G4VG85_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession G4VG85, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 67 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
1M91.4Very high93.9Very high169 Ų16985.7 Ų85.783%0.83348%0.476SS*.  0145.60179.3-175.7-74.200108.4S11 L12M1-S11 CarbonylContact O-C 3.48Å; M1-S11 WeakPolarHBondContact O-CA 3.3Å; M1-L12 HydrophobicContact CB-CB 4.24Å; M1-L12 PolarHBondContact N-O 3.49Å; M1-L12 PolarHBondContact O-N 2.93Å
2Y93.6Very high94.1Very high141 Ų14183.1 Ų83.155%0.55346%0.46SS*.EExtended strand (participates in β ladder)trans-142.3135.7177178.2-91000110N9 I10Y2-N9 HydrophobicContact CE2-CB 4.03Å; Y2-N9 PolarHBondContact OH-OD1 2.98Å; Y2-I10 CarbonylContact C-O 3.55Å; Y2-I10 WeakPolarHBondContact CA-O 3.46Å
3V94.4Very high94.2Very high61 Ų6181.9 Ų81.937%0.3745%0.453SS..EExtended strand (participates in β ladder)trans-140.9139.4175.2-171.60000107.8L5 I10V3-L5 HydrophobicContact CG1-CD1 4.33Å; V3-L5 HydrophobicContact CG1-CD2 3.93Å; V3-L5 HydrophobicContact CG1-CG 3.83Å; V3-I10 PolarHBondContact N-O 3.27Å; V3-I10 PolarHBondContact O-N 3.49Å; V3-I10 VanDerWaalsContact O-O 3.11Å
4S93Very high94.2Very high66 Ų6683.8 Ų83.846%0.46247%0.474SS..EExtended strand (participates in β ladder)trans-113.9125.3169.4-167.90000108.5V8 N9S4-V8 WeakPolarHBondContact CA-O 3.33Å; S4-N9 PolarHBondContact OG-OD1 3.27Å
5L90.6Very high94.2Very high97 Ų9785.6 Ų85.651%0.50848%0.482SS..EExtended strand (participates in β ladder)trans-132.2120.4-179.8-61.7176.4000108.7V3 G7 V8 I10V3-L5 HydrophobicContact CG1-CD1 4.33Å; V3-L5 HydrophobicContact CG1-CD2 3.93Å; V3-L5 HydrophobicContact CG1-CG 3.83Å; L5-G7 VanDerWaalsContact C-N 3.26Å; L5-G7 PolarHBondContact O-N 2.73Å; L5-G7 VanDerWaalsContact O-N 3.08Å; L5-V8 PolarHBondContact N-O 3.13Å; L5-V8 WeakPolarHBondContact O-CA 3.47Å; L5-V8 WeakPolarHBondContact O-CB 3.33Å; L5-V8 PolarHBondContact O-N 3.41Å; L5-I10 HydrophobicContact CD1-CD1 4.07Å
6D91.2Very high94.2Very high177 Ų17786.8 Ų86.895%0.94748%0.482SS*.THydrogen-bonded Turntrans47.143.9170.7-60.9-22.8000115V8D6-V8 VanDerWaalsContact C-N 3.3Å; D6-V8 PolarHBondContact O-N 3.37Å
7G91.5Very high94.4Very high49 Ų4985 Ų8551%0.50547%0.471SS..THydrogen-bonded Turntrans77.812.3-179.800000114.9L5L5-G7 VanDerWaalsContact C-N 3.26Å; L5-G7 PolarHBondContact O-N 2.73Å; L5-G7 VanDerWaalsContact O-N 3.08Å
8V95.5Very high94.6Very high44 Ų4482.4 Ų82.427%0.26746%0.456SS..EExtended strand (participates in β ladder)trans-111.5118.2170.5-168.80000109.5S4 L5 D6 I10 M20 E21 N22S4-V8 WeakPolarHBondContact CA-O 3.33Å; L5-V8 PolarHBondContact N-O 3.13Å; L5-V8 WeakPolarHBondContact O-CA 3.47Å; L5-V8 WeakPolarHBondContact O-CB 3.33Å; L5-V8 PolarHBondContact O-N 3.41Å; D6-V8 VanDerWaalsContact C-N 3.3Å; D6-V8 PolarHBondContact O-N 3.37Å; V8-I10 HydrophobicContact CG1-CG1 4.05Å; V8-M20 HydrophobicContact CG1-CB 4.38Å; V8-E21 CarbonylContact C-O 3.55Å; V8-E21 WeakPolarHBondContact CA-O 3.5Å; V8-N22 HydrophobicContact CG2-CB 4.07Å
9N96.7Very high94.7Very high54 Ų5479.6 Ų79.629%0.28944%0.442SS..EExtended strand (participates in β ladder)trans-87.7118.4171.4-64.6-25.5000109.1Y2 S4 M20 E21Y2-N9 HydrophobicContact CE2-CB 4.03Å; Y2-N9 PolarHBondContact OH-OD1 2.98Å; S4-N9 PolarHBondContact OG-OD1 3.27Å; N9-M20 CarbonylContact O-C 3.59Å; N9-M20 WeakPolarHBondContact O-CA 3.17Å; N9-E21 HydrophobicContact CB-CB 4.45Å; N9-E21 PolarHBondContact N-O 2.69Å; N9-E21 PolarHBondContact O-N 3.23Å
10I97.5Very high94.9Very high46 Ų4678.6 Ų78.624%0.23643%0.434CS..EExtended strand (participates in β ladder)trans-112.2120.5-179.8-54.7173.2000107.6Y2 V3 L5 V8 L18 T19 M20Y2-I10 CarbonylContact C-O 3.55Å; Y2-I10 WeakPolarHBondContact CA-O 3.46Å; V3-I10 PolarHBondContact N-O 3.27Å; V3-I10 PolarHBondContact O-N 3.49Å; V3-I10 VanDerWaalsContact O-O 3.11Å; L5-I10 HydrophobicContact CD1-CD1 4.07Å; V8-I10 HydrophobicContact CG1-CG1 4.05Å; I10-L18 HydrophobicContact CG2-CD1 3.72Å; I10-T19 CarbonylContact C-O 3.52Å; I10-T19 WeakPolarHBondContact CA-O 3.35Å; I10-M20 HydrophobicContact CG1-CG 4.24Å; I10-M20 HydrophobicContact CG2-CG 4.26Å
11S97.4Very high95Very high39 Ų3978.9 Ų78.927%0.27343%0.432SS..EExtended strand (participates in β ladder)trans-131144178.966.30000111.3M1 L18 T19M1-S11 CarbonylContact O-C 3.48Å; M1-S11 WeakPolarHBondContact O-CA 3.3Å; S11-L18 CarbonylContact O-C 3.56Å; S11-L18 WeakPolarHBondContact O-CA 3.43Å; S11-T19 PolarHBondContact N-O 3.11Å; S11-T19 PolarHBondContact O-N 2.85Å
12L96.6Very high95.1Very high54 Ų5474 Ų7428%0.28341%0.409SS..EExtended strand (participates in β ladder)trans-121.6118.9171.4178.564.2000107.9M1 L18 L31M1-L12 HydrophobicContact CB-CB 4.24Å; M1-L12 PolarHBondContact N-O 3.49Å; M1-L12 PolarHBondContact O-N 2.93Å; L12-L18 HydrophobicContact CD1-CB 4.43Å; L12-L31 HydrophobicContact CD1-CD1 3.84Å
13N94.7Very high94.9Very high68 Ų6876.3 Ų76.336%0.36442%0.417SS..  trans-89.2175.3179.77515.1000112.4N15 H16 I17N13-N15 PolarHBondContact O-N 2.99Å; N13-N15 WeakPolarHBondContact OD1-CA 3.11Å; N13-N15 WeakPolarHBondContact OD1-CB 3.24Å; N13-N15 PolarHBondContact OD1-N 3.25Å; N13-H16 PolarHBondContact O-N 3.42Å; N13-H16 VanDerWaalsContact O-N 3.13Å; N13-H16 PolarHBondContact OD1-N 2.93Å; N13-I17 PolarHBondContact N-O 3.42Å; N13-I17 VanDerWaalsContact N-O 3.14Å; N13-I17 PolarHBondContact OD1-N 2.97Å
14S94.6Very high94.8Very high108 Ų10878 Ų7876%0.75542%0.421SS*.THydrogen-bonded Turntrans-64.7-18.5179.755.80000114.1H16S14-H16 PolarHBondContact O-N 3.28Å
15N94Very high95Very high111 Ų11176.3 Ų76.359%0.59441%0.408SS*.THydrogen-bonded Turntrans-90.412178.2-61.5-14000111.9N13 I17N13-N15 PolarHBondContact O-N 2.99Å; N13-N15 WeakPolarHBondContact OD1-CA 3.11Å; N13-N15 WeakPolarHBondContact OD1-CB 3.24Å; N13-N15 PolarHBondContact OD1-N 3.25Å; N15-I17 HydrophobicContact CB-CG1 4.34Å; N15-I17 PolarHBondContact O-N 3.43Å
16H94.5Very high95.3Very high104 Ų10473.8 Ų73.848%0.48140%0.397SS..  trans60.527.6-176.1-52.885.8000113.2N13 S14 L31N13-H16 PolarHBondContact O-N 3.42Å; N13-H16 VanDerWaalsContact O-N 3.13Å; N13-H16 PolarHBondContact OD1-N 2.93Å; S14-H16 PolarHBondContact O-N 3.28Å; H16-L31 HydrophobicContact CB-CB 4.25Å; H16-L31 WeakPolarHBondContact O-CA 3.31Å; H16-L31 VanDerWaalsContact O-CB 3.24Å; H16-L31 WeakPolarHBondContact O-CB 3.3Å; H16-L31 PolarHBondContact O-N 2.05Å
17I97.4Very high95.6Very high57 Ų5767 Ų6729%0.29236%0.362SS..EExtended strand (participates in β ladder)trans-91.2119.5171.9-55.9180000108.3N13 N15N13-I17 PolarHBondContact N-O 3.42Å; N13-I17 VanDerWaalsContact N-O 3.14Å; N13-I17 PolarHBondContact OD1-N 2.97Å; N15-I17 HydrophobicContact CB-CG1 4.34Å; N15-I17 PolarHBondContact O-N 3.43Å
18L97.5Very high95.9Very high38 Ų3866.4 Ų66.420%0.19935%0.349CS..EExtended strand (participates in β ladder)trans-84.4121170-177.870.2000108.6I10 S11 L12 M20 T28 I29 L31I10-L18 HydrophobicContact CG2-CD1 3.72Å; S11-L18 CarbonylContact O-C 3.56Å; S11-L18 WeakPolarHBondContact O-CA 3.43Å; L12-L18 HydrophobicContact CD1-CB 4.43Å; L18-M20 HydrophobicContact CD2-SD 4.47Å; L18-M20 HydrophobicContact CG-CG 4.42Å; L18-T28 CarbonylContact O-C 3.53Å; L18-T28 VanDerWaalsContact O-CA 3.3Å; L18-T28 WeakPolarHBondContact O-CA 3.34Å; L18-I29 PolarHBondContact N-O 2.93Å; L18-I29 PolarHBondContact O-N 3.42Å; L18-L31 HydrophobicContact CB-CD1 3.95Å; L18-L31 HydrophobicContact CB-CD2 4.42Å; L18-L31 HydrophobicContact CB-CG 4.02Å
19T97.9Very high96Very high30 Ų3067 Ų6718%0.18435%0.35CS..EExtended strand (participates in β ladder)trans-112126.2173.6-57.80000109.1I10 S11 T26 T27 T28I10-T19 CarbonylContact C-O 3.52Å; I10-T19 WeakPolarHBondContact CA-O 3.35Å; S11-T19 PolarHBondContact N-O 3.11Å; S11-T19 PolarHBondContact O-N 2.85Å; T19-T26 HydrophobicContact CG2-CG2 3.75Å; T19-T27 CarbonylContact C-O 3.43Å; T19-T27 VanDerWaalsContact CA-O 3.31Å; T19-T27 WeakPolarHBondContact CA-O 3.29Å; T19-T28 HydrophobicContact CG2-CG2 4.28Å
20M97.5Very high96Very high59 Ų5965.7 Ų65.729%0.29135%0.345SS..EExtended strand (participates in β ladder)trans-117116172.4-60.2176.6-69.600108.2V8 N9 I10 L18 T27 I29V8-M20 HydrophobicContact CG1-CB 4.38Å; N9-M20 CarbonylContact O-C 3.59Å; N9-M20 WeakPolarHBondContact O-CA 3.17Å; I10-M20 HydrophobicContact CG1-CG 4.24Å; I10-M20 HydrophobicContact CG2-CG 4.26Å; L18-M20 HydrophobicContact CD2-SD 4.47Å; L18-M20 HydrophobicContact CG-CG 4.42Å; M20-T27 HydrophobicContact CE-CG2 3.87Å; M20-T27 PolarHBondContact N-O 2.93Å; M20-T27 PolarHBondContact O-N 2.83Å; M20-I29 HydrophobicContact CE-CD1 3.99Å
21E96.7Very high95.9Very high85 Ų8567.2 Ų67.240%0.39735%0.353SS..EExtended strand (participates in β ladder)trans-120.9123.7-177.2179.3179-175.100109.6V8 N9 C25 T26V8-E21 CarbonylContact C-O 3.55Å; V8-E21 WeakPolarHBondContact CA-O 3.5Å; N9-E21 HydrophobicContact CB-CB 4.45Å; N9-E21 PolarHBondContact N-O 2.69Å; N9-E21 PolarHBondContact O-N 3.23Å; E21-C25 WeakPolarHBondContact CA-O 3.09Å; E21-T26 HydrophobicContact CB-CG2 4.49Å
22N94.2Very high95.6Very high65 Ų6569.3 Ų69.335%0.34837%0.365SS..  trans-113.6-175.3165.869.630.8000109.5V8 H24 C25V8-N22 HydrophobicContact CG2-CB 4.07Å; N22-H24 PolarHBondContact O-N 3.16Å; N22-H24 WeakPolarHBondContact OD1-CA 3.25Å; N22-H24 PolarHBondContact OD1-N 2.93Å; N22-C25 PolarHBondContact N-O 2.75Å; N22-C25 PolarHBondContact OD1-N 2.73Å; N22-C25 PolarHBondContact OD1-O 2.95Å
23R90.5Very high95.4Very high191 Ų19171.2 Ų71.272%0.72138%0.382SS*.SBendtrans-55.1-24.9179.7-69-171.9179.9-162.6-0114.2R53R23-R53 VanDerWaalsContact O-CD 3.31Å; R23-R53 WeakPolarHBondContact O-CD 3.22Å; R23-R53 PolarHBondContact O-NE 3.11Å; R23-R53 VanDerWaalsContact O-NE 3.16Å
24H92.1Very high95.5Very high97 Ų9771.3 Ų71.345%0.44939%0.386SS..SBendtrans-114.6-31.8-169-56.6-57000113.6N22 C52 R53N22-H24 PolarHBondContact O-N 3.16Å; N22-H24 WeakPolarHBondContact OD1-CA 3.25Å; N22-H24 PolarHBondContact OD1-N 2.93Å; H24-C52 CarbonylContact O-C 3.52Å; H24-C52 VanDerWaalsContact O-CA 3.32Å; H24-C52 WeakPolarHBondContact O-CA 3.25Å; H24-R53 WeakPolarHBondContact O-CB 3.24Å; H24-R53 WeakPolarHBondContact O-CG 3.37Å; H24-R53 PolarHBondContact O-N 3.36Å
25C95.9Very high95.5Very high29 Ų2970.4 Ų70.420%0.19637%0.373CS..EExtended strand (participates in β ladder)trans-139.5142-171.3-58.10000111.4E21 N22 L51 C52E21-C25 WeakPolarHBondContact CA-O 3.09Å; N22-C25 PolarHBondContact N-O 2.75Å; N22-C25 PolarHBondContact OD1-N 2.73Å; N22-C25 PolarHBondContact OD1-O 2.95Å; C25-L51 CarbonylContact C-O 3.56Å; C25-L51 VanDerWaalsContact CA-O 3.29Å; C25-L51 WeakPolarHBondContact CA-O 2.97Å; C25-C52 HydrophobicContact CB-CB 4.12Å; C25-C52 WeakPolarHBondContact CB-SG 3.39Å; C25-C52 WeakPolarHBondContact SG-CB 3.41Å; C25-C52 CovalentContact SG-SG 2.05Å; C25-C52 PolarHBondContact SG-SG 3.1Å
26T97.5Very high95.7Very high45 Ų4573.3 Ų73.328%0.27638%0.383SS..EExtended strand (participates in β ladder)trans-108.6120.5165.3-52.30000107.8T19 E21 T28 L51T19-T26 HydrophobicContact CG2-CG2 3.75Å; E21-T26 HydrophobicContact CB-CG2 4.49Å; T26-T28 HydrophobicContact CG2-CG2 4.49Å; T26-L51 PolarHBondContact N-O 2.84Å; T26-L51 PolarHBondContact O-N 3.22Å
27T97.8Very high95.8Very high33 Ų3374.7 Ų74.720%0.20239%0.39CS..EExtended strand (participates in β ladder)trans-107.8133.9172.7-57.90000108.8T19 M20 I29 T49 V50T19-T27 CarbonylContact C-O 3.43Å; T19-T27 VanDerWaalsContact CA-O 3.31Å; T19-T27 WeakPolarHBondContact CA-O 3.29Å; M20-T27 HydrophobicContact CE-CG2 3.87Å; M20-T27 PolarHBondContact N-O 2.93Å; M20-T27 PolarHBondContact O-N 2.83Å; T27-I29 HydrophobicContact CG2-CD1 4.38Å; T27-I29 HydrophobicContact CG2-CG1 4.21Å; T27-T49 CarbonylContact C-O 3.55Å; T27-T49 VanDerWaalsContact CA-O 3.29Å; T27-T49 WeakPolarHBondContact CA-O 3.07Å; T27-V50 HydrophobicContact CG2-CG2 4.06Å
28T97.8Very high95.8Very high37 Ų3773.4 Ų73.423%0.22738%0.383CS..EExtended strand (participates in β ladder)trans-120.9140171.2710000109.7L18 T19 T26 G48 T49L18-T28 CarbonylContact O-C 3.53Å; L18-T28 VanDerWaalsContact O-CA 3.3Å; L18-T28 WeakPolarHBondContact O-CA 3.34Å; T19-T28 HydrophobicContact CG2-CG2 4.28Å; T26-T28 HydrophobicContact CG2-CG2 4.49Å; T28-G48 CarbonylContact O-C 3.51Å; T28-G48 WeakPolarHBondContact O-CA 3.43Å; T28-T49 PolarHBondContact N-O 2.67Å; T28-T49 PolarHBondContact O-N 3.3Å; T28-T49 PolarHBondContact OG1-N 3.34Å; T28-T49 PolarHBondContact OG1-OG1 3.39Å
29I97.5Very high95.8Very high58 Ų5876.8 Ų76.830%0.29740%0.4SS..EExtended strand (participates in β ladder)trans-137.4129176.3-58.4170.7000107.7L18 M20 T27 L31 R46L18-I29 PolarHBondContact N-O 2.93Å; L18-I29 PolarHBondContact O-N 3.42Å; M20-I29 HydrophobicContact CE-CD1 3.99Å; T27-I29 HydrophobicContact CG2-CD1 4.38Å; T27-I29 HydrophobicContact CG2-CG1 4.21Å; I29-L31 HydrophobicContact CG2-CD2 4.26Å; I29-R46 HydrophobicContact CG2-CB 4.17Å
30S96.2Very high95.8Very high26 Ų2679.1 Ų79.118%0.18242%0.422CS..EExtended strand (participates in β ladder)trans-71.8128169.1-1780000110.6T32 R46 E47S30-T32 PolarHBondContact OG-N 2.79Å; S30-T32 PolarHBondContact OG-OG1 3.29Å; S30-R46 VanDerWaalsContact O-CB 3.25Å; S30-R46 WeakPolarHBondContact O-CB 3.46Å; S30-R46 VanDerWaalsContact O-CD 3.25Å; S30-R46 WeakPolarHBondContact O-CD 3.32Å; S30-R46 VanDerWaalsContact O-CG 3.22Å; S30-R46 WeakPolarHBondContact O-CG 3.36Å; S30-E47 PolarHBondContact N-O 3.4Å
31L94.6Very high95.9Very high77 Ų7779.2 Ų79.240%0.40343%0.426SS..  trans-102.332.3170.7-53.2-175.6000111.2L12 H16 L18 I29 S33L12-L31 HydrophobicContact CD1-CD1 3.84Å; H16-L31 HydrophobicContact CB-CB 4.25Å; H16-L31 WeakPolarHBondContact O-CA 3.31Å; H16-L31 VanDerWaalsContact O-CB 3.24Å; H16-L31 WeakPolarHBondContact O-CB 3.3Å; H16-L31 PolarHBondContact O-N 2.05Å; L18-L31 HydrophobicContact CB-CD1 3.95Å; L18-L31 HydrophobicContact CB-CD2 4.42Å; L18-L31 HydrophobicContact CB-CG 4.02Å; I29-L31 HydrophobicContact CG2-CD2 4.26Å; L31-S33 PolarHBondContact O-N 2.78Å
32T91.7Very high95.8Very high84 Ų8483.9 Ų83.952%0.51545%0.448SS..PPolyproline II helixtrans-51.5135.3172.6-55.60000110.3S30 R46S30-T32 PolarHBondContact OG-N 2.79Å; S30-T32 PolarHBondContact OG-OG1 3.29Å; T32-R46 PolarHBondContact O-NE 3.39Å; T32-R46 PolarHBondContact O-NH2 3.13Å; T32-R46 VanDerWaalsContact O-NH2 3.16Å
33S93.6Very high95.9Very high93 Ų9385 Ų8565%0.6546%0.457SS*.PPolyproline II helixtrans-52.5142.5177-590000111.3L31L31-S33 PolarHBondContact O-N 2.78Å
34P95.2Very high96Very high70 Ų7078 Ų7846%0.45544%0.444SS..PPolyproline II helixtrans-64.9143.9178.229.2-34.9000111.8E38 I39 R46P34-E38 WeakPolarHBondContact CA-OE2 3.39Å; P34-E38 HydrophobicContact CB-CB 3.97Å; P34-I39 HydrophobicContact CB-CG1 3.98Å; P34-I39 HydrophobicContact CG-CD1 4.33Å; P34-I39 HydrophobicContact CG-CG1 3.91Å; P34-R46 VanDerWaalsContact CA-NH2 3.26Å
35N95.3Very high96.1Very high89 Ų8983.5 Ų83.548%0.47646%0.462SS..PPolyproline II helixtrans-81.8170.9171.669.847.4000111.1Q37 E38 I39N35-Q37 VanDerWaalsContact C-N 3.27Å; N35-Q37 PolarHBondContact O-N 2.86Å; N35-Q37 WeakPolarHBondContact OD1-CA 3.39Å; N35-Q37 WeakPolarHBondContact OD1-CB 3.45Å; N35-Q37 PolarHBondContact OD1-N 2.82Å; N35-E38 PolarHBondContact N-OE2 3.31Å; N35-E38 PolarHBondContact O-N 2.83Å; N35-E38 VanDerWaalsContact O-N 3.11Å; N35-E38 PolarHBondContact OD1-N 2.85Å; N35-I39 WeakPolarHBondContact O-CG1 3.29Å; N35-I39 PolarHBondContact O-N 3.13Å
36E97.6Very high96Very high173 Ų17386.2 Ų86.281%0.80847%0.469SS*.Hα-helixtrans-56.9-38.3-177.4-65.4-178.617700113.3I39 A40E36-I39 PolarHBondContact O-N 3.48Å; E36-A40 WeakPolarHBondContact O-CB 3.46Å; E36-A40 PolarHBondContact O-N 2.94Å
37Q97.2Very high95.8Very high132 Ų13292 Ų9262%0.61749%0.493SS*.Hα-helixtrans-65.9-43.9177.6-176.662.936.400111.1N35 I39 A40 T41N35-Q37 VanDerWaalsContact C-N 3.27Å; N35-Q37 PolarHBondContact O-N 2.86Å; N35-Q37 WeakPolarHBondContact OD1-CA 3.39Å; N35-Q37 WeakPolarHBondContact OD1-CB 3.45Å; N35-Q37 PolarHBondContact OD1-N 2.82Å; Q37-I39 VanDerWaalsContact C-N 3.33Å; Q37-I39 PolarHBondContact O-N 2.87Å; Q37-A40 PolarHBondContact O-N 2.77Å; Q37-T41 WeakPolarHBondContact O-CG2 3.32Å; Q37-T41 PolarHBondContact O-N 2.74Å; Q37-T41 PolarHBondContact O-OG1 3.46Å; Q37-T41 VanDerWaalsContact O-OG1 3.13Å
38E97.9Very high95.8Very high31 Ų3192.5 Ų92.515%0.14550%0.504CS..Hα-helixtrans-65.4-37.1178-65.6-175.213500112.2P34 N35 Q42 T43 G44 Y45 R46P34-E38 WeakPolarHBondContact CA-OE2 3.39Å; P34-E38 HydrophobicContact CB-CB 3.97Å; N35-E38 PolarHBondContact N-OE2 3.31Å; N35-E38 PolarHBondContact O-N 2.83Å; N35-E38 VanDerWaalsContact O-N 3.11Å; N35-E38 PolarHBondContact OD1-N 2.85Å; E38-Q42 VanDerWaalsContact O-CA 3.3Å; E38-Q42 WeakPolarHBondContact O-CA 3.44Å; E38-Q42 PolarHBondContact O-N 2.82Å; E38-T43 VanDerWaalsContact CA-O 3.24Å; E38-T43 WeakPolarHBondContact CA-O 3.44Å; E38-T43 WeakPolarHBondContact CB-O 3.43Å; E38-T43 WeakPolarHBondContact CG-O 3.39Å; E38-T43 PolarHBondContact O-N 2.89Å; E38-G44 WeakPolarHBondContact OE1-CA 3.33Å; E38-Y45 PolarHBondContact OE1-N 3.49Å; E38-R46 VanDerWaalsContact CD-NH1 3.26Å; E38-R46 IonicContact OE1-CZ 3.72Å; E38-R46 IonicContact OE1-NH1 2.69Å; E38-R46 PolarHBondContact OE1-NH1 3.14Å; E38-R46 IonicContact OE1-NH2 3.88Å; E38-R46 IonicContact OE2-CZ 3.41Å; E38-R46 IonicContact OE2-NH1 3.11Å; E38-R46 PolarHBondContact OE2-NH1 2.94Å; E38-R46 VanDerWaalsContact OE2-NH1 3.11Å; E38-R46 IonicContact OE2-NH2 2.85Å; E38-R46 PolarHBondContact OE2-NH2 3.31Å
39I97.9Very high95.8Very high109 Ų10994.1 Ų94.156%0.55951%0.514SS*.Hα-helixtrans-64.2-46.1173.9-65.9167.5000109.9P34 N35 E36 Q37 T41 Q42P34-I39 HydrophobicContact CB-CG1 3.98Å; P34-I39 HydrophobicContact CG-CD1 4.33Å; P34-I39 HydrophobicContact CG-CG1 3.91Å; N35-I39 WeakPolarHBondContact O-CG1 3.29Å; N35-I39 PolarHBondContact O-N 3.13Å; E36-I39 PolarHBondContact O-N 3.48Å; Q37-I39 VanDerWaalsContact C-N 3.33Å; Q37-I39 PolarHBondContact O-N 2.87Å; I39-T41 PolarHBondContact O-N 2.82Å; I39-Q42 PolarHBondContact O-N 2.78Å
40A97.9Very high95.8Very high78 Ų7896 Ų9665%0.64553%0.528SS*.Hα-helixtrans-65.4-37.8-177.800000112.9E36 Q37E36-A40 WeakPolarHBondContact O-CB 3.46Å; E36-A40 PolarHBondContact O-N 2.94Å; Q37-A40 PolarHBondContact O-N 2.77Å
41T98Very high95.8Very high62 Ų62100.6 Ų100.638%0.3855%0.55SS..Hα-helixtrans-91.3-10.7179.762.90000113.8Q37 I39 T43Q37-T41 WeakPolarHBondContact O-CG2 3.32Å; Q37-T41 PolarHBondContact O-N 2.74Å; Q37-T41 PolarHBondContact O-OG1 3.46Å; Q37-T41 VanDerWaalsContact O-OG1 3.13Å; I39-T41 PolarHBondContact O-N 2.82Å; T41-T43 WeakPolarHBondContact CB-OG1 3.38Å; T41-T43 PolarHBondContact O-N 3.01Å; T41-T43 PolarHBondContact OG1-N 2.93Å; T41-T43 PolarHBondContact OG1-O 2.81Å; T41-T43 PolarHBondContact OG1-OG1 3.04Å
42Q95.9Very high95.8Very high182 Ų182100.5 Ų100.585%0.8556%0.555SS**THydrogen-bonded Turntrans55.928.9-169.7-55-174.9-17.400113.2E38 I39E38-Q42 VanDerWaalsContact O-CA 3.3Å; E38-Q42 WeakPolarHBondContact O-CA 3.44Å; E38-Q42 PolarHBondContact O-N 2.82Å; I39-Q42 PolarHBondContact O-N 2.78Å
43T95.1Very high95.8Very high89 Ų89102.4 Ų102.455%0.54655%0.552SS.*  trans-135.7143.2179.663.80000109.8E38 T41E38-T43 VanDerWaalsContact CA-O 3.24Å; E38-T43 WeakPolarHBondContact CA-O 3.44Å; E38-T43 WeakPolarHBondContact CB-O 3.43Å; E38-T43 WeakPolarHBondContact CG-O 3.39Å; E38-T43 PolarHBondContact O-N 2.89Å; T41-T43 WeakPolarHBondContact CB-OG1 3.38Å; T41-T43 PolarHBondContact O-N 3.01Å; T41-T43 PolarHBondContact OG1-N 2.93Å; T41-T43 PolarHBondContact OG1-O 2.81Å; T41-T43 PolarHBondContact OG1-OG1 3.04Å
44G93.5Very high95.7Very high43 Ų43101.3 Ų101.344%0.44354%0.544SS..  trans-162.1162.5175.800000111.2E38E38-G44 WeakPolarHBondContact OE1-CA 3.33Å
45Y93.7Very high95.1Very high213 Ų213105 Ų10584%0.83556%0.556SS**  trans-120.1145.8174.2-64.5-84.8000108.8E38E38-Y45 PolarHBondContact OE1-N 3.49Å
46R94.6Very high94.4Very high87 Ų87107.6 Ų107.633%0.32857%0.569SS.*  trans-122.5132.8175.7-65.1-64174.7-89.27.7108.4I29 S30 T32 P34 E38I29-R46 HydrophobicContact CG2-CB 4.17Å; S30-R46 VanDerWaalsContact O-CB 3.25Å; S30-R46 WeakPolarHBondContact O-CB 3.46Å; S30-R46 VanDerWaalsContact O-CD 3.25Å; S30-R46 WeakPolarHBondContact O-CD 3.32Å; S30-R46 VanDerWaalsContact O-CG 3.22Å; S30-R46 WeakPolarHBondContact O-CG 3.36Å; T32-R46 PolarHBondContact O-NE 3.39Å; T32-R46 PolarHBondContact O-NH2 3.13Å; T32-R46 VanDerWaalsContact O-NH2 3.16Å; P34-R46 VanDerWaalsContact CA-NH2 3.26Å; E38-R46 VanDerWaalsContact CD-NH1 3.26Å; E38-R46 IonicContact OE1-CZ 3.72Å; E38-R46 IonicContact OE1-NH1 2.69Å; E38-R46 PolarHBondContact OE1-NH1 3.14Å; E38-R46 IonicContact OE1-NH2 3.88Å; E38-R46 IonicContact OE2-CZ 3.41Å; E38-R46 IonicContact OE2-NH1 3.11Å; E38-R46 PolarHBondContact OE2-NH1 2.94Å; E38-R46 VanDerWaalsContact OE2-NH1 3.11Å; E38-R46 IonicContact OE2-NH2 2.85Å; E38-R46 PolarHBondContact OE2-NH2 3.31Å
47E93.9Very high93.4Very high167 Ų167101.1 Ų101.178%0.7854%0.542SS*.  trans-62.5141.4170.8-70-63.4154.400109.6S30S30-E47 PolarHBondContact N-O 3.4Å
48G96.4Very high92Very high43 Ų4399.6 Ų99.644%0.44353%0.532SS..EExtended strand (participates in β ladder)trans-161.5160.9179.100000111.5T28T28-G48 CarbonylContact O-C 3.51Å; T28-G48 WeakPolarHBondContact O-CA 3.43Å
49T97.7Very high90.5Very high70 Ų70107 Ų10743%0.42956%0.558SS.*EExtended strand (participates in β ladder)trans-129.9148.8176.565.40000110.2T27 T28T27-T49 CarbonylContact C-O 3.55Å; T27-T49 VanDerWaalsContact CA-O 3.29Å; T27-T49 WeakPolarHBondContact CA-O 3.07Å; T28-T49 PolarHBondContact N-O 2.67Å; T28-T49 PolarHBondContact O-N 3.3Å; T28-T49 PolarHBondContact OG1-N 3.34Å; T28-T49 PolarHBondContact OG1-OG1 3.39Å
50V97.5Very high89.1Confident97 Ų97105.2 Ų105.259%0.58856%0.556SS**EExtended strand (participates in β ladder)trans-124.5115.9168.7-179.70000106.9T27T27-V50 HydrophobicContact CG2-CG2 4.06Å
51L96.7Very high87.4Confident123 Ų123105.9 Ų105.964%0.64455%0.546SS*.EExtended strand (participates in β ladder)trans-115.4108.3176.3-65177.5000108.1C25 T26C25-L51 CarbonylContact C-O 3.56Å; C25-L51 VanDerWaalsContact CA-O 3.29Å; C25-L51 WeakPolarHBondContact CA-O 2.97Å; T26-L51 PolarHBondContact N-O 2.84Å; T26-L51 PolarHBondContact O-N 3.22Å
52C95.4Very high85.7Confident75 Ų75106.5 Ų106.551%0.50754%0.544SS..EExtended strand (participates in β ladder)trans-106.3143.4177-66.10000111.2H24 C25H24-C52 CarbonylContact O-C 3.52Å; H24-C52 VanDerWaalsContact O-CA 3.32Å; H24-C52 WeakPolarHBondContact O-CA 3.25Å; C25-C52 HydrophobicContact CB-CB 4.12Å; C25-C52 WeakPolarHBondContact CB-SG 3.39Å; C25-C52 WeakPolarHBondContact SG-CB 3.41Å; C25-C52 CovalentContact SG-SG 2.05Å; C25-C52 PolarHBondContact SG-SG 3.1Å
53R91.3Very high84.4Confident125 Ų125101 Ų10147%0.47253%0.529SS..  trans-58.7137171.8-72.8-173-176.6-140.90110.1R23 H24 S57R23-R53 VanDerWaalsContact O-CD 3.31Å; R23-R53 WeakPolarHBondContact O-CD 3.22Å; R23-R53 PolarHBondContact O-NE 3.11Å; R23-R53 VanDerWaalsContact O-NE 3.16Å; H24-R53 WeakPolarHBondContact O-CB 3.24Å; H24-R53 WeakPolarHBondContact O-CG 3.37Å; H24-R53 PolarHBondContact O-N 3.36Å; R53-S57 WeakPolarHBondContact CB-OG 3.31Å
54S90.9Very high83.2Confident69 Ų69101.9 Ų101.948%0.48354%0.535SS..  trans-75.6155.7174.273.90000110.8L56 S57 Y58S54-L56 PolarHBondContact O-N 3.16Å; S54-L56 VanDerWaalsContact O-N 3.13Å; S54-S57 PolarHBondContact N-OG 3.21Å; S54-S57 PolarHBondContact O-N 2.82Å; S54-S57 PolarHBondContact O-OG 3.46Å; S54-Y58 PolarHBondContact O-N 2.8Å
55Q82.7Confident81.9Confident148 Ų148107 Ų10769%0.69255%0.547SS*.Hα-helixtrans-56.4-28.7175.2-67.8-67.8-20.500113.2Y58 R59Q55-Y58 WeakPolarHBondContact O-CB 3.38Å; Q55-Y58 PolarHBondContact O-N 2.89Å; Q55-R59 PolarHBondContact O-N 3.08Å
56L81.7Confident80.5Confident144 Ų144104.7 Ų104.775%0.75454%0.544SS*.Hα-helixtrans-65.4-41.7176.5-67.2170.3000111.6S54 Y58 R59S54-L56 PolarHBondContact O-N 3.16Å; S54-L56 VanDerWaalsContact O-N 3.13Å; L56-Y58 PolarHBondContact O-N 2.73Å; L56-R59 PolarHBondContact O-N 2.76Å
57S75.5Confident78.7Confident36 Ų36110.6 Ų110.625%0.25258%0.582SS.*Hα-helixtrans-69.7-22176.8680000113.5R53 S54 S60R53-S57 WeakPolarHBondContact CB-OG 3.31Å; S54-S57 PolarHBondContact N-OG 3.21Å; S54-S57 PolarHBondContact O-N 2.82Å; S54-S57 PolarHBondContact O-OG 3.46Å; S57-S60 PolarHBondContact O-OG 3.35Å
58Y68.6Low77.9Confident100 Ų100107.8 Ų107.839%0.39257%0.572SS.*Hα-helixtrans-69.6-47.8176-176.7-102.1000111.4S54 Q55 L56 S60 Q61 Q62S54-Y58 PolarHBondContact O-N 2.8Å; Q55-Y58 WeakPolarHBondContact O-CB 3.38Å; Q55-Y58 PolarHBondContact O-N 2.89Å; L56-Y58 PolarHBondContact O-N 2.73Å; Y58-S60 VanDerWaalsContact C-N 3.31Å; Y58-S60 PolarHBondContact O-N 2.94Å; Y58-Q61 PolarHBondContact O-N 3.41Å; Y58-Q62 HydrophobicContact CD1-CG 4.49Å; Y58-Q62 HydrophobicContact CE1-CG 4.14Å; Y58-Q62 PolarHBondContact O-N 3.29Å; Y58-Q62 PolarHBondContact OH-NE2 3.19Å; Y58-Q62 VanDerWaalsContact OH-NE2 3.1Å
59R66.6Low77Confident187 Ų187111.2 Ų111.271%0.70658%0.579SS**Hα-helixtrans-62.8-35.9-178.8-69.3-174.8178.5-173.2-1.5113.1Q55 L56 Q61 A63Q55-R59 PolarHBondContact O-N 3.08Å; L56-R59 PolarHBondContact O-N 2.76Å; R59-Q61 VanDerWaalsContact C-N 3.29Å; R59-Q61 PolarHBondContact O-N 2.95Å; R59-A63 PolarHBondContact O-N 2.89Å
60S68.1Low75.8Confident71 Ų71113.4 Ų113.450%0.49759%0.587SS.*Hα-helixtrans-67.8-26.1178.852.80000113.7S57 Y58 V64S57-S60 PolarHBondContact O-OG 3.35Å; Y58-S60 VanDerWaalsContact C-N 3.31Å; Y58-S60 PolarHBondContact O-N 2.94Å; S60-V64 VanDerWaalsContact O-CG2 3.32Å; S60-V64 WeakPolarHBondContact O-CG2 3.32Å
61Q61.2Low74.5Confident93 Ų93114.4 Ų114.444%0.43559%0.587SS.*Hα-helixtrans-85-38.7177.7-70-167-4100112.4Y58 R59 A63 V64 E65Y58-Q61 PolarHBondContact O-N 3.41Å; R59-Q61 VanDerWaalsContact C-N 3.29Å; R59-Q61 PolarHBondContact O-N 2.95Å; Q61-A63 VanDerWaalsContact C-N 3.26Å; Q61-A63 PolarHBondContact O-N 3.1Å; Q61-V64 PolarHBondContact O-N 3.19Å; Q61-E65 PolarHBondContact O-N 3.24Å
62Q62.6Low73.1Confident75 Ų75113.9 Ų113.935%0.3558%0.583SS.*Hα-helixtrans-59.3-40.6173.8-67.2-172.4-55.900111.4Y58 V64 E65 E66Y58-Q62 HydrophobicContact CD1-CG 4.49Å; Y58-Q62 HydrophobicContact CE1-CG 4.14Å; Y58-Q62 PolarHBondContact O-N 3.29Å; Y58-Q62 PolarHBondContact OH-NE2 3.19Å; Y58-Q62 VanDerWaalsContact OH-NE2 3.1Å; Q62-V64 PolarHBondContact O-N 3Å; Q62-E65 PolarHBondContact O-N 3.01Å; Q62-E66 WeakPolarHBondContact O-CG 3.41Å; Q62-E66 PolarHBondContact O-N 3.37Å; Q62-E66 VanDerWaalsContact O-N 3.1Å
63A69Low71.7Confident65 Ų65116.5 Ų116.554%0.53759%0.588SS.*Hα-helixtrans-64.5-21.4175.500000114.1R59 Q61R59-A63 PolarHBondContact O-N 2.89Å; Q61-A63 VanDerWaalsContact C-N 3.26Å; Q61-A63 PolarHBondContact O-N 3.1Å
64V70.5Confident70.3Confident109 Ų109115.9 Ų115.966%0.66160%0.597SS**Hα-helixtrans-90.9-25.6175.9174.50000111.5S60 Q61 Q62S60-V64 VanDerWaalsContact O-CG2 3.32Å; S60-V64 WeakPolarHBondContact O-CG2 3.32Å; Q61-V64 PolarHBondContact O-N 3.19Å; Q62-V64 PolarHBondContact O-N 3Å
65E65.5Low68.7Low149 Ų149119.5 Ų119.570%0.69661%0.605SS**Hα-helixtrans-82.2-17.1175.8-71.6179.6174.300113Q61 Q62Q61-E65 PolarHBondContact O-N 3.24Å; Q62-E65 PolarHBondContact O-N 3.01Å
66E65.1Low67.5Low166 Ų166117.1 Ų117.178%0.77660%0.598SS**  trans-91.9-3.9-179.5-73.7179.1179.200115Q62Q62-E66 WeakPolarHBondContact O-CG 3.41Å; Q62-E66 PolarHBondContact O-N 3.37Å; Q62-E66 VanDerWaalsContact O-N 3.1Å
67D55.7Low66.2Low210 Ų210114.6 Ų114.6100%1.12358%0.584SS**  trans-1130-180-147.728.1000111.2

Retrieved 67 of 67 residues in 14.7 ms (Link to these results)