A0A077ZD66_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZD66, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 72 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
1M53.7Low82.4Confident242 Ų24299.3 Ų99.3100%1.19268%0.682SS**  0980-57.6155.1120.400106.4
2A70.7Confident83.4Confident97 Ų9795.6 Ų95.680%0.80266%0.663SS**  trans-77.5132.117800000108.3A4A2-A4 PolarHBondContact O-N 3.08Å
3P73.3Confident84.3Confident125 Ų12592.4 Ų92.481%0.81265%0.647SS**  trans-60.9128.5176.425.5-32000108.6G5P3-G5 PolarHBondContact O-N 3.03Å
4A81.2Confident85.1Confident104 Ų10493.6 Ų93.686%0.8664%0.64SS**  trans-59.3114.2171.600000107.7A2A2-A4 PolarHBondContact O-N 3.08Å
5G84.5Confident85.8Confident59 Ų5990.5 Ų90.561%0.60862%0.624SS**PPolyproline II helixtrans-60.8159.7175.700000111.1P3 S7P3-G5 PolarHBondContact O-N 3.03Å; G5-S7 PolarHBondContact O-N 3.11Å
6P84.7Confident86.4Confident90 Ų9090.7 Ų90.758%0.58462%0.62SS**PPolyproline II helixtrans-56.1143.5174.724-32.4000110.2V10 V11P6-V10 HydrophobicContact CB-CB 4.14Å; P6-V10 HydrophobicContact CB-CG1 3.96Å; P6-V11 HydrophobicContact CB-CG2 4.14Å; P6-V11 HydrophobicContact CG-CG2 3.72Å
7S90.5Very high87Confident76 Ų7690.5 Ų90.553%0.53162%0.618SS.*PPolyproline II helixtrans-58.3149.1175.960.20000110.5G5 G9 V10 V11G5-S7 PolarHBondContact O-N 3.11Å; S7-G9 PolarHBondContact O-N 3.32Å; S7-G9 VanDerWaalsContact O-N 3.08Å; S7-V10 WeakPolarHBondContact O-CA 3.47Å; S7-V10 WeakPolarHBondContact O-CB 3.23Å; S7-V10 PolarHBondContact O-N 3.34Å; S7-V10 WeakPolarHBondContact OG-CG2 3.2Å; S7-V11 PolarHBondContact O-N 2.95Å; S7-V11 VanDerWaalsContact O-N 3.16Å
8S87.6Confident87.5Confident106 Ų10688.8 Ų88.874%0.74161%0.607SS**Hα-helixtrans-52.5-34.7-17953.30000112.8V11 A12S8-V11 PolarHBondContact O-N 3.04Å; S8-A12 WeakPolarHBondContact O-CB 3.29Å; S8-A12 PolarHBondContact O-N 3.24Å
9G91Very high88Confident48 Ų4889.1 Ų89.150%0.49561%0.605SS.*Hα-helixtrans-62.7-40.317400000113.7S7 A13S7-G9 PolarHBondContact O-N 3.32Å; S7-G9 VanDerWaalsContact O-N 3.08Å; G9-A13 WeakPolarHBondContact O-CB 3.06Å; G9-A13 PolarHBondContact O-N 3.19Å
10V94.8Very high88.5Confident68 Ų6888 Ų8841%0.41260%0.598SS.*Hα-helixtrans-67.1-42.6176.71730000110.6P6 S7 A12 A13 I14P6-V10 HydrophobicContact CB-CB 4.14Å; P6-V10 HydrophobicContact CB-CG1 3.96Å; S7-V10 WeakPolarHBondContact O-CA 3.47Å; S7-V10 WeakPolarHBondContact O-CB 3.23Å; S7-V10 PolarHBondContact O-N 3.34Å; S7-V10 WeakPolarHBondContact OG-CG2 3.2Å; V10-A12 PolarHBondContact O-N 3.09Å; V10-A13 PolarHBondContact O-N 3.16Å; V10-I14 HydrophobicContact CG1-CD1 3.75Å; V10-I14 HydrophobicContact CG1-CG1 4.41Å; V10-I14 VanDerWaalsContact O-CG1 3.29Å; V10-I14 WeakPolarHBondContact O-CG1 3.28Å; V10-I14 PolarHBondContact O-N 3.44Å
11V94.5Very high88.9Confident77 Ų7786.2 Ų86.247%0.46759%0.589SS.*Hα-helixtrans-62-44.9178-179.10000111.1P6 S7 S8 A13 I14 A15P6-V11 HydrophobicContact CB-CG2 4.14Å; P6-V11 HydrophobicContact CG-CG2 3.72Å; S7-V11 PolarHBondContact O-N 2.95Å; S7-V11 VanDerWaalsContact O-N 3.16Å; S8-V11 PolarHBondContact O-N 3.04Å; V11-A13 PolarHBondContact O-N 3.06Å; V11-I14 PolarHBondContact O-N 2.76Å; V11-A15 WeakPolarHBondContact O-CB 3.22Å; V11-A15 PolarHBondContact O-N 3.33Å
12A94.7Very high91Very high55 Ų5579.6 Ų79.646%0.45556%0.562SS.*Hα-helixtrans-62.1-42.9177.200000112.2S8 V10 A15 V16S8-A12 WeakPolarHBondContact O-CB 3.29Å; S8-A12 PolarHBondContact O-N 3.24Å; V10-A12 PolarHBondContact O-N 3.09Å; A12-A15 PolarHBondContact O-N 2.84Å; A12-V16 WeakPolarHBondContact O-CG2 3.4Å; A12-V16 PolarHBondContact O-N 3.39Å
13A94.9Very high92.3Very high54 Ų5478.7 Ų78.745%0.44655%0.547SS..Hα-helixtrans-62.5-46.2177.700000112.1G9 V10 V11 A15 V16 C17G9-A13 WeakPolarHBondContact O-CB 3.06Å; G9-A13 PolarHBondContact O-N 3.19Å; V10-A13 PolarHBondContact O-N 3.16Å; V11-A13 PolarHBondContact O-N 3.06Å; A13-A15 VanDerWaalsContact C-N 3.33Å; A13-A15 PolarHBondContact O-N 3.44Å; A13-V16 PolarHBondContact O-N 3.23Å; A13-C17 WeakPolarHBondContact O-CB 3.16Å; A13-C17 PolarHBondContact O-N 3.39Å; A13-C17 PolarHBondContact O-SG 2.82Å; A13-C17 VanDerWaalsContact O-SG 3.36Å
14I95Very high93.4Very high109 Ų10978.3 Ų78.356%0.55954%0.537SS*.Hα-helixtrans-60.6-44.4177.3-66.6166.5000110.5V10 V11 C17 S18V10-I14 HydrophobicContact CG1-CD1 3.75Å; V10-I14 HydrophobicContact CG1-CG1 4.41Å; V10-I14 VanDerWaalsContact O-CG1 3.29Å; V10-I14 WeakPolarHBondContact O-CG1 3.28Å; V10-I14 PolarHBondContact O-N 3.44Å; V11-I14 PolarHBondContact O-N 2.76Å; I14-C17 PolarHBondContact O-N 3.27Å; I14-S18 VanDerWaalsContact O-CB 3.3Å; I14-S18 WeakPolarHBondContact O-CB 3.36Å; I14-S18 PolarHBondContact O-N 3.35Å; I14-S18 PolarHBondContact O-OG 2.99Å
15A95.3Very high94.2Very high48 Ų4877.6 Ų77.640%0.39752%0.522SS..Hα-helixtrans-58.8-50.9177.900000111.4V11 A12 A13 C17 S18 V19V11-A15 WeakPolarHBondContact O-CB 3.22Å; V11-A15 PolarHBondContact O-N 3.33Å; A12-A15 PolarHBondContact O-N 2.84Å; A13-A15 VanDerWaalsContact C-N 3.33Å; A13-A15 PolarHBondContact O-N 3.44Å; A15-C17 PolarHBondContact O-N 3.45Å; A15-S18 PolarHBondContact O-N 2.91Å; A15-S18 PolarHBondContact O-OG 3Å; A15-V19 WeakPolarHBondContact O-CG2 3.39Å; A15-V19 PolarHBondContact O-N 3.19Å
16V96.3Very high94.8Very high93 Ų9377.5 Ų77.556%0.56452%0.516SS*.Hα-helixtrans-62-46.9179.1175.90000111.3A12 A13 S18 V19 C20A12-V16 WeakPolarHBondContact O-CG2 3.4Å; A12-V16 PolarHBondContact O-N 3.39Å; A13-V16 PolarHBondContact O-N 3.23Å; V16-S18 VanDerWaalsContact C-N 3.31Å; V16-S18 PolarHBondContact O-N 3.4Å; V16-V19 PolarHBondContact O-N 3.45Å; V16-C20 PolarHBondContact O-N 3.01Å; V16-C20 PolarHBondContact O-SG 3.04Å; V16-C20 VanDerWaalsContact O-SG 3.34Å
17C96Very high95.4Very high87 Ų8777.2 Ų77.259%0.58851%0.509SS*.Hα-helixtrans-58.8-42.1177-74.60000112.2A13 I14 A15 C20 A21A13-C17 WeakPolarHBondContact O-CB 3.16Å; A13-C17 PolarHBondContact O-N 3.39Å; A13-C17 PolarHBondContact O-SG 2.82Å; A13-C17 VanDerWaalsContact O-SG 3.36Å; I14-C17 PolarHBondContact O-N 3.27Å; A15-C17 PolarHBondContact O-N 3.45Å; C17-C20 PolarHBondContact O-N 2.89Å; C17-A21 VanDerWaalsContact O-CB 3.31Å; C17-A21 WeakPolarHBondContact O-CB 3.36Å; C17-A21 PolarHBondContact O-N 3.47Å
18S96.1Very high95.8Very high60 Ų6076.5 Ų76.542%0.4251%0.507SS..Hα-helixtrans-64.4-43.1179.172.80000111.9I14 A15 V16 A21 V22I14-S18 VanDerWaalsContact O-CB 3.3Å; I14-S18 WeakPolarHBondContact O-CB 3.36Å; I14-S18 PolarHBondContact O-N 3.35Å; I14-S18 PolarHBondContact O-OG 2.99Å; A15-S18 PolarHBondContact O-N 2.91Å; A15-S18 PolarHBondContact O-OG 3Å; V16-S18 VanDerWaalsContact C-N 3.31Å; V16-S18 PolarHBondContact O-N 3.4Å; S18-A21 PolarHBondContact O-N 3.26Å; S18-V22 WeakPolarHBondContact O-CG2 3.27Å; S18-V22 PolarHBondContact O-N 2.97Å
19V97Very high96.3Very high94 Ų9475.9 Ų75.957%0.5750%0.499SS*.Hα-helixtrans-64.2-46.8176.8173.80000110.4A15 V16 A21 V22 V23A15-V19 WeakPolarHBondContact O-CG2 3.39Å; A15-V19 PolarHBondContact O-N 3.19Å; V16-V19 PolarHBondContact O-N 3.45Å; V19-A21 VanDerWaalsContact C-N 3.33Å; V19-A21 PolarHBondContact O-N 3.39Å; V19-V22 PolarHBondContact O-N 2.77Å; V19-V23 WeakPolarHBondContact O-CG2 3.39Å; V19-V23 PolarHBondContact O-N 3.23Å
20C97.4Very high96.6Very high67 Ų6780.1 Ų80.145%0.45350%0.501SS..Hα-helixtrans-59.4-43.1176-700000112.1V16 C17 V23 L24V16-C20 PolarHBondContact O-N 3.01Å; V16-C20 PolarHBondContact O-SG 3.04Å; V16-C20 VanDerWaalsContact O-SG 3.34Å; C17-C20 PolarHBondContact O-N 2.89Å; C20-V23 PolarHBondContact O-N 3.2Å; C20-L24 WeakPolarHBondContact O-CB 3.45Å; C20-L24 WeakPolarHBondContact O-CG 3.33Å; C20-L24 PolarHBondContact O-N 3.11Å
21A97.3Very high96.7Very high51 Ų5183 Ų8342%0.42151%0.508SS..Hα-helixtrans-62.4-45178.500000111.6C17 S18 V19 V23 L24 V25C17-A21 VanDerWaalsContact O-CB 3.31Å; C17-A21 WeakPolarHBondContact O-CB 3.36Å; C17-A21 PolarHBondContact O-N 3.47Å; S18-A21 PolarHBondContact O-N 3.26Å; V19-A21 VanDerWaalsContact C-N 3.33Å; V19-A21 PolarHBondContact O-N 3.39Å; A21-V23 VanDerWaalsContact C-N 3.35Å; A21-V23 PolarHBondContact O-N 2.92Å; A21-L24 PolarHBondContact O-N 3.46Å; A21-V25 WeakPolarHBondContact O-CB 3.39Å; A21-V25 VanDerWaalsContact O-CG2 3.25Å; A21-V25 WeakPolarHBondContact O-CG2 3.47Å; A21-V25 PolarHBondContact O-N 2.95Å
22V97.7Very high96.8Very high103 Ų10381.6 Ų81.662%0.62451%0.505SS*.Hα-helixtrans-61.6-43.6177.1173.70000111.2S18 V19 V25 A26S18-V22 WeakPolarHBondContact O-CG2 3.27Å; S18-V22 PolarHBondContact O-N 2.97Å; V19-V22 PolarHBondContact O-N 2.77Å; V22-V25 PolarHBondContact O-N 3.18Å; V22-A26 WeakPolarHBondContact O-CB 3.44Å; V22-A26 PolarHBondContact O-N 2.9Å
23V97.9Very high96.8Very high78 Ų7885.7 Ų85.747%0.47351%0.509SS..Hα-helixtrans-62.3-45.5177.6172.50000111.2V19 C20 A21 A26 L27V19-V23 WeakPolarHBondContact O-CG2 3.39Å; V19-V23 PolarHBondContact O-N 3.23Å; C20-V23 PolarHBondContact O-N 3.2Å; A21-V23 VanDerWaalsContact C-N 3.35Å; A21-V23 PolarHBondContact O-N 2.92Å; V23-A26 PolarHBondContact O-N 3.38Å; V23-L27 HydrophobicContact CG1-CD1 4.15Å; V23-L27 WeakPolarHBondContact O-CG 3.25Å; V23-L27 PolarHBondContact O-N 3.47Å
24L97.5Very high96.8Very high117 Ų11787.5 Ų87.561%0.61351%0.507SS*.Hα-helixtrans-63.3-43178.2-72.4175.6000112C20 A21 L27 A28C20-L24 WeakPolarHBondContact O-CB 3.45Å; C20-L24 WeakPolarHBondContact O-CG 3.33Å; C20-L24 PolarHBondContact O-N 3.11Å; A21-L24 PolarHBondContact O-N 3.46Å; L24-L27 PolarHBondContact O-N 3.43Å; L24-A28 WeakPolarHBondContact O-CB 3.26Å; L24-A28 PolarHBondContact O-N 2.85Å
25V97.9Very high96.6Very high90 Ų9088.4 Ų88.455%0.54551%0.507SS..Hα-helixtrans-63.3-44.7176.4171.90000110.6A21 V22 L27 A28 V29A21-V25 WeakPolarHBondContact O-CB 3.39Å; A21-V25 VanDerWaalsContact O-CG2 3.25Å; A21-V25 WeakPolarHBondContact O-CG2 3.47Å; A21-V25 PolarHBondContact O-N 2.95Å; V22-V25 PolarHBondContact O-N 3.18Å; V25-L27 VanDerWaalsContact C-N 3.34Å; V25-L27 PolarHBondContact O-N 2.83Å; V25-A28 PolarHBondContact O-N 3.39Å; V25-V29 HydrophobicContact CG1-CG2 4.31Å; V25-V29 WeakPolarHBondContact O-CB 3.36Å; V25-V29 VanDerWaalsContact O-CG2 3.28Å; V25-V29 WeakPolarHBondContact O-CG2 3.26Å; V25-V29 PolarHBondContact O-N 3.41Å
26A97.8Very high96.4Very high57 Ų5790.1 Ų90.147%0.47151%0.509SS..Hα-helixtrans-60.2-43.4177.500000111.9V22 V23 Y30V22-A26 WeakPolarHBondContact O-CB 3.44Å; V22-A26 PolarHBondContact O-N 2.9Å; V23-A26 PolarHBondContact O-N 3.38Å; A26-Y30 VanDerWaalsContact O-CB 3.3Å; A26-Y30 WeakPolarHBondContact O-CB 3.3Å; A26-Y30 PolarHBondContact O-N 2.88Å
27L97.5Very high96.2Very high84 Ų8490.6 Ų90.644%0.4450%0.503SS..Hα-helixtrans-63.9-46.7175-71.4174.3000111.6V23 L24 V25 V29 Y30 F31V23-L27 HydrophobicContact CG1-CD1 4.15Å; V23-L27 WeakPolarHBondContact O-CG 3.25Å; V23-L27 PolarHBondContact O-N 3.47Å; L24-L27 PolarHBondContact O-N 3.43Å; V25-L27 VanDerWaalsContact C-N 3.34Å; V25-L27 PolarHBondContact O-N 2.83Å; L27-V29 VanDerWaalsContact C-N 3.33Å; L27-V29 PolarHBondContact O-N 3.19Å; L27-Y30 PolarHBondContact O-N 3.29Å; L27-F31 VanDerWaalsContact O-CD2 3.26Å; L27-F31 WeakPolarHBondContact O-CD2 3.41Å; L27-F31 PolarHBondContact O-N 3.47Å
28A97.6Very high95.7Very high61 Ų6191.9 Ų91.950%0.50450%0.5SS..Hα-helixtrans-58.7-45.5178.600000111.6L24 V25 F31 A32L24-A28 WeakPolarHBondContact O-CB 3.26Å; L24-A28 PolarHBondContact O-N 2.85Å; V25-A28 PolarHBondContact O-N 3.39Å; A28-F31 PolarHBondContact O-N 2.9Å; A28-A32 VanDerWaalsContact O-CB 3.25Å; A28-A32 WeakPolarHBondContact O-CB 3.27Å; A28-A32 PolarHBondContact O-N 3.26Å
29V97.8Very high95.1Very high93 Ų9396.3 Ų96.356%0.56451%0.508SS*.Hα-helixtrans-63.1-44.3175.8172.50000110.9V25 L27 A32 Y33V25-V29 HydrophobicContact CG1-CG2 4.31Å; V25-V29 WeakPolarHBondContact O-CB 3.36Å; V25-V29 VanDerWaalsContact O-CG2 3.28Å; V25-V29 WeakPolarHBondContact O-CG2 3.26Å; V25-V29 PolarHBondContact O-N 3.41Å; L27-V29 VanDerWaalsContact C-N 3.33Å; L27-V29 PolarHBondContact O-N 3.19Å; V29-A32 PolarHBondContact O-N 2.87Å; V29-Y33 VanDerWaalsContact O-CB 3.26Å; V29-Y33 WeakPolarHBondContact O-CB 3.28Å; V29-Y33 PolarHBondContact O-N 3.42Å
30Y97.2Very high94.4Very high136 Ų136100.2 Ų100.253%0.53351%0.513SS..Hα-helixtrans-61.7-46.6177.9177-98.7000112.4A26 L27 Y33 K34A26-Y30 VanDerWaalsContact O-CB 3.3Å; A26-Y30 WeakPolarHBondContact O-CB 3.3Å; A26-Y30 PolarHBondContact O-N 2.88Å; L27-Y30 PolarHBondContact O-N 3.29Å; Y30-Y33 PolarHBondContact O-N 3.48Å; Y30-K34 HydrophobicContact CE1-CD 4.37Å; Y30-K34 VanDerWaalsContact O-CB 3.3Å; Y30-K34 WeakPolarHBondContact O-CB 3.25Å; Y30-K34 PolarHBondContact O-N 2.85Å
31F96.7Very high93.5Very high128 Ų128103.6 Ų103.656%0.56152%0.52SS*.Hα-helixtrans-65.4-42.4177.2-86.1-74.5000112L27 A28 K34 K35L27-F31 VanDerWaalsContact O-CD2 3.26Å; L27-F31 WeakPolarHBondContact O-CD2 3.41Å; L27-F31 PolarHBondContact O-N 3.47Å; A28-F31 PolarHBondContact O-N 2.9Å; F31-K34 PolarHBondContact O-N 3.38Å; F31-K35 WeakPolarHBondContact O-CB 3.33Å; F31-K35 PolarHBondContact O-N 3.42Å
32A96.8Very high92.2Very high48 Ų48104.4 Ų104.440%0.39752%0.521SS..Hα-helixtrans-60.5-48.2175.100000111A28 V29 K34 K35 I36A28-A32 VanDerWaalsContact O-CB 3.25Å; A28-A32 WeakPolarHBondContact O-CB 3.27Å; A28-A32 PolarHBondContact O-N 3.26Å; V29-A32 PolarHBondContact O-N 2.87Å; A32-K34 PolarHBondContact O-N 3.41Å; A32-K35 PolarHBondContact O-N 2.9Å; A32-I36 VanDerWaalsContact O-CG1 3.27Å; A32-I36 WeakPolarHBondContact O-CG1 3.5Å; A32-I36 PolarHBondContact O-N 2.85Å
33Y96Very high90.9Very high142 Ų142106.2 Ų106.256%0.55752%0.523SS*.Hα-helixtrans-59.9-45.9176.3176.3-104.9000111.9V29 Y30 K35 I36 K37V29-Y33 VanDerWaalsContact O-CB 3.26Å; V29-Y33 WeakPolarHBondContact O-CB 3.28Å; V29-Y33 PolarHBondContact O-N 3.42Å; Y30-Y33 PolarHBondContact O-N 3.48Å; Y33-K35 PolarHBondContact O-N 2.89Å; Y33-I36 PolarHBondContact O-N 3.43Å; Y33-K37 HydrophobicContact CE1-CD 4.21Å; Y33-K37 VanDerWaalsContact O-CB 3.27Å; Y33-K37 WeakPolarHBondContact O-CB 3.47Å; Y33-K37 PolarHBondContact O-N 3.43Å
34K95Very high89.5Confident92 Ų92106.4 Ų106.440%0.454%0.541SS..Hα-helixtrans-60.3-44.8176.8-177176.7172.91790111.5Y30 F31 A32 K37 Q38Y30-K34 HydrophobicContact CE1-CD 4.37Å; Y30-K34 VanDerWaalsContact O-CB 3.3Å; Y30-K34 WeakPolarHBondContact O-CB 3.25Å; Y30-K34 PolarHBondContact O-N 2.85Å; F31-K34 PolarHBondContact O-N 3.38Å; A32-K34 PolarHBondContact O-N 3.41Å; K34-K37 PolarHBondContact O-N 3.4Å; K34-Q38 WeakPolarHBondContact O-CB 3.47Å; K34-Q38 WeakPolarHBondContact O-CG 3.3Å; K34-Q38 PolarHBondContact O-N 2.84Å
35K91.2Very high88.2Confident127 Ų127105.4 Ų105.455%0.55253%0.533SS*.Hα-helixtrans-64.5-43.8178.4-175.1175.9179.1173.20111.8F31 A32 Y33 Q38 R39F31-K35 WeakPolarHBondContact O-CB 3.33Å; F31-K35 PolarHBondContact O-N 3.42Å; A32-K35 PolarHBondContact O-N 2.9Å; Y33-K35 PolarHBondContact O-N 2.89Å; K35-Q38 PolarHBondContact O-N 3.2Å; K35-R39 WeakPolarHBondContact O-CG 3.37Å; K35-R39 PolarHBondContact O-N 3.39Å
36I91.1Very high86.9Confident85 Ų85108.7 Ų108.744%0.43654%0.536SS..Hα-helixtrans-64.1-45.7176.1-67.3165000110.1A32 Y33 Q38 R39 R40A32-I36 VanDerWaalsContact O-CG1 3.27Å; A32-I36 WeakPolarHBondContact O-CG1 3.5Å; A32-I36 PolarHBondContact O-N 2.85Å; Y33-I36 PolarHBondContact O-N 3.43Å; I36-Q38 VanDerWaalsContact C-N 3.32Å; I36-Q38 PolarHBondContact O-N 2.88Å; I36-R39 PolarHBondContact O-N 3.34Å; I36-R40 WeakPolarHBondContact O-CG 3.33Å; I36-R40 PolarHBondContact O-N 3.43Å
37K90.4Very high85.9Confident103 Ų103112.4 Ų112.445%0.44854%0.538SS..Hα-helixtrans-61.8-39.3178.1-173.5174.4-177.3174.80112.1Y33 K34 K41Y33-K37 HydrophobicContact CE1-CD 4.21Å; Y33-K37 VanDerWaalsContact O-CB 3.27Å; Y33-K37 WeakPolarHBondContact O-CB 3.47Å; Y33-K37 PolarHBondContact O-N 3.43Å; K34-K37 PolarHBondContact O-N 3.4Å; K37-K41 WeakPolarHBondContact O-CG 3.35Å; K37-K41 PolarHBondContact O-N 3Å
38Q87Confident85Confident113 Ų113111.3 Ų111.353%0.52854%0.536SS..Hα-helixtrans-65.9-43.4173.9-78-177-34.800111.8K34 K35 I36 R40 K41 C42K34-Q38 WeakPolarHBondContact O-CB 3.47Å; K34-Q38 WeakPolarHBondContact O-CG 3.3Å; K34-Q38 PolarHBondContact O-N 2.84Å; K35-Q38 PolarHBondContact O-N 3.2Å; I36-Q38 VanDerWaalsContact C-N 3.32Å; I36-Q38 PolarHBondContact O-N 2.88Å; Q38-R40 PolarHBondContact O-N 2.87Å; Q38-K41 WeakPolarHBondContact O-CB 3.31Å; Q38-K41 PolarHBondContact O-N 3.31Å; Q38-K41 VanDerWaalsContact O-N 3.11Å; Q38-C42 PolarHBondContact O-N 2.91Å; Q38-C42 PolarHBondContact O-SG 3.33Å
39R83.2Confident84.1Confident153 Ų153111.8 Ų111.858%0.57754%0.541SS*.Hα-helixtrans-58.7-46.8175.5-76.1177.9172.4-106.3-5.4111.9K35 I36 K41 C42 E43K35-R39 WeakPolarHBondContact O-CG 3.37Å; K35-R39 PolarHBondContact O-N 3.39Å; I36-R39 PolarHBondContact O-N 3.34Å; R39-K41 PolarHBondContact O-N 2.9Å; R39-C42 CarbonylContact O-C 3.5Å; R39-C42 PolarHBondContact O-N 2.95Å; R39-E43 WeakPolarHBondContact O-CG 3.33Å; R39-E43 PolarHBondContact O-N 2.94Å
40R81.5Confident83.2Confident177 Ų177114.5 Ų114.567%0.66854%0.542SS*.Hα-helixtrans-60.4-29175.4-69.2-174.4-170-173.33.1114.2I36 Q38 C42I36-R40 WeakPolarHBondContact O-CG 3.33Å; I36-R40 PolarHBondContact O-N 3.43Å; Q38-R40 PolarHBondContact O-N 2.87Å; R40-C42 VanDerWaalsContact C-N 3.34Å
41K78.3Confident82Confident138 Ų138111.5 Ų111.560%0.653%0.533SS*.Hα-helixtrans-72.6-31.1174.2-73.5-179.7176.1-161.50112.2K37 Q38 R39 Q45K37-K41 WeakPolarHBondContact O-CG 3.35Å; K37-K41 PolarHBondContact O-N 3Å; Q38-K41 WeakPolarHBondContact O-CB 3.31Å; Q38-K41 PolarHBondContact O-N 3.31Å; Q38-K41 VanDerWaalsContact O-N 3.11Å; R39-K41 PolarHBondContact O-N 2.9Å; K41-Q45 PolarHBondContact O-NE2 3.41Å
42C71Confident81Confident67 Ų67111.7 Ų111.745%0.45354%0.535SS..Hα-helixtrans-90.8-21.5179.5-590000112.7Q38 R39 R40 G44 Q45Q38-C42 PolarHBondContact O-N 2.91Å; Q38-C42 PolarHBondContact O-SG 3.33Å; R39-C42 CarbonylContact O-C 3.5Å; R39-C42 PolarHBondContact O-N 2.95Å; R40-C42 VanDerWaalsContact C-N 3.34Å; C42-G44 PolarHBondContact O-N 3.46Å; C42-Q45 PolarHBondContact O-N 3.34Å
43E68.8Low80.1Confident141 Ų141116.3 Ų116.366%0.65955%0.548SS*.THydrogen-bonded Turntrans-60.7106.8171.4-80.8170.4-17400108.7R39R39-E43 WeakPolarHBondContact O-CG 3.33Å; R39-E43 PolarHBondContact O-N 2.94Å
44G68.7Low79.1Confident82 Ų82115.5 Ų115.585%0.84555%0.548SS*.THydrogen-bonded Turntrans100.9-6.8-177.500000115.3C42 Y46C42-G44 PolarHBondContact O-N 3.46Å; G44-Y46 PolarHBondContact O-N 3.35Å
45Q71.6Confident78Confident97 Ų97115.5 Ų115.545%0.45355%0.552SS.*  trans-77.8109.3167.1-67.8-168.631.200108.4K41 C42 W47K41-Q45 PolarHBondContact O-NE2 3.41Å; C42-Q45 PolarHBondContact O-N 3.34Å; Q45-W47 HydrophobicContact CB-CZ2 4.25Å; Q45-W47 PolarHBondContact O-N 3.02Å; Q45-W47 PolarHBondContact O-NE1 2.94Å
46Y69.6Low76.9Confident158 Ų158114.2 Ų114.262%0.6256%0.558SS**  trans-71.4119.3170179.9-106000108.5G44 P48 E51G44-Y46 PolarHBondContact O-N 3.35Å; Y46-P48 HydrophobicContact CD1-CB 4.36Å; Y46-P48 HydrophobicContact CD1-CG 4.33Å; Y46-P48 HydrophobicContact CE1-CB 3.66Å; Y46-P48 HydrophobicContact CE1-CG 4.08Å; Y46-P48 WeakPolarHBondContact O-CD 3.34Å; Y46-E51 WeakPolarHBondContact CD2-OE1 3.32Å; Y46-E51 VanDerWaalsContact CE2-CD 3.43Å; Y46-E51 WeakPolarHBondContact CE2-OE2 3.29Å
47W77.5Confident75.8Confident135 Ų135112.8 Ų112.851%0.51157%0.565SS.*  trans-112.588.6178.6-63.893.2000107.8Q45 A49 Y50 E51Q45-W47 HydrophobicContact CB-CZ2 4.25Å; Q45-W47 PolarHBondContact O-N 3.02Å; Q45-W47 PolarHBondContact O-NE1 2.94Å; W47-A49 VanDerWaalsContact C-N 3.25Å; W47-A49 PolarHBondContact O-N 3.36Å; W47-Y50 PolarHBondContact O-N 3.34Å; W47-E51 PolarHBondContact O-N 3.49Å
48P77.2Confident74.9Confident61 Ų61113.2 Ų113.240%0.39657%0.568SS.*Hα-helixtrans-53.6-44.8-173.315.6-27.1000111.7Y46 Y50 E51 E52Y46-P48 HydrophobicContact CD1-CB 4.36Å; Y46-P48 HydrophobicContact CD1-CG 4.33Å; Y46-P48 HydrophobicContact CE1-CB 3.66Å; Y46-P48 HydrophobicContact CE1-CG 4.08Å; Y46-P48 WeakPolarHBondContact O-CD 3.34Å; P48-Y50 PolarHBondContact O-N 3Å; P48-E51 PolarHBondContact O-N 3.33Å; P48-E52 VanDerWaalsContact O-CB 3.29Å; P48-E52 WeakPolarHBondContact O-CB 3.3Å; P48-E52 WeakPolarHBondContact O-CG 3.37Å; P48-E52 PolarHBondContact O-N 3.3Å
49A79.7Confident74Confident72 Ų72114.6 Ų114.660%0.59558%0.579SS**Hα-helixtrans-63.7-3817900000113.8W47 E53W47-A49 VanDerWaalsContact C-N 3.25Å; W47-A49 PolarHBondContact O-N 3.36Å; A49-E53 WeakPolarHBondContact O-CB 3.38Å; A49-E53 PolarHBondContact O-N 2.72Å
50Y78.2Confident73.5Confident150 Ų150112.2 Ų112.259%0.58858%0.577SS**Hα-helixtrans-73.9-38.3178.4175.9-103.1000111.7W47 P48 E53 K54W47-Y50 PolarHBondContact O-N 3.34Å; P48-Y50 PolarHBondContact O-N 3Å; Y50-E53 PolarHBondContact O-N 3.42Å; Y50-K54 VanDerWaalsContact O-CB 3.28Å; Y50-K54 WeakPolarHBondContact O-CB 3.44Å; Y50-K54 PolarHBondContact O-N 2.86Å
51E72.8Confident73.1Confident73 Ų73108.7 Ų108.734%0.34158%0.578SS.*Hα-helixtrans-68.4-39.9175.2-69.9-171.5-157.200111.6Y46 W47 P48 K54 N55Y46-E51 WeakPolarHBondContact CD2-OE1 3.32Å; Y46-E51 VanDerWaalsContact CE2-CD 3.43Å; Y46-E51 WeakPolarHBondContact CE2-OE2 3.29Å; W47-E51 PolarHBondContact O-N 3.49Å; P48-E51 PolarHBondContact O-N 3.33Å; E51-K54 PolarHBondContact O-N 3.37Å; E51-N55 VanDerWaalsContact O-CB 3.23Å; E51-N55 WeakPolarHBondContact O-CB 3.5Å; E51-N55 PolarHBondContact O-N 3.27Å; E51-N55 PolarHBondContact O-OD1 3.36Å
52E74.8Confident72.8Confident132 Ų132108.3 Ų108.362%0.61759%0.589SS**Hα-helixtrans-60.2-46.6171.2-76.3172.9-166.200111.6P48 N55 C56P48-E52 VanDerWaalsContact O-CB 3.29Å; P48-E52 WeakPolarHBondContact O-CB 3.3Å; P48-E52 WeakPolarHBondContact O-CG 3.37Å; P48-E52 PolarHBondContact O-N 3.3Å; E52-N55 PolarHBondContact O-N 3Å; E52-C56 WeakPolarHBondContact O-CB 3.47Å; E52-C56 PolarHBondContact O-N 3.43Å
53E78.2Confident72.8Confident144 Ų144112 Ų11267%0.67360%0.603SS**Hα-helixtrans-63.2-45.6177.2-173.2-178.2179.100111.9A49 Y50 N55 C56 G57A49-E53 WeakPolarHBondContact O-CB 3.38Å; A49-E53 PolarHBondContact O-N 2.72Å; Y50-E53 PolarHBondContact O-N 3.42Å; E53-N55 VanDerWaalsContact C-N 3.33Å; E53-N55 PolarHBondContact O-N 3.44Å; E53-C56 WeakPolarHBondContact O-CB 3.49Å; E53-C56 PolarHBondContact O-N 3.29Å; E53-G57 PolarHBondContact O-N 2.91Å
54K76.4Confident73.2Confident126 Ų126110.2 Ų110.255%0.54860%0.604SS.*Hα-helixtrans-58.5-46.1175-178.3-175.1172.6-165.90110.9Y50 E51 G57 Q58Y50-K54 VanDerWaalsContact O-CB 3.28Å; Y50-K54 WeakPolarHBondContact O-CB 3.44Å; Y50-K54 PolarHBondContact O-N 2.86Å; E51-K54 PolarHBondContact O-N 3.37Å; K54-G57 PolarHBondContact O-N 3.35Å; K54-Q58 WeakPolarHBondContact O-CG 3.45Å
55N69.9Low73.6Confident91 Ų91111.7 Ų111.749%0.48760%0.599SS.*Hα-helixtrans-69.9-33.4179.8-70.36.8000111.9E51 E52 E53 G57 Q58E51-N55 VanDerWaalsContact O-CB 3.23Å; E51-N55 WeakPolarHBondContact O-CB 3.5Å; E51-N55 PolarHBondContact O-N 3.27Å; E51-N55 PolarHBondContact O-OD1 3.36Å; E52-N55 PolarHBondContact O-N 3Å; E53-N55 VanDerWaalsContact C-N 3.33Å; E53-N55 PolarHBondContact O-N 3.44Å; N55-G57 VanDerWaalsContact C-N 3.28Å; N55-G57 PolarHBondContact O-N 3.49Å; N55-Q58 PolarHBondContact O-N 3.05Å
56C68.6Low73.7Confident100 Ų100112.5 Ų112.568%0.67661%0.613SS**Hα-helixtrans-59-41176.2-171.20000111E52 E53 Q58E52-C56 WeakPolarHBondContact O-CB 3.47Å; E52-C56 PolarHBondContact O-N 3.43Å; E53-C56 WeakPolarHBondContact O-CB 3.49Å; E53-C56 PolarHBondContact O-N 3.29Å; C56-Q58 VanDerWaalsContact C-N 3.3Å; C56-Q58 PolarHBondContact O-N 3.04Å
57G69.1Low74Confident56 Ų56108 Ų10858%0.57761%0.608SS**Hα-helixtrans-69-23.3175.800000114.6E53 K54 N55 N59E53-G57 PolarHBondContact O-N 2.91Å; K54-G57 PolarHBondContact O-N 3.35Å; N55-G57 VanDerWaalsContact C-N 3.28Å; N55-G57 PolarHBondContact O-N 3.49Å; G57-N59 PolarHBondContact O-N 3.49Å; G57-N59 PolarHBondContact O-ND2 3.5Å
58Q70.2Confident73.8Confident111 Ų111108.8 Ų108.852%0.51962%0.621SS.*THydrogen-bonded Turntrans-76.3-4.7-175.5-64.7-171.3-77.900113.7K54 N55 C56 L60K54-Q58 WeakPolarHBondContact O-CG 3.45Å; N55-Q58 PolarHBondContact O-N 3.05Å; C56-Q58 VanDerWaalsContact C-N 3.3Å; C56-Q58 PolarHBondContact O-N 3.04Å; Q58-L60 HydrophobicContact CB-CD1 3.21Å; Q58-L60 HydrophobicContact CG-CD1 4.31Å; Q58-L60 PolarHBondContact O-N 3.01Å
59N69.7Low73.5Confident142 Ų142114.2 Ų114.276%0.75964%0.641SS**THydrogen-bonded Turntrans4241175.9-71.6-83.3000112.6G57G57-N59 PolarHBondContact O-N 3.49Å; G57-N59 PolarHBondContact O-ND2 3.5Å
60L71.7Confident72.8Confident103 Ų103113.9 Ų113.954%0.53965%0.645SS.*PPolyproline II helixtrans-64.9138.2-179.4-85.186.1000108.4Q58Q58-L60 HydrophobicContact CB-CD1 3.21Å; Q58-L60 HydrophobicContact CG-CD1 4.31Å; Q58-L60 PolarHBondContact O-N 3.01Å
61P73.8Confident71.9Confident104 Ų104113.6 Ų113.668%0.67565%0.653SS**PPolyproline II helixtrans-56150.9165.925.2-32000109L63P61-L63 PolarHBondContact O-N 3.41Å; P61-L63 VanDerWaalsContact O-N 3.09Å
62P71.7Confident71.6Confident129 Ų129120.7 Ų120.784%0.83869%0.691SS**PPolyproline II helixtrans-48.5123179.4-2431.5000110.2
63L70.7Confident71.5Confident144 Ų144120.2 Ų120.275%0.75469%0.694SS**PPolyproline II helixtrans-63.2134.6173.6-76.6162.9000108.1P61P61-L63 PolarHBondContact O-N 3.41Å; P61-L63 VanDerWaalsContact O-N 3.09Å
64P76.7Confident71.1Confident104 Ų104118.9 Ų118.968%0.67570%0.695SS**PPolyproline II helixtrans-59148.4171.126.3-32.7000109.1
65P77.7Confident70.8Confident114 Ų114118.5 Ų118.574%0.7470%0.704SS**PPolyproline II helixtrans-54.2144.1176.223.6-33000109.8A67P65-A67 PolarHBondContact O-N 3.16Å
66P73Confident70.9Confident114 Ų114120.1 Ų120.174%0.7472%0.716SS**PPolyproline II helixtrans-55.1134.4177.723.3-32.5000109.5I68P66-I68 PolarHBondContact O-N 2.87Å
67A75.9Confident71Confident63 Ų63121.4 Ų121.452%0.52172%0.719SS.*PPolyproline II helixtrans-59.9131.3176.400000109.3P65 E69 G70P65-A67 PolarHBondContact O-N 3.16Å; A67-E69 HydrophobicContact CB-CB 4.43Å; A67-E69 PolarHBondContact O-N 3.27Å; A67-G70 PolarHBondContact O-N 3.05Å; A67-G70 VanDerWaalsContact O-N 3.16Å
68I73.8Confident71.1Confident152 Ų152125.7 Ų125.778%0.77973%0.728SS**G310 helixtrans-54.2-24.4175.4-102.1154.3000112.1P66 G70 L71P66-I68 PolarHBondContact O-N 2.87Å; I68-G70 PolarHBondContact O-N 3.08Å; I68-G70 VanDerWaalsContact O-N 3.08Å; I68-L71 PolarHBondContact O-N 3.02Å; I68-L71 VanDerWaalsContact O-N 3.11Å
69E71.4Confident71.2Confident174 Ų174126.8 Ų126.881%0.81374%0.743SS**G310 helixtrans-58.3-18.7178.5-63.9176.5166.100114.3A67A67-E69 HydrophobicContact CB-CB 4.43Å; A67-E69 PolarHBondContact O-N 3.27Å
70G64.1Low71.3Confident66 Ų66125.6 Ų125.668%0.6874%0.742SS**G310 helixtrans-102.23.5177.800000115.8A67 I68A67-G70 PolarHBondContact O-N 3.05Å; A67-G70 VanDerWaalsContact O-N 3.16Å; I68-G70 PolarHBondContact O-N 3.08Å; I68-G70 VanDerWaalsContact O-N 3.08Å
71L60.4Low71.3Confident144 Ų144127.5 Ų127.575%0.75476%0.759SS**  trans-97.910.8-176-128.579.3000114.2I68I68-L71 PolarHBondContact O-N 3.02Å; I68-L71 VanDerWaalsContact O-N 3.11Å
72I66.1Low71.1Confident222 Ų222129.6 Ų129.6100%1.13877%0.767SS**  trans-113.40177.555.9163.3000112.2

Retrieved 72 of 72 residues in 113.4 ms (Link to these results)