<?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_v002.xsd">
	<Entry B_factor_type="FULL" CCP4version="7.0 (Gargrove)" DCC_R="0.15" DCC_Rfree="0.18" DCC_refinement_program="REFMAC" DataAnisotropy="0.023" DataCompleteness="98.93" EDS_R="0.17" EDS_resolution="1.45" EDS_resolution_low="29.96" Fo_Fc_correlation="0.973" IoverSigma="2.29(1.45A)" PDB-R="0.15" PDB-Rfree="0.18" PDB-deposition-date="2014-01-04" PDB-resolution="1.45" PDB-resolution-low="46.00" PDB-revision-date="2017-11-22" PDB-revision-number="2" RefmacVersion="5.8.0158" RestypesNotcheckedForBondAngleGeometry="CLM,SO4,EDO" TransNCS="The largest off-origin peak in the Patterson function is 6.80% of the height of the origin peak. No significant pseudotranslation is detected." TwinL="0.497" TwinL2="0.331" WilsonBaniso="[20.519,20.975,20.492,0.000,0.000,0.000]" WilsonBestimate="20.654" XMLcreationDate="Mar 14, 2018 -- 09:14 am GMT" absolute-percentile-DCC_Rfree="94.0" absolute-percentile-clashscore="84.6" absolute-percentile-percent-RSRZ-outliers="76.8" absolute-percentile-percent-rama-outliers="100.0" absolute-percentile-percent-rota-outliers="83.2" acentric_outliers="0" angles_rmsz="1.03" attemptedValidationSteps="mogul,molprobity,validation-pack,xtriage,eds,percentiles,writexml" babinet_b="141.289" babinet_k="0.288" bonds_rmsz="0.93" bulk_solvent_b="46.332" bulk_solvent_k="0.361" centric_outliers="0" clashscore="2.46" high-resol-relative-percentile-DCC_Rfree="1.44" high-resol-relative-percentile-clashscore="1.44" high-resol-relative-percentile-percent-RSRZ-outliers="1.44" high-resol-relative-percentile-percent-rama-outliers="1.44" high-resol-relative-percentile-percent-rota-outliers="1.44" low-resol-relative-percentile-DCC_Rfree="1.48" low-resol-relative-percentile-clashscore="1.48" low-resol-relative-percentile-percent-RSRZ-outliers="1.48" low-resol-relative-percentile-percent-rama-outliers="1.48" low-resol-relative-percentile-percent-rota-outliers="1.48" num-H-reduce="1407" num-free-reflections="1584" numMillerIndices="31292" numPDBids-absolute-percentile-DCC_Rfree="111664" numPDBids-absolute-percentile-clashscore="122126" numPDBids-absolute-percentile-percent-RSRZ-outliers="108989" numPDBids-absolute-percentile-percent-rama-outliers="120053" numPDBids-absolute-percentile-percent-rota-outliers="120020" numPDBids-relative-percentile-DCC_Rfree="1761" numPDBids-relative-percentile-clashscore="1816" numPDBids-relative-percentile-percent-RSRZ-outliers="1733" numPDBids-relative-percentile-percent-rama-outliers="1793" numPDBids-relative-percentile-percent-rota-outliers="1793" num_angles_rmsz="1877" num_bonds_rmsz="1386" pdbid="4OAD" percent-RSRZ-outliers="1.25" percent-free-reflections="5.06" percent-rama-outliers="0.00" percent-rota-outliers="0.83" percentilebins="all,1.45,xray" protein-DNA-RNA-entities="1" relative-percentile-DCC_Rfree="77.4" relative-percentile-clashscore="73.1" relative-percentile-percent-RSRZ-outliers="76.3" relative-percentile-percent-rama-outliers="100.0" relative-percentile-percent-rota-outliers="62.2" xtriage_input_columns="F_meas_au,F_meas_sigma_au"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="58.550" resname="HIS" resnum="0" rscc="0.519" rsr="0.266" rsrz="3.489" said="A" seq="2"/>
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	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="18.760" phi="-63.1" psi="146.6" rama="Favored" resname="ALA" resnum="8" rscc="0.978" rsr="0.049" rsrz="-0.816" said="A" seq="10"/>
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	<ModelledSubgroup NatomsEDS="11" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="19.690" phi="-61.1" psi="-47.9" rama="Favored" resname="LEU" resnum="13" rota="mt" rscc="0.965" rsr="0.093" rsrz="0.123" said="A" seq="15">
		<angle-outlier atom0="CB" atom1="CG" atom2="CD2" mean="111.000" obs="120.735" stdev="1.700" z="5.73"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="11" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="19.690" phi="-61.1" psi="-47.9" rama="Favored" resname="LEU" resnum="13" rota="mt" rscc="0.965" rsr="0.093" rsrz="0.123" said="A" seq="15">
		<angle-outlier atom0="CB" atom1="CG" atom2="CD2" mean="111.000" obs="120.735" stdev="1.700" z="5.73"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="15" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="22.340" phi="-61.6" psi="-40.9" rama="Favored" resname="GLU" resnum="14" rota="tp10" rscc="0.964" rsr="0.105" rsrz="-0.200" said="A" seq="16"/>
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		<clash atom="HB2" cid="4" clashmag="0.43" dist="2.00"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="20.030" phi="-66.2" psi="-38.7" rama="Favored" resname="LEU" resnum="103" rota="tp" rscc="0.933" rsr="0.107" rsrz="0.545" said="A" seq="105"/>
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	<ModelledSubgroup NatomsEDS="19" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="26.740" phi="-66.4" psi="-45.5" rama="Favored" resname="ARG" resnum="105" rota="mtm-85" rscc="0.948" rsr="0.117" rsrz="0.175" said="A" seq="107"/>
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	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="24.410" phi="-107.2" psi="-0.1" rama="Favored" resname="TYR" resnum="108" rota="m-85" rscc="0.922" rsr="0.091" rsrz="0.320" said="A" seq="110"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="23.660" phi="52.2" psi="37.4" rama="Favored" resname="LYS" resnum="109" rota="mmtt" rscc="0.947" rsr="0.081" rsrz="-0.657" said="A" seq="111"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="17.870" phi="-70.3" psi="142.1" rama="Favored" resname="ALA" resnum="110" rscc="0.978" rsr="0.047" rsrz="-0.865" said="A" seq="112"/>
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		<angle-outlier atom0="NE" atom1="CZ" atom2="NH2" mean="120.300" obs="117.340" stdev="0.500" z="-5.92"/>
		<angle-outlier atom0="NE" atom1="CZ" atom2="NH1" mean="120.300" obs="122.857" stdev="0.500" z="5.12"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="18.650" phi="-145.3" psi="141.9" rama="Favored" resname="LEU" resnum="112" rota="tp" rscc="0.980" rsr="0.063" rsrz="-0.780" said="A" seq="114"/>
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	<ModelledSubgroup NatomsEDS="16" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="19.060" phi="-144.1" psi="126.2" rama="Favored" resname="ILE" resnum="115" rota="mt" rscc="0.976" rsr="0.101" rsrz="0.399" said="A" seq="117">
		<clash atom="CG2" cid="5" clashmag="0.41" dist="2.65"/>
		<clash atom="HG23" cid="0" clashmag="0.63" dist="1.99"/>
		<clash atom="O" cid="0" clashmag="0.63" dist="1.99"/>
		<clash atom="O" cid="5" clashmag="0.41" dist="2.65"/>
		<clash atom="HD13" cid="3" clashmag="0.51" dist="1.92"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="20.380" phi="-109.0" psi="132.4" rama="Favored" resname="SER" resnum="116" rota="m" rscc="0.943" rsr="0.092" rsrz="0.080" said="A" seq="118"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="14.830" phi="-56.5" psi="-33.2" rama="Favored" resname="ASN" resnum="119" rota="p-10" rscc="0.951" rsr="0.105" rsrz="0.241" said="A" seq="121"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="16.010" phi="-73.2" psi="-17.6" rama="Favored" resname="ALA" resnum="120" rscc="0.980" rsr="0.101" rsrz="0.458" said="A" seq="122"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="17.490" phi="-84.3" psi="69.0" rama="Favored" resname="ASN" resnum="121" rota="t-20" rscc="0.969" rsr="0.072" rsrz="-0.391" said="A" seq="123"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="16.730" phi="-55.0" psi="-42.1" rama="Favored" resname="ALA" resnum="122" rscc="0.976" rsr="0.085" rsrz="0.066" said="A" seq="124"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="18.880" phi="-55.5" psi="-43.9" rama="Favored" resname="ALA" resnum="123" rscc="0.976" rsr="0.118" rsrz="0.875" said="A" seq="125"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="16.820" phi="-67.2" psi="-43.2" rama="Favored" resname="GLY" resnum="124" rscc="0.979" rsr="0.105" rsrz="0.497" said="A" seq="126"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="16.070" phi="-60.4" psi="-39.8" rama="Favored" resname="LEU" resnum="125" rota="mt" rscc="0.974" rsr="0.126" rsrz="1.117" said="A" seq="127"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="17.970" phi="-73.3" psi="-38.5" rama="Favored" resname="LEU" resnum="126" rota="mt" rscc="0.976" rsr="0.088" rsrz="-0.027" said="A" seq="128"/>
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	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="17.220" phi="-60.0" psi="-45.1" rama="Favored" resname="THR" resnum="129" rota="m" rscc="0.981" rsr="0.049" rsrz="-0.826" said="A" seq="131"/>
	<ModelledSubgroup NatomsEDS="15" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="8" owab="26.010" phi="-60.9" psi="-30.9" rama="Favored" resname="GLN" resnum="130" rota="tt0" rscc="0.964" rsr="0.100" rsrz="-0.088" said="A" seq="132"/>
	<ModelledSubgroup NatomsEDS="15" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="8" owab="26.010" phi="-60.9" psi="-30.9" rama="Favored" resname="GLN" resnum="130" rota="tt0" rscc="0.964" rsr="0.100" rsrz="-0.088" said="A" seq="132"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="20.440" phi="-86.2" psi="1.9" rama="Favored" resname="LEU" resnum="131" rota="mt" rscc="0.967" rsr="0.087" rsrz="-0.057" said="A" seq="133"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="19.860" phi="101.0" psi="3.3" rama="Favored" resname="GLY" resnum="132" rscc="0.957" rsr="0.063" rsrz="-0.391" said="A" seq="134"/>
	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="16.810" phi="-75.4" psi="140.4" rama="Favored" resname="TYR" resnum="133" rota="m-85" rscc="0.975" rsr="0.055" rsrz="-0.788" said="A" seq="135"/>
	<ModelledSubgroup NatomsEDS="15" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="8" owab="22.450" phi="-120.1" psi="147.4" rama="Favored" resname="GLN" resnum="134" rota="mt-30" rscc="0.946" rsr="0.116" rsrz="0.193" said="A" seq="136"/>
	<ModelledSubgroup NatomsEDS="15" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="8" owab="22.450" phi="-120.1" psi="147.4" rama="Favored" resname="GLN" resnum="134" rota="mt-30" rscc="0.946" rsr="0.116" rsrz="0.193" said="A" seq="136"/>
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	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="22.030" phi="-117.3" psi="-38.0" rama="Favored" resname="ARG" resnum="136" rota="mmt180" rscc="0.956" rsr="0.077" rsrz="-0.517" said="A" seq="138"/>
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	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="19.000" phi="80.4" psi="14.3" rama="Favored" resname="GLY" resnum="146" rscc="0.975" rsr="0.057" rsrz="-0.518" said="A" seq="148"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="20.790" phi="-89.7" psi="144.8" rama="Favored" resname="ARG" resnum="147" rota="mtt85" rscc="0.971" rsr="0.052" rsrz="-0.950" said="A" seq="149"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="24.670" phi="-78.2" psi="131.0" rama="Favored" resname="ARG" resnum="148" rota="mtp180" rscc="0.947" rsr="0.082" rsrz="-0.431" said="A" seq="150">
		<angle-outlier atom0="NE" atom1="CZ" atom2="NH1" mean="120.300" obs="117.712" stdev="0.500" z="-5.17"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="16.960" phi="-126.5" psi="166.3" rama="Favored" resname="VAL" resnum="149" rota="m" rscc="0.968" rsr="0.093" rsrz="0.210" said="A" seq="151"/>
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	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="2" icode=" " model="1" mogul_angles_rmsz="0.16" mogul_bonds_rmsz="0.88" mogul_rmsz_numangles="6" mogul_rmsz_numbonds="4" owab="21.520" resname="SO4" resnum="201" rscc="0.989" rsr="0.044" said="B" seq="."/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="0.900" chain="A" ent="2" icode=" " model="1" mogul_angles_rmsz="0.80" mogul_bonds_rmsz="0.52" mogul_rmsz_numangles="6" mogul_rmsz_numbonds="4" owab="37.280" resname="SO4" resnum="202" rscc="0.979" rsr="0.149" said="C" seq="."/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="2" icode=" " model="1" mogul_angles_rmsz="0.46" mogul_bonds_rmsz="0.47" mogul_rmsz_numangles="6" mogul_rmsz_numbonds="4" owab="51.390" resname="SO4" resnum="203" rscc="0.938" rsr="0.157" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="5" altcode="A" avgoccu="0.700" chain="A" ent="2" icode=" " model="1" mogul_angles_rmsz="0.43" mogul_bonds_rmsz="0.49" mogul_rmsz_numangles="6" mogul_rmsz_numbonds="4" owab="57.760" resname="SO4" resnum="204" rscc="0.901" rsr="0.180" said="E" seq="."/>
	<ModelledSubgroup NatomsEDS="20" altcode="A" avgoccu="0.700" chain="A" ent="3" icode=" " model="1" mogul_angles_rmsz="0.45" mogul_bonds_rmsz="0.66" mogul_rmsz_numangles="22" mogul_rmsz_numbonds="19" num-H-reduce="11" owab="23.380" resname="CLM" resnum="205" rscc="0.764" rsr="0.231" said="F" seq=".">
		<mog-bond-outlier Zscore="2.67" atoms="C2,N2" mean="1.34" mindiff="0.00" numobs="6590" obsval="1.39" stdev="0.02"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="20" altcode=" " avgoccu="0.900" chain="A" ent="3" icode=" " model="1" mogul_angles_rmsz="0.47" mogul_bonds_rmsz="0.66" mogul_rmsz_numangles="22" mogul_rmsz_numbonds="19" num-H-reduce="11" owab="39.760" resname="CLM" resnum="206" rscc="0.791" rsr="0.256" said="G" seq=".">
		<clash atom="H5" cid="4" clashmag="0.43" dist="2.00"/>
		<mog-bond-outlier Zscore="2.69" atoms="C2,N2" mean="1.34" mindiff="0.00" numobs="6590" obsval="1.40" stdev="0.02"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" mogul_angles_rmsz="0.61" mogul_bonds_rmsz="0.23" mogul_rmsz_numangles="2" mogul_rmsz_numbonds="3" num-H-reduce="6" owab="47.140" resname="EDO" resnum="207" rscc="0.895" rsr="0.113" said="H" seq="."/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" mogul_angles_rmsz="0.34" mogul_bonds_rmsz="0.70" mogul_rmsz_numangles="2" mogul_rmsz_numbonds="3" num-H-reduce="6" owab="26.230" resname="EDO" resnum="208" rscc="0.952" rsr="0.094" said="I" seq="."/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" mogul_angles_rmsz="0.17" mogul_bonds_rmsz="0.54" mogul_rmsz_numangles="2" mogul_rmsz_numbonds="3" num-H-reduce="6" owab="44.850" resname="EDO" resnum="209" rscc="0.904" rsr="0.207" said="J" seq="."/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" mogul_angles_rmsz="0.74" mogul_bonds_rmsz="0.34" mogul_rmsz_numangles="2" mogul_rmsz_numbonds="3" num-H-reduce="6" owab="52.100" resname="EDO" resnum="210" rscc="0.877" rsr="0.113" said="K" seq="."/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" mogul_angles_rmsz="0.99" mogul_bonds_rmsz="0.56" mogul_rmsz_numangles="2" mogul_rmsz_numbonds="3" num-H-reduce="6" owab="41.420" resname="EDO" resnum="211" rscc="0.908" rsr="0.161" said="L" seq="."/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" mogul_angles_rmsz="0.87" mogul_bonds_rmsz="0.46" mogul_rmsz_numangles="2" mogul_rmsz_numbonds="3" num-H-reduce="6" owab="49.070" resname="EDO" resnum="212" rscc="0.768" rsr="0.267" said="M" seq="."/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" mogul_angles_rmsz="0.68" mogul_bonds_rmsz="0.40" mogul_rmsz_numangles="2" mogul_rmsz_numbonds="3" num-H-reduce="6" owab="33.620" resname="EDO" resnum="213" rscc="0.896" rsr="0.149" said="N" seq="."/>
	<ModelledSubgroup NatomsEDS="4" altcode="A" avgoccu="0.700" chain="A" ent="4" icode=" " model="1" mogul_angles_rmsz="0.46" mogul_bonds_rmsz="1.09" mogul_rmsz_numangles="2" mogul_rmsz_numbonds="3" num-H-reduce="6" owab="23.850" resname="EDO" resnum="214" rscc="0.935" rsr="0.331" said="O" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.130" resname="HOH" resnum="301" rscc="0.990" rsr="0.166" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.160" resname="HOH" resnum="302" rscc="0.986" rsr="0.123" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.280" resname="HOH" resnum="303" rscc="0.973" rsr="0.163" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.200" resname="HOH" resnum="304" rscc="0.992" rsr="0.086" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.280" resname="HOH" resnum="305" rscc="0.988" rsr="0.069" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.230" resname="HOH" resnum="306" rscc="0.980" rsr="0.085" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.380" resname="HOH" resnum="307" rscc="0.968" rsr="0.183" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.250" resname="HOH" resnum="308" rscc="0.937" rsr="0.065" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.670" resname="HOH" resnum="309" rscc="0.920" rsr="0.087" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.630" resname="HOH" resnum="310" rscc="0.984" rsr="0.082" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.500" resname="HOH" resnum="311" rscc="0.977" rsr="0.106" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.380" resname="HOH" resnum="312" rscc="0.988" rsr="0.096" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.750" resname="HOH" resnum="313" rscc="0.963" rsr="0.068" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.050" resname="HOH" resnum="314" rscc="0.939" rsr="0.096" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.310" resname="HOH" resnum="315" rscc="0.919" rsr="0.078" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.750" resname="HOH" resnum="316" rscc="0.963" rsr="0.087" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="25.040" resname="HOH" resnum="317" rscc="0.912" rsr="0.175" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.800" resname="HOH" resnum="318" rscc="0.983" rsr="0.065" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="25.230" resname="HOH" resnum="319" rscc="0.984" rsr="0.071" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.470" resname="HOH" resnum="320" rscc="0.894" rsr="0.126" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.570" resname="HOH" resnum="321" rscc="0.982" rsr="0.044" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.400" resname="HOH" resnum="322" rscc="0.956" rsr="0.117" said="P" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.530" resname="HOH" resnum="329" rscc="0.938" rsr="0.063" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.380" resname="HOH" resnum="330" rscc="0.888" rsr="0.092" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.160" resname="HOH" resnum="331" rscc="0.972" rsr="0.191" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="34.140" resname="HOH" resnum="332" rscc="0.936" rsr="0.178" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.300" resname="HOH" resnum="333" rscc="0.934" rsr="0.098" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.490" resname="HOH" resnum="334" rscc="0.903" rsr="0.097" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.530" resname="HOH" resnum="335" rscc="0.981" rsr="0.065" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.160" resname="HOH" resnum="336" rscc="0.971" rsr="0.139" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="25.000" resname="HOH" resnum="337" rscc="0.979" rsr="0.121" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.500" resname="HOH" resnum="338" rscc="0.891" rsr="0.141" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.620" resname="HOH" resnum="339" rscc="0.965" rsr="0.154" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.010" resname="HOH" resnum="340" rscc="0.879" rsr="0.101" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.870" resname="HOH" resnum="341" rscc="0.964" rsr="0.061" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="25.860" resname="HOH" resnum="342" rscc="0.974" rsr="0.100" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.700" resname="HOH" resnum="343" rscc="0.946" rsr="0.080" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.980" resname="HOH" resnum="344" rscc="0.943" rsr="0.150" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.700" resname="HOH" resnum="345" rscc="0.868" rsr="0.165" said="P" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.400" resname="HOH" resnum="348" rscc="0.944" rsr="0.146" said="P" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="41.110" resname="HOH" resnum="353" rscc="0.889" rsr="0.079" said="P" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="32.100" resname="HOH" resnum="358" rscc="0.934" rsr="0.238" said="P" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="38.980" resname="HOH" resnum="366" rscc="0.918" rsr="0.160" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="34.010" resname="HOH" resnum="367" rscc="0.967" rsr="0.100" said="P" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="35.680" resname="HOH" resnum="369" rscc="0.943" rsr="0.076" said="P" seq="."/>
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		<clash atom="O" cid="2" clashmag="0.52" dist="2.08"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="46.070" resname="HOH" resnum="462" rscc="0.841" rsr="0.116" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="49.880" resname="HOH" resnum="463" rscc="0.788" rsr="0.234" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="44.140" resname="HOH" resnum="464" rscc="0.774" rsr="0.184" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="39.360" resname="HOH" resnum="465" rscc="0.906" rsr="0.265" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="44.420" resname="HOH" resnum="466" rscc="0.611" rsr="0.163" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="42.470" resname="HOH" resnum="467" rscc="0.811" rsr="0.190" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="51.130" resname="HOH" resnum="468" rscc="0.760" rsr="0.148" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="45.980" resname="HOH" resnum="469" rscc="0.850" rsr="0.120" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="59.270" resname="HOH" resnum="470" rscc="0.761" rsr="0.126" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="50.490" resname="HOH" resnum="471" rscc="0.697" rsr="0.211" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="45.800" resname="HOH" resnum="472" rscc="0.929" rsr="0.205" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="50.520" resname="HOH" resnum="473" rscc="0.766" rsr="0.200" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="47.540" resname="HOH" resnum="474" rscc="0.927" rsr="0.068" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="36.940" resname="HOH" resnum="475" rscc="0.709" rsr="0.246" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="36.940" resname="HOH" resnum="475" rscc="0.709" rsr="0.246" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="47.890" resname="HOH" resnum="476" rscc="0.751" rsr="0.296" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="47.770" resname="HOH" resnum="477" rscc="0.825" rsr="0.377" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="52.010" resname="HOH" resnum="478" rscc="0.656" rsr="0.118" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="43.640" resname="HOH" resnum="479" rscc="0.884" rsr="0.174" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode="A" avgoccu="0.700" chain="A" ent="5" icode=" " model="1" owab="42.250" resname="HOH" resnum="480" rscc="0.854" rsr="0.229" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="40.320" resname="HOH" resnum="481" rscc="0.875" rsr="0.147" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="31.200" resname="HOH" resnum="482" rscc="0.940" rsr="0.083" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode="A" avgoccu="0.700" chain="A" ent="5" icode=" " model="1" owab="39.190" resname="HOH" resnum="483" rscc="0.873" rsr="0.218" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="40.370" resname="HOH" resnum="484" rscc="0.943" rsr="0.291" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="45.240" resname="HOH" resnum="485" rscc="0.950" rsr="0.185" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="49.620" resname="HOH" resnum="486" rscc="0.893" rsr="0.103" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="44.240" resname="HOH" resnum="487" rscc="0.934" rsr="0.065" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="51.070" resname="HOH" resnum="488" rscc="0.779" rsr="0.149" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="49.210" resname="HOH" resnum="489" rscc="0.871" rsr="0.211" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="38.990" resname="HOH" resnum="490" rscc="0.790" rsr="0.718" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="44.320" resname="HOH" resnum="491" rscc="0.813" rsr="0.129" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="51.300" resname="HOH" resnum="492" rscc="0.680" rsr="0.258" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="40.900" resname="HOH" resnum="493" rscc="0.827" rsr="0.404" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="35.070" resname="HOH" resnum="494" rscc="0.958" rsr="0.206" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="39.540" resname="HOH" resnum="495" rscc="0.780" rsr="0.199" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode="B" avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="33.850" resname="HOH" resnum="496" rscc="0.927" rsr="0.255" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.980" resname="HOH" resnum="497" rscc="0.943" rsr="0.099" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="42.730" resname="HOH" resnum="498" rscc="0.876" rsr="0.106" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="47.380" resname="HOH" resnum="499" rscc="0.732" rsr="0.119" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="47.130" resname="HOH" resnum="500" rscc="0.697" rsr="0.645" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="52.620" resname="HOH" resnum="501" rscc="0.691" rsr="0.305" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="57.740" resname="HOH" resnum="502" rscc="0.601" rsr="0.199" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="57.370" resname="HOH" resnum="503" rscc="0.730" rsr="0.248" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="56.290" resname="HOH" resnum="504" rscc="0.633" rsr="0.214" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="50.350" resname="HOH" resnum="505" rscc="0.761" rsr="0.158" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="53.350" resname="HOH" resnum="506" rscc="0.878" rsr="0.115" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="43.710" resname="HOH" resnum="507" rscc="0.783" rsr="0.158" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="52.530" resname="HOH" resnum="508" rscc="0.881" rsr="0.158" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="57.410" resname="HOH" resnum="509" rscc="0.854" rsr="0.214" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="33.930" resname="HOH" resnum="510" rscc="0.801" rsr="0.265" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="38.370" resname="HOH" resnum="511" rscc="0.891" rsr="0.199" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode="A" avgoccu="0.600" chain="A" ent="5" icode=" " model="1" owab="37.800" resname="HOH" resnum="512" rscc="0.789" rsr="0.632" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="53.770" resname="HOH" resnum="513" rscc="0.840" rsr="0.074" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="32.860" resname="HOH" resnum="514" rscc="0.675" rsr="0.222" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="37.350" resname="HOH" resnum="515" rscc="0.472" rsr="0.177" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode="A" avgoccu="0.600" chain="A" ent="5" icode=" " model="1" owab="31.970" resname="HOH" resnum="516" rscc="0.825" rsr="0.249" said="P" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="35.750" resname="HOH" resnum="517" rscc="0.594" rsr="0.361" said="P" seq="."/>
	<ModelledEntityInstance absolute_RSRZ_percentile="76.77" absolute_rama_percentile="100.00" absolute_sidechain_percentile="85.28" angles_rmsz="1.03" bonds_rmsz="0.93" chain="A" ent="1" model="1" num_angles_rmsz="1877" num_bonds_rmsz="1386" relative_RSRZ_percentile="76.34" relative_rama_percentile="100.00" relative_sidechain_percentile="65.53" said="A"/>
	<programs>
		<program name="dcc" properties="DCC_R,DCC_refinement_program,B_factor_type,DCC_Rfree" version="2.23  (2018-02-06)"/>
		<program name="validation-pipeline" properties="PDB-revision-date,PDB-resolution,protein-DNA-RNA-entities,PDB-Rfree,PDB-R,percentilebins,PDB-resolution-low,pdbid,PDB-revision-number,attemptedValidationSteps,XMLcreationDate,PDB-deposition-date" version="trunk31020"/>
		<program name="mogul" properties="mogul_rmsz_numangles,mogul_angles_rmsz,mogul-torsion-outlier,mogul-angle-outlier,mogul-bond-outlier,mogul_bonds_rmsz,mogul-ring-outlier,mogul_rmsz_numbonds" version="1.7.3 (157068), CSD as539be (2018)"/>
		<program name="eds" properties="rscc,owab,EDS_R,avgoccu,EDS_resolution_low,CCP4version,babinet_b,num-free-reflections,relative_RSRZ_percentile,rsrz,DataCompleteness,percent-RSRZ-outliers,bulk_solvent_b,RefmacVersion,bulk_solvent_k,percent-free-reflections,EDS_resolution,Fo_Fc_correlation,rsr,NatomsEDS,babinet_k,absolute_RSRZ_percentile" version="trunk31020"/>
		<program name="xtriage" properties="xtriage_input_columns,numMillerIndices,DataAnisotropy,TransNCS,centric_outliers,TwinL,acentric_outliers,WilsonBestimate,TwinL2,IoverSigma,WilsonBaniso" version="1.13"/>
		<program name="molprobity" properties="bond-outlier,relative_rama_percentile,phi,psi,cis_peptide,clash,angle-outlier,num_bonds_rmsz,absolute_sidechain_percentile,relative_sidechain_percentile,clashscore,bonds_rmsz,percent-rama-outliers,RestypesNotcheckedForBondAngleGeometry,num-H-reduce,rota,num_angles_rmsz,angles_rmsz,percent-rota-outliers,rama,absolute_rama_percentile" version="4.02b-467"/>
		<program name="percentiles" properties="numPDBids-absolute-percentile-percent-rota-outliers,high-resol-relative-percentile-percent-rota-outliers,absolute-percentile-percent-RSRZ-outliers,relative-percentile-percent-rama-outliers,absolute-percentile-percent-rama-outliers,absolute-percentile-clashscore,absolute-percentile-percent-rota-outliers,relative-percentile-clashscore,high-resol-relative-percentile-percent-rama-outliers,numPDBids-relative-percentile-percent-RSRZ-outliers,numPDBids-relative-percentile-DCC_Rfree,absolute-percentile-DCC_Rfree,relative-percentile-DCC_Rfree,relative-percentile-percent-RSRZ-outliers,low-resol-relative-percentile-percent-RSRZ-outliers,numPDBids-relative-percentile-percent-rama-outliers,numPDBids-relative-percentile-clashscore,high-resol-relative-percentile-clashscore,numPDBids-absolute-percentile-percent-RSRZ-outliers,low-resol-relative-percentile-clashscore,numPDBids-relative-percentile-percent-rota-outliers,low-resol-relative-percentile-percent-rama-outliers,low-resol-relative-percentile-percent-rota-outliers,numPDBids-absolute-percentile-clashscore,numPDBids-absolute-percentile-percent-rama-outliers,low-resol-relative-percentile-DCC_Rfree,high-resol-relative-percentile-percent-RSRZ-outliers,numPDBids-absolute-percentile-DCC_Rfree,relative-percentile-percent-rota-outliers,high-resol-relative-percentile-DCC_Rfree" version="20171227.v01 (using entries in the PDB archive December 27th 2017)"/>
	</programs>
</wwPDB-validation-information>
