A0A077ZN14_TRITR Loading...

Zf-CCHC domain containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A077ZN14, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 135 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
1M59.4Low77Confident243 Ų243119.2 Ų119.2100%1.19763%0.626SS**  0110.10-65.6176.4163.600108.2
2T60.2Low77.4Confident132 Ų132119.3 Ų119.381%0.8162%0.621SS**  trans-75128.5174.844.20000109.2
3S74.3Confident77.7Confident88 Ų88119.4 Ų119.462%0.61562%0.616SS**  trans-63.1139.6-176.3-37.80000111.1A5 A6 Q7S3-A5 PolarHBondContact O-N 2.94Å; S3-A6 WeakPolarHBondContact O-CB 3.3Å; S3-A6 PolarHBondContact O-N 3.27Å; S3-Q7 PolarHBondContact O-N 3.4Å
4S75.1Confident78.1Confident99 Ų99120.1 Ų120.169%0.69262%0.616SS**Hα-helixtrans-52.6-32.5-178.864.40000113.4A6 Q7 A8S4-A6 VanDerWaalsContact C-N 3.3Å; S4-A6 PolarHBondContact O-N 2.94Å; S4-Q7 PolarHBondContact O-N 3.29Å; S4-A8 PolarHBondContact O-N 3.16Å
5A78.1Confident78.3Confident54 Ų54118.4 Ų118.445%0.44661%0.607SS.*Hα-helixtrans-60.3-36.1174.600000113.2S3 R9S3-A5 PolarHBondContact O-N 2.94Å; A5-R9 VanDerWaalsContact O-CG 3.3Å; A5-R9 WeakPolarHBondContact O-CG 3.5Å; A5-R9 PolarHBondContact O-N 3.31Å; A5-R9 VanDerWaalsContact O-N 3.09Å
6A79.2Confident78.5Confident41 Ų41120.3 Ų120.334%0.33960%0.604SS.*Hα-helixtrans-69.5-39.7176.600000111.1S3 S4 R9 R10S3-A6 WeakPolarHBondContact O-CB 3.3Å; S3-A6 PolarHBondContact O-N 3.27Å; S4-A6 VanDerWaalsContact C-N 3.3Å; S4-A6 PolarHBondContact O-N 2.94Å; A6-R9 PolarHBondContact O-N 3.05Å; A6-R10 WeakPolarHBondContact O-CG 3.37Å; A6-R10 PolarHBondContact O-N 3.35Å
7Q83.9Confident78.4Confident114 Ų114120.1 Ų120.153%0.53361%0.605SS.*Hα-helixtrans-67.3-40.4176.2-165176.529.600111.7S3 S4 R9 R10 R11S3-Q7 PolarHBondContact O-N 3.4Å; S4-Q7 PolarHBondContact O-N 3.29Å; Q7-R9 PolarHBondContact O-N 3.48Å; Q7-R10 PolarHBondContact O-N 3.09Å; Q7-R11 WeakPolarHBondContact O-CG 3.41Å; Q7-R11 PolarHBondContact O-N 2.88Å
8A83.9Confident78.5Confident48 Ų48117.8 Ų117.840%0.39761%0.607SS.*Hα-helixtrans-61.2-44175.700000112.1S4 R11 Q12S4-A8 PolarHBondContact O-N 3.16Å; A8-R11 PolarHBondContact O-N 3.07Å; A8-Q12 WeakPolarHBondContact O-CG 3.32Å; A8-Q12 PolarHBondContact O-N 2.8Å
9R84.5Confident78.8Confident159 Ų159115.6 Ų115.660%0.659%0.594SS**Hα-helixtrans-63.2-43.3175.8-71173-168.3-115.45.1112A5 A6 Q7 R11 Q12 Q13A5-R9 VanDerWaalsContact O-CG 3.3Å; A5-R9 WeakPolarHBondContact O-CG 3.5Å; A5-R9 PolarHBondContact O-N 3.31Å; A5-R9 VanDerWaalsContact O-N 3.09Å; A6-R9 PolarHBondContact O-N 3.05Å; Q7-R9 PolarHBondContact O-N 3.48Å; R9-R11 VanDerWaalsContact C-N 3.35Å; R9-R11 PolarHBondContact O-N 3.38Å; R9-Q12 PolarHBondContact O-N 2.67Å; R9-Q13 WeakPolarHBondContact O-CB 3.38Å; R9-Q13 WeakPolarHBondContact O-CG 3.11Å; R9-Q13 PolarHBondContact O-N 2.97Å
10R84.1Confident79.2Confident175 Ų175116.4 Ų116.466%0.6659%0.593SS**Hα-helixtrans-61.2-42.9176.1-74.3178.8-176.8-120.72.2111.8A6 Q7 Q13 Q14A6-R10 WeakPolarHBondContact O-CG 3.37Å; A6-R10 PolarHBondContact O-N 3.35Å; Q7-R10 PolarHBondContact O-N 3.09Å; R10-Q13 PolarHBondContact O-N 2.73Å; R10-Q14 WeakPolarHBondContact O-CB 3Å; R10-Q14 VanDerWaalsContact O-CG 3.32Å; R10-Q14 WeakPolarHBondContact O-CG 3.48Å; R10-Q14 PolarHBondContact O-N 2.85Å
11R84.9Confident79.5Confident158 Ų158111 Ų11160%0.59657%0.565SS**Hα-helixtrans-61.6-45.5174.2-74.8-178.7172.8-152.1-0.4111.6Q7 A8 R9 Q13 Q14 I15Q7-R11 WeakPolarHBondContact O-CG 3.41Å; Q7-R11 PolarHBondContact O-N 2.88Å; A8-R11 PolarHBondContact O-N 3.07Å; R9-R11 VanDerWaalsContact C-N 3.35Å; R9-R11 PolarHBondContact O-N 3.38Å; R11-Q13 VanDerWaalsContact C-N 3.34Å; R11-Q13 PolarHBondContact O-N 3.45Å; R11-Q14 PolarHBondContact O-N 2.92Å; R11-I15 WeakPolarHBondContact O-CD1 3.38Å; R11-I15 WeakPolarHBondContact O-CG1 3.3Å; R11-I15 PolarHBondContact O-N 3.05Å
12Q80.9Confident80.6Confident120 Ų120106.4 Ų106.456%0.56154%0.539SS*.Hα-helixtrans-62.9-40176.5-73.4179.1-200112.4A8 R9 I15 R16A8-Q12 WeakPolarHBondContact O-CG 3.32Å; A8-Q12 PolarHBondContact O-N 2.8Å; R9-Q12 PolarHBondContact O-N 2.67Å; Q12-I15 PolarHBondContact O-N 2.97Å; Q12-R16 WeakPolarHBondContact O-CG 3.49Å; Q12-R16 PolarHBondContact O-N 3.1Å
13Q82.1Confident81.7Confident121 Ų121101.8 Ų101.857%0.56551%0.512SS*.Hα-helixtrans-64.2-45.9174.6-74.5173.4-15.500111.2R9 R10 R11 I15 R16 L17R9-Q13 WeakPolarHBondContact O-CB 3.38Å; R9-Q13 WeakPolarHBondContact O-CG 3.11Å; R9-Q13 PolarHBondContact O-N 2.97Å; R10-Q13 PolarHBondContact O-N 2.73Å; R11-Q13 VanDerWaalsContact C-N 3.34Å; R11-Q13 PolarHBondContact O-N 3.45Å; Q13-I15 VanDerWaalsContact C-N 3.32Å; Q13-I15 PolarHBondContact O-N 3.34Å; Q13-R16 PolarHBondContact O-N 3.01Å; Q13-R16 VanDerWaalsContact O-N 3.15Å; Q13-L17 VanDerWaalsContact O-CG 3.29Å; Q13-L17 WeakPolarHBondContact O-CG 3.45Å; Q13-L17 PolarHBondContact O-N 3.15Å
14Q82.2Confident82.3Confident130 Ų13099.8 Ų99.861%0.60750%0.497SS*.Hα-helixtrans-59.6-42.2175-76.6176-15.100111.8R10 R11 R16 L17 A18R10-Q14 WeakPolarHBondContact O-CB 3Å; R10-Q14 VanDerWaalsContact O-CG 3.32Å; R10-Q14 WeakPolarHBondContact O-CG 3.48Å; R10-Q14 PolarHBondContact O-N 2.85Å; R11-Q14 PolarHBondContact O-N 2.92Å; Q14-R16 PolarHBondContact O-N 3.46Å; Q14-L17 PolarHBondContact O-N 3.2Å; Q14-A18 VanDerWaalsContact O-CB 3.24Å; Q14-A18 WeakPolarHBondContact O-CB 3.44Å; Q14-A18 PolarHBondContact O-N 3.21Å
15I82.2Confident82.7Confident94 Ų9497.2 Ų97.248%0.48249%0.487SS..Hα-helixtrans-61.6-44.8175.1-67.1162.2000110.1R11 Q12 Q13 L17 A18 Q19R11-I15 WeakPolarHBondContact O-CD1 3.38Å; R11-I15 WeakPolarHBondContact O-CG1 3.3Å; R11-I15 PolarHBondContact O-N 3.05Å; Q12-I15 PolarHBondContact O-N 2.97Å; Q13-I15 VanDerWaalsContact C-N 3.32Å; Q13-I15 PolarHBondContact O-N 3.34Å; I15-L17 VanDerWaalsContact C-N 3.32Å; I15-L17 PolarHBondContact O-N 3.04Å; I15-A18 PolarHBondContact O-N 2.81Å; I15-Q19 HydrophobicContact CG2-CG 3.78Å; I15-Q19 WeakPolarHBondContact O-CB 2.98Å; I15-Q19 WeakPolarHBondContact O-CG 3.47Å; I15-Q19 PolarHBondContact O-N 3.01Å
16R80.4Confident83Confident148 Ų14896 Ų9656%0.55848%0.479SS*.Hα-helixtrans-62.5-37.4177.1-74.1-175.5-178.8-169.3-1.2113.3Q12 Q13 Q14 G28 F30Q12-R16 WeakPolarHBondContact O-CG 3.49Å; Q12-R16 PolarHBondContact O-N 3.1Å; Q13-R16 PolarHBondContact O-N 3.01Å; Q13-R16 VanDerWaalsContact O-N 3.15Å; Q14-R16 PolarHBondContact O-N 3.46Å; R16-G28 CarbonylContact O-C 3.59Å; R16-G28 VanDerWaalsContact O-CA 3.29Å; R16-G28 WeakPolarHBondContact O-CA 3.33Å; R16-F30 HydrophobicContact CG-CE2 3.79Å; R16-F30 HydrophobicContact CG-CZ 4.14Å
17L78.2Confident83.3Confident118 Ų11899.6 Ų99.662%0.61849%0.492SS*.Hα-helixtrans-74.1-34.9178.4-66.1172.6000112.4Q13 Q14 I15Q13-L17 VanDerWaalsContact O-CG 3.29Å; Q13-L17 WeakPolarHBondContact O-CG 3.45Å; Q13-L17 PolarHBondContact O-N 3.15Å; Q14-L17 PolarHBondContact O-N 3.2Å; I15-L17 VanDerWaalsContact C-N 3.32Å; I15-L17 PolarHBondContact O-N 3.04Å
18A79.9Confident83.3Confident78 Ų7896 Ų9665%0.64549%0.486SS*.Hα-helixtrans-84.2-20.7179.100000113.6Q14 I15Q14-A18 VanDerWaalsContact O-CB 3.24Å; Q14-A18 WeakPolarHBondContact O-CB 3.44Å; Q14-A18 PolarHBondContact O-N 3.21Å; I15-A18 PolarHBondContact O-N 2.81Å
19Q83.2Confident83.5Confident76 Ų7695.9 Ų95.936%0.35548%0.477SS..PPolyproline II helixtrans-76.6128.5177.4-75.8-82.8-54.300110.4I15 F30I15-Q19 HydrophobicContact CG2-CG 3.78Å; I15-Q19 WeakPolarHBondContact O-CB 2.98Å; I15-Q19 WeakPolarHBondContact O-CG 3.47Å; I15-Q19 PolarHBondContact O-N 3.01Å; Q19-F30 HydrophobicContact CB-CE1 4.11Å; Q19-F30 HydrophobicContact CG-CE1 4.17Å
20K86.8Confident83.5Confident132 Ų13291.6 Ų91.657%0.57446%0.463SS*.BIsolated β-bridgetrans-82.5143.7169.368-178.9-178.5-1790110.8F22 G26 L27K20-F22 PolarHBondContact O-N 3.25Å; K20-G26 CarbonylContact C-O 3.56Å; K20-G26 WeakPolarHBondContact CA-O 3.2Å; K20-L27 HydrophobicContact CB-CD2 3.89Å
21C86Confident83.5Confident2 Ų285.5 Ų85.51%0.01445%0.449CS..PPolyproline II helixtrans-66.6126.6172.5177.70000109.4S23 C24 G25 G26 H29 A31 C34C21-S23 PolarHBondContact O-N 2.84Å; C21-S23 PolarHBondContact SG-N 3.48Å; C21-S23 VanDerWaalsContact SG-N 3.38Å; C21-C24 VanDerWaalsContact SG-SG 3.69Å; C21-G25 WeakPolarHBondContact O-CA 3.32Å; C21-G25 PolarHBondContact O-N 2.91Å; C21-G26 VanDerWaalsContact CB-O 3.24Å; C21-G26 WeakPolarHBondContact CB-O 3.41Å; C21-G26 PolarHBondContact N-O 3.37Å; C21-H29 VanDerWaalsContact CB-NE2 3.34Å; C21-H29 WeakPolarHBondContact CB-NE2 3.36Å; C21-H29 PolarHBondContact SG-NE2 2.93Å; C21-H29 VanDerWaalsContact SG-NE2 3.37Å; C21-A31 VanDerWaalsContact SG-CA 3.58Å; C21-C34 VanDerWaalsContact SG-SG 3.61Å
22F83.5Confident83.3Confident148 Ų14889.2 Ų89.265%0.64946%0.463SS*.THydrogen-bonded Turntrans-74.1-8.4177.1-66.4-84.3000113.9K20 A31K20-F22 PolarHBondContact O-N 3.25Å; F22-A31 HydrophobicContact CB-CB 4.17Å
23S83.4Confident83.5Confident34 Ų3488.7 Ų88.724%0.23846%0.464CS..THydrogen-bonded Turntrans-94.1-58.3177.1-175.10000110.9C21 H38C21-S23 PolarHBondContact O-N 2.84Å; C21-S23 PolarHBondContact SG-N 3.48Å; C21-S23 VanDerWaalsContact SG-N 3.38Å; S23-H38 VanDerWaalsContact O-CB 3.24Å; S23-H38 WeakPolarHBondContact O-CB 3.39Å; S23-H38 PolarHBondContact OG-N 3.41Å; S23-H38 PolarHBondContact OG-O 3.3Å
24C85.2Confident83.6Confident46 Ų4683.8 Ų83.831%0.31144%0.444SS..THydrogen-bonded Turntrans-104-8.2-176.272.50000115.4C21 G26 H29 C34 H38C21-C24 VanDerWaalsContact SG-SG 3.69Å; C24-G26 VanDerWaalsContact C-N 3.26Å; C24-G26 PolarHBondContact O-N 3.47Å; C24-G26 PolarHBondContact SG-N 3.09Å; C24-H29 PolarHBondContact SG-NE2 3.05Å; C24-H29 VanDerWaalsContact SG-NE2 3.39Å; C24-C34 PolarHBondContact SG-SG 3.39Å; C24-H38 HydrophobicContact CB-CB 4.34Å
25G84.5Confident83.6Confident46 Ų4685.6 Ų85.647%0.47446%0.456SS..  trans79.6-6.5-174.300000115.7C21C21-G25 WeakPolarHBondContact O-CA 3.32Å; C21-G25 PolarHBondContact O-N 2.91Å
26G83.1Confident83.2Confident27 Ų2785 Ų8528%0.27846%0.458SS..  trans-68.6157179.300000114.1K20 C21 C24K20-G26 CarbonylContact C-O 3.56Å; K20-G26 WeakPolarHBondContact CA-O 3.2Å; C21-G26 VanDerWaalsContact CB-O 3.24Å; C21-G26 WeakPolarHBondContact CB-O 3.41Å; C21-G26 PolarHBondContact N-O 3.37Å; C24-G26 VanDerWaalsContact C-N 3.26Å; C24-G26 PolarHBondContact O-N 3.47Å; C24-G26 PolarHBondContact SG-N 3.09Å
27L86.2Confident82.6Confident117 Ų11783.1 Ų83.161%0.61346%0.464SS*.BIsolated β-bridgetrans-93162.4179.5-62.3174.5000112K20 H29K20-L27 HydrophobicContact CB-CD2 3.89Å; L27-H29 PolarHBondContact O-N 3.49Å; L27-H29 PolarHBondContact O-ND1 3.35Å
28G84Confident81.8Confident39 Ų3983.6 Ų83.640%0.40246%0.463SS..SBendtrans85.20.3171.200000116R16R16-G28 CarbonylContact O-C 3.59Å; R16-G28 VanDerWaalsContact O-CA 3.29Å; R16-G28 WeakPolarHBondContact O-CA 3.33Å
29H88Confident80.8Confident46 Ų4687.4 Ų87.421%0.21347%0.468CS..SBendtrans-149.4158.1177.266.5-78.2000111.6C21 C24 L27 D33 C34C21-H29 VanDerWaalsContact CB-NE2 3.34Å; C21-H29 WeakPolarHBondContact CB-NE2 3.36Å; C21-H29 PolarHBondContact SG-NE2 2.93Å; C21-H29 VanDerWaalsContact SG-NE2 3.37Å; C24-H29 PolarHBondContact SG-NE2 3.05Å; C24-H29 VanDerWaalsContact SG-NE2 3.39Å; L27-H29 PolarHBondContact O-N 3.49Å; L27-H29 PolarHBondContact O-ND1 3.35Å; H29-D33 HydrophobicContact CB-CB 4.43Å; H29-C34 PolarHBondContact NE2-SG 3.35Å
30F84.4Confident79.4Confident69 Ų6992.7 Ų92.730%0.30348%0.484SS..  trans-90.9163173.2-65.9-72.3000111R16 Q19 R32 D33 C34R16-F30 HydrophobicContact CG-CE2 3.79Å; R16-F30 HydrophobicContact CG-CZ 4.14Å; Q19-F30 HydrophobicContact CB-CE1 4.11Å; Q19-F30 HydrophobicContact CG-CE1 4.17Å; F30-R32 PolarHBondContact O-N 3.5Å; F30-D33 PolarHBondContact O-N 2.83Å; F30-C34 PolarHBondContact O-N 3.32Å
31A83.4Confident77.9Confident46 Ų4692.3 Ų92.338%0.3850%0.495SS..G310 helixtrans-54.8-22.9175.100000114C21 F22C21-A31 VanDerWaalsContact SG-CA 3.58Å; F22-A31 HydrophobicContact CB-CB 4.17Å
32R82.1Confident76.5Confident236 Ų23696.7 Ų96.789%0.89152%0.518SS*.G310 helixtrans-73.5-26.4175.9-58.6-171.470.9-178.92.2113.8F30F30-R32 PolarHBondContact O-N 3.5Å
33D83.9Confident75.2Confident109 Ų10993.2 Ų93.258%0.58352%0.517SS*.G310 helixtrans-109.813.7-175.9-55.6-52.2000111.4H29 F30 L35H29-D33 HydrophobicContact CB-CB 4.43Å; F30-D33 PolarHBondContact O-N 2.83Å; D33-L35 PolarHBondContact O-N 2.98Å
34C84.9Confident74Confident19 Ų1999.7 Ų99.713%0.12855%0.549CS..  trans-74.8121.6-176.2-162.80000110.7C21 C24 H29 F30 T36C21-C34 VanDerWaalsContact SG-SG 3.61Å; C24-C34 PolarHBondContact SG-SG 3.39Å; H29-C34 PolarHBondContact NE2-SG 3.35Å; F30-C34 PolarHBondContact O-N 3.32Å; C34-T36 PolarHBondContact O-N 2.89Å; C34-T36 PolarHBondContact SG-O 2.85Å
35L81.7Confident72.7Confident167 Ų16799.3 Ų99.387%0.87455%0.554SS**SBendtrans-66.8-24.1176.2-68.9106.7000112.3D33 P37D33-L35 PolarHBondContact O-N 2.98Å; L35-P37 WeakPolarHBondContact O-CD 3.18Å
36T75.4Confident71.5Confident83 Ų83102.8 Ų102.851%0.50957%0.567SS.*SBendtrans-113.594.817449.30000108.6C34 H38C34-T36 PolarHBondContact O-N 2.89Å; C34-T36 PolarHBondContact SG-O 2.85Å; T36-H38 PolarHBondContact O-N 3.41Å
37P66.1Low70.4Confident108 Ų108107.1 Ų107.170%0.70159%0.591SS**  trans-65.988.2170.527.8-32.4000107.7L35 Q39L35-P37 WeakPolarHBondContact O-CD 3.18Å; P37-Q39 PolarHBondContact O-N 3.45Å
38H61.9Low68.7Low128 Ų128113.8 Ų113.859%0.59361%0.608SS**  trans-71.1121.3175.3-135.3-69.1000106.7S23 C24 T36S23-H38 VanDerWaalsContact O-CB 3.24Å; S23-H38 WeakPolarHBondContact O-CB 3.39Å; S23-H38 PolarHBondContact OG-N 3.41Å; S23-H38 PolarHBondContact OG-O 3.3Å; C24-H38 HydrophobicContact CB-CB 4.34Å; T36-H38 PolarHBondContact O-N 3.41Å
39Q58.7Low67.4Low158 Ų158115.8 Ų115.874%0.73862%0.62SS**  trans-48.9139.5175.3-64.1175.55.500108P37P37-Q39 PolarHBondContact O-N 3.45Å
40R53.5Low66Low186 Ų186120.6 Ų120.670%0.70265%0.648SS**  trans-17.7135.9175.3-62.5165.9137.9-116.95.6112.4D42 A43R40-D42 HydrophobicContact CB-CB 4.12Å; R40-D42 WeakPolarHBondContact CB-OD2 3.29Å; R40-D42 IonicContact CZ-OD2 3.81Å; R40-D42 IonicContact NH1-OD2 2.84Å; R40-D42 PolarHBondContact NH1-OD2 2.93Å; R40-D42 PolarHBondContact O-N 2.83Å; R40-A43 PolarHBondContact O-N 3.32Å
41P56.9Low64.7Low124 Ų124123.9 Ų123.981%0.80567%0.673SS**THydrogen-bonded Turntrans-61.622172.227.1-34.4000114.6
42D54.8Low63.1Low94 Ų94132.5 Ų132.550%0.50370%0.696SS.*THydrogen-bonded Turntrans-99.61.3177.3-54.4-46.9000112.7R40 D44R40-D42 HydrophobicContact CB-CB 4.12Å; R40-D42 WeakPolarHBondContact CB-OD2 3.29Å; R40-D42 IonicContact CZ-OD2 3.81Å; R40-D42 IonicContact NH1-OD2 2.84Å; R40-D42 PolarHBondContact NH1-OD2 2.93Å; R40-D42 PolarHBondContact O-N 2.83Å; D42-D44 VanDerWaalsContact C-N 3.34Å; D42-D44 PolarHBondContact O-N 3.33Å
43A56.6Low61.5Low76 Ų76132.7 Ų132.763%0.62870%0.696SS**SBendtrans-75.6-18.3-177.300000114.5R40R40-A43 PolarHBondContact O-N 3.32Å
44D59Low60.2Low169 Ų169138.9 Ų138.990%0.90471%0.712SS**SBendtrans-120.811.5176.9-67.5-77.5000112.8D42D42-D44 VanDerWaalsContact C-N 3.34Å; D42-D44 PolarHBondContact O-N 3.33Å
45G56.8Low58.8Low39 Ų39145 Ų14540%0.40274%0.744SS.*SBendtrans-102.2134.2174.900000110.4
46P59.8Low57.5Low118 Ų118140.5 Ų140.577%0.76674%0.737SS**PPolyproline II helixtrans-55.714217623.9-32.5000109.5R48P46-R48 PolarHBondContact O-N 2.84Å
47P59.4Low56.5Low118 Ų118140.8 Ų140.877%0.76676%0.756SS**PPolyproline II helixtrans-52.6132.9176.123.7-33000107.8A49P47-A49 PolarHBondContact O-N 3.33Å
48R50.9Low55.9Low257 Ų257139.6 Ų139.697%0.9776%0.764SS**  trans-61.489.7170.3-72-169.1174.5177.2-0.9107.7P46 D50P46-R48 PolarHBondContact O-N 2.84Å; R48-D50 PolarHBondContact O-N 3.38Å
49A57.1Low55.5Low81 Ų81137 Ų13767%0.66977%0.772SS**  trans-62.7124.1169.300000107.7P47P47-A49 PolarHBondContact O-N 3.33Å
50D59.2Low55.6Low148 Ų148135.8 Ų135.879%0.79178%0.781SS**  trans46.4102.6150.8-70.1-75.6000119R48R48-D50 PolarHBondContact O-N 3.38Å
51V55.8Low55.7Low137 Ų137130.8 Ų130.883%0.8379%0.787SS**  -150.1101.4129-175.90000110.3
52R49.7Very low55.6Low228 Ų228129 Ų12986%0.8679%0.792SS**  trans64103.7149.4-54.6-82.5177.7176.5-2.9118.2R54R52-R54 PolarHBondContact O-N 3.44Å
53R50.2Low55.6Low239 Ų239128.7 Ų128.790%0.90281%0.81SS**  trans-40.8118.2149.4-74.8-173.3178.1-164.91.2110
54R54.9Low55.6Low239 Ų239128.5 Ų128.590%0.90282%0.816SS**  trans-117.1100.3159.6-160.9175-156.1-171.95.2106.9R52 X56R52-R54 PolarHBondContact O-N 3.44Å; R54-G56 PolarHBondContact O-N 3.4Å; R54-G56 VanDerWaalsContact O-N 3.15Å
55D57.3Low55.7Low149 Ų149125 Ų12580%0.79781%0.805SS**  trans-45.5114.6164.6-57.6-88.7000108.8
56X52.6Low56Low72 Ų72134.6 Ų134.674%0.74283%0.829SS**  trans-175.299.2-174.100000110.3R54R54-G56 PolarHBondContact O-N 3.4Å; R54-G56 VanDerWaalsContact O-N 3.15Å
57X54.6Low55.9Low88 Ų88137.9 Ų137.991%0.90783%0.826SS**  trans-58.9149.4-169.300000115.8
58X54.1Low55.8Low83 Ų83136.3 Ų136.386%0.85683%0.831SS**  trans-14576.416800000109
59X54.2Low56.4Low75 Ų75133.2 Ų133.277%0.77382%0.82SS**  trans-85131.4166.400000110.3
60X60Low56.6Low131 Ų131135.5 Ų135.592%0.91683%0.826SS**  trans160.299.9152.5-80.50000106.9
61X55.9Low56.7Low81 Ų81138.4 Ų138.484%0.83583%0.832SS**  135.1132.279.200000104.5
62X54.5Low56.8Low88 Ų88136 Ų13691%0.90783%0.826SS**  cis10095.547.300000107.9
63X55.4Low57.2Low86 Ų86131.8 Ų131.889%0.88783%0.825SS**  trans105.9130.4171.600000113.6
64X56.7Low57.4Low73 Ų73124 Ų12475%0.75381%0.812SS**  cis172.1133.5700000107.7
65X60.5Low57.5Low95 Ų95119.1 Ų119.166%0.66481%0.809SS**  trans-18.2124.9164.2-171.80000115.8
66R62Low57.6Low241 Ų241118.5 Ų118.591%0.90981%0.805SS**  trans-154.981.4141.8-109179.3-81.3-137.36.2110.8
67R58.9Low57.8Low186 Ų186124 Ų12470%0.70281%0.811SS**  trans22.2102.5139.9-51.8-178-139-134.85.2115.4R69R67-R69 VanDerWaalsContact C-N 3.34Å; R67-R69 HydrophobicContact CB-CG 4.44Å; R67-R69 PolarHBondContact O-N 3.29Å
68G57.4Low57.7Low86 Ų86126.7 Ų126.789%0.88780%0.802SS**  trans-6499149.200000108.1
69R62.1Low57.7Low191 Ų191128.1 Ų128.172%0.72180%0.799SS**  trans-90113.4163.3-78.1-178-177.2167.70.3106.5R67R67-R69 VanDerWaalsContact C-N 3.34Å; R67-R69 HydrophobicContact CB-CG 4.44Å; R67-R69 PolarHBondContact O-N 3.29Å
70T63Low57.8Low130 Ų130130.5 Ų130.580%0.79880%0.801SS**  trans-55.1135.1158.940.70000108.5A72T70-A72 VanDerWaalsContact C-N 3.32Å; T70-A72 PolarHBondContact O-N 2.92Å
71F61.4Low57.6Low209 Ų209133.5 Ų133.592%0.91780%0.803SS**  trans-71.990.9172-67.4-89.1000107.9
72A58.2Low57.2Low87 Ų87135.6 Ų135.672%0.71980%0.804SS**  trans-85.9118.5161.500000107.6T70 A74T70-A72 VanDerWaalsContact C-N 3.32Å; T70-A72 PolarHBondContact O-N 2.92Å; A72-A74 PolarHBondContact O-N 3.49Å
73V56.8Low57.2Low138 Ų138134.4 Ų134.484%0.83679%0.793SS**  trans-74115.1170.4-26.60000106.1
74A55.1Low57.4Low75 Ų75136.5 Ų136.562%0.6279%0.788SS**  trans-122.1103.7174.200000107.7A72 L76A72-A74 PolarHBondContact O-N 3.49Å; A74-L76 HydrophobicContact CB-CD1 4.45Å; A74-L76 PolarHBondContact O-N 3.15Å
75T57.1Low57.3Low138 Ų138138.9 Ų138.985%0.84779%0.788SS**  trans-73.4105.4171-42.60000107.5
76L59.5Low57Low136 Ų136142.3 Ų142.371%0.71279%0.794SS**  trans-115.6101.3178.8-83.6163.9000108.5A74 M78A74-L76 HydrophobicContact CB-CD1 4.45Å; A74-L76 PolarHBondContact O-N 3.15Å; L76-M78 HydrophobicContact CB-CE 3.52Å; L76-M78 HydrophobicContact CD1-CE 4.37Å; L76-M78 HydrophobicContact CD2-CE 3.46Å; L76-M78 VanDerWaalsContact CD2-CE 3.46Å; L76-M78 HydrophobicContact CG-CE 3.91Å
77Q55.8Low56.5Low187 Ų187136.5 Ų136.587%0.87479%0.785SS**  trans-85.4115.6176.6169.4-175.5-37.700109.3
78M53.5Low56.5Low145 Ų145134.5 Ų134.571%0.71479%0.788SS**  trans-141140.4169.7-18.4-74.5-176.100112.2L76L76-M78 HydrophobicContact CB-CE 3.52Å; L76-M78 HydrophobicContact CD1-CE 4.37Å; L76-M78 HydrophobicContact CD2-CE 3.46Å; L76-M78 VanDerWaalsContact CD2-CE 3.46Å; L76-M78 HydrophobicContact CG-CE 3.91Å
79S54.6Low56.1Low112 Ų112138.9 Ų138.978%0.78379%0.787SS**  trans-71.7164.1-164.5-50.60000117.2
80P55.2Low55.5Low126 Ų126133 Ų13382%0.81879%0.786SS**  trans-83136.417933.5-31.8000111.8
81M57.2Low55.2Low193 Ų193136.8 Ų136.895%0.95179%0.792SS**  trans-107.6115.1164-78.4-174.471.300109.9
82S47.5Very low54.8Low125 Ų125138.6 Ų138.687%0.87479%0.793SS**  trans-70148.7165.3-58.40000111.1
83G53.6Low54.1Low64 Ų64139.3 Ų139.366%0.6679%0.79SS**  trans139.3131145.700000116.5
84T59.7Low53.9Low129 Ų129141.3 Ų141.379%0.79179%0.79SS**  trans73.993.9159.666.70000115.8
85T54.5Low53.8Low124 Ų124149.3 Ų149.376%0.76180%0.804SS**  60.2154.980.763.80000114.2
86E53.7Low53.6Low167 Ų167153.8 Ų153.878%0.7881%0.806SS**  trans97.884.6176.5-47.5-83.485.900112.9
87T52.1Low53.5Low119 Ų119153 Ų15373%0.7381%0.808SS**  86.9131.184.2-60.30000112.5
88L58.3Low53.5Low144 Ų144149.9 Ų149.975%0.75480%0.802SS**  trans91.7120.4158-123.868.5000119.3
89M48.7Very low54Low177 Ų177147.9 Ų147.987%0.87280%0.8SS**  trans70.2113.3147.4-78161.1120.800119.1
90G49.5Very low54Low68 Ų68148.8 Ų148.870%0.70180%0.803SS**  110106.8116.800000116.6
91K56.4Low53.9Low210 Ų210148.6 Ų148.691%0.91380%0.8SS**  trans63.9106.8136-62.1179.3-179.2-176.20117.3
92R53.5Low53.6Low247 Ų247146.3 Ų146.393%0.93279%0.792SS**  trans-40.8160.3158.3-95.3-178.7150.5-133.1-0114.9
93P44.8Very low53.8Low102 Ų102145.6 Ų145.666%0.66279%0.793SS**  -109.3152-125.138.8-32.4000112.4
94Q50.6Low53.9Low180 Ų180149.3 Ų149.384%0.84180%0.798SS**  trans-134.5100.8161.1-68.1-68.6-3.200107.7R96Q94-R96 VanDerWaalsContact C-N 3.34Å; Q94-R96 PolarHBondContact O-N 2.95Å
95R54.2Low53.5Low243 Ų243153 Ų15392%0.91780%0.803SS**  trans-57.7105158.4-90.7-174.2172.1-153.5-0.3106.1P97R95-P97 VanDerWaalsContact O-CD 3.3Å; R95-P97 WeakPolarHBondContact O-CD 3.29Å
96R53.2Low53.7Low232 Ų232151.3 Ų151.388%0.87580%0.802SS**  trans-86.1108.3160.3-115.1177.1172.5-125.60.5106.4Q94 T98Q94-R96 VanDerWaalsContact C-N 3.34Å; Q94-R96 PolarHBondContact O-N 2.95Å; R96-T98 PolarHBondContact O-N 2.84Å
97P57.1Low54.2Low118 Ų118148.6 Ų148.677%0.76679%0.792SS**PPolyproline II helixtrans-68.1117.7159.1-4.823.3000106.1R95R95-P97 VanDerWaalsContact O-CD 3.3Å; R95-P97 WeakPolarHBondContact O-CD 3.29Å
98T56.2Low55.2Low123 Ų123147 Ų14776%0.75578%0.784SS**PPolyproline II helixtrans-56.8130.4169.644.90000109R96R96-T98 PolarHBondContact O-N 2.84Å
99P62.9Low56.1Low103 Ų103143.3 Ų143.367%0.66977%0.77SS**PPolyproline II helixtrans-62.2134.6173.226.8-32.3000108.4T101P99-T101 VanDerWaalsContact C-N 3.35Å; P99-T101 PolarHBondContact O-N 3.34Å
100P55.2Low57.6Low130 Ų130139.3 Ų139.384%0.84475%0.751SS**  trans-64.7102.6164.226.5-29.7000107.5D102P100-D102 PolarHBondContact O-N 3.22Å; P100-D102 VanDerWaalsContact O-N 3.16Å
101T52.9Low59.2Low122 Ų122146 Ų14675%0.74876%0.755SS**  trans-57105.5152.239.90000106.7P99P99-T101 VanDerWaalsContact C-N 3.35Å; P99-T101 PolarHBondContact O-N 3.34Å
102D50.7Low60.5Low146 Ų146139.9 Ų139.978%0.78173%0.732SS**SBendtrans173.2100.6145.6-93.4-51.3000110.1P100 N104P100-D102 PolarHBondContact O-N 3.22Å; P100-D102 VanDerWaalsContact O-N 3.16Å; D102-N104 VanDerWaalsContact C-N 3.29Å; D102-N104 PolarHBondContact O-N 2.96Å
103A52.2Low62Low110 Ų110138.2 Ų138.291%0.90973%0.726SS**SBendtrans43.530.9131.300000120.8
104N54.7Low63.8Low141 Ų141136.7 Ų136.775%0.75471%0.711SS**  trans-132.5119.4157.4-160.4-21.8000108.6D102 A106D102-N104 VanDerWaalsContact C-N 3.29Å; D102-N104 PolarHBondContact O-N 2.96Å; N104-A106 PolarHBondContact O-N 2.95Å
105K51.8Low65.3Low206 Ų206134.2 Ų134.290%0.89670%0.704SS**  trans-60.669.3178.9-71.1178.5173.6-168.60110.9L107K105-L107 PolarHBondContact O-N 2.71Å
106A59.7Low66.3Low89 Ų89128.2 Ų128.274%0.73670%0.699SS**  trans-72.298175.700000107.3N104N104-A106 PolarHBondContact O-N 2.95Å
107L63.2Low67.7Low110 Ų110121.5 Ų121.558%0.57668%0.68SS**  trans-43.6138.1169.5-71.4163.2000109.3K105 S109 L122K105-L107 PolarHBondContact O-N 2.71Å; L107-S109 PolarHBondContact O-N 3.33Å; L107-S109 VanDerWaalsContact O-N 3.09Å; L107-L122 HydrophobicContact CB-CD2 3.98Å; L107-L122 HydrophobicContact CD1-CD1 3.91Å
108P74Confident69Low86 Ų86120.5 Ų120.556%0.55867%0.673SS**  trans-55.7124.9-177.721.6-28.9000108V123P108-V123 HydrophobicContact CB-CB 4.45Å; P108-V123 HydrophobicContact CG-CB 4.37Å; P108-V123 WeakPolarHBondContact CG-O 3.24Å; P108-V123 WeakPolarHBondContact O-CB 3.34Å; P108-V123 PolarHBondContact O-N 3.24Å
109S77.1Confident70.3Confident67 Ų67118.8 Ų118.847%0.46965%0.653SS.*EExtended strand (participates in β ladder)trans-128.9139.8-176.661.10000110.3L107 V121L107-S109 PolarHBondContact O-N 3.33Å; L107-S109 VanDerWaalsContact O-N 3.09Å; S109-V121 CarbonylContact C-O 3.46Å; S109-V121 WeakPolarHBondContact CA-O 3.24Å; S109-V121 WeakPolarHBondContact CB-O 3.17Å
110I80.8Confident71.3Confident93 Ų93119.1 Ų119.148%0.47765%0.649SS.*EExtended strand (participates in β ladder)trans-113.2136.2178.2-62.3174.3000108L112 V121 V123I110-L112 HydrophobicContact CB-CD1 4.1Å; I110-L112 HydrophobicContact CG2-CD1 3.96Å; I110-L112 HydrophobicContact CG2-CG 3.98Å; I110-L112 PolarHBondContact O-N 3Å; I110-V121 PolarHBondContact N-O 2.64Å; I110-V121 PolarHBondContact O-N 3.37Å; I110-V123 HydrophobicContact CB-CG2 4.32Å; I110-V123 HydrophobicContact CD1-CG2 3.5Å; I110-V123 VanDerWaalsContact CD1-CG2 3.5Å; I110-V123 HydrophobicContact CG1-CG2 3.61Å
111R81.4Confident72.6Confident208 Ų208115.7 Ų115.779%0.78563%0.626SS**EExtended strand (participates in β ladder)trans-79.9112169.5-77.8180-167.3-149.48109.1R119 N120R111-R119 WeakPolarHBondContact CA-O 3.48Å; R111-N120 WeakPolarHBondContact CG-OD1 3.24Å
112L84Confident74.1Confident81 Ų81115.1 Ų115.142%0.42462%0.618SS.*EExtended strand (participates in β ladder)trans-114.7141.4175.3-69.6127.1000109.3I110 I114 R119 V121I110-L112 HydrophobicContact CB-CD1 4.1Å; I110-L112 HydrophobicContact CG2-CD1 3.96Å; I110-L112 HydrophobicContact CG2-CG 3.98Å; I110-L112 PolarHBondContact O-N 3Å; L112-I114 HydrophobicContact CB-CG1 4.43Å; L112-R119 PolarHBondContact N-O 3.39Å; L112-R119 PolarHBondContact O-N 3.22Å; L112-V121 HydrophobicContact CB-CG2 4.4Å; L112-V121 HydrophobicContact CD1-CB 3.71Å; L112-V121 HydrophobicContact CD1-CG1 4.47Å; L112-V121 HydrophobicContact CD1-CG2 3.58Å
113R85.1Confident75.6Confident213 Ų213111 Ų11180%0.80460%0.597SS**EExtended strand (participates in β ladder)trans-88.9114.8168.6-71.7-177.3173.7178-2.5107.7
114I82.3Confident76.9Confident69 Ų69113.8 Ų113.835%0.35459%0.591SS.*EExtended strand (participates in β ladder)trans-117.5119.5174.4-51.2178.5000106L112 S116 I117 R119L112-I114 HydrophobicContact CB-CG1 4.43Å; I114-S116 PolarHBondContact O-N 3.27Å; I114-I117 PolarHBondContact N-O 2.69Å; I114-I117 PolarHBondContact O-N 3.45Å; I114-I117 VanDerWaalsContact O-N 3.1Å; I114-R119 VanDerWaalsContact CG2-NH1 3.27Å
115D81.8Confident77.9Confident128 Ų128112.7 Ų112.768%0.68459%0.594SS**THydrogen-bonded Turntrans57.743.3-176.5-43.9-54.5000113.2I117 R119D115-I117 PolarHBondContact O-N 3.41Å; D115-R119 IonicContact OD2-NH1 3.77Å; D115-R119 IonicContact OD2-NH2 3.8Å
116S76Confident79Confident117 Ų117111 Ų11182%0.81859%0.587SS**THydrogen-bonded Turntrans63.90.6-174.3-56.50000115.8I114I114-S116 PolarHBondContact O-N 3.27Å
117I82.6Confident79.5Confident91 Ų91112 Ų11247%0.46759%0.588SS.*EExtended strand (participates in β ladder)trans-98.9122.1177.7-58.7167.9000109.2I114 D115 R119I114-I117 PolarHBondContact N-O 2.69Å; I114-I117 PolarHBondContact O-N 3.45Å; I114-I117 VanDerWaalsContact O-N 3.1Å; D115-I117 PolarHBondContact O-N 3.41Å; I117-R119 HydrophobicContact CG2-CG 4.35Å; I117-R119 PolarHBondContact O-N 3.49Å
118P83.8Confident79.6Confident97 Ų97112.2 Ų112.263%0.6360%0.599SS**EExtended strand (participates in β ladder)trans-68.8122.5173.427.9-32.3000110.4
119R84.6Confident78.9Confident88 Ų88111.2 Ų111.233%0.33260%0.604SS.*EExtended strand (participates in β ladder)trans-122.4141.5176.2-63.3-178-175.8141.67.6109.7R111 L112 I114 D115 I117R111-R119 WeakPolarHBondContact CA-O 3.48Å; L112-R119 PolarHBondContact N-O 3.39Å; L112-R119 PolarHBondContact O-N 3.22Å; I114-R119 VanDerWaalsContact CG2-NH1 3.27Å; D115-R119 IonicContact OD2-NH1 3.77Å; D115-R119 IonicContact OD2-NH2 3.8Å; I117-R119 HydrophobicContact CG2-CG 4.35Å; I117-R119 PolarHBondContact O-N 3.49Å
120N82.6Confident78.1Confident109 Ų109119.1 Ų119.158%0.58362%0.623SS**EExtended strand (participates in β ladder)trans-87.1121.4168.6-69-52.4000108.3R111R111-N120 WeakPolarHBondContact CG-OD1 3.24Å
121V83Confident77.4Confident58 Ų58120.9 Ų120.935%0.35264%0.641SS.*EExtended strand (participates in β ladder)trans-110.6131177.6-175.20000108.4S109 I110 L112S109-V121 CarbonylContact C-O 3.46Å; S109-V121 WeakPolarHBondContact CA-O 3.24Å; S109-V121 WeakPolarHBondContact CB-O 3.17Å; I110-V121 PolarHBondContact N-O 2.64Å; I110-V121 PolarHBondContact O-N 3.37Å; L112-V121 HydrophobicContact CB-CG2 4.4Å; L112-V121 HydrophobicContact CD1-CB 3.71Å; L112-V121 HydrophobicContact CD1-CG1 4.47Å; L112-V121 HydrophobicContact CD1-CG2 3.58Å
122L84.3Confident76.5Confident111 Ų111120.5 Ų120.558%0.58165%0.646SS**EExtended strand (participates in β ladder)trans-75.9128.6173-58.9179.8000109.2L107L107-L122 HydrophobicContact CB-CD2 3.98Å; L107-L122 HydrophobicContact CD1-CD1 3.91Å
123V81.8Confident76Confident59 Ų59118.9 Ų118.936%0.35865%0.648SS.*  trans-90.7116.2173.3-177.30000107.4P108 I110P108-V123 HydrophobicContact CB-CB 4.45Å; P108-V123 HydrophobicContact CG-CB 4.37Å; P108-V123 WeakPolarHBondContact CG-O 3.24Å; P108-V123 WeakPolarHBondContact O-CB 3.34Å; P108-V123 PolarHBondContact O-N 3.24Å; I110-V123 HydrophobicContact CB-CG2 4.32Å; I110-V123 HydrophobicContact CD1-CG2 3.5Å; I110-V123 VanDerWaalsContact CD1-CG2 3.5Å; I110-V123 HydrophobicContact CG1-CG2 3.61Å
124Q79.6Confident75.5Confident168 Ų168114.6 Ų114.679%0.78565%0.648SS**  trans-106.2106.6171.2-172.9164-12.700108.2F126Q124-F126 PolarHBondContact O-N 2.91Å
125C77.1Confident75Confident119 Ų119120.7 Ų120.780%0.80469%0.692SS**  trans-78.8109.5168.4-170.20000107.4
126F74Confident74.7Confident171 Ų171120.4 Ų120.475%0.7569%0.692SS**  trans-91.7115.7167.553.1-88.6000107.6Q124 S128Q124-F126 PolarHBondContact O-N 2.91Å; F126-S128 PolarHBondContact O-N 2.72Å
127S69.5Low74.6Confident109 Ų109120.5 Ų120.576%0.76269%0.686SS**  trans-84.4110.9170.165.60000108.6G129S127-G129 PolarHBondContact O-N 2.85Å
128S65.6Low74.1Confident115 Ų115122.2 Ų122.280%0.80470%0.698SS**  trans-80.564.3162.257.80000109.2F126 R130F126-S128 PolarHBondContact O-N 2.72Å; S128-R130 PolarHBondContact O-N 3.39Å
129G59.3Low73.6Confident64 Ų64123.6 Ų123.666%0.6670%0.702SS**  trans-79103.1172.100000109.1S127S127-G129 PolarHBondContact O-N 2.85Å
130R61.9Low72.9Confident233 Ų233125.9 Ų125.988%0.87973%0.725SS**  trans-73.4133.2156.4-65.7-178.9-176.4-99.10.9106.4S128 F132S128-R130 PolarHBondContact O-N 3.39Å; R130-F132 PolarHBondContact O-N 3.31Å; R130-F132 VanDerWaalsContact O-N 3.07Å
131P65.7Low72.2Confident130 Ų130127 Ų12784%0.84474%0.735SS**  trans-62.2114.9168.325.8-30.7000107.7G133P131-G133 PolarHBondContact O-N 3.35Å
132F62.7Low71.5Confident201 Ų201131.9 Ų131.988%0.88276%0.762SS**  trans-81.2105.1164-162.8-92.5000105.8R130R130-F132 PolarHBondContact O-N 3.31Å; R130-F132 VanDerWaalsContact O-N 3.07Å
133G73.3Confident70.5Confident46 Ų46133.5 Ų133.547%0.47478%0.776SS.*  trans-69162.2171.700000111P131P131-G133 PolarHBondContact O-N 3.35Å
134P73.5Confident69.5Low123 Ų123139.8 Ų139.880%0.79981%0.811SS**  trans-60.5160.2174.527.2-33.7000111.8
135P72.4Confident68.6Low198 Ų198137.2 Ų137.2100%1.28681%0.813SS**  trans-60.50-176.728.2-37.3000113.9

Retrieved 135 of 135 residues in 124.1 ms (Link to these results)