolarHBondContact O-CB 3.49Å; L12-Y16 PolarHBondContact O-N 3.23Å; D13-Y16 PolarHBondContact O-N 2.99Å; Y16-S20 WeakPolarHBondContact O-CB 3.43Å; Y16-S20 PolarHBondContact O-N 2.84Å
17E58.8Low60.2Low128 Ų128111 Ų11160%0.59854%0.54SS*.Hα-helixtrans-71.7-42.4177.5-157.1157.8-148.100110.8D13 S20 D21D13-E17 VanDerWaalsContact O-CB 3.3Å; D13-E17 WeakPolarHBondContact O-CB 3.49Å; D13-E17 PolarHBondContact O-N 2.87Å; E17-S20 PolarHBondContact O-N 3.45Å; E17-D21 VanDerWaalsContact O-CB 3.31Å; E17-D21 WeakPolarHBondContact O-CB 3.2Å; E17-D21 PolarHBondContact O-N 2.83Å
18E59.6Low61.2Low90 Ų90112.6 Ų112.642%0.42154%0.544SS..Hα-helixtrans-68-38.6173.9-167.1172.4-149.500112.1W14 D21 V22W14-E18 WeakPolarHBondContact CZ3-OE2 3.38Å; W14-E18 VanDerWaalsContact O-CB 3.23Å; W14-E18 WeakPolarHBondContact O-CB 3.38Å; W14-E18 PolarHBondContact O-N 3.49Å; E18-D21 PolarHBondContact O-N 2.82Å; E18-V22 VanDerWaalsContact O-CB 3.31Å; E18-V22 WeakPolarHBondContact O-CB 3.44Å; E18-V22 WeakPolarHBondContact O-CG2 3.39Å; E18-V22 PolarHBondContact O-N 3.49Å
19C58.6Low62.2Low62 Ų62110.4 Ų110.442%0.41954%0.541SS..Hα-helixtrans-68.4-36.9172.5-76.70000112.3Y15 L23Y15-C19 WeakPolarHBondContact O-CB 3.37Å; Y15-C19 PolarHBondContact O-N 3.46Å; Y15-C19 PolarHBondContact O-SG 2.7Å; C19-L23 VanDerWaalsContact O-CB 3.3Å; C19-L23 WeakPolarHBondContact O-CB 3.11Å; C19-L23 WeakPolarHBondContact O-CG 3.4Å; C19-L23 PolarHBondContact O-N 3.5Å
20S61.1Low63.1Low63 Ų63107.4 Ų107.444%0.44153%0.534SS..Hα-helixtrans-65.1-44.7173.5-1790000110.8Y16 E17 L23 C24Y16-S20 WeakPolarHBondContact O-CB 3.43Å; Y16-S20 PolarHBondContact O-N 2.84Å; E17-S20 PolarHBondContact O-N 3.45Å; S20-L23 PolarHBondContact O-N 3.47Å; S20-C24 VanDerWaalsContact O-CB 3.23Å; S20-C24 WeakPolarHBondContact O-CB 3.3Å; S20-C24 PolarHBondContact O-N 2.7Å; S20-C24 PolarHBondContact O-SG 3.07Å
21D62Low63.8Low105 Ų105103.5 Ų103.556%0.56152%0.523SS*.Hα-helixtrans-66.4-39177.2-81.2-8.8000112.1E17 E18 C24 A25E17-D21 VanDerWaalsContact O-CB 3.31Å; E17-D21 WeakPolarHBondContact O-CB 3.2Å; E17-D21 PolarHBondContact O-N 2.83Å; E18-D21 PolarHBondContact O-N 2.82Å; D21-C24 PolarHBondContact O-N 3.33Å; D21-A25 WeakPolarHBondContact O-CB 3.26Å; D21-A25 PolarHBondContact O-N 3.02Å
22V66.7Low64.5Low85 Ų85100.7 Ų100.752%0.51551%0.514SS..Hα-helixtrans-68.2-41.7175170.60000111.3E18 A25 E26E18-V22 VanDerWaalsContact O-CB 3.31Å; E18-V22 WeakPolarHBondContact O-CB 3.44Å; E18-V22 WeakPolarHBondContact O-CG2 3.39Å; E18-V22 PolarHBondContact O-N 3.49Å; V22-A25 PolarHBondContact O-N 3.15Å; V22-E26 WeakPolarHBondContact O-CB 3.2Å; V22-E26 PolarHBondContact O-N 3.42Å
23L63.8Low65.2Low101 Ų101102.8 Ų102.853%0.52952%0.518SS..Hα-helixtrans-69.4-33.4175.3-72.1170.9000112.2C19 S20 R27C19-L23 VanDerWaalsContact O-CB 3.3Å; C19-L23 WeakPolarHBondContact O-CB 3.11Å; C19-L23 WeakPolarHBondContact O-CG 3.4Å; C19-L23 PolarHBondContact O-N 3.5Å; S20-L23 PolarHBondContact O-N 3.47Å; L23-R27 WeakPolarHBondContact O-CB 3.46Å; L23-R27 PolarHBondContact O-N 3.26Å
24C70.4Confident65.7Low51 Ų51100.3 Ų100.335%0.34551%0.507SS..Hα-helixtrans-71-42172.8-70.70000111.1S20 D21 R27 V28S20-C24 VanDerWaalsContact O-CB 3.23Å; S20-C24 WeakPolarHBondContact O-CB 3.3Å; S20-C24 PolarHBondContact O-N 2.7Å; S20-C24 PolarHBondContact O-SG 3.07Å; D21-C24 PolarHBondContact O-N 3.33Å; C24-R27 PolarHBondContact O-N 2.99Å; C24-V28 WeakPolarHBondContact O-CB 3.15Å; C24-V28 WeakPolarHBondContact O-CG2 3.31Å; C24-V28 PolarHBondContact O-N 3.5Å
25A70.6Confident66.3Low65 Ų65100 Ų10054%0.53751%0.506SS..Hα-helixtrans-67.8-36.3175.800000112.1D21 V22 G29D21-A25 WeakPolarHBondContact O-CB 3.26Å; D21-A25 PolarHBondContact O-N 3.02Å; V22-A25 PolarHBondContact O-N 3.15Å; A25-G29 WeakPolarHBondContact O-CA 3.42Å; A25-G29 PolarHBondContact O-N 3.3Å
26E71.6Confident67.3Low105 Ų10598.8 Ų98.849%0.49151%0.511SS..Hα-helixtrans-70.7-41.5173.9-175.1175.2-165.800111.3V22 G29 Q30V22-E26 WeakPolarHBondContact O-CB 3.2Å; V22-E26 PolarHBondContact O-N 3.42Å; E26-G29 PolarHBondContact O-N 3.21Å; E26-Q30 VanDerWaalsContact O-CB 3.31Å; E26-Q30 WeakPolarHBondContact O-CB 3.33Å; E26-Q30 WeakPolarHBondContact O-CG 3.35Å; E26-Q30 PolarHBondContact O-N 2.79Å
27R74.3Confident68.7Low156 Ų15693.5 Ų93.559%0.58949%0.494SS*.Hα-helixtrans-63.6-46.1173-174.5-170.6-53.2173.15.5111.5L23 C24 G29 Q30 M31L23-R27 WeakPolarHBondContact O-CB 3.46Å; L23-R27 PolarHBondContact O-N 3.26Å; C24-R27 PolarHBondContact O-N 2.99Å; R27-G29 VanDerWaalsContact C-N 3.33Å; R27-Q30 PolarHBondContact O-N 2.9Å; R27-M31 HydrophobicContact CG-SD 4.43Å; R27-M31 VanDerWaalsContact O-CB 3.32Å; R27-M31 WeakPolarHBondContact O-CB 3.49Å; R27-M31 WeakPolarHBondContact O-CG 3.49Å; R27-M31 PolarHBondContact O-N 3.21Å
28V73.9Confident69.9Low82 Ų8293.5 Ų93.550%0.49750%0.497SS..Hα-helixtrans-65.5-38.8176.4169.70000110.4C24 M31 T32C24-V28 WeakPolarHBondContact O-CB 3.15Å; C24-V28 WeakPolarHBondContact O-CG2 3.31Å; C24-V28 PolarHBondContact O-N 3.5Å; V28-M31 PolarHBondContact O-N 2.85Å; V28-T32 VanDerWaalsContact O-CB 3.27Å; V28-T32 WeakPolarHBondContact O-CB 3.23Å; V28-T32 PolarHBondContact O-N 3.34Å; V28-T32 PolarHBondContact O-OG1 3.46Å
29G72.9Confident71.3Confident38 Ų3894.5 Ų94.539%0.39251%0.506SS..Hα-helixtrans-67.2-40.7175.200000112.7A25 E26 R27 T32 K33A25-G29 WeakPolarHBondContact O-CA 3.42Å; A25-G29 PolarHBondContact O-N 3.3Å; E26-G29 PolarHBondContact O-N 3.21Å; R27-G29 VanDerWaalsContact C-N 3.33Å; G29-T32 PolarHBondContact O-N 3.15Å; G29-K33 WeakPolarHBondContact O-CB 3.39Å; G29-K33 PolarHBondContact O-N 2.81Å
30Q69.9Low72.6Confident114 Ų11492.1 Ų92.153%0.53349%0.49SS..Hα-helixtrans-65.6-43.6171.1-78.6178.612.700111.1E26 R27 T32 K33 T34E26-Q30 VanDerWaalsContact O-CB 3.31Å; E26-Q30 WeakPolarHBondContact O-CB 3.33Å; E26-Q30 WeakPolarHBondContact O-CG 3.35Å; E26-Q30 PolarHBondContact O-N 2.79Å; R27-Q30 PolarHBondContact O-N 2.9Å; Q30-T32 PolarHBondContact O-N 2.82Å; Q30-K33 PolarHBondContact O-N 2.94Å; Q30-T34 PolarHBondContact O-N 3.44Å; Q30-T34 PolarHBondContact O-OG1 3.04Å
31M66.8Low73.9Confident86 Ų8691.1 Ų91.142%0.42448%0.481SS..Hα-helixtrans-58.4-48.1173.3-77.8-179.964.200110.9R27 V28 K33 T34 Y35R27-M31 HydrophobicContact CG-SD 4.43Å; R27-M31 VanDerWaalsContact O-CB 3.32Å; R27-M31 WeakPolarHBondContact O-CB 3.49Å; R27-M31 WeakPolarHBondContact O-CG 3.49Å; R27-M31 PolarHBondContact O-N 3.21Å; V28-M31 PolarHBondContact O-N 2.85Å; M31-K33 VanDerWaalsContact C-N 3.32Å; M31-K33 PolarHBondContact O-N 3.11Å; M31-T34 VanDerWaalsContact C-OG1 3.31Å; M31-T34 VanDerWaalsContact CA-OG1 3.31Å; M31-T34 WeakPolarHBondContact CA-OG1 3.29Å; M31-T34 PolarHBondContact O-N 3.02Å; M31-T34 PolarHBondContact O-OG1 2.93Å; M31-Y35 HydrophobicContact CB-CD2 4.46Å; M31-Y35 HydrophobicContact CB-CE2 4.16Å; M31-Y35 HydrophobicContact CE-CE2 4.09Å; M31-Y35 WeakPolarHBondContact O-CD2 3.47Å; M31-Y35 PolarHBondContact O-N 3.21Å
32T68.4Low75.1Confident66 Ų6688.9 Ų88.941%0.40547%0.472SS..Hα-helixtrans-66.3-36.5179.5-53.70000111V28 G29 Q30 Y35 N36V28-T32 VanDerWaalsContact O-CB 3.27Å; V28-T32 WeakPolarHBondContact O-CB 3.23Å; V28-T32 PolarHBondContact O-N 3.34Å; V28-T32 PolarHBondContact O-OG1 3.46Å; G29-T32 PolarHBondContact O-N 3.15Å; Q30-T32 PolarHBondContact O-N 2.82Å; T32-Y35 PolarHBondContact O-N 2.94Å; T32-N36 WeakPolarHBondContact O-CB 3.44Å; T32-N36 PolarHBondContact O-N 3.45Å; T32-N36 PolarHBondContact O-ND2 3.44Å
33K70.6Confident76.2Confident160 Ų16091.7 Ų91.770%0.69647%0.473SS*.Hα-helixtrans-68.2-36.1174.7-166.4173.5-1751790112.3G29 Q30 M31 D37G29-K33 WeakPolarHBondContact O-CB 3.39Å; G29-K33 PolarHBondContact O-N 2.81Å; Q30-K33 PolarHBondContact O-N 2.94Å; M31-K33 VanDerWaalsContact C-N 3.32Å; M31-K33 PolarHBondContact O-N 3.11Å; K33-D37 PolarHBondContact O-N 2.88Å
34T67Low77.6Confident54 Ų5490.9 Ų90.933%0.33147%0.469SS..Hα-helixtrans-70.7-32.4170.847.60000112.5Q30 M31 D37 V41Q30-T34 PolarHBondContact O-N 3.44Å; Q30-T34 PolarHBondContact O-OG1 3.04Å; M31-T34 VanDerWaalsContact C-OG1 3.31Å; M31-T34 VanDerWaalsContact CA-OG1 3.31Å; M31-T34 WeakPolarHBondContact CA-OG1 3.29Å; M31-T34 PolarHBondContact O-N 3.02Å; M31-T34 PolarHBondContact O-OG1 2.93Å; T34-D37 PolarHBondContact O-N 3.39Å; T34-D37 VanDerWaalsContact O-O 3.05Å; T34-V41 WeakPolarHBondContact O-CG2 3.23Å
35Y69.8Low78.6Confident154 Ų15493.8 Ų93.860%0.60448%0.481SS*.Hα-helixtrans-71-32.8174.1-73.5-62.1000113.1M31 T32 D37 V41M31-Y35 HydrophobicContact CB-CD2 4.46Å; M31-Y35 HydrophobicContact CB-CE2 4.16Å; M31-Y35 HydrophobicContact CE-CE2 4.09Å; M31-Y35 WeakPolarHBondContact O-CD2 3.47Å; M31-Y35 PolarHBondContact O-N 3.21Å; T32-Y35 PolarHBondContact O-N 2.94Å; Y35-D37 VanDerWaalsContact C-N 3.32Å; Y35-V41 HydrophobicContact CD1-CG2 4.4Å
36N77.8Confident79.7Confident129 Ų12995 Ų9569%0.6948%0.475SS*.Hα-helixtrans-77.2-18.8176.6-68.8-34.4000113T32T32-N36 WeakPolarHBondContact O-CB 3.44Å; T32-N36 PolarHBondContact O-N 3.45Å; T32-N36 PolarHBondContact O-ND2 3.44Å
37D87.8Confident80.8Confident69 Ų6994.5 Ų94.537%0.36947%0.473SS..  trans-96.295174-177.8-3.2000109.7K33 T34 Y35 D39 A40 V41K33-D37 PolarHBondContact O-N 2.88Å; T34-D37 PolarHBondContact O-N 3.39Å; T34-D37 VanDerWaalsContact O-O 3.05Å; Y35-D37 VanDerWaalsContact C-N 3.32Å; D37-D39 PolarHBondContact O-N 2.94Å; D37-D39 VanDerWaalsContact O-N 3.16Å; D37-D39 PolarHBondContact OD1-N 2.96Å; D37-D39 VanDerWaalsContact OD1-N 3.13Å; D37-A40 HydrophobicContact CB-CB 3.83Å; D37-A40 WeakPolarHBondContact O-CA 3.37Å; D37-A40 WeakPolarHBondContact O-CB 3.37Å; D37-A40 PolarHBondContact O-N 3.23Å; D37-A40 PolarHBondContact OD1-N 2.97Å; D37-V41 PolarHBondContact O-N 3.4Å
38I84.9Confident81.7Confident128 Ų12892.6 Ų92.666%0.65647%0.469SS*.Hα-helixtrans-54.9-35.1-178.5-62169.2000111.1V41 T42I38-V41 PolarHBondContact O-N 3.39Å; I38-T42 WeakPolarHBondContact O-CB 3.48Å; I38-T42 PolarHBondContact O-N 3.4Å; I38-T42 PolarHBondContact O-OG1 3.35Å
39D87.9Confident82.7Confident111 Ų11194.1 Ų94.159%0.59447%0.47SS*.Hα-helixtrans-73.3-29.2179.4-66.1-28.8000111.9D37 R43D37-D39 PolarHBondContact O-N 2.94Å; D37-D39 VanDerWaalsContact O-N 3.16Å; D37-D39 PolarHBondContact OD1-N 2.96Å; D37-D39 VanDerWaalsContact OD1-N 3.13Å; D39-R43 WeakPolarHBondContact O-CB 3.29Å; D39-R43 WeakPolarHBondContact O-CG 3.37Å; D39-R43 PolarHBondContact O-N 2.81Å; D39-R43 VanDerWaalsContact O-N 3.15Å; D39-R43 PolarHBondContact O-NE 3.43Å
40A87.1Confident83.8Confident12 Ų1298.6 Ų98.610%0.09948%0.475CS..Hα-helixtrans-73-42.717300000111.8D37 T42 R43 L44D37-A40 HydrophobicContact CB-CB 3.83Å; D37-A40 WeakPolarHBondContact O-CA 3.37Å; D37-A40 WeakPolarHBondContact O-CB 3.37Å; D37-A40 PolarHBondContact O-N 3.23Å; D37-A40 PolarHBondContact OD1-N 2.97Å; A40-T42 VanDerWaalsContact C-N 3.34Å; A40-R43 PolarHBondContact O-N 3.44Å; A40-L44 WeakPolarHBondContact O-CG 3.42Å; A40-L44 PolarHBondContact O-N 2.81Å
41V88.6Confident85.2Confident42 Ų4296.7 Ų96.726%0.25547%0.469SS..Hα-helixtrans-61.4-44.6173.7-178.10000110.7T34 Y35 D37 I38 R43 L44 L45T34-V41 WeakPolarHBondContact O-CG2 3.23Å; Y35-V41 HydrophobicContact CD1-CG2 4.4Å; D37-V41 PolarHBondContact O-N 3.4Å; I38-V41 PolarHBondContact O-N 3.39Å; V41-R43 PolarHBondContact O-N 3.31Å; V41-L44 PolarHBondContact O-N 2.97Å; V41-L45 HydrophobicContact CG1-CD1 4.01Å; V41-L45 HydrophobicContact CG1-CG 4.36Å; V41-L45 WeakPolarHBondContact O-CG 3.47Å; V41-L45 PolarHBondContact O-N 2.84Å
42T86.6Confident86.6Confident59 Ų5998.6 Ų98.636%0.36248%0.48SS..Hα-helixtrans-62.7-45.2-179.2-54.90000111.3I38 A40 L44 L45 E46I38-T42 WeakPolarHBondContact O-CB 3.48Å; I38-T42 PolarHBondContact O-N 3.4Å; I38-T42 PolarHBondContact O-OG1 3.35Å; A40-T42 VanDerWaalsContact C-N 3.34Å; T42-L44 PolarHBondContact O-N 3.32Å; T42-L45 PolarHBondContact O-N 2.74Å; T42-E46 WeakPolarHBondContact O-CG 3.23Å; T42-E46 PolarHBondContact O-N 3.4Å
43R90.4Very high87.9Confident143 Ų14399.9 Ų99.954%0.5448%0.482SS..Hα-helixtrans-61.6-39.2175.1-79.1178.7-78.4136-7.4113.3D39 A40 V41 E47D39-R43 WeakPolarHBondContact O-CB 3.29Å; D39-R43 WeakPolarHBondContact O-CG 3.37Å; D39-R43 PolarHBondContact O-N 2.81Å; D39-R43 VanDerWaalsContact O-N 3.15Å; D39-R43 PolarHBondContact O-NE 3.43Å; A40-R43 PolarHBondContact O-N 3.44Å; V41-R43 PolarHBondContact O-N 3.31Å; R43-E47 WeakPolarHBondContact O-CB 3.4Å; R43-E47 PolarHBondContact O-N 3.01Å
44L91.6Very high89.2Confident85 Ų8597.2 Ų97.245%0.44547%0.474SS..Hα-helixtrans-66.2-38.6175.2-79.9167.2000112A40 V41 T42 E47 K48A40-L44 WeakPolarHBondContact O-CG 3.42Å; A40-L44 PolarHBondContact O-N 2.81Å; V41-L44 PolarHBondContact O-N 2.97Å; T42-L44 PolarHBondContact O-N 3.32Å; L44-E47 PolarHBondContact O-N 3.39Å; L44-K48 WeakPolarHBondContact O-CB 3.34Å; L44-K48 VanDerWaalsContact O-CG 3.28Å; L44-K48 WeakPolarHBondContact O-CG 3.45Å; L44-K48 PolarHBondContact O-N 2.91Å
45L91.7Very high90.7Very high112 Ų11297.3 Ų97.359%0.58648%0.481SS*.Hα-helixtrans-66.1-45175.3-73.8172.3000111.5V41 T42 E47 K48 E49V41-L45 HydrophobicContact CG1-CD1 4.01Å; V41-L45 HydrophobicContact CG1-CG 4.36Å; V41-L45 WeakPolarHBondContact O-CG 3.47Å; V41-L45 PolarHBondContact O-N 2.84Å; T42-L45 PolarHBondContact O-N 2.74Å; L45-E47 VanDerWaalsContact C-N 3.29Å; L45-E47 PolarHBondContact O-N 2.84Å; L45-K48 PolarHBondContact O-N 3.29Å; L45-E49 WeakPolarHBondContact O-CB 3.4Å; L45-E49 PolarHBondContact O-N 2.97Å
46E93.8Very high92Very high89 Ų8993 Ų9342%0.41648%0.477SS..Hα-helixtrans-61.8-36.4174.5-70.8173.1-174.100112.3T42 R50T42-E46 WeakPolarHBondContact O-CG 3.23Å; T42-E46 PolarHBondContact O-N 3.4Å; E46-R50 WeakPolarHBondContact O-CB 3.37Å; E46-R50 WeakPolarHBondContact O-CG 3.46Å; E46-R50 PolarHBondContact O-N 2.97Å; E46-R50 IonicContact OE2-NH2 2.64Å
47E94.1Very high92.9Very high96 Ų9695.3 Ų95.345%0.44948%0.476SS..Hα-helixtrans-67.3-42.3174.1-173176.2-173.400111.9R43 L44 L45 R50 D51R43-E47 WeakPolarHBondContact O-CB 3.4Å; R43-E47 PolarHBondContact O-N 3.01Å; L44-E47 PolarHBondContact O-N 3.39Å; L45-E47 VanDerWaalsContact C-N 3.29Å; L45-E47 PolarHBondContact O-N 2.84Å; E47-R50 PolarHBondContact O-N 2.97Å; E47-D51 PolarHBondContact O-N 2.88Å
48K95.1Very high93.4Very high116 Ų11696.4 Ų96.450%0.50448%0.481SS..Hα-helixtrans-67-36.5175-71.6-71.7147.7-136.50112.5L44 L45 D51 L52L44-K48 WeakPolarHBondContact O-CB 3.34Å; L44-K48 VanDerWaalsContact O-CG 3.28Å; L44-K48 WeakPolarHBondContact O-CG 3.45Å; L44-K48 PolarHBondContact O-N 2.91Å; L45-K48 PolarHBondContact O-N 3.29Å; K48-D51 IonicContact NZ-OD2 2.67Å; K48-D51 PolarHBondContact NZ-OD2 3.03Å; K48-D51 PolarHBondContact O-N 3.13Å; K48-L52 WeakPolarHBondContact O-CB 3.2Å; K48-L52 VanDerWaalsContact O-CG 3.28Å; K48-L52 WeakPolarHBondContact O-CG 3.28Å; K48-L52 PolarHBondContact O-N 3.09Å
49E94.6Very high94Very high113 Ų11391.7 Ų91.753%0.52846%0.464SS..Hα-helixtrans-61.6-46.8172.5-174.6172.8-163.500110.5L45 D51 L52 E53L45-E49 WeakPolarHBondContact O-CB 3.4Å; L45-E49 PolarHBondContact O-N 2.97Å; E49-D51 PolarHBondContact O-N 3.35Å; E49-L52 PolarHBondContact O-N 3.32Å; E49-E53 WeakPolarHBondContact O-CG 3.07Å; E49-E53 PolarHBondContact O-N 3.4Å
50R96.4Very high94.4Very high132 Ų13293.1 Ų93.150%0.49847%0.467SS..Hα-helixtrans-60.6-40.5173.9-79-173.1-106.699.91.6113.3E46 E47 E53 L54E46-R50 WeakPolarHBondContact O-CB 3.37Å; E46-R50 WeakPolarHBondContact O-CG 3.46Å; E46-R50 PolarHBondContact O-N 2.97Å; E46-R50 IonicContact OE2-NH2 2.64Å; E47-R50 PolarHBondContact O-N 2.97Å; R50-E53 PolarHBondContact O-N 3.46Å; R50-L54 WeakPolarHBondContact O-CB 3.2Å; R50-L54 PolarHBondContact O-N 3.35Å
51D97.5Very high94.9Very high75 Ų7595.2 Ų95.240%0.40148%0.481SS..Hα-helixtrans-63.1-42.9175.3-75.8-18.8000111.4E47 K48 E49 L54 A55E47-D51 PolarHBondContact O-N 2.88Å; K48-D51 IonicContact NZ-OD2 2.67Å; K48-D51 PolarHBondContact NZ-OD2 3.03Å; K48-D51 PolarHBondContact O-N 3.13Å; E49-D51 PolarHBondContact O-N 3.35Å; D51-L54 PolarHBondContact O-N 2.93Å; D51-A55 WeakPolarHBondContact O-CB 3.27Å; D51-A55 PolarHBondContact O-N 2.9Å
52L96.9Very high95.4Very high126 Ų12698.2 Ų98.266%0.6650%0.495SS*.Hα-helixtrans-65.8-42.6177.5-73.8171.9000111.6K48 E49 L54 A55 A56K48-L52 WeakPolarHBondContact O-CB 3.2Å; K48-L52 VanDerWaalsContact O-CG 3.28Å; K48-L52 WeakPolarHBondContact O-CG 3.28Å; K48-L52 PolarHBondContact O-N 3.09Å; E49-L52 PolarHBondContact O-N 3.32Å; L52-L54 VanDerWaalsContact C-N 3.32Å; L52-L54 PolarHBondContact O-N 3.18Å; L52-A55 PolarHBondContact O-N 3.12Å; L52-A56 WeakPolarHBondContact O-CB 3.34Å; L52-A56 PolarHBondContact O-N 2.83Å
53E96.6Very high95.9Very high92 Ų92101.4 Ų101.443%0.4351%0.509SS..Hα-helixtrans-60-42.9173.4-74.8-178.8179.200111.8E49 R50 A56 R57E49-E53 WeakPolarHBondContact O-CG 3.07Å; E49-E53 PolarHBondContact O-N 3.4Å; R50-E53 PolarHBondContact O-N 3.46Å; E53-A56 PolarHBondContact O-N 3.12Å; E53-R57 WeakPolarHBondContact O-CB 3.27Å; E53-R57 WeakPolarHBondContact O-CG 3.45Å; E53-R57 PolarHBondContact O-N 3.35Å
54L97.4Very high96.2Very high104 Ų104102 Ų10255%0.54552%0.516SS..Hα-helixtrans-67.5-42.6178.7-172.5144000111.2R50 D51 L52 A56 R57 I58R50-L54 WeakPolarHBondContact O-CB 3.2Å; R50-L54 PolarHBondContact O-N 3.35Å; D51-L54 PolarHBondContact O-N 2.93Å; L52-L54 VanDerWaalsContact C-N 3.32Å; L52-L54 PolarHBondContact O-N 3.18Å; L54-A56 VanDerWaalsContact C-N 3.34Å; L54-A56 PolarHBondContact O-N 2.97Å; L54-R57 PolarHBondContact O-N 3.46Å; L54-I58 HydrophobicContact CD2-CD1 3.46Å; L54-I58 VanDerWaalsContact CD2-CD1 3.46Å; L54-I58 HydrophobicContact CD2-CG1 4.26Å; L54-I58 HydrophobicContact CG-CD1 4.37Å; L54-I58 WeakPolarHBondContact O-CG1 3.32Å; L54-I58 PolarHBondContact O-N 2.89Å
55A97.8Very high96.6Very high57 Ų57103.8 Ų103.847%0.47152%0.52SS..Hα-helixtrans-61.5-42.1173.900000111.7D51 L52 I58 G59D51-A55 WeakPolarHBondContact O-CB 3.27Å; D51-A55 PolarHBondContact O-N 2.9Å; L52-A55 PolarHBondContact O-N 3.12Å; A55-I58 PolarHBondContact O-N 3.43Å; A55-G59 PolarHBondContact O-N 2.83Å
56A96.5Very high96.8Very high64 Ų64103 Ų10353%0.52952%0.517SS..Hα-helixtrans-63.9-42.6175.500000111.7L52 E53 L54 G59 Q60L52-A56 WeakPolarHBondContact O-CB 3.34Å; L52-A56 PolarHBondContact O-N 2.83Å; E53-A56 PolarHBondContact O-N 3.12Å; L54-A56 VanDerWaalsContact C-N 3.34Å; L54-A56 PolarHBondContact O-N 2.97Å; A56-G59 PolarHBondContact O-N 3.03Å; A56-Q60 WeakPolarHBondContact O-CB 3.35Å; A56-Q60 PolarHBondContact O-N 3.34Å
57R97.4Very high97Very high176 Ų176104.9 Ų104.966%0.66452%0.524SS*.Hα-helixtrans-64.4-42.6175.1-79.9-175.4-175.7164.47112.7E53 L54 G59 Q60 S61E53-R57 WeakPolarHBondContact O-CB 3.27Å; E53-R57 WeakPolarHBondContact O-CG 3.45Å; E53-R57 PolarHBondContact O-N 3.35Å; L54-R57 PolarHBondContact O-N 3.46Å; R57-G59 VanDerWaalsContact C-N 3.35Å; R57-Q60 PolarHBondContact O-N 2.84Å; R57-S61 WeakPolarHBondContact O-CB 3.48Å; R57-S61 PolarHBondContact O-N 3.44Å
58I97.5Very high97.1Very high92 Ų92103.7 Ų103.747%0.47252%0.523SS..Hα-helixtrans-63.4-45.5174.8-69.8176.4000109.6L54 A55 Q60 S61 L62L54-I58 HydrophobicContact CD2-CD1 3.46Å; L54-I58 VanDerWaalsContact CD2-CD1 3.46Å; L54-I58 HydrophobicContact CD2-CG1 4.26Å; L54-I58 HydrophobicContact CG-CD1 4.37Å; L54-I58 WeakPolarHBondContact O-CG1 3.32Å; L54-I58 PolarHBondContact O-N 2.89Å; A55-I58 PolarHBondContact O-N 3.43Å; I58-Q60 VanDerWaalsContact C-N 3.35Å; I58-Q60 PolarHBondContact O-N 3.38Å; I58-S61 PolarHBondContact O-N 3.4Å; I58-L62 HydrophobicContact CG2-CD1 3.91Å; I58-L62 HydrophobicContact CG2-CG 4.3Å; I58-L62 WeakPolarHBondContact O-CB 3.44Å; I58-L62 WeakPolarHBondContact O-CG 3.39Å; I58-L62 PolarHBondContact O-N 2.88Å
59G98.1Very high97.3Very high29 Ų29102.9 Ų102.930%0.29952%0.523SS..Hα-helixtrans-56.3-46.9175.200000112.1A55 A56 R57 S61 L62 L63A55-G59 PolarHBondContact O-N 2.83Å; A56-G59 PolarHBondContact O-N 3.03Å; R57-G59 VanDerWaalsContact C-N 3.35Å; G59-S61 PolarHBondContact O-N 3.06Å; G59-L62 PolarHBondContact O-N 3.43Å; G59-L63 WeakPolarHBondContact O-CB 3.5Å; G59-L63 WeakPolarHBondContact O-CG 3.36Å; G59-L63 PolarHBondContact O-N 3.32Å
60Q96.8Very high97.4Very high141 Ų141100 Ų10066%0.65951%0.514SS*.Hα-helixtrans-64.4-40.3176.5-167.4-178.523.900112.3A56 R57 I58 L63 K64A56-Q60 WeakPolarHBondContact O-CB 3.35Å; A56-Q60 PolarHBondContact O-N 3.34Å; R57-Q60 PolarHBondContact O-N 2.84Å; I58-Q60 VanDerWaalsContact C-N 3.35Å; I58-Q60 PolarHBondContact O-N 3.38Å; Q60-L63 PolarHBondContact O-N 3.16Å; Q60-K64 WeakPolarHBondContact O-CB 3.27Å; Q60-K64 PolarHBondContact O-N 2.91Å
61S97.8Very high97.4Very high57 Ų5797.7 Ų97.740%0.39951%0.509SS..Hα-helixtrans-64.4-41.3175.9-171.20000111.8R57 I58 G59 K64 K65R57-S61 WeakPolarHBondContact O-CB 3.48Å; R57-S61 PolarHBondContact O-N 3.44Å; I58-S61 PolarHBondContact O-N 3.4Å; G59-S61 PolarHBondContact O-N 3.06Å; S61-K64 PolarHBondContact O-N 2.89Å; S61-K65 WeakPolarHBondContact O-CG 3.41Å; S61-K65 PolarHBondContact O-N 3.1Å
62L98.1Very high97.4Very high104 Ų104101.6 Ų101.655%0.54552%0.518SS..Hα-helixtrans-67.2-44175.9-72174.1000111.5I58 G59 K64 K65 N66I58-L62 HydrophobicContact CG2-CD1 3.91Å; I58-L62 HydrophobicContact CG2-CG 4.3Å; I58-L62 WeakPolarHBondContact O-CB 3.44Å; I58-L62 WeakPolarHBondContact O-CG 3.39Å; I58-L62 PolarHBondContact O-N 2.88Å; G59-L62 PolarHBondContact O-N 3.43Å; L62-K64 VanDerWaalsContact C-N 3.34Å; L62-K64 PolarHBondContact O-N 3.4Å; L62-K65 PolarHBondContact O-N 3.03Å; L62-N66 WeakPolarHBondContact O-CB 3.47Å; L62-N66 PolarHBondContact O-N 2.96Å
63L97.7Very high97.5Very high126 Ų12699.6 Ų99.666%0.6651%0.508SS*.Hα-helixtrans-60.1-43.6174.6-77.1170000111.4G59 Q60 K65 N66 K67G59-L63 WeakPolarHBondContact O-CB 3.5Å; G59-L63 WeakPolarHBondContact O-CG 3.36Å; G59-L63 PolarHBondContact O-N 3.32Å; Q60-L63 PolarHBondContact O-N 3.16Å; L63-K65 PolarHBondContact O-N 2.97Å; L63-N66 PolarHBondContact O-N 2.93Å; L63-K67 WeakPolarHBondContact O-CB 3.43Å; L63-K67 PolarHBondContact O-N 2.84Å
64K97.9Very high97.5Very high156 Ų156100.3 Ų100.368%0.67851%0.511SS*.Hα-helixtrans-62.3-44176.1-171.9173.8-177.4175.30111.6Q60 S61 L62 K67 T68Q60-K64 WeakPolarHBondContact O-CB 3.27Å; Q60-K64 PolarHBondContact O-N 2.91Å; S61-K64 PolarHBondContact O-N 2.89Å; L62-K64 VanDerWaalsContact C-N 3.34Å; L62-K64 PolarHBondContact O-N 3.4Å; K64-K67 PolarHBondContact O-N 3.12Å; K64-T68 WeakPolarHBondContact O-CG2 3.45Å; K64-T68 PolarHBondContact O-N 3.41Å; K64-T68 PolarHBondContact O-OG1 3.35Å
65K97.9Very high97.5Very high122 Ų122100.1 Ų100.153%0.5351%0.51SS..Hα-helixtrans-63.1-41.6174.9-75.5174.9-178.1170.80111.9S61 L62 L63 T68 L69S61-K65 WeakPolarHBondContact O-CG 3.41Å; S61-K65 PolarHBondContact O-N 3.1Å; L62-K65 PolarHBondContact O-N 3.03Å; L63-K65 PolarHBondContact O-N 2.97Å; K65-T68 WeakPolarHBondContact CA-OG1 3.3Å; K65-T68 PolarHBondContact O-N 2.66Å; K65-T68 PolarHBondContact O-OG1 3.15Å; K65-L69 WeakPolarHBondContact O-CB 3.48Å; K65-L69 VanDerWaalsContact O-CG 3.31Å; K65-L69 WeakPolarHBondContact O-CG 3.28Å; K65-L69 PolarHBondContact O-N 3.42Å
66N96.9Very high97.5Very high96 Ų96100.9 Ų100.951%0.51351%0.506SS..Hα-helixtrans-64.4-44.6178.3-165.1-90.5000110.6L62 L63 T68 L69 T70L62-N66 WeakPolarHBondContact O-CB 3.47Å; L62-N66 PolarHBondContact O-N 2.96Å; L63-N66 PolarHBondContact O-N 2.93Å; N66-T68 PolarHBondContact O-N 2.89Å; N66-L69 CarbonylContact O-C 3.59Å; N66-L69 WeakPolarHBondContact O-CA 3.35Å; N66-L69 WeakPolarHBondContact O-CB 3.44Å; N66-L69 PolarHBondContact O-N 3.21Å; N66-T70 PolarHBondContact O-N 3.33Å; N66-T70 PolarHBondContact O-OG1 3.45Å
67K97.9Very high97.6Very high129 Ų129103.8 Ų103.856%0.56151%0.508SS*.Hα-helixtrans-56.6-46.2173.2-177.2171.9176170.30112.6L63 K64 L69 T70 E71L63-K67 WeakPolarHBondContact O-CB 3.43Å; L63-K67 PolarHBondContact O-N 2.84Å; K64-K67 PolarHBondContact O-N 3.12Å; K67-L69 PolarHBondContact O-N 3.35Å; K67-T70 VanDerWaalsContact CA-OG1 3.31Å; K67-T70 WeakPolarHBondContact CA-OG1 3.3Å; K67-T70 PolarHBondContact O-N 3.16Å; K67-T70 PolarHBondContact O-OG1 3.16Å; K67-E71 WeakPolarHBondContact CE-OE1 3.39Å; K67-E71 WeakPolarHBondContact CG-OE1 3.35Å; K67-E71 WeakPolarHBondContact O-CB 3.26Å; K67-E71 VanDerWaalsContact O-CG 3.29Å; K67-E71 WeakPolarHBondContact O-CG 3.4Å; K67-E71 PolarHBondContact O-N 2.96Å
68T97.3Very high97.6Very high71 Ų71101.4 Ų101.444%0.43651%0.505SS..Hα-helixtrans-66.6-28176.454.30000113.1K64 K65 N66 R72K64-T68 WeakPolarHBondContact O-CG2 3.45Å; K64-T68 PolarHBondContact O-N 3.41Å; K64-T68 PolarHBondContact O-OG1 3.35Å; K65-T68 WeakPolarHBondContact CA-OG1 3.3Å; K65-T68 PolarHBondContact O-N 2.66Å; K65-T68 PolarHBondContact O-OG1 3.15Å; N66-T68 PolarHBondContact O-N 2.89Å; T68-R72 WeakPolarHBondContact O-CB 3.4Å; T68-R72 PolarHBondContact O-N 3.02Å; T68-R72 VanDerWaalsContact O-N 3.14Å
69L97.4Very high97.6Very high98 Ų98102.4 Ų102.451%0.51351%0.507SS..Hα-helixtrans-76.5-38.7175.6-75.6170000111.4K65 N66 K67 R72 N73K65-L69 WeakPolarHBondContact O-CB 3.48Å; K65-L69 VanDerWaalsContact O-CG 3.31Å; K65-L69 WeakPolarHBondContact O-CG 3.28Å; K65-L69 PolarHBondContact O-N 3.42Å; N66-L69 CarbonylContact O-C 3.59Å; N66-L69 WeakPolarHBondContact O-CA 3.35Å; N66-L69 WeakPolarHBondContact O-CB 3.44Å; N66-L69 PolarHBondContact O-N 3.21Å; K67-L69 PolarHBondContact O-N 3.35Å; L69-R72 PolarHBondContact O-N 3.3Å; L69-N73 WeakPolarHBondContact O-CB 3.48Å; L69-N73 PolarHBondContact O-N 3.13Å
70T96.8Very high97.6Very high53 Ų53105.3 Ų105.333%0.32552%0.519SS..Hα-helixtrans-65.4-46.6174.248.40000110.7N66 K67 R72 N73 E74N66-T70 PolarHBondContact O-N 3.33Å; N66-T70 PolarHBondContact O-OG1 3.45Å; K67-T70 VanDerWaalsContact CA-OG1 3.31Å; K67-T70 WeakPolarHBondContact CA-OG1 3.3Å; K67-T70 PolarHBondContact O-N 3.16Å; K67-T70 PolarHBondContact O-OG1 3.16Å; T70-R72 VanDerWaalsContact C-N 3.25Å; T70-R72 PolarHBondContact O-N 2.79Å; T70-N73 PolarHBondContact O-N 3.36Å; T70-E74 WeakPolarHBondContact O-CG 3.27Å; T70-E74 PolarHBondContact O-N 2.9Å
71E97.9Very high97.6Very high84 Ų84102.6 Ų102.639%0.39351%0.507SS..Hα-helixtrans-56.8-40.7173.9-72.2166.8-174.700111.4K67 L75K67-E71 WeakPolarHBondContact CE-OE1 3.39Å; K67-E71 WeakPolarHBondContact CG-OE1 3.35Å; K67-E71 WeakPolarHBondContact O-CB 3.26Å; K67-E71 VanDerWaalsContact O-CG 3.29Å; K67-E71 WeakPolarHBondContact O-CG 3.4Å; K67-E71 PolarHBondContact O-N 2.96Å; E71-L75 WeakPolarHBondContact O-CG 3.32Å; E71-L75 PolarHBondContact O-N 3.37Å; E71-L75 VanDerWaalsContact O-N 3.11Å
72R97.8Very high97.6Very high156 Ų156105.6 Ų105.659%0.58951%0.514SS*.Hα-helixtrans-68.1-37.5175.9-177.4178.8173.977.66.2112.5T68 L69 T70 L76T68-R72 WeakPolarHBondContact O-CB 3.4Å; T68-R72 PolarHBondContact O-N 3.02Å; T68-R72 VanDerWaalsContact O-N 3.14Å; L69-R72 PolarHBondContact O-N 3.3Å; T70-R72 VanDerWaalsContact C-N 3.25Å; T70-R72 PolarHBondContact O-N 2.79Å; R72-L76 HydrophobicContact CG-CD1 4.34Å; R72-L76 VanDerWaalsContact O-CG 3.32Å; R72-L76 WeakPolarHBondContact O-CG 3.47Å; R72-L76 PolarHBondContact O-N 2.86Å; R72-L76 VanDerWaalsContact O-N 3.15Å
73N97.3Very high97.6Very high85 Ų85105.2 Ų105.246%0.45551%0.512SS..Hα-helixtrans-68-43.9176.8-79.7-11.2000110.8L69 T70 L75 L76 E77L69-N73 WeakPolarHBondContact O-CB 3.48Å; L69-N73 PolarHBondContact O-N 3.13Å; T70-N73 PolarHBondContact O-N 3.36Å; N73-L75 VanDerWaalsContact C-N 3.34Å; N73-L75 PolarHBondContact O-N 2.88Å; N73-L76 CarbonylContact O-C 3.51Å; N73-L76 WeakPolarHBondContact O-CA 3.38Å; N73-L76 WeakPolarHBondContact O-CB 3.43Å; N73-L76 PolarHBondContact O-N 3.43Å; N73-E77 WeakPolarHBondContact O-CB 3.24Å; N73-E77 WeakPolarHBondContact O-CG 3.4Å; N73-E77 PolarHBondContact O-N 3.01Å
74E97.6Very high97.6Very high106 Ų106106.5 Ų106.550%0.49551%0.508SS..Hα-helixtrans-54.6-49.4174.3-72.8165.5-17100110.6T70 L76 E77 E78T70-E74 WeakPolarHBondContact O-CG 3.27Å; T70-E74 PolarHBondContact O-N 2.9Å; E74-L76 VanDerWaalsContact C-N 3.26Å; E74-L76 PolarHBondContact O-N 3.29Å; E74-E77 PolarHBondContact O-N 2.83Å; E74-E77 VanDerWaalsContact O-N 3.16Å; E74-E78 WeakPolarHBondContact O-CG 3.45Å; E74-E78 PolarHBondContact O-N 3.21Å
75L97.6Very high97.6Very high101 Ų101104.8 Ų104.853%0.52950%0.502SS..Hα-helixtrans-62-30.1176-70.8173000114.1E71 N73 Q79E71-L75 WeakPolarHBondContact O-CG 3.32Å; E71-L75 PolarHBondContact O-N 3.37Å; E71-L75 VanDerWaalsContact O-N 3.11Å; N73-L75 VanDerWaalsContact C-N 3.34Å; N73-L75 PolarHBondContact O-N 2.88Å; L75-Q79 WeakPolarHBondContact O-CG 3.38Å; L75-Q79 PolarHBondContact O-N 3.01Å; L75-Q79 PolarHBondContact O-NE2 2.71Å
76L97.9Very high97.6Very high72 Ų72103.9 Ų103.938%0.37750%0.5SS..Hα-helixtrans-78.4-37.7176.1-74.5171.6000111.2R72 N73 E74 Q79 V80R72-L76 HydrophobicContact CG-CD1 4.34Å; R72-L76 VanDerWaalsContact O-CG 3.32Å; R72-L76 WeakPolarHBondContact O-CG 3.47Å; R72-L76 PolarHBondContact O-N 2.86Å; R72-L76 VanDerWaalsContact O-N 3.15Å; N73-L76 CarbonylContact O-C 3.51Å; N73-L76 WeakPolarHBondContact O-CA 3.38Å; N73-L76 WeakPolarHBondContact O-CB 3.43Å; N73-L76 PolarHBondContact O-N 3.43Å; E74-L76 VanDerWaalsContact C-N 3.26Å; E74-L76 PolarHBondContact O-N 3.29Å; L76-Q79 PolarHBondContact O-N 3.35Å; L76-V80 VanDerWaalsContact O-CG2 3.32Å; L76-V80 WeakPolarHBondContact O-CG2 3.48Å; L76-V80 PolarHBondContact O-N 3.33Å
77E97.8Very high97.7Very high125 Ų125101.9 Ų101.958%0.58449%0.491SS*.Hα-helixtrans-63.2-44.7174.3-73.2170.3-169.900110.5N73 E74 Q79 V80 E81N73-E77 WeakPolarHBondContact O-CB 3.24Å; N73-E77 WeakPolarHBondContact O-CG 3.4Å; N73-E77 PolarHBondContact O-N 3.01Å; E74-E77 PolarHBondContact O-N 2.83Å; E74-E77 VanDerWaalsContact O-N 3.16Å; E77-Q79 PolarHBondContact O-N 2.91Å; E77-V80 PolarHBondContact O-N 3.24Å; E77-V80 VanDerWaalsContact O-N 3.16Å; E77-E81 PolarHBondContact O-N 2.82Å
78E97.4Very high97.7Very high126 Ų12698.7 Ų98.759%0.58949%0.485SS*.Hα-helixtrans-57.8-45.1172.9-73.7174.2-177.200112.2E74 V80 E81 H82E74-E78 WeakPolarHBondContact O-CG 3.45Å; E74-E78 PolarHBondContact O-N 3.21Å; E78-V80 VanDerWaalsContact C-N 3.33Å; E78-V80 PolarHBondContact O-N 2.89Å; E78-E81 PolarHBondContact O-N 2.85Å; E78-H82 WeakPolarHBondContact O-CB 3.35Å; E78-H82 PolarHBondContact O-N 3.44Å
79Q97.8Very high97.7Very high113 Ų113101 Ų10153%0.52849%0.491SS..Hα-helixtrans-64-37.8176.3-81.3171.686.300112.5L75 L76 E77 I83L75-Q79 WeakPolarHBondContact O-CG 3.38Å; L75-Q79 PolarHBondContact O-N 3.01Å; L75-Q79 PolarHBondContact O-NE2 2.71Å; L76-Q79 PolarHBondContact O-N 3.35Å; E77-Q79 PolarHBondContact O-N 2.91Å; Q79-I83 VanDerWaalsContact O-CG1 3.28Å; Q79-I83 WeakPolarHBondContact O-CG1 3.47Å; Q79-I83 PolarHBondContact O-N 2.98Å
80V97.9Very high97.7Very high91 Ų91100.3 Ų100.355%0.55249%0.487SS*.Hα-helixtrans-66.9-43.1177.1167.20000110.6L76 E77 E78 I83 R84L76-V80 VanDerWaalsContact O-CG2 3.32Å; L76-V80 WeakPolarHBondContact O-CG2 3.48Å; L76-V80 PolarHBondContact O-N 3.33Å; E77-V80 PolarHBondContact O-N 3.24Å; E77-V80 VanDerWaalsContact O-N 3.16Å; E78-V80 VanDerWaalsContact C-N 3.33Å; E78-V80 PolarHBondContact O-N 2.89Å; V80-I83 PolarHBondContact O-N 3.13Å; V80-R84 VanDerWaalsContact O-CB 3.27Å; V80-R84 WeakPolarHBondContact O-CB 3.38Å; V80-R84 PolarHBondContact O-N 3.32Å
81E97.8Very high97.7Very high84 Ų84106 Ų10639%0.39350%0.503SS..Hα-helixtrans-65.4-41.6175.9-74.1-58.1137.300111.5E77 E78 I83 R84 E85E77-E81 PolarHBondContact O-N 2.82Å; E78-E81 PolarHBondContact O-N 2.85Å; E81-I83 PolarHBondContact O-N 3.02Å; E81-R84 CarbonylContact O-C 3.58Å; E81-R84 WeakPolarHBondContact O-CA 3.49Å; E81-R84 WeakPolarHBondContact O-CB 3.23Å; E81-R84 PolarHBondContact O-N 3.11Å; E81-R84 IonicContact OE1-NH1 3.03Å; E81-R84 PolarHBondContact OE1-NH1 3.02Å; E81-R84 IonicContact OE2-NH1 3.62Å; E81-E85 WeakPolarHBondContact O-CG 3.31Å; E81-E85 PolarHBondContact O-N 2.83Å
82H97.6Very high97.7Very high120 Ų120108.3 Ų108.356%0.55651%0.513SS*.Hα-helixtrans-59.2-46174.7-17658.6000112.8E78 R84 E85 E86E78-H82 WeakPolarHBondContact O-CB 3.35Å; E78-H82 PolarHBondContact O-N 3.44Å; H82-R84 VanDerWaalsContact C-N 3.27Å; H82-R84 PolarHBondContact O-N 3.27Å; H82-E85 PolarHBondContact O-N 3.41Å; H82-E86 PolarHBondContact O-N 3.07Å
83I97.7Very high97.7Very high96 Ų96104.2 Ų104.249%0.49250%0.501SS..Hα-helixtrans-64.1-36.3175.5-68.3166.5000110.8Q79 V80 E81 E86 V87Q79-I83 VanDerWaalsContact O-CG1 3.28Å; Q79-I83 WeakPolarHBondContact O-CG1 3.47Å; Q79-I83 PolarHBondContact O-N 2.98Å; V80-I83 PolarHBondContact O-N 3.13Å; E81-I83 PolarHBondContact O-N 3.02Å; I83-E86 PolarHBondContact O-N 3.27Å; I83-V87 HydrophobicContact CG2-CG2 4.32Å; I83-V87 WeakPolarHBondContact O-CB 3.14Å; I83-V87 VanDerWaalsContact O-CG2 3.23Å; I83-V87 WeakPolarHBondContact O-CG2 3.31Å; I83-V87 PolarHBondContact O-N 3.24Å
84R98Very high97.7Very high153 Ų153105 Ų10558%0.57750%0.504SS*.Hα-helixtrans-67.1-40.1178.6-175.5-174.1-178.3-177.5-2.4111.7V80 E81 H82 S88V80-R84 VanDerWaalsContact O-CB 3.27Å; V80-R84 WeakPolarHBondContact O-CB 3.38Å; V80-R84 PolarHBondContact O-N 3.32Å; E81-R84 CarbonylContact O-C 3.58Å; E81-R84 WeakPolarHBondContact O-CA 3.49Å; E81-R84 WeakPolarHBondContact O-CB 3.23Å; E81-R84 PolarHBondContact O-N 3.11Å; E81-R84 IonicContact OE1-NH1 3.03Å; E81-R84 PolarHBondContact OE1-NH1 3.02Å; E81-R84 IonicContact OE2-NH1 3.62Å; H82-R84 VanDerWaalsContact C-N 3.27Å; H82-R84 PolarHBondContact O-N 3.27Å; R84-S88 WeakPolarHBondContact O-CB 3.49Å; R84-S88 PolarHBondContact O-N 3.24Å; R84-S88 PolarHBondContact O-OG 3.32Å
85E97.9Very high97.7Very high119 Ų119102.4 Ų102.456%0.55650%0.498SS*.Hα-helixtrans-62-49.5172.2-72.2171.117700110.4E81 H82 V87 S88 Q89E81-E85 WeakPolarHBondContact O-CG 3.31Å; E81-E85 PolarHBondContact O-N 2.83Å; H82-E85 PolarHBondContact O-N 3.41Å; E85-V87 VanDerWaalsContact C-N 3.35Å; E85-V87 PolarHBondContact O-N 3.11Å; E85-S88 CarbonylContact O-C 3.6Å; E85-S88 WeakPolarHBondContact O-CA 3.42Å; E85-S88 WeakPolarHBondContact O-CB 3.46Å; E85-S88 PolarHBondContact O-N 3.01Å; E85-Q89 PolarHBondContact O-N 2.81Å
86E97.9Very high97.6Very high103 Ų103102.8 Ų102.848%0.48150%0.498SS..Hα-helixtrans-57.9-45.7177.3-169.6-172.3173.800111.5H82 I83 S88 Q89 L90H82-E86 PolarHBondContact O-N 3.07Å; I83-E86 PolarHBondContact O-N 3.27Å; E86-S88 VanDerWaalsContact C-N 3.29Å; E86-S88 PolarHBondContact O-N 2.88Å; E86-Q89 PolarHBondContact O-N 3.36Å; E86-L90 HydrophobicContact CG-CD1 4.28Å; E86-L90 WeakPolarHBondContact O-CB 3.32Å; E86-L90 WeakPolarHBondContact O-CG 3.06Å; E86-L90 PolarHBondContact O-N 2.87Å
87V97.9Very high97.5Very high55 Ų55104.2 Ų104.233%0.33350%0.502SS..Hα-helixtrans-61.8-38.3175.3167.50000111.5I83 E85 R91I83-V87 HydrophobicContact CG2-CG2 4.32Å; I83-V87 WeakPolarHBondContact O-CB 3.14Å; I83-V87 VanDerWaalsContact O-CG2 3.23Å; I83-V87 WeakPolarHBondContact O-CG2 3.31Å; I83-V87 PolarHBondContact O-N 3.24Å; E85-V87 VanDerWaalsContact C-N 3.35Å; E85-V87 PolarHBondContact O-N 3.11Å; V87-R91 VanDerWaalsContact O-CB 3.31Å; V87-R91 WeakPolarHBondContact O-CB 3.13Å; V87-R91 VanDerWaalsContact O-CG 3.23Å; V87-R91 WeakPolarHBondContact O-CG 3.32Å; V87-R91 PolarHBondContact O-N 3.15Å
88S97.6Very high97.5Very high62 Ų62103 Ų10343%0.43450%0.499SS..Hα-helixtrans-68.7-40.6178.6-58.70000111.1R84 E85 E86 R91 H92R84-S88 WeakPolarHBondContact O-CB 3.49Å; R84-S88 PolarHBondContact O-N 3.24Å; R84-S88 PolarHBondContact O-OG 3.32Å; E85-S88 CarbonylContact O-C 3.6Å; E85-S88 WeakPolarHBondContact O-CA 3.42Å; E85-S88 WeakPolarHBondContact O-CB 3.46Å; E85-S88 PolarHBondContact O-N 3.01Å; E86-S88 VanDerWaalsContact C-N 3.29Å; E86-S88 PolarHBondContact O-N 2.88Å; S88-R91 PolarHBondContact O-N 2.79Å; S88-H92 PolarHBondContact O-N 3.31Å
89Q97.8Very high97.4Very high118 Ų118101.9 Ų101.955%0.55149%0.494SS*.Hα-helixtrans-64.6-48.7175.7-173.1162.6-0.100111.7E85 E86 R91 H92 E93E85-Q89 PolarHBondContact O-N 2.81Å; E86-Q89 PolarHBondContact O-N 3.36Å; Q89-R91 VanDerWaalsContact C-N 3.3Å; Q89-R91 PolarHBondContact O-N 2.91Å; Q89-H92 PolarHBondContact O-N 2.83Å; Q89-H92 VanDerWaalsContact O-N 3.13Å; Q89-E93 PolarHBondContact O-N 2.91Å
90L97.7Very high97.2Very high85 Ų85101 Ų10145%0.44549%0.492SS..Hα-helixtrans-61.5-37176.2-70.9175.2000112.5E86 L94E86-L90 HydrophobicContact CG-CD1 4.28Å; E86-L90 WeakPolarHBondContact O-CB 3.32Å; E86-L90 WeakPolarHBondContact O-CG 3.06Å; E86-L90 PolarHBondContact O-N 2.87Å; L90-L94 WeakPolarHBondContact O-CB 3.07Å; L90-L94 WeakPolarHBondContact O-CG 3.48Å; L90-L94 PolarHBondContact O-N 2.97Å
91R97.5Very high96.9Very high172 Ų172101.6 Ų101.665%0.64949%0.492SS*.Hα-helixtrans-64.3-43173.5-82.1175.1174.1157.60.4112V87 S88 Q89 L94 S95V87-R91 VanDerWaalsContact O-CB 3.31Å; V87-R91 WeakPolarHBondContact O-CB 3.13Å; V87-R91 VanDerWaalsContact O-CG 3.23Å; V87-R91 WeakPolarHBondContact O-CG 3.32Å; V87-R91 PolarHBondContact O-N 3.15Å; S88-R91 PolarHBondContact O-N 2.79Å; Q89-R91 VanDerWaalsContact C-N 3.3Å; Q89-R91 PolarHBondContact O-N 2.91Å; R91-L94 PolarHBondContact O-N 3.35Å; R91-S95 PolarHBondContact O-N 2.87Å
92H97.5Very high96.6Very high133 Ų133104.2 Ų104.262%0.61650%0.504SS*.Hα-helixtrans-64-44.7177-178.758.7000111.5S88 Q89 L94 S95 M96S88-H92 PolarHBondContact O-N 3.31Å; Q89-H92 PolarHBondContact O-N 2.83Å; Q89-H92 VanDerWaalsContact O-N 3.13Å; H92-L94 PolarHBondContact O-N 3.21Å; H92-S95 WeakPolarHBondContact O-CB 3.46Å; H92-S95 PolarHBondContact O-N 2.83Å; H92-M96 PolarHBondContact O-N 3.19Å
93E97.7Very high96.3Very high70 Ų70105.3 Ų105.333%0.32751%0.508SS..Hα-helixtrans-60.8-42.1174.7-76.2-171.3-153.500113.2Q89 S95 M96 K97Q89-E93 PolarHBondContact O-N 2.91Å; E93-S95 VanDerWaalsContact C-N 3.35Å; E93-M96 PolarHBondContact O-N 2.68Å; E93-K97 WeakPolarHBondContact O-CB 3.39Å; E93-K97 VanDerWaalsContact O-CG 3.29Å; E93-K97 WeakPolarHBondContact O-CG 3.33Å; E93-K97 PolarHBondContact O-N 3.35Å; E93-K97 IonicContact OE2-NZ 3.03Å; E93-K97 PolarHBondContact OE2-NZ 3.09Å
94L96.9Very high95.8Very high101 Ų101108.2 Ų108.253%0.52951%0.513SS..Hα-helixtrans-61.6-44.5175.1-87.8165.3000110.8L90 R91 H92 M96 K97 D98L90-L94 WeakPolarHBondContact O-CB 3.07Å; L90-L94 WeakPolarHBondContact O-CG 3.48Å; L90-L94 PolarHBondContact O-N 2.97Å; R91-L94 PolarHBondContact O-N 3.35Å; H92-L94 PolarHBondContact O-N 3.21Å; L94-M96 PolarHBondContact O-N 3.05Å; L94-K97 PolarHBondContact O-N 3.24Å; L94-D98 WeakPolarHBondContact O-CB 3.47Å; L94-D98 PolarHBondContact O-N 2.96Å
95S97.2Very high95.3Very high52 Ų52104.8 Ų104.836%0.36451%0.51SS..Hα-helixtrans-57.6-47.2175.3-168.20000111.8R91 H92 E93 K97 D98 E99R91-S95 PolarHBondContact O-N 2.87Å; H92-S95 WeakPolarHBondContact O-CB 3.46Å; H92-S95 PolarHBondContact O-N 2.83Å; E93-S95 VanDerWaalsContact C-N 3.35Å; S95-K97 VanDerWaalsContact C-N 3.33Å; S95-K97 PolarHBondContact O-N 2.84Å; S95-D98 PolarHBondContact O-N 2.7Å; S95-E99 WeakPolarHBondContact O-CG 3.49Å; S95-E99 PolarHBondContact O-N 2.81Å; S95-E99 PolarHBondContact OG-OE1 2.9Å
96M96.6Very high94.6Very high108 Ų108101.8 Ų101.853%0.53250%0.502SS..Hα-helixtrans-62.9-40.6178.8-175.4-17766.100111.8H92 E93 L94 E99 L100H92-M96 PolarHBondContact O-N 3.19Å; E93-M96 PolarHBondContact O-N 2.68Å; L94-M96 PolarHBondContact O-N 3.05Å; M96-E99 PolarHBondContact O-N 3.33Å; M96-L100 WeakPolarHBondContact O-CB 3.49Å; M96-L100 PolarHBondContact O-N 2.89Å
97K96.1Very high93.7Very high103 Ų10399.4 Ų99.445%0.44850%0.499SS..Hα-helixtrans-65.8-40.3175.4-73.4166.5-176.9148.20111.2E93 L94 S95 L100 L101E93-K97 WeakPolarHBondContact O-CB 3.39Å; E93-K97 VanDerWaalsContact O-CG 3.29Å; E93-K97 WeakPolarHBondContact O-CG 3.33Å; E93-K97 PolarHBondContact O-N 3.35Å; E93-K97 IonicContact OE2-NZ 3.03Å; E93-K97 PolarHBondContact OE2-NZ 3.09Å; L94-K97 PolarHBondContact O-N 3.24Å; S95-K97 VanDerWaalsContact C-N 3.33Å; S95-K97 PolarHBondContact O-N 2.84Å; K97-L100 PolarHBondContact O-N 3.39Å; K97-L101 WeakPolarHBondContact O-CB 3.44Å; K97-L101 VanDerWaalsContact O-CG 3.3Å; K97-L101 WeakPolarHBondContact O-CG 3.5Å; K97-L101 PolarHBondContact O-N 3.02Å
98D96.5Very high92.7Very high98 Ų9899.3 Ų99.352%0.52451%0.505SS..Hα-helixtrans-65.6-42.4176.2-77.4-20.7000111.7L94 S95 L101 Q102L94-D98 WeakPolarHBondContact O-CB 3.47Å; L94-D98 PolarHBondContact O-N 2.96Å; S95-D98 PolarHBondContact O-N 2.7Å; D98-L101 PolarHBondContact O-N 3.32Å; D98-Q102 WeakPolarHBondContact O-CB 3.29Å; D98-Q102 PolarHBondContact O-N 2.94Å
99E95.7Very high91.1Very high103 Ų103104 Ų10448%0.48152%0.52SS..Hα-helixtrans-60.6-45.3174.2-75.2171.4-147.300111.4S95 M96 Q102 F103S95-E99 WeakPolarHBondContact O-CG 3.49Å; S95-E99 PolarHBondContact O-N 2.81Å; S95-E99 PolarHBondContact OG-OE1 2.9Å; M96-E99 PolarHBondContact O-N 3.33Å; E99-Q102 WeakPolarHBondContact O-CB 3.29Å; E99-Q102 PolarHBondContact O-N 3.22Å; E99-F103 WeakPolarHBondContact O-CD2 3.12Å; E99-F103 PolarHBondContact O-N 3.43Å
100L94.3Very high89.3Confident96 Ų96106.6 Ų106.650%0.50353%0.532SS..Hα-helixtrans-63.5-43.5177.1-174.864.2000111.9M96 K97 Q102 F103 Y104M96-L100 WeakPolarHBondContact O-CB 3.49Å; M96-L100 PolarHBondContact O-N 2.89Å; K97-L100 PolarHBondContact O-N 3.39Å; L100-Q102 VanDerWaalsContact C-N 3.3Å; L100-Q102 PolarHBondContact O-N 2.81Å; L100-F103 WeakPolarHBondContact O-CB 3.31Å; L100-F103 PolarHBondContact O-N 3.47Å; L100-Y104 HydrophobicContact CD1-CD2 4.21Å; L100-Y104 HydrophobicContact CD1-CE2 3.72Å; L100-Y104 HydrophobicContact CD2-CE2 4.22Å; L100-Y104 HydrophobicContact CG-CD2 3.99Å; L100-Y104 HydrophobicContact CG-CE2 3.72Å; L100-Y104 WeakPolarHBondContact O-CD2 3.44Å; L100-Y104 PolarHBondContact O-N 3.08Å
101L91.4Very high87.2Confident103 Ų103106.5 Ų106.554%0.53954%0.538SS..Hα-helixtrans-62.6-38.4174.4-76.3170.9000111.5K97 D98 Y104 T105K97-L101 WeakPolarHBondContact O-CB 3.44Å; K97-L101 VanDerWaalsContact O-CG 3.3Å; K97-L101 WeakPolarHBondContact O-CG 3.5Å; K97-L101 PolarHBondContact O-N 3.02Å; D98-L101 PolarHBondContact O-N 3.32Å; L101-Y104 PolarHBondContact O-N 3.2Å; L101-T105 WeakPolarHBondContact O-CB 3.23Å; L101-T105 PolarHBondContact O-N 2.81Å; L101-T105 PolarHBondContact O-OG1 3.41Å
102Q91.3Very high84.5Confident139 Ų139106 Ų10665%0.6554%0.543SS*.Hα-helixtrans-60.9-45.7174-173.6176.412.100110.9D98 E99 L100 Y104 T105 S106D98-Q102 WeakPolarHBondContact O-CB 3.29Å; D98-Q102 PolarHBondContact O-N 2.94Å; E99-Q102 WeakPolarHBondContact O-CB 3.29Å; E99-Q102 PolarHBondContact O-N 3.22Å; L100-Q102 VanDerWaalsContact C-N 3.3Å; L100-Q102 PolarHBondContact O-N 2.81Å; Q102-Y104 PolarHBondContact O-N 3.21Å; Q102-T105 PolarHBondContact O-N 2.74Å; Q102-S106 WeakPolarHBondContact O-CB 3.32Å; Q102-S106 PolarHBondContact O-N 3.47Å; Q102-S106 PolarHBondContact O-OG 3.44Å
103F90.6Very high82Confident143 Ų143104.7 Ų104.763%0.62755%0.546SS*.Hα-helixtrans-57.6-45.6174.1-80.1-67.2000112.7E99 L100 S106 A107E99-F103 WeakPolarHBondContact O-CD2 3.12Å; E99-F103 PolarHBondContact O-N 3.43Å; L100-F103 WeakPolarHBondContact O-CB 3.31Å; L100-F103 PolarHBondContact O-N 3.47Å; F103-S106 WeakPolarHBondContact CA-OG 3.47Å; F103-S106 PolarHBondContact O-N 2.78Å; F103-S106 PolarHBondContact O-OG 2.83Å; F103-A107 WeakPolarHBondContact O-CB 3.48Å; F103-A107 PolarHBondContact O-N 3.02Å
104Y88.3Confident79.4Confident157 Ų157110.4 Ų110.462%0.61657%0.573SS**Hα-helixtrans-67.1-37.2177.3-80-65.9000112.7L100 L101 Q102 A107 A108L100-Y104 HydrophobicContact CD1-CD2 4.21Å; L100-Y104 HydrophobicContact CD1-CE2 3.72Å; L100-Y104 HydrophobicContact CD2-CE2 4.22Å; L100-Y104 HydrophobicContact CG-CD2 3.99Å; L100-Y104 HydrophobicContact CG-CE2 3.72Å; L100-Y104 WeakPolarHBondContact O-CD2 3.44Å; L100-Y104 PolarHBondContact O-N 3.08Å; L101-Y104 PolarHBondContact O-N 3.2Å; Q102-Y104 PolarHBondContact O-N 3.21Å; Y104-A107 PolarHBondContact O-N 3.41Å; Y104-A108 WeakPolarHBondContact O-CB 3.33Å; Y104-A108 PolarHBondContact O-N 2.75Å
105T87.4Confident76.9Confident81 Ų81111.1 Ų111.150%0.49759%0.586SS.*Hα-helixtrans-68-43.2177.7-51.40000110.3L101 Q102 A108 E109L101-T105 WeakPolarHBondContact O-CB 3.23Å; L101-T105 PolarHBondContact O-N 2.81Å; L101-T105 PolarHBondContact O-OG1 3.41Å; Q102-T105 PolarHBondContact O-N 2.74Å; T105-A108 PolarHBondContact O-N 2.97Å; T105-E109 WeakPolarHBondContact O-CG 3.14Å; T105-E109 PolarHBondContact O-N 3.49Å
106S82Confident74.3Confident56 Ų56115 Ų11539%0.39261%0.608SS.*Hα-helixtrans-65.8-40.3173.855.10000112.5Q102 F103 E109 E110Q102-S106 WeakPolarHBondContact O-CB 3.32Å; Q102-S106 PolarHBondContact O-N 3.47Å; Q102-S106 PolarHBondContact O-OG 3.44Å; F103-S106 WeakPolarHBondContact CA-OG 3.47Å; F103-S106 PolarHBondContact O-N 2.78Å; F103-S106 PolarHBondContact O-OG 2.83Å; S106-E109 PolarHBondContact O-N 3.26Å; S106-E110 WeakPolarHBondContact O-CB 3.31Å; S106-E110 PolarHBondContact O-N 2.98Å
107A79.9Confident71.1Confident52 Ų52115 Ų11543%0.4362%0.618SS.*Hα-helixtrans-68.5-35.5176.900000112F103 Y104 S111F103-A107 WeakPolarHBondContact O-CB 3.48Å; F103-A107 PolarHBondContact O-N 3.02Å; Y104-A107 PolarHBondContact O-N 3.41Å; A107-S111 WeakPolarHBondContact O-CB 3.19Å; A107-S111 PolarHBondContact O-N 3.14Å; A107-S111 VanDerWaalsContact O-N 3.08Å; A107-S111 PolarHBondContact O-OG 3.27Å; A107-S111 VanDerWaalsContact O-OG 3.13Å
108A76.4Confident68.3Low54 Ų54115.2 Ų115.245%0.44663%0.632SS.*Hα-helixtrans-66.9-44.6173.800000111.3Y104 T105 E110 S111Y104-A108 WeakPolarHBondContact O-CB 3.33Å; Y104-A108 PolarHBondContact O-N 2.75Å; T105-A108 PolarHBondContact O-N 2.97Å; A108-E110 VanDerWaalsContact C-N 3.32Å; A108-E110 PolarHBondContact O-N 3.34Å; A108-S111 PolarHBondContact O-N 3.02Å; A108-S111 PolarHBondContact O-OG 3.36Å
109E64.4Low65.6Low160 Ų160116.8 Ų116.875%0.74865%0.645SS**Hα-helixtrans-65-32.3175.2-77.2-172.7163.200113T105 S106T105-E109 WeakPolarHBondContact O-CG 3.14Å; T105-E109 PolarHBondContact O-N 3.49Å; S106-E109 PolarHBondContact O-N 3.26Å
110E59.4Low63.6Low173 Ų173117.3 Ų117.381%0.80866%0.657SS**Hα-helixtrans-81.3-15.7177.7-155169.9-152.900113S106 A108S106-E110 WeakPolarHBondContact O-CB 3.31Å; S106-E110 PolarHBondContact O-N 2.98Å; A108-E110 VanDerWaalsContact C-N 3.32Å; A108-E110 PolarHBondContact O-N 3.34Å
111S53.5Low61.7Low83 Ų83120.8 Ų120.858%0.5868%0.676SS**SBendtrans-95.8-1.1-176.472.10000116.1A107 A108 P113A107-S111 WeakPolarHBondContact O-CB 3.19Å; A107-S111 PolarHBondContact O-N 3.14Å; A107-S111 VanDerWaalsContact O-N 3.08Å; A107-S111 PolarHBondContact O-OG 3.27Å; A107-S111 VanDerWaalsContact O-OG 3.13Å; A108-S111 PolarHBondContact O-N 3.02Å; A108-S111 PolarHBondContact O-OG 3.36Å; S111-P113 WeakPolarHBondContact O-CD 3.15Å
112E41.4Very low59.3Low161 Ų161126 Ų12675%0.75269%0.694SS**  trans-96.991.8172.6-82.3-77.2154.200111.5
113P44.3Very low57.2Low105 Ų105129.4 Ų129.468%0.68270%0.701SS**  trans-103.7120.1140.732.1-21.6000108.3S111 S115S111-P113 WeakPolarHBondContact O-CD 3.15Å; P113-S115 PolarHBondContact O-N 2.84Å
114E43.2Very low54.9Low191 Ų191130.4 Ų130.489%0.89371%0.713SS**  trans-36.3109.5167.7-61.4176.7144.400112.2
115S44.2Very low53.1Low115 Ų115129.6 Ų129.680%0.80471%0.714SS**  trans-159.7107.3160.5-170.10000113.4P113P113-S115 PolarHBondContact O-N 2.84Å
116V42.5Very low51.4Low134 Ų134130.7 Ų130.781%0.81273%0.726SS**  trans-62153.4171.8-164.90000111.4
117C30.3Very low49.6Very low109 Ų109134.3 Ų134.374%0.73675%0.751SS**  trans113.2118.8135.7-138.40000119.6
118S36.3Very low48.2Very low107 Ų107134.1 Ų134.175%0.74875%0.746SS**  trans88.2121132.3-69.60000123.2
119T40.8Very low47Very low130 Ų130135.8 Ų135.880%0.79876%0.755SS**  trans-69.7-176.2146.252.90000110.6
120P54.4Low46.4Very low115 Ų115133.2 Ų133.275%0.74775%0.75SS**  cis-142.1-177.3-4.329.5-3.3000116.5
121L53.1Low46.4Very low169 Ų169131.4 Ų131.489%0.88574%0.741SS**  trans-14.1143160.2-81.4111.7000121.2
122K40.8Very low46.6Very low213 Ų213131.3 Ų131.393%0.92673%0.734SS**  trans-158.3139.2135.1-128.8-165.5-178.9-171.70116.3
123R47.8Very low47.6Very low210 Ų210131.9 Ų131.979%0.79273%0.731SS**  trans-81.9145179.4-175-175.1-155.11525.3112.7
124N43.4Very low48.7Very low164 Ų164134.1 Ų134.188%0.87773%0.73SS**  trans-151.3133.2162.4-155.613.4000112
125E48.5Very low50.4Low139 Ų139130.8 Ų130.865%0.6571%0.714SS**  trans-116.4147.6-171.5-71.3-87.1165.200110.8
126S53.3Low52.3Low105 Ų105130.2 Ų130.273%0.73470%0.702SS**  trans87.874.9157.7-47.80000119.7
127S43.9Very low54.4Low132 Ų132128.1 Ų128.192%0.92369%0.686SS**SBendtrans-156.923.6145-74.40000113.6
128S50.2Low57.3Low47 Ų47126.6 Ų126.633%0.32968%0.676SS.*  trans-124.119.3-164680000116.8V130 Q131 N132S128-V130 VanDerWaalsContact C-N 3.32Å; S128-V130 PolarHBondContact O-N 3.49Å; S128-V130 VanDerWaalsContact O-N 3.15Å; S128-Q131 CarbonylContact O-C 3.55Å; S128-Q131 PolarHBondContact O-N 3.36Å; S128-N132 VanDerWaalsContact O-CB 3.26Å; S128-N132 WeakPolarHBondContact O-CB 3.35Å; S128-N132 PolarHBondContact O-N 3.3Å; S128-N132 PolarHBondContact O-ND2 2.92Å; S128-N132 PolarHBondContact O-OD1 2.94Å; S128-N132 PolarHBondContact OG-ND2 3.38Å; S128-N132 PolarHBondContact OG-OD1 3.48Å
129S52Low59.9Low90 Ų90127.3 Ų127.363%0.62967%0.671SS**Hα-helixtrans-60.3-31.8-169.966.50000115.8
130V50.9Low62.4Low106 Ų106126.8 Ų126.864%0.64266%0.66SS**Hα-helixtrans-81.6-35.2174.71790000111.6S128 N132 Y133 F134S128-V130 VanDerWaalsContact C-N 3.32Å; S128-V130 PolarHBondContact O-N 3.49Å; S128-V130 VanDerWaalsContact O-N 3.15Å; V130-N132 VanDerWaalsContact C-N 3.3Å; V130-N132 PolarHBondContact O-N 3.19Å; V130-Y133 PolarHBondContact O-N 3.13Å; V130-F134 WeakPolarHBondContact O-CD2 3.3Å
131Q59.1Low64.3Low135 Ų135127.9 Ų127.963%0.63165%0.653SS**Hα-helixtrans-67-31.9171.4-135.8108.1-0.500111.9S128 H135S128-Q131 CarbonylContact O-C 3.55Å; S128-Q131 PolarHBondContact O-N 3.36Å; Q131-H135 WeakPolarHBondContact O-CB 3.34Å; Q131-H135 PolarHBondContact O-CD2 2.89Å; Q131-H135 VanDerWaalsContact O-CD2 3.26Å; Q131-H135 PolarHBondContact O-N 3.02Å
132N59Low66.4Low80 Ų80125 Ų12543%0.42863%0.633SS.*Hα-helixtrans-69.6-33.6179.5-74.7-18.1000111.7S128 V130 H135 L136S128-N132 VanDerWaalsContact O-CB 3.26Å; S128-N132 WeakPolarHBondContact O-CB 3.35Å; S128-N132 PolarHBondContact O-N 3.3Å; S128-N132 PolarHBondContact O-ND2 2.92Å; S128-N132 PolarHBondContact O-OD1 2.94Å; S128-N132 PolarHBondContact OG-ND2 3.38Å; S128-N132 PolarHBondContact OG-OD1 3.48Å; V130-N132 VanDerWaalsContact C-N 3.3Å; V130-N132 PolarHBondContact O-N 3.19Å; N132-H135 PolarHBondContact O-N 3.16Å; N132-L136 WeakPolarHBondContact O-CB 3.29Å; N132-L136 PolarHBondContact O-N 3.39Å
133Y62Low69Low173 Ų173119.5 Ų119.568%0.67861%0.613SS**Hα-helixtrans-66.1-46.8175.1-101.4-88.3000111.7V130 H135 L136 D137V130-Y133 PolarHBondContact O-N 3.13Å; Y133-H135 VanDerWaalsContact C-N 3.33Å; Y133-H135 PolarHBondContact O-N 3.27Å; Y133-L136 PolarHBondContact O-N 2.94Å; Y133-L136 VanDerWaalsContact O-N 3.15Å; Y133-D137 PolarHBondContact O-N 2.91Å
134F68.1Low71.3Confident153 Ų153115 Ų11567%0.67160%0.599SS**Hα-helixtrans-64-37.2174.1-75.4-77000112.6V130 L136 S138V130-F134 WeakPolarHBondContact O-CD2 3.3Å; F134-L136 VanDerWaalsContact C-N 3.35Å; F134-S138 WeakPolarHBondContact O-CB 3.4Å; F134-S138 PolarHBondContact O-N 2.93Å
135H78Confident73.9Confident120 Ų120110.1 Ų110.156%0.55657%0.573SS**Hα-helixtrans-66.4-35.1172.3-89-61.3000112.9Q131 N132 Y133 L139Q131-H135 WeakPolarHBondContact O-CB 3.34Å; Q131-H135 PolarHBondContact O-CD2 2.89Å; Q131-H135 VanDerWaalsContact O-CD2 3.26Å; Q131-H135 PolarHBondContact O-N 3.02Å; N132-H135 PolarHBondContact O-N 3.16Å; Y133-H135 VanDerWaalsContact C-N 3.33Å; Y133-H135 PolarHBondContact O-N 3.27Å; H135-L139 WeakPolarHBondContact O-CB 3.39Å; H135-L139 WeakPolarHBondContact O-CD1 3.41Å; H135-L139 WeakPolarHBondContact O-CG 3.3Å; H135-L139 PolarHBondContact O-N 3.45Å
136L83.3Confident76.2Confident104 Ų104107.7 Ų107.755%0.54556%0.564SS.*Hα-helixtrans-74-40.7179.4-159.1138000111.3N132 Y133 F134 L139 Q140N132-L136 WeakPolarHBondContact O-CB 3.29Å; N132-L136 PolarHBondContact O-N 3.39Å; Y133-L136 PolarHBondContact O-N 2.94Å; Y133-L136 VanDerWaalsContact O-N 3.15Å; F134-L136 VanDerWaalsContact C-N 3.35Å; L136-L139 PolarHBondContact O-N 3.43Å; L136-Q140 VanDerWaalsContact O-CB 3.23Å; L136-Q140 WeakPolarHBondContact O-CB 3.33Å; L136-Q140 PolarHBondContact O-N 2.75Å
137D87.6Confident78.2Confident89 Ų89108 Ų10848%0.47655%0.554SS.*Hα-helixtrans-63.2-40.3171.4-74.4-19.8000111.7Y133 Q140 K141Y133-D137 PolarHBondContact O-N 2.91Å; D137-Q140 PolarHBondContact O-N 3.4Å; D137-K141 WeakPolarHBondContact O-CB 2.98Å; D137-K141 PolarHBondContact O-N 3.43Å
138S90.1Very high80.8Confident77 Ų77106.2 Ų106.254%0.53853%0.531SS..Hα-helixtrans-67.1-38.4175.8-169.30000112.3F134 K142F134-S138 WeakPolarHBondContact O-CB 3.4Å; F134-S138 PolarHBondContact O-N 2.93Å; S138-K142 WeakPolarHBondContact O-CB 3.45Å; S138-K142 PolarHBondContact O-N 2.79Å
139L91.9Very high83Confident123 Ų123108.8 Ų108.864%0.64454%0.538SS*.Hα-helixtrans-65.4-41.8172.5-91.4157000111.3H135 L136 K142 L143H135-L139 WeakPolarHBondContact O-CB 3.39Å; H135-L139 WeakPolarHBondContact O-CD1 3.41Å; H135-L139 WeakPolarHBondContact O-CG 3.3Å; H135-L139 PolarHBondContact O-N 3.45Å; L136-L139 PolarHBondContact O-N 3.43Å; L139-K142 PolarHBondContact O-N 3.4Å; L139-L143 VanDerWaalsContact O-CB 3.29Å; L139-L143 WeakPolarHBondContact O-CB 3.37Å; L139-L143 PolarHBondContact O-N 2.78Å
140Q93Very high85.2Confident119 Ų119107.8 Ų107.856%0.55653%0.526SS*.Hα-helixtrans-69.1-38.9-179.5-163.6169.7-0.500111.6L136 D137 L143 K144L136-Q140 VanDerWaalsContact O-CB 3.23Å; L136-Q140 WeakPolarHBondContact O-CB 3.33Å; L136-Q140 PolarHBondContact O-N 2.75Å; D137-Q140 PolarHBondContact O-N 3.4Å; Q140-L143 PolarHBondContact O-N 2.81Å; Q140-K144 PolarHBondContact O-N 3.41Å
141K94.9Very high87.4Confident137 Ų137107.2 Ų107.260%0.59652%0.522SS*.Hα-helixtrans-62.3-47.9169.3-176.3178.1177.9-178.60111.2D137 L143 K144 D145D137-K141 WeakPolarHBondContact O-CB 2.98Å; D137-K141 PolarHBondContact O-N 3.43Å; K141-L143 VanDerWaalsContact C-N 3.27Å; K141-L143 PolarHBondContact O-N 3.33Å; K141-K144 WeakPolarHBondContact O-CB 3.38Å; K141-K144 PolarHBondContact O-N 3.46Å; K141-K144 VanDerWaalsContact O-N 3.12Å; K141-D145 PolarHBondContact O-N 2.85Å
142K95.9Very high89.3Confident110 Ų110104.8 Ų104.848%0.47852%0.517SS..Hα-helixtrans-63.2-35.5178.9-172.957.6179.4168.30112.2S138 L139 L146S138-K142 WeakPolarHBondContact O-CB 3.45Å; S138-K142 PolarHBondContact O-N 2.79Å; L139-K142 PolarHBondContact O-N 3.4Å; K142-L146 HydrophobicContact CD-CG 4.46Å; K142-L146 HydrophobicContact CG-CD1 4.23Å; K142-L146 WeakPolarHBondContact O-CB 3.12Å; K142-L146 WeakPolarHBondContact O-CG 3.22Å; K142-L146 PolarHBondContact O-N 2.89Å
143L95.7Very high91.1Very high96 Ų96105.2 Ų105.250%0.50352%0.518SS..Hα-helixtrans-64.5-44.2173.5-175.2135.6000111L139 Q140 K141 L146 E147L139-L143 VanDerWaalsContact O-CB 3.29Å; L139-L143 WeakPolarHBondContact O-CB 3.37Å; L139-L143 PolarHBondContact O-N 2.78Å; Q140-L143 PolarHBondContact O-N 2.81Å; K141-L143 VanDerWaalsContact C-N 3.27Å; K141-L143 PolarHBondContact O-N 3.33Å; L143-L146 PolarHBondContact O-N 2.89Å; L143-E147 HydrophobicContact CD2-CG 4.4Å; L143-E147 WeakPolarHBondContact CD2-OE1 3.32Å; L143-E147 WeakPolarHBondContact O-CB 3.4Å; L143-E147 VanDerWaalsContact O-CG 3.27Å; L143-E147 WeakPolarHBondContact O-CG 3.22Å; L143-E147 PolarHBondContact O-N 3.41Å
144K96.9Very high92.8Very high115 Ų115105.2 Ų105.250%0.552%0.517SS..Hα-helixtrans-63-44.3174.3-166.8-179.2-177.3-91.10112.5Q140 K141 L146 E147 E148Q140-K144 PolarHBondContact O-N 3.41Å; K141-K144 WeakPolarHBondContact O-CB 3.38Å; K141-K144 PolarHBondContact O-N 3.46Å; K141-K144 VanDerWaalsContact O-N 3.12Å; K144-L146 VanDerWaalsContact C-N 3.32Å; K144-L146 PolarHBondContact O-N 2.81Å; K144-E147 WeakPolarHBondContact O-CB 3.41Å; K144-E147 PolarHBondContact O-N 2.84Å; K144-E148 WeakPolarHBondContact CE-OE1 3.22Å; K144-E148 IonicContact NZ-OE1 2.66Å; K144-E148 PolarHBondContact NZ-OE1 3.31Å; K144-E148 WeakPolarHBondContact O-CG 3.31Å; K144-E148 PolarHBondContact O-N 3.32Å
145D96.9Very high94.3Very high63 Ų63101.2 Ų101.234%0.33751%0.508SS..Hα-helixtrans-62-41.7177.1-61.7-18.4000110.5K141 E148 E149K141-D145 PolarHBondContact O-N 2.85Å; D145-E148 PolarHBondContact O-N 3.49Å; D145-E149 WeakPolarHBondContact O-CB 3.34Å; D145-E149 PolarHBondContact O-N 3.19Å
146L96.8Very high95.2Very high87 Ų87100.1 Ų100.146%0.45550%0.503SS..Hα-helixtrans-68.7-34.5175-73.7171.5000112.6K142 L143 K144 N150K142-L146 HydrophobicContact CD-CG 4.46Å; K142-L146 HydrophobicContact CG-CD1 4.23Å; K142-L146 WeakPolarHBondContact O-CB 3.12Å; K142-L146 WeakPolarHBondContact O-CG 3.22Å; K142-L146 PolarHBondContact O-N 2.89Å; L143-L146 PolarHBondContact O-N 2.89Å; K144-L146 VanDerWaalsContact C-N 3.32Å; K144-L146 PolarHBondContact O-N 2.81Å; L146-N150 VanDerWaalsContact O-CB 3.28Å; L146-N150 WeakPolarHBondContact O-CB 3.37Å; L146-N150 PolarHBondContact O-N 3.43Å
147E96.8Very high95.9Very high112 Ų11298 Ų9852%0.52350%0.501SS..Hα-helixtrans-64.6-44.7173.2-77.9173.1169.600110.9L143 K144 N150 V151L143-E147 HydrophobicContact CD2-CG 4.4Å; L143-E147 WeakPolarHBondContact CD2-OE1 3.32Å; L143-E147 WeakPolarHBondContact O-CB 3.4Å; L143-E147 VanDerWaalsContact O-CG 3.27Å; L143-E147 WeakPolarHBondContact O-CG 3.22Å; L143-E147 PolarHBondContact O-N 3.41Å; K144-E147 WeakPolarHBondContact O-CB 3.41Å; K144-E147 PolarHBondContact O-N 2.84Å; E147-N150 PolarHBondContact O-N 2.88Å; E147-V151 WeakPolarHBondContact O-CG2 3.41Å; E147-V151 PolarHBondContact O-N 3.16Å
148E97.3Very high96.4Very high94 Ų9497.1 Ų97.144%0.43950%0.501SS..Hα-helixtrans-62.8-46.5175.5-71.5172.6-168.100111.1K144 D145 N150 V151 V152K144-E148 WeakPolarHBondContact CE-OE1 3.22Å; K144-E148 IonicContact NZ-OE1 2.66Å; K144-E148 PolarHBondContact NZ-OE1 3.31Å; K144-E148 WeakPolarHBondContact O-CG 3.31Å; K144-E148 PolarHBondContact O-N 3.32Å; D145-E148 PolarHBondContact O-N 3.49Å; E148-N150 VanDerWaalsContact C-N 3.33Å; E148-N150 PolarHBondContact O-N 3.48Å; E148-V151 WeakPolarHBondContact O-CB 3.45Å; E148-V151 PolarHBondContact O-N 2.75Å; E148-V151 VanDerWaalsContact O-N 3.15Å; E148-V152 WeakPolarHBondContact O-CG2 3.33Å; E148-V152 PolarHBondContact O-N 2.77Å
149E97.4Very high96.8Very high102 Ų10298.6 Ų98.648%0.47750%0.5SS..Hα-helixtrans-59.9-41.2174.7-171.8-178.8172.200111.8D145 V151 V152 L153D145-E149 WeakPolarHBondContact O-CB 3.34Å; D145-E149 PolarHBondContact O-N 3.19Å; E149-V151 VanDerWaalsContact C-N 3.31Å; E149-V151 PolarHBondContact O-N 2.88Å; E149-V152 PolarHBondContact O-N 2.94Å; E149-L153 HydrophobicContact CG-CD1 4.15Å; E149-L153 HydrophobicContact CG-CG 4.45Å; E149-L153 WeakPolarHBondContact O-CB 3.24Å; E149-L153 VanDerWaalsContact O-CG 3.3Å; E149-L153 WeakPolarHBondContact O-CG 3.45Å; E149-L153 PolarHBondContact O-N 3.42Å
150N96.6Very high97.1Very high68 Ų6897 Ų9736%0.36449%0.492SS..Hα-helixtrans-65.2-34.9176.8-160.3-95000112.4L146 E147 E148 R154L146-N150 VanDerWaalsContact O-CB 3.28Å; L146-N150 WeakPolarHBondContact O-CB 3.37Å; L146-N150 PolarHBondContact O-N 3.43Å; E147-N150 PolarHBondContact O-N 2.88Å; E148-N150 VanDerWaalsContact C-N 3.33Å; E148-N150 PolarHBondContact O-N 3.48Å; N150-R154 WeakPolarHBondContact O-CB 3.4Å; N150-R154 VanDerWaalsContact O-CG 3.26Å; N150-R154 WeakPolarHBondContact O-CG 3.42Å; N150-R154 PolarHBondContact O-N 3.37Å; N150-R154 VanDerWaalsContact O-N 3.12Å; N150-R154 PolarHBondContact OD1-NE 2.97Å; N150-R154 PolarHBondContact OD1-NH1 3.2Å; N150-R154 VanDerWaalsContact OD1-NH1 3.13Å; N150-R154 PolarHBondContact OD1-NH2 3.44Å
151V98.1Very high97.3Very high95 Ų9598 Ų9858%0.57649%0.494SS*.Hα-helixtrans-67-45.5173.3171.40000110.4E147 E148 E149 R154 S155E147-V151 WeakPolarHBondContact O-CG2 3.41Å; E147-V151 PolarHBondContact O-N 3.16Å; E148-V151 WeakPolarHBondContact O-CB 3.45Å; E148-V151 PolarHBondContact O-N 2.75Å; E148-V151 VanDerWaalsContact O-N 3.15Å; E149-V151 VanDerWaalsContact C-N 3.31Å; E149-V151 PolarHBondContact O-N 2.88Å; V151-R154 PolarHBondContact O-N 3.43Å; V151-S155 PolarHBondContact O-N 3.41Å; V151-S155 PolarHBondContact O-OG 3.45Å
152V98.1Very high97.5Very high84 Ų8495.1 Ų95.151%0.50949%0.488SS..Hα-helixtrans-61.4-48.6177.9173.10000111.2E148 E149 R154 S155 E156E148-V152 WeakPolarHBondContact O-CG2 3.33Å; E148-V152 PolarHBondContact O-N 2.77Å; E149-V152 PolarHBondContact O-N 2.94Å; V152-R154 PolarHBondContact O-N 2.91Å; V152-S155 WeakPolarHBondContact CA-OG 3.47Å; V152-S155 PolarHBondContact O-N 2.9Å; V152-S155 VanDerWaalsContact O-N 3.07Å; V152-S155 PolarHBondContact O-OG 3.29Å; V152-E156 WeakPolarHBondContact O-CB 3.21Å; V152-E156 PolarHBondContact O-N 3.47Å
153L98.1Very high97.6Very high88 Ų8893.2 Ų93.246%0.46148%0.481SS..Hα-helixtrans-59.8-35.3177.1-72.5171.6000112.1E149 A157E149-L153 HydrophobicContact CG-CD1 4.15Å; E149-L153 HydrophobicContact CG-CG 4.45Å; E149-L153 WeakPolarHBondContact O-CB 3.24Å; E149-L153 VanDerWaalsContact O-CG 3.3Å; E149-L153 WeakPolarHBondContact O-CG 3.45Å; E149-L153 PolarHBondContact O-N 3.42Å; L153-A157 VanDerWaalsContact O-CB 3.24Å; L153-A157 WeakPolarHBondContact O-CB 3.45Å; L153-A157 PolarHBondContact O-N 2.9Å
154R98.2Very high97.7Very high174 Ų17492 Ų9266%0.65748%0.477SS*.Hα-helixtrans-70.1-38.5174.7-79176.6175.7149.84.3112.6N150 V151 V152 S158N150-R154 WeakPolarHBondContact O-CB 3.4Å; N150-R154 VanDerWaalsContact O-CG 3.26Å; N150-R154 WeakPolarHBondContact O-CG 3.42Å; N150-R154 PolarHBondContact O-N 3.37Å; N150-R154 VanDerWaalsContact O-N 3.12Å; N150-R154 PolarHBondContact OD1-NE 2.97Å; N150-R154 PolarHBondContact OD1-NH1 3.2Å; N150-R154 VanDerWaalsContact OD1-NH1 3.13Å; N150-R154 PolarHBondContact OD1-NH2 3.44Å; V151-R154 PolarHBondContact O-N 3.43Å; V152-R154 PolarHBondContact O-N 2.91Å; R154-S158 WeakPolarHBondContact O-CB 3.33Å; R154-S158 PolarHBondContact O-N 3.4Å
155S97.9Very high97.7Very high68 Ų6889.9 Ų89.948%0.47647%0.471SS..Hα-helixtrans-67.1-41.6173.948.60000111.7V151 V152 S158 Q159V151-S155 PolarHBondContact O-N 3.41Å; V151-S155 PolarHBondContact O-OG 3.45Å; V152-S155 WeakPolarHBondContact CA-OG 3.47Å; V152-S155 PolarHBondContact O-N 2.9Å; V152-S155 VanDerWaalsContact O-N 3.07Å; V152-S155 PolarHBondContact O-OG 3.29Å; S155-S158 WeakPolarHBondContact O-CB 3.41Å; S155-S158 PolarHBondContact O-N 2.86Å; S155-Q159 WeakPolarHBondContact O-CB 3.48Å; S155-Q159 PolarHBondContact O-N 2.69Å
156E98.1Very high97.8Very high97 Ų9789.7 Ų89.745%0.45347%0.472SS..Hα-helixtrans-64.1-45.7176.8-172.7-179.2172.500111.1V152 S158 Q159 L160V152-E156 WeakPolarHBondContact O-CB 3.21Å; V152-E156 PolarHBondContact O-N 3.47Å; E156-S158 VanDerWaalsContact C-N 3.27Å; E156-S158 PolarHBondContact O-N 3.08Å; E156-Q159 PolarHBondContact O-N 3.05Å; E156-Q159 VanDerWaalsContact O-N 3.13Å; E156-L160 HydrophobicContact CG-CD1 4.31Å; E156-L160 WeakPolarHBondContact O-CB 3.27Å; E156-L160 WeakPolarHBondContact O-CG 3.28Å; E156-L160 PolarHBondContact O-N 3.41Å
157A97.9Very high97.9Very high61 Ų6192.4 Ų92.450%0.50448%0.477SS..Hα-helixtrans-61.1-36174.100000112.5L153 K161L153-A157 VanDerWaalsContact O-CB 3.24Å; L153-A157 WeakPolarHBondContact O-CB 3.45Å; L153-A157 PolarHBondContact O-N 2.9Å; A157-K161 WeakPolarHBondContact O-CB 3.44Å; A157-K161 PolarHBondContact O-N 2.99Å; A157-K161 VanDerWaalsContact O-N 3.11Å
158S97.4Very high97.9Very high69 Ų6992.3 Ų92.348%0.48348%0.477SS..Hα-helixtrans-70.6-38.2174.5-171.10000112.2R154 S155 E156 T162R154-S158 WeakPolarHBondContact O-CB 3.33Å; R154-S158 PolarHBondContact O-N 3.4Å; S155-S158 WeakPolarHBondContact O-CB 3.41Å; S155-S158 PolarHBondContact O-N 2.86Å; E156-S158 VanDerWaalsContact C-N 3.27Å; E156-S158 PolarHBondContact O-N 3.08Å; S158-T162 PolarHBondContact O-N 3.45Å; S158-T162 VanDerWaalsContact O-N 3.09Å; S158-T162 PolarHBondContact O-OG1 3.34Å
159Q98.3Very high98Very high109 Ų10994 Ų9451%0.50949%0.485SS..Hα-helixtrans-66.9-49.7177.5178.3177.2-400110.8S155 E156 K161 T162 E163S155-Q159 WeakPolarHBondContact O-CB 3.48Å; S155-Q159 PolarHBondContact O-N 2.69Å; E156-Q159 PolarHBondContact O-N 3.05Å; E156-Q159 VanDerWaalsContact O-N 3.13Å; Q159-K161 VanDerWaalsContact C-N 3.26Å; Q159-K161 PolarHBondContact O-N 3.39Å; Q159-T162 WeakPolarHBondContact CA-OG1 3.47Å; Q159-T162 PolarHBondContact O-N 2.94Å; Q159-T162 PolarHBondContact O-OG1 3.4Å; Q159-E163 HydrophobicContact CG-CG 4.45Å; Q159-E163 VanDerWaalsContact CG-OE1 3.32Å; Q159-E163 WeakPolarHBondContact CG-OE1 3.38Å; Q159-E163 PolarHBondContact NE2-OE1 3.47Å; Q159-E163 WeakPolarHBondContact O-CG 3.33Å; Q159-E163 PolarHBondContact O-N 2.86Å
160L98.3Very high98Very high90 Ų9095.1 Ų95.147%0.47149%0.488SS..Hα-helixtrans-55.7-43.9174.7-74.9171.8000110.9E156 T162 E163 T164E156-L160 HydrophobicContact CG-CD1 4.31Å; E156-L160 WeakPolarHBondContact O-CB 3.27Å; E156-L160 WeakPolarHBondContact O-CG 3.28Å; E156-L160 PolarHBondContact O-N 3.41Å; L160-T162 VanDerWaalsContact C-N 3.33Å; L160-T162 PolarHBondContact O-N 3.2Å; L160-E163 PolarHBondContact O-N 3.5Å; L160-T164 WeakPolarHBondContact O-CB 3.31Å; L160-T164 PolarHBondContact O-N 3.31Å; L160-T164 PolarHBondContact O-OG1 2.76Å
161K98.4Very high98Very high140 Ų14096.9 Ų96.961%0.60949%0.494SS*.Hα-helixtrans-58.3-44175.2-179-177.5177-176.20112.4A157 Q159 I165A157-K161 WeakPolarHBondContact O-CB 3.44Å; A157-K161 PolarHBondContact O-N 2.99Å; A157-K161 VanDerWaalsContact O-N 3.11Å; Q159-K161 VanDerWaalsContact C-N 3.26Å; Q159-K161 PolarHBondContact O-N 3.39Å; K161-I165 HydrophobicContact CG-CD1 4.25Å; K161-I165 WeakPolarHBondContact O-CD1 3.28Å; K161-I165 VanDerWaalsContact O-CG1 3.29Å; K161-I165 WeakPolarHBondContact O-CG1 3.47Å; K161-I165 PolarHBondContact O-N 3.48Å
162T98.1Very high98Very high76 Ų7697.6 Ų97.647%0.46649%0.491SS..Hα-helixtrans-67.9-40.4177.548.50000111.9S158 Q159 L160 I165 T166S158-T162 PolarHBondContact O-N 3.45Å; S158-T162 VanDerWaalsContact O-N 3.09Å; S158-T162 PolarHBondContact O-OG1 3.34Å; Q159-T162 WeakPolarHBondContact CA-OG1 3.47Å; Q159-T162 PolarHBondContact O-N 2.94Å; Q159-T162 PolarHBondContact O-OG1 3.4Å; L160-T162 VanDerWaalsContact C-N 3.33Å; L160-T162 PolarHBondContact O-N 3.2Å; T162-I165 PolarHBondContact O-N 3.36Å; T162-T166 WeakPolarHBondContact O-CG2 3.46Å; T162-T166 PolarHBondContact O-N 2.81Å
163E98.2Very high98Very high70 Ų7098.5 Ų98.533%0.32749%0.49SS..Hα-helixtrans-61.9-46.7176.6-74.2174-167.700110.9Q159 L160 I165 T166 Y167Q159-E163 HydrophobicContact CG-CG 4.45Å; Q159-E163 VanDerWaalsContact CG-OE1 3.32Å; Q159-E163 WeakPolarHBondContact CG-OE1 3.38Å; Q159-E163 PolarHBondContact NE2-OE1 3.47Å; Q159-E163 WeakPolarHBondContact O-CG 3.33Å; Q159-E163 PolarHBondContact O-N 2.86Å; L160-E163 PolarHBondContact O-N 3.5Å; E163-I165 VanDerWaalsContact C-N 3.34Å; E163-I165 PolarHBondContact O-N 3.39Å; E163-T166 WeakPolarHBondContact CA-OG1 3.46Å; E163-T166 PolarHBondContact O-N 3.47Å; E163-T166 PolarHBondContact O-OG1 2.86Å; E163-Y167 HydrophobicContact CB-CD2 4.39Å; E163-Y167 HydrophobicContact CB-CE2 4.18Å; E163-Y167 WeakPolarHBondContact O-CD2 3.36Å; E163-Y167 PolarHBondContact O-N 3.37Å
164T97.9Very high98Very high70 Ų70100.2 Ų100.243%0.42950%0.499SS..Hα-helixtrans-54.1-48.1174.4-57.30000111.7L160 T166 Y167 E168L160-T164 WeakPolarHBondContact O-CB 3.31Å; L160-T164 PolarHBondContact O-N 3.31Å; L160-T164 PolarHBondContact O-OG1 2.76Å; T164-T166 VanDerWaalsContact C-N 3.3Å; T164-T166 PolarHBondContact O-N 2.83Å; T164-Y167 PolarHBondContact O-N 3.03Å; T164-E168 HydrophobicContact CG2-CG 4.37Å; T164-E168 WeakPolarHBondContact CG2-OE1 3.34Å; T164-E168 WeakPolarHBondContact O-CB 3.14Å; T164-E168 WeakPolarHBondContact O-CG 3.49Å; T164-E168 PolarHBondContact O-N 2.88Å
165I97.8Very high98.1Very high70 Ų7095 Ų9536%0.35949%0.486SS..Hα-helixtrans-60.3-41.6177.6-65.4163000110.9K161 T162 E163 Y167 E168 E169K161-I165 HydrophobicContact CG-CD1 4.25Å; K161-I165 WeakPolarHBondContact O-CD1 3.28Å; K161-I165 VanDerWaalsContact O-CG1 3.29Å; K161-I165 WeakPolarHBondContact O-CG1 3.47Å; K161-I165 PolarHBondContact O-N 3.48Å; T162-I165 PolarHBondContact O-N 3.36Å; E163-I165 VanDerWaalsContact C-N 3.34Å; E163-I165 PolarHBondContact O-N 3.39Å; I165-Y167 PolarHBondContact O-N 2.82Å; I165-E168 PolarHBondContact O-N 2.91Å; I165-E169 WeakPolarHBondContact O-CG 3.45Å; I165-E169 PolarHBondContact O-N 3.32Å
166T98.3Very high98.1Very high59 Ų5995.1 Ų95.136%0.36248%0.481SS..Hα-helixtrans-68.1-33.7178.661.90000113.3T162 E163 T164 K170T162-T166 WeakPolarHBondContact O-CG2 3.46Å; T162-T166 PolarHBondContact O-N 2.81Å; E163-T166 WeakPolarHBondContact CA-OG1 3.46Å; E163-T166 PolarHBondContact O-N 3.47Å; E163-T166 PolarHBondContact O-OG1 2.86Å; T164-T166 VanDerWaalsContact C-N 3.3Å; T164-T166 PolarHBondContact O-N 2.83Å; T166-K170 VanDerWaalsContact O-CG 3.3Å; T166-K170 WeakPolarHBondContact O-CG 3.49Å; T166-K170 PolarHBondContact O-N 3.27Å; T166-K170 VanDerWaalsContact O-N 3.13Å
167Y98.3Very high98.1Very high144 Ų14493.6 Ų93.657%0.56548%0.476SS*.Hα-helixtrans-70.7-43.6174.7-73.9-63.8000111.1E163 T164 I165 E169 K170 E171E163-Y167 HydrophobicContact CB-CD2 4.39Å; E163-Y167 HydrophobicContact CB-CE2 4.18Å; E163-Y167 WeakPolarHBondContact O-CD2 3.36Å; E163-Y167 PolarHBondContact O-N 3.37Å; T164-Y167 PolarHBondContact O-N 3.03Å; I165-Y167 PolarHBondContact O-N 2.82Å; Y167-E169 VanDerWaalsContact C-N 3.3Å; Y167-E169 PolarHBondContact O-N 2.87Å; Y167-K170 PolarHBondContact O-N 3.34Å; Y167-K170 VanDerWaalsContact O-N 3.16Å; Y167-E171 PolarHBondContact O-N 3.05Å
168E97.7Very high98.1Very high111 Ų11194.3 Ų94.352%0.51948%0.477SS..Hα-helixtrans-57.5-42.3173.5-72.9173.7179.400111.5T164 I165 E171 Q172T164-E168 HydrophobicContact CG2-CG 4.37Å; T164-E168 WeakPolarHBondContact CG2-OE1 3.34Å; T164-E168 WeakPolarHBondContact O-CB 3.14Å; T164-E168 WeakPolarHBondContact O-CG 3.49Å; T164-E168 PolarHBondContact O-N 2.88Å; I165-E168 PolarHBondContact O-N 2.91Å; E168-E171 PolarHBondContact O-N 3.25Å; E168-Q172 VanDerWaalsContact O-CB 3.29Å; E168-Q172 WeakPolarHBondContact O-CB 3.38Å; E168-Q172 PolarHBondContact O-N 3.23Å
169E98.2Very high98.2Very high130 Ų13094.1 Ų94.161%0.60747%0.473SS*.Hα-helixtrans-64-40.8175.9-77177.717800112.6I165 Y167 Q172 Q173I165-E169 WeakPolarHBondContact O-CG 3.45Å; I165-E169 PolarHBondContact O-N 3.32Å; Y167-E169 VanDerWaalsContact C-N 3.3Å; Y167-E169 PolarHBondContact O-N 2.87Å; E169-Q172 PolarHBondContact O-N 3.46Å; E169-Q173 WeakPolarHBondContact O-CB 3.3Å; E169-Q173 PolarHBondContact O-N 2.85Å
170K98.3Very high98.2Very high124 Ų12494.1 Ų94.154%0.53947%0.471SS..Hα-helixtrans-66.1-43.9176.3-72.9171-174.8172.90111.6T166 Y167 Q173 L174T166-K170 VanDerWaalsContact O-CG 3.3Å; T166-K170 WeakPolarHBondContact O-CG 3.49Å; T166-K170 PolarHBondContact O-N 3.27Å; T166-K170 VanDerWaalsContact O-N 3.13Å; Y167-K170 PolarHBondContact O-N 3.34Å; Y167-K170 VanDerWaalsContact O-N 3.16Å; K170-Q173 WeakPolarHBondContact O-CB 3.39Å; K170-Q173 PolarHBondContact O-N 2.95Å; K170-L174 WeakPolarHBondContact O-CG 3.35Å; K170-L174 PolarHBondContact O-N 3.43Å
171E97.1Very high98.2Very high106 Ų10696.4 Ų96.450%0.49548%0.479SS..Hα-helixtrans-60.8-46.4175.7-172.5-172.9168.200110.7Y167 E168 Q173 L174 V175Y167-E171 PolarHBondContact O-N 3.05Å; E168-E171 PolarHBondContact O-N 3.25Å; E171-Q173 PolarHBondContact O-N 3.19Å; E171-L174 PolarHBondContact O-N 3.06Å; E171-L174 VanDerWaalsContact O-N 3.16Å; E171-V175 WeakPolarHBondContact O-CG2 3.43Å; E171-V175 PolarHBondContact O-N 3.4Å
172Q98.1Very high98.2Very high110 Ų11094.6 Ų94.651%0.51448%0.476SS..Hα-helixtrans-60.5-34.7176.6-174.759.578.900112.2E168 E169 N176E168-Q172 VanDerWaalsContact O-CB 3.29Å; E168-Q172 WeakPolarHBondContact O-CB 3.38Å; E168-Q172 PolarHBondContact O-N 3.23Å; E169-Q172 PolarHBondContact O-N 3.46Å; Q172-N176 PolarHBondContact NE2-ND2 3.25Å; Q172-N176 WeakPolarHBondContact O-CB 3.34Å; Q172-N176 PolarHBondContact O-N 3.22Å; Q172-N176 PolarHBondContact O-ND2 2.83Å
173Q98.3Very high98.2Very high102 Ų10297 Ų9748%0.47748%0.476SS..Hα-helixtrans-68.3-46.2174.8-175.856.840.100111.6E169 K170 E171 V175 N176 D177E169-Q173 WeakPolarHBondContact O-CB 3.3Å; E169-Q173 PolarHBondContact O-N 2.85Å; K170-Q173 WeakPolarHBondContact O-CB 3.39Å; K170-Q173 PolarHBondContact O-N 2.95Å; E171-Q173 PolarHBondContact O-N 3.19Å; Q173-V175 VanDerWaalsContact C-N 3.33Å; Q173-V175 PolarHBondContact O-N 2.9Å; Q173-N176 WeakPolarHBondContact O-CB 3.4Å; Q173-N176 PolarHBondContact O-N 2.98Å; Q173-N176 VanDerWaalsContact O-N 3.08Å; Q173-D177 PolarHBondContact NE2-OD1 2.98Å; Q173-D177 VanDerWaalsContact NE2-OD1 3.09Å; Q173-D177 PolarHBondContact NE2-OD2 3.47Å; Q173-D177 PolarHBondContact O-N 2.84Å
174L98.4Very high98.2Very high125 Ų12597.3 Ų97.365%0.65448%0.48SS*.Hα-helixtrans-59.6-42.5176.2-69.9173000112K170 E171 N176 D177 C178K170-L174 WeakPolarHBondContact O-CG 3.35Å; K170-L174 PolarHBondContact O-N 3.43Å; E171-L174 PolarHBondContact O-N 3.06Å; E171-L174 VanDerWaalsContact O-N 3.16Å; L174-N176 VanDerWaalsContact C-N 3.33Å; L174-N176 PolarHBondContact O-N 3.1Å; L174-D177 PolarHBondContact O-N 3.09Å; L174-C178 WeakPolarHBondContact O-CB 2.89Å; L174-C178 PolarHBondContact O-N 3.04Å
175V98.6Very high98.3Very high64 Ų6496 Ų9639%0.38848%0.477SS..Hα-helixtrans-61.4-43.1174172.90000110.7E171 Q173 D177 C178 V179E171-V175 WeakPolarHBondContact O-CG2 3.43Å; E171-V175 PolarHBondContact O-N 3.4Å; Q173-V175 VanDerWaalsContact C-N 3.33Å; Q173-V175 PolarHBondContact O-N 2.9Å; V175-D177 VanDerWaalsContact C-N 3.33Å; V175-D177 PolarHBondContact O-N 3.09Å; V175-C178 PolarHBondContact O-N 3.27Å; V175-V179 HydrophobicContact CG1-CG2 4.33Å; V175-V179 WeakPolarHBondContact O-CB 3.49Å; V175-V179 WeakPolarHBondContact O-CG2 3.35Å; V175-V179 PolarHBondContact O-N 3.43Å
176N98.4Very high98.3Very high71 Ų7196.9 Ų96.938%0.3848%0.482SS..Hα-helixtrans-62.3-40.2177-88-62.1000112.6Q172 Q173 L174 V179 K180Q172-N176 PolarHBondContact NE2-ND2 3.25Å; Q172-N176 WeakPolarHBondContact O-CB 3.34Å; Q172-N176 PolarHBondContact O-N 3.22Å; Q172-N176 PolarHBondContact O-ND2 2.83Å; Q173-N176 WeakPolarHBondContact O-CB 3.4Å; Q173-N176 PolarHBondContact O-N 2.98Å; Q173-N176 VanDerWaalsContact O-N 3.08Å; L174-N176 VanDerWaalsContact C-N 3.33Å; L174-N176 PolarHBondContact O-N 3.1Å; N176-V179 PolarHBondContact O-N 2.69Å; N176-K180 WeakPolarHBondContact O-CB 3.39Å; N176-K180 PolarHBondContact O-N 2.91Å
177D98.5Very high98.3Very high64 Ų6498.7 Ų98.734%0.34249%0.493SS..Hα-helixtrans-67.9-44.1178.2-68.6-30.1000110.8Q173 L174 V175 V179 K180 E181Q173-D177 PolarHBondContact NE2-OD1 2.98Å; Q173-D177 VanDerWaalsContact NE2-OD1 3.09Å; Q173-D177 PolarHBondContact NE2-OD2 3.47Å; Q173-D177 PolarHBondContact O-N 2.84Å; L174-D177 PolarHBondContact O-N 3.09Å; V175-D177 VanDerWaalsContact C-N 3.33Å; V175-D177 PolarHBondContact O-N 3.09Å; D177-V179 PolarHBondContact O-N 3.49Å; D177-K180 WeakPolarHBondContact O-CB 3.4Å; D177-K180 PolarHBondContact O-N 3.2Å; D177-K180 VanDerWaalsContact O-N 3.09Å; D177-E181 WeakPolarHBondContact O-CG 3.46Å; D177-E181 PolarHBondContact O-N 3.2Å
178C98.1Very high98.3Very high77 Ų7797.7 Ų97.752%0.5249%0.493SS..Hα-helixtrans-59-44.3172.9-177.70000112.1L174 V175 K180 E181 L182L174-C178 WeakPolarHBondContact O-CB 2.89Å; L174-C178 PolarHBondContact O-N 3.04Å; V175-C178 PolarHBondContact O-N 3.27Å; C178-K180 VanDerWaalsContact C-N 3.28Å; C178-K180 PolarHBondContact O-N 2.88Å; C178-E181 PolarHBondContact O-N 2.95Å; C178-L182 WeakPolarHBondContact O-CB 3.47Å; C178-L182 PolarHBondContact O-N 3.22Å
179V98.7Very high98.3Very high65 Ų6597.5 Ų97.539%0.39450%0.495SS..Hα-helixtrans-66.1-34177.5174.20000110.9V175 N176 D177 R183V175-V179 HydrophobicContact CG1-CG2 4.33Å; V175-V179 WeakPolarHBondContact O-CB 3.49Å; V175-V179 WeakPolarHBondContact O-CG2 3.35Å; V175-V179 PolarHBondContact O-N 3.43Å; N176-V179 PolarHBondContact O-N 2.69Å; D177-V179 PolarHBondContact O-N 3.49Å; V179-R183 WeakPolarHBondContact O-CB 3.05Å; V179-R183 WeakPolarHBondContact O-CG 3.45Å; V179-R183 PolarHBondContact O-N 3.42Å; V179-R183 PolarHBondContact O-NE 3.26Å
180K98.5Very high98.4Very high109 Ų10994.1 Ų94.147%0.47449%0.489SS..Hα-helixtrans-68.3-47.8175.7-176.3-173171.8-165.30111.1N176 D177 C178 L182 R183 D184N176-K180 WeakPolarHBondContact O-CB 3.39Å; N176-K180 PolarHBondContact O-N 2.91Å; D177-K180 WeakPolarHBondContact O-CB 3.4Å; D177-K180 PolarHBondContact O-N 3.2Å; D177-K180 VanDerWaalsContact O-N 3.09Å; C178-K180 VanDerWaalsContact C-N 3.28Å; C178-K180 PolarHBondContact O-N 2.88Å; K180-L182 VanDerWaalsContact C-N 3.3Å; K180-L182 PolarHBondContact O-N 3.06Å; K180-R183 CarbonylContact O-C 3.59Å; K180-R183 WeakPolarHBondContact O-CA 3.36Å; K180-R183 WeakPolarHBondContact O-CB 3.41Å; K180-R183 PolarHBondContact O-N 3.4Å; K180-R183 VanDerWaalsContact O-N 3.1Å; K180-D184 VanDerWaalsContact O-CG 3.31Å; K180-D184 PolarHBondContact O-N 2.8Å
181E98.5Very high98.4Very high137 Ų13790.9 Ų90.964%0.6448%0.482SS*.Hα-helixtrans-59.9-41.6176.1-72.2179.4-172.500111.6D177 C178 R183 D184 A185D177-E181 WeakPolarHBondContact O-CG 3.46Å; D177-E181 PolarHBondContact O-N 3.2Å; C178-E181 PolarHBondContact O-N 2.95Å; E181-R183 VanDerWaalsContact C-N 3.33Å; E181-R183 PolarHBondContact O-N 3.42Å; E181-D184 PolarHBondContact O-N 3.23Å; E181-A185 WeakPolarHBondContact O-CB 3.38Å; E181-A185 PolarHBondContact O-N 3.46Å
182L98.4Very high98.4Very high102 Ų10291 Ų9153%0.53449%0.485SS..Hα-helixtrans-64.4-37.9175.3-171.2141.2000111.9C178 K180 N186C178-L182 WeakPolarHBondContact O-CB 3.47Å; C178-L182 PolarHBondContact O-N 3.22Å; K180-L182 VanDerWaalsContact C-N 3.3Å; K180-L182 PolarHBondContact O-N 3.06Å; L182-N186 WeakPolarHBondContact CD2-ND2 3.33Å; L182-N186 WeakPolarHBondContact O-CB 3.43Å; L182-N186 VanDerWaalsContact O-CG 3.25Å; L182-N186 PolarHBondContact O-N 3.41Å; L182-N186 PolarHBondContact O-ND2 2.91Å
183R98.5Very high98.5Very high126 Ų12689.2 Ų89.248%0.47548%0.484SS..Hα-helixtrans-63.9-45.2172-82.4-175.4-97117.7-4.9111.7V179 K180 E181 N186 V187V179-R183 WeakPolarHBondContact O-CB 3.05Å; V179-R183 WeakPolarHBondContact O-CG 3.45Å; V179-R183 PolarHBondContact O-N 3.42Å; V179-R183 PolarHBondContact O-NE 3.26Å; K180-R183 CarbonylContact O-C 3.59Å; K180-R183 WeakPolarHBondContact O-CA 3.36Å; K180-R183 WeakPolarHBondContact O-CB 3.41Å; K180-R183 PolarHBondContact O-N 3.4Å; K180-R183 VanDerWaalsContact O-N 3.1Å; E181-R183 VanDerWaalsContact C-N 3.33Å; E181-R183 PolarHBondContact O-N 3.42Å; R183-N186 WeakPolarHBondContact O-CB 3.49Å; R183-N186 PolarHBondContact O-N 2.95Å; R183-V187 WeakPolarHBondContact O-CG2 3.5Å; R183-V187 PolarHBondContact O-N 2.99Å
184D98.5Very high98.5Very high77 Ų7791.3 Ų91.341%0.41249%0.494SS..Hα-helixtrans-66.4-41.2-178.9-67.8-17.3000111.1K180 E181 V187 Q188K180-D184 VanDerWaalsContact O-CG 3.31Å; K180-D184 PolarHBondContact O-N 2.8Å; E181-D184 PolarHBondContact O-N 3.23Å; D184-V187 PolarHBondContact O-N 3.48Å; D184-Q188 WeakPolarHBondContact O-CG 3.43Å; D184-Q188 PolarHBondContact O-N 2.92Å
185A98.4Very high98.5Very high44 Ų4491 Ų9136%0.36449%0.489SS..Hα-helixtrans-61.4-43.217200000111.8E181 V187 Q188 I189E181-A185 WeakPolarHBondContact O-CB 3.38Å; E181-A185 PolarHBondContact O-N 3.46Å; A185-V187 VanDerWaalsContact C-N 3.33Å; A185-V187 PolarHBondContact O-N 3.37Å; A185-Q188 WeakPolarHBondContact O-CB 3.36Å; A185-Q188 PolarHBondContact O-N 3.34Å; A185-I189 VanDerWaalsContact O-CG1 3.3Å; A185-I189 WeakPolarHBondContact O-CG1 3.5Å; A185-I189 PolarHBondContact O-N 2.96Å
186N98.3Very high98.5Very high87 Ų8793.5 Ų93.547%0.46550%0.5SS..Hα-helixtrans-62.5-38.3175.4-80.3-27.5000112.6L182 R183 I189 A190L182-N186 WeakPolarHBondContact CD2-ND2 3.33Å; L182-N186 WeakPolarHBondContact O-CB 3.43Å; L182-N186 VanDerWaalsContact O-CG 3.25Å; L182-N186 PolarHBondContact O-N 3.41Å; L182-N186 PolarHBondContact O-ND2 2.91Å; R183-N186 WeakPolarHBondContact O-CB 3.49Å; R183-N186 PolarHBondContact O-N 2.95Å; N186-I189 PolarHBondContact O-N 3.27Å; N186-A190 WeakPolarHBondContact O-CB 3.39Å; N186-A190 PolarHBondContact O-N 3.32Å
187V98.5Very high98.5Very high98 Ų9892.9 Ų92.959%0.59451%0.505SS*.Hα-helixtrans-65-41.9174.1170.70000110.9R183 D184 A185 A190 S191R183-V187 WeakPolarHBondContact O-CG2 3.5Å; R183-V187 PolarHBondContact O-N 2.99Å; D184-V187 PolarHBondContact O-N 3.48Å; A185-V187 VanDerWaalsContact C-N 3.33Å; A185-V187 PolarHBondContact O-N 3.37Å; V187-A190 PolarHBondContact O-N 2.88Å; V187-S191 PolarHBondContact O-N 3.28Å
188Q98.6Very high98.5Very high122 Ų12296.4 Ų96.457%0.5752%0.517SS*.Hα-helixtrans-62.6-44.4175.4-70.4174.241.900111.8D184 A185 A190 S191 I192D184-Q188 WeakPolarHBondContact O-CG 3.43Å; D184-Q188 PolarHBondContact O-N 2.92Å; A185-Q188 WeakPolarHBondContact O-CB 3.36Å; A185-Q188 PolarHBondContact O-N 3.34Å; Q188-A190 VanDerWaalsContact C-N 3.3Å; Q188-A190 PolarHBondContact O-N 3.42Å; Q188-S191 WeakPolarHBondContact O-CB 3.29Å; Q188-S191 PolarHBondContact O-N 2.91Å; Q188-I192 WeakPolarHBondContact O-CG1 3.36Å; Q188-I192 PolarHBondContact O-N 3.45Å
189I98.5Very high98.5Very high108 Ų10899.9 Ų99.955%0.55452%0.523SS*.Hα-helixtrans-59.1-43.9175.1-68.9165.9000110.5A185 N186 I192 S193A185-I189 VanDerWaalsContact O-CG1 3.3Å; A185-I189 WeakPolarHBondContact O-CG1 3.5Å; A185-I189 PolarHBondContact O-N 2.96Å; N186-I189 PolarHBondContact O-N 3.27Å; I189-I192 PolarHBondContact O-N 3.41Å; I189-S193 VanDerWaalsContact O-CB 3.29Å; I189-S193 WeakPolarHBondContact O-CB 3.35Å; I189-S193 PolarHBondContact O-N 2.95Å
190A98.6Very high98.5Very high59 Ų59101 Ų10149%0.48853%0.531SS..Hα-helixtrans-62.4-43.9176.900000112N186 V187 Q188 S193 E194N186-A190 WeakPolarHBondContact O-CB 3.39Å; N186-A190 PolarHBondContact O-N 3.32Å; V187-A190 PolarHBondContact O-N 2.88Å; Q188-A190 VanDerWaalsContact C-N 3.3Å; Q188-A190 PolarHBondContact O-N 3.42Å; A190-S193 PolarHBondContact O-N 3.44Å; A190-E194 PolarHBondContact O-N 2.88Å
191S98.5Very high98.5Very high56 Ų56100.9 Ų100.939%0.39253%0.532SS..Hα-helixtrans-60.8-48.6176.2-170.80000111.8V187 Q188 S193 E194 E195V187-S191 PolarHBondContact O-N 3.28Å; Q188-S191 WeakPolarHBondContact O-CB 3.29Å; Q188-S191 PolarHBondContact O-N 2.91Å; S191-S193 VanDerWaalsContact C-N 3.3Å; S191-S193 PolarHBondContact O-N 3.44Å; S191-E194 PolarHBondContact O-N 3.23Å; S191-E195 WeakPolarHBondContact O-CG 3.48Å; S191-E195 PolarHBondContact O-N 2.93Å
192I98.6Very high98.5Very high109 Ų10996.9 Ų96.956%0.55952%0.515SS*.Hα-helixtrans-63.1-39.6178.2-67167.5000110.4Q188 I189 E194 E195 L196Q188-I192 WeakPolarHBondContact O-CG1 3.36Å; Q188-I192 PolarHBondContact O-N 3.45Å; I189-I192 PolarHBondContact O-N 3.41Å; I192-E194 VanDerWaalsContact C-N 3.35Å; I192-E194 PolarHBondContact O-N 2.89Å; I192-E195 PolarHBondContact O-N 2.7Å; I192-L196 WeakPolarHBondContact O-CB 3.36Å; I192-L196 PolarHBondContact O-N 2.94Å
193S98.4Very high98.4Very high71 Ų7194.4 Ų94.450%0.49751%0.509SS..Hα-helixtrans-63.9-38.8175.8-1760000112.3I189 A190 S191 A197I189-S193 VanDerWaalsContact O-CB 3.29Å; I189-S193 WeakPolarHBondContact O-CB 3.35Å; I189-S193 PolarHBondContact O-N 2.95Å; A190-S193 PolarHBondContact O-N 3.44Å; S191-S193 VanDerWaalsContact C-N 3.3Å; S191-S193 PolarHBondContact O-N 3.44Å; S193-A197 WeakPolarHBondContact O-CB 3.49Å; S193-A197 PolarHBondContact O-N 3.15Å
194E98.4Very high98.4Very high146 Ų14690.8 Ų90.868%0.68251%0.506SS*.Hα-helixtrans-67.6-42.4175.7-174.9173.6-173.900111.2A190 S191 I192 L196 A197 K198A190-E194 PolarHBondContact O-N 2.88Å; S191-E194 PolarHBondContact O-N 3.23Å; I192-E194 VanDerWaalsContact C-N 3.35Å; I192-E194 PolarHBondContact O-N 2.89Å; E194-L196 PolarHBondContact O-N 3.13Å; E194-A197 WeakPolarHBondContact O-CB 3.36Å; E194-A197 PolarHBondContact O-N 3.21Å; E194-K198 WeakPolarHBondContact O-CB 3.45Å; E194-K198 PolarHBondContact O-N 3.43Å
195E98.6Very high98.4Very high119 Ų11992.7 Ų92.756%0.55651%0.507SS*.Hα-helixtrans-61.5-43174.1-73.1179.5-159.200112.1S191 I192 A197 K198 K199S191-E195 WeakPolarHBondContact O-CG 3.48Å; S191-E195 PolarHBondContact O-N 2.93Å; I192-E195 PolarHBondContact O-N 2.7Å; E195-A197 VanDerWaalsContact C-N 3.34Å; E195-A197 PolarHBondContact O-N 3.47Å; E195-K198 PolarHBondContact O-N 3.04Å; E195-K199 WeakPolarHBondContact O-CG 3.45Å; E195-K199 PolarHBondContact O-N 3.3Å
196L98.5Very high98.4Very high117 Ų11796.4 Ų96.461%0.61352%0.517SS*.Hα-helixtrans-61.2-42.9174.6-174.176.6000111.3I192 E194 K199 T200I192-L196 WeakPolarHBondContact O-CB 3.36Å; I192-L196 PolarHBondContact O-N 2.94Å; E194-L196 PolarHBondContact O-N 3.13Å; L196-K199 PolarHBondContact O-N 3.16Å; L196-T200 WeakPolarHBondContact O-CB 3.34Å; L196-T200 PolarHBondContact O-N 3.44Å; L196-T200 PolarHBondContact O-OG1 2.93Å
197A98.4Very high98.4Very high58 Ų5896.4 Ų96.448%0.47951%0.514SS..Hα-helixtrans-62.3-44.7176.600000111.2S193 E194 E195 K199 T200 E201S193-A197 WeakPolarHBondContact O-CB 3.49Å; S193-A197 PolarHBondContact O-N 3.15Å; E194-A197 WeakPolarHBondContact O-CB 3.36Å; E194-A197 PolarHBondContact O-N 3.21Å; E195-A197 VanDerWaalsContact C-N 3.34Å; E195-A197 PolarHBondContact O-N 3.47Å; A197-K199 PolarHBondContact O-N 2.86Å; A197-T200 WeakPolarHBondContact O-CB 3.49Å; A197-T200 PolarHBondContact O-N 3.17Å; A197-E201 PolarHBondContact O-N 3.36Å
198K98.6Very high98.4Very high137 Ų13798.3 Ų98.360%0.59652%0.517SS*.Hα-helixtrans-61.5-43.5175.9-173.8178.4179.6179.80112.1E194 E195 T200 E201 D202E194-K198 WeakPolarHBondContact O-CB 3.45Å; E194-K198 PolarHBondContact O-N 3.43Å; E195-K198 PolarHBondContact O-N 3.04Å; K198-T200 VanDerWaalsContact C-N 3.3Å; K198-T200 PolarHBondContact O-N 2.91Å; K198-E201 PolarHBondContact O-N 2.95Å; K198-D202 PolarHBondContact O-N 3.44Å
199K98.3Very high98.4Very high151 Ų15198.3 Ų98.366%0.65752%0.517SS*.Hα-helixtrans-62.5-37.3174.7-72-65.7-175.6-1790112.3E195 L196 A197 D202 A203E195-K199 WeakPolarHBondContact O-CG 3.45Å; E195-K199 PolarHBondContact O-N 3.3Å; L196-K199 PolarHBondContact O-N 3.16Å; A197-K199 PolarHBondContact O-N 2.86Å; K199-D202 PolarHBondContact O-N 3.3Å; K199-A203 WeakPolarHBondContact O-CB 3.45Å; K199-A203 PolarHBondContact O-N 3.3Å
200T98.5Very high98.4Very high89 Ų8997.2 Ų97.255%0.54651%0.511SS..Hα-helixtrans-66.2-40.9175.9-55.90000111.3L196 A197 K198 A203 A204L196-T200 WeakPolarHBondContact O-CB 3.34Å; L196-T200 PolarHBondContact O-N 3.44Å; L196-T200 PolarHBondContact O-OG1 2.93Å; A197-T200 WeakPolarHBondContact O-CB 3.49Å; A197-T200 PolarHBondContact O-N 3.17Å; K198-T200 VanDerWaalsContact C-N 3.3Å; K198-T200 PolarHBondContact O-N 2.91Å; T200-A203 PolarHBondContact O-N 3.49Å; T200-A204 WeakPolarHBondContact O-CB 3.41Å; T200-A204 PolarHBondContact O-N 2.89Å
201E98.5Very high98.4Very high106 Ų10698.1 Ų98.150%0.49551%0.511SS..Hα-helixtrans-65.6-42.8174.9-167.6-168.6156.100112A197 K198 A203 A204 R205A197-E201 PolarHBondContact O-N 3.36Å; K198-E201 PolarHBondContact O-N 2.95Å; E201-A203 VanDerWaalsContact C-N 3.34Å; E201-A203 PolarHBondContact O-N 3.37Å; E201-A204 WeakPolarHBondContact O-CB 3.42Å; E201-A204 PolarHBondContact O-N 3.24Å; E201-R205 PolarHBondContact O-N 2.92Å; E201-R205 IonicContact OE1-CZ 2.82Å; E201-R205 IonicContact OE1-NH1 3.94Å; E201-R205 PolarHBondContact OE1-NH1 2.91Å; E201-R205 IonicContact OE1-NH2 3.49Å
202D98.5Very high98.5Very high52 Ų52101.4 Ų101.428%0.27852%0.519SS..Hα-helixtrans-59.9-44174.3-76.8-26.9000111.7K198 K199 A204 R205 Q206K198-D202 PolarHBondContact O-N 3.44Å; K199-D202 PolarHBondContact O-N 3.3Å; D202-A204 VanDerWaalsContact C-N 3.33Å; D202-A204 PolarHBondContact O-N 2.78Å; D202-R205 PolarHBondContact O-N 3.49Å; D202-R205 IonicContact OD1-CZ 3.51Å; D202-R205 IonicContact OD1-NE 3.9Å; D202-R205 IonicContact OD1-NH2 3.71Å; D202-R205 PolarHBondContact OD1-NH2 2.89Å; D202-Q206 WeakPolarHBondContact O-CG 3.31Å; D202-Q206 PolarHBondContact O-N 2.87Å
203A97.9Very high98.5Very high51 Ų5199.8 Ų99.842%0.42151%0.512SS..Hα-helixtrans-63.4-39.3175.500000111.8K199 T200 E201 Q206 Q207K199-A203 WeakPolarHBondContact O-CB 3.45Å; K199-A203 PolarHBondContact O-N 3.3Å; T200-A203 PolarHBondContact O-N 3.49Å; E201-A203 VanDerWaalsContact C-N 3.34Å; E201-A203 PolarHBondContact O-N 3.37Å; A203-Q206 PolarHBondContact O-N 2.93Å; A203-Q207 WeakPolarHBondContact O-CB 3.17Å; A203-Q207 PolarHBondContact O-N 2.97Å
204A97.9Very high98.5Very high49 Ų49100.8 Ų100.841%0.40551%0.511SS..Hα-helixtrans-62.9-44.4174.600000111.8T200 E201 D202 Q206 Q207 E208T200-A204 WeakPolarHBondContact O-CB 3.41Å; T200-A204 PolarHBondContact O-N 2.89Å; E201-A204 WeakPolarHBondContact O-CB 3.42Å; E201-A204 PolarHBondContact O-N 3.24Å; D202-A204 VanDerWaalsContact C-N 3.33Å; D202-A204 PolarHBondContact O-N 2.78Å; A204-Q206 PolarHBondContact O-N 3.5Å; A204-Q207 WeakPolarHBondContact O-CB 3.41Å; A204-Q207 PolarHBondContact O-N 3.37Å; A204-E208 WeakPolarHBondContact O-CG 3.38Å; A204-E208 PolarHBondContact O-N 3.19Å
205R98.6Very high98.5Very high118 Ų11897.1 Ų97.145%0.44550%0.501SS..Hα-helixtrans-58.8-44.7173.9-76.8-167.3-83.5-106.4-0.7112.3E201 D202 Q207 E208 E209E201-R205 PolarHBondContact O-N 2.92Å; E201-R205 IonicContact OE1-CZ 2.82Å; E201-R205 IonicContact OE1-NH1 3.94Å; E201-R205 PolarHBondContact OE1-NH1 2.91Å; E201-R205 IonicContact OE1-NH2 3.49Å; D202-R205 PolarHBondContact O-N 3.49Å; D202-R205 IonicContact OD1-CZ 3.51Å; D202-R205 IonicContact OD1-NE 3.9Å; D202-R205 IonicContact OD1-NH2 3.71Å; D202-R205 PolarHBondContact OD1-NH2 2.89Å; R205-Q207 VanDerWaalsContact C-N 3.32Å; R205-Q207 PolarHBondContact O-N 2.98Å; R205-E208 WeakPolarHBondContact O-CB 3.5Å; R205-E208 PolarHBondContact O-N 2.93Å; R205-E209 PolarHBondContact O-N 3.1Å
206Q98.5Very high98.5Very high122 Ų12296.2 Ų96.257%0.5750%0.497SS*.Hα-helixtrans-62.7-40.9176.5-72.5177.4-11.900111.6D202 A203 A204 E208 E209 I210D202-Q206 WeakPolarHBondContact O-CG 3.31Å; D202-Q206 PolarHBondContact O-N 2.87Å; A203-Q206 PolarHBondContact O-N 2.93Å; A204-Q206 PolarHBondContact O-N 3.5Å; Q206-E208 VanDerWaalsContact C-N 3.32Å; Q206-E208 PolarHBondContact O-N 3.3Å; Q206-E209 PolarHBondContact O-N 3.43Å; Q206-I210 VanDerWaalsContact O-CG1 3.27Å; Q206-I210 WeakPolarHBondContact O-CG1 3.46Å; Q206-I210 PolarHBondContact O-N 3.48Å
207Q98.6Very high98.5Very high87 Ų8794.5 Ų94.541%0.40749%0.488SS..Hα-helixtrans-62.3-38.9175.6-176.659.333.300112A203 A204 R205 T211A203-Q207 WeakPolarHBondContact O-CB 3.17Å; A203-Q207 PolarHBondContact O-N 2.97Å; A204-Q207 WeakPolarHBondContact O-CB 3.41Å; A204-Q207 PolarHBondContact O-N 3.37Å; R205-Q207 VanDerWaalsContact C-N 3.32Å; R205-Q207 PolarHBondContact O-N 2.98Å; Q207-T211 WeakPolarHBondContact O-CB 3.36Å; Q207-T211 PolarHBondContact O-N 3.4Å; Q207-T211 PolarHBondContact O-OG1 3.47Å
208E98.5Very high98.5Very high137 Ų13795.9 Ų95.964%0.6449%0.49SS*.Hα-helixtrans-64.2-44174-71.7177.3-178.700112.1A204 R205 Q206 T211 H212A204-E208 WeakPolarHBondContact O-CG 3.38Å; A204-E208 PolarHBondContact O-N 3.19Å; R205-E208 WeakPolarHBondContact O-CB 3.5Å; R205-E208 PolarHBondContact O-N 2.93Å; Q206-E208 VanDerWaalsContact C-N 3.32Å; Q206-E208 PolarHBondContact O-N 3.3Å; E208-T211 WeakPolarHBondContact O-CB 3.47Å; E208-T211 PolarHBondContact O-N 3.48Å; E208-H212 PolarHBondContact O-N 3.26Å
209E98.6Very high98.5Very high123 Ų12393.4 Ų93.458%0.57548%0.483SS*.Hα-helixtrans-63.2-46.2177-175.4175.5-174.600111.6R205 Q206 T211 H212 L213R205-E209 PolarHBondContact O-N 3.1Å; Q206-E209 PolarHBondContact O-N 3.43Å; E209-T211 VanDerWaalsContact C-N 3.26Å; E209-T211 PolarHBondContact O-N 2.92Å; E209-H212 PolarHBondContact O-N 2.86Å; E209-H212 VanDerWaalsContact O-N 3.15Å; E209-L213 HydrophobicContact CG-CD1 4.09Å; E209-L213 HydrophobicContact CG-CG 4.4Å; E209-L213 WeakPolarHBondContact O-CB 3.45Å; E209-L213 WeakPolarHBondContact O-CG 3.43Å; E209-L213 PolarHBondContact O-N 2.95Å
210I98.4Very high98.5Very high85 Ų8590.8 Ų90.844%0.43648%0.476SS..Hα-helixtrans-56.7-45.3174.3-69.7166.4000109.8Q206 H212 L213 L214Q206-I210 VanDerWaalsContact O-CG1 3.27Å; Q206-I210 WeakPolarHBondContact O-CG1 3.46Å; Q206-I210 PolarHBondContact O-N 3.48Å; I210-H212 VanDerWaalsContact C-N 3.35Å; I210-H212 PolarHBondContact O-N 3.42Å; I210-L213 PolarHBondContact O-N 3.45Å; I210-L214 HydrophobicContact CG2-CD1 3.86Å; I210-L214 HydrophobicContact CG2-CG 4.29Å; I210-L214 WeakPolarHBondContact O-CB 3.48Å; I210-L214 VanDerWaalsContact O-CG 3.23Å; I210-L214 WeakPolarHBondContact O-CG 3.47Å; I210-L214 PolarHBondContact O-N 3.2Å
211T98.6Very high98.5Very high77 Ų7791.7 Ų91.747%0.47247%0.474SS..Hα-helixtrans-62.8-41.4178.8-570000111.6Q207 E208 E209 L214 S215Q207-T211 WeakPolarHBondContact O-CB 3.36Å; Q207-T211 PolarHBondContact O-N 3.4Å; Q207-T211 PolarHBondContact O-OG1 3.47Å; E208-T211 WeakPolarHBondContact O-CB 3.47Å; E208-T211 PolarHBondContact O-N 3.48Å; E209-T211 VanDerWaalsContact C-N 3.26Å; E209-T211 PolarHBondContact O-N 2.92Å; T211-L214 PolarHBondContact O-N 2.91Å; T211-S215 PolarHBondContact O-N 2.96Å
212H98.7Very high98.5Very high125 Ų12594 Ų9458%0.57948%0.482SS*.Hα-helixtrans-64.4-45.3176.1-175.570.9000112.3E208 E209 I210 S215 Q216E208-H212 PolarHBondContact O-N 3.26Å; E209-H212 PolarHBondContact O-N 2.86Å; E209-H212 VanDerWaalsContact O-N 3.15Å; I210-H212 VanDerWaalsContact C-N 3.35Å; I210-H212 PolarHBondContact O-N 3.42Å; H212-S215 WeakPolarHBondContact O-CB 3.24Å; H212-S215 PolarHBondContact O-N 3.21Å; H212-Q216 PolarHBondContact O-N 2.94Å
213L98.8Very high98.5Very high76 Ų7697.9 Ų97.940%0.39850%0.497SS..Hα-helixtrans-63.8-41177.3-69.7174.4000111.7E209 I210 S215 Q216 I217E209-L213 HydrophobicContact CG-CD1 4.09Å; E209-L213 HydrophobicContact CG-CG 4.4Å; E209-L213 WeakPolarHBondContact O-CB 3.45Å; E209-L213 WeakPolarHBondContact O-CG 3.43Å; E209-L213 PolarHBondContact O-N 2.95Å; I210-L213 PolarHBondContact O-N 3.45Å; L213-S215 PolarHBondContact O-N 2.7Å; L213-Q216 PolarHBondContact O-N 2.96Å; L213-I217 WeakPolarHBondContact O-CG1 3.36Å; L213-I217 PolarHBondContact O-N 2.77Å
214L98.6Very high98.5Very high92 Ų9298.4 Ų98.448%0.48250%0.501SS..Hα-helixtrans-61.3-43.6174.4-73.9172.9000111.6I210 T211 Q216 I217 V218I210-L214 HydrophobicContact CG2-CD1 3.86Å; I210-L214 HydrophobicContact CG2-CG 4.29Å; I210-L214 WeakPolarHBondContact O-CB 3.48Å; I210-L214 VanDerWaalsContact O-CG 3.23Å; I210-L214 WeakPolarHBondContact O-CG 3.47Å; I210-L214 PolarHBondContact O-N 3.2Å; T211-L214 PolarHBondContact O-N 2.91Å; L214-Q216 VanDerWaalsContact C-N 3.33Å; L214-Q216 PolarHBondContact O-N 3.48Å; L214-I217 PolarHBondContact O-N 2.91Å; L214-V218 WeakPolarHBondContact O-CG2 3.13Å; L214-V218 PolarHBondContact O-N 3.45Å
215S98.5Very high98.6Very high68 Ų68103 Ų10348%0.47651%0.512SS..Hα-helixtrans-58.1-45.7173.9-175.50000111.6T211 H212 L213 I217 V218 D219T211-S215 PolarHBondContact O-N 2.96Å; H212-S215 WeakPolarHBondContact O-CB 3.24Å; H212-S215 PolarHBondContact O-N 3.21Å; L213-S215 PolarHBondContact O-N 2.7Å; S215-I217 PolarHBondContact O-N 3.11Å; S215-V218 PolarHBondContact O-N 2.84Å; S215-D219 PolarHBondContact O-N 2.97Å
216Q98.8Very high98.6Very high100 Ų10099.7 Ų99.747%0.46751%0.51SS..Hα-helixtrans-62-41.5176.9-175.6178.48900112.5H212 L213 L214 D219 L220H212-Q216 PolarHBondContact O-N 2.94Å; L213-Q216 PolarHBondContact O-N 2.96Å; L214-Q216 VanDerWaalsContact C-N 3.33Å; L214-Q216 PolarHBondContact O-N 3.48Å; Q216-D219 PolarHBondContact O-N 3.36Å; Q216-L220 HydrophobicContact CG-CD1 4.14Å; Q216-L220 WeakPolarHBondContact O-CB 3.27Å; Q216-L220 VanDerWaalsContact O-CG 3.29Å; Q216-L220 WeakPolarHBondContact O-CG 3.37Å; Q216-L220 PolarHBondContact O-N 2.93Å
217I98.6Very high98.5Very high82 Ų8297.4 Ų97.442%0.42151%0.506SS..Hα-helixtrans-61.6-45.3176.2-71.4166.8000110.3L213 L214 S215 D219 L220 Q221L213-I217 WeakPolarHBondContact O-CG1 3.36Å; L213-I217 PolarHBondContact O-N 2.77Å; L214-I217 PolarHBondContact O-N 2.91Å; S215-I217 PolarHBondContact O-N 3.11Å; I217-D219 PolarHBondContact O-N 2.85Å; I217-L220 PolarHBondContact O-N 3.42Å; I217-Q221 HydrophobicContact CG2-CG 4.3Å; I217-Q221 WeakPolarHBondContact O-CB 3.23Å; I217-Q221 VanDerWaalsContact O-CG 3.28Å; I217-Q221 WeakPolarHBondContact O-CG 3.39Å; I217-Q221 PolarHBondContact O-N 3.26Å
218V98.8Very high98.5Very high87 Ų8795.6 Ų95.653%0.52751%0.506SS..Hα-helixtrans-62-43.6178.6171.20000111.2L214 S215 L220 Q221 K222L214-V218 WeakPolarHBondContact O-CG2 3.13Å; L214-V218 PolarHBondContact O-N 3.45Å; S215-V218 PolarHBondContact O-N 2.84Å; V218-L220 PolarHBondContact O-N 3.31Å; V218-Q221 PolarHBondContact O-N 3.46Å; V218-K222 WeakPolarHBondContact O-CB 3.34Å; V218-K222 PolarHBondContact O-N 3.24Å
219D98.6Very high98.5Very high84 Ų8492.6 Ų92.645%0.44950%0.497SS..Hα-helixtrans-63.3-41.7176.3-82.4-17.9000112.5S215 Q216 I217 K222 K223S215-D219 PolarHBondContact O-N 2.97Å; Q216-D219 PolarHBondContact O-N 3.36Å; I217-D219 PolarHBondContact O-N 2.85Å; D219-K222 PolarHBondContact O-N 3.35Å; D219-K223 WeakPolarHBondContact O-CG 3.49Å; D219-K223 PolarHBondContact O-N 2.91Å
220L98.5Very high98.5Very high96 Ų9692 Ų9250%0.50349%0.494SS..Hα-helixtrans-65.7-41.2175.3-73.4173.8000111.7Q216 I217 V218 K222 K223 A224Q216-L220 HydrophobicContact CG-CD1 4.14Å; Q216-L220 WeakPolarHBondContact O-CB 3.27Å; Q216-L220 VanDerWaalsContact O-CG 3.29Å; Q216-L220 WeakPolarHBondContact O-CG 3.37Å; Q216-L220 PolarHBondContact O-N 2.93Å; I217-L220 PolarHBondContact O-N 3.42Å; V218-L220 PolarHBondContact O-N 3.31Å; L220-K222 VanDerWaalsContact C-N 3.33Å; L220-K222 PolarHBondContact O-N 3.49Å; L220-K223 PolarHBondContact O-N 2.66Å; L220-A224 WeakPolarHBondContact O-CB 3.48Å; L220-A224 PolarHBondContact O-N 2.97Å
221Q98.6Very high98.5Very high108 Ų10892.7 Ų92.751%0.50550%0.499SS..Hα-helixtrans-62.2-41.2174.2-76.4178-900111.5I217 V218 A224 K225I217-Q221 HydrophobicContact CG2-CG 4.3Å; I217-Q221 WeakPolarHBondContact O-CB 3.23Å; I217-Q221 VanDerWaalsContact O-CG 3.28Å; I217-Q221 WeakPolarHBondContact O-CG 3.39Å; I217-Q221 PolarHBondContact O-N 3.26Å; V218-Q221 PolarHBondContact O-N 3.46Å; Q221-A224 PolarHBondContact O-N 2.87Å; Q221-K225 WeakPolarHBondContact O-CG 3.4Å; Q221-K225 PolarHBondContact O-N 3.49Å
222K98.6Very high98.5Very high154 Ų15494.8 Ų94.867%0.6750%0.503SS*.Hα-helixtrans-61.9-44175.5-175.2178.7178-179.80111.5V218 D219 L220 K225 A226V218-K222 WeakPolarHBondContact O-CB 3.34Å; V218-K222 PolarHBondContact O-N 3.24Å; D219-K222 PolarHBondContact O-N 3.35Å; L220-K222 VanDerWaalsContact C-N 3.33Å; L220-K222 PolarHBondContact O-N 3.49Å; K222-K225 PolarHBondContact O-N 3.34Å; K222-A226 PolarHBondContact O-N 3.45Å
223K98.6Very high98.5Very high135 Ų13593.5 Ų93.559%0.58750%0.497SS*.Hα-helixtrans-63.6-44.1175.4-72.1171.6-175.9171.40112D219 L220 K225 A226 C227D219-K223 WeakPolarHBondContact O-CG 3.49Å; D219-K223 PolarHBondContact O-N 2.91Å; L220-K223 PolarHBondContact O-N 2.66Å; K223-K225 VanDerWaalsContact C-N 3.32Å; K223-K225 PolarHBondContact O-N 3Å; K223-A226 PolarHBondContact O-N 3.45Å; K223-C227 PolarHBondContact O-N 3.25Å; K223-C227 PolarHBondContact O-SG 2.86Å; K223-C227 VanDerWaalsContact O-SG 3.35Å
224A98.3Very high98.5Very high61 Ų6195.3 Ų95.350%0.50451%0.507SS..Hα-helixtrans-60.4-42.2177.300000111.8L220 Q221 C227 A228L220-A224 WeakPolarHBondContact O-CB 3.48Å; L220-A224 PolarHBondContact O-N 2.97Å; Q221-A224 PolarHBondContact O-N 2.87Å; A224-C227 PolarHBondContact O-N 3.15Å; A224-A228 WeakPolarHBondContact O-CB 3.47Å; A224-A228 PolarHBondContact O-N 3.28Å
225K98.5Very high98.5Very high147 Ų14795.1 Ų95.164%0.63951%0.509SS*.Hα-helixtrans-63-43.6173.9-72.5177.4-178.3-179.40112.1Q221 K222 K223 A228 V229Q221-K225 WeakPolarHBondContact O-CG 3.4Å; Q221-K225 PolarHBondContact O-N 3.49Å; K222-K225 PolarHBondContact O-N 3.34Å; K223-K225 VanDerWaalsContact C-N 3.32Å; K223-K225 PolarHBondContact O-N 3Å; K225-A228 WeakPolarHBondContact O-CB 3.36Å; K225-A228 PolarHBondContact O-N 2.74Å; K225-V229 WeakPolarHBondContact O-CG2 3.5Å; K225-V229 PolarHBondContact O-N 2.96Å
226A98.3Very high98.5Very high48 Ų4898.2 Ų98.240%0.39752%0.516SS..Hα-helixtrans-60.6-47176.500000111.7K222 K223 A228 V229 E230K222-A226 PolarHBondContact O-N 3.45Å; K223-A226 PolarHBondContact O-N 3.45Å; A226-A228 VanDerWaalsContact C-N 3.28Å; A226-A228 PolarHBondContact O-N 3.28Å; A226-V229 PolarHBondContact O-N 3.27Å; A226-E230 WeakPolarHBondContact O-CG 3.48Å; A226-E230 PolarHBondContact O-N 3.11Å
227C98.3Very high98.4Very high74 Ų7499.7 Ų99.750%0.552%0.523SS..Hα-helixtrans-63.1-33.5175.7-65.30000112.8K223 A224 N231K223-C227 PolarHBondContact O-N 3.25Å; K223-C227 PolarHBondContact O-SG 2.86Å; K223-C227 VanDerWaalsContact O-SG 3.35Å; A224-C227 PolarHBondContact O-N 3.15Å; C227-N231 WeakPolarHBondContact O-CB 3.28Å; C227-N231 PolarHBondContact O-N 2.96Å
228A98.6Very high98.4Very high49 Ų49100.3 Ų100.341%0.40553%0.527SS..Hα-helixtrans-64.2-45174.600000111.3A224 K225 A226 N231 E232A224-A228 WeakPolarHBondContact O-CB 3.47Å; A224-A228 PolarHBondContact O-N 3.28Å; K225-A228 WeakPolarHBondContact O-CB 3.36Å; K225-A228 PolarHBondContact O-N 2.74Å; A226-A228 VanDerWaalsContact C-N 3.28Å; A226-A228 PolarHBondContact O-N 3.28Å; A228-N231 WeakPolarHBondContact O-CB 3.4Å; A228-N231 PolarHBondContact O-N 3.02Å; A228-E232 WeakPolarHBondContact O-CG 3.29Å; A228-E232 PolarHBondContact O-N 2.86Å
229V98.5Very high98.4Very high74 Ų7497.5 Ų97.545%0.44852%0.515SS..Hα-helixtrans-63.1-46.7175.9174.70000111.3K225 A226 N231 E232 E233K225-V229 WeakPolarHBondContact O-CG2 3.5Å; K225-V229 PolarHBondContact O-N 2.96Å; A226-V229 PolarHBondContact O-N 3.27Å; V229-N231 PolarHBondContact O-N 3.46Å; V229-E232 WeakPolarHBondContact O-CB 3.33Å; V229-E232 PolarHBondContact O-N 3.05Å; V229-E232 VanDerWaalsContact O-N 3.09Å; V229-E233 WeakPolarHBondContact O-CG 3.44Å; V229-E233 PolarHBondContact O-N 2.89Å
230E98.3Very high98.4Very high111 Ų11196.3 Ų96.352%0.51952%0.517SS..Hα-helixtrans-58.4-37.8175.9-71.8173.2-175.800111.9A226 E233 L234A226-E230 WeakPolarHBondContact O-CG 3.48Å; A226-E230 PolarHBondContact O-N 3.11Å; E230-E233 PolarHBondContact O-N 3.37Å; E230-L234 VanDerWaalsContact O-CG 3.3Å; E230-L234 WeakPolarHBondContact O-CG 3.36Å; E230-L234 PolarHBondContact O-N 3.29Å
231N98Very high98.4Very high98 Ų9894.6 Ų94.652%0.52452%0.516SS..Hα-helixtrans-67.5-40.7175.8-166.19.5000111.8C227 A228 V229 E233 L234 V235C227-N231 WeakPolarHBondContact O-CB 3.28Å; C227-N231 PolarHBondContact O-N 2.96Å; A228-N231 WeakPolarHBondContact O-CB 3.4Å; A228-N231 PolarHBondContact O-N 3.02Å; V229-N231 PolarHBondContact O-N 3.46Å; N231-E233 VanDerWaalsContact C-N 3.33Å; N231-E233 PolarHBondContact O-N 2.82Å; N231-L234 PolarHBondContact O-N 3.48Å; N231-V235 WeakPolarHBondContact O-CB 3.43Å; N231-V235 VanDerWaalsContact O-CG2 3.26Å; N231-V235 WeakPolarHBondContact O-CG2 3.43Å; N231-V235 PolarHBondContact O-N 3.24Å
232E98.3Very high98.4Very high121 Ų12193.9 Ų93.957%0.56551%0.512SS*.Hα-helixtrans-60.2-42.8173.2-71.8174.8-171.100111.7A228 V229 V235 Q236A228-E232 WeakPolarHBondContact O-CG 3.29Å; A228-E232 PolarHBondContact O-N 2.86Å; V229-E232 WeakPolarHBondContact O-CB 3.33Å; V229-E232 PolarHBondContact O-N 3.05Å; V229-E232 VanDerWaalsContact O-N 3.09Å; E232-V235 PolarHBondContact O-N 3.43Å; E232-Q236 VanDerWaalsContact O-CG 3.29Å; E232-Q236 WeakPolarHBondContact O-CG 3.43Å; E232-Q236 PolarHBondContact O-N 3.24Å
233E98.4Very high98.4Very high98 Ų9890.9 Ų90.946%0.45850%0.503SS..Hα-helixtrans-61.8-45.3175-69.2175.4177.400111.8V229 E230 N231 V235 Q236 H237V229-E233 WeakPolarHBondContact O-CG 3.44Å; V229-E233 PolarHBondContact O-N 2.89Å; E230-E233 PolarHBondContact O-N 3.37Å; N231-E233 VanDerWaalsContact C-N 3.33Å; N231-E233 PolarHBondContact O-N 2.82Å; E233-V235 VanDerWaalsContact C-N 3.33Å; E233-V235 PolarHBondContact O-N 2.9Å; E233-Q236 WeakPolarHBondContact O-CB 3.46Å; E233-Q236 PolarHBondContact O-N 3.49Å; E233-H237 PolarHBondContact O-CD2 3.31Å; E233-H237 PolarHBondContact O-N 2.87Å
234L98.4Very high98.4Very high115 Ų11586.6 Ų86.660%0.60249%0.493SS*.Hα-helixtrans-63.6-38.7176.1-71.6174.6000112.3E230 N231 Q236 H237 L238E230-L234 VanDerWaalsContact O-CG 3.3Å; E230-L234 WeakPolarHBondContact O-CG 3.36Å; E230-L234 PolarHBondContact O-N 3.29Å; N231-L234 PolarHBondContact O-N 3.48Å; L234-Q236 VanDerWaalsContact C-N 3.34Å; L234-H237 PolarHBondContact O-N 3.37Å; L234-L238 WeakPolarHBondContact O-CB 3.33Å; L234-L238 PolarHBondContact O-N 3.5Å
235V98.6Very high98.4Very high87 Ų8789.9 Ų89.953%0.52750%0.498SS..Hα-helixtrans-63.7-41174.1168.50000110.7N231 E232 E233 L238 G239N231-V235 WeakPolarHBondContact O-CB 3.43Å; N231-V235 VanDerWaalsContact O-CG2 3.26Å; N231-V235 WeakPolarHBondContact O-CG2 3.43Å; N231-V235 PolarHBondContact O-N 3.24Å; E232-V235 PolarHBondContact O-N 3.43Å; E233-V235 VanDerWaalsContact C-N 3.33Å; E233-V235 PolarHBondContact O-N 2.9Å; V235-L238 PolarHBondContact O-N 2.93Å; V235-G239 PolarHBondContact O-N 3.39Å
236Q98.5Very high98.4Very high134 Ų13489.9 Ų89.963%0.62649%0.494SS*.Hα-helixtrans-62.3-46.2174.1-70.9172.523.800111.6E232 E233 L234 L238 G239 A240E232-Q236 VanDerWaalsContact O-CG 3.29Å; E232-Q236 WeakPolarHBondContact O-CG 3.43Å; E232-Q236 PolarHBondContact O-N 3.24Å; E233-Q236 WeakPolarHBondContact O-CB 3.46Å; E233-Q236 PolarHBondContact O-N 3.49Å; L234-Q236 VanDerWaalsContact C-N 3.34Å; Q236-L238 PolarHBondContact O-N 3.41Å; Q236-G239 PolarHBondContact O-N 2.99Å; Q236-G239 VanDerWaalsContact O-N 3.16Å; Q236-A240 PolarHBondContact O-N 3.08Å
237H98.4Very high98.4Very high131 Ų13193.3 Ų93.361%0.60650%0.502SS*.Hα-helixtrans-60.4-42.6175.7-71.4-47.6000112.5E233 L234 G239 A240 A241E233-H237 PolarHBondContact O-CD2 3.31Å; E233-H237 PolarHBondContact O-N 2.87Å; L234-H237 PolarHBondContact O-N 3.37Å; H237-G239 VanDerWaalsContact C-N 3.33Å; H237-G239 PolarHBondContact O-N 2.97Å; H237-A240 PolarHBondContact O-N 2.7Å; H237-A241 WeakPolarHBondContact O-CB 3.4Å; H237-A241 PolarHBondContact O-N 3.46Å
238L98.4Very high98.4Very high95 Ų9594.8 Ų94.850%0.49750%0.504SS..Hα-helixtrans-62-41.9174.4-174.486.7000111.4L234 V235 Q236 A241 K242L234-L238 WeakPolarHBondContact O-CB 3.33Å; L234-L238 PolarHBondContact O-N 3.5Å; V235-L238 PolarHBondContact O-N 2.93Å; Q236-L238 PolarHBondContact O-N 3.41Å; L238-A241 PolarHBondContact O-N 2.98Å; L238-K242 HydrophobicContact CG-CD 4.47Å; L238-K242 WeakPolarHBondContact O-CG 3.46Å; L238-K242 PolarHBondContact O-N 3.35Å
239G98.3Very high98.4Very high27 Ų2795.4 Ų95.428%0.27850%0.503SS..Hα-helixtrans-57.5-54.1175.200000111.5V235 Q236 H237 A241 K242 D243V235-G239 PolarHBondContact O-N 3.39Å; Q236-G239 PolarHBondContact O-N 2.99Å; Q236-G239 VanDerWaalsContact O-N 3.16Å; H237-G239 VanDerWaalsContact C-N 3.33Å; H237-G239 PolarHBondContact O-N 2.97Å; G239-A241 VanDerWaalsContact C-N 3.31Å; G239-A241 PolarHBondContact O-N 2.98Å; G239-K242 WeakPolarHBondContact O-CB 3.47Å; G239-K242 PolarHBondContact O-N 2.84Å; G239-K242 VanDerWaalsContact O-N 3.11Å; G239-D243 PolarHBondContact O-N 3.48Å
240A98.4Very high98.4Very high60 Ų6093.5 Ų93.550%0.49649%0.494SS..Hα-helixtrans-58.4-41.2177.400000112.5Q236 H237 D243 A244Q236-A240 PolarHBondContact O-N 3.08Å; H237-A240 PolarHBondContact O-N 2.7Å; A240-D243 PolarHBondContact O-N 2.86Å; A240-A244 PolarHBondContact O-N 3.09Å
241A98.2Very high98.3Very high59 Ų5992.2 Ų92.249%0.48849%0.488SS..Hα-helixtrans-64.4-40176.300000112.4H237 L238 G239 A244 Q245H237-A241 WeakPolarHBondContact O-CB 3.4Å; H237-A241 PolarHBondContact O-N 3.46Å; L238-A241 PolarHBondContact O-N 2.98Å; G239-A241 VanDerWaalsContact C-N 3.31Å; G239-A241 PolarHBondContact O-N 2.98Å; A241-A244 PolarHBondContact O-N 3.28Å; A241-Q245 WeakPolarHBondContact O-CB 3.42Å; A241-Q245 PolarHBondContact O-N 2.99Å
242K98.6Very high98.4Very high94 Ų9492.5 Ų92.541%0.40949%0.49SS..Hα-helixtrans-65.5-38.8174.4-75.4175.5178.3175.40111.8L238 G239 Q245 R246L238-K242 HydrophobicContact CG-CD 4.47Å; L238-K242 WeakPolarHBondContact O-CG 3.46Å; L238-K242 PolarHBondContact O-N 3.35Å; G239-K242 WeakPolarHBondContact O-CB 3.47Å; G239-K242 PolarHBondContact O-N 2.84Å; G239-K242 VanDerWaalsContact O-N 3.11Å; K242-Q245 PolarHBondContact O-N 2.94Å; K242-R246 VanDerWaalsContact O-CG 3.28Å; K242-R246 WeakPolarHBondContact O-CG 3.42Å; K242-R246 PolarHBondContact O-N 3.45Å
243D98.6Very high98.3Very high90 Ų9092.7 Ų92.748%0.48149%0.485SS..Hα-helixtrans-65.9-44.7176.1-70.5-30.7000111.7G239 A240 Q245 R246 Q247G239-D243 PolarHBondContact O-N 3.48Å; A240-D243 PolarHBondContact O-N 2.86Å; D243-Q245 VanDerWaalsContact C-N 3.31Å; D243-Q245 PolarHBondContact O-N 3.29Å; D243-R246 WeakPolarHBondContact O-CB 3.29Å; D243-R246 PolarHBondContact O-N 2.94Å; D243-R246 VanDerWaalsContact O-N 3.14Å; D243-R246 IonicContact OD1-CZ 2.66Å; D243-R246 IonicContact OD1-NH1 3.57Å; D243-R246 PolarHBondContact OD1-NH1 3.04Å; D243-Q247 PolarHBondContact O-N 2.94Å
244A98.3Very high98.3Very high46 Ų4693 Ų9338%0.3849%0.487SS..Hα-helixtrans-58.7-42.7172.800000111.7A240 A241 R246 Q247 L248A240-A244 PolarHBondContact O-N 3.09Å; A241-A244 PolarHBondContact O-N 3.28Å; A244-R246 PolarHBondContact O-N 3.2Å; A244-Q247 PolarHBondContact O-N 3.36Å; A244-L248 WeakPolarHBondContact O-CG 3.46Å; A244-L248 PolarHBondContact O-N 3.42Å
245Q98.4Very high98.3Very high129 Ų12992.6 Ų92.660%0.60348%0.484SS*.Hα-helixtrans-61.1-44.3174.5-176.9-176.2-1.300111.8A241 K242 D243 Q247 L248 T249A241-Q245 WeakPolarHBondContact O-CB 3.42Å; A241-Q245 PolarHBondContact O-N 2.99Å; K242-Q245 PolarHBondContact O-N 2.94Å; D243-Q245 VanDerWaalsContact C-N 3.31Å; D243-Q245 PolarHBondContact O-N 3.29Å; Q245-Q247 VanDerWaalsContact C-N 3.32Å; Q245-Q247 PolarHBondContact O-N 3.22Å; Q245-L248 PolarHBondContact O-N 3.35Å; Q245-T249 WeakPolarHBondContact O-CB 3.45Å; Q245-T249 PolarHBondContact O-N 2.99Å; Q245-T249 PolarHBondContact O-OG1 3.27Å
246R98.3Very high98.3Very high147 Ų14794.6 Ų94.656%0.55549%0.488SS*.Hα-helixtrans-61.9-41.4177.1-72.8171-168.7124.1-0.9111.4K242 D243 A244 T249 A250K242-R246 VanDerWaalsContact O-CG 3.28Å; K242-R246 WeakPolarHBondContact O-CG 3.42Å; K242-R246 PolarHBondContact O-N 3.45Å; D243-R246 WeakPolarHBondContact O-CB 3.29Å; D243-R246 PolarHBondContact O-N 2.94Å; D243-R246 VanDerWaalsContact O-N 3.14Å; D243-R246 IonicContact OD1-CZ 2.66Å; D243-R246 IonicContact OD1-NH1 3.57Å; D243-R246 PolarHBondContact OD1-NH1 3.04Å; A244-R246 PolarHBondContact O-N 3.2Å; R246-T249 PolarHBondContact O-N 3.38Å; R246-A250 PolarHBondContact O-N 3.4Å
247Q98.5Very high98.2Very high121 Ų12192.5 Ų92.557%0.56548%0.481SS*.Hα-helixtrans-62.6-50.8176.9-176.1177.2-8.200111.4D243 A244 Q245 T249 A250 E251D243-Q247 PolarHBondContact O-N 2.94Å; A244-Q247 PolarHBondContact O-N 3.36Å; Q245-Q247 VanDerWaalsContact C-N 3.32Å; Q245-Q247 PolarHBondContact O-N 3.22Å; Q247-T249 PolarHBondContact O-N 2.92Å; Q247-A250 WeakPolarHBondContact O-CA 3.44Å; Q247-A250 WeakPolarHBondContact O-CB 3.37Å; Q247-A250 PolarHBondContact O-N 3.18Å; Q247-E251 PolarHBondContact NE2-OE1 3.19Å; Q247-E251 PolarHBondContact O-N 2.93Å
248L98.2Very high98.2Very high105 Ų10591.3 Ų91.355%0.5547%0.474SS..Hα-helixtrans-59.4-37.6175.8-70172.4000112A244 Q245 A250 E251 L252A244-L248 WeakPolarHBondContact O-CG 3.46Å; A244-L248 PolarHBondContact O-N 3.42Å; Q245-L248 PolarHBondContact O-N 3.35Å; L248-A250 VanDerWaalsContact C-N 3.3Å; L248-A250 PolarHBondContact O-N 3.08Å; L248-E251 PolarHBondContact O-N 3.36Å; L248-L252 WeakPolarHBondContact O-CG 3.35Å; L248-L252 PolarHBondContact O-N 3.39Å
249T98.1Very high98.2Very high62 Ų6294.3 Ų94.338%0.3848%0.48SS..Hα-helixtrans-67-32.5175.4-53.40000111.9Q245 R246 Q247 R253Q245-T249 WeakPolarHBondContact O-CB 3.45Å; Q245-T249 PolarHBondContact O-N 2.99Å; Q245-T249 PolarHBondContact O-OG1 3.27Å; R246-T249 PolarHBondContact O-N 3.38Å; Q247-T249 PolarHBondContact O-N 2.92Å; T249-R253 PolarHBondContact O-N 3.09Å
250A98.3Very high98.2Very high33 Ų3395.1 Ų95.127%0.27348%0.484SS..Hα-helixtrans-69.9-46.9173.200000111.6R246 Q247 L248 L252 R253 E254R246-A250 PolarHBondContact O-N 3.4Å; Q247-A250 WeakPolarHBondContact O-CA 3.44Å; Q247-A250 WeakPolarHBondContact O-CB 3.37Å; Q247-A250 PolarHBondContact O-N 3.18Å; L248-A250 VanDerWaalsContact C-N 3.3Å; L248-A250 PolarHBondContact O-N 3.08Å; A250-L252 VanDerWaalsContact C-N 3.31Å; A250-L252 PolarHBondContact O-N 2.85Å; A250-R253 WeakPolarHBondContact O-CB 3.42Å; A250-R253 PolarHBondContact O-N 3.04Å; A250-R253 VanDerWaalsContact O-N 3.09Å; A250-E254 WeakPolarHBondContact O-CG 3.5Å; A250-E254 PolarHBondContact O-N 3.11Å
251E98.1Very high98.1Very high84 Ų8497.7 Ų97.739%0.39349%0.486SS..Hα-helixtrans-59.7-39.4176.7-69.6174.9-16700112.2Q247 L248 E254 L255Q247-E251 PolarHBondContact NE2-OE1 3.19Å; Q247-E251 PolarHBondContact O-N 2.93Å; L248-E251 PolarHBondContact O-N 3.36Å; E251-E254 PolarHBondContact O-N 2.91Å; E251-L255 WeakPolarHBondContact O-CG 3.38Å; E251-L255 PolarHBondContact O-N 3.45Å
252L98.3Very high98.1Very high105 Ų10598.3 Ų98.355%0.5549%0.486SS..Hα-helixtrans-60.8-44.3173.4-77.5174.3000112.2L248 A250 L255 E256L248-L252 WeakPolarHBondContact O-CG 3.35Å; L248-L252 PolarHBondContact O-N 3.39Å; A250-L252 VanDerWaalsContact C-N 3.31Å; A250-L252 PolarHBondContact O-N 2.85Å; L252-L255 PolarHBondContact O-N 3.35Å; L252-E256 WeakPolarHBondContact O-CG 3.23Å; L252-E256 PolarHBondContact O-N 3.39Å
253R97.8Very high98.1Very high124 Ų12496.9 Ų96.947%0.46848%0.482SS..Hα-helixtrans-64.2-42.8177.1-171.9-175.8-56.891.28.8111.7T249 A250 L255 E256 D257T249-R253 PolarHBondContact O-N 3.09Å; A250-R253 WeakPolarHBondContact O-CB 3.42Å; A250-R253 PolarHBondContact O-N 3.04Å; A250-R253 VanDerWaalsContact O-N 3.09Å; R253-L255 VanDerWaalsContact C-N 3.25Å; R253-L255 PolarHBondContact O-N 3.07Å; R253-E256 WeakPolarHBondContact O-CB 3.46Å; R253-E256 PolarHBondContact O-N 2.87Å; R253-E256 VanDerWaalsContact O-N 3.14Å; R253-D257 VanDerWaalsContact O-CG 3.29Å; R253-D257 PolarHBondContact O-N 2.81Å
254E98Very high98Very high105 Ų10598.4 Ų98.449%0.49149%0.486SS..Hα-helixtrans-61.4-35.1175.5-70.2178-165.300112.3A250 E251 K258A250-E254 WeakPolarHBondContact O-CG 3.5Å; A250-E254 PolarHBondContact O-N 3.11Å; E251-E254 PolarHBondContact O-N 2.91Å; E254-K258 WeakPolarHBondContact O-CB 3.48Å; E254-K258 WeakPolarHBondContact O-CD 3.4Å; E254-K258 VanDerWaalsContact O-CG 3.24Å; E254-K258 WeakPolarHBondContact O-CG 3.24Å; E254-K258 PolarHBondContact O-N 3.45Å
255L97.9Very high98Very high106 Ų106101.8 Ų101.856%0.55550%0.495SS*.Hα-helixtrans-71.1-38.3173.6-74.3170.8000112.3E251 L252 R253 K258 Y259E251-L255 WeakPolarHBondContact O-CG 3.38Å; E251-L255 PolarHBondContact O-N 3.45Å; L252-L255 PolarHBondContact O-N 3.35Å; R253-L255 VanDerWaalsContact C-N 3.25Å; R253-L255 PolarHBondContact O-N 3.07Å; L255-K258 PolarHBondContact O-N 2.88Å; L255-Y259 WeakPolarHBondContact O-CB 3.5Å; L255-Y259 PolarHBondContact O-N 3.36Å
256E98Very high98Very high129 Ų12999.4 Ų99.460%0.60349%0.486SS*.Hα-helixtrans-61.4-45.3172.7-73.5173.4166.700111.1L252 R253 Y259 A260L252-E256 WeakPolarHBondContact O-CG 3.23Å; L252-E256 PolarHBondContact O-N 3.39Å; R253-E256 WeakPolarHBondContact O-CB 3.46Å; R253-E256 PolarHBondContact O-N 2.87Å; R253-E256 VanDerWaalsContact O-N 3.14Å; E256-Y259 WeakPolarHBondContact O-CB 3.37Å; E256-Y259 PolarHBondContact O-N 3.19Å; E256-A260 PolarHBondContact O-N 3.39Å
257D98Very high97.9Very high90 Ų9097.2 Ų97.248%0.48148%0.482SS..Hα-helixtrans-61.6-46.8176.8-68-22.8000110.9R253 Y259 A260 E261R253-D257 VanDerWaalsContact O-CG 3.29Å; R253-D257 PolarHBondContact O-N 2.81Å; D257-Y259 VanDerWaalsContact C-N 3.29Å; D257-Y259 PolarHBondContact O-N 2.93Å; D257-A260 WeakPolarHBondContact O-CB 3.26Å; D257-A260 PolarHBondContact O-N 3.43Å; D257-A260 VanDerWaalsContact O-N 3.14Å; D257-E261 WeakPolarHBondContact O-CG 3.49Å; D257-E261 PolarHBondContact O-N 3.16Å
258K98.1Very high97.8Very high106 Ų10697.1 Ų97.146%0.46148%0.482SS..Hα-helixtrans-61.1-36.9174.7-74.6168.1-173.4160.10112.8E254 L255 C262E254-K258 WeakPolarHBondContact O-CB 3.48Å; E254-K258 WeakPolarHBondContact O-CD 3.4Å; E254-K258 VanDerWaalsContact O-CG 3.24Å; E254-K258 WeakPolarHBondContact O-CG 3.24Å; E254-K258 PolarHBondContact O-N 3.45Å; L255-K258 PolarHBondContact O-N 2.88Å; K258-C262 PolarHBondContact O-N 3.31Å; K258-C262 PolarHBondContact O-SG 3.31Å
259Y98.1Very high97.7Very high158 Ų15894.3 Ų94.362%0.6247%0.473SS*.Hα-helixtrans-67.2-41.3175.6176.8-97.4000111.1L255 E256 D257 C262 M263L255-Y259 WeakPolarHBondContact O-CB 3.5Å; L255-Y259 PolarHBondContact O-N 3.36Å; E256-Y259 WeakPolarHBondContact O-CB 3.37Å; E256-Y259 PolarHBondContact O-N 3.19Å; D257-Y259 VanDerWaalsContact C-N 3.29Å; D257-Y259 PolarHBondContact O-N 2.93Å; Y259-C262 PolarHBondContact O-N 2.88Å; Y259-M263 HydrophobicContact CD1-CG 4.22Å; Y259-M263 HydrophobicContact CE1-CG 3.73Å; Y259-M263 HydrophobicContact CE2-CG 4.34Å; Y259-M263 WeakPolarHBondContact O-CG 3.38Å; Y259-M263 PolarHBondContact O-N 2.91Å
260A97.8Very high97.6Very high45 Ų4596.3 Ų96.337%0.37248%0.478SS..Hα-helixtrans-61-46.7174.100000111.4E256 D257 C262 M263 E264E256-A260 PolarHBondContact O-N 3.39Å; D257-A260 WeakPolarHBondContact O-CB 3.26Å; D257-A260 PolarHBondContact O-N 3.43Å; D257-A260 VanDerWaalsContact O-N 3.14Å; A260-C262 VanDerWaalsContact C-N 3.33Å; A260-C262 PolarHBondContact O-N 3.15Å; A260-M263 WeakPolarHBondContact O-CB 3.45Å; A260-M263 PolarHBondContact O-N 2.89Å; A260-M263 VanDerWaalsContact O-N 3.1Å; A260-E264 WeakPolarHBondContact O-CG 3.36Å; A260-E264 PolarHBondContact O-N 2.96Å
261E97.6Very high97.4Very high114 Ų11499 Ų9953%0.53349%0.485SS..Hα-helixtrans-56.9-43.4173.8-70.7174.2-174.100112.1D257 M263 E264 M265D257-E261 WeakPolarHBondContact O-CG 3.49Å; D257-E261 PolarHBondContact O-N 3.16Å; E261-M263 VanDerWaalsContact C-N 3.33Å; E261-M263 PolarHBondContact O-N 3.45Å; E261-E264 PolarHBondContact O-N 3.48Å; E261-M265 WeakPolarHBondContact O-CG 3.3Å; E261-M265 PolarHBondContact O-N 3.41Å
262C97.8Very high97.2Very high72 Ų72101.1 Ų101.149%0.48650%0.495SS..Hα-helixtrans-63.8-38.6176.2-700000112.5K258 Y259 A260 L266K258-C262 PolarHBondContact O-N 3.31Å; K258-C262 PolarHBondContact O-SG 3.31Å; Y259-C262 PolarHBondContact O-N 2.88Å; A260-C262 VanDerWaalsContact C-N 3.33Å; A260-C262 PolarHBondContact O-N 3.15Å; C262-L266 WeakPolarHBondContact O-CB 3.49Å; C262-L266 PolarHBondContact O-N 3Å
263M98.1Very high96.9Very high64 Ų64101.8 Ų101.832%0.31550%0.498SS..Hα-helixtrans-67.3-40.1175.4-78.1-66.1-62.500111.7Y259 A260 E261 L266 H267Y259-M263 HydrophobicContact CD1-CG 4.22Å; Y259-M263 HydrophobicContact CE1-CG 3.73Å; Y259-M263 HydrophobicContact CE2-CG 4.34Å; Y259-M263 WeakPolarHBondContact O-CG 3.38Å; Y259-M263 PolarHBondContact O-N 2.91Å; A260-M263 WeakPolarHBondContact O-CB 3.45Å; A260-M263 PolarHBondContact O-N 2.89Å; A260-M263 VanDerWaalsContact O-N 3.1Å; E261-M263 VanDerWaalsContact C-N 3.33Å; E261-M263 PolarHBondContact O-N 3.45Å; M263-L266 PolarHBondContact O-N 2.94Å; M263-H267 PolarHBondContact O-CD2 2.98Å; M263-H267 PolarHBondContact O-N 3.48Å
264E97.3Very high96.7Very high121 Ų121100.6 Ų100.657%0.56550%0.497SS*.Hα-helixtrans-61.8-51174.6-73.9-179.7176.900111.2A260 E261 L266 H267 E268A260-E264 WeakPolarHBondContact O-CG 3.36Å; A260-E264 PolarHBondContact O-N 2.96Å; E261-E264 PolarHBondContact O-N 3.48Å; E264-L266 PolarHBondContact O-N 3.26Å; E264-H267 CarbonylContact O-C 3.57Å; E264-H267 WeakPolarHBondContact O-CA 3.47Å; E264-H267 WeakPolarHBondContact O-CB 3.31Å; E264-H267 PolarHBondContact O-N 2.88Å; E264-E268 WeakPolarHBondContact O-CG 3.36Å; E264-E268 PolarHBondContact O-N 3.21Å
265M97.5Very high96.4Very high118 Ų11899.2 Ų99.258%0.58149%0.493SS*.Hα-helixtrans-58.7-36.4175.5-71.8-163-64.600112.5E261 E268 A269E261-M265 WeakPolarHBondContact O-CG 3.3Å; E261-M265 PolarHBondContact O-N 3.41Å; M265-E268 PolarHBondContact O-N 3.3Å; M265-A269 WeakPolarHBondContact O-CB 3.42Å; M265-A269 PolarHBondContact O-N 2.85Å
266L97.5Very high95.9Very high79 Ų7998.9 Ų98.941%0.41449%0.491SS..Hα-helixtrans-66.1-43.1174.7177.2146.7000111.4C262 M263 E264 A269 Q270C262-L266 WeakPolarHBondContact O-CB 3.49Å; C262-L266 PolarHBondContact O-N 3Å; M263-L266 PolarHBondContact O-N 2.94Å; E264-L266 PolarHBondContact O-N 3.26Å; L266-A269 PolarHBondContact O-N 2.88Å; L266-Q270 HydrophobicContact CD2-CG 4.31Å; L266-Q270 WeakPolarHBondContact O-CB 3.38Å; L266-Q270 VanDerWaalsContact O-CG 3.22Å; L266-Q270 WeakPolarHBondContact O-CG 3.27Å; L266-Q270 PolarHBondContact O-N 2.81Å
267H97.2Very high95.4Very high100 Ų100101.4 Ų101.446%0.46350%0.495SS..Hα-helixtrans-64.8-40.2174.9-76-46.3000112M263 E264 Q270 E271M263-H267 PolarHBondContact O-CD2 2.98Å; M263-H267 PolarHBondContact O-N 3.48Å; E264-H267 CarbonylContact O-C 3.57Å; E264-H267 WeakPolarHBondContact O-CA 3.47Å; E264-H267 WeakPolarHBondContact O-CB 3.31Å; E264-H267 PolarHBondContact O-N 2.88Å; H267-Q270 PolarHBondContact ND1-OE1 3.31Å; H267-Q270 PolarHBondContact O-N 2.83Å; H267-E271 PolarHBondContact O-N 3.5Å
268E96.1Very high94.6Very high120 Ų120102 Ų10256%0.56150%0.498SS*.Hα-helixtrans-59.6-51.6173.1-72.1177.7172.600111.2E264 M265 Q270 E271 E272E264-E268 WeakPolarHBondContact O-CG 3.36Å; E264-E268 PolarHBondContact O-N 3.21Å; M265-E268 PolarHBondContact O-N 3.3Å; E268-Q270 VanDerWaalsContact C-N 3.31Å; E268-Q270 PolarHBondContact O-N 3.43Å; E268-E271 CarbonylContact O-C 3.56Å; E268-E271 PolarHBondContact O-N 3.06Å; E268-E271 VanDerWaalsContact O-N 3.13Å; E268-E272 WeakPolarHBondContact O-CG 3.28Å; E268-E272 PolarHBondContact O-N 3.48Å
269A96.3Very high93.7Very high45 Ų45105 Ų10537%0.37251%0.511SS..Hα-helixtrans-61-38.2177.200000112.4M265 L266 E272 L273M265-A269 WeakPolarHBondContact O-CB 3.42Å; M265-A269 PolarHBondContact O-N 2.85Å; L266-A269 PolarHBondContact O-N 2.88Å; A269-E272 PolarHBondContact O-N 3.45Å; A269-L273 WeakPolarHBondContact O-CG 3.44Å; A269-L273 PolarHBondContact O-N 2.98Å
270Q95.8Very high92Very high105 Ų105102.9 Ų102.949%0.49152%0.515SS..Hα-helixtrans-63.6-43.3173.6-77.6177.3-12.200112.1L266 H267 E268 L273 K274L266-Q270 HydrophobicContact CD2-CG 4.31Å; L266-Q270 WeakPolarHBondContact O-CB 3.38Å; L266-Q270 VanDerWaalsContact O-CG 3.22Å; L266-Q270 WeakPolarHBondContact O-CG 3.27Å; L266-Q270 PolarHBondContact O-N 2.81Å; H267-Q270 PolarHBondContact ND1-OE1 3.31Å; H267-Q270 PolarHBondContact O-N 2.83Å; E268-Q270 VanDerWaalsContact C-N 3.31Å; E268-Q270 PolarHBondContact O-N 3.43Å; Q270-L273 PolarHBondContact O-N 2.61Å; Q270-K274 WeakPolarHBondContact O-CB 3.47Å; Q270-K274 PolarHBondContact O-N 3.46Å
271E94.8Very high89.8Confident90 Ų90107 Ų10742%0.42153%0.528SS..Hα-helixtrans-68.3-36.5175.4-78-63.1143.400111.7H267 E268 K274 N275H267-E271 PolarHBondContact O-N 3.5Å; E268-E271 CarbonylContact O-C 3.56Å; E268-E271 PolarHBondContact O-N 3.06Å; E268-E271 VanDerWaalsContact O-N 3.13Å; E271-K274 VanDerWaalsContact CD-NZ 3.33Å; E271-K274 PolarHBondContact O-N 3.2Å; E271-K274 IonicContact OE1-NZ 2.61Å; E271-K274 PolarHBondContact OE1-NZ 2.88Å; E271-K274 IonicContact OE2-NZ 3.8Å; E271-K274 PolarHBondContact OE2-NZ 3.14Å; E271-N275 VanDerWaalsContact O-CB 3.3Å; E271-N275 WeakPolarHBondContact O-CB 3.37Å; E271-N275 PolarHBondContact O-N 3.39Å; E271-N275 PolarHBondContact O-ND2 2.94Å
272E94.3Very high87.4Confident127 Ų127106.3 Ų106.359%0.59353%0.534SS*.Hα-helixtrans-61-46171.7-73.9-174.3166.800112.2E268 A269 K274 N275 L276E268-E272 WeakPolarHBondContact O-CG 3.28Å; E268-E272 PolarHBondContact O-N 3.48Å; A269-E272 PolarHBondContact O-N 3.45Å; E272-K274 VanDerWaalsContact C-N 3.33Å; E272-K274 PolarHBondContact O-N 2.85Å; E272-N275 CarbonylContact O-C 3.58Å; E272-N275 WeakPolarHBondContact O-CB 3.31Å; E272-N275 PolarHBondContact O-N 2.93Å; E272-L276 WeakPolarHBondContact O-CG 3.38Å; E272-L276 PolarHBondContact O-N 3.37Å
273L91.4Very high85.1Confident119 Ų119111.4 Ų111.462%0.62356%0.556SS**Hα-helixtrans-61.1-41.3175.1-75.3174.4000112A269 Q270 L276 R277A269-L273 WeakPolarHBondContact O-CG 3.44Å; A269-L273 PolarHBondContact O-N 2.98Å; Q270-L273 PolarHBondContact O-N 2.61Å; L273-L276 PolarHBondContact O-N 2.9Å; L273-R277 WeakPolarHBondContact O-CB 3.48Å; L273-R277 PolarHBondContact O-N 2.69Å
274K93.3Very high82.5Confident100 Ų100113.8 Ų113.844%0.43557%0.574SS.*Hα-helixtrans-64.6-41.2174.6-179.4176.7158.9-1470111.3Q270 E271 E272 R277 N278Q270-K274 WeakPolarHBondContact O-CB 3.47Å; Q270-K274 PolarHBondContact O-N 3.46Å; E271-K274 VanDerWaalsContact CD-NZ 3.33Å; E271-K274 PolarHBondContact O-N 3.2Å; E271-K274 IonicContact OE1-NZ 2.61Å; E271-K274 PolarHBondContact OE1-NZ 2.88Å; E271-K274 IonicContact OE2-NZ 3.8Å; E271-K274 PolarHBondContact OE2-NZ 3.14Å; E272-K274 VanDerWaalsContact C-N 3.33Å; E272-K274 PolarHBondContact O-N 2.85Å; K274-R277 PolarHBondContact O-N 2.92Å; K274-N278 WeakPolarHBondContact O-CB 3.42Å; K274-N278 PolarHBondContact O-N 3.5Å; K274-N278 PolarHBondContact O-ND2 2.88Å; K274-N278 PolarHBondContact O-OD1 3.28Å
275N91.2Very high80Confident75 Ų75114.1 Ų114.140%0.40159%0.585SS.*Hα-helixtrans-65.4-40.6175.1-73.6-33.8000112.2E271 E272 N278 K279E271-N275 VanDerWaalsContact O-CB 3.3Å; E271-N275 WeakPolarHBondContact O-CB 3.37Å; E271-N275 PolarHBondContact O-N 3.39Å; E271-N275 PolarHBondContact O-ND2 2.94Å; E272-N275 CarbonylContact O-C 3.58Å; E272-N275 WeakPolarHBondContact O-CB 3.31Å; E272-N275 PolarHBondContact O-N 2.93Å; N275-N278 PolarHBondContact O-N 3.48Å; N275-K279 WeakPolarHBondContact O-CB 3.05Å; N275-K279 VanDerWaalsContact O-CG 3.29Å; N275-K279 WeakPolarHBondContact O-CG 3.38Å; N275-K279 PolarHBondContact O-N 3.3Å
276L88.3Confident77.7Confident100 Ų100114.3 Ų114.352%0.52460%0.598SS.*Hα-helixtrans-63.5-45.2172.4-74.5173.2000111.1E272 L273 N278 K279 T280E272-L276 WeakPolarHBondContact O-CG 3.38Å; E272-L276 PolarHBondContact O-N 3.37Å; L273-L276 PolarHBondContact O-N 2.9Å; L276-N278 VanDerWaalsContact C-N 3.28Å; L276-N278 PolarHBondContact O-N 3.11Å; L276-K279 PolarHBondContact O-N 2.95Å; L276-K279 VanDerWaalsContact O-N 3.14Å; L276-T280 WeakPolarHBondContact O-CB 3.38Å; L276-T280 PolarHBondContact O-N 3.35Å; L276-T280 PolarHBondContact O-OG1 3.4Å
277R86.9Confident75.5Confident182 Ų182118.2 Ų118.269%0.68761%0.607SS**Hα-helixtrans-58.7-40.9174.1178.1178.8167.5-179.7-3.2111.8L273 K274 M281L273-R277 WeakPolarHBondContact O-CB 3.48Å; L273-R277 PolarHBondContact O-N 2.69Å; K274-R277 PolarHBondContact O-N 2.92Å; R277-M281 WeakPolarHBondContact O-CG 3.39Å; R277-M281 PolarHBondContact O-N 2.71Å
278N81.6Confident73.5Confident102 Ų102124.3 Ų124.355%0.54563%0.626SS.*Hα-helixtrans-69.4-31.1176.9-68.1-18.5000112.6K274 N275 L276K274-N278 WeakPolarHBondContact O-CB 3.42Å; K274-N278 PolarHBondContact O-N 3.5Å; K274-N278 PolarHBondContact O-ND2 2.88Å; K274-N278 PolarHBondContact O-OD1 3.28Å; N275-N278 PolarHBondContact O-N 3.48Å; L276-N278 VanDerWaalsContact C-N 3.28Å; L276-N278 PolarHBondContact O-N 3.11Å
279K78.6Confident71.4Confident169 Ų169125.4 Ų125.474%0.73563%0.626SS**Hα-helixtrans-81.9-33.8177.3-74.7172.3-179.3175.20113.5N275 L276 M281N275-K279 WeakPolarHBondContact O-CB 3.05Å; N275-K279 VanDerWaalsContact O-CG 3.29Å; N275-K279 WeakPolarHBondContact O-CG 3.38Å; N275-K279 PolarHBondContact O-N 3.3Å; L276-K279 PolarHBondContact O-N 2.95Å; L276-K279 VanDerWaalsContact O-N 3.14Å; K279-M281 VanDerWaalsContact C-N 3.31Å
280T63.8Low69Low113 Ų113128.3 Ų128.369%0.69363%0.631SS**Hα-helixtrans-81.3-12-178.5-49.90000112.5L276L276-T280 WeakPolarHBondContact O-CB 3.38Å; L276-T280 PolarHBondContact O-N 3.35Å; L276-T280 PolarHBondContact O-OG1 3.4Å
281M50.3Low67.1Low131 Ų131128.7 Ų128.765%0.64565%0.646SS**SBendtrans-100.5114.8172.5-69.5-68.5179.700109.8R277 K279R277-M281 WeakPolarHBondContact O-CG 3.39Å; R277-M281 PolarHBondContact O-N 2.71Å; K279-M281 VanDerWaalsContact C-N 3.31Å
282P46.6Very low65.4Low101 Ų101131.5 Ų131.566%0.65666%0.663SS**  trans-68.1138.7168.529-29.3000108.4T284P282-T284 PolarHBondContact O-N 2.9Å
283N50.7Low63.7Low179 Ų179126.4 Ų126.496%0.95765%0.645SS**  trans-42.7100.4170.2-92.5-15000111.4
284T43.3Very low62.2Low114 Ų114128.3 Ų128.370%0.69966%0.655SS**  trans-13393.4164.464.50000109.5P282P282-T284 PolarHBondContact O-N 2.9Å
285T43.8Very low60.5Low128 Ų128128.3 Ų128.379%0.78566%0.655SS**  trans43.6103.8142.548.40000118.4R287T285-R287 PolarHBondContact O-N 2.97Å
286S50.8Low59.3Low122 Ų122126.4 Ų126.485%0.85365%0.646SS**  trans18.986.6139.6-173.90000116.9
287R50.3Low57.9Low161 Ų161127.4 Ų127.461%0.60865%0.65SS**PPolyproline II helixtrans-92.6127.6157.6-76.7-170.6-174.3-103.83.2109.2T285 Y289T285-R287 PolarHBondContact O-N 2.97Å; R287-Y289 HydrophobicContact CB-CE2 4.41Å; R287-Y289 WeakPolarHBondContact O-CD2 3.25Å; R287-Y289 WeakPolarHBondContact O-CE2 3.42Å; R287-Y289 PolarHBondContact O-N 3.19Å
288R55.6Low56.8Low227 Ų227125.6 Ų125.686%0.85765%0.654SS**PPolyproline II helixtrans-71.9116.4172.7-79.9-164.6-84.9-176.1-5.5109.2
289Y51.3Low56.2Low144 Ų144123 Ų12357%0.56564%0.644SS**BIsolated β-bridgetrans-89.2154.7171.9-68.9-89.9000110.6R287 P296R287-Y289 HydrophobicContact CB-CE2 4.41Å; R287-Y289 WeakPolarHBondContact O-CD2 3.25Å; R287-Y289 WeakPolarHBondContact O-CE2 3.42Å; R287-Y289 PolarHBondContact O-N 3.19Å; Y289-P296 HydrophobicContact CE1-CG 4.09Å
290H46.2Very low55.6Low105 Ų105120.8 Ų120.849%0.48664%0.64SS.*PPolyproline II helixtrans-73.6141171.8-172.4-88.7000109.9L292 G293 M297H290-L292 PolarHBondContact ND1-N 3.08Å; H290-L292 PolarHBondContact O-N 3.08Å; H290-G293 PolarHBondContact O-N 3.41Å; H290-M297 HydrophobicContact CB-SD 4.22Å
291S55.2Low55.9Low114 Ų114117.1 Ų117.180%0.79762%0.621SS**THydrogen-bonded Turntrans-64-5.2-174.138.70000115.4
292L60Low56.9Low148 Ų148112.1 Ų112.178%0.77560%0.6SS**THydrogen-bonded Turntrans-136.520.4177.4-99.598.9000114.1H290H290-L292 PolarHBondContact ND1-N 3.08Å; H290-L292 PolarHBondContact O-N 3.08Å
293G58.3Low58.1Low21 Ų21113.7 Ų113.722%0.21660%0.599CS.*  trans-151.3137.9-17800000115.2H290 F295H290-G293 PolarHBondContact O-N 3.41Å; G293-F295 PolarHBondContact O-N 3.39Å
294L59.9Low59Low158 Ų158109.4 Ų109.483%0.82758%0.575SS**SBendtrans-75.74.9-177.3-86.1131.3000114.9
295F59Low60.1Low101 Ų101107.3 Ų107.344%0.44356%0.557SS.*SBendtrans-114.5139.8-174.7-59.6-73.1000112.3G293 A301G293-F295 PolarHBondContact O-N 3.39Å; F295-A301 HydrophobicContact CD1-CB 4.13Å; F295-A301 HydrophobicContact CE1-CB 4.45Å; F295-A301 HydrophobicContact CG-CB 4.21Å
296P65.3Low61.2Low34 Ų34103 Ų10322%0.22154%0.539CS..BIsolated β-bridgetrans-61.8143.4173.2-21.433000112.1Y289 D298 S299Y289-P296 HydrophobicContact CE1-CG 4.09Å; P296-D298 PolarHBondContact O-N 3.07Å; P296-S299 WeakPolarHBondContact O-CB 3.5Å; P296-S299 PolarHBondContact O-N 3.12Å
297M58.5Low61.9Low121 Ų121101.1 Ų101.160%0.59652%0.522SS*.THydrogen-bonded Turntrans-55.2-22.9-174.8-76.8-67-66.900115.5H290H290-M297 HydrophobicContact CB-SD 4.22Å
298D63.6Low62.4Low145 Ų14598.6 Ų98.678%0.77552%0.518SS*.THydrogen-bonded Turntrans-99.511-176.6-47.8-31.8000112.8P296P296-D298 PolarHBondContact O-N 3.07Å
299S70.3Confident62.7Low48 Ų4893.3 Ų93.334%0.33650%0.498SS..SBendtrans-91.6136-179.2-165.30000111.4P296 A301 A302 E303P296-S299 WeakPolarHBondContact O-CB 3.5Å; P296-S299 PolarHBondContact O-N 3.12Å; S299-A301 PolarHBondContact O-N 3.41Å; S299-A302 WeakPolarHBondContact O-CA 3.36Å; S299-A302 WeakPolarHBondContact O-CB 3.41Å; S299-A302 PolarHBondContact O-N 3.4Å; S299-E303 PolarHBondContact O-N 3.36Å
300L65.4Low63.1Low122 Ų12294.2 Ų94.264%0.63951%0.505SS*.Hα-helixtrans-49.4-29.6171.9-168.676.1000112.4E303 I304L300-E303 PolarHBondContact O-N 2.87Å; L300-I304 HydrophobicContact CD2-CD1 4.29Å; L300-I304 HydrophobicContact CG-CD1 4Å; L300-I304 VanDerWaalsContact O-CG1 3.23Å; L300-I304 WeakPolarHBondContact O-CG1 3.44Å; L300-I304 PolarHBondContact O-N 2.91Å
301A70.3Confident63.6Low36 Ų3696.1 Ų96.130%0.29851%0.514SS..Hα-helixtrans-65.7-35.2174.600000113.5F295 S299 E305F295-A301 HydrophobicContact CD1-CB 4.13Å; F295-A301 HydrophobicContact CE1-CB 4.45Å; F295-A301 HydrophobicContact CG-CB 4.21Å; S299-A301 PolarHBondContact O-N 3.41Å; A301-E305 VanDerWaalsContact O-CB 3.29Å; A301-E305 WeakPolarHBondContact O-CB 3.35Å; A301-E305 PolarHBondContact O-N 3.48Å
302A71.5Confident63.6Low26 Ų2696.2 Ų96.222%0.21551%0.506CS..Hα-helixtrans-73.1-31.5174.900000111.8S299 G306S299-A302 WeakPolarHBondContact O-CA 3.36Å; S299-A302 WeakPolarHBondContact O-CB 3.41Å; S299-A302 PolarHBondContact O-N 3.4Å; A302-G306 PolarHBondContact O-N 3.09Å
303E71.2Confident63.2Low133 Ų13396.6 Ų96.662%0.62150%0.503SS*.Hα-helixtrans-70.5-46172.5-168177.3-177.600111.3S299 L300 G306 T307S299-E303 PolarHBondContact O-N 3.36Å; L300-E303 PolarHBondContact O-N 2.87Å; E303-G306 PolarHBondContact O-N 3.37Å; E303-T307 WeakPolarHBondContact O-CB 3.45Å; E303-T307 PolarHBondContact O-N 2.94Å; E303-T307 PolarHBondContact O-OG1 2.98Å
304I69.1Low62.9Low90 Ų90103.4 Ų103.446%0.46253%0.534SS..Hα-helixtrans-62-46.5175.9-67.3164.6000110.9L300 G306 T307 M308L300-I304 HydrophobicContact CD2-CD1 4.29Å; L300-I304 HydrophobicContact CG-CD1 4Å; L300-I304 VanDerWaalsContact O-CG1 3.23Å; L300-I304 WeakPolarHBondContact O-CG1 3.44Å; L300-I304 PolarHBondContact O-N 2.91Å; I304-G306 VanDerWaalsContact C-N 3.35Å; I304-G306 PolarHBondContact O-N 2.9Å; I304-T307 PolarHBondContact O-N 3.33Å; I304-M308 HydrophobicContact CG2-CG 4.45Å; I304-M308 HydrophobicContact CG2-SD 4.17Å; I304-M308 WeakPolarHBondContact O-CG 3.28Å; I304-M308 PolarHBondContact O-N 3.49Å
305E67Low62.4Low69 Ų69104 Ų10432%0.32253%0.532SS..Hα-helixtrans-65.5-38.7177.2-160.7-158.1-151.900111.8A301 T307 M308 R309A301-E305 VanDerWaalsContact O-CB 3.29Å; A301-E305 WeakPolarHBondContact O-CB 3.35Å; A301-E305 PolarHBondContact O-N 3.48Å; E305-T307 VanDerWaalsContact C-N 3.27Å; E305-T307 PolarHBondContact O-N 2.92Å; E305-M308 PolarHBondContact O-N 3.32Å; E305-R309 VanDerWaalsContact O-CG 3.3Å; E305-R309 WeakPolarHBondContact O-CG 3.43Å; E305-R309 PolarHBondContact O-N 2.69Å; E305-R309 IonicContact OE1-CZ 2.9Å; E305-R309 IonicContact OE1-NE 3.39Å; E305-R309 IonicContact OE1-NH1 3.21Å; E305-R309 IonicContact OE1-NH2 3Å; E305-R309 PolarHBondContact OE1-NH2 2.92Å; E305-R309 IonicContact OE2-CZ 2.71Å; E305-R309 IonicContact OE2-NE 2.76Å; E305-R309 IonicContact OE2-NH2 3.89Å; E305-R309 PolarHBondContact OE2-NH2 3.36Å
306G65.8Low61.8Low39 Ų39107.2 Ų107.240%0.40255%0.549SS..Hα-helixtrans-62.8-32.7173.400000113.1A302 E303 I304 K310A302-G306 PolarHBondContact O-N 3.09Å; E303-G306 PolarHBondContact O-N 3.37Å; I304-G306 VanDerWaalsContact C-N 3.35Å; I304-G306 PolarHBondContact O-N 2.9Å; G306-K310 PolarHBondContact O-N 3.29Å
307T66.6Low60.8Low82 Ų82110.1 Ų110.150%0.50358%0.575SS.*Hα-helixtrans-78.8-42.1178-42.60000111.2E303 I304 E305 R309 K310 E311E303-T307 WeakPolarHBondContact O-CB 3.45Å; E303-T307 PolarHBondContact O-N 2.94Å; E303-T307 PolarHBondContact O-OG1 2.98Å; I304-T307 PolarHBondContact O-N 3.33Å; E305-T307 VanDerWaalsContact C-N 3.27Å; E305-T307 PolarHBondContact O-N 2.92Å; T307-R309 PolarHBondContact O-N 2.93Å; T307-K310 WeakPolarHBondContact O-CB 3.5Å; T307-K310 PolarHBondContact O-N 3.45Å; T307-K310 VanDerWaalsContact O-N 3.14Å; T307-E311 PolarHBondContact O-N 2.96Å
308M60.5Low60.3Low108 Ų108113.8 Ų113.853%0.53259%0.591SS.*Hα-helixtrans-63.3-37.5174.2-72.3-177.569.900113I304 E305 K310 E311 L312I304-M308 HydrophobicContact CG2-CG 4.45Å; I304-M308 HydrophobicContact CG2-SD 4.17Å; I304-M308 WeakPolarHBondContact O-CG 3.28Å; I304-M308 PolarHBondContact O-N 3.49Å; E305-M308 PolarHBondContact O-N 3.32Å; M308-K310 VanDerWaalsContact C-N 3.31Å; M308-E311 PolarHBondContact O-N 3.49Å; M308-L312 WeakPolarHBondContact O-CB 3.44Å; M308-L312 WeakPolarHBondContact O-CG 3.39Å; M308-L312 PolarHBondContact O-N 3.26Å
309R62.6Low59.9Low115 Ų115110.7 Ų110.743%0.43458%0.581SS.*Hα-helixtrans-67.3-33.3173.7-70.3-175.7-143.9-95.120.4112.2E305 T307 E311 Q313E305-R309 VanDerWaalsContact O-CG 3.3Å; E305-R309 WeakPolarHBondContact O-CG 3.43Å; E305-R309 PolarHBondContact O-N 2.69Å; E305-R309 IonicContact OE1-CZ 2.9Å; E305-R309 IonicContact OE1-NE 3.39Å; E305-R309 IonicContact OE1-NH1 3.21Å; E305-R309 IonicContact OE1-NH2 3Å; E305-R309 PolarHBondContact OE1-NH2 2.92Å; E305-R309 IonicContact OE2-CZ 2.71Å; E305-R309 IonicContact OE2-NE 2.76Å; E305-R309 IonicContact OE2-NH2 3.89Å; E305-R309 PolarHBondContact OE2-NH2 3.36Å; T307-R309 PolarHBondContact O-N 2.93Å; R309-E311 VanDerWaalsContact C-N 3.32Å; R309-Q313 WeakPolarHBondContact O-CB 3.43Å; R309-Q313 PolarHBondContact O-N 3.13Å
310K59.4Low59.2Low163 Ų163113.7 Ų113.771%0.70960%0.599SS**Hα-helixtrans-72.1-28.3176.6-142.6174.5-173.4177.80112.2G306 T307 M308G306-K310 PolarHBondContact O-N 3.29Å; T307-K310 WeakPolarHBondContact O-CB 3.5Å; T307-K310 PolarHBondContact O-N 3.45Å; T307-K310 VanDerWaalsContact O-N 3.14Å; M308-K310 VanDerWaalsContact C-N 3.31Å
311E56.1Low58.9Low145 Ų145113.3 Ų113.368%0.67860%0.598SS**Hα-helixtrans-77.5-40.2173.2-156.1169-161.100111.4T307 M308 R309 L314T307-E311 PolarHBondContact O-N 2.96Å; M308-E311 PolarHBondContact O-N 3.49Å; R309-E311 VanDerWaalsContact C-N 3.32Å; E311-L314 PolarHBondContact O-N 3Å
312L56Low58.4Low117 Ų117116.5 Ų116.561%0.61361%0.609SS**Hα-helixtrans-67.2-33.3173.8-76.7166.8000113.7M308 L314 E315M308-L312 WeakPolarHBondContact O-CB 3.44Å; M308-L312 WeakPolarHBondContact O-CG 3.39Å; M308-L312 PolarHBondContact O-N 3.26Å; L312-L314 VanDerWaalsContact C-N 3.26Å; L312-L314 PolarHBondContact O-N 3.46Å; L312-E315 PolarHBondContact O-N 3.02Å
313Q52Low58Low155 Ų155119.2 Ų119.272%0.72462%0.623SS**THydrogen-bonded Turntrans-73.2-12.2178.1-89.3-177.8-30.900114.5R309R309-Q313 WeakPolarHBondContact O-CB 3.43Å; R309-Q313 PolarHBondContact O-N 3.13Å
314L51.1Low57.7Low164 Ų164118.1 Ų118.186%0.85962%0.617SS**THydrogen-bonded Turntrans-94-4.1174.6-134.3120.5000112.8E311 L312E311-L314 PolarHBondContact O-N 3Å; L312-L314 VanDerWaalsContact C-N 3.26Å; L312-L314 PolarHBondContact O-N 3.46Å
315E48.7Very low57.4Low170 Ų170119.4 Ų119.479%0.79462%0.622SS**SBendtrans-119.818-177.6-143.6-179.5-162.700113.1L312 A317L312-E315 PolarHBondContact O-N 3.02Å; E315-A317 PolarHBondContact O-N 2.85Å
316E46.8Very low57.5Low170 Ų170123.3 Ų123.379%0.79464%0.637SS**  trans-99.168172-159.9168.7-165.400110.3
317A43.9Very low57.9Low94 Ų94128.9 Ų128.978%0.77765%0.646SS**  trans-78121.2161.300000108.8E315 S319E315-A317 PolarHBondContact O-N 2.85Å; A317-S319 PolarHBondContact O-N 2.93Å
318E48Very low58.1Low199 Ų199128.1 Ų128.193%0.9364%0.641SS**  trans-41.7123.9177.9-79.4171.8130.200113.8
319S55.5Low58.8Low80 Ų80129.4 Ų129.456%0.55964%0.644SS**  trans-105.5126160.460.80000109.8A317 D321A317-S319 PolarHBondContact O-N 2.93Å; S319-D321 PolarHBondContact O-N 3.39Å; S319-D321 VanDerWaalsContact O-N 3.14Å
320P55.5Low59.4Low110 Ų110129.3 Ų129.371%0.71465%0.649SS**THydrogen-bonded Turntrans-75.50.3-168.328.1-34.3000115.3T323P320-T323 PolarHBondContact O-OG1 2.82Å
321D58.9Low60.1Low114 Ų114125.3 Ų125.361%0.6164%0.638SS**Hα-helixtrans-83-31.7-166.4-155.519.6000113.8S319 T323 H324 Q325S319-D321 PolarHBondContact O-N 3.39Å; S319-D321 VanDerWaalsContact O-N 3.14Å; D321-T323 VanDerWaalsContact C-N 3.34Å; D321-T323 PolarHBondContact O-N 3.43Å; D321-H324 PolarHBondContact O-N 2.9Å; D321-Q325 PolarHBondContact O-N 3.47Å
322I61Low60.8Low103 Ų103122 Ų12253%0.52863%0.628SS.*Hα-helixtrans-70-30.7-177.1-65.3169.2000112.1K326I322-K326 PolarHBondContact O-N 3.39Å
323T62.3Low61.9Low84 Ų84124.2 Ų124.252%0.51563%0.628SS.*Hα-helixtrans-75.4-26.2177.4640000112.7P320 D321 R327P320-T323 PolarHBondContact O-OG1 2.82Å; D321-T323 VanDerWaalsContact C-N 3.34Å; D321-T323 PolarHBondContact O-N 3.43Å; T323-R327 PolarHBondContact O-N 3.16Å; T323-R327 PolarHBondContact O-NE 2.89Å
324H64.8Low62.9Low109 Ų109121.5 Ų121.551%0.50562%0.618SS.*Hα-helixtrans-73.5-45.9174.9-173.755.1000110.6D321 K326 R327 V328D321-H324 PolarHBondContact O-N 2.9Å; H324-K326 PolarHBondContact O-N 3.11Å; H324-R327 PolarHBondContact O-N 3.05Å; H324-V328 WeakPolarHBondContact O-CG2 3.47Å; H324-V328 PolarHBondContact O-N 3.35Å
325Q63.7Low63.9Low118 Ų118118.4 Ų118.455%0.55160%0.602SS**Hα-helixtrans-62.7-41.2179.7-160.1167.617.900112.4D321 R327 V328 F329D321-Q325 PolarHBondContact O-N 3.47Å; Q325-R327 PolarHBondContact O-N 3.48Å; Q325-V328 PolarHBondContact O-N 2.89Å; Q325-F329 HydrophobicContact CG-CD2 4.05Å; Q325-F329 HydrophobicContact CG-CE2 3.97Å; Q325-F329 WeakPolarHBondContact O-CD2 3.38Å; Q325-F329 PolarHBondContact O-N 2.84Å
326K68.8Low64.9Low150 Ų150115.4 Ų115.465%0.65259%0.591SS**Hα-helixtrans-61.6-41.9175-76.4-177.9178177.40112.9I322 H324 F329 E330I322-K326 PolarHBondContact O-N 3.39Å; H324-K326 PolarHBondContact O-N 3.11Å; K326-F329 PolarHBondContact O-N 3.13Å; K326-E330 WeakPolarHBondContact O-CB 3.45Å; K326-E330 PolarHBondContact O-N 3.41Å; K326-E330 VanDerWaalsContact O-N 3.07Å
327R72.9Confident66Low157 Ų157113.1 Ų113.159%0.59258%0.58SS**Hα-helixtrans-66.6-36.6176.3-81.5-171.8-71.9172.3-4.4113T323 H324 Q325 E330 T331T323-R327 PolarHBondContact O-N 3.16Å; T323-R327 PolarHBondContact O-NE 2.89Å; H324-R327 PolarHBondContact O-N 3.05Å; Q325-R327 PolarHBondContact O-N 3.48Å; R327-E330 PolarHBondContact O-N 3.14Å; R327-T331 WeakPolarHBondContact O-CB 3.48Å; R327-T331 PolarHBondContact O-N 3.24Å; R327-T331 PolarHBondContact O-OG1 3.14Å
328V72.3Confident67.1Low66 Ų66113 Ų11340%0.457%0.569SS.*Hα-helixtrans-65.6-45.5176.3172.80000110.8H324 Q325 E330 T331 V332H324-V328 WeakPolarHBondContact O-CG2 3.47Å; H324-V328 PolarHBondContact O-N 3.35Å; Q325-V328 PolarHBondContact O-N 2.89Å; V328-E330 VanDerWaalsContact C-N 3.33Å; V328-E330 PolarHBondContact O-N 2.9Å; V328-T331 PolarHBondContact O-N 2.99Å; V328-V332 VanDerWaalsContact O-CG2 3.31Å; V328-V332 WeakPolarHBondContact O-CG2 3.42Å; V328-V332 PolarHBondContact O-N 3.31Å
329F75.3Confident67.8Low134 Ų134107.9 Ų107.959%0.58855%0.552SS**Hα-helixtrans-64.4-35.7177.1-89.5-79.5000113.2Q325 K326 R333Q325-F329 HydrophobicContact CG-CD2 4.05Å; Q325-F329 HydrophobicContact CG-CE2 3.97Å; Q325-F329 WeakPolarHBondContact O-CD2 3.38Å; Q325-F329 PolarHBondContact O-N 2.84Å; K326-F329 PolarHBondContact O-N 3.13Å; F329-R333 WeakPolarHBondContact O-CB 3.43Å; F329-R333 PolarHBondContact O-N 2.96Å
330E73.4Confident68.1Low113 Ų113112 Ų11253%0.52856%0.56SS.*Hα-helixtrans-71.7-35.1177.8-159.5161.6-144.900112.1K326 R327 V328 R333 N334K326-E330 WeakPolarHBondContact O-CB 3.45Å; K326-E330 PolarHBondContact O-N 3.41Å; K326-E330 VanDerWaalsContact O-N 3.07Å; R327-E330 PolarHBondContact O-N 3.14Å; V328-E330 VanDerWaalsContact C-N 3.33Å; V328-E330 PolarHBondContact O-N 2.9Å; E330-R333 PolarHBondContact O-N 3.34Å; E330-N334 PolarHBondContact O-N 2.86Å; E330-N334 VanDerWaalsContact O-N 3.12Å
331T74.1Confident68Low80 Ų80114.5 Ų114.549%0.49156%0.562SS.*Hα-helixtrans-68.9-43173.9-53.60000111.6R327 V328 R333 N334 I335R327-T331 WeakPolarHBondContact O-CB 3.48Å; R327-T331 PolarHBondContact O-N 3.24Å; R327-T331 PolarHBondContact O-OG1 3.14Å; V328-T331 PolarHBondContact O-N 2.99Å; T331-R333 VanDerWaalsContact C-N 3.31Å; T331-R333 PolarHBondContact O-N 3.38Å; T331-N334 PolarHBondContact O-N 3.4Å; T331-I335 HydrophobicContact CG2-CD1 4Å; T331-I335 WeakPolarHBondContact O-CG1 3.24Å; T331-I335 PolarHBondContact O-N 3.2Å
332V72.8Confident67.6Low75 Ų75119.6 Ų119.646%0.45557%0.573SS.*Hα-helixtrans-64.3-36176.2171.10000111.8V328 N336V328-V332 VanDerWaalsContact O-CG2 3.31Å; V328-V332 WeakPolarHBondContact O-CG2 3.42Å; V328-V332 PolarHBondContact O-N 3.31Å; V332-N336 PolarHBondContact O-N 2.87Å; V332-N336 VanDerWaalsContact O-N 3.14Å
333R77.4Confident66.8Low164 Ų164119 Ų11962%0.61958%0.577SS**Hα-helixtrans-66.1-42.5175.4-166.7-172.7-66.2156.6-2.5111.9F329 E330 T331 Q337F329-R333 WeakPolarHBondContact O-CB 3.43Å; F329-R333 PolarHBondContact O-N 2.96Å; E330-R333 PolarHBondContact O-N 3.34Å; T331-R333 VanDerWaalsContact C-N 3.31Å; T331-R333 PolarHBondContact O-N 3.38Å; R333-Q337 PolarHBondContact O-N 3.26Å; R333-Q337 VanDerWaalsContact O-N 3.12Å
334N73.9Confident66.2Low98 Ų98122 Ų12252%0.52459%0.59SS.*Hα-helixtrans-66.2-41.4176.9-109.2-44.9000112.4E330 T331 N336 Q337 V338E330-N334 PolarHBondContact O-N 2.86Å; E330-N334 VanDerWaalsContact O-N 3.12Å; T331-N334 PolarHBondContact O-N 3.4Å; N334-N336 PolarHBondContact O-N 3.34Å; N334-Q337 PolarHBondContact O-N 3.49Å; N334-V338 VanDerWaalsContact O-CG2 3.32Å; N334-V338 WeakPolarHBondContact O-CG2 3.48Å; N334-V338 PolarHBondContact O-N 3.01Å
335I70.9Confident64.9Low99 Ų99122.8 Ų122.851%0.50860%0.602SS.*Hα-helixtrans-63.5-42.5177.7-67.8166.9000111.2T331 Q337 V338 V339T331-I335 HydrophobicContact CG2-CD1 4Å; T331-I335 WeakPolarHBondContact O-CG1 3.24Å; T331-I335 PolarHBondContact O-N 3.2Å; I335-Q337 VanDerWaalsContact C-N 3.33Å; I335-Q337 PolarHBondContact O-N 2.83Å; I335-V338 PolarHBondContact O-N 2.99Å; I335-V339 WeakPolarHBondContact O-CG2 3.48Å; I335-V339 PolarHBondContact O-N 2.87Å
336N69.7Low63.7Low107 Ų107123.3 Ų123.357%0.57262%0.616SS**Hα-helixtrans-65.8-33.6175.8-95.3-48000113.1V332 N334 K340V332-N336 PolarHBondContact O-N 2.87Å; V332-N336 VanDerWaalsContact O-N 3.14Å; N334-N336 PolarHBondContact O-N 3.34Å; N336-K340 WeakPolarHBondContact O-CB 3.43Å; N336-K340 PolarHBondContact O-N 3.47Å; N336-K340 VanDerWaalsContact O-N 3.13Å
337Q71Confident61.9Low121 Ų121121.6 Ų121.657%0.56562%0.623SS**Hα-helixtrans-68.3-37.9172.6-104.5170.8-1800112.4R333 N334 I335 K340 Q341R333-Q337 PolarHBondContact O-N 3.26Å; R333-Q337 VanDerWaalsContact O-N 3.12Å; N334-Q337 PolarHBondContact O-N 3.49Å; I335-Q337 VanDerWaalsContact C-N 3.33Å; I335-Q337 PolarHBondContact O-N 2.83Å; Q337-K340 PolarHBondContact O-N 3.38Å; Q337-Q341 WeakPolarHBondContact O-CG 3.36Å; Q337-Q341 PolarHBondContact O-N 2.97Å; Q337-Q341 VanDerWaalsContact O-N 3.16Å
338V66.3Low60.4Low91 Ų91120.1 Ų120.155%0.55263%0.633SS**Hα-helixtrans-68.9-35.4176.1172.40000112N334 I335 Q341 R342N334-V338 VanDerWaalsContact O-CG2 3.32Å; N334-V338 WeakPolarHBondContact O-CG2 3.48Å; N334-V338 PolarHBondContact O-N 3.01Å; I335-V338 PolarHBondContact O-N 2.99Å; V338-Q341 PolarHBondContact O-N 3.32Å; V338-R342 PolarHBondContact O-N 3.23Å
339V62.3Low58.6Low93 Ų93125.5 Ų125.556%0.56466%0.656SS**Hα-helixtrans-68.4-38174.4172.60000111.6I335 Q341 R342I335-V339 WeakPolarHBondContact O-CG2 3.48Å; I335-V339 PolarHBondContact O-N 2.87Å; V339-Q341 VanDerWaalsContact C-N 3.31Å; V339-Q341 PolarHBondContact O-N 2.9Å; V339-R342 PolarHBondContact O-N 3.43Å
340K62Low56.7Low166 Ų166126.7 Ų126.772%0.72267%0.669SS**Hα-helixtrans-70.5-23.5177.1-160.5172.4-176.21790113.6N336 Q337 S343N336-K340 WeakPolarHBondContact O-CB 3.43Å; N336-K340 PolarHBondContact O-N 3.47Å; N336-K340 VanDerWaalsContact O-N 3.13Å; Q337-K340 PolarHBondContact O-N 3.38Å; K340-S343 PolarHBondContact O-OG 3.05Å
341Q53.3Low54.9Low162 Ų162129 Ų12976%0.75768%0.683SS**Hα-helixtrans-83.9-15.8174.5-73.1-92.1-48.300113.1Q337 V338 V339Q337-Q341 WeakPolarHBondContact O-CG 3.36Å; Q337-Q341 PolarHBondContact O-N 2.97Å; Q337-Q341 VanDerWaalsContact O-N 3.16Å; V338-Q341 PolarHBondContact O-N 3.32Å; V339-Q341 VanDerWaalsContact C-N 3.31Å; V339-Q341 PolarHBondContact O-N 2.9Å
342R50.4Low52.9Low222 Ų222131.2 Ų131.284%0.83870%0.699SS**THydrogen-bonded Turntrans-88.71.9-179.6-135.5173.3-175.4175.80.6114V338 V339V338-R342 PolarHBondContact O-N 3.23Å; V339-R342 PolarHBondContact O-N 3.43Å
343S45.1Very low51.2Low89 Ų89131.4 Ų131.462%0.62272%0.716SS**THydrogen-bonded Turntrans-107.119.9-177.563.80000114.7K340K340-S343 PolarHBondContact O-OG 3.05Å
344L49.8Very low49Very low149 Ų149128.7 Ų128.778%0.7872%0.722SS**  trans-122.372.7175.7-78.9161.2000110.8
345T36.4Very low47.3Very low124 Ų124132 Ų13276%0.76174%0.74SS**SBendtrans-142.6141157.851.10000109.5
346P39.8Very low45.8Very low130 Ų130135.5 Ų135.584%0.84475%0.754SS**PPolyproline II helixtrans-77.2127.8-170.231.5-32.5000111
347S29.8Very low44Very low114 Ų114136.5 Ų136.580%0.79777%0.77SS**PPolyproline II helixtrans-82.5147.4171.443.60000111.4
348P42.4Very low42.3Very low125 Ų125136.6 Ų136.681%0.81278%0.783SS**PPolyproline II helixtrans-80.2126.5-179.432.4-31000111
349M33.7Very low40.6Very low179 Ų179136.4 Ų136.488%0.88279%0.791SS**  trans39.3115.5139.6-133.7159.35800119.8
350N35.2Very low39.2Very low160 Ų160140.5 Ų140.586%0.85681%0.807SS**PPolyproline II helixtrans-65.1145.4170-74.2-79000113.2
351I36Very low37.6Very low162 Ų162140.5 Ų140.583%0.83181%0.814SS**PPolyproline II helixtrans-90125163.6-60.8171.5000108.2
352P33.3Very low36.5Very low125 Ų125138.3 Ų138.381%0.81282%0.817SS**PPolyproline II helixtrans-80.6132.5172.3-11.628.3000112
353G36.2Very low35.7Very low79 Ų79135.6 Ų135.681%0.81482%0.818SS**  trans115.680.9165.900000115.2
354S30.9Very low35.1Very low108 Ų108140 Ų14076%0.75583%0.834SS**  trans-157.9107.5156.5-178.20000109.7Q356S354-Q356 PolarHBondContact O-N 2.95Å
355N38.3Very low34.1Very low168 Ų168138 Ų13890%0.89883%0.833SS**  trans-80.698.8167.2-69-41.4000108.2
356Q39.5Very low34.1Very low172 Ų172137.5 Ų137.580%0.80483%0.834SS**  trans-145111.4151.2-69.4-164.144.500109.6S354 S358S354-Q356 PolarHBondContact O-N 2.95Å; Q356-S358 PolarHBondContact O-N 3.31Å
357S32.1Very low33.6Very low128 Ų128136.8 Ų136.890%0.89583%0.831SS**  trans-59.8121.8165.5-46.50000109.8
358S34.5Very low33.7Very low122 Ų122137.2 Ų137.285%0.85383%0.828SS**  trans-161.6140.1139.537.70000112.2Q356Q356-S358 PolarHBondContact O-N 3.31Å
359A31.8Very low33Very low87 Ų87136.8 Ų136.872%0.71983%0.828SS**  trans-53.8148-175.200000117
360M32.4Very low33.1Very low180 Ų180134.8 Ų134.889%0.88783%0.826SS**  trans67.5103.9135.5-60-91.8172.700118.4
361N28.7Very low33.6Very low165 Ų165132.6 Ų132.688%0.88282%0.821SS**  trans-65.1126.6149.3-74.6-59.2000110.2
362S30Very low33.5Very low117 Ų117136.3 Ų136.382%0.81882%0.824SS**  trans-145.4100.2149.363.40000109.6
363L33.4Very low33.1Very low165 Ų165135.1 Ų135.186%0.86482%0.819SS**  trans-83.6123.3161.3-73.2167.1000107.8
364L31.8Very low32.9Very low181 Ų181135.8 Ų135.895%0.94881%0.811SS**  trans-180128.8137.8-93155.4000109
365S29.2Very low32.9Very low108 Ų108138.7 Ų138.776%0.75581%0.81SS**  trans-109.2150.1-173.2-59.90000113.2
366S36.3Very low33.2Very low113 Ų113141.1 Ų141.179%0.7981%0.808SS**  trans60.9146.414862.70000119.3
367C30.3Very low32.8Very low114 Ų114136.1 Ų136.177%0.7780%0.803SS**  cis-165154.910.442.40000105.9
368V32Very low32.8Very low123 Ų123134.9 Ų134.975%0.74579%0.794SS**  170.7138.676.1169.50000106.3
369S27.8Very low32.9Very low116 Ų116135.4 Ų135.481%0.81179%0.788SS**  trans153.2120.1134.8-66.80000113
370T35.8Very low33.1Very low137 Ų137138.9 Ų138.984%0.8479%0.793SS**  trans-94-178.8162.4410000109.9
371P46Very low33.2Very low114 Ų114133.7 Ų133.774%0.7479%0.785SS**  cis-135.7169.1-12.533.6-13.9000115.5
372R32.5Very low33.3Very low241 Ų241133.4 Ų133.491%0.90978%0.784SS**  163.7142.3124.1-102.5178.8127.5111.2-5.1115
373S26.1Very low33.4Very low99 Ų99133.9 Ų133.969%0.69278%0.781SS**  trans78.4101.6144.6177.60000118
374S31.6Very low33.4Very low93 Ų93132.3 Ų132.365%0.6578%0.778SS**  76132.589.887.60000112.4
375F30.4Very low34Very low170 Ų170130.4 Ų130.475%0.74677%0.768SS**  cis-171.3158.344.6-126.2-81000109.6
376Y44Very low34.2Very low218 Ų218132.7 Ų132.786%0.85577%0.772SS**  trans67.1127.4170.8-74.2-83.3000118.2
377G32.3Very low34.2Very low67 Ų67133.5 Ų133.569%0.69177%0.767SS**  cis144.8121.26.400000110.6
378S31Very low34.5Very low102 Ų102137.3 Ų137.371%0.71377%0.771SS**  trans73.9115.4164.2-77.90000119.4
379D36.9Very low34.7Very low134 Ų134136.4 Ų136.472%0.71777%0.766SS**  78.9138.863.1-67.6-31.1000111
380I37.7Very low35.1Very low160 Ų160138.3 Ų138.382%0.82177%0.767SS**  cis-170.3150.54.3-94.2153.6000103.6
381G33Very low34.8Very low70 Ų70136.4 Ų136.472%0.72276%0.759SS**  trans162.982.5159.500000117.2
382N31.6Very low34.3Very low160 Ų160138 Ų13886%0.85676%0.76SS**PPolyproline II helixtrans-51143.4174.9-78.2-16.5000115.6
383V31.3Very low34.5Very low126 Ų126133.6 Ų133.676%0.76475%0.753SS**PPolyproline II helixtrans-91.1119.6155.3173.60000108.2L385V383-L385 HydrophobicContact CG1-CD1 4.24Å
384V34.5Very low35.2Very low133 Ų133135 Ų13581%0.80675%0.752SS**PPolyproline II helixtrans-92.4117.9158.5168.50000106.6
385L44.3Very low35.3Very low140 Ų140138 Ų13873%0.73376%0.756SS**PPolyproline II helixtrans-71137.4165.3-9390.8000109.3V383V383-L385 HydrophobicContact CG1-CD1 4.24Å
386D32.4Very low35.6Very low156 Ų156135.1 Ų135.183%0.83475%0.752SS**  trans-128.4137.7147-165.510.4000110.4
387N37Very low35Very low131 Ų131133.5 Ų133.570%0.70175%0.752SS**  trans-91.9123.3179.9-83.9-34.3000109.2
388K36.8Very low35.1Very low193 Ų193135.1 Ų135.184%0.83976%0.759SS**  trans-169111.5137.4-134.3148174.2171.10115.3
389T35.2Very low35.1Very low104 Ų104134.8 Ų134.864%0.63876%0.763SS**  69.6111.7121.3-52.30000121.5
390N35.9Very low35Very low156 Ų156135.2 Ų135.283%0.83477%0.765SS**  trans60.1148.2137.3-66.5-29.5000123.2
391S30.2Very low34.9Very low98 Ų98135 Ų13569%0.68577%0.765SS**  trans102.998.4162.2-152.40000113.8
392I36.7Very low34.8Very low147 Ų147135.2 Ų135.275%0.75477%0.767SS**  68136.186-56.5164.3000111.7
393I35.6Very low35.1Very low149 Ų149134.3 Ų134.376%0.76476%0.762SS**  trans89.8133160.8-47.8-172.1000113.4
394L39.9Very low35.3Very low128 Ų128134 Ų13467%0.6776%0.756SS**  cis178159.6-11.8-162.579000105.3
395E34.1Very low35.7Very low156 Ų156134.4 Ų134.473%0.72975%0.749SS**  trans71.6121.2145-88.2166.9-157.900122.9
396T36.9Very low35.9Very low109 Ų109138 Ų13867%0.66975%0.753SS**  74.6119.3115.3-54.30000121.5
397E31.4Very low36.6Very low184 Ų184133.9 Ų133.986%0.8674%0.737SS**  trans71128.3148.3-75.4177.4173.100123.1
398A33.8Very low37.5Very low101 Ų101134.8 Ų134.884%0.83573%0.734SS**  trans96.8144135.300000120.9
399A31.7Very low38.3Very low95 Ų95133.8 Ų133.879%0.78573%0.73SS**  trans90.397.5159.400000118.6
400D34.2Very low39.4Very low144 Ų144134.9 Ų134.977%0.7774%0.739SS**  35139112.6-153.118.9000120.7
401L36.5Very low40.4Very low155 Ų155129.5 Ų129.581%0.81272%0.721SS**  trans69.8114.6168.2-58.4174.5000119.7
402G30.8Very low41.7Very low74 Ų74129.8 Ų129.876%0.76372%0.718SS**  124.2100125.600000116.7
403N38.8Very low42.3Very low142 Ų142129.3 Ų129.376%0.75972%0.724SS**  trans45.9105.4137.9-17457.2000118.5
404D35.7Very low43.5Very low118 Ų118126 Ų12663%0.63173%0.727SS**  trans-154.177.6143.8-115.3-20.3000112.9R406D404-R406 PolarHBondContact O-N 2.85Å; D404-R406 WeakPolarHBondContact OD1-CB 3.36Å; D404-R406 WeakPolarHBondContact OD1-CD 3.39Å; D404-R406 WeakPolarHBondContact OD1-CG 3.36Å
405E41.5Very low44.2Very low142 Ų142124.2 Ų124.266%0.66472%0.722SS**THydrogen-bonded Turntrans-67.661.3151.8-85.3-76.1167.300109.4K408E405-K408 IonicContact OE1-NZ 2.74Å; E405-K408 PolarHBondContact OE1-NZ 3.37Å; E405-K408 IonicContact OE2-NZ 3.82Å; E405-K408 PolarHBondContact OE2-NZ 3.01Å
406R49.4Very low45.5Very low215 Ų215121.3 Ų121.381%0.81172%0.717SS**THydrogen-bonded Turntrans-135.69.1179.3-77.8-166.7171.5-156.40.7116.2D404D404-R406 PolarHBondContact O-N 2.85Å; D404-R406 WeakPolarHBondContact OD1-CB 3.36Å; D404-R406 WeakPolarHBondContact OD1-CD 3.39Å; D404-R406 WeakPolarHBondContact OD1-CG 3.36Å
407S46.3Very low47.1Very low71 Ų71116.8 Ų116.850%0.49769%0.692SS.*  trans-114.911.3178.465.40000115.4K409 S418S407-K409 VanDerWaalsContact C-N 3.34Å; S407-K409 PolarHBondContact O-N 3.29Å; S407-S418 PolarHBondContact O-OG 2.92Å
408K55.1Low49.1Very low150 Ų150111 Ų11165%0.65267%0.671SS**  trans-90.762.8172.7-62.6173.6-170.9155.80111E405E405-K408 IonicContact OE1-NZ 2.74Å; E405-K408 PolarHBondContact OE1-NZ 3.37Å; E405-K408 IonicContact OE2-NZ 3.82Å; E405-K408 PolarHBondContact OE2-NZ 3.01Å
409K55.5Low51.2Low171 Ų171112.1 Ų112.174%0.74366%0.659SS**  trans-95.9112.8163.9-86.2-178177.2176.90108.5S407 G411S407-K409 VanDerWaalsContact C-N 3.34Å; S407-K409 PolarHBondContact O-N 3.29Å; K409-G411 PolarHBondContact O-N 3.46Å
410P57.2Low53.6Low127 Ų127111.9 Ų111.983%0.82564%0.644SS**PPolyproline II helixtrans-58.9127.4167.4-16.529.1000108.6
411G56.6Low56Low44 Ų44109.7 Ų109.745%0.45463%0.632SS.*PPolyproline II helixtrans-63.2146.8175.400000111.3K409K409-G411 PolarHBondContact O-N 3.46Å
412T57.9Low58.2Low103 Ų103108.1 Ų108.163%0.63262%0.621SS**PPolyproline II helixtrans-77.6157.5169.230.30000111.2G414 T415T412-G414 PolarHBondContact O-N 3.1Å; T412-G414 VanDerWaalsContact O-N 3.07Å; T412-T415 PolarHBondContact O-N 2.89Å
413P49.8Very low60.6Low137 Ų137106.7 Ų106.789%0.8960%0.597SS**THydrogen-bonded Turntrans-55.3117.1-178-23.633.2000111.9
414G60.4Low62.7Low80 Ų80102.2 Ų102.283%0.82558%0.58SS**THydrogen-bonded Turntrans109.6-8.917700000116.3T412T412-G414 PolarHBondContact O-N 3.1Å; T412-G414 VanDerWaalsContact O-N 3.07Å
415T54.7Low65.1Low91 Ų91101.1 Ų101.156%0.55857%0.573SS**SBendtrans-133.3119.9173.331.80000110.8T412 G417T412-T415 PolarHBondContact O-N 2.89Å; T415-G417 PolarHBondContact O-N 2.94Å
416P60.5Low67.3Low95 Ų95103.2 Ų103.262%0.61758%0.575SS**  trans-56.9131.8176.9-24.233.6000111.3D420P416-D420 HydrophobicContact CB-CB 4.4Å
417G71.2Confident69.3Low14 Ų14101.3 Ų101.314%0.14457%0.568CS.*  trans-70.7162.6171.900000111.7T415 H419 D420 L421T415-G417 PolarHBondContact O-N 2.94Å; G417-H419 PolarHBondContact O-N 3.21Å; G417-H419 VanDerWaalsContact O-N 3.15Å; G417-D420 PolarHBondContact O-N 3.37Å; G417-L421 PolarHBondContact O-N 3.05Å
418S72.6Confident71.4Confident61 Ų61103.1 Ų103.143%0.42757%0.572SS.*Hα-helixtrans-51.7-38.2179.341.60000113.4S407 E422S407-S418 PolarHBondContact O-OG 2.92Å; S418-E422 WeakPolarHBondContact O-CB 3.48Å; S418-E422 PolarHBondContact O-N 3.19Å
419H78.4Confident73.1Confident125 Ų12599.7 Ų99.758%0.57957%0.566SS**Hα-helixtrans-74.8-33.3178.7-17357.7000113.8G417 E422 T423G417-H419 PolarHBondContact O-N 3.21Å; G417-H419 VanDerWaalsContact O-N 3.15Å; H419-E422 IonicContact ND1-OE2 2.7Å; H419-T423 WeakPolarHBondContact O-CB 3.48Å; H419-T423 PolarHBondContact O-N 3.16Å; H419-T423 PolarHBondContact O-OG1 3.47Å
420D83.3Confident74.8Confident90 Ų9096 Ų9648%0.48156%0.555SS.*Hα-helixtrans-71.3-38.4175.4-17347.3000110.5P416 G417 T423 A424P416-D420 HydrophobicContact CB-CB 4.4Å; G417-D420 PolarHBondContact O-N 3.37Å; D420-T423 PolarHBondContact O-N 3.15Å; D420-A424 VanDerWaalsContact O-CB 3.29Å; D420-A424 WeakPolarHBondContact O-CB 3.32Å; D420-A424 PolarHBondContact O-N 2.9Å
421L83.1Confident76.2Confident98 Ų9899.3 Ų99.351%0.51355%0.551SS.*Hα-helixtrans-62.6-45.9172.3179.562.9000112.1G417 T423 A424 L425G417-L421 PolarHBondContact O-N 3.05Å; L421-T423 VanDerWaalsContact C-N 3.33Å; L421-T423 PolarHBondContact O-N 2.81Å; L421-A424 PolarHBondContact O-N 3.13Å; L421-L425 HydrophobicContact CD1-CD1 4.41Å; L421-L425 HydrophobicContact CD1-CG 4.36Å; L421-L425 HydrophobicContact CG-CD1 4.25Å; L421-L425 WeakPolarHBondContact O-CB 3.45Å; L421-L425 WeakPolarHBondContact O-CG 3.29Å; L421-L425 PolarHBondContact O-N 3.48Å
422E83.3Confident77.9Confident123 Ų123106.1 Ų106.158%0.57556%0.563SS**Hα-helixtrans-60.2-43.7175.9-175.4-177.9-174.100111.6S418 H419 A424 L425 R426S418-E422 WeakPolarHBondContact O-CB 3.48Å; S418-E422 PolarHBondContact O-N 3.19Å; H419-E422 IonicContact ND1-OE2 2.7Å; E422-A424 PolarHBondContact O-N 3.35Å; E422-L425 PolarHBondContact O-N 2.8Å; E422-R426 WeakPolarHBondContact O-CB 3.41Å; E422-R426 PolarHBondContact O-N 2.89Å
423T80.7Confident79.4Confident43 Ų43107.1 Ų107.126%0.26456%0.56SS.*Hα-helixtrans-65-40.1176.5-57.90000111.5H419 D420 L421 R426 R427H419-T423 WeakPolarHBondContact O-CB 3.48Å; H419-T423 PolarHBondContact O-N 3.16Å; H419-T423 PolarHBondContact O-OG1 3.47Å; D420-T423 PolarHBondContact O-N 3.15Å; L421-T423 VanDerWaalsContact C-N 3.33Å; L421-T423 PolarHBondContact O-N 2.81Å; T423-R426 PolarHBondContact O-N 3.42Å; T423-R427 WeakPolarHBondContact O-CB 3.38Å; T423-R427 VanDerWaalsContact O-CG 3.28Å; T423-R427 WeakPolarHBondContact O-CG 3.49Å; T423-R427 PolarHBondContact O-N 3.35Å
424A83.3Confident81.1Confident48 Ų48105.5 Ų105.540%0.39754%0.544SS..Hα-helixtrans-65-41.917600000111.9D420 L421 E422 R427 L428D420-A424 VanDerWaalsContact O-CB 3.29Å; D420-A424 WeakPolarHBondContact O-CB 3.32Å; D420-A424 PolarHBondContact O-N 2.9Å; L421-A424 PolarHBondContact O-N 3.13Å; E422-A424 PolarHBondContact O-N 3.35Å; A424-R427 PolarHBondContact O-N 3.04Å; A424-L428 WeakPolarHBondContact O-CB 3.42Å; A424-L428 PolarHBondContact O-N 2.9Å
425L87.4Confident82.6Confident95 Ų95107.2 Ų107.250%0.49753%0.526SS..Hα-helixtrans-65.3-42.3175.3-71.9174.2000111.5L421 E422 R427 L428 S429L421-L425 HydrophobicContact CD1-CD1 4.41Å; L421-L425 HydrophobicContact CD1-CG 4.36Å; L421-L425 HydrophobicContact CG-CD1 4.25Å; L421-L425 WeakPolarHBondContact O-CB 3.45Å; L421-L425 WeakPolarHBondContact O-CG 3.29Å; L421-L425 PolarHBondContact O-N 3.48Å; E422-L425 PolarHBondContact O-N 2.8Å; L425-R427 PolarHBondContact O-N 2.89Å; L425-L428 PolarHBondContact O-N 3.26Å; L425-S429 PolarHBondContact O-N 3.03Å; L425-S429 PolarHBondContact O-OG 3.07Å
426R87.4Confident84.3Confident186 Ų186106.9 Ų106.970%0.70252%0.521SS*.Hα-helixtrans-61.7-43.2174.9-170.3173.1-179.8-121.8-1.8111.8E422 T423 L428 S429 L430E422-R426 WeakPolarHBondContact O-CB 3.41Å; E422-R426 PolarHBondContact O-N 2.89Å; T423-R426 PolarHBondContact O-N 3.42Å; R426-L428 VanDerWaalsContact C-N 3.34Å; R426-S429 PolarHBondContact O-N 3.33Å; R426-L430 WeakPolarHBondContact O-CG 3.39Å; R426-L430 PolarHBondContact O-N 3.34Å
427R91.3Very high85.3Confident175 Ų175104.6 Ų104.666%0.6651%0.507SS*.Hα-helixtrans-63-39.2174.1-74.8174.1179.61782112.1T423 A424 L425 R431T423-R427 WeakPolarHBondContact O-CB 3.38Å; T423-R427 VanDerWaalsContact O-CG 3.28Å; T423-R427 WeakPolarHBondContact O-CG 3.49Å; T423-R427 PolarHBondContact O-N 3.35Å; A424-R427 PolarHBondContact O-N 3.04Å; L425-R427 PolarHBondContact O-N 2.89Å; R427-R431 WeakPolarHBondContact O-CB 3.41Å; R427-R431 PolarHBondContact O-N 3Å
428L90.7Very high85.8Confident110 Ų110108.6 Ų108.658%0.57652%0.522SS*.Hα-helixtrans-67.4-41.8177.2-174.965.6000111.7A424 L425 R426 R431 R432A424-L428 WeakPolarHBondContact O-CB 3.42Å; A424-L428 PolarHBondContact O-N 2.9Å; L425-L428 PolarHBondContact O-N 3.26Å; R426-L428 VanDerWaalsContact C-N 3.34Å; L428-R431 PolarHBondContact O-N 2.76Å; L428-R432 PolarHBondContact O-N 3.38Å
429S90.5Very high86.6Confident77 Ų77113 Ų11354%0.53853%0.529SS..Hα-helixtrans-61.2-47.1175.1-66.10000111.7L425 R426 R431 R432 E433L425-S429 PolarHBondContact O-N 3.03Å; L425-S429 PolarHBondContact O-OG 3.07Å; R426-S429 PolarHBondContact O-N 3.33Å; S429-R431 VanDerWaalsContact C-N 3.29Å; S429-R431 PolarHBondContact O-N 2.82Å; S429-R432 WeakPolarHBondContact O-CB 3.43Å; S429-R432 PolarHBondContact O-N 2.84Å; S429-R432 VanDerWaalsContact O-N 3.13Å; S429-E433 WeakPolarHBondContact O-CB 3.47Å; S429-E433 PolarHBondContact O-N 3.23Å
430L89.8Confident87.2Confident95 Ų95113.7 Ų113.750%0.49753%0.527SS..Hα-helixtrans-60.7-38.4175.2-73.6170.7000112R426 E433 N434R426-L430 WeakPolarHBondContact O-CG 3.39Å; R426-L430 PolarHBondContact O-N 3.34Å; L430-E433 PolarHBondContact O-N 3.4Å; L430-N434 VanDerWaalsContact O-CB 3.25Å; L430-N434 WeakPolarHBondContact O-CB 3.49Å; L430-N434 PolarHBondContact O-N 2.9Å
431R88.4Confident87.5Confident195 Ų195114.5 Ų114.574%0.73653%0.526SS*.Hα-helixtrans-66.1-38.3175.8-165.7177.8-169.1148.14.2112.2R427 L428 S429 Y435R427-R431 WeakPolarHBondContact O-CB 3.41Å; R427-R431 PolarHBondContact O-N 3Å; L428-R431 PolarHBondContact O-N 2.76Å; S429-R431 VanDerWaalsContact C-N 3.29Å; S429-R431 PolarHBondContact O-N 2.82Å; R431-Y435 PolarHBondContact O-N 3.14Å; R431-Y435 VanDerWaalsContact O-N 3.08Å
432R91.6Very high87.6Confident188 Ų188115.4 Ų115.471%0.70953%0.526SS*.Hα-helixtrans-68.5-42.9176.1-175.9179.9179.5-177.1-0.9111.4L428 S429 Y435 L436L428-R432 PolarHBondContact O-N 3.38Å; S429-R432 WeakPolarHBondContact O-CB 3.43Å; S429-R432 PolarHBondContact O-N 2.84Å; S429-R432 VanDerWaalsContact O-N 3.13Å; R432-Y435 PolarHBondContact O-N 3.34Å; R432-L436 WeakPolarHBondContact O-CG 3.49Å; R432-L436 PolarHBondContact O-N 2.79Å
433E88.4Confident87.8Confident123 Ų123115.8 Ų115.858%0.57553%0.528SS*.Hα-helixtrans-63.2-44.3176.1-176.1173.9-160.600111.3S429 L430 Y435 L436 S437S429-E433 WeakPolarHBondContact O-CB 3.47Å; S429-E433 PolarHBondContact O-N 3.23Å; L430-E433 PolarHBondContact O-N 3.4Å; E433-Y435 VanDerWaalsContact C-N 3.33Å; E433-Y435 PolarHBondContact O-N 3.41Å; E433-L436 PolarHBondContact O-N 3.45Å; E433-L436 VanDerWaalsContact O-N 3.12Å; E433-S437 PolarHBondContact O-N 3Å; E433-S437 PolarHBondContact O-OG 3.4Å
434N86.7Confident88.1Confident103 Ų103118.8 Ų118.855%0.55154%0.539SS*.Hα-helixtrans-60-42.9175.7-171.7-103000111.7L430 L436 S437 E438L430-N434 VanDerWaalsContact O-CB 3.25Å; L430-N434 WeakPolarHBondContact O-CB 3.49Å; L430-N434 PolarHBondContact O-N 2.9Å; N434-L436 VanDerWaalsContact C-N 3.33Å; N434-L436 PolarHBondContact O-N 3.32Å; N434-S437 VanDerWaalsContact CA-OG 3.31Å; N434-S437 WeakPolarHBondContact CA-OG 3.22Å; N434-S437 PolarHBondContact O-N 2.87Å; N434-S437 PolarHBondContact O-OG 3.16Å; N434-E438 WeakPolarHBondContact O-CB 3.36Å; N434-E438 PolarHBondContact O-N 3.44Å
435Y91.1Very high88Confident117 Ų117119.8 Ų119.846%0.45954%0.535SS..Hα-helixtrans-61.2-38.4174.5-177-97.8000113.2R431 R432 E433 R439R431-Y435 PolarHBondContact O-N 3.14Å; R431-Y435 VanDerWaalsContact O-N 3.08Å; R432-Y435 PolarHBondContact O-N 3.34Å; E433-Y435 VanDerWaalsContact C-N 3.33Å; E433-Y435 PolarHBondContact O-N 3.41Å; Y435-R439 HydrophobicContact CE1-CG 4.29Å; Y435-R439 PolarHBondContact O-N 3.43Å; Y435-R439 VanDerWaalsContact O-N 3.08Å; Y435-R439 PolarHBondContact OH-NE 2.79Å; Y435-R439 VanDerWaalsContact OH-NE 3.13Å; Y435-R439 PolarHBondContact OH-NH2 3.2Å; Y435-R439 VanDerWaalsContact OH-NH2 3.11Å
436L90.6Very high87.4Confident84 Ų84122 Ų12244%0.4454%0.543SS..Hα-helixtrans-70.1-38.3175.4-68.9173.2000111.7R432 E433 N434 R439 R440R432-L436 WeakPolarHBondContact O-CG 3.49Å; R432-L436 PolarHBondContact O-N 2.79Å; E433-L436 PolarHBondContact O-N 3.45Å; E433-L436 VanDerWaalsContact O-N 3.12Å; N434-L436 VanDerWaalsContact C-N 3.33Å; N434-L436 PolarHBondContact O-N 3.32Å; L436-R439 PolarHBondContact O-N 3.24Å; L436-R440 PolarHBondContact O-N 3.35Å
437S81.8Confident87.3Confident47 Ų47118.3 Ų118.333%0.32953%0.534SS..Hα-helixtrans-66.3-39.5175.767.50000112.2E433 N434 R439 R440 F441E433-S437 PolarHBondContact O-N 3Å; E433-S437 PolarHBondContact O-OG 3.4Å; N434-S437 VanDerWaalsContact CA-OG 3.31Å; N434-S437 WeakPolarHBondContact CA-OG 3.22Å; N434-S437 PolarHBondContact O-N 2.87Å; N434-S437 PolarHBondContact O-OG 3.16Å; S437-R439 VanDerWaalsContact C-N 3.34Å; S437-R440 PolarHBondContact O-N 3.44Å; S437-F441 WeakPolarHBondContact O-CB 3.36Å; S437-F441 PolarHBondContact O-N 2.94Å
438E81.9Confident87Confident98 Ų98116.9 Ų116.946%0.45853%0.528SS..Hα-helixtrans-66.4-39.1177-165.1-178.7-16100110.5N434 F441 F442N434-E438 WeakPolarHBondContact O-CB 3.36Å; N434-E438 PolarHBondContact O-N 3.44Å; E438-F441 PolarHBondContact O-N 3.26Å; E438-F442 HydrophobicContact CG-CD2 4.09Å; E438-F442 HydrophobicContact CG-CE2 3.61Å; E438-F442 WeakPolarHBondContact O-CD2 3.35Å; E438-F442 PolarHBondContact O-N 3.47Å
439R89.1Confident86.7Confident153 Ų153117.4 Ų117.458%0.57753%0.526SS*.Hα-helixtrans-62.1-47.1171.3-84.5-167171.4-154.4-2113.2Y435 L436 S437 F441 F442 E443Y435-R439 HydrophobicContact CE1-CG 4.29Å; Y435-R439 PolarHBondContact O-N 3.43Å; Y435-R439 VanDerWaalsContact O-N 3.08Å; Y435-R439 PolarHBondContact OH-NE 2.79Å; Y435-R439 VanDerWaalsContact OH-NE 3.13Å; Y435-R439 PolarHBondContact OH-NH2 3.2Å; Y435-R439 VanDerWaalsContact OH-NH2 3.11Å; L436-R439 PolarHBondContact O-N 3.24Å; S437-R439 VanDerWaalsContact C-N 3.34Å; R439-F441 VanDerWaalsContact C-N 3.31Å; R439-F441 PolarHBondContact O-N 3.13Å; R439-F442 PolarHBondContact O-N 3.27Å; R439-E443 WeakPolarHBondContact O-CB 3.29Å; R439-E443 PolarHBondContact O-N 2.88Å
440R90.1Very high86Confident140 Ų140119.8 Ų119.853%0.52853%0.532SS..Hα-helixtrans-61.8-41.4177.2-74.8-161.5-62.3-108.82111.6L436 S437 F442 E443 E444L436-R440 PolarHBondContact O-N 3.35Å; S437-R440 PolarHBondContact O-N 3.44Å; R440-F442 PolarHBondContact O-N 3.34Å; R440-E443 PolarHBondContact O-N 3.34Å; R440-E444 WeakPolarHBondContact O-CB 3.42Å; R440-E444 WeakPolarHBondContact O-CG 3.36Å; R440-E444 PolarHBondContact O-N 3.24Å
441F89.9Confident85.3Confident106 Ų106120.6 Ų120.647%0.46553%0.533SS..Hα-helixtrans-58.2-46.5175.9179-92.5000111.9S437 E438 R439 E443 E445S437-F441 WeakPolarHBondContact O-CB 3.36Å; S437-F441 PolarHBondContact O-N 2.94Å; E438-F441 PolarHBondContact O-N 3.26Å; R439-F441 VanDerWaalsContact C-N 3.31Å; R439-F441 PolarHBondContact O-N 3.13Å; F441-E443 PolarHBondContact O-N 2.96Å; F441-E445 WeakPolarHBondContact CE1-OE2 3.3Å; F441-E445 VanDerWaalsContact O-CB 3.27Å; F441-E445 WeakPolarHBondContact O-CB 3.48Å; F441-E445 PolarHBondContact O-N 3.41Å
442F85.9Confident84.8Confident117 Ų117115.8 Ų115.851%0.51352%0.519SS..Hα-helixtrans-67.6-34.4177.4-74.9-56.8000113.3E438 R439 R440 Q446E438-F442 HydrophobicContact CG-CD2 4.09Å; E438-F442 HydrophobicContact CG-CE2 3.61Å; E438-F442 WeakPolarHBondContact O-CD2 3.35Å; E438-F442 PolarHBondContact O-N 3.47Å; R439-F442 PolarHBondContact O-N 3.27Å; R440-F442 PolarHBondContact O-N 3.34Å; F442-Q446 VanDerWaalsContact O-CB 3.31Å; F442-Q446 WeakPolarHBondContact O-CB 3.4Å; F442-Q446 PolarHBondContact O-N 3.45Å
443E86.9Confident84Confident132 Ų132112.6 Ų112.662%0.61752%0.516SS*.Hα-helixtrans-70-44.3177.3-163.2162.2-14100111.1R439 R440 F441 Q446 E447R439-E443 WeakPolarHBondContact O-CB 3.29Å; R439-E443 PolarHBondContact O-N 2.88Å; R440-E443 PolarHBondContact O-N 3.34Å; F441-E443 PolarHBondContact O-N 2.96Å; E443-Q446 PolarHBondContact O-N 3.24Å; E443-E447 WeakPolarHBondContact O-CB 3.41Å; E443-E447 PolarHBondContact O-N 3.12Å
444E87.1Confident83.2Confident105 Ų105110.1 Ų110.149%0.49152%0.516SS..Hα-helixtrans-65.5-36173.4-75171.9-164.100112.3R440 E447 R448R440-E444 WeakPolarHBondContact O-CB 3.42Å; R440-E444 WeakPolarHBondContact O-CG 3.36Å; R440-E444 PolarHBondContact O-N 3.24Å; E444-E447 PolarHBondContact O-N 3.48Å; E444-R448 VanDerWaalsContact O-CB 3.24Å; E444-R448 WeakPolarHBondContact O-CB 3.32Å; E444-R448 PolarHBondContact O-N 2.97Å
445E81Confident82.1Confident69 Ų69113 Ų11332%0.32253%0.526SS..Hα-helixtrans-70.5-35.3174.6-171.7168-158.800111.8F441 K449F441-E445 WeakPolarHBondContact CE1-OE2 3.3Å; F441-E445 VanDerWaalsContact O-CB 3.27Å; F441-E445 WeakPolarHBondContact O-CB 3.48Å; F441-E445 PolarHBondContact O-N 3.41Å; E445-K449 WeakPolarHBondContact O-CG 3.32Å; E445-K449 PolarHBondContact O-N 3.12Å
446Q76.1Confident80.6Confident142 Ų142114.1 Ų114.166%0.66453%0.534SS*.Hα-helixtrans-68.2-41.4171.9-173.2-179.23.300111.6F442 E443 K449 L450F442-Q446 VanDerWaalsContact O-CB 3.31Å; F442-Q446 WeakPolarHBondContact O-CB 3.4Å; F442-Q446 PolarHBondContact O-N 3.45Å; E443-Q446 PolarHBondContact O-N 3.24Å; Q446-K449 PolarHBondContact O-N 3.29Å; Q446-L450 WeakPolarHBondContact O-CB 3.4Å; Q446-L450 PolarHBondContact O-N 3.43Å
447E84.8Confident78.7Confident108 Ų108113 Ų11351%0.50554%0.542SS..Hα-helixtrans-65.5-42.5177-174.8171.3-160.900111.4E443 E444 K449 L450 Q451E443-E447 WeakPolarHBondContact O-CB 3.41Å; E443-E447 PolarHBondContact O-N 3.12Å; E444-E447 PolarHBondContact O-N 3.48Å; E447-K449 VanDerWaalsContact C-N 3.34Å; E447-K449 PolarHBondContact O-N 3.49Å; E447-L450 CarbonylContact O-C 3.59Å; E447-L450 WeakPolarHBondContact O-CA 3.34Å; E447-L450 WeakPolarHBondContact O-CB 3.46Å; E447-L450 PolarHBondContact O-N 3.24Å; E447-L450 VanDerWaalsContact O-N 3.09Å; E447-Q451 WeakPolarHBondContact O-CB 3.4Å; E447-Q451 WeakPolarHBondContact O-CG 3.33Å; E447-Q451 PolarHBondContact O-N 3.14Å
448R85.5Confident76.9Confident145 Ų145118.9 Ų118.955%0.54757%0.565SS.*Hα-helixtrans-61.6-41.2173.7-165.5-169.4-35.1-158.94.2112.1E444 L450 Q451 E452E444-R448 VanDerWaalsContact O-CB 3.24Å; E444-R448 WeakPolarHBondContact O-CB 3.32Å; E444-R448 PolarHBondContact O-N 2.97Å; R448-L450 VanDerWaalsContact C-N 3.32Å; R448-Q451 PolarHBondContact O-N 2.83Å; R448-E452 WeakPolarHBondContact O-CB 3.4Å; R448-E452 PolarHBondContact O-N 3.05Å
449K83.1Confident74.6Confident122 Ų122122.2 Ų122.253%0.5359%0.585SS.*Hα-helixtrans-65.2-35.4172.7-82.6178.9178.8166.50112.4E445 Q446 E447 L453E445-K449 WeakPolarHBondContact O-CG 3.32Å; E445-K449 PolarHBondContact O-N 3.12Å; Q446-K449 PolarHBondContact O-N 3.29Å; E447-K449 VanDerWaalsContact C-N 3.34Å; E447-K449 PolarHBondContact O-N 3.49Å; K449-L453 WeakPolarHBondContact O-CB 3.36Å; K449-L453 VanDerWaalsContact O-CG 3.23Å; K449-L453 WeakPolarHBondContact O-CG 3.33Å; K449-L453 PolarHBondContact O-N 3.01Å
450L75.7Confident72.1Confident126 Ų126126.8 Ų126.866%0.6660%0.602SS**Hα-helixtrans-69.3-40.2176.1-163.478.4000111.3Q446 E447 R448 L453 A454Q446-L450 WeakPolarHBondContact O-CB 3.4Å; Q446-L450 PolarHBondContact O-N 3.43Å; E447-L450 CarbonylContact O-C 3.59Å; E447-L450 WeakPolarHBondContact O-CA 3.34Å; E447-L450 WeakPolarHBondContact O-CB 3.46Å; E447-L450 PolarHBondContact O-N 3.24Å; E447-L450 VanDerWaalsContact O-N 3.09Å; R448-L450 VanDerWaalsContact C-N 3.32Å; L450-L453 PolarHBondContact O-N 2.96Å; L450-A454 WeakPolarHBondContact O-CB 3.49Å; L450-A454 PolarHBondContact O-N 3.21Å
451Q76.2Confident69.5Low112 Ų112126.1 Ų126.152%0.52362%0.618SS.*Hα-helixtrans-65.3-43.6173.9-73.8171.4-2.900111.4E447 R448 L453 A454 E455E447-Q451 WeakPolarHBondContact O-CB 3.4Å; E447-Q451 WeakPolarHBondContact O-CG 3.33Å; E447-Q451 PolarHBondContact O-N 3.14Å; R448-Q451 PolarHBondContact O-N 2.83Å; Q451-L453 VanDerWaalsContact C-N 3.28Å; Q451-L453 PolarHBondContact O-N 3.37Å; Q451-A454 WeakPolarHBondContact O-CB 3.31Å; Q451-A454 PolarHBondContact O-N 2.93Å; Q451-A454 VanDerWaalsContact O-N 3.11Å; Q451-E455 WeakPolarHBondContact O-CB 3.4Å; Q451-E455 PolarHBondContact O-N 3.31Å
452E77.9Confident66.7Low94 Ų94124.8 Ų124.844%0.43964%0.635SS.*Hα-helixtrans-63.9-33.5176.2-165.1-168.8156.400112R448 K456R448-E452 WeakPolarHBondContact O-CB 3.4Å; R448-E452 PolarHBondContact O-N 3.05Å; E452-K456 WeakPolarHBondContact O-CB 3.22Å; E452-K456 WeakPolarHBondContact O-CG 3.41Å; E452-K456 PolarHBondContact O-N 3.45Å; E452-K456 IonicContact OE1-NZ 3.53Å; E452-K456 PolarHBondContact OE1-NZ 3Å
453L73.4Confident64.3Low122 Ų122124.2 Ų124.264%0.63965%0.645SS**Hα-helixtrans-74.1-32.3173-74.6170.6000112.8K449 L450 Q451 G457K449-L453 WeakPolarHBondContact O-CB 3.36Å; K449-L453 VanDerWaalsContact O-CG 3.23Å; K449-L453 WeakPolarHBondContact O-CG 3.33Å; K449-L453 PolarHBondContact O-N 3.01Å; L450-L453 PolarHBondContact O-N 2.96Å; Q451-L453 VanDerWaalsContact C-N 3.28Å; Q451-L453 PolarHBondContact O-N 3.37Å; L453-G457 PolarHBondContact O-N 3.41Å
454A72.1Confident61.7Low71 Ų71125.9 Ų125.959%0.58766%0.658SS**Hα-helixtrans-69.3-4117300000111.1L450 Q451 G457L450-A454 WeakPolarHBondContact O-CB 3.49Å; L450-A454 PolarHBondContact O-N 3.21Å; Q451-A454 WeakPolarHBondContact O-CB 3.31Å; Q451-A454 PolarHBondContact O-N 2.93Å; Q451-A454 VanDerWaalsContact O-N 3.11Å; A454-G457 PolarHBondContact O-N 3.47Å; A454-G457 VanDerWaalsContact O-N 3.08Å
455E64.6Low59.3Low162 Ų162126.7 Ų126.776%0.75767%0.67SS**Hα-helixtrans-68.6-36.5176.7-166.2178.2-178.600112Q451 G457Q451-E455 WeakPolarHBondContact O-CB 3.4Å; Q451-E455 PolarHBondContact O-N 3.31Å; E455-G457 PolarHBondContact O-N 3.07Å
456K60.1Low57.3Low142 Ų142129 Ų12962%0.61769%0.691SS**THydrogen-bonded Turntrans-74.8-6.3170.2-79.3170.8175.3161.60114.1E452 E458E452-K456 WeakPolarHBondContact O-CB 3.22Å; E452-K456 WeakPolarHBondContact O-CG 3.41Å; E452-K456 PolarHBondContact O-N 3.45Å; E452-K456 IonicContact OE1-NZ 3.53Å; E452-K456 PolarHBondContact OE1-NZ 3Å; K456-E458 VanDerWaalsContact C-N 3.3Å; K456-E458 PolarHBondContact O-N 3.3Å
457G49Very low55.2Low60 Ų60127.6 Ų127.662%0.61969%0.692SS**THydrogen-bonded Turntrans-74.8-13.7-179.100000114.8L453 A454 E455L453-G457 PolarHBondContact O-N 3.41Å; A454-G457 PolarHBondContact O-N 3.47Å; A454-G457 VanDerWaalsContact O-N 3.08Å; E455-G457 PolarHBondContact O-N 3.07Å
458E45.2Very low52.8Low171 Ų171131.2 Ų131.280%0.79971%0.709SS**SBendtrans-107.61.5-165.2-145.4149.3-145.800115.6K456K456-E458 VanDerWaalsContact C-N 3.3Å; K456-E458 PolarHBondContact O-N 3.3Å
459L33.1Very low50.2Low168 Ų168130.4 Ų130.488%0.8873%0.725SS**  trans-137.2103.5174-65.2172.3000111.7
460R36.5Very low48.3Very low249 Ų249131.8 Ų131.894%0.9474%0.737SS**  trans-92.8131.7174.1-94.1-160.1-173.3-114.23.4112.6
461S35.2Very low46.1Very low125 Ų125134.3 Ų134.387%0.87475%0.747SS**  trans83.1111.2139.6-138.60000119.7
462G31.3Very low43.8Very low78 Ų78134.7 Ų134.780%0.80476%0.763SS**  trans-178.784.3165.800000110.9
463S34.9Very low42Very low105 Ų105138.6 Ų138.673%0.73479%0.786SS**  trans-51.4141.8179.7165.60000114.7
464L32.8Very low39.9Very low168 Ų168136 Ų13688%0.8879%0.788SS**  -176.2123.5117.2-88.6169.1000110.2
465T36.2Very low38.2Very low122 Ų122139 Ų13975%0.74880%0.799SS**  trans-84.2165.3177490000111.9
466P40.1Very low36.6Very low118 Ų118140.5 Ų140.577%0.76681%0.806SS**  -135.2128.68521.6-0.5000113
467T32.3Very low35.2Very low111 Ų111138.2 Ų138.268%0.68181%0.808SS**  64.310699.3-41.70000111.3
468E33.4Very low34.4Very low185 Ų185146 Ų14686%0.86482%0.818SS**  -166.1112.681.342.3-145.9132.800112.6
469S31.7Very low33.6Very low127 Ų127147.2 Ų147.289%0.88882%0.821SS**  trans-134.1107.2169.8-159.70000107.5
470I41.8Very low33.5Very low152 Ų152143.7 Ų143.778%0.77981%0.811SS**  trans-93.4122.6176.7-50177.1000107
471M30Very low33.3Very low178 Ų178140.3 Ų140.388%0.87781%0.806SS**  trans129.869.3156.3-61.3-100.498.500111.3
472S27.3Very low33Very low121 Ų121143 Ų14385%0.84680%0.802SS**  trans-104.2133.5149.9-174.90000109
473L40.2Very low33.3Very low176 Ų176144.6 Ų144.692%0.92180%0.796SS**  trans-54.5133.3176.6-69.8149000111.4
474G30.1Very low33.1Very low66 Ų66143.1 Ų143.168%0.6880%0.797SS**  trans-144.891.7-179.600000111.4H476G474-H476 PolarHBondContact O-N 3.06Å
475T36.2Very low32.8Very low135 Ų135144.6 Ų144.683%0.82880%0.797SS**  trans-43.5116.1166.9-15.50000112.8
476H31.7Very low32.5Very low194 Ų194143.4 Ų143.490%0.89879%0.794SS**  trans-145.7134.2154.9-75.9-67.2000112G474G474-H476 PolarHBondContact O-N 3.06Å
477S30.3Very low32.1Very low93 Ų93141.2 Ų141.265%0.6579%0.793SS**  trans-89161.3-171.270.40000113.8
478R32.2Very low32.2Very low223 Ų223144.5 Ų144.584%0.84280%0.803SS**  trans89.4101.8152.9-63.9170.7175162.50.6117.3
479F28.9Very low31.9Very low197 Ų197140.9 Ų140.986%0.86480%0.798SS**  178.8112.1105.7-108.6-92.7000108.3
480S30.2Very low32.1Very low94 Ų94144.4 Ų144.466%0.65780%0.797SS**  70.6100.7114-175.80000113.2
481E32.3Very low31.5Very low178 Ų178142.5 Ų142.583%0.83280%0.798SS**  107107.672.3-173.9173.6-161.700108.7
482F28.1Very low31.7Very low182 Ų182138.9 Ų138.980%0.79879%0.79SS**  trans-178104131.4-164.1-113.7000110.5
483T37.5Very low32Very low111 Ų111144.6 Ų144.668%0.68179%0.793SS**  trans50.3130.3149.365.90000119.7
484G30.7Very low31.6Very low74 Ų74141.5 Ų141.576%0.76379%0.786SS**  cis161.2143.79.500000108.7
485F27Very low31.9Very low200 Ų200149.6 Ų149.688%0.87780%0.798SS**  trans85.796.8156.2-140.6-104.5000120.2
486S30.8Very low32.3Very low96 Ų96151 Ų15167%0.67180%0.799SS**  84.7132.3123-63.80000121.9
487G31.5Very low32.8Very low73 Ų73147.3 Ų147.375%0.75379%0.792SS**  trans130.387.3140.900000114.5S489G487-S489 PolarHBondContact O-N 3.01Å
488M33.8Very low33.7Very low180 Ų180152.1 Ų152.189%0.88781%0.805SS**  trans-59.3129.3161.9-63.3-174.272.500109.9
489S27.3Very low34.7Very low109 Ų109150 Ų15076%0.76280%0.802SS**  trans-155.5114152.3-169.50000109.6G487 S491G487-S489 PolarHBondContact O-N 3.01Å; S489-S491 PolarHBondContact O-N 3.31Å
490F35.3Very low35.6Very low200 Ų200149.2 Ų149.288%0.87781%0.805SS**  trans-69.5112.3163.7-90.7-100.5000107.8
491S30.6Very low36.7Very low112 Ų112153.8 Ų153.878%0.78382%0.816SS**  trans-141.1125.3157-162.80000109.5S489S489-S491 PolarHBondContact O-N 3.31Å
492S32.7Very low37.8Very low102 Ų102151.3 Ų151.371%0.71381%0.808SS**  trans-71.8153.4-174.5-49.70000112.5
493R35.1Very low38.8Very low242 Ų242149.4 Ų149.491%0.91381%0.811SS**  trans84.1100.4157.9-58.5176.5176.6-101.8-2.8117.6
494S30.6Very low39.6Very low111 Ų111152.3 Ų152.378%0.77681%0.814SS**  -179.9101.7116.350.70000110.4
495Y36.2Very low40.4Very low236 Ų236154.3 Ų154.393%0.92581%0.813SS**  trans-118.697162.9-78.2-75.6000108.6
496L44.7Very low41.7Very low163 Ų163153.3 Ų153.385%0.85382%0.816SS**  trans-80.4128.5156.8-158.885.4000106.3E498L496-E498 PolarHBondContact O-N 2.73Å
497P42.1Very low43Very low117 Ų117157.6 Ų157.676%0.7683%0.826SS**  trans-70.7114179.7-18.931.8000112.1K499P497-K499 PolarHBondContact O-N 3.25Å
498E50.1Low44.2Very low194 Ų194157.2 Ų157.291%0.90782%0.821SS**  trans-75.355.7170.7-167.8-175.3176.500111.4L496L496-E498 PolarHBondContact O-N 2.73Å
499K52.8Low45.8Very low180 Ų180151.9 Ų151.978%0.78380%0.802SS**  trans-149.255.7174.3-69.4-168.2-179.2178.30112.8P497P497-K499 PolarHBondContact O-N 3.25Å
500L48.7Very low47.6Very low179 Ų179150.8 Ų150.894%0.93780%0.799SS**  trans-132.439.9154.2-72.6178.4000111
501Q53.2Low49.2Very low191 Ų191145.4 Ų145.489%0.89378%0.783SS**  trans-102.377157.7-163.3177.316.800107.8
502I54.6Low51Low126 Ų126144.8 Ų144.865%0.64677%0.77SS**  trans-126.178.5165.6-52.8178000107K504I502-K504 VanDerWaalsContact C-N 3.29Å; I502-K504 HydrophobicContact CG2-CB 3.77Å; I502-K504 HydrophobicContact CG2-CD 4.27Å; I502-K504 HydrophobicContact CG2-CG 3.81Å; I502-K504 PolarHBondContact O-N 3.27Å
503V49.7Very low52.7Low142 Ų142145.3 Ų145.386%0.86176%0.761SS**  trans-80.894.1143.31780000104.4
504K54.7Low54.3Low171 Ų171138.7 Ų138.774%0.74374%0.74SS**  trans-83.1120.6167.1-114.6-175.5175.7-178.30106.9I502 L506I502-K504 VanDerWaalsContact C-N 3.29Å; I502-K504 HydrophobicContact CG2-CB 3.77Å; I502-K504 HydrophobicContact CG2-CD 4.27Å; I502-K504 HydrophobicContact CG2-CG 3.81Å; I502-K504 PolarHBondContact O-N 3.27Å; K504-L506 PolarHBondContact O-N 3.41Å
505P47.1Very low55.8Low116 Ų116141.6 Ų141.675%0.75374%0.735SS**  trans-60.5134.3170.425.7-30.5000108.5E507P505-E507 PolarHBondContact O-N 3.43Å; P505-E507 VanDerWaalsContact O-N 3.08Å
506L53.6Low57.7Low179 Ų179135.4 Ų135.494%0.93771%0.714SS**  trans-67.2100.1179.7-70.8158.4000109.4K504K504-L506 PolarHBondContact O-N 3.41Å
507E57.8Low58.7Low187 Ų187132.7 Ų132.787%0.87470%0.697SS**  trans-134.1122.8154.5-152.1168.4-171.800106.9P505P505-E507 PolarHBondContact O-N 3.43Å; P505-E507 VanDerWaalsContact O-N 3.08Å
508G57.5Low60Low64 Ų64132.4 Ų132.466%0.6669%0.688SS**  trans-57.7135.7-148.800000116.3
509S67.3Low60.6Low68 Ų68127 Ų12748%0.47668%0.677SS.*  trans-69.2141.9162.562.50000109.4T511 L512 H513S509-T511 PolarHBondContact O-N 3.41Å; S509-T511 VanDerWaalsContact O-N 3.11Å; S509-L512 WeakPolarHBondContact O-CA 3.36Å; S509-L512 WeakPolarHBondContact O-CB 3.32Å; S509-L512 PolarHBondContact O-N 3.22Å; S509-L512 WeakPolarHBondContact OG-CB 3.36Å; S509-L512 PolarHBondContact OG-N 3.47Å; S509-H513 PolarHBondContact O-N 3.04Å
510A64.3Low60.9Low86 Ų86123.8 Ų123.871%0.71167%0.665SS**Hα-helixtrans-54.5-29.4173.100000111.8H513 H514A510-H513 PolarHBondContact O-N 2.67Å; A510-H514 VanDerWaalsContact O-CB 3.24Å; A510-H514 WeakPolarHBondContact O-CB 3.23Å; A510-H514 PolarHBondContact O-N 3.24Å
511T70.2Confident60.9Low88 Ų88121 Ų12154%0.5466%0.657SS.*Hα-helixtrans-64-51.5169.9-42.30000111.2S509 H513 H514 W515S509-T511 PolarHBondContact O-N 3.41Å; S509-T511 VanDerWaalsContact O-N 3.11Å; T511-H513 PolarHBondContact O-N 2.64Å; T511-H514 WeakPolarHBondContact O-CB 3.49Å; T511-H514 PolarHBondContact O-N 3.37Å; T511-H514 VanDerWaalsContact O-N 3.11Å; T511-W515 WeakPolarHBondContact O-CB 3.38Å; T511-W515 PolarHBondContact O-N 3.24Å
512L68.6Low60.9Low99 Ų99118 Ų11852%0.51864%0.643SS.*Hα-helixtrans-58.4-39.8175.7-167.486.8000111.5S509 W515 Q516S509-L512 WeakPolarHBondContact O-CA 3.36Å; S509-L512 WeakPolarHBondContact O-CB 3.32Å; S509-L512 PolarHBondContact O-N 3.22Å; S509-L512 WeakPolarHBondContact OG-CB 3.36Å; S509-L512 PolarHBondContact OG-N 3.47Å; L512-W515 PolarHBondContact O-N 3Å; L512-Q516 WeakPolarHBondContact O-CB 3.29Å; L512-Q516 PolarHBondContact O-N 3Å
513H68.7Low61Low112 Ų112118.9 Ų118.952%0.51965%0.648SS.*Hα-helixtrans-67-36.4177.3-158.6-78.2000112.5S509 A510 T511 Q517S509-H513 PolarHBondContact O-N 3.04Å; A510-H513 PolarHBondContact O-N 2.67Å; T511-H513 PolarHBondContact O-N 2.64Å; H513-Q517 WeakPolarHBondContact O-CB 3.45Å; H513-Q517 PolarHBondContact O-N 3.35Å
514H67.9Low61.4Low103 Ų103115.1 Ų115.148%0.47764%0.638SS.*Hα-helixtrans-68.1-44.4174.1-178.765.1000111.6A510 T511 Q516 Q517 L518A510-H514 VanDerWaalsContact O-CB 3.24Å; A510-H514 WeakPolarHBondContact O-CB 3.23Å; A510-H514 PolarHBondContact O-N 3.24Å; T511-H514 WeakPolarHBondContact O-CB 3.49Å; T511-H514 PolarHBondContact O-N 3.37Å; T511-H514 VanDerWaalsContact O-N 3.11Å; H514-Q516 VanDerWaalsContact C-N 3.34Å; H514-Q517 PolarHBondContact O-N 2.82Å; H514-L518 VanDerWaalsContact O-CG 3.31Å; H514-L518 WeakPolarHBondContact O-CG 3.3Å; H514-L518 PolarHBondContact O-N 3.14Å
515W62.5Low61.3Low173 Ų173109.2 Ų109.266%0.65563%0.626SS**Hα-helixtrans-68.4-33.8175.8-75.166.5000111.8T511 L512 L518 A519T511-W515 WeakPolarHBondContact O-CB 3.38Å; T511-W515 PolarHBondContact O-N 3.24Å; L512-W515 PolarHBondContact O-N 3Å; W515-L518 PolarHBondContact O-N 2.62Å; W515-A519 WeakPolarHBondContact O-CB 3.37Å; W515-A519 PolarHBondContact O-N 2.88Å
516Q74.8Confident61.7Low106 Ų106109.2 Ų109.250%0.49562%0.619SS.*Hα-helixtrans-69.6-35.4173.6-174170.813.400112L512 H514 A519 Q520L512-Q516 WeakPolarHBondContact O-CB 3.29Å; L512-Q516 PolarHBondContact O-N 3Å; H514-Q516 VanDerWaalsContact C-N 3.34Å; Q516-A519 PolarHBondContact O-N 2.89Å; Q516-Q520 WeakPolarHBondContact O-CG 3.44Å; Q516-Q520 PolarHBondContact O-N 3.33Å; Q516-Q520 VanDerWaalsContact O-N 3.1Å
517Q67.4Low61.7Low106 Ų106107.5 Ų107.550%0.49561%0.61SS.*Hα-helixtrans-65-42.2170.1-85.9178-11.100111.8H513 H514 A519 Q520H513-Q517 WeakPolarHBondContact O-CB 3.45Å; H513-Q517 PolarHBondContact O-N 3.35Å; H514-Q517 PolarHBondContact O-N 2.82Å; Q517-A519 VanDerWaalsContact C-N 3.29Å; Q517-A519 PolarHBondContact O-N 2.95Å; Q517-Q520 PolarHBondContact O-N 3.14Å
518L68.6Low61.7Low110 Ų110104.4 Ų104.458%0.57660%0.599SS**Hα-helixtrans-69.2-27.5176.4-67.8171.9000113H514 W515H514-L518 VanDerWaalsContact O-CG 3.31Å; H514-L518 WeakPolarHBondContact O-CG 3.3Å; H514-L518 PolarHBondContact O-N 3.14Å; W515-L518 PolarHBondContact O-N 2.62Å
519A62.1Low61.4Low80 Ų80107.3 Ų107.366%0.66161%0.606SS**THydrogen-bonded Turntrans-89.2-6178.800000113.7W515 Q516 Q517 P521W515-A519 WeakPolarHBondContact O-CB 3.37Å; W515-A519 PolarHBondContact O-N 2.88Å; Q516-A519 PolarHBondContact O-N 2.89Å; Q517-A519 VanDerWaalsContact C-N 3.29Å; Q517-A519 PolarHBondContact O-N 2.95Å; A519-P521 WeakPolarHBondContact O-CD 3.49Å
520Q60Low60.9Low113 Ų113113.4 Ų113.453%0.52862%0.619SS.*SBendtrans-77.4120.7169.7-81.9178.88.200108.9Q516 Q517 H522Q516-Q520 WeakPolarHBondContact O-CG 3.44Å; Q516-Q520 PolarHBondContact O-N 3.33Å; Q516-Q520 VanDerWaalsContact O-N 3.1Å; Q517-Q520 PolarHBondContact O-N 3.14Å; Q520-H522 PolarHBondContact O-CD2 2.92Å; Q520-H522 VanDerWaalsContact O-CD2 3.3Å; Q520-H522 PolarHBondContact O-N 3.3Å
521P48.4Very low60Low121 Ų121115.8 Ų115.879%0.78663%0.627SS**  trans-71.393.5179.428.8-32.8000109.6A519 L523A519-P521 WeakPolarHBondContact O-CD 3.49Å; P521-L523 PolarHBondContact O-N 2.96Å
522H52.8Low59.4Low127 Ų127115.5 Ų115.559%0.58864%0.641SS**  trans-79.5106.9164.131.365.9000108.3Q520 G524 G525Q520-H522 PolarHBondContact O-CD2 2.92Å; Q520-H522 VanDerWaalsContact O-CD2 3.3Å; Q520-H522 PolarHBondContact O-N 3.3Å; H522-G524 PolarHBondContact O-N 3.45Å; H522-G525 PolarHBondContact O-N 2.88Å
523L56.3Low58.6Low146 Ų146115.7 Ų115.776%0.76465%0.646SS**G310 helixtrans-56.2-6.9176.3-78.8126000114.2P521 G525P521-L523 PolarHBondContact O-N 2.96Å; L523-G525 VanDerWaalsContact C-N 3.3Å; L523-G525 PolarHBondContact O-N 3.47Å
524G58.9Low58.2Low63 Ų63116.7 Ų116.765%0.64966%0.66SS**G310 helixtrans-71.9-15.2177.300000115.1H522H522-G524 PolarHBondContact O-N 3.45Å
525G52.9Low57.7Low47 Ų47115.1 Ų115.149%0.48566%0.658SS.*G310 helixtrans-92.81.3-179.600000115.5H522 L523 L527H522-G525 PolarHBondContact O-N 2.88Å; L523-G525 VanDerWaalsContact C-N 3.3Å; L523-G525 PolarHBondContact O-N 3.47Å; G525-L527 VanDerWaalsContact C-N 3.33Å
526I56Low57Low116 Ų116117.4 Ų117.460%0.59567%0.673SS**SBendtrans-78.2-19.9179.3-102.3168.5000112.5
527L53.8Low56Low143 Ų143115.9 Ų115.975%0.74969%0.686SS**SBendtrans-104.7-8.3-176.3-60.5178.3000113.5G525 P529G525-L527 VanDerWaalsContact C-N 3.33Å; L527-P529 WeakPolarHBondContact O-CD 3.42Å
528D56.4Low54.8Low121 Ų121117.8 Ų117.865%0.64769%0.693SS**SBendtrans-84.8117.8176-95.5-8000109.8R530D528-R530 PolarHBondContact O-N 3.4Å
529P51.2Low53.7Low126 Ų126123.8 Ų123.882%0.81871%0.708SS**  trans-68.2108.8177.826.7-31.2000109.6L527L527-P529 WeakPolarHBondContact O-CD 3.42Å
530R56.3Low52.7Low195 Ų195126.3 Ų126.374%0.73672%0.715SS**  trans-89.2126.8168.7-78.4-174179.4-153.7-0.6109.6D528 G532 V533D528-R530 PolarHBondContact O-N 3.4Å; R530-G532 PolarHBondContact O-N 3.18Å; R530-V533 PolarHBondContact O-N 3.34Å
531P46Very low51.8Low136 Ų136128.3 Ų128.388%0.88373%0.728SS**THydrogen-bonded Turntrans-54.6123.7178.1-23.232.1000110.8
532G58.3Low51.4Low82 Ų82130.6 Ų130.685%0.84573%0.734SS**THydrogen-bonded Turntrans92-0175.600000116.9R530R530-G532 PolarHBondContact O-N 3.18Å
533V52.3Low51Low103 Ų103129.5 Ų129.562%0.62474%0.736SS**  trans-115.599.2177.2-174.80000110.5R530R530-V533 PolarHBondContact O-N 3.34Å
534V58.8Low49.9Very low133 Ų133128.9 Ų128.981%0.80673%0.733SS**  trans-90.7114.5172.8-171.90000108.6K536V534-K536 PolarHBondContact O-N 3.48Å
535T57.7Low49Very low71 Ų71133.3 Ų133.344%0.43674%0.742SS.*  trans-71.4122.6174.2510000109.4G537 F538T535-G537 PolarHBondContact O-N 2.93Å; T535-F538 PolarHBondContact O-N 2.98Å; T535-F538 VanDerWaalsContact OG1-CD2 3.24Å; T535-F538 WeakPolarHBondContact OG1-CD2 3.42Å
536K47.5Very low48.4Very low220 Ų220138 Ų13896%0.95776%0.756SS**THydrogen-bonded Turntrans-63.297.7-177.4-173.3172.7-177.6173.40110.2V534V534-K536 PolarHBondContact O-N 3.48Å
537G54.3Low47.6Very low75 Ų75140.7 Ų140.777%0.77377%0.766SS**THydrogen-bonded Turntrans138.4-10.7175.400000116.2T535T535-G537 PolarHBondContact O-N 2.93Å
538F43.3Very low46.8Very low146 Ų146139.9 Ų139.964%0.6477%0.766SS**  trans-91119.3177.4-79.4-94.9000111.2T535T535-F538 PolarHBondContact O-N 2.98Å; T535-F538 VanDerWaalsContact OG1-CD2 3.24Å; T535-F538 WeakPolarHBondContact OG1-CD2 3.42Å
539R44.8Very low45.8Very low236 Ų236142.9 Ų142.989%0.89177%0.77SS**  trans-101112.4157.8-57.2-161.5-174.2-830.9106.1L541R539-L541 PolarHBondContact O-N 3.35Å
540T41Very low44.8Very low132 Ų132142.9 Ų142.981%0.8177%0.771SS**  trans-65.5112.4165.932.20000107.3D542T540-D542 PolarHBondContact O-N 3Å
541L41.7Very low44Very low156 Ų156140.7 Ų140.782%0.81777%0.773SS**  trans-67.4113.3158.5-88152.8000105.7R539 V543R539-L541 PolarHBondContact O-N 3.35Å; L541-V543 VanDerWaalsContact C-N 3.32Å; L541-V543 HydrophobicContact CB-CG2 4.21Å; L541-V543 PolarHBondContact O-N 3.14Å
542D38.9Very low44Very low168 Ų168140.9 Ų140.990%0.89877%0.767SS**  trans-62.7100164.4-89.5-19.8000107.4T540T540-D542 PolarHBondContact O-N 3Å
543V43.8Very low43Very low104 Ų104144.7 Ų144.763%0.6377%0.768SS**  trans-120.9128.1166.9177.30000104.2L541L541-V543 VanDerWaalsContact C-N 3.32Å; L541-V543 HydrophobicContact CB-CG2 4.21Å; L541-V543 PolarHBondContact O-N 3.14Å
544D35Very low42.6Very low133 Ų133148.5 Ų148.571%0.71178%0.776SS**  trans10265.7175.5-50.4-24.9000116.4
545L38.2Very low41.9Very low157 Ų157151.2 Ų151.282%0.82278%0.781SS**  -119.287.3124-128.779.1000107.8E547L545-E547 VanDerWaalsContact C-N 3.27Å; L545-E547 PolarHBondContact O-N 3.38Å
546D40.8Very low41.5Very low146 Ų146157.4 Ų157.478%0.78180%0.804SS**  trans-63.788.9162.3-105.9-13.7000108.1
547E38.6Very low41.4Very low172 Ų172154.3 Ų154.380%0.80480%0.799SS**  trans-104.2105.4156.8-90.5-177.3171.100109.2L545 Y549L545-E547 VanDerWaalsContact C-N 3.27Å; L545-E547 PolarHBondContact O-N 3.38Å; E547-Y549 PolarHBondContact O-N 3.31Å
548V38.8Very low40.7Very low125 Ų125157.4 Ų157.476%0.75880%0.797SS**  trans-70115.3-177.1172.60000110.7
549Y34.3Very low40.5Very low184 Ų184156.3 Ų156.372%0.72280%0.803SS**  trans41135.2147.1-89.8-93.7000121.5E547 L551E547-Y549 PolarHBondContact O-N 3.31Å; Y549-L551 HydrophobicContact CD1-CD1 3.98Å; Y549-L551 HydrophobicContact CD1-CG 4.3Å; Y549-L551 HydrophobicContact CE1-CD1 3.67Å; Y549-L551 HydrophobicContact CE1-CG 4.18Å
550C31.1Very low39.9Very low127 Ų127148.2 Ų148.286%0.85879%0.792SS**  -151.1122.3122.5-94.90000112.6N552C550-N552 VanDerWaalsContact C-N 3.34Å; C550-N552 PolarHBondContact O-N 3.36Å; C550-N552 VanDerWaalsContact O-N 3.11Å
551L39.7Very low39.5Very low148 Ų148148.6 Ų148.678%0.77579%0.79SS**  trans-75.472.4170.5-90.9145.4000110.4Y549Y549-L551 HydrophobicContact CD1-CD1 3.98Å; Y549-L551 HydrophobicContact CD1-CG 4.3Å; Y549-L551 HydrophobicContact CE1-CD1 3.67Å; Y549-L551 HydrophobicContact CE1-CG 4.18Å
552N44.9Very low39.1Very low140 Ų140149 Ų14975%0.74979%0.787SS**  trans-179.283.2163.6-94.2-7.5000110.6C550C550-N552 VanDerWaalsContact C-N 3.34Å; C550-N552 PolarHBondContact O-N 3.36Å; C550-N552 VanDerWaalsContact O-N 3.11Å
553D37Very low38.8Very low163 Ų163147.8 Ų147.887%0.87278%0.779SS**  trans-142.8134.8139.7-144.5-5.8000110.4
554F44.4Very low38.1Very low182 Ų182148.5 Ų148.580%0.79879%0.788SS**  trans-82.6154-164.9-88-104.1000111.4
555E43.9Very low37.9Very low191 Ų191150 Ų15089%0.89380%0.795SS**  trans-50.3131.1166.4-67.9170.4140.800111.6
556E49.5Very low37.8Very low200 Ų200148.1 Ų148.194%0.93579%0.793SS**  trans-141.4129.8147.7-125.4173.9-169.400109.5
557D44.8Very low37.1Very low156 Ų156152.8 Ų152.883%0.83480%0.8SS**  trans-93169.8-172-163.48.6000110.7
558D41.1Very low36.6Very low140 Ų140152.7 Ų152.775%0.74980%0.804SS**  trans76.9125.8179.1-96.3-16.9000116.5
559T38.2Very low36.1Very low123 Ų123150.8 Ų150.876%0.75580%0.801SS**  cis-163.6153.820.6220000109.3
560G32.7Very low35.7Very low65 Ų65148 Ų14867%0.6780%0.804SS**  trans96105.8142.500000118.5
561D32.4Very low35.6Very low141 Ų141146.5 Ų146.575%0.75479%0.794SS**  trans63.2105.1145-55.6-28000119.5
562H32.5Very low35.2Very low164 Ų164145.9 Ų145.976%0.75980%0.797SS**  154.3123.8112-81.3-65.9000112.6
563I33.4Very low34.9Very low142 Ų142144.4 Ų144.473%0.72880%0.795SS**  trans76.396.4144.6-53.6160.3000116.8L565I563-L565 HydrophobicContact CG2-CG 4.38Å
564S28.6Very low34.4Very low119 Ų119142.1 Ų142.183%0.83279%0.787SS**  trans-80120155.1-52.70000110.3
565L30.7Very low33.7Very low164 Ų164141.8 Ų141.886%0.85979%0.788SS**  trans-105123.7158.1-83.2168.7000109I563I563-L565 HydrophobicContact CG2-CG 4.38Å
566P36.1Very low33.1Very low119 Ų119141 Ų14177%0.77378%0.784SS**  trans-100.5128.8166.230.1-19.3000112.1
567R27.1Very low32.6Very low243 Ų243137.4 Ų137.492%0.91778%0.778SS**  trans-35.6130.1159.3-166.7179.4-159.3153.53.6114.4
568L28.1Very low31.8Very low170 Ų170138.3 Ų138.389%0.8978%0.777SS**  trans-83.5131161.2-101.9143.8000110.2
569A27.6Very low31.2Very low86 Ų86137.4 Ų137.471%0.71178%0.776SS**  trans-172124.513800000112.6
570T25.4Very low30.8Very low126 Ų126137.1 Ų137.177%0.77378%0.779SS**  trans95.8118.2136.1-52.80000120.2
571S29.3Very low30.6Very low94 Ų94137.7 Ų137.766%0.65779%0.786SS**  trans102112.4133.166.80000122.3
572T30.8Very low30.4Very low135 Ų135139.4 Ų139.483%0.82879%0.789SS**  trans74.7157.1132.537.80000121.4
573P38.8Very low30.3Very low110 Ų110141.5 Ų141.571%0.71479%0.79SS**  trans-115.7-170-133.426.9-4000113.4
574V27.9Very low30.3Very low114 Ų114138.9 Ų138.969%0.69179%0.785SS**  trans107136.1148.8-177.60000116.9
575Q30Very low30.4Very low176 Ų176141.8 Ų141.882%0.82279%0.785SS**  trans95.2101.3153.8-89.5157.342.600120.2
576H30Very low30.2Very low175 Ų175138.4 Ų138.481%0.8178%0.781SS**  trans-46.1154.8136.1-77.7-93.4000111.5
577P39.1Very low30Very low124 Ų124144.1 Ų144.181%0.80579%0.787SS**  -138151.4106.731.8-16.8000114.7
578E27.5Very low30.1Very low174 Ų174139.2 Ų139.281%0.81378%0.783SS**  trans-72147.8169.9-49.6-172.4144.900112.4
579T29.1Very low30.2Very low121 Ų121137.2 Ų137.274%0.74278%0.779SS**  trans-170108.4141.2142.30000107.1
580S28.9Very low30.4Very low117 Ų117139.9 Ų139.982%0.81879%0.786SS**  79.1124.782.984.70000114.1
581G29.2Very low30.7Very low78 Ų78139.5 Ų139.580%0.80479%0.788SS**  trans168.382.5179.900000114.6
582E29Very low30.7Very low176 Ų176138.3 Ų138.382%0.82279%0.791SS**  trans-27161.1153.3-78.7176.4118.100116.1
583R29.6Very low30.8Very low208 Ų208138.1 Ų138.179%0.78580%0.795SS**  cis172.31570.1176.5-165.8173.7165.2-0.7105.1
584S33.2Very low30.5Very low88 Ų88142.9 Ų142.962%0.61580%0.799SS**  trans76.4144.3162.7-570000116.3
585Q30.3Very low30.6Very low180 Ų180143.4 Ų143.484%0.84181%0.807SS**  cis-168.9150.811.7-127.8168.9-13.500110.1
586A28.2Very low30.8Very low92 Ų92144.1 Ų144.176%0.7680%0.804SS**  trans60.5113139.100000123
587R30.6Very low31.4Very low240 Ų240141.3 Ų141.391%0.90680%0.801SS**  trans-4.9136.3136.8-62.7177.8166.7-165.4-5.1117.7
588V29.1Very low30.9Very low139 Ų139141.4 Ų141.484%0.84281%0.805SS**  -153.7133.3129.6169.30000110.1
589T31.1Very low31.1Very low129 Ų129144.4 Ų144.479%0.79181%0.809SS**  trans-78.5140.1168.646.10000112.1
590V31.6Very low31.6Very low142 Ų142143.8 Ų143.886%0.86181%0.807SS**  trans-143.2132.7151.5175.80000110.3
591S32.5Very low31.5Very low117 Ų117147.6 Ų147.682%0.81881%0.811SS**  trans-84.6162.2177.8-58.60000113.6
592G28.8Very low31.5Very low70 Ų70148.9 Ų148.972%0.72281%0.814SS**  trans109.1127.8160.600000112
593S32.2Very low31.5Very low130 Ų130145.8 Ų145.891%0.90981%0.813SS**  cis-160.3157.834.9-67.90000112.2
594R33.1Very low32Very low211 Ų211141.9 Ų141.980%0.79681%0.814SS**  trans-69.4136.5177.9-178.7-175.6-168.5-173.92.6112.5Y596R594-Y596 HydrophobicContact CG-CE2 4.46Å
595S29.4Very low31.8Very low124 Ų124147 Ų14787%0.86783%0.828SS**  trans-160.8144.7137.6-132.30000112.2
596Y35.2Very low31.8Very low191 Ų191147.8 Ų147.875%0.74983%0.832SS**  trans-89.7172.4-171.3-87.7-83.1000112.5R594R594-Y596 HydrophobicContact CG-CE2 4.46Å
597P41.2Very low32Very low116 Ų116151.4 Ų151.475%0.75384%0.835SS**  trans-95.2156.6-156.837.7-34.4000113.8
598S29Very low31.9Very low127 Ų127148.7 Ų148.789%0.88883%0.833SS**  trans-125.2128.2165.2-68.70000109.8
599R32.4Very low32.1Very low237 Ų237150.9 Ų150.989%0.89483%0.834SS**  trans-99176.8170-153.2-156.3167.7166.7-2.5108.2
600P39.6Very low32.5Very low107 Ų107149.9 Ų149.970%0.69583%0.829SS**  -100.8158.1-10336.4-19.4000112.5
601Q27.3Very low32.9Very low197 Ų197149 Ų14992%0.92183%0.826SS**  trans-123.4130.9167.4-127.8179.5-27.900109.7
602A29.2Very low32.6Very low105 Ų105148.2 Ų148.287%0.86883%0.827SS**  trans-67.6144.8176.700000111.3
603S28.4Very low32.7Very low112 Ų112149.1 Ų149.178%0.78383%0.828SS**  trans-116150.2168.949.50000109.8
604P39.5Very low32.6Very low125 Ų125149.9 Ų149.981%0.81283%0.827SS**PPolyproline II helixtrans-88.3153-178.524.3-10.4000112.7
605E29.4Very low32.5Very low197 Ų197148.4 Ų148.492%0.92183%0.829SS**PPolyproline II helixtrans-62.3128.6165.9-81.5163.7128.200111
606E29.4Very low32.7Very low196 Ų196152.2 Ų152.292%0.91683%0.834SS**PPolyproline II helixtrans-103.3119.3159.1-100.1178.8162.300107.9
607M32.4Very low32.5Very low167 Ų167152.1 Ų152.182%0.82384%0.84SS**PPolyproline II helixtrans-78.7136.9167.7-79.3167.8149.300109.3
608Q29.9Very low32.1Very low183 Ų183155.5 Ų155.586%0.85585%0.845SS**  trans-120.3116.2174.9-149.6165.837.700107.7
609E32.8Very low32.2Very low186 Ų186158.9 Ų158.987%0.86985%0.847SS**PPolyproline II helixtrans-83.8154.7175.2-115.5-166.1141.500111.8
610P39.9Very low32.2Very low107 Ų107156.5 Ų156.570%0.69585%0.846SS**PPolyproline II helixtrans-95.9172-177.638.7-31.3000113.1
611P38.5Very low31.9Very low123 Ų123161 Ų16180%0.79986%0.858SS**PPolyproline II helixtrans-94.4143.1-17735.2-31000114.8
612A28Very low32.1Very low102 Ų102160.8 Ų160.884%0.84386%0.857SS**  trans60.4125.1136.800000121.9
613A29.2Very low32.2Very low88 Ų88165.1 Ų165.173%0.72786%0.86SS**  trans-72.8157.817200000114.5
614T30.3Very low32.5Very low146 Ų146169.3 Ų169.390%0.89687%0.867SS**  trans-124.5117.8143.843.50000108.1
615E30.9Very low31.9Very low180 Ų180167 Ų16784%0.84187%0.866SS**  trans-70.3138.2170.9-59.9168.7162.200109.9
616E33.8Very low32Very low205 Ų205164 Ų16496%0.95887%0.867SS**  trans-143.3146.8142.9-77.3-160.1170.100109.1
617E32.2Very low32Very low188 Ų188158 Ų15888%0.87986%0.857SS**  trans-85.1156.3-150.5-61.7172.3149.400115.2
618E32.4Very low32.1Very low187 Ų187160 Ų16087%0.87487%0.865SS**  trans11.1135.1147.8-55.3-174.917100120.9
619E31.8Very low32.1Very low198 Ų198154.5 Ų154.593%0.92586%0.857SS**  -163.3133.4112.3-103.2179.9-167.500111
620E32.3Very low32Very low188 Ų188151.8 Ų151.888%0.87985%0.853SS**  trans-75.9143.3174.5-59.5-178.5151.100111.2
621E32.4Very low31.5Very low201 Ų201153.2 Ų153.294%0.93986%0.86SS**  trans-152.1131.4137.7-77-153.6157.400110.6
622E32.5Very low31.3Very low192 Ų192155.6 Ų155.690%0.89787%0.865SS**  trans-76.9136.3168.5-62.5-171.1153.900110.9
623E31.1Very low31.4Very low197 Ų197155.7 Ų155.792%0.92186%0.859SS**  trans-162135.8140.4-125.3-171.817800112.7
624E32.9Very low31.6Very low199 Ų199157.4 Ų157.493%0.9386%0.863SS**  trans-67143171.4-67.9-167.7147.600112.1
625G28.6Very low31.6Very low78 Ų78157 Ų15780%0.80486%0.859SS**  trans179.5100.2169.900000116.9
626S30.5Very low31.7Very low133 Ų133156.1 Ų156.193%0.9386%0.861SS**  trans-47.7137.6165152.80000114.8
627G29.6Very low31.5Very low70 Ų70154.5 Ų154.572%0.72286%0.858SS**  trans152115151.100000116.6
628E34Very low31.5Very low209 Ų209149.4 Ų149.498%0.97785%0.848SS**  trans-54.7141.7164-71.6170123.900112.7
629G30.7Very low31.6Very low67 Ų67146.5 Ų146.569%0.69185%0.845SS**  trans156.695.8161.100000116.6
630T30.1Very low31.5Very low130 Ų130146.7 Ų146.780%0.79884%0.843SS**  trans45.9120.4139.6-40.30000120.1
631T29.2Very low32Very low136 Ų136143.4 Ų143.483%0.83484%0.838SS**  175.9125.2118.731.10000111.2
632I34.3Very low31.8Very low174 Ų174142.9 Ų142.989%0.89284%0.836SS**PPolyproline II helixtrans-101.2125.5174.9-51.9168.9000106.8
633S30Very low31.8Very low103 Ų103137.9 Ų137.972%0.7283%0.827SS**PPolyproline II helixtrans-90.7147.8170-59.40000109.9
634P34.8Very low31.9Very low125 Ų125136.6 Ų136.681%0.81282%0.821SS**PPolyproline II helixtrans-87.6132.7-169.634-30.7000111.3
635V30.6Very low32Very low136 Ų136136.8 Ų136.882%0.82482%0.82SS**  trans-110.7124.1165.2175.10000108.8
636N31.2Very low32.4Very low162 Ų162143.8 Ų143.887%0.86682%0.822SS**  trans-57.5127176.3-82.2-60.5000111.8
637L30.6Very low32.5Very low171 Ų171141.9 Ų141.990%0.89581%0.814SS**  trans-114.4117.4161-94.9137.1000108.7
638A32.5Very low32.7Very low81 Ų81145.8 Ų145.867%0.66982%0.817SS**PPolyproline II helixtrans-68.1149.7171.900000110.8
639P33.7Very low32.7Very low127 Ų127142.4 Ų142.483%0.82581%0.805SS**PPolyproline II helixtrans-84.7125178.9117.9000110.9
640F30.8Very low32.9Very low202 Ų202145.1 Ų145.189%0.88681%0.808SS**PPolyproline II helixtrans-82141.7162-86.1-84000110.4
641P41.2Very low32.8Very low118 Ų118144.4 Ų144.477%0.76681%0.808SS**PPolyproline II helixtrans-83.3151.5-173.231.8-33.2000114.1
642E29.6Very low33.1Very low190 Ų190144.1 Ų144.189%0.88881%0.806SS**PPolyproline II helixtrans-56.5139-177.9-69.6165.8139.100114.3
643A32.6Very low33.5Very low88 Ų88141.2 Ų141.273%0.72780%0.798SS**PPolyproline II helixtrans-81.1120168.600000110.5F645A643-F645 PolarHBondContact O-N 3.44Å
644E32.1Very low33.5Very low170 Ų170139.8 Ų139.879%0.79480%0.8SS**PPolyproline II helixtrans-72.3116.7174.2-65.8-176.6157.200111.2
645F35.3Very low33.4Very low203 Ų203140.3 Ų140.389%0.8980%0.801SS**PPolyproline II helixtrans-89.6121.9167.5-93.2-88.8000110.7A643A643-F645 PolarHBondContact O-N 3.44Å
646W37.6Very low33.6Very low225 Ų225142 Ų14285%0.85280%0.804SS**PPolyproline II helixtrans-79.1124.2172.6-77.487.4000111.5
647A31.4Very low33.6Very low93 Ų93145.4 Ų145.477%0.76981%0.805SS**PPolyproline II helixtrans-85.5122.1168.400000110.5
648I34.9Very low34Very low152 Ų152142.9 Ų142.978%0.77980%0.801SS**  trans-101.4109.6168.2-64.6175000107.7T650I648-T650 HydrophobicContact CG2-CG2 4.09Å
649L33.2Very low33.9Very low138 Ų138142.4 Ų142.472%0.72380%0.804SS**  trans-92115.9166.1-79.1164.7000108.6
650T34.9Very low34.1Very low124 Ų124142.3 Ų142.376%0.76181%0.807SS**  trans-117.3109.7161.555.80000109.3I648I648-T650 HydrophobicContact CG2-CG2 4.09Å
651S28.4Very low34.1Very low114 Ų114140.8 Ų140.880%0.79781%0.807SS**  trans-96.7124.9166.1175.80000107.8
652V35.2Very low33.7Very low131 Ų131140.9 Ų140.979%0.79481%0.81SS**  trans-127.8122.8167.1178.70000108.2
653P42.2Very low33.7Very low112 Ų112138.8 Ų138.873%0.72781%0.81SS**  trans-84.3134.1174.531.6-29.4000111.3
654G30.5Very low33.7Very low74 Ų74139.1 Ų139.176%0.76381%0.813SS**  trans-73136.1176.300000113.3
655T32Very low33.8Very low136 Ų136136.6 Ų136.683%0.83481%0.814SS**  trans-120.896.6160.8-56.30000107.9
656I34.9Very low33.7Very low171 Ų171131.4 Ų131.488%0.87781%0.808SS**  trans-95.4105.6171.4-61.3176.8000107.7
657R31.2Very low33.7Very low234 Ų234131.9 Ų131.988%0.88381%0.81SS**  trans-104123.2166.3-165.8178.8-175.1-170.92.1108.2
658S39Very low33.9Very low118 Ų118135.5 Ų135.583%0.82582%0.815SS**  trans-55.2133.4177.1-52.40000112.4
659G31.1Very low33.8Very low71 Ų71134.5 Ų134.573%0.73282%0.821SS**  trans-150.6103.3170.800000110.1
660S37.7Very low34.3Very low125 Ų125135.2 Ų135.287%0.87486%0.862SS**  trans-67129.3173-45.60000110.3
661L32.1Very low34.2Very low170 Ų170135.8 Ų135.889%0.8987%0.867SS**  trans-140.5115.7166.3-100.1157000110.3
662S31.9Very low34.5Very low119 Ų119136.9 Ų136.983%0.83287%0.87SS**  trans-58.5131.7174.6-68.80000112.3A664S662-A664 PolarHBondContact O-N 3.37Å
663V30.6Very low34.5Very low147 Ų147137.3 Ų137.389%0.89187%0.874SS**  trans-84105.4163.6175.30000108.2
664A30.6Very low34Very low94 Ų94138.8 Ų138.878%0.77788%0.883SS**  trans-94.6117.716400000108.9S662S662-A664 PolarHBondContact O-N 3.37Å
665S34.4Very low34.3Very low118 Ų118142.8 Ų142.883%0.82589%0.891SS**  trans-73127.7172.2-161.90000109.7
666A33.7Very low34.4Very low93 Ų93143.3 Ų143.377%0.76989%0.894SS**  trans-136.8107.7166.200000109.9
667R37.8Very low34.4Very low235 Ų235141.3 Ų141.389%0.88790%0.896SS**  trans-58.3143161.6-69.2172.9175.3175.3-2.7109.6
668L35.2Very low34.6Very low169 Ų169134.2 Ų134.289%0.88590%0.897SS**  trans-145.2119.2150-105.3130.5000110.2
669C34.1Very low34.3Very low132 Ų132135.5 Ų135.589%0.89290%0.903SS**  trans-62.4146.1162-65.20000110.3
670G42Very low34.5Very low153 Ų153141.4 Ų141.4100%1.57792%0.918SS**  trans-179.20168.700000108.2

Retrieved 670 of 670 residues in 733.4 ms (Link to these results)