A0A077Z1U4_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z1U4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 74 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
1M51.9Low66.2Low251 Ų251120 Ų120100%1.23657%0.572SS**  01270-61.3173.3-160.500108.4
2R56.4Low66.4Low251 Ų251114.6 Ų114.695%0.94755%0.549SS*.PPolyproline II helixtrans-76.6135.7178.5-70.4178.1-179.1172.50.4109.1M4R2-M4 PolarHBondContact O-N 3.34Å
3S55.7Low66.1Low32 Ų32118.8 Ų118.822%0.22457%0.568CS.*PPolyproline II helixtrans-57.3131.3177.8-175.70000111.5V5 H26S3-V5 PolarHBondContact O-N 3.16Å; S3-H26 WeakPolarHBondContact CB-CE1 3.47Å; S3-H26 WeakPolarHBondContact CB-ND1 3.11Å; S3-H26 PolarHBondContact OG-CE1 3.25Å; S3-H26 VanDerWaalsContact OG-CE1 3.24Å; S3-H26 PolarHBondContact OG-ND1 3.23Å
4M65.7Low65.8Low140 Ų140121.3 Ų121.369%0.6959%0.586SS**PPolyproline II helixtrans-62.9130.4161.9-168.1174.3-75.900108.1R2 T25R2-M4 PolarHBondContact O-N 3.34Å; M4-T25 PolarHBondContact O-N 2.96Å; M4-T25 PolarHBondContact O-OG1 2.62Å
5V67.7Low65.1Low63 Ų63124.7 Ų124.738%0.38259%0.59SS.*EExtended strand (participates in β ladder)trans-115.2108.8-178.4176.40000107.3S3 R22 V23S3-V5 PolarHBondContact O-N 3.16Å; V5-R22 HydrophobicContact CG1-CG 3.19Å; V5-V23 WeakPolarHBondContact CA-O 3.45Å
6T70.2Confident65Low56 Ų56118.8 Ų118.834%0.34457%0.572SS.*EExtended strand (participates in β ladder)trans-93117.6173.133.70000109.1V23T6-V23 PolarHBondContact N-O 2.92Å; T6-V23 PolarHBondContact O-N 2.91Å
7M77.6Confident65.1Low100 Ų100113.8 Ų113.849%0.49355%0.551SS.*EExtended strand (participates in β ladder)trans-92.3126.9172.4-61.8-162.4-42.800109.6V21 R22M7-V21 CarbonylContact C-O 3.56Å; M7-V21 WeakPolarHBondContact CA-O 3.5Å; M7-R22 HydrophobicContact CG-CG 4.48Å
8M75.4Confident65.6Low94 Ų94108.9 Ų108.946%0.46353%0.526SS..EExtended strand (participates in β ladder)trans-118.5140.2173.2-57.5178.4-15900109.1R20 V21 V23M8-R20 CarbonylContact O-C 3.52Å; M8-V21 HydrophobicContact CB-CB 4.44Å; M8-V21 PolarHBondContact N-O 3.23Å; M8-V21 PolarHBondContact O-N 3.12Å; M8-V23 HydrophobicContact CE-CG2 4.22Å
9I72.1Confident66Low84 Ų84104 Ų10443%0.43150%0.503SS..EExtended strand (participates in β ladder)trans-112.5116.6175.1-54.2-174.8000107.5Y18 T19 R20 L40I9-Y18 HydrophobicContact CG2-CD1 3.92Å; I9-Y18 HydrophobicContact CG2-CG 4.32Å; I9-T19 WeakPolarHBondContact CA-O 3.47Å; I9-R20 HydrophobicContact CD1-CG 4.26Å; I9-R20 HydrophobicContact CG1-CG 4.09Å; I9-L40 HydrophobicContact CD1-CD2 4.16Å; I9-L40 HydrophobicContact CG2-CD1 4.41Å
10K69.2Low66.5Low129 Ų129103.9 Ų103.956%0.56150%0.497SS*.EExtended strand (participates in β ladder)trans-106.5122.3175.5-68.2-168.9175.6-171.70109.4T19K10-T19 PolarHBondContact N-O 3Å; K10-T19 PolarHBondContact O-N 2.85Å
11K66.7Low66.8Low120 Ų12099.6 Ų99.652%0.52248%0.478SS..EExtended strand (participates in β ladder)trans-71.3126.2174.1-171.3178.3-174.6-176.40109Y18K11-Y18 HydrophobicContact CB-CD1 3.74Å; K11-Y18 HydrophobicContact CB-CE1 3.58Å; K11-Y18 HydrophobicContact CD-CE1 3.94Å; K11-Y18 HydrophobicContact CG-CD1 3.97Å; K11-Y18 HydrophobicContact CG-CE1 3.51Å
12D67.7Low68.3Low55 Ų5593.5 Ų93.529%0.29444%0.441SS..EExtended strand (participates in β ladder)trans-88.5103.2165.9-170.9-41.5000107.2N14 R15 T17D12-N14 PolarHBondContact O-N 3.43Å; D12-N14 PolarHBondContact OD1-N 2.92Å; D12-R15 PolarHBondContact OD1-N 3.29Å; D12-T17 WeakPolarHBondContact CA-O 3.27Å; D12-T17 VanDerWaalsContact CB-O 3.3Å; D12-T17 WeakPolarHBondContact CB-O 3.45Å; D12-T17 PolarHBondContact N-O 3.15Å
13Q63.3Low69.3Low170 Ų17083 Ų8379%0.79441%0.405SS*.THydrogen-bonded Turntrans-63.4-23.5-177.4-74.9176.7-42.300112.5
14N62.1Low70.5Confident153 Ų15383.9 Ų83.982%0.81841%0.405SS*.THydrogen-bonded Turntrans-89.1-13.1-172.2-79.88.8000114.2D12D12-N14 PolarHBondContact O-N 3.43Å; D12-N14 PolarHBondContact OD1-N 2.92Å
15R54.9Low70.9Confident173 Ų17380.5 Ų80.565%0.65339%0.392SS*.THydrogen-bonded Turntrans-129.70.1-169.7-69.9-174.4174.1158.1-0.9115.7D12 T17D12-R15 PolarHBondContact OD1-N 3.29Å; R15-T17 HydrophobicContact CB-CG2 4.49Å; R15-T17 PolarHBondContact O-N 3.24Å
16G62.8Low71.1Confident29 Ų2983.1 Ų83.130%0.29940%0.4SS..THydrogen-bonded Turntrans52.950.4-16900000109.4W37G16-W37 PolarHBondContact O-NE1 3.47Å
17T67.4Low71.4Confident34 Ų3482.9 Ų82.921%0.20940%0.399CS..EExtended strand (participates in β ladder)trans-137.9153.2170.956.10000110D12 R15 W37D12-T17 WeakPolarHBondContact CA-O 3.27Å; D12-T17 VanDerWaalsContact CB-O 3.3Å; D12-T17 WeakPolarHBondContact CB-O 3.45Å; D12-T17 PolarHBondContact N-O 3.15Å; R15-T17 HydrophobicContact CB-CG2 4.49Å; R15-T17 PolarHBondContact O-N 3.24Å; T17-W37 VanDerWaalsContact N-NE1 3.18Å
18Y73.4Confident71.2Confident26 Ų2685.9 Ų85.910%0.10241%0.411CS..EExtended strand (participates in β ladder)trans-112.3144.3172.8-67.9-95.5000108.8I9 K11 V35 W37 L40 L42I9-Y18 HydrophobicContact CG2-CD1 3.92Å; I9-Y18 HydrophobicContact CG2-CG 4.32Å; K11-Y18 HydrophobicContact CB-CD1 3.74Å; K11-Y18 HydrophobicContact CB-CE1 3.58Å; K11-Y18 HydrophobicContact CD-CE1 3.94Å; K11-Y18 HydrophobicContact CG-CD1 3.97Å; K11-Y18 HydrophobicContact CG-CE1 3.51Å; Y18-V35 PolarHBondContact N-O 3.25Å; Y18-V35 PolarHBondContact O-N 2.86Å; Y18-W37 AromaticContact CD2-CD1 3.72Å; Y18-W37 HydrophobicContact CD2-CG 4.38Å; Y18-W37 AromaticContact CD2-NE1 3.59Å; Y18-W37 AromaticContact CE2-CD1 3.69Å; Y18-W37 AromaticContact CE2-CD2 3.76Å; Y18-W37 HydrophobicContact CE2-CD2 3.76Å; Y18-W37 AromaticContact CE2-CE2 3.49Å; Y18-W37 VanDerWaalsContact CE2-CE2 3.49Å; Y18-W37 HydrophobicContact CE2-CE3 4.24Å; Y18-W37 HydrophobicContact CE2-CG 4.04Å; Y18-W37 HydrophobicContact CE2-CH2 4.37Å; Y18-W37 AromaticContact CE2-CZ2 3.96Å; Y18-W37 HydrophobicContact CE2-CZ2 3.96Å; Y18-W37 HydrophobicContact CE2-CZ3 4.4Å; Y18-W37 AromaticContact CE2-NE1 3.33Å; Y18-W37 VanDerWaalsContact CE2-NE1 3.33Å; Y18-L40 HydrophobicContact CD1-CD1 4.24Å; Y18-L40 HydrophobicContact CD2-CD1 3.53Å; Y18-L40 HydrophobicContact CE2-CD1 4.34Å; Y18-L40 HydrophobicContact CG-CD1 3.47Å; Y18-L40 VanDerWaalsContact CG-CD1 3.47Å; Y18-L42 HydrophobicContact CE1-CD1 4.05Å; Y18-L42 HydrophobicContact CE2-CD1 4.07Å
19T73.8Confident71.4Confident16 Ų1689.8 Ų89.810%0.09842%0.421CS..EExtended strand (participates in β ladder)trans-103.6115.4170.5-57.10000108.8I9 K10 V21 R32 T33I9-T19 WeakPolarHBondContact CA-O 3.47Å; K10-T19 PolarHBondContact N-O 3Å; K10-T19 PolarHBondContact O-N 2.85Å; T19-V21 HydrophobicContact CG2-CG2 3.94Å; T19-R32 HydrophobicContact CG2-CB 3.81Å; T19-R32 HydrophobicContact CG2-CG 4.24Å; T19-T33 WeakPolarHBondContact CA-O 3.49Å
20R75.4Confident71.9Confident101 Ų10193 Ų9338%0.38143%0.429SS..EExtended strand (participates in β ladder)trans-81.4118.3165.9-64.5-177.984.5162.13.3107.7M8 I9 R32 T33 V35M8-R20 CarbonylContact O-C 3.52Å; I9-R20 HydrophobicContact CD1-CG 4.26Å; I9-R20 HydrophobicContact CG1-CG 4.09Å; R20-R32 WeakPolarHBondContact O-CA 3.3Å; R20-T33 PolarHBondContact N-O 3.03Å; R20-T33 PolarHBondContact O-N 2.8Å; R20-V35 HydrophobicContact CB-CG2 4.24Å; R20-V35 HydrophobicContact CG-CG2 3.65Å
21V74.2Confident72.3Confident15 Ų1590.1 Ų90.19%0.09142%0.422CS..EExtended strand (participates in β ladder)trans-106.7114.1177-171.10000107.5M7 M8 T19 V23 T31 R32M7-V21 CarbonylContact C-O 3.56Å; M7-V21 WeakPolarHBondContact CA-O 3.5Å; M8-V21 HydrophobicContact CB-CB 4.44Å; M8-V21 PolarHBondContact N-O 3.23Å; M8-V21 PolarHBondContact O-N 3.12Å; T19-V21 HydrophobicContact CG2-CG2 3.94Å; V21-V23 HydrophobicContact CG1-CG2 3.87Å; V21-T31 CarbonylContact C-O 3.59Å; V21-T31 WeakPolarHBondContact CA-O 3.47Å; V21-R32 HydrophobicContact CG1-CG 4.19Å; V21-R32 HydrophobicContact CG2-CG 4.1Å
22R83Confident72.8Confident122 Ų12291.9 Ų91.946%0.4643%0.425SS..EExtended strand (participates in β ladder)trans-98.7111.7173179.1-178.6-78.2152.6-3.7108.1V5 M7 Y30 T31V5-R22 HydrophobicContact CG1-CG 3.19Å; M7-R22 HydrophobicContact CG-CG 4.48Å; R22-Y30 CarbonylContact O-C 3.6Å; R22-Y30 VanDerWaalsContact O-CA 3.32Å; R22-Y30 WeakPolarHBondContact O-CA 3.46Å; R22-T31 PolarHBondContact N-O 2.72Å; R22-T31 PolarHBondContact O-N 2.9Å
23V76.1Confident73.2Confident32 Ų3293.4 Ų93.419%0.19444%0.437CS..EExtended strand (participates in β ladder)trans-100.5123.2-178.2-175.40000109.5V5 T6 M8 V21V5-V23 WeakPolarHBondContact CA-O 3.45Å; T6-V23 PolarHBondContact N-O 2.92Å; T6-V23 PolarHBondContact O-N 2.91Å; M8-V23 HydrophobicContact CE-CG2 4.22Å; V21-V23 HydrophobicContact CG1-CG2 3.87Å
24H82.2Confident73.7Confident49 Ų4994.5 Ų94.523%0.22743%0.434CS..EExtended strand (participates in β ladder)trans-98.3101.1172.9-63.1-91.1000108.4H26 T27 H28 R29H24-H26 VanDerWaalsContact C-N 3.29Å; H24-H26 PolarHBondContact O-N 3.22Å; H24-T27 PolarHBondContact O-N 3.35Å; H24-H28 WeakPolarHBondContact O-CA 3.36Å; H24-H28 PolarHBondContact O-N 3.02Å; H24-R29 HydrophobicContact CB-CB 4.43Å; H24-R29 WeakPolarHBondContact CB-O 3.37Å; H24-R29 PolarHBondContact N-O 2.71Å; H24-R29 PolarHBondContact O-N 3.21Å
25T73.1Confident74Confident69 Ų6988.1 Ų88.142%0.42340%0.4SS..THydrogen-bonded Turntrans-66.5-27.2-170.252.60000113.8M4M4-T25 PolarHBondContact O-N 2.96Å; M4-T25 PolarHBondContact O-OG1 2.62Å
26H71.8Confident74.5Confident118 Ų11882.5 Ų82.555%0.54639%0.391SS..THydrogen-bonded Turntrans-72.1-29.7178.174.5-50.9000115.2S3 H24S3-H26 WeakPolarHBondContact CB-CE1 3.47Å; S3-H26 WeakPolarHBondContact CB-ND1 3.11Å; S3-H26 PolarHBondContact OG-CE1 3.25Å; S3-H26 VanDerWaalsContact OG-CE1 3.24Å; S3-H26 PolarHBondContact OG-ND1 3.23Å; H24-H26 VanDerWaalsContact C-N 3.29Å; H24-H26 PolarHBondContact O-N 3.22Å
27T77.7Confident74.3Confident52 Ų5282.3 Ų82.332%0.31938%0.381SS..THydrogen-bonded Turntrans-111.52.5-17841.40000111.4H24 R29H24-T27 PolarHBondContact O-N 3.35Å; T27-R29 PolarHBondContact O-N 2.94Å
28H73.4Confident74Confident162 Ų16286.1 Ų86.175%0.7541%0.407SS*.THydrogen-bonded Turntrans48.621.6-169.5-60.6-91.6000113.1H24H24-H28 WeakPolarHBondContact O-CA 3.36Å; H24-H28 PolarHBondContact O-N 3.02Å
29R78.7Confident73.6Confident176 Ų17688.4 Ų88.466%0.66443%0.431SS*.EExtended strand (participates in β ladder)trans-85134.5-178.8-74.3176.5-174.6166.50.9108.8H24 T27H24-R29 HydrophobicContact CB-CB 4.43Å; H24-R29 WeakPolarHBondContact CB-O 3.37Å; H24-R29 PolarHBondContact N-O 2.71Å; H24-R29 PolarHBondContact O-N 3.21Å; T27-R29 PolarHBondContact O-N 2.94Å
30Y82Confident73Confident152 Ų15289.4 Ų89.460%0.59644%0.435SS*.EExtended strand (participates in β ladder)trans-120137.1170.461.9-92.6000109.4R22 R32R22-Y30 CarbonylContact O-C 3.6Å; R22-Y30 VanDerWaalsContact O-CA 3.32Å; R22-Y30 WeakPolarHBondContact O-CA 3.46Å; Y30-R32 HydrophobicContact CD2-CG 3.86Å; Y30-R32 HydrophobicContact CE2-CG 4.21Å
31T78.5Confident72.3Confident68 Ų6887.8 Ų87.842%0.41745%0.45SS..EExtended strand (participates in β ladder)trans-109.4131167.747.80000108.4V21 R22V21-T31 CarbonylContact C-O 3.59Å; V21-T31 WeakPolarHBondContact CA-O 3.47Å; R22-T31 PolarHBondContact N-O 2.72Å; R22-T31 PolarHBondContact O-N 2.9Å
32R78.2Confident71.6Confident157 Ų15791.1 Ų91.159%0.59247%0.467SS*.EExtended strand (participates in β ladder)trans-111.9116.9179.7-63176.980.8164.4-0.5108.6T19 R20 V21 Y30T19-R32 HydrophobicContact CG2-CB 3.81Å; T19-R32 HydrophobicContact CG2-CG 4.24Å; R20-R32 WeakPolarHBondContact O-CA 3.3Å; V21-R32 HydrophobicContact CG1-CG 4.19Å; V21-R32 HydrophobicContact CG2-CG 4.1Å; Y30-R32 HydrophobicContact CD2-CG 3.86Å; Y30-R32 HydrophobicContact CE2-CG 4.21Å
33T76Confident70.3Confident88 Ų8895 Ų9554%0.5449%0.487SS..EExtended strand (participates in β ladder)trans-111.8125.5174.4-49.30000108.6T19 R20T19-T33 WeakPolarHBondContact CA-O 3.49Å; R20-T33 PolarHBondContact N-O 3.03Å; R20-T33 PolarHBondContact O-N 2.8Å
34R73Confident69.3Low193 Ų19398.1 Ų98.173%0.72850%0.501SS*.EExtended strand (participates in β ladder)trans-75.4132171.5-68.3-177.9-178.6158.73.1108.8
35V67.8Low68.1Low19 Ų19104.5 Ų104.512%0.11553%0.531CS..EExtended strand (participates in β ladder)trans-125.9122.8-177.9-171.10000108.3Y18 R20 A39 L40Y18-V35 PolarHBondContact N-O 3.25Å; Y18-V35 PolarHBondContact O-N 2.86Å; R20-V35 HydrophobicContact CB-CG2 4.24Å; R20-V35 HydrophobicContact CG-CG2 3.65Å; V35-A39 HydrophobicContact CG1-CB 3.71Å; V35-L40 HydrophobicContact CB-CD1 4.36Å; V35-L40 HydrophobicContact CB-CG 4.47Å; V35-L40 HydrophobicContact CG1-CD1 4.2Å; V35-L40 HydrophobicContact CG1-CD2 4.35Å; V35-L40 HydrophobicContact CG1-CG 3.81Å
36A65.1Low67.5Low55 Ų55106.1 Ų106.146%0.45554%0.541SS..EExtended strand (participates in β ladder)trans-66.9149.1174.300000110.1P38 A39A36-P38 VanDerWaalsContact C-CD 3.48Å; A36-P38 HydrophobicContact CB-CG 4.38Å; A36-A39 WeakPolarHBondContact O-CB 3.35Å; A36-A39 PolarHBondContact O-N 3.37Å
37W60.5Low66.8Low24 Ų24105.6 Ų105.69%0.09155%0.546CS..G310 helixtrans-49.3-46.1-179-81.943.6000115.9G16 T17 Y18 A39 L40 M44G16-W37 PolarHBondContact O-NE1 3.47Å; T17-W37 VanDerWaalsContact N-NE1 3.18Å; Y18-W37 AromaticContact CD2-CD1 3.72Å; Y18-W37 HydrophobicContact CD2-CG 4.38Å; Y18-W37 AromaticContact CD2-NE1 3.59Å; Y18-W37 AromaticContact CE2-CD1 3.69Å; Y18-W37 AromaticContact CE2-CD2 3.76Å; Y18-W37 HydrophobicContact CE2-CD2 3.76Å; Y18-W37 AromaticContact CE2-CE2 3.49Å; Y18-W37 VanDerWaalsContact CE2-CE2 3.49Å; Y18-W37 HydrophobicContact CE2-CE3 4.24Å; Y18-W37 HydrophobicContact CE2-CG 4.04Å; Y18-W37 HydrophobicContact CE2-CH2 4.37Å; Y18-W37 AromaticContact CE2-CZ2 3.96Å; Y18-W37 HydrophobicContact CE2-CZ2 3.96Å; Y18-W37 HydrophobicContact CE2-CZ3 4.4Å; Y18-W37 AromaticContact CE2-NE1 3.33Å; Y18-W37 VanDerWaalsContact CE2-NE1 3.33Å; W37-A39 PolarHBondContact O-N 3.13Å; W37-L40 PolarHBondContact O-N 2.8Å; W37-M44 HydrophobicContact CD2-CE 3.42Å; W37-M44 VanDerWaalsContact CD2-CE 3.42Å; W37-M44 HydrophobicContact CD2-SD 4.46Å; W37-M44 HydrophobicContact CE3-CB 3.52Å; W37-M44 HydrophobicContact CE3-CE 3.4Å; W37-M44 VanDerWaalsContact CE3-CE 3.4Å; W37-M44 HydrophobicContact CE3-CG 3.89Å; W37-M44 HydrophobicContact CE3-SD 4.15Å; W37-M44 HydrophobicContact CG-CE 4.24Å; W37-M44 HydrophobicContact CH2-CB 3.71Å; W37-M44 HydrophobicContact CH2-CE 3.57Å; W37-M44 HydrophobicContact CH2-CG 3.11Å; W37-M44 HydrophobicContact CH2-SD 3.27Å; W37-M44 WeakPolarHBondContact CH2-SD 3.32Å; W37-M44 HydrophobicContact CZ2-CE 3.55Å; W37-M44 HydrophobicContact CZ2-CG 4.08Å; W37-M44 HydrophobicContact CZ2-SD 3.6Å; W37-M44 VanDerWaalsContact CZ2-SD 3.6Å; W37-M44 HydrophobicContact CZ3-CB 3.04Å; W37-M44 HydrophobicContact CZ3-CE 3.57Å; W37-M44 HydrophobicContact CZ3-CG 3.08Å; W37-M44 HydrophobicContact CZ3-SD 3.66Å
38P60.8Low65.4Low115 Ų115111 Ų11175%0.74757%0.568SS**G310 helixtrans-61.2-29.5-179.820.3-31.7000112.9A36 L40 G41A36-P38 VanDerWaalsContact C-CD 3.48Å; A36-P38 HydrophobicContact CB-CG 4.38Å; P38-L40 VanDerWaalsContact C-N 3.27Å; P38-L40 PolarHBondContact O-N 2.8Å; P38-G41 PolarHBondContact O-N 2.67Å
39A63.9Low63.8Low74 Ų74113.4 Ų113.461%0.61257%0.57SS**G310 helixtrans-76.5-8.7-176.600000114.4V35 A36 W37V35-A39 HydrophobicContact CG1-CB 3.71Å; A36-A39 WeakPolarHBondContact O-CB 3.35Å; A36-A39 PolarHBondContact O-N 3.37Å; W37-A39 PolarHBondContact O-N 3.13Å
40L62.1Low62.3Low37 Ų37109.2 Ų109.219%0.19457%0.573CS.*G310 helixtrans-102.1-3.6174.1-75.2169.2000113.4I9 Y18 V35 W37 P38 L42I9-L40 HydrophobicContact CD1-CD2 4.16Å; I9-L40 HydrophobicContact CG2-CD1 4.41Å; Y18-L40 HydrophobicContact CD1-CD1 4.24Å; Y18-L40 HydrophobicContact CD2-CD1 3.53Å; Y18-L40 HydrophobicContact CE2-CD1 4.34Å; Y18-L40 HydrophobicContact CG-CD1 3.47Å; Y18-L40 VanDerWaalsContact CG-CD1 3.47Å; V35-L40 HydrophobicContact CB-CD1 4.36Å; V35-L40 HydrophobicContact CB-CG 4.47Å; V35-L40 HydrophobicContact CG1-CD1 4.2Å; V35-L40 HydrophobicContact CG1-CD2 4.35Å; V35-L40 HydrophobicContact CG1-CG 3.81Å; W37-L40 PolarHBondContact O-N 2.8Å; P38-L40 VanDerWaalsContact C-N 3.27Å; P38-L40 PolarHBondContact O-N 2.8Å; L40-L42 HydrophobicContact CB-CB 4.39Å; L40-L42 HydrophobicContact CB-CD1 3.91Å; L40-L42 HydrophobicContact CB-CG 3.9Å; L40-L42 HydrophobicContact CD1-CD1 4.21Å; L40-L42 PolarHBondContact O-N 3.32Å; L40-L42 VanDerWaalsContact O-N 3.13Å
41G60Low61.1Low67 Ų67107 Ų10769%0.69158%0.575SS**THydrogen-bonded Turntrans63.113.1-173.800000113.8P38P38-G41 PolarHBondContact O-N 2.67Å
42L60.7Low59.7Low84 Ų84109.4 Ų109.444%0.4460%0.595SS.*  trans-89.5109.4-179.3-63.8174.9000108.8Y18 L40 M44Y18-L42 HydrophobicContact CE1-CD1 4.05Å; Y18-L42 HydrophobicContact CE2-CD1 4.07Å; L40-L42 HydrophobicContact CB-CB 4.39Å; L40-L42 HydrophobicContact CB-CD1 3.91Å; L40-L42 HydrophobicContact CB-CG 3.9Å; L40-L42 HydrophobicContact CD1-CD1 4.21Å; L40-L42 PolarHBondContact O-N 3.32Å; L40-L42 VanDerWaalsContact O-N 3.13Å; L42-M44 PolarHBondContact O-N 3.21Å
43K54.1Low58.6Low204 Ų204109.9 Ų109.989%0.88760%0.601SS**  trans-70126.3171-66.8-173.8-179.2178.80108.4E45K43-E45 PolarHBondContact O-N 3.31Å
44M55.3Low57.7Low97 Ų97115 Ų11548%0.47862%0.616SS.*  trans-66.3125.4165.3-151.8160.1-19.400107.4W37 L42 T46W37-M44 HydrophobicContact CD2-CE 3.42Å; W37-M44 VanDerWaalsContact CD2-CE 3.42Å; W37-M44 HydrophobicContact CD2-SD 4.46Å; W37-M44 HydrophobicContact CE3-CB 3.52Å; W37-M44 HydrophobicContact CE3-CE 3.4Å; W37-M44 VanDerWaalsContact CE3-CE 3.4Å; W37-M44 HydrophobicContact CE3-CG 3.89Å; W37-M44 HydrophobicContact CE3-SD 4.15Å; W37-M44 HydrophobicContact CG-CE 4.24Å; W37-M44 HydrophobicContact CH2-CB 3.71Å; W37-M44 HydrophobicContact CH2-CE 3.57Å; W37-M44 HydrophobicContact CH2-CG 3.11Å; W37-M44 HydrophobicContact CH2-SD 3.27Å; W37-M44 WeakPolarHBondContact CH2-SD 3.32Å; W37-M44 HydrophobicContact CZ2-CE 3.55Å; W37-M44 HydrophobicContact CZ2-CG 4.08Å; W37-M44 HydrophobicContact CZ2-SD 3.6Å; W37-M44 VanDerWaalsContact CZ2-SD 3.6Å; W37-M44 HydrophobicContact CZ3-CB 3.04Å; W37-M44 HydrophobicContact CZ3-CE 3.57Å; W37-M44 HydrophobicContact CZ3-CG 3.08Å; W37-M44 HydrophobicContact CZ3-SD 3.66Å; L42-M44 PolarHBondContact O-N 3.21Å; M44-T46 HydrophobicContact CB-CG2 4.29Å; M44-T46 PolarHBondContact O-N 3.05Å
45E58Low57.2Low184 Ų184110 Ų11086%0.8661%0.607SS**  trans-60.592.3151.3-71.8-176.9-176.500105.4K43 T47K43-E45 PolarHBondContact O-N 3.31Å; E45-T47 PolarHBondContact O-N 3.18Å
46T60.6Low57.2Low103 Ų103113 Ų11363%0.63263%0.625SS**  trans-6897.5168.747.40000104.4M44 Q48M44-T46 HydrophobicContact CB-CG2 4.29Å; M44-T46 PolarHBondContact O-N 3.05Å; T46-Q48 PolarHBondContact O-N 3.35Å
47T56.7Low57.6Low107 Ų107118.2 Ų118.266%0.65664%0.638SS**  trans-62.383.7152-44.50000104.7E45 W49E45-T47 PolarHBondContact O-N 3.18Å; T47-W49 PolarHBondContact O-N 2.98Å
48Q47.6Very low58.3Low166 Ų166119.6 Ų119.678%0.77665%0.647SS**  trans-69.185.3168.3-167174.2-7.700103T46 A50T46-Q48 PolarHBondContact O-N 3.35Å; Q48-A50 PolarHBondContact O-N 2.89Å
49W41.1Very low59Low212 Ų212116.3 Ų116.380%0.80363%0.63SS**  trans-52.8104.8154.8-67.382000102.8T47 T51T47-W49 PolarHBondContact O-N 2.98Å; W49-T51 PolarHBondContact O-N 2.87Å
50A46.9Very low59.7Low88 Ų88119.1 Ų119.173%0.72763%0.63SS**  trans-5790.7159.700000103.4Q48 S52Q48-A50 PolarHBondContact O-N 2.89Å; A50-S52 PolarHBondContact O-N 2.79Å
51T56.7Low60.6Low105 Ų105124 Ų12464%0.64465%0.65SS**  trans-54.4107.6152.135.50000101.5W49 K53W49-T51 PolarHBondContact O-N 2.87Å; T51-K53 PolarHBondContact O-N 3Å
52S48.5Very low61.4Low118 Ų118128.1 Ų128.183%0.82566%0.656SS**  trans-58.682171.4175.40000105.9A50 K54A50-S52 PolarHBondContact O-N 2.79Å; S52-K54 PolarHBondContact O-N 2.87Å
53K55.1Low62.2Low168 Ų168128.4 Ų128.473%0.7366%0.657SS**  trans-73.8106.7162.3-68.3-175-177.4-177.60101.1T51 T55T51-K53 PolarHBondContact O-N 3Å; K53-T55 PolarHBondContact O-N 3.47Å
54K57.2Low62.9Low195 Ų195124 Ų12485%0.84865%0.649SS**  trans-47.8100.8164.7-173.6179.3-174.1176.60105.8S52 T56S52-K54 PolarHBondContact O-N 2.87Å; K54-T56 PolarHBondContact O-N 3.01Å
55T63.7Low63.5Low87 Ų87123.7 Ų123.753%0.53465%0.654SS.*  trans-53.9119179.7-61.70000105.3K53 K57 A59 Q60K53-T55 PolarHBondContact O-N 3.47Å; T55-K57 PolarHBondContact O-N 3.28Å; T55-A59 HydrophobicContact CG2-CB 3.99Å; T55-Q60 HydrophobicContact CG2-CB 4.03Å
56T67Low64.3Low82 Ų82119.8 Ų119.850%0.50364%0.642SS.*  trans-58.4137175.149.80000106.5K54 L58 A59 Q60K54-T56 PolarHBondContact O-N 3.01Å; T56-L58 PolarHBondContact O-N 2.86Å; T56-A59 PolarHBondContact O-N 3.35Å; T56-A59 WeakPolarHBondContact OG1-CB 3.19Å; T56-Q60 PolarHBondContact O-N 2.99Å; T56-Q60 VanDerWaalsContact O-N 3.15Å
57K73.8Confident64.8Low166 Ų166120.4 Ų120.472%0.72265%0.648SS**Hα-helixtrans-50.8-33.9-179.6-73.6-176174.8-174.90111.5T55 Q60 F61T55-K57 PolarHBondContact O-N 3.28Å; K57-Q60 WeakPolarHBondContact O-CB 3.04Å; K57-Q60 PolarHBondContact O-N 2.83Å; K57-F61 WeakPolarHBondContact O-CD2 3.45Å; K57-F61 PolarHBondContact O-N 2.77Å
58L75.8Confident65.6Low52 Ų52120 Ų12027%0.27264%0.642SS.*Hα-helixtrans-58.2-47.2173.6-62.1-178.2000113.3T56 Q60 F61 N62 L63 T65 L68T56-L58 PolarHBondContact O-N 2.86Å; L58-Q60 VanDerWaalsContact C-N 3.3Å; L58-Q60 PolarHBondContact O-N 2.76Å; L58-F61 PolarHBondContact O-N 2.73Å; L58-N62 PolarHBondContact O-N 2.86Å; L58-L63 HydrophobicContact CB-CB 4.22Å; L58-L63 HydrophobicContact CD2-CB 4.16Å; L58-L63 HydrophobicContact CD2-CD1 3.69Å; L58-L63 PolarHBondContact O-N 3.4Å; L58-T65 HydrophobicContact CB-CG2 4.07Å; L58-L68 HydrophobicContact CD1-CD1 3.83Å; L58-L68 HydrophobicContact CD1-CD2 4.49Å; L58-L68 HydrophobicContact CD1-CG 4.27Å
59A73.6Confident66.9Low47 Ų47115.8 Ų115.839%0.38863%0.627SS.*Hα-helixtrans-68.9-27.417800000112.7T55 T56 F61 T65T55-A59 HydrophobicContact CG2-CB 3.99Å; T56-A59 PolarHBondContact O-N 3.35Å; T56-A59 WeakPolarHBondContact OG1-CB 3.19Å; A59-F61 VanDerWaalsContact C-N 3.31Å; A59-T65 HydrophobicContact CB-CG2 4.43Å
60Q79.5Confident68.6Low132 Ų132111.7 Ų111.762%0.61763%0.631SS**Hα-helixtrans-68.3-30.8173.8-172.1177.7-400112.4T55 T56 K57 L58T55-Q60 HydrophobicContact CG2-CB 4.03Å; T56-Q60 PolarHBondContact O-N 2.99Å; T56-Q60 VanDerWaalsContact O-N 3.15Å; K57-Q60 WeakPolarHBondContact O-CB 3.04Å; K57-Q60 PolarHBondContact O-N 2.83Å; L58-Q60 VanDerWaalsContact C-N 3.3Å; L58-Q60 PolarHBondContact O-N 2.76Å
61F81Confident70.1Confident141 Ų141118.8 Ų118.862%0.61864%0.639SS**THydrogen-bonded Turntrans-100.116.7179.9-67.2-69.5000113.7K57 L58 A59 L63K57-F61 WeakPolarHBondContact O-CD2 3.45Å; K57-F61 PolarHBondContact O-N 2.77Å; L58-F61 PolarHBondContact O-N 2.73Å; A59-F61 VanDerWaalsContact C-N 3.31Å; F61-L63 HydrophobicContact CB-CD1 4.2Å; F61-L63 HydrophobicContact CB-CG 4.1Å; F61-L63 PolarHBondContact O-N 2.91Å; F61-L63 VanDerWaalsContact O-N 3.16Å
62N76.2Confident71Confident153 Ų153117.3 Ų117.382%0.81863%0.63SS**THydrogen-bonded Turntrans53.830-176.4-63.9-38.3000114.1L58L58-N62 PolarHBondContact O-N 2.86Å
63L77.2Confident72.3Confident89 Ų89121.5 Ų121.547%0.46663%0.627SS.*  trans-85141.1176.7-63.4174.1000110.2L58 F61 T65L58-L63 HydrophobicContact CB-CB 4.22Å; L58-L63 HydrophobicContact CD2-CB 4.16Å; L58-L63 HydrophobicContact CD2-CD1 3.69Å; L58-L63 PolarHBondContact O-N 3.4Å; F61-L63 HydrophobicContact CB-CD1 4.2Å; F61-L63 HydrophobicContact CB-CG 4.1Å; F61-L63 PolarHBondContact O-N 2.91Å; F61-L63 VanDerWaalsContact O-N 3.16Å; L63-T65 PolarHBondContact O-N 3.28Å
64P70.1Confident73.2Confident111 Ų111125.9 Ų125.972%0.72165%0.647SS**  trans-60.5124.3178.822.6-31.1000110.7T66P64-T66 PolarHBondContact O-N 3.34Å
65T67.2Low74Confident92 Ų92122.5 Ų122.556%0.56464%0.637SS**  trans-91.584.2-178.556.20000110.4L58 A59 L63L58-T65 HydrophobicContact CB-CG2 4.07Å; A59-T65 HydrophobicContact CB-CG2 4.43Å; L63-T65 PolarHBondContact O-N 3.28Å
66T74.4Confident74.6Confident101 Ų101124.3 Ų124.362%0.6264%0.642SS**  trans-77152.6160.154.40000109.8P64 L68P64-T66 PolarHBondContact O-N 3.34Å; T66-L68 PolarHBondContact O-N 3.47Å
67P72.1Confident75Confident117 Ų117126.7 Ų126.776%0.7665%0.65SS**  trans-58.2113.4176.8-2131.6000110.9T69P67-T69 PolarHBondContact O-N 3.24Å
68L72.5Confident75Confident99 Ų99124.4 Ų124.452%0.51865%0.645SS.*  trans-74.9108.5175-67.7175.2000109.1L58 T66 T72L58-L68 HydrophobicContact CD1-CD1 3.83Å; L58-L68 HydrophobicContact CD1-CD2 4.49Å; L58-L68 HydrophobicContact CD1-CG 4.27Å; T66-L68 PolarHBondContact O-N 3.47Å; L68-T72 WeakPolarHBondContact CD2-O 3.49Å
69T75.8Confident75Confident77 Ų77128.9 Ų128.947%0.47267%0.669SS.*  trans-88.2162.8165.161.70000109.7P67 R71 T72 R73P67-T69 PolarHBondContact O-N 3.24Å; T69-R71 PolarHBondContact O-N 2.65Å; T69-T72 PolarHBondContact N-OG1 3.03Å; T69-T72 PolarHBondContact O-N 2.78Å; T69-T72 PolarHBondContact O-OG1 3.33Å; T69-T72 PolarHBondContact OG1-OG1 3.32Å; T69-R73 PolarHBondContact O-N 2.9Å; T69-R73 VanDerWaalsContact O-N 3.12Å
70S76.5Confident75.1Confident126 Ų126134.3 Ų134.388%0.88169%0.688SS**THydrogen-bonded Turntrans-53-26.2175.8-54.70000113.2
71R78.3Confident74.8Confident237 Ų237134.5 Ų134.589%0.89469%0.693SS**THydrogen-bonded Turntrans-79.6-25.4178.2-154.4178.8-149.6178.86.3114.2T69T69-R71 PolarHBondContact O-N 2.65Å
72T75.7Confident74.3Confident74 Ų74134 Ų13445%0.45470%0.698SS.*THydrogen-bonded Turntrans-110.93.9-17451.10000113.1L68 T69L68-T72 WeakPolarHBondContact CD2-O 3.49Å; T69-T72 PolarHBondContact N-OG1 3.03Å; T69-T72 PolarHBondContact O-N 2.78Å; T69-T72 PolarHBondContact O-OG1 3.33Å; T69-T72 PolarHBondContact OG1-OG1 3.32Å
73R75.7Confident74.1Confident205 Ų205132.4 Ų132.477%0.77469%0.688SS**  trans-81.4-19.7178.7-175.2172.8176.5-100.5-0.6114T69T69-R73 PolarHBondContact O-N 2.9Å; T69-R73 VanDerWaalsContact O-N 3.12Å
74K74.2Confident73.9Confident261 Ų261136.4 Ų136.4100%1.13571%0.708SS**  trans-79.70174.6-176.7-178.5-179.3-176.90109.6

Retrieved 74 of 74 residues in 266.8 ms (Link to these results)