<?xml version="1.0" ?>
<wwPDB-validation-information xmlns:xsi="http://wwpdb.org/validation/schema/wwpdb_validation_v002.xsd">
	<Entry B_factor_type="FULL" CCP4version="6.5.0" DCC_R="0.20" DCC_Rfree="0.24" DCC_refinement_program="REFMAC" DataAnisotropy="0.731" DataCompleteness="83.18" EDS_R="0.20" EDS_resolution="2.00" EDS_resolution_low="19.95" Fo_Fc_correlation="0.918" IoverSigma="3.43(2.01A)" PDB-R="0.20" PDB-Rfree="0.24" PDB-deposition-date="2006-03-31" PDB-resolution="2.10" PDB-resolution-low="19.95" PDB-revision-date="2009-02-24" PDB-revision-number="2" RefmacVersion="5.8.0135" RestypesNotcheckedForBondAngleGeometry="NA,CA,ACT" TransNCS="The largest off-origin peak in the Patterson function is 5.14% of the height of the origin peak. No significant pseudotranslation is detected." TwinL="0.482" TwinL2="0.315" WilsonBaniso="[24.224,13.278,12.129,0.000,0.000,0.000]" WilsonBestimate="16.140" XMLcreationDate="Feb  1, 2016 -- 02:18 AM GMT" absolute-percentile-DCC_Rfree="49.7" absolute-percentile-clashscore="39.7" absolute-percentile-percent-RSRZ-outliers="72.8" absolute-percentile-percent-rama-outliers="52.3" absolute-percentile-percent-rota-outliers="46.3" acentric_outliers="1" angles_rmsz="0.57" attemptedValidationSteps="mogul,xtriage,molprobity,validation-pack,eds,coreclust,chemicalshifts,percentiles,writexml,writepdf" bonds_rmsz="0.42" bulk_solvent_b="40.006" bulk_solvent_k="0.404" centric_outliers="2" clashscore="8.75" cyrange_error=" Less than two structures selected." cyrange_version="Kirchner et al. (2012)" high-resol-relative-percentile-DCC_Rfree="2.1" high-resol-relative-percentile-clashscore="2.1" high-resol-relative-percentile-percent-RSRZ-outliers="2.1" high-resol-relative-percentile-percent-rama-outliers="2.1" high-resol-relative-percentile-percent-rota-outliers="2.1" low-resol-relative-percentile-DCC_Rfree="2.1" low-resol-relative-percentile-clashscore="2.1" low-resol-relative-percentile-percent-RSRZ-outliers="2.1" low-resol-relative-percentile-percent-rama-outliers="2.1" low-resol-relative-percentile-percent-rota-outliers="2.1" nmr_models_consistency_flag="True" nmrclust_error="Wrapper check: not enough residues in core to run NmrClust" nmrclust_version="Kelley et al. (1996)" num-H-reduce="3617" num-free-reflections="1304" numMillerIndices="27805" numPDBids-absolute-percentile-DCC_Rfree="91344" numPDBids-absolute-percentile-clashscore="102246" numPDBids-absolute-percentile-percent-RSRZ-outliers="91569" numPDBids-absolute-percentile-percent-rama-outliers="100387" numPDBids-absolute-percentile-percent-rota-outliers="100360" numPDBids-relative-percentile-DCC_Rfree="3939" numPDBids-relative-percentile-clashscore="4460" numPDBids-relative-percentile-percent-RSRZ-outliers="3948" numPDBids-relative-percentile-percent-rama-outliers="4413" numPDBids-relative-percentile-percent-rota-outliers="4414" num_angles_rmsz="5497" num_bonds_rmsz="4039" panav_version="Wang et al. (2010)" pdbid="2GJR" percent-RSRZ-outliers="1.66" percent-free-reflections="5.27" percent-rama-outliers="0.21" percent-rota-outliers="3.20" percentilebins="all,2.1,xray" protein-DNA-RNA-entities="1" rci_version="v_1n_11_5_13_A (Berjanski et al., 2005)" relative-percentile-DCC_Rfree="55.7" relative-percentile-clashscore="39.6" relative-percentile-percent-RSRZ-outliers="77.9" relative-percentile-percent-rama-outliers="53.2" relative-percentile-percent-rota-outliers="48.3" shiftchecker_version="rb-20026688" xtriage_input_columns="F_meas_au,F_meas_sigma_au"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="23.830" resname="THR" resnum="5" rota="OUTLIER" rscc="0.812" rsr="0.226" rsrz="2.088" said="A" seq="5" validate="True">
		<clash atom="N" cid="11" clashmag="0.87" dist="2.08"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="16.400" phi="-74.3" psi="137.0" rama="Favored" resname="ASN" resnum="6" rota="m-20" rscc="0.919" rsr="0.109" rsrz="-0.279" said="A" seq="6" validate="True"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="15.720" phi="-77.3" psi="133.4" rama="Favored" resname="GLY" resnum="7" rscc="0.962" rsr="0.105" rsrz="-0.128" said="A" seq="7" validate="True"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="13.110" phi="-135.9" psi="129.4" rama="Favored" resname="THR" resnum="8" rota="m" rscc="0.953" rsr="0.099" rsrz="-0.336" said="A" seq="8" validate="True"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="14.730" phi="-101.7" psi="155.5" rama="Favored" resname="MET" resnum="9" rota="OUTLIER" rscc="0.967" rsr="0.101" rsrz="-0.355" said="A" seq="9" validate="True"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="12.480" phi="-132.3" psi="129.5" rama="Favored" resname="MET" resnum="10" rota="ttt" rscc="0.963" rsr="0.118" rsrz="-0.037" said="A" seq="10" validate="True"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="8" owab="8.530" phi="-76.5" psi="105.7" rama="Favored" resname="GLN" resnum="11" rota="tt0" rscc="0.964" rsr="0.122" rsrz="-0.279" said="A" seq="11" validate="True">
		<clash atom="O" cid="60" clashmag="0.42" dist="2.19"/>
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	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="11.320" phi="-96.0" psi="58.0" rama="Allowed" resname="TYR" resnum="12" rota="t80" rscc="0.943" rsr="0.116" rsrz="0.017" said="A" seq="12" validate="True"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="10.390" phi="-174.8" psi="164.2" rama="Favored" resname="PHE" resnum="13" rota="p90" rscc="0.932" rsr="0.131" rsrz="0.290" said="A" seq="13" validate="True"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="12.320" phi="-136.9" psi="172.2" rama="Favored" resname="GLU" resnum="14" rota="OUTLIER" rscc="0.956" rsr="0.115" rsrz="-0.533" said="A" seq="14" validate="True"/>
	<ModelledSubgroup NatomsEDS="14" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="10" owab="11.180" phi="-59.9" psi="-39.9" rama="Favored" resname="TRP" resnum="15" rota="t-105" rscc="0.922" rsr="0.145" rsrz="0.791" said="A" seq="15" validate="True"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="14.380" phi="-104.3" psi="30.7" rama="Favored" resname="HIS" resnum="16" rota="m-70" rscc="0.910" rsr="0.137" rsrz="0.264" said="A" seq="16" validate="True"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="11.400" phi="-57.1" psi="149.7" rama="Favored" resname="LEU" resnum="17" rota="mt" rscc="0.948" rsr="0.117" rsrz="-0.176" said="A" seq="17" validate="True"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="12.510" phi="-63.2" psi="147.2" rama="Favored" resname="PRO" resnum="18" rota="Cg_endo" rscc="0.948" rsr="0.133" rsrz="0.314" said="A" seq="18" validate="True"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="14.510" phi="-89.5" psi="76.4" rama="Favored" resname="ASN" resnum="19" rota="t30" rscc="0.923" rsr="0.120" rsrz="-0.101" said="A" seq="19" validate="True"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="13.180" phi="-119.7" psi="0.7" rama="Favored" resname="ASP" resnum="20" rota="p-10" rscc="0.948" rsr="0.142" rsrz="0.198" said="A" seq="20" validate="True"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="10.810" phi="67.1" psi="16.2" rama="Favored" resname="GLY" resnum="21" rscc="0.974" rsr="0.080" rsrz="-0.565" said="A" seq="21" validate="True"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="8" owab="14.510" phi="-113.7" psi="9.4" rama="Favored" resname="GLN" resnum="22" rota="tp-100" rscc="0.849" rsr="0.179" rsrz="0.586" said="A" seq="22" validate="True">
		<clash atom="NE2" cid="22" clashmag="0.51" dist="2.18"/>
		<clash atom="OE1" cid="21" clashmag="0.72" dist="2.22"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="11.350" phi="-74.5" psi="-37.6" rama="Favored" resname="HIS" resnum="23" rota="t60" rscc="0.951" rsr="0.096" rsrz="-0.438" said="A" seq="23" validate="True"/>
	<ModelledSubgroup NatomsEDS="14" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="10" owab="8.810" phi="-61.7" psi="-38.0" rama="Favored" resname="TRP" resnum="24" rota="m95" rscc="0.952" rsr="0.101" rsrz="-0.251" said="A" seq="24" validate="True"/>
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		<clash atom="ND2" cid="21" clashmag="0.72" dist="2.22"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="12.830" phi="-50.5" psi="-45.7" rama="Favored" resname="ARG" resnum="26" rota="mtm-85" rscc="0.953" rsr="0.103" rsrz="-0.626" said="A" seq="26" validate="True"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="9.210" phi="-62.1" psi="-47.4" rama="Favored" resname="LEU" resnum="27" rota="tp" rscc="0.907" rsr="0.142" rsrz="0.347" said="A" seq="27" validate="True"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="13.730" phi="-55.8" psi="-49.9" rama="Favored" resname="ARG" resnum="28" rota="OUTLIER" rscc="0.886" rsr="0.165" rsrz="0.309" said="A" seq="28" validate="True">
		<clash atom="CG" cid="3" clashmag="0.63" dist="1.89"/>
		<clash atom="CG" cid="4" clashmag="0.45" dist="2.56"/>
		<clash atom="HG2" cid="0" clashmag="1.16" dist="1.00"/>
		<clash atom="HG2" cid="1" clashmag="0.96" dist="1.76"/>
		<clash atom="NH1" cid="1" clashmag="0.96" dist="1.76"/>
		<clash atom="NH1" cid="2" clashmag="0.78" dist="2.17"/>
		<clash atom="NH1" cid="4" clashmag="0.45" dist="2.56"/>
		<clash atom="HH11" cid="0" clashmag="1.16" dist="1.00"/>
		<clash atom="HH11" cid="3" clashmag="0.63" dist="1.89"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="11.390" phi="-73.7" psi="-6.7" rama="Favored" resname="ASP" resnum="29" rota="m-20" rscc="0.960" rsr="0.122" rsrz="-0.116" said="A" seq="29" validate="True">
		<clash atom="OD1" cid="2" clashmag="0.78" dist="2.17"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="14.530" phi="-106.7" psi="-8.6" rama="Favored" resname="ASP" resnum="30" rota="t0" rscc="0.960" rsr="0.090" rsrz="-0.619" said="A" seq="30" validate="True"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="13.970" phi="-57.9" psi="-45.3" rama="Favored" resname="ALA" resnum="31" rscc="0.952" rsr="0.102" rsrz="-0.214" said="A" seq="31" validate="True"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="14.000" phi="-67.0" psi="-52.5" rama="Favored" resname="SER" resnum="32" rota="m" rscc="0.969" rsr="0.081" rsrz="-0.673" said="A" seq="32" validate="True"/>
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		<clash atom="HD21" cid="55" clashmag="0.43" dist="2.16"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="15.240" phi="-63.8" psi="-42.7" rama="Favored" resname="LEU" resnum="34" rota="mt" rscc="0.898" rsr="0.169" rsrz="0.912" said="A" seq="34" validate="True"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" flippable-sidechain="1" icode=" " model="1" num-H-reduce="6" owab="20.060" phi="-62.0" psi="-27.9" rama="Favored" resname="ASN" resnum="36" rota="m120" rscc="0.930" rsr="0.128" rsrz="0.029" said="A" seq="36" validate="True"/>
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		<clash atom="NE" cid="55" clashmag="0.43" dist="2.16"/>
		<symm-clash atom="NH2" clashmag="0.07" dist="2.13" scid="1" symop="1_555"/>
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	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="16.380" phi="92.0" psi="4.4" rama="Favored" resname="GLY" resnum="38" rscc="0.934" rsr="0.108" rsrz="-0.075" said="A" seq="38" validate="True"/>
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		<clash atom="HB2" cid="27" clashmag="0.64" dist="1.79"/>
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	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="9.110" phi="-102.4" psi="-8.6" rama="Favored" resname="ALA" resnum="47" rscc="0.915" rsr="0.152" rsrz="0.757" said="A" seq="47" validate="True"/>
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		<clash atom="HB2" cid="51" clashmag="0.46" dist="2.15"/>
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	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="12.800" phi="-71.8" psi="124.8" rama="Favored" resname="LYS" resnum="49" rota="tppp?" rscc="0.954" rsr="0.130" rsrz="-0.411" said="A" seq="49" validate="True"/>
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		<clash atom="O" cid="51" clashmag="0.46" dist="2.15"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="9.680" phi="-63.0" psi="-18.9" rama="Favored" resname="LEU" resnum="63" rota="mt" rscc="0.936" rsr="0.120" rsrz="-0.113" said="A" seq="63" validate="True">
		<clash atom="HB3" cid="49" clashmag="0.46" dist="2.30"/>
		<clash atom="HB3" cid="50" clashmag="0.40" dist="2.55"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="9.980" phi="-85.5" psi="96.6" rama="Favored" resname="ASN" resnum="70" rota="t30" rscc="0.964" rsr="0.107" rsrz="-0.312" said="A" seq="70" validate="True"/>
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		<clash atom="HG2" cid="64" 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="13" owab="13.790" phi="65.5" psi="19.2" rama="Favored" resname="LYS" resnum="72" rota="mmpt?" rscc="0.938" rsr="0.126" rsrz="-0.467" said="A" seq="72" validate="True"/>
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		<clash atom="CD2" cid="16" clashmag="0.75" dist="2.03"/>
		<clash atom="CD2" cid="18" clashmag="0.50" dist="2.77"/>
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		<clash atom="ND2" cid="18" clashmag="0.50" dist="2.77"/>
		<clash atom="HD21" cid="16" clashmag="0.75" dist="2.03"/>
		<clash atom="HD21" cid="17" clashmag="0.59" dist="1.47"/>
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		<clash atom="HB3" cid="48" clashmag="0.46" dist="2.15"/>
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		<symm-clash atom="O" clashmag="0.07" dist="2.13" scid="1" symop="1_545"/>
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		<clash atom="CG" cid="34" clashmag="0.45" dist="2.46"/>
		<clash atom="HG2" cid="33" clashmag="0.60" dist="1.84"/>
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	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="14.990" phi="-110.1" psi="139.7" rama="Favored" resname="ALA" resnum="139" rscc="0.912" rsr="0.136" rsrz="0.447" said="A" seq="139" validate="True"/>
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		<clash atom="HB2" cid="31" clashmag="0.62" dist="1.80"/>
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		<clash atom="HA3" cid="64" clashmag="0.41" dist="2.02"/>
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		<clash atom="O" cid="15" clashmag="0.53" dist="2.08"/>
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		<clash atom="HB2" cid="15" clashmag="0.53" dist="2.08"/>
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	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="11.960" phi="-159.3" psi="130.9" rama="Favored" resname="SER" resnum="153" rota="t" rscc="0.968" rsr="0.079" rsrz="-0.708" said="A" seq="153" validate="True">
		<clash atom="HB2" cid="13" clashmag="0.71" dist="1.55"/>
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		<clash atom="CB" cid="43" clashmag="0.43" dist="2.65"/>
		<clash atom="HB3" cid="41" clashmag="0.52" dist="2.10"/>
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		<clash atom="O" cid="23" clashmag="0.68" dist="2.27"/>
		<clash atom="CD2" cid="25" clashmag="0.44" dist="2.53"/>
		<clash atom="CG" cid="24" clashmag="0.53" dist="2.43"/>
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		<clash atom="HA" cid="24" clashmag="0.53" dist="2.43"/>
		<clash atom="HA" cid="25" clashmag="0.44" dist="2.53"/>
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		<clash atom="HB2" cid="38" clashmag="0.54" dist="1.89"/>
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		<clash atom="C" cid="45" clashmag="0.49" dist="2.33"/>
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		<clash atom="HG21" cid="26" clashmag="0.67" dist="1.76"/>
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	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="10.880" phi="-77.4" psi="-8.1" rama="Favored" resname="LYS" resnum="239" rota="pttt" rscc="0.949" rsr="0.142" rsrz="-0.243" said="A" seq="239" validate="True">
		<clash atom="HB2" cid="38" clashmag="0.54" dist="1.89"/>
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		<clash atom="NZ" cid="23" clashmag="0.68" dist="2.27"/>
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	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="10.110" phi="-59.7" psi="-44.3" rama="Favored" resname="TYR" resnum="243" rota="m-30" rscc="0.971" rsr="0.096" rsrz="-0.416" said="A" seq="243" validate="True">
		<clash atom="HH" cid="39" clashmag="0.54" dist="1.53"/>
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	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="11.340" phi="-65.1" psi="-32.8" rama="Favored" resname="SER" resnum="244" rota="p" rscc="0.961" rsr="0.098" rsrz="-0.373" said="A" seq="244" validate="True"/>
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		<clash atom="HB2" cid="59" clashmag="0.42" dist="2.01"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="12.900" phi="-79.1" psi="-31.0" rama="Favored" resname="ASP" resnum="248" rota="m-20" rscc="0.935" rsr="0.107" rsrz="-0.352" said="A" seq="248" validate="True"/>
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		<clash atom="HG2" cid="54" clashmag="0.43" dist="1.99"/>
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		<clash atom="HD22" cid="10" clashmag="0.46" dist="1.63"/>
		<clash atom="CG" cid="6" clashmag="0.96" dist="2.01"/>
		<clash atom="HA" cid="10" clashmag="0.46" dist="1.63"/>
		<clash atom="HB3" cid="8" clashmag="0.78" dist="1.78"/>
		<clash atom="HB3" cid="9" clashmag="0.77" dist="1.84"/>
		<clash atom="CB" cid="7" clashmag="0.88" dist="2.21"/>
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		<symm-clash atom="OE2" clashmag="0.01" dist="2.19" scid="2" symop="1_555"/>
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		<clash atom="HB2" cid="54" clashmag="0.43" dist="1.99"/>
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		<clash atom="HB1" cid="26" clashmag="0.67" dist="1.76"/>
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		<clash atom="HG3" cid="29" clashmag="0.64" dist="1.98"/>
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		<clash atom="HD11" cid="58" clashmag="0.42" dist="2.01"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="5.770" resname="HOH" resnum="1529" rscc="0.983" rsr="0.062" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.320" resname="HOH" resnum="1530" rscc="0.869" rsr="0.134" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.670" resname="HOH" resnum="1531" rscc="0.940" rsr="0.074" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="4.880" resname="HOH" resnum="1532" rscc="0.975" rsr="0.071" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.450" resname="HOH" resnum="1533" rscc="0.891" rsr="0.271" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.410" resname="HOH" resnum="1534" rscc="0.983" rsr="0.184" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.510" resname="HOH" resnum="1535" rscc="0.986" rsr="0.076" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.670" resname="HOH" resnum="1536" rscc="0.963" rsr="0.087" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.430" resname="HOH" resnum="1537" rscc="0.988" rsr="0.105" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.400" resname="HOH" resnum="1538" rscc="0.990" rsr="0.092" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.360" resname="HOH" resnum="1539" rscc="0.965" rsr="0.085" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.470" resname="HOH" resnum="1540" rscc="0.984" rsr="0.267" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.100" resname="HOH" resnum="1541" rscc="0.968" rsr="0.110" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.270" resname="HOH" resnum="1542" rscc="0.984" rsr="0.096" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.710" resname="HOH" resnum="1543" rscc="0.958" rsr="0.103" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.460" resname="HOH" resnum="1544" rscc="0.981" rsr="0.066" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="5.670" resname="HOH" resnum="1545" rscc="0.983" rsr="0.133" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.660" resname="HOH" resnum="1546" rscc="0.976" rsr="0.077" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.880" resname="HOH" resnum="1547" rscc="0.948" rsr="0.079" said="G" seq="." validate="True">
		<clash atom="O" cid="5" clashmag="1.02" dist="1.59"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.380" resname="HOH" resnum="1548" rscc="0.872" rsr="0.274" said="G" seq="." validate="True">
		<clash atom="O" cid="9" clashmag="0.77" dist="1.84"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.490" resname="HOH" resnum="1549" rscc="0.970" rsr="0.067" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.280" resname="HOH" resnum="1550" rscc="0.954" rsr="0.194" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.020" resname="HOH" resnum="1551" rscc="0.940" rsr="0.161" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.060" resname="HOH" resnum="1552" rscc="0.938" rsr="0.094" said="G" seq="." validate="True"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.090" resname="HOH" resnum="1554" rscc="0.961" rsr="0.097" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.030" resname="HOH" resnum="1555" rscc="0.965" rsr="0.103" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.780" resname="HOH" resnum="1556" rscc="0.886" rsr="0.166" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.860" resname="HOH" resnum="1557" rscc="0.966" rsr="0.069" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.650" resname="HOH" resnum="1558" rscc="0.972" rsr="0.146" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.960" resname="HOH" resnum="1559" rscc="0.883" rsr="0.124" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.040" resname="HOH" resnum="1560" rscc="0.951" rsr="0.130" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.140" resname="HOH" resnum="1561" rscc="0.940" rsr="0.098" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.580" resname="HOH" resnum="1562" rscc="0.936" rsr="0.128" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.580" resname="HOH" resnum="1563" rscc="0.969" rsr="0.283" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.620" resname="HOH" resnum="1564" rscc="0.985" rsr="0.134" said="G" seq="." validate="True"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.680" resname="HOH" resnum="1566" rscc="0.908" rsr="0.141" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.050" resname="HOH" resnum="1567" rscc="0.962" rsr="0.104" said="G" seq="." validate="True"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.470" resname="HOH" resnum="1572" rscc="0.910" rsr="0.109" said="G" seq="." validate="True"/>
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		<clash atom="O" cid="22" clashmag="0.51" dist="2.18"/>
	</ModelledSubgroup>
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		<clash atom="O" cid="41" clashmag="0.52" dist="2.10"/>
		<clash atom="O" cid="43" clashmag="0.43" dist="2.65"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.380" resname="HOH" resnum="1704" rscc="0.950" rsr="0.204" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.580" resname="HOH" resnum="1705" rscc="0.689" rsr="0.144" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.400" resname="HOH" resnum="1706" rscc="0.951" rsr="0.079" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.830" resname="HOH" resnum="1707" rscc="0.972" rsr="0.120" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.650" resname="HOH" resnum="1708" rscc="0.959" rsr="0.237" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.550" resname="HOH" resnum="1709" rscc="0.960" rsr="0.130" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.760" resname="HOH" resnum="1710" rscc="0.903" rsr="0.115" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.340" resname="HOH" resnum="1711" rscc="0.919" rsr="0.092" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="39.810" resname="HOH" resnum="1712" rscc="0.790" rsr="0.122" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.410" resname="HOH" resnum="1713" rscc="0.977" rsr="0.071" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.960" resname="HOH" resnum="1714" rscc="0.914" rsr="0.190" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.270" resname="HOH" resnum="1715" rscc="0.938" rsr="0.237" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.020" resname="HOH" resnum="1716" rscc="0.936" rsr="0.102" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="25.360" resname="HOH" resnum="1717" rscc="0.932" rsr="0.191" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.510" resname="HOH" resnum="1718" rscc="0.867" rsr="0.414" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.010" resname="HOH" resnum="1719" rscc="0.824" rsr="0.268" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.090" resname="HOH" resnum="1720" rscc="0.967" rsr="0.098" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.570" resname="HOH" resnum="1721" rscc="0.963" rsr="0.140" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.050" resname="HOH" resnum="1722" rscc="0.941" rsr="0.193" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.450" resname="HOH" resnum="1723" rscc="0.925" rsr="0.169" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.680" resname="HOH" resnum="1724" rscc="0.919" rsr="0.302" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.290" resname="HOH" resnum="1725" rscc="0.886" rsr="0.347" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.410" resname="HOH" resnum="1726" rscc="0.916" rsr="0.166" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="42.430" resname="HOH" resnum="1727" rscc="0.864" rsr="0.374" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.570" resname="HOH" resnum="1728" rscc="0.944" rsr="0.079" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="44.560" resname="HOH" resnum="1729" rscc="0.811" rsr="0.416" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="34.290" resname="HOH" resnum="1730" rscc="0.859" rsr="0.153" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.470" resname="HOH" resnum="1731" rscc="0.899" rsr="0.205" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.480" resname="HOH" resnum="1732" rscc="0.911" rsr="0.116" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.070" resname="HOH" resnum="1733" rscc="0.936" rsr="0.220" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.990" resname="HOH" resnum="1734" rscc="0.927" rsr="0.162" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.860" resname="HOH" resnum="1735" rscc="0.973" rsr="0.127" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.280" resname="HOH" resnum="1736" rscc="0.952" rsr="0.121" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.010" resname="HOH" resnum="1737" rscc="0.946" rsr="0.086" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.720" resname="HOH" resnum="1738" rscc="0.954" rsr="0.071" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="31.390" resname="HOH" resnum="1739" rscc="0.877" rsr="0.175" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.170" resname="HOH" resnum="1740" rscc="0.911" rsr="0.194" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.330" resname="HOH" resnum="1741" rscc="0.926" rsr="0.107" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.010" resname="HOH" resnum="1742" rscc="0.940" rsr="0.082" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.150" resname="HOH" resnum="1743" rscc="0.916" rsr="0.329" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.610" resname="HOH" resnum="1744" rscc="0.940" rsr="0.098" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.340" resname="HOH" resnum="1745" rscc="0.917" rsr="0.393" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.170" resname="HOH" resnum="1746" rscc="0.960" rsr="0.127" said="G" seq="." validate="True">
		<clash atom="O" cid="63" clashmag="0.41" dist="2.20"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="43.660" resname="HOH" resnum="1747" rscc="0.947" rsr="0.135" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.100" resname="HOH" resnum="1748" rscc="0.973" rsr="0.085" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.020" resname="HOH" resnum="1749" rscc="0.906" rsr="0.220" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.500" resname="HOH" resnum="1750" rscc="0.923" rsr="0.085" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="32.860" resname="HOH" resnum="1751" rscc="0.908" rsr="0.391" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="36.870" resname="HOH" resnum="1752" rscc="0.848" rsr="0.192" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.990" resname="HOH" resnum="1753" rscc="0.942" rsr="0.124" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.760" resname="HOH" resnum="1754" rscc="0.796" rsr="0.218" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.600" resname="HOH" resnum="1755" rscc="0.896" rsr="0.162" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.190" resname="HOH" resnum="1756" rscc="0.937" rsr="0.076" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="42.200" resname="HOH" resnum="1757" rscc="0.814" rsr="0.236" said="G" seq="." validate="True">
		<clash atom="O" cid="35" clashmag="0.58" dist="2.03"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.410" resname="HOH" resnum="1758" rscc="0.768" rsr="0.162" said="G" seq="." validate="True">
		<symm-clash atom="O" clashmag="0.01" dist="2.19" scid="2" symop="1_655"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.190" resname="HOH" resnum="1759" rscc="0.852" rsr="0.279" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.800" resname="HOH" resnum="1760" rscc="0.972" rsr="0.298" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.220" resname="HOH" resnum="1761" rscc="0.754" rsr="0.374" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.960" resname="HOH" resnum="1762" rscc="0.730" rsr="0.229" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.370" resname="HOH" resnum="1763" rscc="0.917" rsr="0.123" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.050" resname="HOH" resnum="1764" rscc="0.929" rsr="0.091" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.420" resname="HOH" resnum="1765" rscc="0.952" rsr="0.239" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.710" resname="HOH" resnum="1766" rscc="0.915" rsr="0.132" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="38.910" resname="HOH" resnum="1767" rscc="0.895" rsr="0.209" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.580" resname="HOH" resnum="1768" rscc="0.957" rsr="0.299" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.430" resname="HOH" resnum="1769" rscc="0.886" rsr="0.101" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="32.030" resname="HOH" resnum="1770" rscc="0.935" rsr="0.098" said="G" seq="." validate="True"/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="25.330" resname="HOH" resnum="1771" rscc="0.887" rsr="0.139" said="G" seq="." validate="True"/>
	<ModelledEntityInstance absolute_RSRZ_percentile="69.78" absolute_rama_percentile="53.44" absolute_sidechain_percentile="48.03" angles_rmsz="0.57" bonds_rmsz="0.42" chain="A" ent="1" model="1" num_angles_rmsz="5497" num_bonds_rmsz="4039" relative_RSRZ_percentile="74.49" relative_rama_percentile="54.53" relative_sidechain_percentile="49.99" said="A"/>
	<programs>
		<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="20151230.v01 (using entries in the PDB archive December 30th 2015)"/>
		<program name="chemicalshifts" properties="rci_version,shiftchecker_version,panav_version" version="rb-20026688"/>
		<program name="eds" properties="rscc,ligRSRZ,owab,EDS_R,ligRSRnumnbrs,avgoccu,EDS_resolution_low,ligRSRnbrStdev,relative_RSRZ_percentile,rsrz,DataCompleteness,percent-RSRZ-outliers,bulk_solvent_b,RefmacVersion,bulk_solvent_k,CCP4version,EDS_resolution,Fo_Fc_correlation,rsr,NatomsEDS,lig_rsrz_nbr_id,absolute_RSRZ_percentile,ligRSRnbrMean" version="rb-20026688"/>
		<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="trunk26865"/>
		<program name="dcc" properties="DCC_refinement_program,num-free-reflections,DCC_R,B_factor_type,percent-free-reflections,DCC_Rfree" version="2.14  (2015-09-10)"/>
		<program name="mogul" properties="mogul_rmsz_numangles,mogul_angles_rmsz,mogul-torsion-outlier,mogul-angle-outlier,mogul-bond-outlier,mogul_bonds_rmsz,mogul-ignore,mogul-ring-outlier,mogul_rmsz_numbonds" version="1.7 (RC4), CSD as536be (2015)"/>
		<program name="xtriage" properties="xtriage_input_columns,numMillerIndices,DataAnisotropy,TransNCS,centric_outliers,TwinL,acentric_outliers,WilsonBestimate,TwinL2,IoverSigma,WilsonBaniso" version="1.9-1692"/>
		<program name="validation-pack" properties="symm-clash" version="unknown"/>
		<program name="coreclust" properties="cyrange_error,cyrange_version,nmrclust_version,nmr_models_consistency_flag,validate,nmrclust_error" version="rb-20026688"/>
		<program name="molprobity" properties="relative_rama_percentile,clash,absolute_sidechain_percentile,angles_rmsz,absolute_rama_percentile,phi,psi,num-H-reduce,cis_peptide,relative_sidechain_percentile,clashscore,bonds_rmsz,percent-rama-outliers,percent-rota-outliers,flippable-sidechain,bond-outlier,angle-outlier,num_bonds_rmsz,RestypesNotcheckedForBondAngleGeometry,rota,num_angles_rmsz,rama" version="4.02b-467"/>
	</programs>
</wwPDB-validation-information>
