<?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,1.796,xray" attemptedValidationSteps="molprobity,validation-pack,xtriage,eds,mogul,buster-report,percentiles,writexml" PDB-deposition-date="2016-03-14" PDB-revision-date="2024-10-16" PDB-revision-number="5" protein-DNA-RNA-entities="1" PDB-resolution="1.80" PDB-resolution-low="35.45" PDB-R="0.1670" PDB-Rfree="0.2092" pdbid="5IRS" extended_pdbid="5IRS" num-H-reduce="929" clashscore="3.19" RestypesNotcheckedForBondAngleGeometry="DTT" percent-rama-outliers="0.00" percent-rota-outliers="0.00" bonds_rmsz="0.70" num_bonds_rmsz="953" angles_rmsz="0.84" num_angles_rmsz="1282" TwinL="0.485" DataAnisotropy="0.414" xtriage_input_columns="intensity_meas,intensity_sigma" IoverSigma="0.69(1.79A)" WilsonBaniso="[39.301,25.900,31.816,0.000,0.000,0.000]" TwinL2="0.317" TransNCS="The largest off-origin peak in the Patterson function is 11.22% of the height of the origin peak. No significant pseudotranslation is detected." numMillerIndices="14838" WilsonBestimate="31.253" acentric_outliers="0" centric_outliers="0" CCP4version="9.0.010 (Gargrove)" EDS_resolution="1.80" num-free-reflections="1484" no-ligands-for-buster-report="yes" density-fitnessVersion="1.0.12" bulk_solvent_b="47.331" percent-RSRZ-outliers="7.27" EDS_resolution_low="35.45" DCC_R="0.1835" DataCompleteness="94.70" bulk_solvent_k="0.435" B_factor_type="FULL" DCC_Rfree="0.2174" percent-free-reflections="9.91" EDS_R="0.1816" Fo_Fc_correlation="0.968" DCC_refinement_program="PHENIX" absolute-percentile-clashscore="72.8" numPDBids-absolute-percentile-clashscore="190562" relative-percentile-clashscore="67.6" numPDBids-relative-percentile-clashscore="8479" low-resol-relative-percentile-clashscore="1.8" high-resol-relative-percentile-clashscore="1.8" 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="8391" low-resol-relative-percentile-percent-rama-outliers="1.8" high-resol-relative-percentile-percent-rama-outliers="1.8" absolute-percentile-percent-rota-outliers="100.0" numPDBids-absolute-percentile-percent-rota-outliers="187428" relative-percentile-percent-rota-outliers="100.0" numPDBids-relative-percentile-percent-rota-outliers="8390" low-resol-relative-percentile-percent-rota-outliers="1.8" high-resol-relative-percentile-percent-rota-outliers="1.8" absolute-percentile-percent-RSRZ-outliers="20.9" numPDBids-absolute-percentile-percent-RSRZ-outliers="180081" relative-percentile-percent-RSRZ-outliers="19.2" numPDBids-relative-percentile-percent-RSRZ-outliers="7663" low-resol-relative-percentile-percent-RSRZ-outliers="1.8" high-resol-relative-percentile-percent-RSRZ-outliers="1.8" absolute-percentile-DCC_Rfree="68.5" numPDBids-absolute-percentile-DCC_Rfree="180053" relative-percentile-DCC_Rfree="56.0" numPDBids-relative-percentile-DCC_Rfree="7662" low-resol-relative-percentile-DCC_Rfree="1.8" high-resol-relative-percentile-DCC_Rfree="1.8" XMLcreationDate="Mar  9, 2026 -- 09:36 PM UTC"/>
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	<ModelledSubgroup num-H-reduce="13" phi="-67.0" psi="144.4" rama="Favored" rota="mtm180" rsrz="-0.878" rsr="0.051" rscc="0.967" owab="30.390" avgoccu="1.000" EDIAm="1.010" OPIA="100.000" NatomsEDS="24" model="1" chain="A" resnum="43" said="A" ent="1" seq="42" icode=" " resname="ARG" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-68.1" psi="125.6" rama="Favored" rota="mttt" rsrz="0.028" rsr="0.099" rscc="0.964" owab="43.150" avgoccu="1.000" EDIAm="0.111" OPIA="66.670" NatomsEDS="22" model="1" chain="A" resnum="44" said="A" ent="1" seq="43" icode=" " resname="LYS" altcode=" "/>
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	<ModelledSubgroup num-H-reduce="6" phi="-94.6" psi="-28.8" rama="Favored" rota="mt-10" rsrz="-0.518" rsr="0.072" rscc="0.931" owab="35.730" avgoccu="1.000" EDIAm="0.932" OPIA="77.780" NatomsEDS="15" model="1" chain="A" resnum="70" said="A" ent="1" seq="69" icode=" " resname="GLU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="4" phi="-122.0" psi="135.5" rama="Favored" rota="m-30" rsrz="-0.637" rsr="0.054" rscc="0.970" owab="26.210" avgoccu="1.000" EDIAm="0.979" OPIA="100.000" NatomsEDS="12" model="1" chain="A" resnum="71" said="A" ent="1" seq="70" icode=" " resname="ASP" altcode=" "/>
	<ModelledSubgroup num-H-reduce="4" phi="-155.0" psi="103.3" rama="Favored" rota="t0" rsrz="-0.716" rsr="0.051" rscc="0.975" owab="29.990" avgoccu="1.000" EDIAm="0.978" OPIA="87.500" NatomsEDS="12" model="1" chain="A" resnum="72" said="A" ent="1" seq="71" icode=" " resname="ASP" altcode=" "/>
	<ModelledSubgroup num-H-reduce="11" phi="-118.0" psi="123.4" rama="Favored" rota="mt" rsrz="0.000" rsr="0.070" rscc="0.975" owab="35.700" avgoccu="1.000" EDIAm="0.681" OPIA="75.000" NatomsEDS="19" model="1" chain="A" resnum="73" said="A" ent="1" seq="72" icode=" " resname="LEU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="11" phi="-75.9" psi="124.3" rama="Favored" rota="mt" rsrz="-0.763" rsr="0.046" rscc="0.978" owab="29.210" avgoccu="1.000" EDIAm="0.937" OPIA="75.000" NatomsEDS="19" model="1" chain="A" resnum="74" said="A" ent="1" seq="73" icode=" " resname="ILE" altcode=" "/>
	<ModelledSubgroup num-H-reduce="11" phi="-123.0" psi="130.4" rama="Favored" rota="mm" rsrz="-0.119" rsr="0.065" rscc="0.966" owab="29.060" avgoccu="1.000" EDIAm="0.786" OPIA="75.000" NatomsEDS="19" model="1" chain="A" resnum="75" said="A" ent="1" seq="74" icode=" " resname="ILE" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-101.2" psi="159.0" rama="Favored" rota="m-80" rsrz="-0.093" rsr="0.061" rscc="0.967" owab="28.740" avgoccu="1.000" EDIAm="0.926" OPIA="81.820" NatomsEDS="20" model="1" chain="A" resnum="76" said="A" ent="1" seq="75" icode=" " resname="PHE" altcode=" "/>
	<ModelledSubgroup num-H-reduce="7" phi="-54.3" psi="133.8" rama="Favored" rota="Cg_exo" rsrz="-0.325" rsr="0.060" rscc="0.952" owab="33.460" avgoccu="1.000" EDIAm="0.937" OPIA="100.000" NatomsEDS="14" model="1" chain="A" resnum="77" said="A" ent="1" seq="76" icode=" " resname="PRO" altcode=" "/>
	<ModelledSubgroup num-H-reduce="4" phi="69.5" psi="6.9" rama="Favored" rota="m-30" rsrz="1.061" rsr="0.118" rscc="0.915" owab="52.600" avgoccu="1.000" EDIAm="0.119" OPIA="50.000" NatomsEDS="12" model="1" chain="A" resnum="78" said="A" ent="1" seq="77" icode=" " resname="ASP" altcode=" "/>
	<ModelledSubgroup num-H-reduce="4" phi="-70.5" psi="-33.5" rama="Favored" rota="m-30" rsrz="-0.318" rsr="0.066" rscc="0.954" owab="39.910" avgoccu="1.000" EDIAm="0.969" OPIA="100.000" NatomsEDS="12" model="1" chain="A" resnum="79" said="A" ent="1" seq="78" icode=" " resname="ASP" altcode=" "/>
	<ModelledSubgroup num-H-reduce="5" phi="-154.9" psi="168.2" rama="Favored" rota="m" rsrz="-0.172" rsr="0.056" rscc="0.979" owab="17.280" avgoccu="0.500" EDIAm="0.973" OPIA="90.580" NatomsEDS="22" model="1" chain="A" resnum="80" said="A" ent="1" seq="79" icode=" " resname="CYS" altcode="A">
		<clash atom="SG" dist="3.14" clashmag="0.41" cid="5"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="5" phi="-154.9" psi="168.2" rama="Favored" rota="m" rsrz="-0.172" rsr="0.056" rscc="0.979" owab="17.280" avgoccu="0.500" EDIAm="0.973" OPIA="90.580" NatomsEDS="22" model="1" chain="A" resnum="80" said="A" ent="1" seq="79" icode=" " resname="CYS" altcode="B">
		<clash atom="SG" dist="2.55" clashmag="0.46" cid="4"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="5" phi="-133.4" psi="139.3" rama="Favored" rota="tt0" rsrz="0.441" rsr="0.112" rscc="0.936" owab="40.660" avgoccu="1.000" EDIAm="0.297" OPIA="55.560" NatomsEDS="15" model="1" chain="A" resnum="81" said="A" ent="1" seq="80" icode=" " resname="GLU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-106.7" psi="124.1" rama="Favored" rota="t80" rsrz="-0.439" rsr="0.051" rscc="0.970" owab="26.070" avgoccu="1.000" EDIAm="0.986" OPIA="100.000" NatomsEDS="20" model="1" chain="A" resnum="82" said="A" ent="1" seq="81" icode=" " resname="PHE" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-148.5" psi="156.5" rama="Favored" rota="pttm" rsrz="-0.099" rsr="0.094" rscc="0.954" owab="46.060" avgoccu="1.000" EDIAm="0.142" OPIA="55.560" NatomsEDS="22" model="1" chain="A" resnum="83" said="A" ent="1" seq="82" icode=" " resname="LYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-67.9" psi="142.9" rama="Favored" rota="ttp80" rsrz="0.387" rsr="0.103" rscc="0.950" owab="48.440" avgoccu="1.000" EDIAm="0.193" OPIA="63.640" NatomsEDS="24" model="1" chain="A" resnum="84" said="A" ent="1" seq="83" icode=" " resname="ARG" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-94.2" psi="98.4" rama="Favored" rota="t" rsrz="-0.771" rsr="0.044" rscc="0.980" owab="29.820" avgoccu="1.000" EDIAm="0.922" OPIA="71.430" NatomsEDS="16" model="1" chain="A" resnum="85" said="A" ent="1" seq="84" icode=" " resname="VAL" altcode=" "/>
	<ModelledSubgroup num-H-reduce="7" phi="-61.1" psi="-31.9" rama="Favored" rota="Cg_endo" rsrz="0.294" rsr="0.080" rscc="0.941" owab="50.270" avgoccu="1.000" EDIAm="0.788" OPIA="42.860" NatomsEDS="14" model="1" chain="A" resnum="86" said="A" ent="1" seq="85" icode=" " resname="PRO" altcode=" "/>
	<ModelledSubgroup num-H-reduce="8" phi="-91.1" psi="8.6" rama="Favored" rota="mm110" rsrz="1.047" rsr="0.127" rscc="0.916" owab="57.040" avgoccu="1.000" EDIAm="0.148" OPIA="33.330" NatomsEDS="17" model="1" chain="A" resnum="87" said="A" ent="1" seq="86" icode=" " resname="GLN" altcode=" "/>
	<ModelledSubgroup num-H-reduce="4" phi="-85.1" psi="119.6" rama="Favored" rota="t" rsrz="0.620" rsr="0.080" rscc="0.956" owab="24.610" avgoccu="0.500" EDIAm="0.835" OPIA="66.670" NatomsEDS="20" model="1" chain="A" resnum="88" said="A" ent="1" seq="87" icode=" " resname="CYS" altcode="A"/>
	<ModelledSubgroup num-H-reduce="5" phi="-85.1" psi="119.6" rama="Favored" rota="t" rsrz="0.620" rsr="0.080" rscc="0.956" owab="24.610" avgoccu="0.500" EDIAm="0.835" OPIA="66.670" NatomsEDS="20" model="1" chain="A" resnum="88" said="A" ent="1" seq="87" icode=" " resname="CYS" altcode="B"/>
	<ModelledSubgroup num-H-reduce="7" phi="-56.8" psi="-20.0" rama="Favored" rota="Cg_exo" rsrz="1.099" rsr="0.106" rscc="0.902" owab="52.210" avgoccu="1.000" EDIAm="0.868" OPIA="85.710" NatomsEDS="14" model="1" chain="A" resnum="89" said="A" ent="1" seq="88" icode=" " resname="PRO" altcode=" "/>
	<ModelledSubgroup num-H-reduce="5" phi="-65.4" psi="-34.7" rama="Favored" rota="p" rsrz="2.096" rsr="0.149" rscc="0.820" owab="52.950" avgoccu="1.000" EDIAm="0.872" OPIA="83.330" NatomsEDS="11" model="1" chain="A" resnum="90" said="A" ent="1" seq="89" icode=" " resname="SER" altcode=" ">
		<clash atom="HB3" dist="2.60" clashmag="0.42" cid="3"/>
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	<ModelledSubgroup num-H-reduce="3" phi="68.5" psi="13.1" rama="Favored" rsrz="3.775" owab="57.400" avgoccu="1.000" rsr="0.194" EDIAm="0.766" OPIA="50.000" rscc="0.819" NatomsEDS="7" model="1" chain="A" resnum="91" said="A" ent="1" seq="90" icode=" " resname="GLY" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-121.0" psi="17.1" rama="Favored" rota="mtp180" rsrz="0.314" rsr="0.100" rscc="0.911" owab="35.860" avgoccu="1.000" EDIAm="0.906" OPIA="81.820" NatomsEDS="24" model="1" chain="A" resnum="92" said="A" ent="1" seq="91" icode=" " resname="ARG" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-97.0" psi="133.4" rama="Favored" rota="t" rsrz="-1.083" rsr="0.035" rscc="0.986" owab="22.810" avgoccu="1.000" EDIAm="0.987" OPIA="85.710" NatomsEDS="16" model="1" chain="A" resnum="93" said="A" ent="1" seq="92" icode=" " resname="VAL" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-125.1" psi="151.7" rama="Favored" rota="m-80" rsrz="-0.645" rsr="0.045" rscc="0.980" owab="24.510" avgoccu="1.000" EDIAm="0.972" OPIA="100.000" NatomsEDS="21" model="1" chain="A" resnum="94" said="A" ent="1" seq="93" icode=" " resname="TYR" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-127.0" psi="135.3" rama="Favored" rota="p" rsrz="-1.118" rsr="0.034" rscc="0.988" owab="25.680" avgoccu="1.000" EDIAm="0.963" OPIA="71.430" NatomsEDS="16" model="1" chain="A" resnum="95" said="A" ent="1" seq="94" icode=" " resname="VAL" altcode=" "/>
	<ModelledSubgroup num-H-reduce="11" phi="-95.4" psi="108.1" rama="Favored" rota="tp" rsrz="-0.533" rsr="0.054" rscc="0.975" owab="26.730" avgoccu="1.000" EDIAm="0.916" OPIA="87.500" NatomsEDS="19" model="1" chain="A" resnum="96" said="A" ent="1" seq="95" icode=" " resname="LEU" altcode=" ">
		<clash atom="HD11" dist="2.55" clashmag="0.46" cid="4"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="13" phi="-109.2" psi="125.2" rama="Favored" rota="tttm" rsrz="0.003" rsr="0.098" rscc="0.948" owab="43.330" avgoccu="1.000" EDIAm="0.362" OPIA="66.670" NatomsEDS="22" model="1" chain="A" resnum="97" said="A" ent="1" seq="96" icode=" " resname="LYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-84.8" psi="115.7" rama="Favored" rota="m-80" rsrz="0.772" rsr="0.086" rscc="0.955" owab="37.390" avgoccu="1.000" EDIAm="0.832" OPIA="63.640" NatomsEDS="20" model="1" chain="A" resnum="98" said="A" ent="1" seq="97" icode=" " resname="PHE" altcode=" ">
		<clash atom="CE2" dist="3.14" clashmag="0.41" cid="5"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="13" phi="-63.5" psi="-25.1" rama="Favored" rota="mttt" rsrz="1.420" rsr="0.154" rscc="0.786" owab="68.290" avgoccu="1.000" EDIAm="0.172" OPIA="44.440" NatomsEDS="22" model="1" chain="A" resnum="99" said="A" ent="1" seq="98" icode=" " resname="LYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="5" phi="-111.4" psi="115.1" rama="Favored" rsrz="2.683" owab="68.320" avgoccu="1.000" rsr="0.149" EDIAm="0.175" OPIA="40.000" rscc="0.876" NatomsEDS="10" model="1" chain="A" resnum="100" said="A" ent="1" seq="99" icode=" " resname="ALA" altcode=" "/>
	<ModelledSubgroup num-H-reduce="3" phi="101.9" psi="172.5" rama="Favored" rsrz="2.430" owab="74.770" avgoccu="1.000" rsr="0.148" EDIAm="0.800" OPIA="50.000" rscc="0.729" NatomsEDS="7" model="1" chain="A" resnum="101" said="A" ent="1" seq="100" icode=" " resname="GLY" altcode=" "/>
	<ModelledSubgroup num-H-reduce="5" phi="-91.3" psi="8.9" rama="Favored" rota="p" rsrz="1.385" rsr="0.123" rscc="0.798" owab="66.980" avgoccu="1.000" EDIAm="0.477" OPIA="33.330" NatomsEDS="11" model="1" chain="A" resnum="102" said="A" ent="1" seq="101" icode=" " resname="SER" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-70.6" psi="129.2" rama="Favored" rota="tttp" rsrz="0.965" rsr="0.136" rscc="0.930" owab="54.180" avgoccu="1.000" EDIAm="0.168" OPIA="44.440" NatomsEDS="22" model="1" chain="A" resnum="103" said="A" ent="1" seq="102" icode=" " resname="LYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-135.0" psi="141.8" rama="Favored" rota="mtt90" rsrz="0.071" rsr="0.090" rscc="0.932" owab="40.200" avgoccu="1.000" EDIAm="0.887" OPIA="90.910" NatomsEDS="24" model="1" chain="A" resnum="104" said="A" ent="1" seq="103" icode=" " resname="ARG" altcode=" "/>
	<ModelledSubgroup num-H-reduce="11" phi="-124.7" psi="126.1" rama="Favored" rota="mt" rsrz="0.367" rsr="0.081" rscc="0.965" owab="32.630" avgoccu="1.000" EDIAm="0.662" OPIA="75.000" NatomsEDS="19" model="1" chain="A" resnum="105" said="A" ent="1" seq="104" icode=" " resname="LEU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-100.8" psi="143.7" rama="Favored" rota="m-80" rsrz="-0.405" rsr="0.052" rscc="0.966" owab="24.010" avgoccu="1.000" EDIAm="0.992" OPIA="100.000" NatomsEDS="20" model="1" chain="A" resnum="106" said="A" ent="1" seq="105" icode=" " resname="PHE" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-137.1" psi="156.7" rama="Favored" rota="m-80" rsrz="-0.266" rsr="0.056" rscc="0.971" owab="22.850" avgoccu="1.000" EDIAm="0.948" OPIA="90.910" NatomsEDS="20" model="1" chain="A" resnum="107" said="A" ent="1" seq="106" icode=" " resname="PHE" altcode=" "/>
	<ModelledSubgroup num-H-reduce="10" phi="-131.5" psi="126.7" rama="Favored" rota="p-90" rsrz="-0.195" rsr="0.055" rscc="0.976" owab="25.980" avgoccu="1.000" EDIAm="1.001" OPIA="100.000" NatomsEDS="24" model="1" chain="A" resnum="108" said="A" ent="1" seq="107" icode=" " resname="TRP" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-62.7" psi="137.7" rama="Favored" rota="mmt" rsrz="-0.256" rsr="0.065" rscc="0.968" owab="29.750" avgoccu="1.000" EDIAm="0.831" OPIA="87.500" NatomsEDS="17" model="1" chain="A" resnum="109" said="A" ent="1" seq="108" icode=" " resname="MET" altcode=" "/>
	<ModelledSubgroup num-H-reduce="8" phi="-118.7" psi="3.9" rama="Favored" rota="mt0" rsrz="-0.623" rsr="0.060" rscc="0.958" owab="26.370" avgoccu="1.000" EDIAm="0.990" OPIA="100.000" NatomsEDS="17" model="1" chain="A" resnum="110" said="A" ent="1" seq="109" icode=" " resname="GLN" altcode=" "/>
	<ModelledSubgroup num-H-reduce="6" phi="-61.1" psi="135.8" rama="Favored" rota="mm-30" rsrz="0.201" rsr="0.102" rscc="0.915" owab="44.330" avgoccu="1.000" EDIAm="0.835" OPIA="66.670" NatomsEDS="15" model="1" chain="A" resnum="111" said="A" ent="1" seq="110" icode=" " resname="GLU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="7" phi="-61.3" psi="-41.3" rama="Favored" rota="Cg_endo" rsrz="2.183" rsr="0.141" rscc="0.839" owab="65.360" avgoccu="1.000" EDIAm="0.250" OPIA="57.140" NatomsEDS="14" model="1" chain="A" resnum="112" said="A" ent="1" seq="111" icode=" " resname="PRO" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-96.1" psi="147.0" rama="Favored" rota="mptt" rsrz="0.509" rsr="0.118" rscc="0.877" owab="77.930" avgoccu="1.000" EDIAm="0.048" OPIA="44.440" NatomsEDS="22" model="1" chain="A" resnum="113" said="A" ent="1" seq="112" icode=" " resname="LYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="7" phi="-83.6" psi="-9.2" rama="Favored" rota="p" rsrz="0.394" rsr="0.081" rscc="0.933" owab="46.090" avgoccu="1.000" EDIAm="0.760" OPIA="71.430" NatomsEDS="14" model="1" chain="A" resnum="114" said="A" ent="1" seq="113" icode=" " resname="THR" altcode=" "/>
	<ModelledSubgroup num-H-reduce="4" phi="-53.6" psi="-33.8" rama="Favored" rota="m-30" rsrz="1.353" rsr="0.129" rscc="0.875" owab="55.220" avgoccu="1.000" EDIAm="0.405" OPIA="75.000" NatomsEDS="12" model="1" chain="A" resnum="115" said="A" ent="1" seq="114" icode=" " resname="ASP" altcode=" "/>
	<ModelledSubgroup num-H-reduce="8" phi="-103.2" psi="5.8" rama="Favored" rota="mm110" rsrz="0.224" rsr="0.094" rscc="0.928" owab="47.930" avgoccu="1.000" EDIAm="0.531" OPIA="55.560" NatomsEDS="17" model="1" chain="A" resnum="116" said="A" ent="1" seq="115" icode=" " resname="GLN" altcode=" "/>
	<ModelledSubgroup num-H-reduce="4" phi="-56.9" psi="-48.8" rama="Favored" rota="m-30" rsrz="-0.716" rsr="0.051" rscc="0.969" owab="30.930" avgoccu="1.000" EDIAm="0.961" OPIA="100.000" NatomsEDS="12" model="1" chain="A" resnum="117" said="A" ent="1" seq="116" icode=" " resname="ASP" altcode=" "/>
	<ModelledSubgroup num-H-reduce="6" phi="-69.8" psi="-32.2" rama="Favored" rota="mm-30" rsrz="2.504" rsr="0.198" rscc="0.744" owab="18.350" avgoccu="0.500" EDIAm="0.347" OPIA="55.560" NatomsEDS="30" model="1" chain="A" resnum="118" said="A" ent="1" seq="117" icode=" " resname="GLU" altcode="A"/>
	<ModelledSubgroup num-H-reduce="6" phi="-69.8" psi="-32.2" rama="Favored" rota="mm-30" rsrz="2.504" rsr="0.198" rscc="0.744" owab="18.350" avgoccu="0.500" EDIAm="0.347" OPIA="55.560" NatomsEDS="30" model="1" chain="A" resnum="118" said="A" ent="1" seq="117" icode=" " resname="GLU" altcode="B"/>
	<ModelledSubgroup num-H-reduce="5" phi="-67.3" psi="-44.0" rama="Favored" rota="tp30" rsrz="-0.566" rsr="0.070" rscc="0.945" owab="32.410" avgoccu="1.000" EDIAm="1.022" OPIA="100.000" NatomsEDS="15" model="1" chain="A" resnum="119" said="A" ent="1" seq="118" icode=" " resname="GLU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="7" phi="-55.6" psi="-45.8" rama="Favored" rota="m170" rsrz="-0.169" rsr="0.064" rscc="0.964" owab="29.320" avgoccu="1.000" EDIAm="0.983" OPIA="100.000" NatomsEDS="18" model="1" chain="A" resnum="120" said="A" ent="1" seq="119" icode=" " resname="HIS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="5" phi="-60.6" psi="-43.1" rama="Favored" rota="t" rsrz="-0.832" rsr="0.036" rscc="0.982" owab="25.920" avgoccu="1.000" EDIAm="1.066" OPIA="100.000" NatomsEDS="11" model="1" chain="A" resnum="121" said="A" ent="1" seq="120" icode=" " resname="CYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-61.8" psi="-43.5" rama="Favored" rota="ttm110" rsrz="-0.465" rsr="0.068" rscc="0.959" owab="38.240" avgoccu="1.000" EDIAm="0.904" OPIA="81.820" NatomsEDS="24" model="1" chain="A" resnum="122" said="A" ent="1" seq="121" icode=" " resname="ARG" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-64.2" psi="-42.3" rama="Favored" rota="mttt" rsrz="-0.073" rsr="0.095" rscc="0.950" owab="43.170" avgoccu="1.000" EDIAm="0.243" OPIA="66.670" NatomsEDS="22" model="1" chain="A" resnum="123" said="A" ent="1" seq="122" icode=" " resname="LYS" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-52.3" psi="-52.0" rama="Favored" rota="t" rsrz="-0.111" rsr="0.063" rscc="0.957" owab="24.650" avgoccu="1.000" EDIAm="0.868" OPIA="71.430" NatomsEDS="16" model="1" chain="A" resnum="124" said="A" ent="1" seq="123" icode=" " resname="VAL" altcode=" "/>
	<ModelledSubgroup num-H-reduce="6" phi="-60.3" psi="-39.5" rama="Favored" rota="m-40" rsrz="-0.492" rsr="0.056" rscc="0.965" owab="29.360" avgoccu="1.000" EDIAm="1.000" OPIA="87.500" NatomsEDS="14" model="1" chain="A" resnum="125" said="A" ent="1" seq="124" icode=" " resname="ASN" altcode=" "/>
	<ModelledSubgroup num-H-reduce="6" phi="-65.2" psi="-46.1" rama="Favored" rota="mt-10" rsrz="-0.350" rsr="0.079" rscc="0.925" owab="36.070" avgoccu="1.000" EDIAm="0.886" OPIA="88.890" NatomsEDS="15" model="1" chain="A" resnum="126" said="A" ent="1" seq="125" icode=" " resname="GLU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-79.0" psi="-24.4" rama="Favored" rota="m-80" rsrz="0.549" rsr="0.080" rscc="0.949" owab="38.460" avgoccu="1.000" EDIAm="0.832" OPIA="50.000" NatomsEDS="21" model="1" chain="A" resnum="127" said="A" ent="1" seq="126" icode=" " resname="TYR" altcode=" "/>
	<ModelledSubgroup num-H-reduce="11" phi="-79.0" psi="-36.2" rama="Favored" rota="mt" rsrz="-0.300" rsr="0.061" rscc="0.961" owab="29.470" avgoccu="1.000" EDIAm="0.908" OPIA="75.000" NatomsEDS="19" model="1" chain="A" resnum="128" said="A" ent="1" seq="127" icode=" " resname="LEU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="6" phi="-110.7" psi="-11.1" rama="Favored" rota="m-40" rsrz="-0.011" rsr="0.074" rscc="0.927" owab="38.200" avgoccu="1.000" EDIAm="0.907" OPIA="87.500" NatomsEDS="14" model="1" chain="A" resnum="129" said="A" ent="1" seq="128" icode=" " resname="ASN" altcode=" "/>
	<ModelledSubgroup num-H-reduce="6" rota="m-40" rsrz="2.717" owab="63.600" avgoccu="1.000" rsr="0.176" EDIAm="0.155" OPIA="62.500" rscc="0.786" NatomsEDS="14" model="1" chain="A" resnum="130" said="A" ent="1" seq="129" icode=" " resname="ASN" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" ligand_clashes_outlier="yes" ligand_num_symm_clashes="0" ligand_num_clashes="4" rsr="0.172" mogul_rmsz_numbonds="7" rscc="0.529" owab="73.660" avgoccu="1.000" ligand_geometry_outlier="yes" EDIAm="0.032" OPIA="0.000" mogul_rmsz_numangles="4" mogul_bonds_rmsz="0.71" NatomsEDS="16" mogul_angles_rmsz="1.95" model="1" chain="A" resnum="201" said="B" ent="2" seq="." icode=" " resname="DTT" altcode=" ">
		<clash atom="S4" dist="2.48" clashmag="1.11" cid="0"/>
		<clash atom="S4" dist="2.70" clashmag="0.79" cid="1"/>
		<clash atom="S4" dist="2.38" clashmag="0.63" cid="2"/>
		<clash atom="S1" dist="2.60" clashmag="0.42" cid="3"/>
		<mog-angle-outlier atoms="C2,C1,S1" numobs="45" mean="114.43" stdev="2.79" mindiff="3.90" Zscore="2.20" obsval="120.58"/>
		<mog-angle-outlier atoms="O2,C2,C3" numobs="147" mean="109.57" stdev="2.10" mindiff="0.03" Zscore="3.15" obsval="116.20"/>
		<mog-torsion-outlier atoms="S1,C1,C2,O2" numobs="41" mean="44.90" stdev="17.42" mindiff="16.49" local_density="0.00" obsval="96.78"/>
		<mog-torsion-outlier atoms="S1,C1,C2,C3" numobs="32" mean="83.11" stdev="54.41" mindiff="20.52" local_density="0.00" obsval="-34.08"/>
		<mog-torsion-outlier atoms="C1,C2,C3,O3" numobs="68" mean="63.89" stdev="38.81" mindiff="30.44" local_density="0.00" obsval="-16.99"/>
		<mog-torsion-outlier atoms="C1,C2,C3,C4" numobs="47" mean="59.78" stdev="10.28" mindiff="33.05" local_density="0.00" obsval="108.72"/>
		<mog-torsion-outlier atoms="O2,C2,C3,O3" numobs="80" mean="72.30" stdev="25.33" mindiff="17.14" local_density="0.00" obsval="-143.66"/>
		<mog-torsion-outlier atoms="O2,C2,C3,C4" numobs="68" mean="62.93" stdev="38.81" mindiff="29.48" local_density="0.00" obsval="-17.95"/>
		<mog-torsion-outlier atoms="C2,C3,C4,S4" numobs="32" mean="54.06" stdev="29.97" mindiff="12.42" local_density="0.00" obsval="-146.51"/>
		<mog-torsion-outlier atoms="O3,C3,C4,S4" numobs="41" mean="62.90" stdev="46.51" mindiff="27.59" local_density="0.00" obsval="-21.37"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="10" owab="73.270" avgoccu="1.000" rsr="0.170" EDIAm="0.304" OPIA="25.000" mogul_rmsz_numbonds="7" mogul_rmsz_numangles="4" mogul_bonds_rmsz="0.69" rscc="0.779" NatomsEDS="18" mogul_angles_rmsz="1.28" model="1" chain="A" resnum="202" said="C" ent="2" seq="." icode=" " resname="DTT" altcode=" ">
		<clash atom="S4" dist="2.48" clashmag="1.11" cid="0"/>
		<clash atom="C4" dist="2.70" clashmag="0.79" cid="1"/>
		<clash atom="H42" dist="2.38" clashmag="0.63" cid="2"/>
		<mog-torsion-outlier atoms="C2,C3,C4,S4" numobs="32" mean="54.06" stdev="22.16" mindiff="20.46" local_density="0.00" obsval="-138.47"/>
		<mog-torsion-outlier atoms="O3,C3,C4,S4" numobs="41" mean="72.43" stdev="46.51" mindiff="37.12" local_density="0.00" obsval="-11.84"/>
	</ModelledSubgroup>
	<ModelledSubgroup rscc="0.854" rsr="0.143" EDIAm="0.151" OPIA="0.000" owab="53.240" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="301" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.895" rsr="0.161" EDIAm="0.377" OPIA="0.000" owab="46.580" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="302" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.931" rsr="0.168" EDIAm="0.257" OPIA="0.000" owab="33.760" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="303" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.910" rsr="0.110" EDIAm="0.476" OPIA="0.000" owab="40.210" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="304" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.894" rsr="0.116" EDIAm="0.435" OPIA="0.000" owab="46.870" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="305" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.865" rsr="0.115" EDIAm="0.426" OPIA="0.000" owab="43.310" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="306" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.834" rsr="0.113" EDIAm="0.733" OPIA="0.000" owab="54.340" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="307" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.911" rsr="0.095" EDIAm="0.672" OPIA="0.000" owab="34.730" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="308" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.785" rsr="0.137" EDIAm="0.330" OPIA="0.000" owab="54.270" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="309" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.948" rsr="0.103" EDIAm="0.364" OPIA="0.000" owab="35.580" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="310" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.930" rsr="0.096" EDIAm="0.469" OPIA="0.000" owab="44.720" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="311" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.862" rsr="0.174" EDIAm="0.156" OPIA="0.000" owab="47.340" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="312" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.947" rsr="0.185" EDIAm="0.758" OPIA="0.000" owab="46.820" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="313" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.958" rsr="0.112" EDIAm="0.599" OPIA="0.000" owab="33.820" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="314" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.854" rsr="0.121" EDIAm="0.628" OPIA="0.000" owab="36.810" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="315" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.979" rsr="0.084" EDIAm="0.720" OPIA="0.000" owab="26.550" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="316" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.945" rsr="0.079" EDIAm="0.731" OPIA="0.000" owab="25.530" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="317" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.968" rsr="0.053" EDIAm="0.864" OPIA="100.000" owab="28.330" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="318" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.966" rsr="0.112" EDIAm="0.484" OPIA="0.000" owab="39.800" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="319" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.819" rsr="0.129" EDIAm="0.299" OPIA="0.000" owab="42.620" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="320" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.887" rsr="0.098" EDIAm="0.685" OPIA="0.000" owab="32.570" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="321" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.849" rsr="0.143" EDIAm="0.601" OPIA="0.000" owab="52.000" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="322" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.950" rsr="0.068" EDIAm="0.882" OPIA="100.000" owab="25.610" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="323" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.955" rsr="0.087" EDIAm="0.763" OPIA="0.000" owab="27.640" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="324" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.955" rsr="0.060" EDIAm="0.870" OPIA="100.000" owab="21.730" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="325" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.959" rsr="0.127" EDIAm="0.504" OPIA="0.000" owab="42.440" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="326" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.847" rsr="0.171" EDIAm="0.477" OPIA="0.000" owab="39.170" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="327" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.822" rsr="0.175" EDIAm="0.172" OPIA="0.000" owab="39.010" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="328" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.924" rsr="0.129" EDIAm="0.255" OPIA="0.000" owab="42.220" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="329" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.908" rsr="0.106" EDIAm="0.673" OPIA="0.000" owab="28.310" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="330" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.969" rsr="0.046" EDIAm="0.939" OPIA="100.000" owab="22.820" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="331" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.965" rsr="0.104" EDIAm="0.797" OPIA="0.000" owab="29.720" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="332" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.929" rsr="0.070" EDIAm="0.693" OPIA="0.000" owab="37.410" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="333" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.835" rsr="0.178" EDIAm="0.377" OPIA="0.000" owab="45.270" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="334" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.806" rsr="0.184" EDIAm="0.000" OPIA="0.000" owab="50.560" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="335" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.911" rsr="0.102" EDIAm="0.593" OPIA="0.000" owab="39.220" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="336" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.974" rsr="0.066" EDIAm="0.671" OPIA="0.000" owab="40.000" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="337" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.917" rsr="0.147" EDIAm="0.119" OPIA="0.000" owab="41.870" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="338" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.889" rsr="0.100" EDIAm="0.754" OPIA="0.000" owab="31.740" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="339" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.878" rsr="0.158" EDIAm="0.699" OPIA="0.000" owab="52.250" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="340" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.931" rsr="0.108" EDIAm="0.852" OPIA="100.000" owab="33.460" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="341" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.910" rsr="0.138" EDIAm="0.890" OPIA="100.000" owab="37.050" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="342" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.894" rsr="0.203" EDIAm="0.440" OPIA="0.000" owab="33.400" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="343" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.946" rsr="0.052" EDIAm="0.940" OPIA="100.000" owab="35.370" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="344" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.950" rsr="0.104" EDIAm="0.373" OPIA="0.000" owab="37.990" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="345" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.899" rsr="0.156" EDIAm="0.410" OPIA="0.000" owab="38.730" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="346" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.934" rsr="0.088" EDIAm="0.798" OPIA="0.000" owab="34.900" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="347" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.876" rsr="0.188" EDIAm="0.066" OPIA="0.000" owab="44.130" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="348" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.948" rsr="0.087" EDIAm="0.065" OPIA="0.000" owab="48.710" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="349" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.889" rsr="0.091" EDIAm="0.573" OPIA="0.000" owab="44.100" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="350" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.973" rsr="0.077" EDIAm="1.016" OPIA="100.000" owab="24.390" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="351" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.890" rsr="0.113" EDIAm="0.284" OPIA="0.000" owab="50.460" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="352" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.858" rsr="0.117" EDIAm="0.588" OPIA="0.000" owab="41.640" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="353" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.839" rsr="0.108" EDIAm="0.116" OPIA="0.000" owab="56.150" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="354" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.927" rsr="0.121" EDIAm="0.227" OPIA="0.000" owab="43.460" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="355" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.862" rsr="0.190" EDIAm="0.475" OPIA="0.000" owab="38.360" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="356" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.747" rsr="0.175" EDIAm="0.000" OPIA="0.000" owab="54.610" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="357" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.898" rsr="0.290" EDIAm="0.796" OPIA="0.000" owab="50.000" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="358" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.886" rsr="0.107" EDIAm="0.232" OPIA="0.000" owab="45.090" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="359" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.890" rsr="0.118" EDIAm="0.900" OPIA="100.000" owab="33.470" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="360" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.717" rsr="0.185" EDIAm="0.309" OPIA="0.000" owab="50.920" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="361" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.811" rsr="0.078" EDIAm="0.000" OPIA="0.000" owab="62.540" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="362" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.631" rsr="0.126" EDIAm="0.159" OPIA="0.000" owab="52.220" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="363" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.884" rsr="0.114" EDIAm="0.191" OPIA="0.000" owab="49.160" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="364" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.786" rsr="0.189" EDIAm="0.123" OPIA="0.000" owab="57.600" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="365" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.946" rsr="0.106" EDIAm="0.222" OPIA="0.000" owab="52.020" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="366" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledSubgroup rscc="0.931" rsr="0.104" EDIAm="0.401" OPIA="0.000" owab="43.670" avgoccu="1.000" NatomsEDS="1" model="1" chain="A" resnum="367" said="D" ent="3" seq="." icode=" " resname="HOH" altcode=" "/>
	<ModelledEntityInstance bonds_rmsz="0.70" num_bonds_rmsz="953" angles_rmsz="0.84" num_angles_rmsz="1282" absolute_sidechain_percentile="100.00" relative_sidechain_percentile="100.00" absolute_rama_percentile="100.00" relative_rama_percentile="100.00" absolute_RSRZ_percentile="20.90" relative_RSRZ_percentile="19.25" said="A" model="1" chain="A" ent="1"/>
	<programs>
		<program name="validation-pipeline" version="2.49" properties="percentilebins,protein-DNA-RNA-entities,PDB-resolution-low,PDB-Rfree,attemptedValidationSteps,pdbid,PDB-revision-date,PDB-deposition-date,PDB-resolution,PDB-R,XMLcreationDate,PDB-revision-number,extended_pdbid"/>
		<program name="molprobity" version="4-5-2 with Phenix2.0" properties="ligand_clashes_outlier,num_bonds_rmsz,relative_rama_percentile,phi,absolute_sidechain_percentile,RestypesNotcheckedForBondAngleGeometry,clashscore,bonds_rmsz,psi,absolute_rama_percentile,clash,rama,num_angles_rmsz,relative_sidechain_percentile,bond-outlier,angle-outlier,percent-rama-outliers,percent-rota-outliers,rota,angles_rmsz,ligand_num_clashes,ligand_num_symm_clashes,num-H-reduce"/>
		<program name="xtriage" version="2.0" properties="TransNCS,WilsonBaniso,WilsonBestimate,TwinL,acentric_outliers,DataAnisotropy,centric_outliers,xtriage_input_columns,TwinL2,numMillerIndices,IoverSigma"/>
		<program name="eds" version="3.0" properties="rsrz,EDS_resolution,CCP4version,num-free-reflections,bulk_solvent_b,EDIAm,density-fitnessVersion,OPIA,percent-RSRZ-outliers,NatomsEDS,EDS_resolution_low,absolute_RSRZ_percentile,DataCompleteness,bulk_solvent_k,rsr,percent-free-reflections,rscc,EDS_R,avgoccu,owab,Fo_Fc_correlation,relative_RSRZ_percentile"/>
		<program name="buster-report" version="unknown" properties="no-ligands-for-buster-report"/>
		<program name="mogul" version="2022.3.0, CSD as543be (2022)" properties="mogul-angle-outlier,ligand_geometry_outlier,mogul_bonds_rmsz,mogul-torsion-outlier,mogul-bond-outlier,mogul_rmsz_numangles,mogul_rmsz_numbonds,mogul_angles_rmsz"/>
		<program name="dcc" version="&quot;2.31  (2025-03-10))&quot;" properties="B_factor_type,DCC_refinement_program,DCC_Rfree,DCC_R"/>
		<program name="percentiles" version="20250101.v01 (using entries in the PDB archive January 1st 2025)" properties="low-resol-relative-percentile-percent-RSRZ-outliers,absolute-percentile-clashscore,numPDBids-relative-percentile-percent-rota-outliers,numPDBids-absolute-percentile-percent-RSRZ-outliers,absolute-percentile-percent-RSRZ-outliers,numPDBids-relative-percentile-percent-rama-outliers,numPDBids-absolute-percentile-clashscore,relative-percentile-percent-RSRZ-outliers,numPDBids-relative-percentile-DCC_Rfree,numPDBids-absolute-percentile-percent-rama-outliers,absolute-percentile-DCC_Rfree,absolute-percentile-percent-rama-outliers,relative-percentile-percent-rama-outliers,high-resol-relative-percentile-percent-rama-outliers,relative-percentile-DCC_Rfree,numPDBids-relative-percentile-percent-RSRZ-outliers,low-resol-relative-percentile-DCC_Rfree,relative-percentile-percent-rota-outliers,high-resol-relative-percentile-clashscore,numPDBids-absolute-percentile-DCC_Rfree,numPDBids-absolute-percentile-percent-rota-outliers,relative-percentile-clashscore,low-resol-relative-percentile-clashscore,numPDBids-relative-percentile-clashscore,low-resol-relative-percentile-percent-rota-outliers,low-resol-relative-percentile-percent-rama-outliers,high-resol-relative-percentile-DCC_Rfree,absolute-percentile-percent-rota-outliers,high-resol-relative-percentile-percent-rota-outliers,high-resol-relative-percentile-percent-RSRZ-outliers"/>
	</programs>
</wwPDB-validation-information>
