<?xml version="1.0" ?>
<wwPDB-validation-information xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:noNamespaceSchemaLocation="http://wwpdb.org/validation/schema/wwpdb_validation_v6.06.xsd">
	<Entry percentilebins="all,2.2,xray" attemptedValidationSteps="molprobity,validation-pack,xtriage,eds,mogul,buster-report,percentiles,writexml" PDB-deposition-date="2005-08-08" PDB-revision-date="2024-10-16" PDB-revision-number="4" protein-DNA-RNA-entities="1" PDB-resolution="2.20" PDB-resolution-low="9.74" PDB-R="0.1810" PDB-Rfree="0.2180" pdbid="2D0S" extended_pdbid="2D0S" num-H-reduce="665" clashscore="5.35" RestypesNotcheckedForBondAngleGeometry="HEC" percent-rama-outliers="0.00" percent-rota-outliers="11.11" bonds_rmsz="1.23" num_bonds_rmsz="614" angles_rmsz="1.17" num_angles_rmsz="829" numMillerIndices="4025" WilsonBaniso="[23.717,19.688,22.128,0.000,0.000,0.000]" xtriage_input_columns="F_meas_au,F_meas_sigma_au" IoverSigma="5.71(2.21A)" DataAnisotropy="0.184" TwinL="0.491" TransNCS="The largest off-origin peak in the Patterson function is 10.68% of the height of the origin peak. No significant pseudotranslation is detected." acentric_outliers="1" TwinL2="0.331" centric_outliers="0" WilsonBestimate="22.151" DCC_refinement_program="REFMAC" density-fitnessVersion="1.0.12" bulk_solvent_k="0.328" bulk_solvent_b="34.101" B_factor_type="FULL" CCP4version="9.0.010 (Gargrove)" DCC_Rfree="0.1539" DataCompleteness="92.98" num-free-reflections="397" DCC_R="0.1559" ligands-for-buster-report="yes" EDS_resolution="2.20" EDS_resolution_low="9.74" EDS_R="0.1564" percent-free-reflections="9.30" Fo_Fc_correlation="0.961" percent-RSRZ-outliers="0.00" absolute-percentile-clashscore="49.2" numPDBids-absolute-percentile-clashscore="190562" relative-percentile-clashscore="58.3" numPDBids-relative-percentile-clashscore="6851" low-resol-relative-percentile-clashscore="2.2" high-resol-relative-percentile-clashscore="2.2" absolute-percentile-percent-rama-outliers="100.0" numPDBids-absolute-percentile-percent-rama-outliers="187476" relative-percentile-percent-rama-outliers="100.0" numPDBids-relative-percentile-percent-rama-outliers="6768" low-resol-relative-percentile-percent-rama-outliers="2.2" high-resol-relative-percentile-percent-rama-outliers="2.2" absolute-percentile-percent-rota-outliers="5.7" numPDBids-absolute-percentile-percent-rota-outliers="187428" relative-percentile-percent-rota-outliers="5.5" numPDBids-relative-percentile-percent-rota-outliers="6769" low-resol-relative-percentile-percent-rota-outliers="2.2" high-resol-relative-percentile-percent-rota-outliers="2.2" absolute-percentile-percent-RSRZ-outliers="100.0" numPDBids-absolute-percentile-percent-RSRZ-outliers="180081" relative-percentile-percent-RSRZ-outliers="100.0" numPDBids-relative-percentile-percent-RSRZ-outliers="6166" low-resol-relative-percentile-percent-RSRZ-outliers="2.2" high-resol-relative-percentile-percent-RSRZ-outliers="2.2" absolute-percentile-DCC_Rfree="98.7" numPDBids-absolute-percentile-DCC_Rfree="180053" relative-percentile-DCC_Rfree="100.0" numPDBids-relative-percentile-DCC_Rfree="6164" low-resol-relative-percentile-DCC_Rfree="2.2" high-resol-relative-percentile-DCC_Rfree="2.2" XMLcreationDate="Mar  6, 2026 -- 10:04 AM UTC"/>
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	<ModelledSubgroup num-H-reduce="4" phi="-107.9" psi="-8.6" rama="Favored" rota="m" rscc="0.974" OPIA="66.670" rsr="0.056" owab="16.740" avgoccu="1.000" EDIAm="0.824" rsrz="-0.583" NatomsEDS="6" model="1" chain="A" resnum="13" said="A" ent="1" seq="13" icode=" " resname="CYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="7" phi="-137.2" psi="144.0" rama="Favored" rota="m-70" rscc="0.962" OPIA="90.000" rsr="0.050" owab="12.040" avgoccu="1.000" EDIAm="0.939" rsrz="-0.855" NatomsEDS="10" model="1" chain="A" resnum="14" said="A" ent="1" seq="14" icode=" " resname="HIS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="5" phi="-129.3" psi="163.1" rama="Favored" avgoccu="1.000" EDIAm="0.885" rscc="0.977" OPIA="60.000" rsrz="-1.146" rsr="0.037" owab="16.290" NatomsEDS="5" model="1" chain="A" resnum="15" said="A" ent="1" seq="15" icode=" " resname="ALA" altcode=" "/>
	<ModelledSubgroup num-H-reduce="11" phi="-59.6" psi="-59.4" rama="Favored" rota="mt" rscc="0.945" OPIA="100.000" rsr="0.056" owab="20.300" avgoccu="1.000" EDIAm="0.967" rsrz="-0.816" NatomsEDS="8" model="1" chain="A" resnum="16" said="A" ent="1" seq="16" icode=" " resname="ILE" altcode=" "/>
	<ModelledSubgroup num-H-reduce="4" phi="-106.1" psi="5.1" rama="Favored" rota="OUTLIER" rscc="0.625" OPIA="25.000" rsr="0.149" owab="39.770" avgoccu="1.000" EDIAm="0.085" rsrz="1.587" NatomsEDS="8" model="1" chain="A" resnum="17" said="A" ent="1" seq="17" icode=" " resname="ASP" altcode=" ">
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	<ModelledSubgroup num-H-reduce="13" phi="-146.6" psi="160.7" rama="Favored" rota="OUTLIER" rscc="0.898" OPIA="44.440" rsr="0.081" owab="36.870" avgoccu="1.000" EDIAm="0.136" rsrz="-0.661" NatomsEDS="9" model="1" chain="A" resnum="18" said="A" ent="1" seq="18" icode=" " resname="LYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-90.0" psi="142.9" rama="Favored" rota="OUTLIER" rscc="0.892" OPIA="33.330" rsr="0.079" owab="37.170" avgoccu="1.000" EDIAm="0.408" rsrz="-0.706" NatomsEDS="9" model="1" chain="A" resnum="19" said="A" ent="1" seq="19" icode=" " resname="LYS" altcode=" ">
		<clash atom="O" dist="2.20" clashmag="0.41" cid="5"/>
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	<ModelledSubgroup num-H-reduce="11" phi="-129.4" psi="-137.4" rama="Allowed" rota="mt" rscc="0.958" OPIA="62.500" rsr="0.049" owab="22.820" avgoccu="1.000" EDIAm="0.769" rsrz="-1.021" NatomsEDS="8" model="1" chain="A" resnum="20" said="A" ent="1" seq="20" icode=" " resname="LEU" altcode=" ">
		<clash atom="HD23" dist="2.20" clashmag="0.41" cid="5"/>
		<angle-outlier atom0="N" atom1="CA" atom2="C" obs="98.669" z="-5.70" mean="110.800" stdev="2.130"/>
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	<ModelledSubgroup num-H-reduce="9" phi="-59.8" psi="-47.6" rama="Favored" rota="t" rscc="0.957" OPIA="71.430" rsr="0.053" owab="23.400" avgoccu="1.000" EDIAm="0.564" rsrz="-0.833" NatomsEDS="7" model="1" chain="A" resnum="21" said="A" ent="1" seq="21" icode=" " resname="VAL" altcode=" "/>
	<ModelledSubgroup num-H-reduce="3" phi="-105.0" psi="173.9" rama="Favored" avgoccu="1.000" EDIAm="0.889" rscc="0.971" OPIA="100.000" rsrz="-1.050" rsr="0.039" owab="15.730" NatomsEDS="4" model="1" chain="A" resnum="22" said="A" ent="1" seq="22" icode=" " resname="GLY" altcode=" "/>
	<ModelledSubgroup num-H-reduce="7" phi="-65.3" psi="157.5" rama="Favored" rota="Cg_endo" rscc="0.982" OPIA="100.000" rsr="0.031" owab="12.840" avgoccu="1.000" EDIAm="0.993" rsrz="-1.354" NatomsEDS="7" model="1" chain="A" resnum="23" said="A" ent="1" seq="23" icode=" " resname="PRO" altcode=" "/>
	<ModelledSubgroup num-H-reduce="5" phi="-66.7" psi="154.2" rama="Favored" rota="p" rscc="0.971" OPIA="83.330" rsr="0.043" owab="15.560" avgoccu="1.000" EDIAm="0.908" rsrz="-1.102" NatomsEDS="6" model="1" chain="A" resnum="24" said="A" ent="1" seq="24" icode=" " resname="SER" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-69.4" psi="-29.3" rama="Favored" rota="m-10" rscc="0.932" OPIA="91.670" rsr="0.053" owab="18.150" avgoccu="1.000" EDIAm="0.961" rsrz="-0.770" NatomsEDS="12" model="1" chain="A" resnum="25" said="A" ent="1" seq="25" icode=" " resname="TYR" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-67.3" psi="-33.8" rama="Favored" rota="mttm" rscc="0.956" OPIA="44.440" rsr="0.056" owab="24.210" avgoccu="1.000" EDIAm="0.529" rsrz="-1.234" NatomsEDS="9" model="1" chain="A" resnum="26" said="A" ent="1" seq="26" icode=" " resname="LYS" altcode=" "/>
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	<ModelledSubgroup num-H-reduce="9" phi="-118.0" psi="175.1" rama="Favored" rota="m-80" rscc="0.976" OPIA="100.000" rsr="0.035" owab="17.650" avgoccu="1.000" EDIAm="0.941" rsrz="-1.294" NatomsEDS="12" model="1" chain="A" resnum="32" said="A" ent="1" seq="32" icode=" " resname="TYR" altcode=" "/>
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		<clash atom="O" dist="2.03" clashmag="0.42" cid="1"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="13" phi="-59.2" psi="-58.8" rama="Favored" rota="ttmt" rscc="0.953" OPIA="55.560" rsr="0.057" owab="27.870" avgoccu="1.000" EDIAm="0.731" rsrz="-1.211" NatomsEDS="9" model="1" chain="A" resnum="45" said="A" ent="1" seq="45" icode=" " resname="LYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-80.1" psi="-16.8" rama="Favored" rota="mttt" rscc="0.940" OPIA="44.440" rsr="0.067" owab="34.130" avgoccu="1.000" EDIAm="0.286" rsrz="-0.982" NatomsEDS="9" model="1" chain="A" resnum="46" said="A" ent="1" seq="46" icode=" " resname="LYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="3" phi="78.3" psi="-173.5" rama="Favored" avgoccu="1.000" EDIAm="0.929" rscc="0.966" OPIA="100.000" rsrz="-0.971" rsr="0.042" owab="22.230" NatomsEDS="4" model="1" chain="A" resnum="47" said="A" ent="1" seq="47" icode=" " resname="GLY" altcode=" "/>
	<ModelledSubgroup num-H-reduce="3" phi="137.3" psi="175.8" rama="Favored" avgoccu="1.000" EDIAm="0.912" rscc="0.974" OPIA="75.000" rsrz="-0.997" rsr="0.041" owab="25.400" NatomsEDS="4" model="1" chain="A" resnum="48" said="A" ent="1" seq="48" icode=" " resname="GLY" altcode=" "/>
	<ModelledSubgroup num-H-reduce="5" phi="-130.7" psi="-176.2" rama="Favored" avgoccu="1.000" EDIAm="0.382" rscc="0.957" OPIA="80.000" rsrz="-0.871" rsr="0.047" owab="27.320" NatomsEDS="5" model="1" chain="A" resnum="49" said="A" ent="1" seq="49" icode=" " resname="ALA" altcode=" "/>
	<ModelledSubgroup num-H-reduce="3" phi="91.5" psi="-21.4" rama="Favored" avgoccu="1.000" EDIAm="0.806" rscc="0.918" OPIA="75.000" rsrz="-0.467" rsr="0.061" owab="25.650" NatomsEDS="4" model="1" chain="A" resnum="50" said="A" ent="1" seq="50" icode=" " resname="GLY" altcode=" ">
		<angle-outlier atom0="N" atom1="CA" atom2="C" obs="124.847" z="8.21" mean="115.080" stdev="1.190"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="9" phi="-72.2" psi="-41.9" rama="Favored" rota="t" rscc="0.938" OPIA="71.430" rsr="0.059" owab="20.700" avgoccu="1.000" EDIAm="0.824" rsrz="-0.667" NatomsEDS="7" model="1" chain="A" resnum="51" said="A" ent="1" seq="51" icode=" " resname="VAL" altcode=" "/>
	<ModelledSubgroup num-H-reduce="10" phi="-112.3" psi="-9.6" rama="Favored" rota="m100" rscc="0.957" OPIA="100.000" rsr="0.042" owab="15.820" avgoccu="1.000" EDIAm="0.969" rsrz="-1.012" NatomsEDS="14" model="1" chain="A" resnum="52" said="A" ent="1" seq="52" icode=" " resname="TRP" altcode=" "/>
	<ModelledSubgroup num-H-reduce="3" phi="166.1" psi="-176.0" rama="Favored" avgoccu="1.000" EDIAm="0.842" rscc="0.918" OPIA="75.000" rsrz="-0.042" rsr="0.077" owab="19.320" NatomsEDS="4" model="1" chain="A" resnum="53" said="A" ent="1" seq="53" icode=" " resname="GLY" altcode=" "/>
	<ModelledSubgroup num-H-reduce="7" phi="-86.9" psi="-14.6" rama="Favored" rota="Cg_endo" rscc="0.950" OPIA="71.430" rsr="0.050" owab="22.680" avgoccu="1.000" EDIAm="0.841" rsrz="-0.856" NatomsEDS="7" model="1" chain="A" resnum="54" said="A" ent="1" seq="54" icode=" " resname="PRO" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-84.0" psi="122.6" rama="Favored" rota="OUTLIER" rscc="0.973" OPIA="71.430" rsr="0.042" owab="26.310" avgoccu="1.000" EDIAm="0.656" rsrz="-1.139" NatomsEDS="7" model="1" chain="A" resnum="55" said="A" ent="1" seq="55" icode=" " resname="VAL" altcode=" "/>
	<ModelledSubgroup num-H-reduce="7" phi="-76.0" psi="152.0" rama="Favored" rota="Cg_endo" rscc="0.969" OPIA="71.430" rsr="0.046" owab="23.190" avgoccu="1.000" EDIAm="0.873" rsrz="-0.961" NatomsEDS="7" model="1" chain="A" resnum="56" said="A" ent="1" seq="56" icode=" " resname="PRO" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-95.9" psi="130.6" rama="Favored" rota="ttp" rscc="0.985" OPIA="50.000" rsr="0.044" owab="15.180" avgoccu="1.000" EDIAm="0.748" rsrz="-1.062" NatomsEDS="8" model="1" chain="A" resnum="57" said="A" ent="1" seq="57" icode=" " resname="MET" altcode=" ">
		<clash atom="HB2" dist="2.38" clashmag="0.53" cid="2"/>
		<angle-outlier atom0="N" atom1="CA" atom2="C" obs="95.029" z="-10.06" mean="109.620" stdev="1.450"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="7" phi="-67.5" psi="156.1" rama="Favored" rota="Cg_endo" rscc="0.967" OPIA="85.710" rsr="0.042" owab="19.970" avgoccu="1.000" EDIAm="0.928" rsrz="-1.066" NatomsEDS="7" model="1" chain="A" resnum="58" said="A" ent="1" seq="58" icode=" " resname="PRO" altcode=" "/>
	<ModelledSubgroup num-H-reduce="7" phi="-66.0" psi="165.2" rama="Favored" rota="Cg_endo" rscc="0.960" OPIA="85.710" rsr="0.050" owab="19.480" avgoccu="1.000" EDIAm="0.918" rsrz="-0.856" NatomsEDS="7" model="1" chain="A" resnum="59" said="A" ent="1" seq="59" icode=" " resname="PRO" altcode=" "/>
	<ModelledSubgroup flippable-sidechain="1" num-H-reduce="7" phi="-128.7" psi="72.3" rama="Favored" rota="m-70" rscc="0.962" OPIA="100.000" rsr="0.046" owab="16.190" avgoccu="1.000" EDIAm="0.955" rsrz="-0.953" NatomsEDS="10" model="1" chain="A" resnum="60" said="A" ent="1" seq="60" icode=" " resname="HIS" altcode=" ">
		<clash atom="HE1" dist="1.88" clashmag="0.55" cid="0"/>
		<clash atom="HD2" dist="2.03" clashmag="0.42" cid="1"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="7" phi="-68.5" psi="-15.4" rama="Favored" rota="Cg_endo" rscc="0.970" OPIA="85.710" rsr="0.037" owab="18.470" avgoccu="1.000" EDIAm="0.952" rsrz="-1.197" NatomsEDS="7" model="1" chain="A" resnum="61" said="A" ent="1" seq="61" icode=" " resname="PRO" altcode=" "/>
	<ModelledSubgroup num-H-reduce="8" phi="-113.8" psi="11.2" rama="Favored" rota="mt0" rscc="0.955" OPIA="55.560" rsr="0.053" owab="24.590" avgoccu="1.000" EDIAm="0.833" rsrz="-1.061" NatomsEDS="9" model="1" chain="A" resnum="62" said="A" ent="1" seq="62" icode=" " resname="GLN" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-106.5" psi="128.9" rama="Favored" rota="t" rscc="0.977" OPIA="85.710" rsr="0.047" owab="15.260" avgoccu="1.000" EDIAm="1.024" rsrz="-1.000" NatomsEDS="7" model="1" chain="A" resnum="63" said="A" ent="1" seq="63" icode=" " resname="VAL" altcode=" "/>
	<ModelledSubgroup num-H-reduce="5" phi="-60.4" psi="133.2" rama="Favored" avgoccu="1.000" EDIAm="0.858" rscc="0.957" OPIA="60.000" rsrz="-0.761" rsr="0.051" owab="16.000" NatomsEDS="5" model="1" chain="A" resnum="64" said="A" ent="1" seq="64" icode=" " resname="ALA" altcode=" "/>
	<ModelledSubgroup num-H-reduce="6" phi="-52.4" psi="-32.0" rama="Favored" rota="tt0" rscc="0.954" OPIA="66.670" rsr="0.054" owab="26.080" avgoccu="1.000" EDIAm="0.746" rsrz="-1.173" NatomsEDS="9" model="1" chain="A" resnum="65" said="A" ent="1" seq="65" icode=" " resname="GLU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="5" phi="-64.3" psi="-36.7" rama="Favored" avgoccu="1.000" EDIAm="0.887" rscc="0.968" OPIA="80.000" rsrz="-0.816" rsr="0.049" owab="15.780" NatomsEDS="5" model="1" chain="A" resnum="66" said="A" ent="1" seq="66" icode=" " resname="ALA" altcode=" "/>
	<ModelledSubgroup num-H-reduce="4" phi="-73.1" psi="-43.7" rama="Favored" rota="m-30" rscc="0.927" OPIA="87.500" rsr="0.058" owab="17.210" avgoccu="1.000" EDIAm="0.957" rsrz="-0.808" NatomsEDS="8" model="1" chain="A" resnum="67" said="A" ent="1" seq="67" icode=" " resname="ASP" altcode=" "/>
	<ModelledSubgroup num-H-reduce="11" phi="-55.7" psi="-47.9" rama="Favored" rota="mt" rscc="0.976" OPIA="100.000" rsr="0.049" owab="14.400" avgoccu="1.000" EDIAm="1.006" rsrz="-1.008" NatomsEDS="8" model="1" chain="A" resnum="68" said="A" ent="1" seq="68" icode=" " resname="ILE" altcode=" "/>
	<ModelledSubgroup num-H-reduce="6" phi="-61.3" psi="-43.6" rama="Favored" rota="tt0" rscc="0.959" OPIA="77.780" rsr="0.047" owab="18.600" avgoccu="1.000" EDIAm="0.796" rsrz="-1.341" NatomsEDS="9" model="1" chain="A" resnum="69" said="A" ent="1" seq="69" icode=" " resname="GLU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-48.3" psi="-49.5" rama="Favored" rota="tttm" rscc="0.919" OPIA="44.440" rsr="0.070" owab="25.820" avgoccu="1.000" EDIAm="0.663" rsrz="-0.913" NatomsEDS="9" model="1" chain="A" resnum="70" said="A" ent="1" seq="70" icode=" " resname="LYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="11" phi="-66.7" psi="-42.3" rama="Favored" rota="mt" rscc="0.961" OPIA="87.500" rsr="0.049" owab="12.470" avgoccu="1.000" EDIAm="0.932" rsrz="-1.008" NatomsEDS="8" model="1" chain="A" resnum="71" said="A" ent="1" seq="71" icode=" " resname="ILE" altcode=" ">
		<clash atom="HG13" dist="1.96" clashmag="0.48" cid="4"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="9" phi="-64.7" psi="-41.2" rama="Favored" rota="t" rscc="0.974" OPIA="85.710" rsr="0.038" owab="14.200" avgoccu="1.000" EDIAm="0.892" rsrz="-1.250" NatomsEDS="7" model="1" chain="A" resnum="72" said="A" ent="1" seq="72" icode=" " resname="VAL" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-66.4" psi="-31.9" rama="Favored" rota="mtt-85" rscc="0.962" OPIA="90.910" rsr="0.044" owab="18.150" avgoccu="1.000" EDIAm="0.954" rsrz="-1.313" NatomsEDS="11" model="1" chain="A" resnum="73" said="A" ent="1" seq="73" icode=" " resname="ARG" altcode=" "/>
	<ModelledSubgroup num-H-reduce="10" phi="-70.2" psi="-51.0" rama="Favored" rota="t60" rscc="0.971" OPIA="100.000" rsr="0.036" owab="16.660" avgoccu="1.000" EDIAm="0.919" rsrz="-1.192" NatomsEDS="14" model="1" chain="A" resnum="74" said="A" ent="1" seq="74" icode=" " resname="TRP" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-41.5" psi="-43.1" rama="Allowed" rota="t" rscc="0.977" OPIA="85.710" rsr="0.032" owab="12.610" avgoccu="1.000" EDIAm="0.928" rsrz="-1.417" NatomsEDS="7" model="1" chain="A" resnum="75" said="A" ent="1" seq="75" icode=" " resname="VAL" altcode=" "/>
	<ModelledSubgroup num-H-reduce="11" phi="-74.5" psi="-14.2" rama="Favored" rota="mt" rscc="0.949" OPIA="75.000" rsr="0.057" owab="18.790" avgoccu="1.000" EDIAm="0.798" rsrz="-0.807" NatomsEDS="8" model="1" chain="A" resnum="76" said="A" ent="1" seq="76" icode=" " resname="LEU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="7" phi="-86.2" psi="-7.6" rama="Favored" rota="p" rscc="0.952" OPIA="71.430" rsr="0.049" owab="22.250" avgoccu="1.000" EDIAm="0.876" rsrz="-0.903" NatomsEDS="7" model="1" chain="A" resnum="77" said="A" ent="1" seq="77" icode=" " resname="THR" altcode=" "/>
	<ModelledSubgroup num-H-reduce="11" phi="-77.0" psi="83.4" rama="Favored" rota="mt" rscc="0.945" OPIA="62.500" rsr="0.059" owab="25.950" avgoccu="1.000" EDIAm="0.607" rsrz="-0.753" NatomsEDS="8" model="1" chain="A" resnum="78" said="A" ent="1" seq="78" icode=" " resname="LEU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" rota="OUTLIER" avgoccu="1.000" EDIAm="0.069" rscc="0.650" OPIA="0.000" rsrz="0.830" rsr="0.146" owab="55.620" NatomsEDS="10" model="1" chain="A" resnum="79" said="A" ent="1" seq="79" icode=" " resname="LYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="31" avgoccu="1.000" EDIAm="0.887" mogul_bonds_rmsz="1.91" rscc="0.986" mogul_rmsz_numbonds="46" mogul_angles_rmsz="1.72" OPIA="81.400" mogul_rmsz_numangles="58" rsr="0.042" owab="12.840" NatomsEDS="43" model="1" chain="A" resnum="80" said="B" ent="2" seq="." icode=" " resname="HEC" altcode=" ">
		<clash atom="C1D" dist="2.38" clashmag="0.53" cid="2"/>
		<clash atom="HBC3" dist="1.94" clashmag="0.48" cid="3"/>
		<clash atom="HMC1" dist="1.94" clashmag="0.48" cid="3"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="452" mean="124.45" stdev="1.09" mindiff="0.07" Zscore="2.10" obsval="126.74"/>
		<mog-angle-outlier atoms="CBA,CAA,C2A" numobs="542" mean="112.53" stdev="2.77" mindiff="0.52" Zscore="-2.06" obsval="106.85"/>
		<mog-angle-outlier atoms="CBB,CAB,C3B" numobs="28" mean="127.43" stdev="2.00" mindiff="10.06" Zscore="-7.84" obsval="111.76"/>
		<mog-angle-outlier atoms="CMC,C2C,C1C" numobs="569" mean="125.42" stdev="1.52" mindiff="0.03" Zscore="-2.77" obsval="121.20"/>
		<mog-angle-outlier atoms="CBC,CAC,C3C" numobs="28" mean="127.43" stdev="2.00" mindiff="3.52" Zscore="-4.57" obsval="118.30"/>
		<mog-angle-outlier atoms="C4D,ND,C1D" numobs="37" mean="105.82" stdev="1.63" mindiff="1.73" Zscore="3.81" obsval="112.04"/>
		<mog-angle-outlier atoms="C1D,C2D,C3D" numobs="298" mean="106.82" stdev="1.15" mindiff="0.32" Zscore="-2.08" obsval="104.43"/>
		<mog-angle-outlier atoms="CBD,CAD,C3D" numobs="542" mean="112.53" stdev="2.77" mindiff="0.19" Zscore="-2.17" obsval="106.52"/>
		<mog-angle-outlier atoms="CAD,CBD,CGD" numobs="901" mean="113.67" stdev="2.65" mindiff="0.15" Zscore="-2.44" obsval="107.20"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="4776" mean="123.09" stdev="3.17" mindiff="0.01" Zscore="-2.01" obsval="116.70"/>
		<mog-bond-outlier atoms="CMA,C3A" numobs="10571" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.81" obsval="1.56"/>
		<mog-bond-outlier atoms="CAB,C3B" numobs="28" mean="1.35" stdev="0.03" mindiff="0.07" Zscore="6.81" obsval="1.57"/>
		<mog-bond-outlier atoms="CMC,C2C" numobs="10571" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.00" obsval="1.54"/>
		<mog-bond-outlier atoms="CAC,C3C" numobs="28" mean="1.35" stdev="0.03" mindiff="0.08" Zscore="7.14" obsval="1.58"/>
		<mog-bond-outlier atoms="C3D,C2D" numobs="1539" mean="1.38" stdev="0.03" mindiff="0.01" Zscore="4.79" obsval="1.51"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="40" mean="94.37" stdev="33.84" mindiff="30.82" local_density="0.00" obsval="55.95"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="43" mean="69.16" stdev="31.28" mindiff="26.35" local_density="0.00" obsval="-124.09"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="40" mean="102.09" stdev="49.64" mindiff="32.20" local_density="0.00" obsval="36.64"/>
		<mog-torsion-outlier atoms="C4C,C3C,CAC,CBC" numobs="43" mean="56.89" stdev="61.61" mindiff="13.27" local_density="0.00" obsval="-159.26"/>
	</ModelledSubgroup>
	<ModelledSubgroup avgoccu="1.000" EDIAm="0.981" rscc="0.990" OPIA="100.000" rsr="0.034" owab="9.130" NatomsEDS="1" model="1" chain="A" resnum="81" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" ">
		<clash atom="O" dist="1.88" clashmag="0.55" cid="0"/>
	</ModelledSubgroup>
	<ModelledSubgroup rscc="0.955" rsr="0.037" EDIAm="0.979" OPIA="100.000" owab="8.870" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="82" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.992" rsr="0.022" EDIAm="0.637" OPIA="0.000" owab="17.970" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="83" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.946" rsr="0.042" EDIAm="0.978" OPIA="100.000" owab="16.130" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="84" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.980" rsr="0.039" EDIAm="1.078" OPIA="100.000" owab="16.520" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="85" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.981" rsr="0.040" EDIAm="0.841" OPIA="100.000" owab="10.550" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="86" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.950" rsr="0.046" EDIAm="0.881" OPIA="100.000" owab="28.040" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="87" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.947" rsr="0.049" EDIAm="0.695" OPIA="0.000" owab="29.150" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="88" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.937" rsr="0.041" EDIAm="0.812" OPIA="100.000" owab="24.140" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="89" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.983" rsr="0.065" EDIAm="0.843" OPIA="100.000" owab="24.310" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="90" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.942" rsr="0.062" EDIAm="0.882" OPIA="100.000" owab="30.770" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="91" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.987" rsr="0.039" EDIAm="0.723" OPIA="0.000" owab="24.000" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="92" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.974" rsr="0.034" EDIAm="0.818" OPIA="100.000" owab="23.430" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="93" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.946" rsr="0.045" EDIAm="1.002" OPIA="100.000" owab="14.360" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="94" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.967" rsr="0.055" EDIAm="0.794" OPIA="0.000" owab="16.580" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="95" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.927" rsr="0.068" EDIAm="0.546" OPIA="0.000" owab="21.830" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="96" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.936" rsr="0.066" EDIAm="0.905" OPIA="100.000" owab="27.150" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="97" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.980" rsr="0.027" EDIAm="0.979" OPIA="100.000" owab="19.960" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="98" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.968" rsr="0.034" EDIAm="1.090" OPIA="100.000" owab="19.750" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="99" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.962" rsr="0.052" EDIAm="0.844" OPIA="100.000" owab="22.640" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="100" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.850" rsr="0.072" EDIAm="0.653" OPIA="0.000" owab="28.470" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="101" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.903" rsr="0.036" EDIAm="0.858" OPIA="100.000" owab="26.480" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="102" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.947" rsr="0.093" EDIAm="0.849" OPIA="100.000" owab="16.370" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="103" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.896" rsr="0.062" EDIAm="0.497" OPIA="0.000" owab="24.970" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="104" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.978" rsr="0.041" EDIAm="0.753" OPIA="0.000" owab="31.810" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="105" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.884" rsr="0.116" EDIAm="0.631" OPIA="0.000" owab="38.850" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="106" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.936" rsr="0.083" EDIAm="0.614" OPIA="0.000" owab="18.990" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="107" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.912" rsr="0.078" EDIAm="0.925" OPIA="100.000" owab="9.140" avgoccu="0.500" NatomsEDS="1" model="1" chain="A" resnum="108" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.907" rsr="0.050" EDIAm="0.554" OPIA="0.000" owab="37.270" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="109" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.895" rsr="0.056" EDIAm="0.697" OPIA="0.000" owab="33.690" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="110" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.970" rsr="0.061" EDIAm="0.305" OPIA="0.000" owab="28.850" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="111" said="C" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledEntityInstance bonds_rmsz="1.23" num_bonds_rmsz="614" angles_rmsz="1.17" num_angles_rmsz="829" absolute_sidechain_percentile="5.65" relative_sidechain_percentile="5.54" absolute_rama_percentile="100.00" relative_rama_percentile="100.00" absolute_RSRZ_percentile="100.00" relative_RSRZ_percentile="100.00" said="A" model="1" chain="A" ent="1"/>
	<programs>
		<program name="validation-pipeline" version="2.49" properties="pdbid,PDB-Rfree,PDB-R,extended_pdbid,PDB-revision-number,attemptedValidationSteps,percentilebins,PDB-resolution-low,PDB-revision-date,PDB-resolution,XMLcreationDate,PDB-deposition-date,protein-DNA-RNA-entities"/>
		<program name="molprobity" version="4-5-2 with Phenix2.0" properties="num-H-reduce,absolute_rama_percentile,rota,relative_rama_percentile,clash,angle-outlier,psi,flippable-sidechain,percent-rota-outliers,RestypesNotcheckedForBondAngleGeometry,percent-rama-outliers,relative_sidechain_percentile,bond-outlier,absolute_sidechain_percentile,angles_rmsz,rama,phi,bonds_rmsz,clashscore,num_angles_rmsz,num_bonds_rmsz"/>
		<program name="xtriage" version="2.0" properties="TwinL,numMillerIndices,WilsonBaniso,TransNCS,xtriage_input_columns,acentric_outliers,TwinL2,centric_outliers,WilsonBestimate,IoverSigma,DataAnisotropy"/>
		<program name="eds" version="3.0" properties="absolute_RSRZ_percentile,bulk_solvent_b,density-fitnessVersion,OPIA,bulk_solvent_k,rsr,owab,avgoccu,CCP4version,DataCompleteness,num-free-reflections,rsrz,EDS_resolution,relative_RSRZ_percentile,rscc,EDS_resolution_low,EDS_R,percent-free-reflections,EDIAm,Fo_Fc_correlation,percent-RSRZ-outliers,NatomsEDS"/>
		<program name="dcc" version="&quot;2.31  (2025-03-10))&quot;" properties="DCC_Rfree,DCC_refinement_program,DCC_R,B_factor_type"/>
		<program name="buster-report" version="wwPDB partial adaption of 1.1.7 (2018)" properties="ligands-for-buster-report"/>
		<program name="mogul" version="2022.3.0, CSD as543be (2022)" properties="mogul-torsion-outlier,mogul-angle-outlier,mogul_angles_rmsz,mogul-bond-outlier,mogul_rmsz_numbonds,mogul_rmsz_numangles,mogul_bonds_rmsz"/>
		<program name="percentiles" version="20250101.v01 (using entries in the PDB archive January 1st 2025)" properties="relative-percentile-percent-rama-outliers,relative-percentile-clashscore,numPDBids-relative-percentile-DCC_Rfree,numPDBids-relative-percentile-percent-rota-outliers,high-resol-relative-percentile-DCC_Rfree,numPDBids-absolute-percentile-clashscore,numPDBids-absolute-percentile-DCC_Rfree,absolute-percentile-percent-rota-outliers,absolute-percentile-percent-rama-outliers,high-resol-relative-percentile-percent-RSRZ-outliers,relative-percentile-percent-RSRZ-outliers,relative-percentile-percent-rota-outliers,numPDBids-absolute-percentile-percent-rama-outliers,low-resol-relative-percentile-percent-RSRZ-outliers,absolute-percentile-percent-RSRZ-outliers,numPDBids-relative-percentile-percent-rama-outliers,absolute-percentile-clashscore,low-resol-relative-percentile-percent-rota-outliers,numPDBids-absolute-percentile-percent-rota-outliers,high-resol-relative-percentile-percent-rota-outliers,numPDBids-relative-percentile-percent-RSRZ-outliers,low-resol-relative-percentile-percent-rama-outliers,low-resol-relative-percentile-DCC_Rfree,numPDBids-relative-percentile-clashscore,high-resol-relative-percentile-percent-rama-outliers,low-resol-relative-percentile-clashscore,absolute-percentile-DCC_Rfree,numPDBids-absolute-percentile-percent-RSRZ-outliers,high-resol-relative-percentile-clashscore,relative-percentile-DCC_Rfree"/>
	</programs>
</wwPDB-validation-information>
