A0A087XER7_POEFO Loading...

Polyadenylate-binding protein-interacting protein 2

Acts as a repressor in the regulation of translation initiation of poly(A)-containing mRNAs. Its inhibitory activity on translation is mediated via its action on PABPC1. Displaces the interaction of PABPC1 with poly(A) RNA and competes with PAIP1 for binding to PABPC1. Its association with PABPC1 results in disruption of the cytoplasmic poly(A) RNP structure organization.

AlphaFold DB , UniProt , Accession A0A087XER7, Species POEFO (Poecilia formosa, Amazon molly), Gene PAIP2, Length 132 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
1M48.1Very low46.5Very low245 Ų245143.9 Ų143.9100%1.20783%0.831SS**  095.30-85.2155.5145.300110.1
2K40.9Very low46.7Very low209 Ų209141.6 Ų141.691%0.90982%0.824SS**  trans179.8123.8132.6-108.7176.7172.3176.10108.4
3D42.7Very low46.5Very low150 Ų150142.8 Ų142.880%0.80284%0.835SS**  trans-77163.5-163.6-61.5-66.5000115.4
4P54.8Low45.9Very low113 Ų113137.2 Ų137.273%0.73482%0.823SS**  trans-87.5144.2-176.234.8-30.1000111.7
5T48.1Very low46Very low142 Ų142138.5 Ų138.587%0.87183%0.832SS**  trans-110.3108.1170.5-500000109.1G7T5-G7 PolarHBondContact O-N 2.89Å
6I54.3Low45.5Very low152 Ų152133.6 Ų133.678%0.77982%0.819SS**  trans-70.3118.3171.5-65.9168.9000107.9
7G40.9Very low45.9Very low67 Ų67136.5 Ų136.569%0.69182%0.821SS**  trans-117.695.7173.200000110.5T5T5-G7 PolarHBondContact O-N 2.89Å
8T45.6Very low46.1Very low130 Ų130135.4 Ų135.480%0.79882%0.815SS**  trans-70.3127.4170.4-56.90000109.8
9T43.5Very low46.3Very low118 Ų118134.2 Ų134.272%0.72481%0.807SS**  trans-121.7137.3167.449.50000109.8
10P52.8Low46.4Very low127 Ų127134.8 Ų134.883%0.82581%0.805SS**  trans-89.6134.1177.433.9-29.2000110.3
11T39.9Very low46.4Very low130 Ų130132.7 Ų132.780%0.79880%0.797SS**  trans-107.8135.5173.8-57.80000109.8
12P48.9Very low46.5Very low116 Ų116125.9 Ų125.975%0.75377%0.774SS**  trans-81.1148.3-168.832.2-35.5000113.8G14P12-G14 PolarHBondContact O-N 3.37Å
13T44.6Very low47.1Very low157 Ų157123.4 Ų123.496%0.96377%0.765SS**  trans-58.4115.4168.1-42.10000110.7
14G37.4Very low47.3Very low65 Ų65125.6 Ų125.667%0.6777%0.768SS**  trans-136.1117.3174.300000109.7P12 G16P12-G14 PolarHBondContact O-N 3.37Å; G14-G16 PolarHBondContact O-N 3.2Å
15T47.7Very low47Very low156 Ų156122.7 Ų122.796%0.95776%0.759SS**  trans-43.6116176.247.80000113.2
16G37.5Very low47.1Very low60 Ų60121.1 Ų121.162%0.61975%0.754SS**  trans-163.992.4172.500000108.2G14 V18G14-G16 PolarHBondContact O-N 3.2Å; G16-V18 PolarHBondContact O-N 3.29Å
17E52.4Low47.1Very low184 Ų184123.4 Ų123.486%0.8676%0.761SS**  trans-64.382.3170.8-168.6-174.7-17500108.2V19E17-V19 HydrophobicContact CG-CG2 4.1Å; E17-V19 PolarHBondContact O-N 2.83Å
18V49.1Very low48.4Very low116 Ų116127.5 Ų127.570%0.70376%0.762SS**  trans-83.997.5161-170.70000104.1G16 L20G16-V18 PolarHBondContact O-N 3.29Å; V18-L20 PolarHBondContact O-N 3.42Å
19V50.5Low50Low112 Ų112125.6 Ų125.668%0.67975%0.747SS**  trans-57.385.3163.9178.50000106.4E17 S21E17-V19 HydrophobicContact CG-CG2 4.1Å; E17-V19 PolarHBondContact O-N 2.83Å; V19-S21 PolarHBondContact O-N 3.05Å
20L48.9Very low51.9Low147 Ų147125.5 Ų125.577%0.7775%0.749SS**  trans-64.392.2163.1-90.2142.1000104.4V18 S22V18-L20 PolarHBondContact O-N 3.42Å; L20-S22 PolarHBondContact O-N 3.45Å
21S46.8Very low53.4Low91 Ų91125.7 Ų125.764%0.63674%0.737SS**  trans-62.260.9163.4-177.70000109.3V19V19-S21 PolarHBondContact O-N 3.05Å
22S49.4Very low55.5Low101 Ų101121.3 Ų121.371%0.70671%0.714SS**  trans-90.529.9160.1-156.40000109.3L20 F24L20-S22 PolarHBondContact O-N 3.45Å; S22-F24 PolarHBondContact O-N 3.35Å; S22-F24 VanDerWaalsContact O-N 3.15Å
23Q52.7Low57Low157 Ų157123.6 Ų123.673%0.73472%0.715SS**  trans-85.253.2172-171.9155.26.700110.1
24F47.4Very low58.7Low196 Ų196123.4 Ų123.486%0.8670%0.697SS**SBendtrans-147.7100.6159.1-73.7-73.2000106.1S22S22-F24 PolarHBondContact O-N 3.35Å; S22-F24 VanDerWaalsContact O-N 3.15Å
25G49.5Very low60.8Low52 Ų52125.1 Ų125.154%0.53669%0.689SS.*  trans136.12.4174.400000116.5E27 E28G25-E27 PolarHBondContact O-N 2.93Å; G25-E28 PolarHBondContact O-N 2.98Å
26S49.3Very low62.5Low110 Ų110125.9 Ų125.977%0.76967%0.674SS**THydrogen-bonded Turntrans-75.941.2178.766.90000114.3
27E54.7Low64.7Low199 Ų199128.6 Ų128.693%0.9367%0.672SS**THydrogen-bonded Turntrans-145.83.1167.2-75.9-166.8151.600113.6G25G25-E27 PolarHBondContact O-N 2.93Å
28E67.3Low66Low154 Ų154126.9 Ų126.972%0.7266%0.664SS**SBendtrans-96.1138.3169.6-123.8131.9-153.800108.8G25G25-E28 PolarHBondContact O-N 2.98Å
29D79.4Confident67.6Low89 Ų89125.7 Ų125.748%0.47665%0.654SS.*  trans-42.1124.1179.4-1790.8000110F31 A32D29-F31 PolarHBondContact O-N 3.4Å; D29-F31 WeakPolarHBondContact OD1-CD2 3.3Å; D29-F31 PolarHBondContact OD1-N 3.06Å; D29-F31 VanDerWaalsContact OD1-N 3.1Å; D29-A32 HydrophobicContact CB-CB 4.3Å; D29-A32 WeakPolarHBondContact O-CB 3.45Å; D29-A32 PolarHBondContact O-N 3.34Å
30P83.2Confident69.4Low117 Ų117124.4 Ų124.476%0.7664%0.641SS**THydrogen-bonded Turntrans-54.4-15.2177.6-25.833.9000113.9
31F84.8Confident71.2Confident130 Ų130125.1 Ų125.157%0.5764%0.64SS**THydrogen-bonded Turntrans-102.45.1175.6-55.3-73.5000114.4D29 E33 Y34 M35D29-F31 PolarHBondContact O-N 3.4Å; D29-F31 WeakPolarHBondContact OD1-CD2 3.3Å; D29-F31 PolarHBondContact OD1-N 3.06Å; D29-F31 VanDerWaalsContact OD1-N 3.1Å; F31-E33 PolarHBondContact O-N 3.05Å; F31-Y34 HydrophobicContact CD1-CD2 4.18Å; F31-Y34 WeakPolarHBondContact O-CA 3.46Å; F31-Y34 WeakPolarHBondContact O-CB 3.28Å; F31-Y34 PolarHBondContact O-N 3.48Å; F31-M35 PolarHBondContact O-N 3.48Å
32A84.6Confident73.2Confident39 Ų39124.5 Ų124.532%0.32263%0.627SS.*Hα-helixtrans-55.1-37.5-177.200000112.8D29 M35 W36D29-A32 HydrophobicContact CB-CB 4.3Å; D29-A32 WeakPolarHBondContact O-CB 3.45Å; D29-A32 PolarHBondContact O-N 3.34Å; A32-M35 PolarHBondContact O-N 3.47Å; A32-W36 WeakPolarHBondContact O-CB 3.4Å; A32-W36 PolarHBondContact O-N 2.99Å
33E80.3Confident75.3Confident164 Ų164125.2 Ų125.277%0.76662%0.618SS**Hα-helixtrans-68-34.5175.7-171169.8-176.400112.5F31 M37F31-E33 PolarHBondContact O-N 3.05Å; E33-M37 WeakPolarHBondContact O-CB 3.2Å; E33-M37 PolarHBondContact O-N 2.99Å
34Y79.5Confident77.2Confident153 Ų153121.8 Ų121.860%0.660%0.604SS**Hα-helixtrans-73.7-37.3174.9-68.6-74.5000112.3F31 W36 M37 E38F31-Y34 HydrophobicContact CD1-CD2 4.18Å; F31-Y34 WeakPolarHBondContact O-CA 3.46Å; F31-Y34 WeakPolarHBondContact O-CB 3.28Å; F31-Y34 PolarHBondContact O-N 3.48Å; Y34-W36 VanDerWaalsContact C-N 3.35Å; Y34-M37 HydrophobicContact CD1-CE 3.96Å; Y34-M37 PolarHBondContact O-N 3.06Å; Y34-E38 PolarHBondContact O-N 3.25Å
35M82.3Confident79.4Confident100 Ų100118.8 Ų118.849%0.49359%0.587SS.*Hα-helixtrans-66.6-38.7172.6-66.4-65.3-64.900111F31 A32 E38 N39F31-M35 PolarHBondContact O-N 3.48Å; A32-M35 PolarHBondContact O-N 3.47Å; M35-E38 PolarHBondContact O-N 3.09Å; M35-N39 PolarHBondContact O-N 3.26Å; M35-N39 PolarHBondContact O-OD1 3.15Å
36W82.4Confident81.6Confident172 Ų172121.8 Ų121.865%0.65259%0.588SS**Hα-helixtrans-59.8-49.1172.2-175.3-59.9000110.7A32 Y34 E38 N39 E40A32-W36 WeakPolarHBondContact O-CB 3.4Å; A32-W36 PolarHBondContact O-N 2.99Å; Y34-W36 VanDerWaalsContact C-N 3.35Å; W36-E38 PolarHBondContact O-N 3.1Å; W36-N39 CarbonylContact O-C 3.54Å; W36-N39 WeakPolarHBondContact O-CA 3.25Å; W36-N39 PolarHBondContact O-N 3.29Å; W36-E40 WeakPolarHBondContact O-CA 3.22Å; W36-E40 WeakPolarHBondContact O-CB 3.44Å; W36-E40 PolarHBondContact O-N 3.01Å
37M83.6Confident83.8Confident117 Ų117119.3 Ų119.358%0.57657%0.568SS**Hα-helixtrans-60.8-31-179-171.6-178.759.600112.9E33 Y34E33-M37 WeakPolarHBondContact O-CB 3.2Å; E33-M37 PolarHBondContact O-N 2.99Å; Y34-M37 HydrophobicContact CD1-CE 3.96Å; Y34-M37 PolarHBondContact O-N 3.06Å
38E79.9Confident85.7Confident148 Ų148116.8 Ų116.869%0.69256%0.556SS**Hα-helixtrans-69.3-35.6172.1-175.7174.4-156.600112.3Y34 M35 W36Y34-E38 PolarHBondContact O-N 3.25Å; M35-E38 PolarHBondContact O-N 3.09Å; W36-E38 PolarHBondContact O-N 3.1Å
39N82.3Confident87Confident91 Ų91114.7 Ų114.749%0.48755%0.546SS..Hα-helixtrans-95-7.1-178.6-75.397.7000114.6M35 W36 E41 E42 F43M35-N39 PolarHBondContact O-N 3.26Å; M35-N39 PolarHBondContact O-OD1 3.15Å; W36-N39 CarbonylContact O-C 3.54Å; W36-N39 WeakPolarHBondContact O-CA 3.25Å; W36-N39 PolarHBondContact O-N 3.29Å; N39-E41 PolarHBondContact O-N 2.91Å; N39-E42 WeakPolarHBondContact O-CB 3.33Å; N39-E42 PolarHBondContact O-N 2.74Å; N39-F43 PolarHBondContact O-N 3.31Å
40E89.4Confident87.7Confident86 Ų86116 Ų11640%0.40255%0.549SS..Hα-helixtrans-61.8-43.2-173-175-179.8-165.900111.7W36 E42 F43 N44W36-E40 WeakPolarHBondContact O-CA 3.22Å; W36-E40 WeakPolarHBondContact O-CB 3.44Å; W36-E40 PolarHBondContact O-N 3.01Å; E40-E42 VanDerWaalsContact C-N 3.31Å; E40-E42 PolarHBondContact O-N 2.96Å; E40-F43 PolarHBondContact O-N 3.14Å; E40-N44 WeakPolarHBondContact O-CB 3.37Å; E40-N44 VanDerWaalsContact O-CG 3.22Å; E40-N44 PolarHBondContact O-N 3.27Å; E40-N44 PolarHBondContact O-ND2 3.04Å
41E86.4Confident88.3Confident162 Ų162115.8 Ų115.876%0.75754%0.541SS*.Hα-helixtrans-65.4-34.4178.9-65-175.2176.500112.2N39 R45N39-E41 PolarHBondContact O-N 2.91Å; E41-R45 PolarHBondContact O-N 3.23Å; E41-R45 VanDerWaalsContact O-N 3.12Å
42E88.9Confident88.9Confident78 Ų78117.3 Ų117.336%0.36454%0.543SS..Hα-helixtrans-69.5-45176.3-175.863.5-147.900111.2N39 E40 R45 Q46N39-E42 WeakPolarHBondContact O-CB 3.33Å; N39-E42 PolarHBondContact O-N 2.74Å; E40-E42 VanDerWaalsContact C-N 3.31Å; E40-E42 PolarHBondContact O-N 2.96Å; E42-R45 PolarHBondContact O-N 3.03Å; E42-R45 IonicContact OE1-CZ 3.43Å; E42-R45 IonicContact OE1-NE 3.91Å; E42-R45 IonicContact OE1-NH2 2.67Å; E42-R45 PolarHBondContact OE1-NH2 2.95Å; E42-R45 IonicContact OE2-CZ 3.07Å; E42-R45 IonicContact OE2-NH1 3.12Å; E42-R45 PolarHBondContact OE2-NH1 3.3Å; E42-R45 VanDerWaalsContact OE2-NH1 3.12Å; E42-R45 IonicContact OE2-NH2 2.6Å; E42-R45 PolarHBondContact OE2-NH2 3.26Å; E42-Q46 WeakPolarHBondContact O-CB 3.37Å; E42-Q46 PolarHBondContact O-N 3.1Å
43F92.9Very high89.4Confident115 Ų115120.2 Ų120.250%0.50455%0.55SS.*Hα-helixtrans-60.3-46.9176.9178-95.8000111.1N39 E40 R45 Q46 V47N39-F43 PolarHBondContact O-N 3.31Å; E40-F43 PolarHBondContact O-N 3.14Å; F43-R45 VanDerWaalsContact C-N 3.32Å; F43-R45 PolarHBondContact O-N 3.25Å; F43-Q46 PolarHBondContact O-N 3.17Å; F43-V47 HydrophobicContact CD1-CG2 4.16Å; F43-V47 HydrophobicContact CE1-CG2 3.71Å; F43-V47 HydrophobicContact CE2-CG2 4.09Å; F43-V47 HydrophobicContact CZ-CG2 3.67Å; F43-V47 WeakPolarHBondContact O-CG2 3.31Å; F43-V47 PolarHBondContact O-N 3.35Å
44N92.9Very high90.1Very high85 Ų85117.6 Ų117.646%0.45554%0.538SS..Hα-helixtrans-60.2-42.4178.4-71.3-20.6000111.9E40 V47 E48E40-N44 WeakPolarHBondContact O-CB 3.37Å; E40-N44 VanDerWaalsContact O-CG 3.22Å; E40-N44 PolarHBondContact O-N 3.27Å; E40-N44 PolarHBondContact O-ND2 3.04Å; N44-V47 PolarHBondContact O-N 3.14Å; N44-E48 WeakPolarHBondContact O-CB 3.39Å; N44-E48 PolarHBondContact O-N 3.46Å
45R94.9Very high90.9Very high133 Ų133116 Ų11650%0.50254%0.536SS..Hα-helixtrans-62.9-43.6176.2-175.1175.874-135.99.8111.9E41 E42 F43 E48 E49E41-R45 PolarHBondContact O-N 3.23Å; E41-R45 VanDerWaalsContact O-N 3.12Å; E42-R45 PolarHBondContact O-N 3.03Å; E42-R45 IonicContact OE1-CZ 3.43Å; E42-R45 IonicContact OE1-NE 3.91Å; E42-R45 IonicContact OE1-NH2 2.67Å; E42-R45 PolarHBondContact OE1-NH2 2.95Å; E42-R45 IonicContact OE2-CZ 3.07Å; E42-R45 IonicContact OE2-NH1 3.12Å; E42-R45 PolarHBondContact OE2-NH1 3.3Å; E42-R45 VanDerWaalsContact OE2-NH1 3.12Å; E42-R45 IonicContact OE2-NH2 2.6Å; E42-R45 PolarHBondContact OE2-NH2 3.26Å; F43-R45 VanDerWaalsContact C-N 3.32Å; F43-R45 PolarHBondContact O-N 3.25Å; R45-E48 PolarHBondContact O-N 3.25Å; R45-E49 WeakPolarHBondContact O-CB 3.38Å; R45-E49 PolarHBondContact O-N 3.47Å
46Q94.7Very high91.6Very high116 Ų116116 Ų11654%0.54253%0.534SS..Hα-helixtrans-65.2-41.4-179-167.5168.380.600111.6E42 F43 E49 E50E42-Q46 WeakPolarHBondContact O-CB 3.37Å; E42-Q46 PolarHBondContact O-N 3.1Å; F43-Q46 PolarHBondContact O-N 3.17Å; Q46-E49 PolarHBondContact O-N 3.25Å; Q46-E50 WeakPolarHBondContact O-CB 3.4Å; Q46-E50 PolarHBondContact O-N 2.81Å
47V95.8Very high92.2Very high58 Ų58112.4 Ų112.435%0.35253%0.525SS..Hα-helixtrans-64.2-41.2174171.90000111.4F43 N44 E50 L51F43-V47 HydrophobicContact CD1-CG2 4.16Å; F43-V47 HydrophobicContact CE1-CG2 3.71Å; F43-V47 HydrophobicContact CE2-CG2 4.09Å; F43-V47 HydrophobicContact CZ-CG2 3.67Å; F43-V47 WeakPolarHBondContact O-CG2 3.31Å; F43-V47 PolarHBondContact O-N 3.35Å; N44-V47 PolarHBondContact O-N 3.14Å; V47-E50 PolarHBondContact O-N 3.19Å; V47-L51 PolarHBondContact O-N 2.94Å
48E94.1Very high92.8Very high145 Ų145113.7 Ų113.768%0.67853%0.529SS*.Hα-helixtrans-64.6-40.3176.9-173.9174.6-152.800112N44 R45 L51 W52N44-E48 WeakPolarHBondContact O-CB 3.39Å; N44-E48 PolarHBondContact O-N 3.46Å; R45-E48 PolarHBondContact O-N 3.25Å; E48-L51 PolarHBondContact O-N 3.12Å; E48-W52 PolarHBondContact O-N 3.11Å; E48-W52 VanDerWaalsContact O-N 3.08Å
49E94.4Very high93.6Very high111 Ų111114.4 Ų114.452%0.51953%0.526SS..Hα-helixtrans-63.9-45.9175.4-174.4172.1-162.100111.6R45 Q46 L51 W52 E53R45-E49 WeakPolarHBondContact O-CB 3.38Å; R45-E49 PolarHBondContact O-N 3.47Å; Q46-E49 PolarHBondContact O-N 3.25Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 2.77Å; E49-W52 WeakPolarHBondContact O-CB 3.33Å; E49-W52 PolarHBondContact O-N 3.36Å; E49-W52 VanDerWaalsContact O-N 3.15Å; E49-E53 WeakPolarHBondContact O-CG 3.49Å; E49-E53 PolarHBondContact O-N 3.32Å
50E94.3Very high94.2Very high115 Ų115112.8 Ų112.854%0.53752%0.521SS..Hα-helixtrans-59.4-44.5176.3-172.9172.3-16200111.4Q46 V47 W52 E53 E54Q46-E50 WeakPolarHBondContact O-CB 3.4Å; Q46-E50 PolarHBondContact O-N 2.81Å; V47-E50 PolarHBondContact O-N 3.19Å; E50-W52 VanDerWaalsContact C-N 3.27Å; E50-W52 PolarHBondContact O-N 3.17Å; E50-E53 PolarHBondContact O-N 2.77Å; E50-E54 WeakPolarHBondContact O-CG 3.45Å; E50-E54 PolarHBondContact O-N 3.37Å
51L95.9Very high94.4Very high114 Ų114114.8 Ų114.860%0.59753%0.529SS*.Hα-helixtrans-62.1-36.7177.4-142.1105.9000112.3V47 E48 E49 E55V47-L51 PolarHBondContact O-N 2.94Å; E48-L51 PolarHBondContact O-N 3.12Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 2.77Å; L51-E55 PolarHBondContact O-N 3.17Å; L51-E55 VanDerWaalsContact O-N 3.09Å
52W97.2Very high94.7Very high161 Ų161111.8 Ų111.861%0.6152%0.515SS*.Hα-helixtrans-69.7-40.1177.6-171.288.3000112E48 E49 E50 E54 E55 F56E48-W52 PolarHBondContact O-N 3.11Å; E48-W52 VanDerWaalsContact O-N 3.08Å; E49-W52 WeakPolarHBondContact O-CB 3.33Å; E49-W52 PolarHBondContact O-N 3.36Å; E49-W52 VanDerWaalsContact O-N 3.15Å; E50-W52 VanDerWaalsContact C-N 3.27Å; E50-W52 PolarHBondContact O-N 3.17Å; W52-E54 VanDerWaalsContact C-N 3.35Å; W52-E55 PolarHBondContact O-N 3.48Å; W52-F56 HydrophobicContact CH2-CD2 4.41Å; W52-F56 HydrophobicContact CZ3-CB 4.37Å; W52-F56 WeakPolarHBondContact O-CB 3.41Å; W52-F56 PolarHBondContact O-N 2.84Å
53E95.8Very high94.8Very high100 Ų100113.6 Ų113.647%0.46752%0.523SS..Hα-helixtrans-62.7-41.4173.8-71.6-173.3176.700111.9E49 E50 F56 M57E49-E53 WeakPolarHBondContact O-CG 3.49Å; E49-E53 PolarHBondContact O-N 3.32Å; E50-E53 PolarHBondContact O-N 2.77Å; E53-F56 PolarHBondContact O-N 3.15Å; E53-M57 WeakPolarHBondContact O-CG 3.24Å; E53-M57 PolarHBondContact O-N 3.26Å
54E95.2Very high94.5Very high109 Ų109113.9 Ų113.951%0.50953%0.527SS..Hα-helixtrans-60.4-49.3175.1-72.8-173.4164.700111.8E50 W52 F56 M57 E58E50-E54 WeakPolarHBondContact O-CG 3.45Å; E50-E54 PolarHBondContact O-N 3.37Å; W52-E54 VanDerWaalsContact C-N 3.35Å; E54-F56 VanDerWaalsContact C-N 3.28Å; E54-F56 PolarHBondContact O-N 2.61Å; E54-M57 PolarHBondContact O-N 2.8Å; E54-E58 PolarHBondContact O-N 2.95Å
55E94.7Very high94.2Very high119 Ų119114.3 Ų114.356%0.55653%0.529SS*.Hα-helixtrans-60.7-40176.9-172.7-173.4-179.900111.4L51 W52 R59L51-E55 PolarHBondContact O-N 3.17Å; L51-E55 VanDerWaalsContact O-N 3.09Å; W52-E55 PolarHBondContact O-N 3.48Å; E55-R59 PolarHBondContact O-N 2.93Å; E55-R59 VanDerWaalsContact O-N 3.12Å
56F97.4Very high93.9Very high102 Ų102111 Ų11145%0.44752%0.522SS..Hα-helixtrans-62.4-47.6177.1175.9-97.8000111.7W52 E53 E54 R59 C60W52-F56 HydrophobicContact CH2-CD2 4.41Å; W52-F56 HydrophobicContact CZ3-CB 4.37Å; W52-F56 WeakPolarHBondContact O-CB 3.41Å; W52-F56 PolarHBondContact O-N 2.84Å; E53-F56 PolarHBondContact O-N 3.15Å; E54-F56 VanDerWaalsContact C-N 3.28Å; E54-F56 PolarHBondContact O-N 2.61Å; F56-R59 PolarHBondContact O-N 3.15Å; F56-C60 VanDerWaalsContact CZ-SG 3.58Å; F56-C60 PolarHBondContact O-N 2.86Å; F56-C60 PolarHBondContact O-SG 3.16Å; F56-C60 VanDerWaalsContact O-SG 3.42Å
57M96.4Very high93.3Very high96 Ų96109.5 Ų109.547%0.47352%0.515SS..Hα-helixtrans-62.3-43.5178.4-76.8-169.8-74.700112.1E53 E54 R59 C60 F61E53-M57 WeakPolarHBondContact O-CG 3.24Å; E53-M57 PolarHBondContact O-N 3.26Å; E54-M57 PolarHBondContact O-N 2.8Å; M57-R59 VanDerWaalsContact C-N 3.29Å; M57-R59 PolarHBondContact O-N 3.44Å; M57-C60 WeakPolarHBondContact O-CB 3.4Å; M57-C60 PolarHBondContact O-N 3.14Å; M57-C60 VanDerWaalsContact O-N 3.15Å; M57-F61 HydrophobicContact CB-CE2 4.42Å; M57-F61 WeakPolarHBondContact O-CD2 2.97Å; M57-F61 PolarHBondContact O-N 3.43Å
58E96Very high92.2Very high143 Ų143112.4 Ų112.467%0.66852%0.524SS*.Hα-helixtrans-59.7-42.2178.3-170.3168.9-150.300111.2E54 F61 Q62E54-E58 PolarHBondContact O-N 2.95Å; E58-F61 PolarHBondContact O-N 3.43Å; E58-Q62 PolarHBondContact O-N 3.37Å
59R95.3Very high91.4Very high163 Ų163112.4 Ų112.462%0.61552%0.524SS*.Hα-helixtrans-66.7-37.4175.5-171.6155.860.5174.2-4.2113.2E55 F56 M57 Q62 Q63E55-R59 PolarHBondContact O-N 2.93Å; E55-R59 VanDerWaalsContact O-N 3.12Å; F56-R59 PolarHBondContact O-N 3.15Å; M57-R59 VanDerWaalsContact C-N 3.29Å; M57-R59 PolarHBondContact O-N 3.44Å; R59-Q62 PolarHBondContact O-N 3.14Å; R59-Q63 PolarHBondContact O-N 2.86Å
60C95.1Very high90.2Very high57 Ų57114.7 Ų114.739%0.38554%0.535SS..Hα-helixtrans-61.5-43.6174-750000112.2F56 M57 M64F56-C60 VanDerWaalsContact CZ-SG 3.58Å; F56-C60 PolarHBondContact O-N 2.86Å; F56-C60 PolarHBondContact O-SG 3.16Å; F56-C60 VanDerWaalsContact O-SG 3.42Å; M57-C60 WeakPolarHBondContact O-CB 3.4Å; M57-C60 PolarHBondContact O-N 3.14Å; M57-C60 VanDerWaalsContact O-N 3.15Å; C60-M64 PolarHBondContact O-N 2.78Å; C60-M64 VanDerWaalsContact O-N 3.14Å
61F93.9Very high88.8Confident128 Ų128118.4 Ų118.456%0.56154%0.544SS*.Hα-helixtrans-65.6-42.8176.2-72.7-60000111.8M57 E58 Q63 M64 L65M57-F61 HydrophobicContact CB-CE2 4.42Å; M57-F61 WeakPolarHBondContact O-CD2 2.97Å; M57-F61 PolarHBondContact O-N 3.43Å; E58-F61 PolarHBondContact O-N 3.43Å; F61-Q63 VanDerWaalsContact C-N 3.34Å; F61-Q63 PolarHBondContact O-N 3.24Å; F61-M64 WeakPolarHBondContact O-CB 3.43Å; F61-M64 PolarHBondContact O-N 2.91Å; F61-M64 VanDerWaalsContact O-N 3.15Å; F61-L65 WeakPolarHBondContact O-CG 3.43Å; F61-L65 PolarHBondContact O-N 3.47Å
62Q93.8Very high87Confident100 Ų100120.3 Ų120.347%0.46755%0.55SS.*Hα-helixtrans-59.7-45.7178.1-166.365.755.300111.4E58 R59 M64 L65 D66E58-Q62 PolarHBondContact O-N 3.37Å; R59-Q62 PolarHBondContact O-N 3.14Å; Q62-M64 VanDerWaalsContact C-N 3.3Å; Q62-M64 PolarHBondContact O-N 3.09Å; Q62-L65 PolarHBondContact O-N 2.86Å; Q62-D66 PolarHBondContact NE2-OD1 3.12Å; Q62-D66 WeakPolarHBondContact O-CB 3.12Å; Q62-D66 PolarHBondContact O-N 2.97Å
63Q90.6Very high85.1Confident115 Ų115123.4 Ų123.454%0.53756%0.562SS.*Hα-helixtrans-60.2-40.9176-179.6177.1-2400112R59 F61 D66 E67R59-Q63 PolarHBondContact O-N 2.86Å; F61-Q63 VanDerWaalsContact C-N 3.34Å; F61-Q63 PolarHBondContact O-N 3.24Å; Q63-D66 PolarHBondContact O-N 3.26Å; Q63-E67 HydrophobicContact CG-CG 4.46Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.23Å; Q63-E67 PolarHBondContact NE2-OE1 2.99Å; Q63-E67 WeakPolarHBondContact O-CB 3.49Å; Q63-E67 VanDerWaalsContact O-CG 3.25Å; Q63-E67 WeakPolarHBondContact O-CG 3.42Å; Q63-E67 PolarHBondContact O-N 3.33Å
64M86.4Confident83Confident121 Ų121126.3 Ų126.360%0.59657%0.573SS**Hα-helixtrans-64.6-40.5177.7-171.3-174.1-54.600112.3C60 F61 Q62 E67 E68C60-M64 PolarHBondContact O-N 2.78Å; C60-M64 VanDerWaalsContact O-N 3.14Å; F61-M64 WeakPolarHBondContact O-CB 3.43Å; F61-M64 PolarHBondContact O-N 2.91Å; F61-M64 VanDerWaalsContact O-N 3.15Å; Q62-M64 VanDerWaalsContact C-N 3.3Å; Q62-M64 PolarHBondContact O-N 3.09Å; M64-E67 PolarHBondContact O-N 3.17Å; M64-E68 PolarHBondContact O-N 3.35Å
65L87.1Confident81.1Confident94 Ų94126.1 Ų126.149%0.49258%0.575SS.*Hα-helixtrans-67.2-44.2175.8-71.2173.6000111.5F61 Q62 E67 E68 E69F61-L65 WeakPolarHBondContact O-CG 3.43Å; F61-L65 PolarHBondContact O-N 3.47Å; Q62-L65 PolarHBondContact O-N 2.86Å; L65-E67 VanDerWaalsContact C-N 3.28Å; L65-E67 PolarHBondContact O-N 3.14Å; L65-E68 PolarHBondContact O-N 3Å; L65-E68 VanDerWaalsContact O-N 3.16Å; L65-E69 PolarHBondContact O-N 3.37Å
66D87.8Confident79.2Confident65 Ų65122.6 Ų122.635%0.34856%0.562SS.*Hα-helixtrans-64.3-36177.3-67.41.1000111Q62 Q63 Q70Q62-D66 PolarHBondContact NE2-OD1 3.12Å; Q62-D66 WeakPolarHBondContact O-CB 3.12Å; Q62-D66 PolarHBondContact O-N 2.97Å; Q63-D66 PolarHBondContact O-N 3.26Å; D66-Q70 VanDerWaalsContact O-CG 3.23Å; D66-Q70 WeakPolarHBondContact O-CG 3.47Å; D66-Q70 PolarHBondContact O-N 3Å; D66-Q70 VanDerWaalsContact O-N 3.17Å; D66-Q70 PolarHBondContact O-NE2 3.38Å; D66-Q70 VanDerWaalsContact O-NE2 3.14Å
67E82.5Confident77.2Confident84 Ų84122.5 Ų122.539%0.39357%0.574SS.*Hα-helixtrans-62.9-52.3169.8-77.2176-155.500109.9Q63 M64 L65 E69 Q70 W71Q63-E67 HydrophobicContact CG-CG 4.46Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.23Å; Q63-E67 PolarHBondContact NE2-OE1 2.99Å; Q63-E67 WeakPolarHBondContact O-CB 3.49Å; Q63-E67 VanDerWaalsContact O-CG 3.25Å; Q63-E67 WeakPolarHBondContact O-CG 3.42Å; Q63-E67 PolarHBondContact O-N 3.33Å; M64-E67 PolarHBondContact O-N 3.17Å; L65-E67 VanDerWaalsContact C-N 3.28Å; L65-E67 PolarHBondContact O-N 3.14Å; E67-E69 VanDerWaalsContact C-N 3.34Å; E67-E69 PolarHBondContact O-N 2.96Å; E67-Q70 CarbonylContact O-C 3.08Å; E67-Q70 WeakPolarHBondContact O-CB 3.45Å; E67-Q70 PolarHBondContact O-N 3.01Å; E67-Q70 VanDerWaalsContact O-N 3.09Å; E67-W71 PolarHBondContact O-N 3.42Å
68E72.8Confident75.3Confident118 Ų118127.7 Ų127.755%0.55159%0.588SS**Hα-helixtrans-58.2-40179.1-174.8178.3-155.200113.3M64 L65 Q70 W71 E72M64-E68 PolarHBondContact O-N 3.35Å; L65-E68 PolarHBondContact O-N 3Å; L65-E68 VanDerWaalsContact O-N 3.16Å; E68-Q70 VanDerWaalsContact C-N 3.33Å; E68-Q70 PolarHBondContact O-N 3.15Å; E68-W71 CarbonylContact O-C 3.6Å; E68-W71 WeakPolarHBondContact O-CA 3.45Å; E68-W71 PolarHBondContact O-N 2.91Å; E68-W71 VanDerWaalsContact O-N 3.17Å; E68-E72 PolarHBondContact O-N 3.41Å; E68-E72 VanDerWaalsContact O-N 3.15Å
69E76.8Confident73.4Confident145 Ų145125.4 Ų125.468%0.67858%0.581SS**Hα-helixtrans-62.9-40.1175.3-174.1176.5-158.400111.3L65 E67 W71 E72L65-E69 PolarHBondContact O-N 3.37Å; E67-E69 VanDerWaalsContact C-N 3.34Å; E67-E69 PolarHBondContact O-N 2.96Å; E69-W71 VanDerWaalsContact C-N 3.35Å; E69-E72 WeakPolarHBondContact O-CB 3.43Å; E69-E72 PolarHBondContact O-N 3.34Å; E69-E72 VanDerWaalsContact O-N 3.14Å
70Q68.9Low71.5Confident159 Ų159120.3 Ų120.374%0.74357%0.565SS**Hα-helixtrans-70.6-32173.5-70.216949.200112.6D66 E67 E68 E72D66-Q70 VanDerWaalsContact O-CG 3.23Å; D66-Q70 WeakPolarHBondContact O-CG 3.47Å; D66-Q70 PolarHBondContact O-N 3Å; D66-Q70 VanDerWaalsContact O-N 3.17Å; D66-Q70 PolarHBondContact O-NE2 3.38Å; D66-Q70 VanDerWaalsContact O-NE2 3.14Å; E67-Q70 CarbonylContact O-C 3.08Å; E67-Q70 WeakPolarHBondContact O-CB 3.45Å; E67-Q70 PolarHBondContact O-N 3.01Å; E67-Q70 VanDerWaalsContact O-N 3.09Å; E68-Q70 VanDerWaalsContact C-N 3.33Å; E68-Q70 PolarHBondContact O-N 3.15Å; Q70-E72 PolarHBondContact O-N 2.85Å
71W64.8Low69.8Low194 Ų194119.8 Ų119.874%0.73556%0.561SS**THydrogen-bonded Turntrans-82.729.4168.3-59.6110.6000111.7E67 E68 E69 W73E67-W71 PolarHBondContact O-N 3.42Å; E68-W71 CarbonylContact O-C 3.6Å; E68-W71 WeakPolarHBondContact O-CA 3.45Å; E68-W71 PolarHBondContact O-N 2.91Å; E68-W71 VanDerWaalsContact O-N 3.17Å; E69-W71 VanDerWaalsContact C-N 3.35Å; W71-W73 PolarHBondContact O-N 2.86Å
72E58.3Low68.2Low154 Ų154120.7 Ų120.772%0.7258%0.58SS**  trans-30.6113.9161-117.5-173.4-172.200107.6E68 E69 Q70 F74E68-E72 PolarHBondContact O-N 3.41Å; E68-E72 VanDerWaalsContact O-N 3.15Å; E69-E72 WeakPolarHBondContact O-CB 3.43Å; E69-E72 PolarHBondContact O-N 3.34Å; E69-E72 VanDerWaalsContact O-N 3.14Å; Q70-E72 PolarHBondContact O-N 2.85Å; E72-F74 PolarHBondContact O-N 3.03Å
73W58.5Low66.6Low225 Ų225117.4 Ų117.485%0.85257%0.573SS**  trans-57.281.8-176.4-82.372000110.1W71 I75W71-W73 PolarHBondContact O-N 2.86Å; W73-I75 PolarHBondContact O-N 3.47Å
74F50.4Low65.2Low162 Ų162113.4 Ų113.471%0.71156%0.563SS**  trans-72.988.3175.7-161-92.1000105.1E72 P76E72-F74 PolarHBondContact O-N 3.03Å; F74-P76 VanDerWaalsContact C-N 3.34Å; F74-P76 HydrophobicContact CD1-CB 4.16Å; F74-P76 HydrophobicContact CD1-CG 4.22Å; F74-P76 HydrophobicContact CE1-CB 4.24Å; F74-P76 WeakPolarHBondContact O-CD 3.41Å
75I56Low64Low105 Ų105112.9 Ų112.954%0.53857%0.566SS.*  trans-61.9105.3157.6-57.4-179.8000103.6W73 S77 D79 L80W73-I75 PolarHBondContact O-N 3.47Å; I75-S77 PolarHBondContact O-N 3.34Å; I75-D79 HydrophobicContact CG2-CB 4.35Å; I75-L80 HydrophobicContact CG2-CD1 4.18Å; I75-L80 HydrophobicContact CG2-CG 4.2Å
76P54.6Low62.8Low45 Ų45113.4 Ų113.429%0.29257%0.573SS.*  trans-59.6141.3178.8-16.432.7000106.9F74 R78 D79F74-P76 VanDerWaalsContact C-N 3.34Å; F74-P76 HydrophobicContact CD1-CB 4.16Å; F74-P76 HydrophobicContact CD1-CG 4.22Å; F74-P76 HydrophobicContact CE1-CB 4.24Å; F74-P76 WeakPolarHBondContact O-CD 3.41Å; P76-R78 HydrophobicContact CB-CB 4.28Å; P76-R78 PolarHBondContact O-N 3.23Å; P76-D79 WeakPolarHBondContact CD-OD2 3.25Å; P76-D79 PolarHBondContact O-N 3.43Å
77S55.5Low61.6Low100 Ų100114.7 Ų114.770%0.69958%0.577SS**THydrogen-bonded Turntrans-53.9-13.3176.5-44.40000113.6I75I75-S77 PolarHBondContact O-N 3.34Å
78R56.4Low60.8Low204 Ų204113.4 Ų113.477%0.7757%0.573SS**THydrogen-bonded Turntrans-66.2-31.5171.9-168.3-174.871.4179.7-1.8114.1P76P76-R78 HydrophobicContact CB-CB 4.28Å; P76-R78 PolarHBondContact O-N 3.23Å
79D55.5Low60.5Low95 Ų95113 Ų11351%0.50857%0.571SS.*SBendtrans-1000.8-172.8-56.8-23.1000112.1I75 P76I75-D79 HydrophobicContact CG2-CB 4.35Å; P76-D79 WeakPolarHBondContact CD-OD2 3.25Å; P76-D79 PolarHBondContact O-N 3.43Å
80L56.7Low60Low57 Ų57111.3 Ų111.330%0.29857%0.567SS.*SBendtrans-83.7135.7168.5-82.7138.4000110.2I75 L88I75-L80 HydrophobicContact CG2-CD1 4.18Å; I75-L80 HydrophobicContact CG2-CG 4.2Å; L80-L88 HydrophobicContact CD2-CD1 3.53Å
81P57.4Low59.8Low45 Ų45108.5 Ų108.529%0.29255%0.553SS.*  trans-58.8147.4174.223.3-31000110.2G83 G84 L88P81-G83 PolarHBondContact O-N 2.98Å; P81-G84 PolarHBondContact O-N 3.45Å; P81-G84 VanDerWaalsContact O-N 3.12Å; P81-L88 HydrophobicContact CG-CD2 4.2Å; P81-L88 HydrophobicContact CG-CG 4.14Å
82P60.9Low59.9Low147 Ų147103.4 Ų103.496%0.95554%0.54SS*.THydrogen-bonded Turntrans-61.3-1.1-172.721.1-31.3000115.4
83G61.2Low60.4Low31 Ų3199.4 Ų99.432%0.3253%0.529SS..THydrogen-bonded Turntrans-90-1.4175.500000115.8P81 T86P81-G83 PolarHBondContact O-N 2.98Å; G83-T86 PolarHBondContact O-OG1 2.72Å
84G61Low60.6Low32 Ų3295.5 Ų95.533%0.3352%0.524SS..Hα-helixtrans68.6-176.8178.600000114.3P81 T86 Q87P81-G84 PolarHBondContact O-N 3.45Å; P81-G84 VanDerWaalsContact O-N 3.12Å; G84-T86 PolarHBondContact O-N 3.33Å; G84-T86 VanDerWaalsContact O-N 3.11Å; G84-Q87 PolarHBondContact O-N 3.15Å
85V61.3Low61.3Low110 Ų11094.2 Ų94.267%0.66752%0.524SS*.Hα-helixtrans-58.8-26.9-173-165.50000112.7L88 Q89V85-L88 PolarHBondContact O-N 3.09Å; V85-Q89 PolarHBondContact O-N 2.95Å
86T61.3Low61.7Low104 Ų10494 Ų9464%0.63853%0.527SS*.Hα-helixtrans-66.5-41.5178.746.90000113G83 G84 L88 Q89 D90G83-T86 PolarHBondContact O-OG1 2.72Å; G84-T86 PolarHBondContact O-N 3.33Å; G84-T86 VanDerWaalsContact O-N 3.11Å; T86-L88 VanDerWaalsContact C-N 3.3Å; T86-L88 PolarHBondContact O-N 2.97Å; T86-Q89 WeakPolarHBondContact O-CB 3.33Å; T86-Q89 PolarHBondContact O-N 2.96Å; T86-D90 PolarHBondContact O-N 2.79Å; T86-D90 VanDerWaalsContact O-N 3.14Å
87Q62.8Low61.6Low93 Ų9398.8 Ų98.844%0.43555%0.549SS..Hα-helixtrans-71.2-27.9177.4-175.2172.379.900112.3G84 Q91G84-Q87 PolarHBondContact O-N 3.15Å; Q87-Q91 WeakPolarHBondContact O-CG 3.39Å; Q87-Q91 PolarHBondContact O-N 2.94Å; Q87-Q91 PolarHBondContact O-NE2 3.35Å
88L65.7Low61.7Low56 Ų5698.2 Ų98.229%0.29354%0.538SS..Hα-helixtrans-71.8-40.1170.4-77.8174.3000111.5L80 P81 V85 T86 D90 Q91 I92L80-L88 HydrophobicContact CD2-CD1 3.53Å; P81-L88 HydrophobicContact CG-CD2 4.2Å; P81-L88 HydrophobicContact CG-CG 4.14Å; V85-L88 PolarHBondContact O-N 3.09Å; T86-L88 VanDerWaalsContact C-N 3.3Å; T86-L88 PolarHBondContact O-N 2.97Å; L88-D90 VanDerWaalsContact C-N 3.27Å; L88-D90 PolarHBondContact O-N 2.88Å; L88-Q91 PolarHBondContact O-N 3.48Å; L88-Q91 VanDerWaalsContact O-N 3.17Å; L88-I92 WeakPolarHBondContact O-CB 3.5Å; L88-I92 VanDerWaalsContact O-CG1 3.24Å; L88-I92 WeakPolarHBondContact O-CG1 3.35Å; L88-I92 PolarHBondContact O-N 3.39Å
89Q65.7Low61.7Low110 Ų11094.4 Ų94.451%0.51454%0.54SS..Hα-helixtrans-58.8-39.7176-166.667.758.100111.8V85 T86 S93V85-Q89 PolarHBondContact O-N 2.95Å; T86-Q89 WeakPolarHBondContact O-CB 3.33Å; T86-Q89 PolarHBondContact O-N 2.96Å; Q89-S93 WeakPolarHBondContact O-CB 3.44Å; Q89-S93 PolarHBondContact O-N 3.2Å; Q89-S93 PolarHBondContact O-OG 3.08Å
90D66.5Low61.7Low110 Ų11097.1 Ų97.159%0.58856%0.555SS**Hα-helixtrans-67-40.9176.2-70-23.1000112.1T86 L88 L94T86-D90 PolarHBondContact O-N 2.79Å; T86-D90 VanDerWaalsContact O-N 3.14Å; L88-D90 VanDerWaalsContact C-N 3.27Å; L88-D90 PolarHBondContact O-N 2.88Å; D90-L94 PolarHBondContact O-N 2.97Å
91Q64.2Low61.7Low100 Ų10099.2 Ų99.247%0.46757%0.565SS.*Hα-helixtrans-69-38.9176-73.5177.597.900112.6Q87 L88 L94 L95Q87-Q91 WeakPolarHBondContact O-CG 3.39Å; Q87-Q91 PolarHBondContact O-N 2.94Å; Q87-Q91 PolarHBondContact O-NE2 3.35Å; L88-Q91 PolarHBondContact O-N 3.48Å; L88-Q91 VanDerWaalsContact O-N 3.17Å; Q91-L94 PolarHBondContact O-N 3.29Å; Q91-L95 WeakPolarHBondContact O-CG 3.42Å; Q91-L95 PolarHBondContact O-N 3.15Å
92I68.4Low61.6Low87 Ų87107.2 Ų107.245%0.44659%0.589SS.*Hα-helixtrans-67.5-40.5176.5-69.4165.3000110.1L88 L94 L95 V96L88-I92 WeakPolarHBondContact O-CB 3.5Å; L88-I92 VanDerWaalsContact O-CG1 3.24Å; L88-I92 WeakPolarHBondContact O-CG1 3.35Å; L88-I92 PolarHBondContact O-N 3.39Å; I92-L94 PolarHBondContact O-N 3.46Å; I92-L95 CarbonylContact O-C 3.39Å; I92-L95 WeakPolarHBondContact O-CA 3.49Å; I92-L95 PolarHBondContact O-N 3.03Å; I92-V96 PolarHBondContact O-N 3.32Å; I92-V96 VanDerWaalsContact O-N 3.1Å
93S67.9Low61.3Low70 Ų70105.7 Ų105.749%0.4958%0.58SS.*Hα-helixtrans-62.1-28.7176.3-59.60000112.6Q89Q89-S93 WeakPolarHBondContact O-CB 3.44Å; Q89-S93 PolarHBondContact O-N 3.2Å; Q89-S93 PolarHBondContact O-OG 3.08Å
94L63.7Low60.9Low143 Ų143110.7 Ų110.775%0.74960%0.599SS**Hα-helixtrans-76.4-21.4172.5-75.9166.3000113.7D90 Q91 I92D90-L94 PolarHBondContact O-N 2.97Å; Q91-L94 PolarHBondContact O-N 3.29Å; I92-L94 PolarHBondContact O-N 3.46Å
95L63.6Low60.6Low135 Ų135114 Ų11471%0.70761%0.613SS**Hα-helixtrans-92.9-10.4179.1-69.7164.4000113Q91 I92 L97Q91-L95 WeakPolarHBondContact O-CG 3.42Å; Q91-L95 PolarHBondContact O-N 3.15Å; I92-L95 CarbonylContact O-C 3.39Å; I92-L95 WeakPolarHBondContact O-CA 3.49Å; I92-L95 PolarHBondContact O-N 3.03Å; L95-L97 PolarHBondContact O-N 2.97Å
96V65.9Low60.6Low100 Ų100111.7 Ų111.761%0.60660%0.601SS**  trans-66.3105.2173.1171.70000108.3I92 D98I92-V96 PolarHBondContact O-N 3.32Å; I92-V96 VanDerWaalsContact O-N 3.1Å; V96-D98 PolarHBondContact O-N 3.39Å; V96-D98 VanDerWaalsContact O-N 3.14Å
97L52.2Low60.6Low145 Ų145111 Ų11176%0.75959%0.594SS**  trans-73.499.3169.6-61.6174.8000107.7L95 P99L95-L97 PolarHBondContact O-N 2.97Å; L97-P99 VanDerWaalsContact O-CD 3.31Å; L97-P99 WeakPolarHBondContact O-CD 3.16Å
98D56.4Low60.7Low89 Ų89112 Ų11248%0.47660%0.602SS.*  trans-71.7113.1172.5-161.57.6000108.5V96 D100 I101V96-D98 PolarHBondContact O-N 3.39Å; V96-D98 VanDerWaalsContact O-N 3.14Å; D98-D100 PolarHBondContact O-N 2.91Å; D98-D100 VanDerWaalsContact O-N 3.09Å; D98-I101 HydrophobicContact CB-CB 4.46Å; D98-I101 HydrophobicContact CB-CD1 3.7Å; D98-I101 HydrophobicContact CB-CG1 3.88Å; D98-I101 PolarHBondContact O-N 2.67Å; D98-I101 WeakPolarHBondContact OD2-CD1 3.36Å
99P56.4Low60.8Low124 Ų124114.5 Ų114.581%0.80561%0.612SS**THydrogen-bonded Turntrans-68-11-171.727.4-35.1000113.9L97L97-P99 VanDerWaalsContact O-CD 3.31Å; L97-P99 WeakPolarHBondContact O-CD 3.16Å
100D55.8Low61Low152 Ų152113.8 Ų113.881%0.81362%0.615SS**THydrogen-bonded Turntrans-98.6-3.6-180-93.9-24.3000114.2D98D98-D100 PolarHBondContact O-N 2.91Å; D98-D100 VanDerWaalsContact O-N 3.09Å
101I57.4Low61Low101 Ų101113.4 Ų113.452%0.51862%0.616SS.*SBendtrans-89119.3178.6-62.2179.7000110D98D98-I101 HydrophobicContact CB-CB 4.46Å; D98-I101 HydrophobicContact CB-CD1 3.7Å; D98-I101 HydrophobicContact CB-CG1 3.88Å; D98-I101 PolarHBondContact O-N 2.67Å; D98-I101 WeakPolarHBondContact OD2-CD1 3.36Å
102R55.1Low61.3Low213 Ų213114 Ų11480%0.80463%0.626SS**  trans-51.8134.2-179.9-56.217472.3-145.4-0.5110.7D104R102-D104 PolarHBondContact O-N 3.33Å
103P54.3Low61.7Low115 Ų115119 Ų11975%0.74764%0.64SS**THydrogen-bonded Turntrans-8137-162.835.3-40.2000114.8
104D53.4Low62Low135 Ų135118.3 Ų118.372%0.72264%0.635SS**THydrogen-bonded Turntrans-119.1-10.8-164.5-154.221.8000115.6R102R102-D104 PolarHBondContact O-N 3.33Å
105T55.4Low62.8Low103 Ų103117.4 Ų117.463%0.63264%0.64SS**SBendtrans-133.8-42-177.657.10000115.5E109T105-E109 PolarHBondContact O-N 2.71Å
106S60.4Low63.6Low60 Ų60116.1 Ų116.142%0.4263%0.633SS.*Hα-helixtrans-72.2-41.5-173.3-500000112.2L108 E109 V110S106-L108 VanDerWaalsContact C-N 3.33Å; S106-L108 PolarHBondContact O-N 2.88Å; S106-E109 PolarHBondContact O-N 3.18Å; S106-V110 WeakPolarHBondContact O-CG2 3.42Å; S106-V110 PolarHBondContact O-N 2.9Å
107D62.3Low64.3Low90 Ų90115.9 Ų115.948%0.48163%0.629SS.*Hα-helixtrans-67.6-35.1-178.6-65.6-7000112V110 V111D107-V110 PolarHBondContact O-N 2.9Å; D107-V111 VanDerWaalsContact O-CG2 3.28Å; D107-V111 WeakPolarHBondContact O-CG2 3.44Å; D107-V111 PolarHBondContact O-N 3.1Å
108L64.4Low65.6Low115 Ų115113.7 Ų113.760%0.60262%0.623SS**Hα-helixtrans-69-37.5177.7-168.668.9000111.4S106 V111 V112S106-L108 VanDerWaalsContact C-N 3.33Å; S106-L108 PolarHBondContact O-N 2.88Å; L108-V111 PolarHBondContact O-N 2.83Å; L108-V112 HydrophobicContact CG-CG2 4.4Å; L108-V112 WeakPolarHBondContact O-CB 3.43Å; L108-V112 WeakPolarHBondContact O-CG2 3.44Å; L108-V112 PolarHBondContact O-N 3Å
109E66.6Low66.7Low107 Ų107115.3 Ų115.350%0.563%0.632SS.*Hα-helixtrans-64.8-41.7176.7-166.2-171.216100111.4T105 S106 V112 R113T105-E109 PolarHBondContact O-N 2.71Å; S106-E109 PolarHBondContact O-N 3.18Å; E109-V112 PolarHBondContact O-N 3.43Å; E109-R113 HydrophobicContact CG-CG 4.45Å; E109-R113 WeakPolarHBondContact O-CB 3.34Å; E109-R113 VanDerWaalsContact O-CG 3.3Å; E109-R113 WeakPolarHBondContact O-CG 3.46Å; E109-R113 PolarHBondContact O-N 3.4Å; E109-R113 IonicContact OE1-CZ 3.83Å; E109-R113 IonicContact OE1-NH1 2.83Å; E109-R113 PolarHBondContact OE1-NH1 2.96Å
110V71.4Confident68Low95 Ų95110.5 Ų110.558%0.57660%0.603SS**Hα-helixtrans-62.7-43.5176.4173.60000111.1S106 D107 R113 S114S106-V110 WeakPolarHBondContact O-CG2 3.42Å; S106-V110 PolarHBondContact O-N 2.9Å; D107-V110 PolarHBondContact O-N 2.9Å; V110-R113 PolarHBondContact O-N 3.26Å; V110-S114 PolarHBondContact O-N 2.73Å
111V66.5Low69.1Low102 Ų102112.5 Ų112.562%0.61860%0.604SS**Hα-helixtrans-65.9-40.4177.3172.40000111.7D107 L108 S114D107-V111 VanDerWaalsContact O-CG2 3.28Å; D107-V111 WeakPolarHBondContact O-CG2 3.44Å; D107-V111 PolarHBondContact O-N 3.1Å; L108-V111 PolarHBondContact O-N 2.83Å; V111-S114 VanDerWaalsContact O-CB 3.25Å; V111-S114 WeakPolarHBondContact O-CB 3.39Å; V111-S114 PolarHBondContact O-N 2.97Å
112V70.2Confident70.2Confident113 Ų113115 Ų11569%0.68561%0.614SS**Hα-helixtrans-71.4-30.8-179.4170.50000112.4L108 E109L108-V112 HydrophobicContact CG-CG2 4.4Å; L108-V112 WeakPolarHBondContact O-CB 3.43Å; L108-V112 WeakPolarHBondContact O-CG2 3.44Å; L108-V112 PolarHBondContact O-N 3Å; E109-V112 PolarHBondContact O-N 3.43Å
113R75.6Confident71.1Confident193 Ų193110.5 Ų110.573%0.72860%0.6SS**Hα-helixtrans-88.6-5.5176.8-62.2177.889.4169.61.9113E109 V110 S115E109-R113 HydrophobicContact CG-CG 4.45Å; E109-R113 WeakPolarHBondContact O-CB 3.34Å; E109-R113 VanDerWaalsContact O-CG 3.3Å; E109-R113 WeakPolarHBondContact O-CG 3.46Å; E109-R113 PolarHBondContact O-N 3.4Å; E109-R113 IonicContact OE1-CZ 3.83Å; E109-R113 IonicContact OE1-NH1 2.83Å; E109-R113 PolarHBondContact OE1-NH1 2.96Å; V110-R113 PolarHBondContact O-N 3.26Å; R113-S115 PolarHBondContact O-N 3.32Å
114S75Confident72.1Confident54 Ų54108 Ų10838%0.37858%0.583SS.*  trans-63.7130.4176.4-175.10000111V110 V111 L116V110-S114 PolarHBondContact O-N 2.73Å; V111-S114 VanDerWaalsContact O-CB 3.25Å; V111-S114 WeakPolarHBondContact O-CB 3.39Å; V111-S114 PolarHBondContact O-N 2.97Å; S114-L116 PolarHBondContact O-N 3.43Å; S114-L116 WeakPolarHBondContact OG-CB 3.5Å; S114-L116 WeakPolarHBondContact OG-CG 3.46Å; S114-L116 PolarHBondContact OG-N 3.36Å
115S81.4Confident73.2Confident124 Ų124107.9 Ų107.987%0.86759%0.589SS**  trans-84.44.9171.963.40000112.9R113R113-S115 PolarHBondContact O-N 3.32Å
116L79.6Confident73.8Confident108 Ų108106 Ų10657%0.56559%0.591SS**SBendtrans-73.9143.5-179.5-60.2178.4000110.4S114 P118S114-L116 PolarHBondContact O-N 3.43Å; S114-L116 WeakPolarHBondContact OG-CB 3.5Å; S114-L116 WeakPolarHBondContact OG-CG 3.46Å; S114-L116 PolarHBondContact OG-N 3.36Å; L116-P118 WeakPolarHBondContact O-CD 3.47Å
117N80.3Confident74Confident96 Ų96110.5 Ų110.551%0.51361%0.608SS.*  trans-74.9112.1176.2176.510.9000109.6N119 A120N117-N119 PolarHBondContact O-N 3.38Å; N117-N119 WeakPolarHBondContact OD1-CB 3.42Å; N117-N119 PolarHBondContact OD1-N 3.19Å; N117-A120 WeakPolarHBondContact O-CB 3.4Å; N117-A120 PolarHBondContact O-N 3.24Å
118P80.3Confident74.1Confident99 Ų99115 Ų11564%0.64363%0.626SS**THydrogen-bonded Turntrans-64.7-16.4-17927.3-35.2000112.8L116L116-P118 WeakPolarHBondContact O-CD 3.47Å
119N78.9Confident74Confident123 Ų123117.5 Ų117.566%0.65863%0.633SS**THydrogen-bonded Turntrans-94.612.6177.3-55.3-65.3000113.3N117N117-N119 PolarHBondContact O-N 3.38Å; N117-N119 WeakPolarHBondContact OD1-CB 3.42Å; N117-N119 PolarHBondContact OD1-N 3.19Å
120A83.9Confident73.6Confident23 Ų23120.5 Ų120.519%0.1965%0.646CS.*SBendtrans-61.7149.3175.600000111.1N117 E122 F123 T124N117-A120 WeakPolarHBondContact O-CB 3.4Å; N117-A120 PolarHBondContact O-N 3.24Å; A120-E122 HydrophobicContact CB-CG 3.88Å; A120-E122 PolarHBondContact O-N 3.19Å; A120-E122 VanDerWaalsContact O-N 3.1Å; A120-F123 HydrophobicContact CB-CD2 3.94Å; A120-F123 HydrophobicContact CB-CE2 4.38Å; A120-F123 PolarHBondContact O-N 3.12Å; A120-T124 PolarHBondContact O-N 2.6Å; A120-T124 VanDerWaalsContact O-N 3.15Å; A120-T124 PolarHBondContact O-OG1 3.41Å
121K78.7Confident73Confident193 Ų193123 Ų12384%0.83966%0.657SS**THydrogen-bonded Turntrans-62-20.6-176-77.5-176.5174.4-1800114T124K121-T124 WeakPolarHBondContact CA-OG1 3.45Å; K121-T124 VanDerWaalsContact O-O 3.11Å
122E79.8Confident72.5Confident155 Ų155129.3 Ų129.372%0.72469%0.685SS**THydrogen-bonded Turntrans-74.8-27.8174.859.9-163-154.500113.4A120A120-E122 HydrophobicContact CB-CG 3.88Å; A120-E122 PolarHBondContact O-N 3.19Å; A120-E122 VanDerWaalsContact O-N 3.1Å
123F75.6Confident72.6Confident118 Ų118130.1 Ų130.152%0.51869%0.685SS.*THydrogen-bonded Turntrans-98.9-11.6177.9-58.3-63.4000113.3A120A120-F123 HydrophobicContact CB-CD2 3.94Å; A120-F123 HydrophobicContact CB-CE2 4.38Å; A120-F123 PolarHBondContact O-N 3.12Å
124T75.6Confident72.5Confident63 Ų63126.8 Ų126.839%0.38768%0.683SS.*SBendtrans-94117172.150.60000108.9A120 K121 G126A120-T124 PolarHBondContact O-N 2.6Å; A120-T124 VanDerWaalsContact O-N 3.15Å; A120-T124 PolarHBondContact O-OG1 3.41Å; K121-T124 WeakPolarHBondContact CA-OG1 3.45Å; K121-T124 VanDerWaalsContact O-O 3.11Å; T124-G126 PolarHBondContact O-N 3.12Å
125P76.1Confident72.3Confident131 Ų131130.8 Ų130.885%0.85170%0.7SS**  trans-54.7112.5-177.8-26.934.5000111.6
126G66.7Low71.8Confident65 Ų65131.2 Ų131.267%0.6769%0.69SS**  trans-78.3126.4-177.900000111.8T124 Q128T124-G126 PolarHBondContact O-N 3.12Å; G126-Q128 PolarHBondContact O-N 3.29Å
127I65.9Low71.3Confident153 Ų153132.7 Ų132.779%0.78570%0.698SS**  trans-79.287.6172.1-45.8152.5000107.3K129I127-K129 HydrophobicContact CG2-CG 4.3Å; I127-K129 PolarHBondContact O-N 3.19Å
128Q63.1Low70.7Confident184 Ų184135.1 Ų135.186%0.8671%0.71SS**  trans-71.599.4171.8-69.8-175.213.600108.8G126 H130G126-Q128 PolarHBondContact O-N 3.29Å; Q128-H130 PolarHBondContact O-N 2.82Å
129K63.3Low70Confident169 Ų169137.7 Ų137.774%0.73572%0.715SS**  trans-77.9101.6169.3-65.6-173-178.6-177.90108.1I127 N131I127-K129 HydrophobicContact CG2-CG 4.3Å; I127-K129 PolarHBondContact O-N 3.19Å; K129-N131 PolarHBondContact O-N 3.3Å
130H57.8Low69.4Low169 Ų169138.8 Ų138.878%0.78272%0.72SS**  trans-72.6106.3167.8-142.5-88.2000107.4Q128 L132Q128-H130 PolarHBondContact O-N 2.82Å; H130-L132 PolarHBondContact O-N 3.46Å
131N59.1Low68.2Low149 Ų149148.5 Ų148.580%0.79776%0.764SS**  trans-78.8117170.9-72.5-39000107.6K129K129-N131 PolarHBondContact O-N 3.3Å
132L56.3Low67.2Low233 Ų233144.5 Ų144.5100%1.2276%0.757SS**  trans-83.50167.3-79.3157.4000110.1H130H130-L132 PolarHBondContact O-N 3.46Å

Retrieved 132 of 132 residues in 27.5 ms (Link to these results)