<?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_v004.xsd">
	<Entry B_factor_type="FULL" CCP4version="7.0.044 (Gargrove)" DCC_R="0.20" DCC_Rfree="0.24" DCC_refinement_program="REFMAC" DataAnisotropy="0.078" DataCompleteness="99.98" EDS_R="0.20" EDS_resolution="2.24" EDS_resolution_low="42.22" Fo_Fc_correlation="0.934" IoverSigma="10.34(2.24A)" PDB-R="0.20" PDB-Rfree="0.24" PDB-deposition-date="2013-12-26" PDB-resolution="2.24" PDB-resolution-low="42.25" PDB-revision-date="2014-12-31" PDB-revision-number="1" RefmacVersion="5.8.0158" RestypesNotcheckedForBondAngleGeometry="TMP,TYD,PO4,ACT" TransNCS="The largest off-origin peak in the Patterson function is 7.63% of the height of the origin peak. No significant pseudotranslation is detected." TwinL="0.477" TwinL2="0.308" WilsonBaniso="[25.028,23.167,23.460,0.000,0.000,0.000]" WilsonBestimate="23.922" XMLcreationDate="May 15, 2020 -- 02:20 am BST" absolute-percentile-DCC_Rfree="47.0" absolute-percentile-clashscore="40.9" absolute-percentile-percent-RSRZ-outliers="83.9" absolute-percentile-percent-rama-outliers="100.0" absolute-percentile-percent-rota-outliers="44.5" acentric_outliers="0" angles_rmsz="0.61" attemptedValidationSteps="molprobity,validation-pack,xtriage,eds,mogul,buster-report,percentiles,writexml" babinet_b="85.625" babinet_k="0.284" bonds_rmsz="0.51" bulk_solvent_b="37.227" bulk_solvent_k="0.350" centric_outliers="0" clashscore="7.05" high-resol-relative-percentile-DCC_Rfree="2.22" high-resol-relative-percentile-clashscore="2.22" high-resol-relative-percentile-percent-RSRZ-outliers="2.22" high-resol-relative-percentile-percent-rama-outliers="2.22" high-resol-relative-percentile-percent-rota-outliers="2.22" ligands-for-buster-report="yes" low-resol-relative-percentile-DCC_Rfree="2.26" low-resol-relative-percentile-clashscore="2.26" low-resol-relative-percentile-percent-RSRZ-outliers="2.26" low-resol-relative-percentile-percent-rama-outliers="2.26" low-resol-relative-percentile-percent-rota-outliers="2.26" num-H-reduce="1835" num-free-reflections="684" numMillerIndices="13197" numPDBids-absolute-percentile-DCC_Rfree="130704" numPDBids-absolute-percentile-clashscore="141614" numPDBids-absolute-percentile-percent-RSRZ-outliers="127900" numPDBids-absolute-percentile-percent-rama-outliers="138981" numPDBids-absolute-percentile-percent-rota-outliers="138945" numPDBids-relative-percentile-DCC_Rfree="2391" numPDBids-relative-percentile-clashscore="2539" numPDBids-relative-percentile-percent-RSRZ-outliers="2353" numPDBids-relative-percentile-percent-rama-outliers="2489" numPDBids-relative-percentile-percent-rota-outliers="2490" num_angles_rmsz="2485" num_bonds_rmsz="1844" pdbid="4O7S" percent-RSRZ-outliers="0.89" percent-free-reflections="5.18" percent-rama-outliers="0.00" percent-rota-outliers="2.72" percentilebins="all,2.24,xray" protein-DNA-RNA-entities="1" relative-percentile-DCC_Rfree="56.4" relative-percentile-clashscore="39.7" relative-percentile-percent-RSRZ-outliers="84.3" relative-percentile-percent-rama-outliers="100.0" relative-percentile-percent-rota-outliers="51.0" 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="1" owab="57.030" resname="MET" resnum="15" rscc="0.389" rsr="0.377" rsrz="4.464" said="A" seq="15">
		<clash atom="HA" cid="13" clashmag="0.48" dist="2.13"/>
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	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="1" owab="53.180" phi="-146.6" psi="115.0" rama="Favored" resname="ILE" resnum="16" rscc="0.691" rsr="0.170" rsrz="0.461" said="A" seq="16"/>
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		<clash atom="HB2" cid="11" clashmag="0.51" dist="1.92"/>
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	<ModelledSubgroup NatomsEDS="11" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="28.270" phi="-133.0" psi="152.6" rama="Favored" resname="THR" resnum="32" rota="t" rscc="0.960" rsr="0.144" rsrz="0.176" said="A" seq="32">
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		<clash atom="HA2" cid="14" clashmag="0.48" dist="2.13"/>
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	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="45.090" phi="-77.2" psi="-17.3" rama="Favored" resname="THR" resnum="37" rota="p" rscc="0.895" rsr="0.157" rsrz="0.404" said="A" seq="37"/>
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		<clash atom="HA" cid="25" clashmag="0.40" dist="1.96"/>
		<clash atom="HG21" cid="9" clashmag="0.52" dist="2.44"/>
		<clash atom="HD13" cid="25" clashmag="0.40" dist="1.96"/>
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		<clash atom="HE3" cid="4" clashmag="0.62" dist="1.80"/>
		<clash atom="HE2" cid="2" clashmag="0.65" dist="1.95"/>
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		<clash atom="HG3" cid="4" clashmag="0.62" dist="1.80"/>
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		<clash atom="HD11" cid="12" clashmag="0.49" dist="1.93"/>
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	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="16.530" phi="-122.1" psi="-151.2" rama="Allowed" resname="ALA" resnum="189" rscc="0.963" rsr="0.101" rsrz="-0.525" said="A" seq="189"/>
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	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="15.280" phi="-62.4" psi="-13.1" rama="Favored" resname="PRO" resnum="194" rota="Cg_exo" rscc="0.963" rsr="0.098" rsrz="-0.555" said="A" seq="194">
		<clash atom="HB2" cid="22" clashmag="0.43" dist="2.53"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="17.580" phi="-70.4" psi="-34.1" rama="Favored" resname="ASP" resnum="195" rota="m-20" rscc="0.965" rsr="0.112" rsrz="-0.504" said="A" seq="195"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="14.710" phi="-116.5" psi="12.4" rama="Favored" resname="THR" resnum="196" rota="p" rscc="0.977" rsr="0.111" rsrz="-0.404" said="A" seq="196"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="16.520" phi="-138.8" psi="152.6" rama="Favored" resname="CYS" resnum="197" rota="m" rscc="0.988" rsr="0.110" rsrz="-0.181" said="A" seq="197"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="15.820" phi="-101.5" psi="124.6" rama="Favored" resname="ARG" resnum="198" rota="mtt85" rscc="0.962" rsr="0.101" rsrz="-0.885" said="A" seq="198"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="16.370" phi="-122.0" psi="119.4" rama="Favored" resname="PHE" resnum="199" rota="m-85" rscc="0.976" rsr="0.092" rsrz="-0.836" said="A" seq="199"/>
	<ModelledSubgroup NatomsEDS="14" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="10" owab="20.730" phi="-112.4" psi="136.8" rama="Favored" resname="TRP" resnum="200" rota="m0" rscc="0.965" rsr="0.116" rsrz="-0.267" said="A" seq="200"/>
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		<clash atom="OD2" cid="6" clashmag="0.57" dist="2.34"/>
		<clash atom="OD1" cid="7" clashmag="0.56" dist="2.34"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="35.440" phi="-66.8" psi="-37.1" rama="Favored" resname="ALA" resnum="202" rscc="0.930" rsr="0.092" rsrz="-0.685" said="A" seq="202"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="43.370" phi="-66.8" psi="-45.8" rama="Favored" resname="LYS" resnum="203" rscc="0.928" rsr="0.107" rsrz="-0.935" said="A" seq="203"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="35.880" phi="-112.1" psi="-15.5" rama="Favored" resname="THR" resnum="204" rota="p" rscc="0.911" rsr="0.114" rsrz="-0.351" said="A" seq="204">
		<clash atom="O" cid="5" clashmag="0.59" dist="2.01"/>
		<clash atom="OG1" cid="23" clashmag="0.43" dist="2.18"/>
		<clash atom="N" cid="6" clashmag="0.57" dist="2.34"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="36.560" phi="75.8" psi="7.2" rama="Favored" resname="LYS" resnum="205" rota="mptt" rscc="0.895" rsr="0.149" rsrz="-0.374" said="A" seq="205">
		<clash atom="HB2" cid="5" clashmag="0.59" dist="2.01"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="36.700" phi="-77.0" psi="147.1" rama="Favored" resname="ARG" resnum="206" rota="ptm180" rscc="0.877" rsr="0.196" rsrz="0.480" said="A" seq="206">
		<clash atom="HG2" cid="23" clashmag="0.43" dist="2.18"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="24.540" phi="-71.2" psi="129.4" rama="Favored" resname="SER" resnum="207" rota="m" rscc="0.939" rsr="0.104" rsrz="-0.509" said="A" seq="207"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="21.550" phi="-160.1" psi="-171.3" rama="Favored" resname="ASP" resnum="209" rota="p30" rscc="0.985" rsr="0.085" rsrz="-0.907" said="A" seq="209">
		<clash atom="OD2" cid="18" clashmag="0.45" dist="2.17"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="20.120" phi="-59.2" psi="-15.4" rama="Favored" resname="LYS" resnum="210" rota="tttt" rscc="0.947" rsr="0.103" rsrz="-0.988" said="A" seq="210"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="20.540" phi="-62.8" psi="-29.0" rama="Favored" resname="ASP" resnum="211" rota="m-20" rscc="0.967" rsr="0.123" rsrz="-0.340" said="A" seq="211">
		<clash atom="HB2" cid="18" clashmag="0.45" dist="2.17"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="25.060" phi="-53.1" psi="-48.2" rama="Favored" resname="VAL" resnum="212" rota="t" rscc="0.966" rsr="0.156" rsrz="0.305" said="A" seq="212">
		<clash atom="HA" cid="15" clashmag="0.47" dist="1.96"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="27.020" phi="-72.5" psi="-46.0" rama="Favored" resname="PHE" resnum="213" rota="t80" rscc="0.950" rsr="0.135" rsrz="-0.025" said="A" seq="213"/>
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		<clash atom="HB2" cid="15" clashmag="0.47" dist="1.96"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="37.790" phi="129.7" psi="-140.3" rama="Favored" resname="GLY" resnum="218" rscc="0.922" rsr="0.139" rsrz="0.163" said="A" seq="218"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="30.760" phi="-61.6" psi="-45.8" rama="Favored" resname="ILE" resnum="221" rota="mm" rscc="0.903" rsr="0.163" rsrz="0.330" said="A" seq="221"/>
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	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="29.990" phi="-63.2" psi="-45.1" rama="Favored" resname="ALA" resnum="223" rscc="0.950" rsr="0.129" rsrz="-0.027" said="A" seq="223">
		<clash atom="O" cid="17" clashmag="0.46" dist="2.14"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="27.860" phi="-68.6" psi="-36.4" rama="Favored" resname="TYR" resnum="224" rota="m-30" rscc="0.948" rsr="0.160" rsrz="0.527" said="A" seq="224">
		<clash atom="CZ" cid="22" clashmag="0.43" dist="2.53"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="45.190" phi="-61.1" psi="-46.6" rama="Favored" resname="LYS" resnum="225" rota="mttt" rscc="0.900" rsr="0.253" rsrz="1.015" said="A" seq="225">
		<clash atom="HG2" cid="24" clashmag="0.41" dist="2.02"/>
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	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="44.740" phi="-45.4" psi="-57.2" rama="Favored" resname="GLU" resnum="226" rota="OUTLIER" rscc="0.848" rsr="0.235" rsrz="0.858" said="A" seq="226">
		<clash atom="HB2" cid="17" clashmag="0.46" dist="2.14"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="37.300" phi="-54.0" psi="-50.6" rama="Favored" resname="ILE" resnum="227" rota="mm" rscc="0.930" rsr="0.173" rsrz="0.517" said="A" seq="227"/>
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	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="44.340" phi="-68.6" psi="-22.5" rama="Favored" resname="ARG" resnum="230" rota="OUTLIER" rscc="0.896" rsr="0.183" rsrz="0.293" said="A" seq="230">
		<clash atom="NH2" cid="7" clashmag="0.56" dist="2.34"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="46.100" phi="-90.5" psi="-47.7" rama="Favored" resname="ILE" resnum="231" rota="mt" rscc="0.875" rsr="0.158" rsrz="0.237" said="A" seq="231"/>
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	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="2" owab="52.240" phi="-137.2" psi="151.8" rama="Favored" resname="GLU" resnum="234" rscc="0.811" rsr="0.146" rsrz="-0.319" said="A" seq="234"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="1" owab="54.750" phi="-77.2" psi="136.8" rama="Favored" resname="LYS" resnum="235" rscc="0.908" rsr="0.148" rsrz="-0.387" said="A" seq="235"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="58.750" phi="-63.5" psi="124.7" rama="Favored" resname="PRO" resnum="236" rota="Cg_endo" rscc="0.891" rsr="0.182" rsrz="0.876" said="A" seq="236">
		<clash atom="HG3" cid="24" clashmag="0.41" dist="2.02"/>
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	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="1" owab="61.540" phi="-81.1" psi="-34.7" rama="Favored" resname="GLU" resnum="237" rscc="0.746" rsr="0.224" rsrz="0.713" said="A" seq="237"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="58.530" resname="PHE" resnum="238" rota="m-85" rscc="0.795" rsr="0.224" rsrz="1.655" said="A" seq="238"/>
	<ModelledSubgroup NatomsEDS="25" altcode="A" avgoccu="0.550" chain="A" ent="2" icode=" " model="1" mogul_angles_rmsz="1.82" mogul_bonds_rmsz="2.49" mogul_rmsz_numangles="33" mogul_rmsz_numbonds="23" num-H-reduce="13" owab="26.250" resname="TYD" resnum="301" rscc="0.923" rsr="0.170" said="B" seq=".">
		<mog-angle-outlier Zscore="-2.32" atoms="O2,C2,N1" mean="123.11" mindiff="0.04" numobs="85" obsval="120.19" stdev="1.26"/>
		<mog-angle-outlier Zscore="3.69" atoms="N3,C2,N1" mean="116.65" mindiff="2.27" numobs="60" obsval="120.55" stdev="1.06"/>
		<mog-angle-outlier Zscore="-4.89" atoms="C4,N3,C2" mean="126.86" mindiff="3.28" numobs="30" obsval="120.87" stdev="1.22"/>
		<mog-angle-outlier Zscore="2.14" atoms="C6,C5,C4" mean="111.53" mindiff="0.08" numobs="29" obsval="117.66" stdev="2.87"/>
		<mog-angle-outlier Zscore="3.56" atoms="C5M,C5,C6" mean="112.34" mindiff="1.09" numobs="25" obsval="119.94" stdev="2.14"/>
		<mog-angle-outlier Zscore="4.73" atoms="C5,C6,N1" mean="111.11" mindiff="3.63" numobs="20" obsval="120.42" stdev="1.97"/>
		<mog-bond-outlier Zscore="5.25" atoms="C2,N1" mean="1.35" mindiff="0.04" numobs="85" obsval="1.43" stdev="0.01"/>
		<mog-bond-outlier Zscore="-9.25" atoms="C6,N1" mean="1.46" mindiff="0.08" numobs="422" obsval="1.35" stdev="0.01"/>
		<mog-bond-outlier Zscore="-4.07" atoms="C6,C5" mean="1.51" mindiff="0.03" numobs="25" obsval="1.39" stdev="0.03"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="21" altcode="B" avgoccu="0.400" chain="A" ent="3" icode=" " model="1" mogul_angles_rmsz="1.59" mogul_bonds_rmsz="1.07" mogul_rmsz_numangles="23" mogul_rmsz_numbonds="19" num-H-reduce="13" owab="24.850" resname="TMP" resnum="302" rscc="0.911" rsr="0.176" said="C" seq=".">
		<mog-torsion-outlier atoms="C5',O5',P,O1P" local_density="1.39" mean="57.18" mindiff="8.63" numobs="72" obsval="-92.09" stdev="21.49"/>
		<mog-torsion-outlier atoms="C5',O5',P,O2P" local_density="0.00" mean="56.17" mindiff="10.51" numobs="50" obsval="26.63" stdev="45.88"/>
		<mog-torsion-outlier atoms="C5',O5',P,O3P" local_density="0.00" mean="74.77" mindiff="18.59" numobs="50" obsval="147.28" stdev="25.94"/>
		<mog-angle-outlier Zscore="2.04" atoms="O3P,P,O2P" mean="107.64" mindiff="0.50" numobs="224" obsval="115.42" stdev="3.82"/>
		<mog-angle-outlier Zscore="6.00" atoms="C4,N3,C2" mean="115.14" mindiff="2.56" numobs="63" obsval="120.21" stdev="0.84"/>
		<mog-angle-outlier Zscore="-2.52" atoms="C5,C6,N1" mean="122.19" mindiff="1.48" numobs="23" obsval="119.48" stdev="1.08"/>
		<mog-bond-outlier Zscore="3.56" atoms="C4,C5" mean="1.41" mindiff="0.04" numobs="20" obsval="1.49" stdev="0.02"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" mogul_angles_rmsz="0.47" mogul_bonds_rmsz="0.92" mogul_rmsz_numangles="6" mogul_rmsz_numbonds="4" owab="55.620" resname="PO4" resnum="303" rscc="0.916" rsr="0.236" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" mogul_angles_rmsz="0.00" mogul_bonds_rmsz="1.12" mogul_rmsz_numangles="0" mogul_rmsz_numbonds="1" num-H-reduce="3" owab="43.930" resname="ACT" resnum="304" rscc="0.843" rsr="0.211" said="E" seq=".">
		<clash atom="H3" cid="1" clashmag="0.65" dist="1.60"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="30.060" resname="HOH" resnum="401" rscc="0.951" rsr="0.078" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="26.980" resname="HOH" resnum="402" rscc="0.947" rsr="0.164" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="19.330" resname="HOH" resnum="403" rscc="0.831" rsr="0.149" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="27.720" resname="HOH" resnum="404" rscc="0.943" rsr="0.134" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="14.860" resname="HOH" resnum="405" rscc="0.972" rsr="0.161" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="13.680" resname="HOH" resnum="406" rscc="0.978" rsr="0.198" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="24.280" resname="HOH" resnum="407" rscc="0.844" rsr="0.199" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="11.630" resname="HOH" resnum="408" rscc="0.993" rsr="0.153" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="22.840" resname="HOH" resnum="409" rscc="0.912" rsr="0.145" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="20.310" resname="HOH" resnum="410" rscc="0.923" rsr="0.181" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="24.480" resname="HOH" resnum="412" rscc="0.911" rsr="0.165" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="30.970" resname="HOH" resnum="413" rscc="0.905" rsr="0.165" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="19.210" resname="HOH" resnum="414" rscc="0.979" rsr="0.129" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="22.020" resname="HOH" resnum="415" rscc="0.916" rsr="0.120" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="10.110" resname="HOH" resnum="416" rscc="0.982" rsr="0.124" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="27.180" resname="HOH" resnum="417" rscc="0.904" rsr="0.216" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="39.310" resname="HOH" resnum="418" rscc="0.922" rsr="0.080" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="24.550" resname="HOH" resnum="419" rscc="0.861" rsr="0.188" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="18.100" resname="HOH" resnum="420" rscc="0.970" rsr="0.092" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="12.250" resname="HOH" resnum="421" rscc="0.976" rsr="0.117" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="27.590" resname="HOH" resnum="422" rscc="0.950" rsr="0.225" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="12.340" resname="HOH" resnum="423" rscc="0.995" rsr="0.116" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="10.470" resname="HOH" resnum="424" rscc="0.989" rsr="0.152" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="24.250" resname="HOH" resnum="425" rscc="0.956" rsr="0.171" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="19.460" resname="HOH" resnum="426" rscc="0.957" rsr="0.109" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="29.430" resname="HOH" resnum="427" rscc="0.857" rsr="0.205" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="13.190" resname="HOH" resnum="428" rscc="0.973" rsr="0.117" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="31.780" resname="HOH" resnum="429" rscc="0.907" rsr="0.182" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="34.820" resname="HOH" resnum="430" rscc="0.931" rsr="0.223" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="6" icode=" " model="1" owab="14.890" resname="HOH" resnum="431" rscc="0.969" rsr="0.185" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="19.820" resname="HOH" resnum="432" rscc="0.984" rsr="0.134" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="12.650" resname="HOH" resnum="433" rscc="0.982" rsr="0.151" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="35.770" resname="HOH" resnum="434" rscc="0.723" rsr="0.182" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="13.200" resname="HOH" resnum="435" rscc="0.995" rsr="0.120" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="23.600" resname="HOH" resnum="436" rscc="0.956" rsr="0.187" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="22.760" resname="HOH" resnum="437" rscc="0.945" rsr="0.281" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="21.220" resname="HOH" resnum="438" rscc="0.935" rsr="0.175" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="16.400" resname="HOH" resnum="439" rscc="0.975" rsr="0.157" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="18.760" resname="HOH" resnum="440" rscc="0.844" rsr="0.112" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="20.600" resname="HOH" resnum="441" rscc="0.934" rsr="0.145" said="F" seq=".">
		<clash atom="O" cid="2" clashmag="0.65" dist="1.95"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="24.250" resname="HOH" resnum="442" rscc="0.958" rsr="0.125" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="26.230" resname="HOH" resnum="476" rscc="0.940" rsr="0.142" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="6" icode=" " model="1" owab="25.440" resname="HOH" resnum="477" rscc="0.867" rsr="0.136" said="F" seq="."/>
	<ModelledEntityInstance absolute_RSRZ_percentile="83.86" absolute_rama_percentile="100.00" absolute_sidechain_percentile="44.48" angles_rmsz="0.61" bonds_rmsz="0.51" chain="A" ent="1" model="1" num_angles_rmsz="2485" num_bonds_rmsz="1844" relative_RSRZ_percentile="84.32" relative_rama_percentile="100.00" relative_sidechain_percentile="51.04" said="A"/>
	<programs>
		<program name="molprobity" properties="bond-outlier,relative_rama_percentile,phi,psi,RestypesNotcheckedForBondAngleGeometry,clash,angle-outlier,percent-rota-outliers,num_bonds_rmsz,absolute_sidechain_percentile,relative_sidechain_percentile,clashscore,bonds_rmsz,percent-rama-outliers,num-H-reduce,rota,num_angles_rmsz,angles_rmsz,absolute_rama_percentile,rama,flippable-sidechain" 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="20191225.v01 (using entries in the PDB archive December 25th 2019)"/>
		<program name="dcc" properties="DCC_R,DCC_refinement_program,B_factor_type,DCC_Rfree" version="2.26  (2020-01-20)"/>
		<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="2.11"/>
		<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="1.8.5 (274361), CSD as541be (2020)"/>
		<program name="buster-report" properties="ligands-for-buster-report" version="1.1.7 (2018)"/>
		<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="2.11"/>
		<program name="xtriage" properties="xtriage_input_columns,numMillerIndices,DataAnisotropy,TransNCS,centric_outliers,TwinL,acentric_outliers,WilsonBestimate,TwinL2,IoverSigma,WilsonBaniso" version="1.13"/>
	</programs>
</wwPDB-validation-information>
