A0A087WX09_HUMAN Loading...

DEAD-box helicase 3 X-linked

AlphaFold DB , UniProt , Accession A0A087WX09, Species HUMAN (Homo sapiens, Human), Gene DDX3X, Length 98 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
1M46.1Very low57.9Low248 Ų248118.4 Ų118.4100%1.22267%0.674SS**  0111.70-66167.899.400106.9
2S57.4Low59Low114 Ų114114.5 Ų114.580%0.79765%0.649SS**  trans-89112-171.147.70000111
3H57Low59.7Low175 Ų175115 Ų11581%0.8165%0.649SS**  trans-106.4101.8159-175.7-81000107.7
4V60.4Low61Low101 Ų101116.9 Ų116.961%0.61265%0.65SS**  trans-84.3108.8-180171.30000107.3V6V4-V6 HydrophobicContact CG1-CB 3.82Å; V4-V6 HydrophobicContact CG1-CG2 3.2Å; V4-V6 PolarHBondContact O-N 2.97Å
5A64.6Low61.9Low81 Ų81117.1 Ų117.167%0.66964%0.644SS**  trans-77.174.7173.500000109.8
6V59.4Low62.5Low102 Ų102118.3 Ų118.362%0.61864%0.641SS**  trans-104-7.3177.8164.50000112.7V4V4-V6 HydrophobicContact CG1-CB 3.82Å; V4-V6 HydrophobicContact CG1-CG2 3.2Å; V4-V6 PolarHBondContact O-N 2.97Å
7E56.8Low63.2Low186 Ų186116.1 Ų116.187%0.86964%0.643SS**SBendtrans-94.7-9.2-175-51.5-159.6171.500114
8N57.1Low63.6Low95 Ų95113.4 Ų113.451%0.50865%0.646SS.*SBendtrans-104.9-4.3178.4-163.345.6000114.2L10 G11 L12N8-L10 VanDerWaalsContact C-N 3.34Å; N8-G11 PolarHBondContact O-N 3.42Å; N8-L12 PolarHBondContact O-N 3.24Å
9A57.2Low64.4Low55 Ų55113.7 Ų113.746%0.45564%0.644SS.*Hα-helixtrans-67-38.217700000111.5G11 L12A9-G11 PolarHBondContact O-N 3.37Å; A9-L12 PolarHBondContact O-N 3.21Å
10L56.8Low65Low127 Ų127113.2 Ų113.267%0.66564%0.64SS**Hα-helixtrans-66.3-19.3175.2-55.9178.5000112.7N8 Q14N8-L10 VanDerWaalsContact C-N 3.34Å; L10-Q14 WeakPolarHBondContact O-CG 3.1Å; L10-Q14 PolarHBondContact O-NE2 3.02Å
11G64.1Low65.1Low18 Ų18116.5 Ų116.519%0.18666%0.655CS.*Hα-helixtrans-86.6-31.4-179.800000113.9N8 A9 Q15N8-G11 PolarHBondContact O-N 3.42Å; A9-G11 PolarHBondContact O-N 3.37Å; G11-Q15 WeakPolarHBondContact O-CB 3.4Å; G11-Q15 WeakPolarHBondContact O-CG 3.38Å; G11-Q15 PolarHBondContact O-N 3.04Å
12L70.6Confident66.2Low72 Ų72111.2 Ų111.238%0.37763%0.632SS.*Hα-helixtrans-72.9-46.8-174.9-66.7175.9000111.7N8 A9 Q14 Q15 F16N8-L12 PolarHBondContact O-N 3.24Å; A9-L12 PolarHBondContact O-N 3.21Å; L12-Q14 VanDerWaalsContact C-N 3.27Å; L12-Q14 PolarHBondContact O-N 2.95Å; L12-Q15 WeakPolarHBondContact O-CB 3.41Å; L12-Q15 PolarHBondContact O-N 3.45Å; L12-Q15 VanDerWaalsContact O-N 3.1Å; L12-F16 HydrophobicContact CB-CE2 4.43Å; L12-F16 WeakPolarHBondContact O-CD2 3.43Å; L12-F16 PolarHBondContact O-N 3.44Å; L12-F16 VanDerWaalsContact O-N 3.12Å
13D68.8Low66.5Low121 Ų121110 Ų11065%0.64762%0.623SS**Hα-helixtrans-65.7-34.5-178.7-57.7-31.4000111.4F16 A17D13-F16 PolarHBondContact O-N 3.12Å; D13-A17 WeakPolarHBondContact O-CB 2.99Å; D13-A17 PolarHBondContact O-N 3.1Å
14Q77.5Confident66.7Low141 Ų141106.8 Ų106.866%0.65962%0.62SS**Hα-helixtrans-70.1-34.3173.7-72.8169.234.800112.5L10 L12 F16 A17L10-Q14 WeakPolarHBondContact O-CG 3.1Å; L10-Q14 PolarHBondContact O-NE2 3.02Å; L12-Q14 VanDerWaalsContact C-N 3.27Å; L12-Q14 PolarHBondContact O-N 2.95Å; Q14-F16 VanDerWaalsContact C-N 3.32Å; Q14-A17 PolarHBondContact O-N 3.34Å
15Q74.5Confident66.9Low120 Ų120108 Ų10856%0.56162%0.623SS**Hα-helixtrans-65.9-34.2174.6-78.4169.413.900112.3G11 L12G11-Q15 WeakPolarHBondContact O-CB 3.4Å; G11-Q15 WeakPolarHBondContact O-CG 3.38Å; G11-Q15 PolarHBondContact O-N 3.04Å; L12-Q15 WeakPolarHBondContact O-CB 3.41Å; L12-Q15 PolarHBondContact O-N 3.45Å; L12-Q15 VanDerWaalsContact O-N 3.1Å
16F71Confident66.7Low136 Ų136110.6 Ų110.660%0.59663%0.626SS**Hα-helixtrans-84-25.1176.7-63.3-63.5000113.4L12 D13 Q14 G18 L19L12-F16 HydrophobicContact CB-CE2 4.43Å; L12-F16 WeakPolarHBondContact O-CD2 3.43Å; L12-F16 PolarHBondContact O-N 3.44Å; L12-F16 VanDerWaalsContact O-N 3.12Å; D13-F16 PolarHBondContact O-N 3.12Å; Q14-F16 VanDerWaalsContact C-N 3.32Å; F16-G18 PolarHBondContact O-N 3.2Å; F16-L19 HydrophobicContact CD1-CD1 3.78Å; F16-L19 HydrophobicContact CE1-CD1 4.4Å; F16-L19 PolarHBondContact O-N 3.21Å; F16-L19 VanDerWaalsContact O-N 3.12Å
17A75Confident66.6Low82 Ų82115.3 Ų115.368%0.67864%0.641SS**Hα-helixtrans-62.2-23.7179.100000114.1D13 Q14D13-A17 WeakPolarHBondContact O-CB 2.99Å; D13-A17 PolarHBondContact O-N 3.1Å; Q14-A17 PolarHBondContact O-N 3.34Å
18G71.2Confident66.9Low67 Ų67111.5 Ų111.569%0.69164%0.635SS**THydrogen-bonded Turntrans-91.4-1.9177.100000115.2F16 D20F16-G18 PolarHBondContact O-N 3.2Å; G18-D20 VanDerWaalsContact C-N 3.26Å; G18-D20 PolarHBondContact O-N 3.12Å
19L77.9Confident67Low119 Ų119110.4 Ų110.462%0.62365%0.647SS**  trans-93.437.6-177.7-61.9175.7000112.1F16 L21F16-L19 HydrophobicContact CD1-CD1 3.78Å; F16-L19 HydrophobicContact CE1-CD1 4.4Å; F16-L19 PolarHBondContact O-N 3.21Å; F16-L19 VanDerWaalsContact O-N 3.12Å; L19-L21 PolarHBondContact O-N 3.33Å
20D76.4Confident66.9Low104 Ų104109.8 Ų109.856%0.55665%0.646SS**  trans-67.5115.7175.3-17821.5000110.5G18 N22 S23G18-D20 VanDerWaalsContact C-N 3.26Å; G18-D20 PolarHBondContact O-N 3.12Å; D20-N22 PolarHBondContact O-N 2.93Å; D20-N22 VanDerWaalsContact OD1-CB 3.31Å; D20-N22 WeakPolarHBondContact OD1-CB 3.31Å; D20-N22 PolarHBondContact OD1-N 3.3Å; D20-S23 PolarHBondContact O-N 3.38Å
21L68.2Low66.8Low182 Ų182107.7 Ų107.795%0.95364%0.641SS**THydrogen-bonded Turntrans-71.7-9.5176-64.3173.5000112.7L19L19-L21 PolarHBondContact O-N 3.33Å
22N67.6Low66.4Low137 Ų137113.6 Ų113.673%0.73367%0.674SS**THydrogen-bonded Turntrans-93.26.9177-120.6-23.9000113.6D20 S24D20-N22 PolarHBondContact O-N 2.93Å; D20-N22 VanDerWaalsContact OD1-CB 3.31Å; D20-N22 WeakPolarHBondContact OD1-CB 3.31Å; D20-N22 PolarHBondContact OD1-N 3.3Å; N22-S24 PolarHBondContact O-N 2.85Å
23S63.7Low65.8Low88 Ų88112.6 Ų112.662%0.61568%0.676SS**  trans-64.994173.8-172.30000110.3D20 D25D20-S23 PolarHBondContact O-N 3.38Å; S23-D25 PolarHBondContact O-N 3.21Å
24S62.6Low65.4Low108 Ų108110.7 Ų110.776%0.75567%0.673SS**  trans-83.315.9-178.164.40000113.8N22 N26N22-S24 PolarHBondContact O-N 2.85Å; S24-N26 PolarHBondContact O-N 3.45Å
25D63.9Low64.7Low127 Ų127109.8 Ų109.868%0.67967%0.666SS**  trans-86.792.9-174.9-70.9-22.7000110.7S23S23-D25 PolarHBondContact O-N 3.21Å
26N59.5Low64.3Low135 Ų135108 Ų10872%0.72268%0.679SS**  trans85.983.5153-48.7-48.6000115.7S24 S28S24-N26 PolarHBondContact O-N 3.45Å; N26-S28 PolarHBondContact O-N 3.3Å
27Q58.8Low64.7Low202 Ų202110 Ų11094%0.94468%0.683SS**  trans-65.147.2149.5-61.2-176.1-61.900111.4G29Q27-G29 PolarHBondContact O-N 3.04Å
28S63.1Low65.3Low105 Ų105114.5 Ų114.573%0.73468%0.684SS**  trans-85.7110174.3-171.10000109.2N26N26-S28 PolarHBondContact O-N 3.3Å
29G58.6Low65.9Low73 Ų73115.5 Ų115.575%0.75367%0.672SS**SBendtrans76.186.1146.800000117.2Q27Q27-G29 PolarHBondContact O-N 3.04Å
30G55Low66.3Low42 Ų42111.4 Ų111.443%0.43365%0.653SS.*SBendtrans159.386.6150.900000114.6K35G30-K35 WeakPolarHBondContact O-CD 3.46Å; G30-K35 WeakPolarHBondContact O-CE 3.19Å; G30-K35 VanDerWaalsContact O-CG 3.3Å; G30-K35 WeakPolarHBondContact O-CG 3.5Å; G30-K35 PolarHBondContact O-NZ 3.49Å
31S54.8Low66.5Low82 Ų82110.1 Ų110.157%0.57365%0.65SS**  trans32.4105.7163.2-163.50000117.7A33 S34S31-A33 PolarHBondContact O-N 2.77Å; S31-S34 PolarHBondContact O-N 3.06Å; S31-S34 VanDerWaalsContact O-N 3.08Å
32T56.3Low67.3Low143 Ų143108.1 Ų108.188%0.87764%0.636SS**THydrogen-bonded Turntrans-56.2-1.5176.644.50000115.6
33A56.8Low67.9Low51 Ų51104.5 Ų104.542%0.42162%0.616SS.*THydrogen-bonded Turntrans-91.6-20.2173.800000114.4S31 R37S31-A33 PolarHBondContact O-N 2.77Å; A33-R37 PolarHBondContact O-NE 3.38Å; A33-R37 PolarHBondContact O-NH2 3.29Å
34S60.8Low68.8Low81 Ų81106.7 Ų106.757%0.56661%0.611SS**THydrogen-bonded Turntrans-124.3-16.5-161.9-44.60000115.8S31 G36S31-S34 PolarHBondContact O-N 3.06Å; S31-S34 VanDerWaalsContact O-N 3.08Å; S34-G36 PolarHBondContact O-N 2.81Å
35K62.6Low69.4Low122 Ų122107.1 Ų107.153%0.5361%0.605SS.*THydrogen-bonded Turntrans-91.295.1-177.739.8178.3175.4-159.20110.2G30G30-K35 WeakPolarHBondContact O-CD 3.46Å; G30-K35 WeakPolarHBondContact O-CE 3.19Å; G30-K35 VanDerWaalsContact O-CG 3.3Å; G30-K35 WeakPolarHBondContact O-CG 3.5Å; G30-K35 PolarHBondContact O-NZ 3.49Å
36G66.6Low69.7Low81 Ų81109.3 Ų109.384%0.83560%0.604SS**THydrogen-bonded Turntrans132.1-4.7176.500000114.8S34S34-G36 PolarHBondContact O-N 2.81Å
37R80.4Confident69.9Low179 Ų179108.8 Ų108.868%0.67560%0.597SS**  trans-92.2116.5174.1-62.5-165.6-77.2-174.52109.1A33 I39A33-R37 PolarHBondContact O-NE 3.38Å; A33-R37 PolarHBondContact O-NH2 3.29Å; R37-I39 PolarHBondContact O-N 3.23Å
38Y85.6Confident69.8Low176 Ų176103.4 Ų103.469%0.6959%0.587SS**  trans-59.3121.1172172.8-98.9000109.7P40 P41Y38-P40 HydrophobicContact CD1-CG 4.4Å; Y38-P40 HydrophobicContact CE1-CB 4.25Å; Y38-P40 HydrophobicContact CE1-CG 4.03Å; Y38-P41 WeakPolarHBondContact OH-CD 3.3Å
39I83.9Confident69.5Low88 Ų88102.5 Ų102.545%0.45158%0.577SS.*  trans-101.4114.6172.6-54.5177.3000107.5R37 L43 R44R37-I39 PolarHBondContact O-N 3.23Å; I39-L43 HydrophobicContact CG2-CB 3.85Å; I39-R44 HydrophobicContact CB-CG 4.44Å; I39-R44 HydrophobicContact CG2-CG 4.02Å; I39-R44 PolarHBondContact O-NE 3.09Å
40P86.5Confident69.4Low33 Ų33105.3 Ų105.321%0.21457%0.568CS.*  trans-51.2142.9175.8-25.331.1000111.5Y38 H42 L43 R44Y38-P40 HydrophobicContact CD1-CG 4.4Å; Y38-P40 HydrophobicContact CE1-CB 4.25Å; Y38-P40 HydrophobicContact CE1-CG 4.03Å; P40-H42 WeakPolarHBondContact CB-CE1 2.73Å; P40-H42 WeakPolarHBondContact CB-ND1 2.92Å; P40-H42 PolarHBondContact O-N 3.45Å; P40-L43 HydrophobicContact CB-CD1 4.39Å; P40-L43 HydrophobicContact CB-CG 4.27Å; P40-L43 HydrophobicContact CG-CD1 3.95Å; P40-L43 HydrophobicContact CG-CG 4.37Å; P40-L43 WeakPolarHBondContact O-CA 3.48Å; P40-L43 PolarHBondContact O-N 2.88Å; P40-R44 PolarHBondContact O-N 3.34Å
41P82Confident69.4Low77 Ų77106.9 Ų106.950%0.559%0.585SS.*THydrogen-bonded Turntrans-55.9-32.6-173.521.9-33.7000113.5Y38 L43Y38-P41 WeakPolarHBondContact OH-CD 3.3Å; P41-L43 VanDerWaalsContact C-N 3.29Å; P41-L43 PolarHBondContact O-N 2.77Å
42H84.6Confident69.3Low141 Ų141112 Ų11265%0.65360%0.597SS**THydrogen-bonded Turntrans-74.7-14.2177.262.6-90.5000114.1P40P40-H42 WeakPolarHBondContact CB-CE1 2.73Å; P40-H42 WeakPolarHBondContact CB-ND1 2.92Å; P40-H42 PolarHBondContact O-N 3.45Å
43L80.3Confident69.1Low60 Ų60112.9 Ų112.931%0.31459%0.586SS.*THydrogen-bonded Turntrans-98.4-13.3177.5-63.5-174.2000113.4I39 P40 P41 N45 R46I39-L43 HydrophobicContact CG2-CB 3.85Å; P40-L43 HydrophobicContact CB-CD1 4.39Å; P40-L43 HydrophobicContact CB-CG 4.27Å; P40-L43 HydrophobicContact CG-CD1 3.95Å; P40-L43 HydrophobicContact CG-CG 4.37Å; P40-L43 WeakPolarHBondContact O-CA 3.48Å; P40-L43 PolarHBondContact O-N 2.88Å; P41-L43 VanDerWaalsContact C-N 3.29Å; P41-L43 PolarHBondContact O-N 2.77Å; L43-N45 PolarHBondContact O-N 2.99Å; L43-N45 VanDerWaalsContact O-N 3.15Å; L43-R46 PolarHBondContact O-N 3.06Å
44R82.3Confident69.1Low134 Ų134115.8 Ų115.851%0.50659%0.594SS.*THydrogen-bonded Turntrans-60.1-27.3-174.3-66.2178.1-174.3158.8-2.5114.6I39 P40I39-R44 HydrophobicContact CB-CG 4.44Å; I39-R44 HydrophobicContact CG2-CG 4.02Å; I39-R44 PolarHBondContact O-NE 3.09Å; P40-R44 PolarHBondContact O-N 3.34Å
45N74.6Confident68.9Low118 Ų118121.5 Ų121.563%0.63161%0.609SS**THydrogen-bonded Turntrans-126.410.4-175.4-61.6-19.9000113.2L43 E47 A48 T49L43-N45 PolarHBondContact O-N 2.99Å; L43-N45 VanDerWaalsContact O-N 3.15Å; N45-E47 PolarHBondContact O-N 3.44Å; N45-E47 VanDerWaalsContact O-N 3.11Å; N45-A48 PolarHBondContact O-N 3.41Å; N45-T49 PolarHBondContact O-N 3.15Å; N45-T49 PolarHBondContact O-OG1 2.83Å
46R71.5Confident68.7Low172 Ų172122.3 Ų122.365%0.64962%0.619SS**Hα-helixtrans-62-22.4-179.9-169172-174.5168.11.9111.6L43 T49 K50L43-R46 PolarHBondContact O-N 3.06Å; R46-T49 PolarHBondContact O-OG1 2.91Å; R46-K50 PolarHBondContact O-N 2.66Å
47E62Low68.2Low125 Ų125122.2 Ų122.258%0.58461%0.605SS**Hα-helixtrans-73.4-31.8174.5-45.2153.8-129.200113.4N45 T49 K50N45-E47 PolarHBondContact O-N 3.44Å; N45-E47 VanDerWaalsContact O-N 3.11Å; E47-T49 VanDerWaalsContact C-N 3.34Å; E47-K50 WeakPolarHBondContact O-CG 3.16Å
48A57.2Low67.2Low89 Ų89118.2 Ų118.274%0.73660%0.604SS**Hα-helixtrans-81-18.1-179.200000112.3N45N45-A48 PolarHBondContact O-N 3.41Å
49T57Low66.2Low86 Ų86113.3 Ų113.353%0.52861%0.608SS.*Hα-helixtrans-97.8-11.3179.240.70000113.6N45 R46 E47 G51 Y53N45-T49 PolarHBondContact O-N 3.15Å; N45-T49 PolarHBondContact O-OG1 2.83Å; R46-T49 PolarHBondContact O-OG1 2.91Å; E47-T49 VanDerWaalsContact C-N 3.34Å; T49-G51 VanDerWaalsContact C-N 3.32Å; T49-G51 PolarHBondContact O-N 3.08Å; T49-Y53 PolarHBondContact O-OH 3.12Å; T49-Y53 VanDerWaalsContact O-OH 3.14Å
50K56.6Low64.7Low131 Ų131120.3 Ų120.357%0.5763%0.629SS**  trans-91.327.3-178.872.7-175.9-173.6-154.10114.6R46 E47 F52R46-K50 PolarHBondContact O-N 2.66Å; E47-K50 WeakPolarHBondContact O-CG 3.16Å; K50-F52 VanDerWaalsContact C-N 3.28Å; K50-F52 PolarHBondContact O-N 3.42Å
51G55Low63.2Low75 Ų75123.7 Ų123.777%0.77365%0.653SS**SBendtrans-75-7.6179.700000115.4T49T49-G51 VanDerWaalsContact C-N 3.32Å; T49-G51 PolarHBondContact O-N 3.08Å
52F52.8Low61.9Low191 Ų191125.2 Ų125.284%0.83867%0.665SS**SBendtrans-141-1.3-170-156.3-101.8000117K50K50-F52 VanDerWaalsContact C-N 3.28Å; K50-F52 PolarHBondContact O-N 3.42Å
53Y52.5Low60.5Low161 Ų161121.7 Ų121.763%0.63166%0.657SS**SBendtrans-153.964.8-176.731.7-99.2000111.6T49T49-Y53 PolarHBondContact O-OH 3.12Å; T49-Y53 VanDerWaalsContact O-OH 3.14Å
54D56.7Low59.4Low112 Ų112128.6 Ų128.660%0.59968%0.684SS**  trans174.574.5150-96.2-36.2000109.7D56 S57D54-D56 VanDerWaalsContact C-N 3.28Å; D54-S57 VanDerWaalsContact CG-CB 3.4Å; D54-S57 VanDerWaalsContact CG-OG 3.22Å; D54-S57 WeakPolarHBondContact OD1-CB 3.39Å; D54-S57 PolarHBondContact OD1-OG 3.24Å
55K56.6Low58.3Low201 Ų201129.4 Ų129.487%0.87470%0.699SS**SBendtrans-85-7.8160.1-81.8-157.2-174.3-179.70112.5
56D57.2Low57.8Low139 Ų139130.7 Ų130.774%0.74370%0.699SS**SBendtrans-109.7-11-172.1-46.9-33.8000112.4D54 S58D54-D56 VanDerWaalsContact C-N 3.28Å; D56-S58 VanDerWaalsContact C-N 3.32Å; D56-S58 PolarHBondContact O-N 3.41Å
57S57.1Low57.7Low78 Ų78128.6 Ų128.655%0.54570%0.7SS.*  trans-96.835.9179.3-58.30000112.9D54 G59D54-S57 VanDerWaalsContact CG-CB 3.4Å; D54-S57 VanDerWaalsContact CG-OG 3.22Å; D54-S57 WeakPolarHBondContact OD1-CB 3.39Å; D54-S57 PolarHBondContact OD1-OG 3.24Å; S57-G59 PolarHBondContact O-N 3.31Å
58S58.7Low57.8Low95 Ų95127.6 Ų127.666%0.66471%0.714SS**SBendtrans-71.783.6168.861.80000109.8D56 W60D56-S58 VanDerWaalsContact C-N 3.32Å; D56-S58 PolarHBondContact O-N 3.41Å; S58-W60 PolarHBondContact O-N 3.11Å
59G64.8Low57.8Low74 Ų74132 Ų13276%0.76371%0.713SS**SBendtrans68.9-31.8142.900000119.4S57S57-G59 PolarHBondContact O-N 3.31Å
60W53.8Low58Low235 Ų235130.1 Ų130.189%0.8970%0.703SS**SBendtrans-160.798.3173.8-86.1-4000105.8S58 S62S58-W60 PolarHBondContact O-N 3.11Å; W60-S62 PolarHBondContact O-N 3.48Å
61S53.8Low58.2Low104 Ų104129.4 Ų129.473%0.72771%0.714SS**  trans-68.786.5172.347.30000109.2S63S61-S63 PolarHBondContact O-N 2.97Å; S61-S63 VanDerWaalsContact O-N 3.14Å
62S54.4Low58.6Low108 Ų108131.7 Ų131.776%0.75570%0.703SS**  trans-79.174.915752.90000107.5W60 K64W60-S62 PolarHBondContact O-N 3.48Å; S62-K64 PolarHBondContact O-N 3.14Å
63S56.1Low58.9Low68 Ų68124.3 Ų124.348%0.47668%0.681SS.*  trans-54.7108.6161.8-57.50000106.1S61 D65 K66S61-S63 PolarHBondContact O-N 2.97Å; S61-S63 VanDerWaalsContact O-N 3.14Å; S63-D65 PolarHBondContact O-N 3.22Å; S63-K66 PolarHBondContact O-N 3.34Å
64K56.7Low59.1Low204 Ų204121.6 Ų121.689%0.88769%0.685SS**THydrogen-bonded Turntrans-59.5-8.1-175.6-125.8171.1179.4177.30113S62S62-K64 PolarHBondContact O-N 3.14Å
65D60.3Low59.4Low152 Ų152126.2 Ų126.281%0.81369%0.694SS**THydrogen-bonded Turntrans-111.13.9-177.2-42.3-56.5000113.3S63S63-D65 PolarHBondContact O-N 3.22Å
66K63.6Low59.4Low144 Ų144121.4 Ų121.463%0.62669%0.686SS**SBendtrans-94.9104.4171.4-116.7-172.9179.9179.90108.7S63 A68S63-K66 PolarHBondContact O-N 3.34Å; K66-A68 PolarHBondContact O-N 2.54Å
67D68.5Low59.6Low128 Ų128121.5 Ų121.568%0.68469%0.686SS**  trans-50.9140.4170.9-65.9-46.5000109.8Y69 S70D67-Y69 PolarHBondContact O-N 2.85Å; D67-S70 WeakPolarHBondContact O-CB 3.46Å; D67-S70 PolarHBondContact O-N 2.79Å; D67-S70 PolarHBondContact O-OG 2.79Å
68A65.1Low59.7Low105 Ų105123.1 Ų123.187%0.86870%0.698SS**THydrogen-bonded Turntrans-53-14.4-17300000114.7K66K66-A68 PolarHBondContact O-N 2.54Å
69Y56.2Low59.7Low182 Ų182130.4 Ų130.471%0.71471%0.711SS**THydrogen-bonded Turntrans-110.911.1-178.5-106.2-127.1000113.3D67 S71 F72D67-Y69 PolarHBondContact O-N 2.85Å; Y69-S71 PolarHBondContact O-N 3.41Å; Y69-S71 VanDerWaalsContact O-N 3.15Å; Y69-F72 HydrophobicContact CD1-CD1 4.14Å; Y69-F72 AromaticContact CD1-CE1 2.98Å; Y69-F72 HydrophobicContact CD1-CE1 2.98Å; Y69-F72 AromaticContact CD1-CZ 3.3Å; Y69-F72 HydrophobicContact CD1-CZ 3.3Å; Y69-F72 HydrophobicContact CD2-CE1 4.25Å; Y69-F72 HydrophobicContact CE1-CD1 4.32Å; Y69-F72 AromaticContact CE1-CE1 3.47Å; Y69-F72 HydrophobicContact CE1-CE1 3.47Å; Y69-F72 VanDerWaalsContact CE1-CE1 3.47Å; Y69-F72 AromaticContact CE1-CZ 3.98Å; Y69-F72 HydrophobicContact CE1-CZ 3.98Å; Y69-F72 HydrophobicContact CG-CD1 4.45Å; Y69-F72 AromaticContact CG-CE1 3.36Å; Y69-F72 HydrophobicContact CG-CE1 3.36Å; Y69-F72 AromaticContact CG-CZ 3.93Å; Y69-F72 HydrophobicContact CG-CZ 3.93Å; Y69-F72 VanDerWaalsContact O-CD1 3.3Å; Y69-F72 WeakPolarHBondContact O-CD1 3.03Å; Y69-F72 WeakPolarHBondContact O-CE1 2.73Å; Y69-F72 WeakPolarHBondContact O-CZ 3.3Å
70S62.5Low59.5Low46 Ų46130.5 Ų130.532%0.32271%0.712SS.*G310 helixtrans-75.11.5176.7-68.80000114.7D67D67-S70 WeakPolarHBondContact O-CB 3.46Å; D67-S70 PolarHBondContact O-N 2.79Å; D67-S70 PolarHBondContact O-OG 2.79Å
71S60.3Low59.8Low115 Ų115128.8 Ų128.880%0.80471%0.71SS**G310 helixtrans-81.3-31.2-173.5-1660000114.1Y69 G73Y69-S71 PolarHBondContact O-N 3.41Å; Y69-S71 VanDerWaalsContact O-N 3.15Å; S71-G73 PolarHBondContact O-N 2.86Å
72F62.5Low60Low124 Ų124126.5 Ų126.554%0.54469%0.694SS.*G310 helixtrans-84.113.5179.854.3-93.2000114Y69Y69-F72 HydrophobicContact CD1-CD1 4.14Å; Y69-F72 AromaticContact CD1-CE1 2.98Å; Y69-F72 HydrophobicContact CD1-CE1 2.98Å; Y69-F72 AromaticContact CD1-CZ 3.3Å; Y69-F72 HydrophobicContact CD1-CZ 3.3Å; Y69-F72 HydrophobicContact CD2-CE1 4.25Å; Y69-F72 HydrophobicContact CE1-CD1 4.32Å; Y69-F72 AromaticContact CE1-CE1 3.47Å; Y69-F72 HydrophobicContact CE1-CE1 3.47Å; Y69-F72 VanDerWaalsContact CE1-CE1 3.47Å; Y69-F72 AromaticContact CE1-CZ 3.98Å; Y69-F72 HydrophobicContact CE1-CZ 3.98Å; Y69-F72 HydrophobicContact CG-CD1 4.45Å; Y69-F72 AromaticContact CG-CE1 3.36Å; Y69-F72 HydrophobicContact CG-CE1 3.36Å; Y69-F72 AromaticContact CG-CZ 3.93Å; Y69-F72 HydrophobicContact CG-CZ 3.93Å; Y69-F72 VanDerWaalsContact O-CD1 3.3Å; Y69-F72 WeakPolarHBondContact O-CD1 3.03Å; Y69-F72 WeakPolarHBondContact O-CE1 2.73Å; Y69-F72 WeakPolarHBondContact O-CZ 3.3Å
73G60.4Low60.3Low35 Ų35125.1 Ų125.136%0.36169%0.685SS.*  trans75.3121174.700000111.8S71 R75S71-G73 PolarHBondContact O-N 2.86Å; G73-R75 WeakPolarHBondContact O-CG 3.44Å; G73-R75 PolarHBondContact O-N 2.82Å
74S56.4Low60.6Low105 Ų105129.9 Ų129.973%0.73470%0.697SS**  trans-53.796.9155-500000106.8S76S74-S76 PolarHBondContact O-N 3.15Å
75R62.8Low60.8Low208 Ų208128.2 Ų128.279%0.78569%0.69SS**  trans-7370.3169.8-54.9-173.9-171.9-176.51.9105.8G73 D77G73-R75 WeakPolarHBondContact O-CG 3.44Å; G73-R75 PolarHBondContact O-N 2.82Å; R75-D77 PolarHBondContact O-N 3.14Å
76S56.8Low60.8Low100 Ų100125 Ų12570%0.69968%0.679SS**  trans-72.782.4163.2-65.40000106S74S74-S76 PolarHBondContact O-N 3.15Å
77D60.6Low60.5Low141 Ų141125.3 Ų125.375%0.75469%0.688SS**THydrogen-bonded Turntrans8.3122.4143.1-58.1-54.6000114.1R75R75-D77 PolarHBondContact O-N 3.14Å
78S58.5Low60.2Low113 Ų113130.3 Ų130.379%0.7970%0.697SS**THydrogen-bonded Turntrans107.5-13.415977.70000120.7
79R60.8Low60.1Low248 Ų248128.4 Ų128.494%0.93669%0.688SS**SBendtrans-99.11.1-178.4-64.6-175.5-177.3156.11.3116.3
80G59.8Low60.4Low75 Ų75125.5 Ų125.577%0.77370%0.695SS**  trans-107.314.9-17200000116.4S82G80-S82 PolarHBondContact O-N 2.71Å; G80-S82 VanDerWaalsContact O-N 3.12Å
81K60.2Low60.1Low199 Ų199126.3 Ų126.387%0.86571%0.71SS**  trans-82.291.4173-71.6-174.8179.5-179.80109
82S58Low60.1Low56 Ų56127 Ų12739%0.39272%0.715SS.*  trans-67.4136.1163.864.50000109G80 F84G80-S82 PolarHBondContact O-N 2.71Å; G80-S82 VanDerWaalsContact O-N 3.12Å; S82-F84 VanDerWaalsContact CB-CD2 3.47Å; S82-F84 PolarHBondContact O-N 2.83Å; S82-F84 VanDerWaalsContact O-N 3.09Å
83S60.7Low59.9Low79 Ų79132.6 Ų132.655%0.55273%0.732SS**G310 helixtrans-64.9-7.9179.449.20000113.6F85 S86S83-F85 PolarHBondContact O-N 2.77Å; S83-S86 PolarHBondContact O-N 3.39Å
84F61.3Low59.8Low169 Ų169134.1 Ų134.174%0.74175%0.748SS**G310 helixtrans-59.9-21-177.4-60-61.5000114.2S82S82-F84 VanDerWaalsContact CB-CD2 3.47Å; S82-F84 PolarHBondContact O-N 2.83Å; S82-F84 VanDerWaalsContact O-N 3.09Å
85F60.9Low60Low169 Ų169134.6 Ų134.674%0.74175%0.751SS**G310 helixtrans-109.1-2.7175.4-61.9-76.2000114S83 D87S83-F85 PolarHBondContact O-N 2.77Å; F85-D87 VanDerWaalsContact C-N 3.33Å; F85-D87 PolarHBondContact O-N 3.37Å
86S61Low59.8Low83 Ų83131.3 Ų131.358%0.5875%0.754SS**G310 helixtrans-71-28.4-176.8-62.80000112.8S83S83-S86 PolarHBondContact O-N 3.39Å
87D57.4Low59.8Low151 Ų151132.6 Ų132.681%0.80776%0.757SS**G310 helixtrans-86.9-10.5-173.5-59-35.1000114.1F85F85-D87 VanDerWaalsContact C-N 3.33Å; F85-D87 PolarHBondContact O-N 3.37Å
88R61.7Low59.2Low233 Ų233137.1 Ų137.188%0.87978%0.781SS**G310 helixtrans-917.4-176.6-73.5-84.8-163.9171.53.1113.9
89G63Low59.2Low66 Ų66138.3 Ų138.368%0.6878%0.781SS**SBendtrans-140.117-158.700000118.8
90S62.5Low59.2Low121 Ų121132.5 Ų132.585%0.84677%0.773SS**  trans-134.663.6168.5-168.30000111.1
91G56Low59.1Low62 Ų62135.7 Ų135.764%0.63977%0.773SS**  trans-126.272.9173.100000109.3R93G91-R93 PolarHBondContact O-N 2.97Å
92S60.3Low59.1Low130 Ų130132 Ų13291%0.90977%0.767SS**  trans-6673.3165-60.70000109.2G94S92-G94 PolarHBondContact O-N 2.9Å
93R59.5Low59.1Low242 Ų242136.8 Ų136.891%0.91379%0.791SS**  trans-9395.9171.1-67.9-173.9100.7115.2-1.1108.8G91G91-R93 PolarHBondContact O-N 2.97Å
94G58.1Low59Low67 Ų67140.6 Ų140.669%0.69181%0.807SS**  trans81.591.514400000116.7S92 V96S92-G94 PolarHBondContact O-N 2.9Å; G94-V96 PolarHBondContact O-N 2.89Å
95S60.6Low58.9Low114 Ų114138.6 Ų138.680%0.79781%0.811SS**PPolyproline II helixtrans-70.2117.414256.30000107.4V97S95-V97 PolarHBondContact O-N 3.44Å
96V57.8Low58.7Low139 Ų139136.2 Ų136.284%0.84282%0.817SS**PPolyproline II helixtrans-56.5119.5164.9176.70000107.1G94G94-V96 PolarHBondContact O-N 2.89Å
97V56.5Low58.5Low128 Ų128140.7 Ų140.778%0.77684%0.836SS**PPolyproline II helixtrans-72.4130.4169.2-68.70000108S95S95-V97 PolarHBondContact O-N 3.44Å
98N49Very low58.6Low235 Ų235139.7 Ų139.7100%1.25784%0.839SS**  trans-83.30168.9-131.325.7000109.4

Retrieved 98 of 98 residues in 127.7 ms (Link to these results)