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- PDB-3u41: Crystal structure of Escherichia coli DmsD in space group P212121 -

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Basic information

Entry
Database: PDB / ID: 3u41
TitleCrystal structure of Escherichia coli DmsD in space group P212121
ComponentsTwin-arginine leader-binding protein dmsD
KeywordsCHAPERONE / TorD-like DmsD / Chaperone Translocation TorD-like TAT / preDmsA / Cytosol
Function / homology
Function and homology information


signal sequence binding / chaperone-mediated protein folding / plasma membrane / cytoplasm
Similarity search - Function
Tat proofreading chaperone DmsD-type / Tat proofreading chaperone DmsD / TorD-like / TorD-like / DMSO/Nitrate reductase chaperone / TorD-like superfamily / Nitrate reductase delta subunit / Orthogonal Bundle / Mainly Alpha
Similarity search - Domain/homology
DI(HYDROXYETHYL)ETHER / Tat proofreading chaperone DmsD
Similarity search - Component
Biological speciesEscherichia coli (E. coli)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.5 Å
AuthorsStevens, C.M. / Paetzel, M.
History
DepositionOct 6, 2011Deposition site: RCSB / Processing site: RCSB
Revision 1.0Feb 6, 2013Provider: repository / Type: Initial release
Revision 1.1Nov 8, 2017Group: Refinement description / Category: software
Item: _software.classification / _software.contact_author ..._software.classification / _software.contact_author / _software.contact_author_email / _software.date / _software.language / _software.location / _software.name / _software.type / _software.version
Revision 1.2Sep 13, 2023Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Refinement description
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model / struct_ref_seq_dif / struct_site
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _struct_ref_seq_dif.details / _struct_site.pdbx_auth_asym_id / _struct_site.pdbx_auth_comp_id / _struct_site.pdbx_auth_seq_id

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: Twin-arginine leader-binding protein dmsD
B: Twin-arginine leader-binding protein dmsD
C: Twin-arginine leader-binding protein dmsD
D: Twin-arginine leader-binding protein dmsD
E: Twin-arginine leader-binding protein dmsD
F: Twin-arginine leader-binding protein dmsD
G: Twin-arginine leader-binding protein dmsD
H: Twin-arginine leader-binding protein dmsD
hetero molecules


Theoretical massNumber of molelcules
Total (without water)193,58757
Polymers189,1668
Non-polymers4,42149
Water8,251458
1
A: Twin-arginine leader-binding protein dmsD
hetero molecules


Theoretical massNumber of molelcules
Total (without water)24,2948
Polymers23,6461
Non-polymers6497
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
MethodPISA
2
B: Twin-arginine leader-binding protein dmsD
hetero molecules


Theoretical massNumber of molelcules
Total (without water)24,2287
Polymers23,6461
Non-polymers5836
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
MethodPISA
3
C: Twin-arginine leader-binding protein dmsD
hetero molecules


Theoretical massNumber of molelcules
Total (without water)24,54011
Polymers23,6461
Non-polymers89410
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
MethodPISA
4
D: Twin-arginine leader-binding protein dmsD
hetero molecules


Theoretical massNumber of molelcules
Total (without water)24,58111
Polymers23,6461
Non-polymers93510
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
MethodPISA
5
E: Twin-arginine leader-binding protein dmsD
hetero molecules


Theoretical massNumber of molelcules
Total (without water)24,3839
Polymers23,6461
Non-polymers7378
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
MethodPISA
6
F: Twin-arginine leader-binding protein dmsD
hetero molecules


Theoretical massNumber of molelcules
Total (without water)24,1778
Polymers23,6461
Non-polymers5317
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
MethodPISA
7
G: Twin-arginine leader-binding protein dmsD


Theoretical massNumber of molelcules
Total (without water)23,6461
Polymers23,6461
Non-polymers00
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
MethodPISA
8
H: Twin-arginine leader-binding protein dmsD
hetero molecules


Theoretical massNumber of molelcules
Total (without water)23,7382
Polymers23,6461
Non-polymers921
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
MethodPISA
Unit cell
Length a, b, c (Å)94.275, 96.221, 210.243
Angle α, β, γ (deg.)90.00, 90.00, 90.00
Int Tables number19
Space group name H-MP212121

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Components

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Protein , 1 types, 8 molecules ABCDEFGH

#1: Protein
Twin-arginine leader-binding protein dmsD


Mass: 23645.797 Da / Num. of mol.: 8
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Escherichia coli (E. coli) / Strain: K12 / Gene: b1591, dmsD, JW5262, ynfI / Plasmid: pET-15b / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3) / References: UniProt: P69853

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Non-polymers , 6 types, 507 molecules

#2: Chemical...
ChemComp-GOL / GLYCEROL / GLYCERIN / PROPANE-1,2,3-TRIOL / Glycerol


Mass: 92.094 Da / Num. of mol.: 42 / Source method: obtained synthetically / Formula: C3H8O3
#3: Chemical ChemComp-SO4 / SULFATE ION / Sulfate


Mass: 96.063 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: SO4
#4: Chemical ChemComp-TRS / 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL / TRIS BUFFER / Tris


Mass: 122.143 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: C4H12NO3 / Comment: pH buffer*YM
#5: Chemical ChemComp-CL / CHLORIDE ION / Chloride


Mass: 35.453 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: Cl
#6: Chemical ChemComp-PEG / DI(HYDROXYETHYL)ETHER / Diethylene glycol


Mass: 106.120 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: C4H10O3
#7: Water ChemComp-HOH / water / Water


Mass: 18.015 Da / Num. of mol.: 458 / Source method: isolated from a natural source / Formula: H2O

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Experimental details

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Experiment

ExperimentMethod: X-RAY DIFFRACTION / Number of used crystals: 1

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Sample preparation

CrystalDensity Matthews: 2.5 Å3/Da / Density % sol: 50.82 %
Crystal growTemperature: 294 K / Method: vapor diffusion, hanging drop / pH: 6.5
Details: 1.25M Ammonium Sulfate, 11% (v/v) Glycerol, 0.1M Bis-Tris pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 294K

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Data collection

DiffractionMean temperature: 100 K
Diffraction sourceSource: SYNCHROTRON / Site: CLSI / Beamline: 08B1-1 / Wavelength: 1.105 Å
DetectorType: RAYONIX MX300HE / Detector: CCD / Date: May 26, 2011
Details: DCM with cryo-cooled 1st crystal sagittally bent 2nd crystal followed by vertically focusing mirror.
RadiationMonochromator: double crystal monochromator (DCM) / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 1.105 Å / Relative weight: 1
ReflectionResolution: 2.12→50 Å / Num. obs: 63206 / % possible obs: 98.4 % / Observed criterion σ(F): 2 / Observed criterion σ(I): -3 / Redundancy: 8.6 % / Rmerge(I) obs: 0.109 / Net I/σ(I): 12.4
Reflection shell
Resolution (Å)Redundancy (%)Rmerge(I) obsDiffraction-ID% possible all
2.12-2.25.20.981194.4
2.2-2.287.60.889198.5
2.28-2.398.50.642198.4
2.39-2.518.70.489198.3
2.51-2.678.60.354198.1
2.67-2.888.60.256198.1
2.88-3.178.60.176199.1
3.17-3.6290.115199.8
3.62-4.579.80.087199.6
4.57-5010.50.069199.6

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Processing

Software
NameVersionClassificationNB
DENZOdata reduction
SCALEPACKdata scaling
REFMACrefinement
PDB_EXTRACT3.1data extraction
MxDCdata collection
HKL-2000data reduction
PHASESphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: 3EFP(a)
Resolution: 2.5→48.6 Å / Cor.coef. Fo:Fc: 0.922 / Cor.coef. Fo:Fc free: 0.892 / Occupancy max: 1 / Occupancy min: 0.38 / SU B: 19.273 / SU ML: 0.246 / SU R Cruickshank DPI: 0.8727 / Cross valid method: THROUGHOUT / ESU R: 1.084 / ESU R Free: 0.338 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS
RfactorNum. reflection% reflectionSelection details
Rfree0.27068 3180 5 %RANDOM
Rwork0.2298 ---
obs0.23189 59979 94.1 %-
all-107698 --
Solvent computationIon probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK
Displacement parametersBiso mean: 49.563 Å2
Baniso -1Baniso -2Baniso -3
1-4.01 Å2-0 Å20 Å2
2---1.38 Å2-0 Å2
3----2.63 Å2
Refinement stepCycle: LAST / Resolution: 2.5→48.6 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms13167 0 282 458 13907
Refine LS restraints
Refine-IDTypeDev idealDev ideal targetNumber
X-RAY DIFFRACTIONr_bond_refined_d0.0050.01913887
X-RAY DIFFRACTIONr_bond_other_d0.0010.0212825
X-RAY DIFFRACTIONr_angle_refined_deg0.9031.94618924
X-RAY DIFFRACTIONr_angle_other_deg0.71329442
X-RAY DIFFRACTIONr_dihedral_angle_1_deg4.44251632
X-RAY DIFFRACTIONr_dihedral_angle_2_deg29.67123.754658
X-RAY DIFFRACTIONr_dihedral_angle_3_deg13.168152063
X-RAY DIFFRACTIONr_dihedral_angle_4_deg14.8161578
X-RAY DIFFRACTIONr_chiral_restr0.0480.22021
X-RAY DIFFRACTIONr_gen_planes_refined0.0030.02115524
X-RAY DIFFRACTIONr_gen_planes_other0.0010.023398
X-RAY DIFFRACTIONr_nbd_refined
X-RAY DIFFRACTIONr_nbd_other
X-RAY DIFFRACTIONr_nbtor_refined
X-RAY DIFFRACTIONr_nbtor_other
X-RAY DIFFRACTIONr_xyhbond_nbd_refined
X-RAY DIFFRACTIONr_xyhbond_nbd_other
X-RAY DIFFRACTIONr_metal_ion_refined
X-RAY DIFFRACTIONr_metal_ion_other
X-RAY DIFFRACTIONr_symmetry_vdw_refined
X-RAY DIFFRACTIONr_symmetry_vdw_other
X-RAY DIFFRACTIONr_symmetry_hbond_refined
X-RAY DIFFRACTIONr_symmetry_hbond_other
X-RAY DIFFRACTIONr_symmetry_metal_ion_refined
X-RAY DIFFRACTIONr_symmetry_metal_ion_other
X-RAY DIFFRACTIONr_mcbond_it0.1221.58212
X-RAY DIFFRACTIONr_mcbond_other
X-RAY DIFFRACTIONr_mcangle_it0.236213184
X-RAY DIFFRACTIONr_scbond_it0.36635690
X-RAY DIFFRACTIONr_scangle_it0.6114.55753
X-RAY DIFFRACTIONr_rigid_bond_restr
X-RAY DIFFRACTIONr_sphericity_free
X-RAY DIFFRACTIONr_sphericity_bonded
LS refinement shellResolution: 2.498→2.563 Å / Total num. of bins used: 20
RfactorNum. reflection% reflection
Rfree0.358 217 -
Rwork0.288 4406 -
obs--95.05 %
Refinement TLS params.

Method: refined / Refine-ID: X-RAY DIFFRACTION

IDL112)L122)L132)L222)L232)L332)S11 (Å °)S12 (Å °)S13 (Å °)S21 (Å °)S22 (Å °)S23 (Å °)S31 (Å °)S32 (Å °)S33 (Å °)T112)T122)T132)T222)T232)T332)Origin x (Å)Origin y (Å)Origin z (Å)
123.44536.03819.27332.9844-3.027725.23090.3861-1.27280.72040.5408-0.23540.1128-1.2849-1.1009-0.15070.4006-0.039-0.04310.3765-0.02850.630325.452535.648150.2705
20.7480.3302-0.78230.60450.90485.11460.0531-0.0171-0.0565-0.1453-0.12090.0693-0.1902-0.13390.06790.2841-0.0437-0.00630.4105-0.01760.572527.507223.912437.7409
34.62720.52561.846615.4399-4.27238.22820.01040.2646-0.22110.2456-0.09670.2233-0.3874-0.13950.08630.3328-0.05810.04760.4414-0.05020.431824.389720.273526.6117
42.0002-0.5935.54413.69162.746416.826-0.1008-0.098-0.04080.02020.14220.1881-0.3838-0.2897-0.04130.3768-0.0120.09620.36370.0380.437424.676434.143631.1463
519.9011-8.53343.97953.6694-1.72370.83270.08470.3731-0.16480.0268-0.08640.0916-0.1165-0.01320.00170.67050.08050.00740.51520.03090.489829.764134.125224.0311
65.9103-1.23773.66040.6831-1.99715.9583-0.15980.2806-0.2409-0.12230.1594-0.03730.1421-0.43380.00040.471-0.11110.0980.4887-0.12340.570136.360516.826121.0143
72.5704-0.41050.0910.44891.5726.63480.03970.3071-0.0135-0.0026-0.0220.04020.04260.1628-0.01780.3132-0.08380.02780.3931-0.01480.512844.516613.861833.337
83.88348.67841.33219.47913.935611.5240.2695-0.0022-0.52820.60360.068-1.1796-0.23370.824-0.33750.1816-0.01530.05510.4210.01550.605651.518518.858843.9967
917.5583-0.4919-6.07225.12433.31227.75470.0018-0.1640.2980.10450.4043-0.596-0.15870.4215-0.40610.2857-0.0369-0.00020.4454-0.00190.403746.46313.748347.5576
109.70733.5934-1.49541.37670.02748.95170.1848-0.0884-0.32190.0789-0.076-0.15120.25410.1977-0.10870.2612-0.01640.06010.3756-0.05940.552738.133417.156354.1702
1117.4756-1.99735.711116.2196-6.563236.37220.0910.1953-0.18870.66060.1369-0.4059-0.07270.8346-0.22790.28170.0010.02150.44240.03550.430933.2517.213558.2109
1224.7335-16.4049-15.287431.504113.449315.1213-0.6668-0.8125-1.53651.4769-0.08780.06691.17911.12290.75460.3324-0.07910.00280.40820.08060.60229.945211.726947.8105
1314.183914.08819.969838.038524.693816.10750.407-0.026-0.88510.123-0.68490.56910.0995-0.410.2780.3452-0.00890.00990.4760.01630.448637.32548.318944.4003
149.7665-3.5205-4.98172.24013.01924.0835-0.1599-0.0443-0.0791-0.00320.07610.07810.00160.08810.08390.3015-0.02020.05550.3885-0.00390.499331.727320.335844.1201
1517.63537.92093.93739.30342.93794.70090.2898-0.599-0.10150.1207-0.23240.07140.29260.0988-0.05750.28890.0040.02340.4099-0.01030.431626.0525.767952.7347
161.2165-0.2208-3.01132.08971.09868.133-0.0397-0.0393-0.120.2527-0.04450.0099-0.2158-0.02570.08420.3237-0.02860.01980.425-0.01260.573138.602826.603548.5098
174.8371-1.37970.60670.48570.748910.2311-0.0010.41190.33020.0055-0.2175-0.0786-0.0773-0.03030.21850.2663-0.12210.07830.51720.01250.567744.124525.985534.889
182.60762.73774.31928.61763.55297.3685-0.12830.3807-0.1215-0.43990.1859-0.4468-0.1980.5535-0.05770.2922-0.06010.09240.5216-0.02770.456139.371424.5625.0347
191.3395-0.22131.67024.9092.810316.7107-0.10680.01040.1945-0.29910.110.1372-0.63060.2668-0.00320.2547-0.06330.03940.37360.02990.539635.009533.947540.6306
2013.6724-6.0834-10.224.50728.454416.14490.1168-0.07950.9320.33430.0744-0.23060.78790.1615-0.19120.2775-0.02610.09030.34010.00270.616349.075626.790646.0723
2110.56622.561910.859613.5841-2.104328.1029-0.16490.54040.4310.3642-0.2957-1.0376-0.74222.05370.46060.2955-0.00890.030.54730.06290.44660.68423.180340.0427
221.57690.818-0.94374.32535.99311.482-0.0770.2774-0.1859-0.27860.395-0.482-0.40550.4546-0.3180.2116-0.0113-0.01960.45840.09260.635553.96283.558134.2563
231.8257-2.99260.31595.0367-1.34616.21570.05080.0915-0.1557-0.0369-0.05630.3318-0.0833-0.14980.00550.25710.03390.01710.46320.01630.572538.7927-2.76129.6308
243.0195-0.96081.80442.680.19675.3673-0.04570.41910.2597-0.2323-0.1292-0.0901-0.54810.22150.17490.292-0.02620.01420.4946-0.02960.474942.04081.562121.2068
253.38712.5091-1.54186.9582-0.874817.22780.37590.65031.05560.02140.2444-0.2241-0.4337-0.2536-0.62040.1672-0.03690.11090.55380.12550.701754.37351.115423.036
2624.33330.75120.670711.026617.680728.36660.78071.42930.6025-0.1491-0.1394-0.4245-0.2421-0.2585-0.64130.40030.00470.08070.62020.12870.487657.5556-4.224118.1058
272.3045-1.07183.285811.2373.41846.9656-0.1684-0.04950.1317-0.62120.0344-0.2133-0.5452-0.08450.1340.3265-0.00550.07830.549-0.00550.378645.9866-6.792714.4649
285.9059-2.5650.88026.3182-10.240618.83850.05080.2144-0.0804-0.0315-0.05090.08270.0856-0.08280.00020.2135-0.05030.02450.4275-0.05450.556134.2354-12.032622.3489
298.9284-0.44952.76381.84511.32685.2777-0.1369-0.193-0.40670.08090.17430.12080.3732-0.1204-0.03740.2235-0.00220.07040.38940.03340.598238.5408-20.151337.04
303.82393.4179-1.27787.9232-0.58120.54130.262-0.44340.29570.4635-0.18780.3453-0.09970.1447-0.07420.20580.02470.03610.4766-0.01630.510440.2982-15.576447.8286
3111.0934-5.669-3.85266.12336.430518.78480.3349-0.492-0.05190.3138-0.11910.4039-0.1146-0.1624-0.21580.2612-0.05730.04580.36910.01410.473943.1913-6.606953.2831
3218.59232.063317.99993.4805-0.275126.8517-0.1199-0.53680.29550.3558-0.18350.5218-0.4153-0.1170.30340.27490.06360.10450.3969-0.05540.472142.0898-0.96149.4503
3319.2803-4.3816-5.96137.05762.18087.04490.57220.95520.1591-0.6494-0.29090.6003-0.7622-0.29-0.28130.29430.02220.01780.39810.03620.489533.8013-8.911643.2607
341.6622.66611.52249.8613.84831.76630.05920.10520.00130.09580.019-0.00730.01810.09-0.07820.2156-0.00160.02850.4552-0.020.529545.1002-2.034839.6194
355.8266-2.10583.734521.2432-8.11774.69110.0145-0.1203-0.12931.2815-0.03120.0503-0.4770.08050.01670.2825-0.0518-0.02750.53610.01240.423353.28320.862746.6263
362.87212.28462.64192.07522.98255.6363-0.06040.0522-0.1114-0.0804-0.04670.0032-0.19110.03750.10720.22750.02630.02050.4646-0.02050.544549.6758-13.936.9687
370.12440.0483-0.64250.8932-0.39525.1029-0.02770.0297-0.144-0.52530.1358-0.26850.43970.108-0.10810.3490.0110.04920.498-0.06310.709245.3364-12.972322.6964
386.91312.03698.65482.3715-0.796617.1669-0.27920.2604-0.0308-0.046-0.028-0.2162-0.44290.55990.30710.19480.06110.02890.5341-0.0760.484157.7332-6.550733.3706
397.46462.5517-6.254817.0355-4.727227.11450.4947-0.6050.14621.4654-0.21570.1219-0.3109-0.2755-0.27910.20140.0296-0.03690.44050.02190.51560.2846-9.692344.2961
4014.64080.04118.46879.14462.87324.5783-0.0231-0.04350.1650.09270.1125-0.169-0.0716-0.0977-0.08930.26810.08040.03690.35580.02160.4949.3598-23.290841.3597
419.3974.61174.34542.33263.326932.43270.5991-0.5134-0.99260.3712-0.2123-0.3661.39950.8047-0.38680.29840.04230.03490.33790.06640.757528.0713-32.813944.5969
427.3928-3.99876.33955.17811.951415.06520.53170.7948-0.18810.0361-0.5250.19041.08110.6335-0.00670.2582-0.020.05890.46820.02060.544426.8286-27.216737.5525
431.34092.22780.13497.1441-2.41132.0586-0.06810.1830.018-0.3162-0.0942-0.35820.14670.33980.16230.19710.02520.07990.4385-0.02570.638519.4824-17.126634.8166
442.70631.4317-0.51415.67462.65166.8865-0.05780.4480.0993-0.08130.1518-0.1230.01640.1087-0.09410.2071-0.00490.00990.43140.01140.540520.0119-12.399127.5098
453.13973.29211.54317.58753.032611.6771-0.07620.276-0.4457-0.07590.0438-0.44350.11270.29140.03240.27780.08230.05810.4317-0.02250.500820.7385-28.969126.6847
4610.28450.6728-5.03060.76370.74824.1237-0.06930.62480.2207-0.14490.2891-0.0112-0.04660.156-0.21970.44950.0721-0.07180.4993-0.06290.522212.2862-24.519521.636
474.79253.07190.497524.00482.941215.10240.32360.61430.2229-1.4966-0.09590.6253-0.0922-0.1168-0.22770.32190.05570.00040.45440.04710.4577.6165-8.546122.4301
480.9193-0.23741.78960.0669-0.43783.6560.03480.0468-0.0413-0.0467-0.00870.0255-0.108-0.0874-0.02620.29330.002600.42630.00280.58085.9368-8.815637.5764
498.98071.54783.99916.78911.66791.9291-0.1709-0.5892-0.01650.1910.16530.1956-0.0262-0.23550.00560.2578-0.03720.08180.42970.050.53397.0667-13.57753.3561
5018.1972-1.72360.8288.25913.75381.8685-0.2167-0.92860.25370.16890.3615-0.1845-0.0050.0216-0.14480.53640.17640.20120.54420.11920.599520.4451-15.036757.2825
512.0144-4.88995.265313.1991-16.425127.5826-0.0545-0.24030.11980.46220.2997-0.1735-0.16130.3671-0.24510.2856-0.01750.01170.413-0.03820.537525.6456-13.742452.4645
522.443-3.7886-0.565120.09510.83493.46320.08220.25530.4352-0.67580.2992-0.4463-0.11710.5287-0.38140.4215-0.02380.05950.4765-0.0420.472517.1084-3.717746.716
5310.53050.81722.68141.8253-3.58078.83850.0544-0.0115-0.17670.13180.14620.0249-0.2696-0.3872-0.20060.26150.02360.0360.4190.05140.595914.7147-13.841844.7828
545.67640.12290.66110.2464-0.82022.9525-0.0401-0.14660.2736-0.02660.0017-0.01910.0920.0250.03840.2283-0.00840.0020.4287-0.01420.567226.3094-20.096545.379
5512.679-0.8355-6.56213.6285-2.69764.1236-0.136-0.2627-0.0740.23210.0343-0.22880.05630.16250.10170.2770.0365-0.00090.4094-0.01720.511520.4361-25.185851.0783
560.401-1.02760.10112.79620.56254.23290.0048-0.0387-0.00050.06260.0487-0.03180.3075-0.1743-0.05350.2313-0.03720.04110.43180.02830.54718.712-22.002943.7247
576.20165.14642.49574.61322.82937.19870.08650.03980.4804-0.17680.02450.5262-0.1561-0.6924-0.1110.24510.0135-0.03820.43780.01940.54823.0517-17.150630.0993
581.6524-1.62191.09021.8273-0.2313.7770.0689-0.0634-0.0251-0.11120.0523-0.0546-0.0816-0.0622-0.12120.2638-0.04270.00950.414-0.03440.541511.5741-23.003931.9988
593.7327-6.63340.451116.3649-7.596616.8401-0.23960.1602-0.70080.1131-0.7867-0.1660.26920.47751.02620.2828-0.02380.04270.38570.04840.825818.3692-32.416843.1179
6013.9935-3.10082.99140.7176-0.95684.129-0.3052-0.36270.24420.11510.0707-0.0795-0.13750.02120.23440.3209-0.04610.01540.3611-0.01520.60176.5877-24.592651.6363
6121.96741.885-3.757121.9723-7.246622.19-0.3453-0.6017-0.11140.72170.67411.33180.6184-1.4625-0.32880.3593-0.01230.03780.45450.02670.4674-6.6996-0.172354.2065
622.29223.4427-1.66926.8111-2.36914.9976-0.28360.3071-0.1433-0.06760.16960.15080.2428-0.06250.1140.22140.0151-0.00940.3806-0.0120.57060.84513.652442.9452
632.88120.37162.15384.57092.29414.6883-0.2360.32940.1544-0.50550.3064-0.1193-0.17710.0501-0.07050.25270.00620.08350.44840.02890.51311.10726.654432.9814
6414.61739.0175-4.3086.33931.290421.8386-1.18220.83240.0335-0.74490.55950.15530.1862-0.46160.62280.42060.0029-0.12130.42470.02660.5218-1.60884.704727.5092
6514.8189-3.9049-0.87088.31350.865110.425-0.79430.3075-0.43290.13850.43010.48710.3862-0.67420.36420.2181-0.0764-0.0060.37280.00080.5584-8.46984.654436.0279
662.51054.3699-0.96917.7685-1.73460.3976-0.29670.33880.2015-0.34640.44840.37430.0682-0.135-0.15170.42320.0985-0.15390.81650.14090.5591-9.867711.629831.8025
6711.38953.9087-2.5412.6776-3.07314.7303-0.44141.32240.7473-0.61840.42060.31370.3016-0.12790.02080.8627-0.0701-0.19240.43650.03110.51584.099516.116224.4363
6818.49878.26734.59525.78046.210313.8637-0.15210.13010.14360.18980.4068-0.450.2379-0.086-0.25470.2750.02210.02110.4378-0.04220.525612.750318.859633.7299
691.60210.67541.86763.00731.15722.2276-0.1446-0.06540.0117-0.35230.12820.0544-0.217-0.05560.01640.24440.02070.04280.4310.01590.586613.41323.106241.809
7019.69885.0468-2.29935.0639-10.229524.96170.3095-0.91710.59960.2853-0.29650.1376-0.47740.4158-0.0130.30030.1208-0.05540.4295-0.07570.72310.164726.307154.1912
713.21642.2282-1.5067.8505-3.45424.00120.0054-0.22730.2010.41820.1421-0.1688-0.2247-0.0769-0.14750.20540.02660.02520.4351-0.02030.542514.532915.555956.8944
720.9916-1.567-4.765115.35350.180427.1807-0.2741-0.14130.07851.14710.281-1.00120.97040.7832-0.00690.26010.0167-0.01190.5152-0.05650.523213.68163.054558.8501
7324.246527.0713-7.562731.8713-6.48464.7073-0.3970.1298-0.9705-0.08180.2639-1.16840.54030.17180.13310.2405-0.0420.03380.4339-0.05780.621.12238.235847.7212
740.23040.8209-0.41677.05690.13071.39790.00820.00410.0062-0.25810.03270.1326-0.15810.0292-0.04090.2425-0.00550.00170.4405-0.00810.5539.83798.107948.5656
757.48380.1026-5.246516.83725.97525.85820.4719-0.27270.03631.165-0.2035-0.65860.12550.0912-0.26840.33730.0186-0.01960.40820.05480.53053.7105-1.281255.7708
761.50141.31950.1641.18190.15290.02420.08390.00660.00390.0868-0.07810.08040.0011-0.0512-0.00590.2410.02330.05170.4434-0.01790.59712.25315.379951.5082
777.7469-0.3471-5.47420.06170.27843.90190.54880.20890.5318-0.2131-0.0970.0202-0.5742-0.1504-0.45180.84120.0634-0.07260.39850.02340.5292.091620.253333.2294
784.9002-1.855-9.539910.7257.735520.2699-0.08730.64861.0047-1.54151.29871.4434-0.4761-0.6212-1.21140.3978-0.119-0.28750.61980.1980.8484-4.175715.39839.6589
793.72273.9477-7.06610.7341-3.304516.186-0.29480.42560.0155-0.32790.08830.50440.3608-0.94740.20660.2608-0.00640.02590.50370.01540.5609-5.922110.647148.1069
805.06832.5267-0.28698.3032-1.28220.9720.0033-0.128-0.2499-0.00840.10620.10.052-0.2591-0.10950.26610.03260.05440.455-0.03340.5113-0.386418.150956.394
817.55924.6691.68493.24831.67345.5474-0.3558-0.8299-0.3169-0.0655-0.338-0.5592-0.10310.93930.69380.2933-0.2036-0.00290.6853-0.16881.103858.72050.3158-5.7671
823.2097-0.1626-3.54752.96936.537917.7276-0.00380.05830.5991-0.32570.19560.2562-0.980.4301-0.19180.5939-0.0010.09290.3734-0.11480.489349.5744-1.8105-13.8867
836.0611-2.98321.15962.28280.51811.6811-0.4924-0.29170.16410.1897-0.01830.2401-0.1798-0.28830.51080.28460.03590.0360.4391-0.03540.536740.4253-7.059-19.4047
8411.87661.8444-4.68025.3880.29054.89770.3177-0.29450.2478-0.5566-0.14550.3249-0.40470.0499-0.17220.40370.081-0.00460.3805-0.03090.425741.5817-0.3671-24.7651
854.34133.60932.05164.59326.102614.40620.15850.00561.112-0.046-0.13880.5932-0.98570.4977-0.01970.4217-0.2615-0.08120.67490.12440.683256.32180.3192-23.7609
8618.14357.0453-3.49318.46793.8195.358-0.34250.21960.0172-0.95990.7021-0.391-0.72380.5874-0.35960.3925-0.1133-0.00290.5104-0.02150.505958.2568-5.4714-28.314
873.4752-0.72674.13130.3765-0.17377.1034-0.03030.21590.2257-0.06820.078-0.1156-0.140.5717-0.04770.3463-0.0606-0.02590.4571-0.01840.513343.7446-9.2137-35.4537
887.41764.8608-2.933.9396-2.60911.80160.2292-0.27440.24780.0247-0.04870.2831-0.0044-0.094-0.18050.2550.0347-0.03970.5275-0.07880.508436.3278-17.4089-25.4701
895.14330.07930.9927.7709-2.662210.2541-0.0458-0.7003-0.99110.12920.60670.01870.43010.1368-0.56090.23410.0534-0.05080.45290.01510.566342.2518-24.339-11.7454
905.23923.94722.882316.04047.30943.60890.1034-0.2903-0.55550.61250.1321-0.26020.28990.005-0.23540.26240.0939-0.00340.52720.07470.439938.063-22.685-5.2991
912.35956.46680.235320.1976.715916.51420.25180.00660.03160.74280.23160.05990.703-0.3123-0.48330.346-0.0486-0.09370.63090.03360.476140.8738-13.54692.8724
920.3528-0.15430.45387.9734-16.640534.79490.48490.01140.2683-0.04620.51070.53450.2632-0.9805-0.99560.80920.04170.14560.4476-0.03550.666340.1822-5.74521.0489
9315.87396.382711.201232.725414.347511.1229-0.33780.530.7691.14110.062-0.44820.13140.31470.27580.3692-0.11410.10270.4825-0.02410.806231.3567-9.7986-7.9583
940.0392-0.13110.09545.0376-0.17030.89040.0205-0.06280.03030.21190.14010.1924-0.05610.2833-0.16060.2964-0.00270.01990.5382-0.06120.462142.5669-8.8988-8.624
951.4598-2.14922.01616.51742.20114.7891-0.4306-0.0204-0.08041.36470.37840.5573-0.32530.15060.05230.3028-0.03120.04440.5717-0.15380.469550.384-3.5932-0.0458
960.5674-1.1969-3.36314.58227.782220.25340.1421-0.1938-0.00490.61510.0606-0.0699-0.59040.9681-0.20270.4928-0.0934-0.07360.5964-0.02450.51650.3145-15.3352-5.5046
971.52810.50562.31571.0973-2.596215.73430.133-0.053-0.36670.0026-0.1314-0.31080.42230.2527-0.00160.2170.0084-0.00820.5207-0.06180.545949.7394-19.9778-20.2381
982.3682-1.88470.52864.8167-1.33275.0536-0.00970.0462-0.2092-0.15610.129-0.0234-0.13540.2525-0.11920.2189-0.0105-0.00660.4825-0.08440.495850.884-12.1312-24.5072
997.9886-2.73536.15522.16273.188627.89390.1552-0.38090.1553-0.35650.0227-0.2144-1.2322-0.6116-0.17790.29-0.0960.02450.6259-0.04270.722659.7885-9.4794-8.3498
1005.00464.70882.014513.11514.64756.57240.3808-0.584-0.54570.4136-0.3132-0.63450.3585-0.2103-0.06760.14560.1027-0.07250.52210.01890.525851.9464-23.6447-6.4184
10120.667422.6634-10.45724.8571-11.4725.2981-0.58370.2174-0.8569-0.68580.1801-0.91990.3791-0.05540.40361.23240.5124-0.12770.6837-0.12450.504327.991-37.0328-13.2177
1024.5731-0.76262.59162.4422-1.83044.2991-0.04010.29150.1595-0.2975-0.1269-0.27120.36190.13460.1670.2201-0.0403-0.00430.4719-0.00490.530125.8499-26.3524-19.9668
1033.1242.11040.89331.74381.003610.9706-0.20280.00290.2632-0.08060.1080.104-0.50610.48950.09480.3373-0.0153-0.1170.3318-0.02030.490822.2426-14.177-26.3764
1044.5953-4.37574.648513.2071-3.01746.65280.07540.49580.2197-0.7356-0.051-0.3820.6230.7289-0.02440.33750.0403-0.08090.46-0.07540.44225.5494-29.2055-31.3492
10513.46634.21937.49711.8764-0.971924.8917-1.3250.4622-1.4905-0.40820.172-0.7376-0.5989-0.4011.1530.58060.01220.07950.4983-0.16570.640919.8313-33.5292-34.6625
1062.9441-3.51876.08784.469-5.939619.85820.14620.29270.2263-0.2405-0.3752-0.28760.14710.0710.22890.347-0.0844-0.04290.4171-0.01240.524117.3435-22.7759-37.8461
1073.52270.9095-9.03745.7243-3.882923.62810.2330.1349-0.0299-0.0129-0.27420.1641-0.6249-0.27750.04130.36870.0255-0.10220.42470.0180.46611.1514-11.0297-30.0662
10810.16031.10483.67380.1540.42291.43020.2542-0.17660.38620.0118-0.1535-0.00530.0329-0.0411-0.10080.82520.1020.06530.6961-0.10930.58763.9207-9.8543-22.0886
1099.3896-2.3427-0.34561.3161-2.649510.2564-0.2111-1.04040.31650.10770.3596-0.0347-0.245-0.3517-0.14850.1724-0.02190.00270.6421-0.18840.57046.1603-19.2789-12.9749
11013.1334-0.9537-4.05020.07170.29511.2556-0.072-0.4195-0.01240.02490.04840.01880.05940.07930.02360.3913-0.0567-0.00310.7293-0.14360.62534.2928-17.6475-5.4225
11120.9928-5.201210.30979.1093-0.82675.4522-0.7713-1.64660.42490.92650.34310.8161-0.174-0.84470.42820.3301-0.05680.13930.5498-0.10340.533816.1419-21.1934-0.1434
11210.66995.1831-4.896126.0411-23.934622.01630.574-0.7410.44660.7593-0.53290.0356-0.62760.4517-0.04120.4685-0.1142-0.03880.5047-0.16880.39423.3605-19.0633-2.9021
11311.883517.33090.761136.64935.03392.24630.26840.2140.6214-1.0118-0.3437-0.054-0.3095-0.02990.07520.27630.01510.14520.7002-0.09580.543716.0073-9.9413-8.3559
11415.9102-2.37523.87420.522-1.15132.9912-0.2172-0.13780.35410.10460.0658-0.0858-0.205-0.0130.15140.29220.0236-0.04260.4536-0.07780.478318.3392-20.7012-13.6765
1158.36650.4493-0.97824.41552.40733.2540.0699-0.3065-0.05960.536-0.2636-0.01470.0896-0.03190.19370.2694-0.0091-0.03780.46050.00950.413829.1081-26.0246-8.5903
11610.2542-2.55941.59244.8564-1.5313.2164-0.3367-0.3640.18390.29140.0365-0.00650.41170.11110.30020.2065-0.0310.01560.5177-0.03490.477916.2205-29.3284-8.9788
1179.7909-2.33580.57580.5578-0.13650.03820.08470.2847-0.0709-0.0107-0.05290.01850.02580.0186-0.03190.1629-0.0163-0.03960.5511-0.06780.64286.5276-24.7676-21.8942
1181.79222.5571-0.90874.8479-2.1111.0236-0.0798-0.13790.27680.18140.03320.2018-0.2101-0.11910.04670.38250.1088-0.12670.64-0.13940.554310.071-20.2711-30.4376
1190.15790.5264-0.702610.2261-8.61917.7856-0.2639-0.0179-0.1155-0.57060.1180.03540.9786-0.04950.14590.5705-0.02950.01160.4873-0.02330.527817.2796-33.1281-20.7638
12019.3615-5.44444.56512.3862-2.17393.0374-0.7083-1.4042-0.13050.40750.6327-0.0404-0.216-0.1990.07550.2395-0.0150.04360.6192-0.11370.49687.2166-31.4357-9.5576
12118.241-11.07463.05946.7348-1.8530.5157-0.10710.17920.82010.0489-0.0497-0.4658-0.05380.05420.15681.0305-0.11760.0480.3487-0.14810.49321.853128.8674-1.6567
1221.3946-0.6911-1.24339.10593.87558.0375-0.28360.3791-0.1201-0.60990.16670.2059-0.3919-0.19370.11690.779-0.0171-0.01540.2781-0.0080.355429.446316.4522-13.65
1230.59511.97232.32136.55237.71169.07890.04680.0473-0.0110.1810.0895-0.09110.18210.1572-0.13620.8942-0.0369-0.11450.33140.04850.501226.978118.1233-22.2838
1248.3321-1.42948.593937.8636-28.765328.684-0.50830.95611.298-0.2226-0.05720.831-0.20610.84740.56550.8364-0.0233-0.04040.58930.04860.596224.002830.0741-20.8193
1252.1264.5958-5.930913.8311-15.721518.7357-0.50240.5048-0.14571.0207-0.1725-0.7391-0.2859-0.55180.67491.6892-0.4742-0.09130.78970.05780.7428.953234.034-14.6173
1262.128-2.62753.953.3505-5.05947.64530.0420.50920.27750.3595-0.5326-0.3149-0.60770.81810.49061.48740.0240.00290.42240.18750.288733.354530.4445-23.2623
12711.6978-2.71831.679125.5545-12.4416.07490.2580.4586-0.05640.6694-0.13780.3607-0.3210.1055-0.12020.85230.00960.02050.75190.04150.491440.460620.6685-31.0267
12820.8651-10.54747.22565.3885-3.2848.8894-0.20450.43190.6430.0767-0.171-0.2413-0.0153-0.2530.37540.7413-0.10630.11710.3299-0.07180.475441.213311.5119-21.254
1293.4881-0.4804-0.21675.85657.57189.88710.2068-0.13560.6637-0.38690.1138-0.3415-0.37990.2498-0.32070.6237-0.04260.18610.3856-0.07330.547446.377212.6235-7.4964
13021.543720.572814.891437.92818.403111.26620.26660.9561-0.06920.3005-0.1313-0.69890.19740.4796-0.13530.6216-0.09310.07920.7526-0.08730.470850.54639.76760.7548
13112.641-2.1067-8.67343.0728-0.54227.4048-0.0603-0.61540.28030.00810.3047-0.01010.01950.2844-0.24440.4267-0.0722-0.01530.4767-0.17620.413737.62469.86235.4676
13217.3227-8.4537-4.220515.198113.749624.89340.3649-0.7211-0.89080.75670.04870.1955-0.5698-0.4567-0.41360.4463-0.07530.0450.4648-0.00910.303527.37799.9088.9461
13330.2155-10.7147-12.96677.4538.36679.4589-0.5818-0.746-1.814-0.6402-0.27150.7772-0.6658-0.15940.85330.6421-0.08450.07140.4377-0.03010.532430.56314.1206-3.9098
1344.2223-0.50810.37960.61460.07242.6730.1220.2961-0.0514-0.33740.0184-0.0087-0.574-0.0289-0.14050.5995-0.00670.03770.2969-0.05260.427531.294113.8298-3.856
13525.52241.87420.789110.72675.95173.30920.5847-1.06160.65140.2933-0.58480.02190.1385-0.35510.00010.71980.0547-0.02460.4732-0.06410.300522.342119.72763.5517
1364.638-5.1023-6.60357.99933.46715.5828-0.048-0.05620.22-0.00990.0047-0.3814-0.007-0.00710.04320.5755-0.07270.00680.3419-0.12350.516835.474821.16252.596
1370.08510.0667-1.1919.31110.371122.49710.09280.06860.0505-0.51310.384-0.61250.6433-0.7008-0.47680.8337-0.11480.14270.47120.01490.393144.679522.3702-14.0988
1386.1189-7.46822.0499.1204-2.233820.6570.58940.12250.0994-0.7554-0.1152-0.11190.11072.3003-0.47421.0107-0.17810.06210.32470.03580.32337.45723.6993-18.1803
1394.24-0.89894.238412.67533.70055.93390.15160.1662-0.12331.1256-0.26840.74830.54710.06430.11680.85-0.06160.11140.34910.04240.597835.236629.6687-8.292
14010.7081-6.210.4996.39011.60321.4163-0.0739-0.60190.5413-0.48680.4063-0.5973-0.56260.1504-0.33230.7941-0.24810.16610.384-0.14490.429639.132725.63852.2463
14134.90944.5479-5.196728.829615.07099.5576-0.0557-1.3791-0.11720.25090.1493-0.17290.16820.3881-0.09360.46580.0903-0.05190.6324-0.05350.6075-7.5264-6.6298-7.657
14223.6766.62272.642614.15836.28462.8325-0.59020.5624-1.3077-0.65790.17390.5799-0.4258-0.10830.41630.65990.518-0.41760.8207-0.370.5260.9643-1.8189-15.3798
1436.29359.3236-8.904523.4728-9.837915.0196-0.72250.76381.0326-1.14881.13410.7584-0.0656-0.811-0.41161.6318-0.0431-0.99650.26270.50131.69213.39815.1244-19.2697
1442.2639-3.359-1.74125.01622.59711.3705-0.24720.1054-0.2550.4456-0.0710.40880.2653-0.09190.31821.072-0.2316-0.20010.45980.07960.80694.7821.6589-27.1361
1450.12411.10711.190610.583611.350412.1994-0.1055-0.01010.0273-0.2832-0.28420.3781-0.3793-0.4360.38970.87530.1049-0.14140.8352-0.05490.7407-7.3261-0.3881-23.0851
14621.46435.3883-7.59721.4836-1.03578.71950.6636-0.5038-1.35260.2804-0.2164-0.46020.3885-0.1385-0.44720.82510.0421-0.10390.5572-0.04160.7091-5.67958.4327-27.971
1474.4084-1.7421-6.72280.69022.663810.38490.2595-0.0107-0.0293-0.06510.0253-0.006-0.35040.3015-0.28491.01440.0932-0.30240.968-0.3141.285711.052914.902-30.221
14813.31375.3940.74857.2793-6.21948.4343-0.23290.1110.5324-0.49570.02830.06140.29460.00150.20461.12540.266-0.01680.243-0.07850.476414.468317.4983-16.2872
1499.4818-8.78662.440916.25850.05817.54490.7947-0.09380.3628-1.1705-0.68740.3495-0.94010.1691-0.10730.56470.2534-0.09710.396-0.16490.397510.394617.4829-0.7637
1503.01654.9768-0.571729.189-8.029711.91330.2784-0.6251-0.40850.8152-0.34620.56010.1178-1.04210.06770.20040.0592-0.03410.6193-0.14020.50558.39713.63655.0589
15112.12328.45145.05287.03975.70746.3303-0.00470.1041-0.7791-0.4155-0.2858-0.2679-0.7668-0.5280.29040.43110.2208-0.03310.3878-0.08640.447513.65593.4302-4.6951
1525.2523.45752.226429.4778-1.3271.2623-0.1789-0.66640.1342-0.895-0.00470.2383-0.0703-0.43810.18360.2710.2455-0.15260.6382-0.35140.65125.2393-3.3695-7.4556
1535.11117.15920.659916.39621.34690.11490.4676-0.6255-0.5611-0.2567-0.50051.0288-0.0033-0.02490.03290.6126-0.0155-0.10910.7431-0.04790.7865-0.916-6.0408-1.1145
1546.01725.5271-5.835713.06259.952135.0814-0.0895-0.09640.95640.1184-0.64911.71790.4297-1.20980.73860.14170.2917-0.15840.7648-0.36190.7332-1.08714.7514-1.1683
1550.0613-0.18960.31459.3693-11.218213.6810.17230.08190.06280.4487-0.06990.3952-0.37590.2299-0.10240.72290.3127-0.07390.4921-0.09780.86180.875515.7851-9.1401
15616.84378.7924-6.09876.287-6.975310.9613-1.4914-0.73641.0028-2.16940.2682-0.06443.6558-0.76131.22321.5089-0.25930.13051.0846-0.08030.83423.870520.514-19.1457
15743.2304-13.7171-15.9628.493819.662557.4306-0.5966-0.37970.6059-0.26330.5967-0.1562-1.28341.5863-0.00010.8553-0.3359-0.50970.7118-0.25010.65453.831913.3304-24.079
15830.82678.8522-29.00923.711-11.867438.2588-0.1281-0.9211-0.26170.0867-0.5953-0.1069-0.49821.66660.72340.48390.1604-0.47020.373-0.11560.9034-4.62698.3739-15.6803
15911.13961.16257.44295.528-1.29875.7710.533-1.1841.1167-0.439-0.62411.80.554-0.62350.09110.47640.1667-0.06840.6335-0.31090.858-9.21853.9192-5.1175
16010.543-8.8297-0.83889.34453.74414.81420.6952-0.1314-0.8721-1.0448-0.03330.2418-0.7998-0.2299-0.66180.56660.3009-0.11510.3928-0.05090.67121.564619.7583-0.8037
Refinement TLS group
IDRefine-IDRefine TLS-IDAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1A1 - 5
2X-RAY DIFFRACTION2A6 - 25
3X-RAY DIFFRACTION3A26 - 40
4X-RAY DIFFRACTION4A41 - 49
5X-RAY DIFFRACTION5A50 - 61
6X-RAY DIFFRACTION6A62 - 75
7X-RAY DIFFRACTION7A76 - 90
8X-RAY DIFFRACTION8A91 - 95
9X-RAY DIFFRACTION9A96 - 104
10X-RAY DIFFRACTION10A105 - 110
11X-RAY DIFFRACTION11A111 - 115
12X-RAY DIFFRACTION12A116 - 120
13X-RAY DIFFRACTION13A121 - 125
14X-RAY DIFFRACTION14A126 - 139
15X-RAY DIFFRACTION15A140 - 147
16X-RAY DIFFRACTION16A148 - 158
17X-RAY DIFFRACTION17A159 - 166
18X-RAY DIFFRACTION18A167 - 179
19X-RAY DIFFRACTION19A180 - 195
20X-RAY DIFFRACTION20A196 - 204
21X-RAY DIFFRACTION21B1 - 5
22X-RAY DIFFRACTION22B6 - 14
23X-RAY DIFFRACTION23B15 - 28
24X-RAY DIFFRACTION24B29 - 41
25X-RAY DIFFRACTION25B42 - 49
26X-RAY DIFFRACTION26B50 - 55
27X-RAY DIFFRACTION27B56 - 64
28X-RAY DIFFRACTION28B65 - 76
29X-RAY DIFFRACTION29B77 - 96
30X-RAY DIFFRACTION30B97 - 106
31X-RAY DIFFRACTION31B107 - 111
32X-RAY DIFFRACTION32B112 - 119
33X-RAY DIFFRACTION33B120 - 126
34X-RAY DIFFRACTION34B127 - 140
35X-RAY DIFFRACTION35B141 - 149
36X-RAY DIFFRACTION36B150 - 167
37X-RAY DIFFRACTION37B168 - 183
38X-RAY DIFFRACTION38B184 - 192
39X-RAY DIFFRACTION39B193 - 198
40X-RAY DIFFRACTION40B199 - 204
41X-RAY DIFFRACTION41C1 - 5
42X-RAY DIFFRACTION42C6 - 13
43X-RAY DIFFRACTION43C14 - 21
44X-RAY DIFFRACTION44C22 - 40
45X-RAY DIFFRACTION45C41 - 50
46X-RAY DIFFRACTION46C51 - 63
47X-RAY DIFFRACTION47C64 - 70
48X-RAY DIFFRACTION48C71 - 90
49X-RAY DIFFRACTION49C91 - 106
50X-RAY DIFFRACTION50C107 - 111
51X-RAY DIFFRACTION51C112 - 119
52X-RAY DIFFRACTION52C120 - 124
53X-RAY DIFFRACTION53C125 - 129
54X-RAY DIFFRACTION54C130 - 145
55X-RAY DIFFRACTION55C146 - 153
56X-RAY DIFFRACTION56C154 - 165
57X-RAY DIFFRACTION57C166 - 173
58X-RAY DIFFRACTION58C174 - 187
59X-RAY DIFFRACTION59C188 - 194
60X-RAY DIFFRACTION60C195 - 204
61X-RAY DIFFRACTION61D1 - 5
62X-RAY DIFFRACTION62D6 - 21
63X-RAY DIFFRACTION63D22 - 34
64X-RAY DIFFRACTION64D35 - 41
65X-RAY DIFFRACTION65D42 - 50
66X-RAY DIFFRACTION66D51 - 58
67X-RAY DIFFRACTION67D59 - 70
68X-RAY DIFFRACTION68D71 - 78
69X-RAY DIFFRACTION69D79 - 90
70X-RAY DIFFRACTION70D91 - 95
71X-RAY DIFFRACTION71D96 - 110
72X-RAY DIFFRACTION72D111 - 117
73X-RAY DIFFRACTION73D118 - 122
74X-RAY DIFFRACTION74D123 - 139
75X-RAY DIFFRACTION75D140 - 146
76X-RAY DIFFRACTION76D147 - 165
77X-RAY DIFFRACTION77D166 - 178
78X-RAY DIFFRACTION78D179 - 184
79X-RAY DIFFRACTION79D185 - 191
80X-RAY DIFFRACTION80D192 - 204
81X-RAY DIFFRACTION81E1 - 9
82X-RAY DIFFRACTION82E10 - 17
83X-RAY DIFFRACTION83E18 - 25
84X-RAY DIFFRACTION84E26 - 37
85X-RAY DIFFRACTION85E38 - 49
86X-RAY DIFFRACTION86E50 - 60
87X-RAY DIFFRACTION87E61 - 69
88X-RAY DIFFRACTION88E70 - 83
89X-RAY DIFFRACTION89E84 - 95
90X-RAY DIFFRACTION90E96 - 104
91X-RAY DIFFRACTION91E105 - 112
92X-RAY DIFFRACTION92E113 - 117
93X-RAY DIFFRACTION93E118 - 122
94X-RAY DIFFRACTION94E123 - 139
95X-RAY DIFFRACTION95E140 - 149
96X-RAY DIFFRACTION96E150 - 158
97X-RAY DIFFRACTION97E159 - 169
98X-RAY DIFFRACTION98E170 - 186
99X-RAY DIFFRACTION99E187 - 194
100X-RAY DIFFRACTION100E195 - 204
101X-RAY DIFFRACTION101F1 - 5
102X-RAY DIFFRACTION102F6 - 20
103X-RAY DIFFRACTION103F21 - 38
104X-RAY DIFFRACTION104F39 - 49
105X-RAY DIFFRACTION105F50 - 55
106X-RAY DIFFRACTION106F56 - 63
107X-RAY DIFFRACTION107F64 - 76
108X-RAY DIFFRACTION108F77 - 84
109X-RAY DIFFRACTION109F85 - 92
110X-RAY DIFFRACTION110F93 - 103
111X-RAY DIFFRACTION111F104 - 111
112X-RAY DIFFRACTION112F112 - 119
113X-RAY DIFFRACTION113F120 - 125
114X-RAY DIFFRACTION114F126 - 136
115X-RAY DIFFRACTION115F137 - 144
116X-RAY DIFFRACTION116F145 - 159
117X-RAY DIFFRACTION117F160 - 167
118X-RAY DIFFRACTION118F168 - 180
119X-RAY DIFFRACTION119F181 - 192
120X-RAY DIFFRACTION120F193 - 204
121X-RAY DIFFRACTION121G2 - 9
122X-RAY DIFFRACTION122G10 - 27
123X-RAY DIFFRACTION123G28 - 39
124X-RAY DIFFRACTION124G40 - 45
125X-RAY DIFFRACTION125G46 - 52
126X-RAY DIFFRACTION126G53 - 61
127X-RAY DIFFRACTION127G62 - 66
128X-RAY DIFFRACTION128G67 - 79
129X-RAY DIFFRACTION129G80 - 93
130X-RAY DIFFRACTION130G94 - 98
131X-RAY DIFFRACTION131G99 - 110
132X-RAY DIFFRACTION132G111 - 116
133X-RAY DIFFRACTION133G117 - 122
134X-RAY DIFFRACTION134G123 - 139
135X-RAY DIFFRACTION135G140 - 147
136X-RAY DIFFRACTION136G148 - 158
137X-RAY DIFFRACTION137G159 - 173
138X-RAY DIFFRACTION138G174 - 182
139X-RAY DIFFRACTION139G183 - 188
140X-RAY DIFFRACTION140G189 - 204
141X-RAY DIFFRACTION141H2 - 7
142X-RAY DIFFRACTION142H8 - 19
143X-RAY DIFFRACTION143H20 - 28
144X-RAY DIFFRACTION144H29 - 42
145X-RAY DIFFRACTION145H43 - 50
146X-RAY DIFFRACTION146H51 - 61
147X-RAY DIFFRACTION147H62 - 71
148X-RAY DIFFRACTION148H72 - 86
149X-RAY DIFFRACTION149H87 - 101
150X-RAY DIFFRACTION150H102 - 113
151X-RAY DIFFRACTION151H114 - 130
152X-RAY DIFFRACTION152H131 - 141
153X-RAY DIFFRACTION153H142 - 147
154X-RAY DIFFRACTION154H148 - 156
155X-RAY DIFFRACTION155H157 - 165
156X-RAY DIFFRACTION156H166 - 171
157X-RAY DIFFRACTION157H172 - 178
158X-RAY DIFFRACTION158H179 - 187
159X-RAY DIFFRACTION159H188 - 197
160X-RAY DIFFRACTION160H198 - 204

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