<?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="PARTIAL" CCP4version="7.0 (Gargrove)" DCC_R="0.21" DCC_Rfree="0.27" DCC_refinement_program="REFMAC" DataAnisotropy="0.117" DataCompleteness="99.68" EDS_R="0.21" EDS_resolution="2.51" EDS_resolution_low="31.26" Fo_Fc_correlation="0.958" IoverSigma="2.43(2.51A)" PDB-R="0.19" PDB-Rfree="0.25" PDB-deposition-date="2008-09-02" PDB-resolution="2.51" PDB-resolution-low="31.26" PDB-revision-date="2011-07-13" PDB-revision-number="2" RefmacVersion="5.8.0158" RestypesNotcheckedForBondAngleGeometry="CA" TransNCS="The largest off-origin peak in the Patterson function is 8.86% of the height of the origin peak. No significant pseudotranslation is detected." TwinFraction="-h,1/3*h-1/3*k-1/3*l,-4/3*h-8/3*k+1/3*l:0.000;-1/3*h+1/3*k+1/3*l,-k,8/3*h+4/3*k+1/3*l:0.000;-2/3*h-1/3*k-1/3*l,-1/3*h-2/3*k+1/3*l,-4/3*h+4/3*k+1/3*l:0.000" TwinL="0.491" TwinL2="0.324" WilsonBaniso="[59.318,59.318,52.623,-0.000,0.000,0.000]" WilsonBestimate="57.626" XMLcreationDate="Mar  8, 2018 -- 07:05 pm GMT" absolute-percentile-DCC_Rfree="20.2" absolute-percentile-clashscore="8.9" absolute-percentile-percent-RSRZ-outliers="22.8" absolute-percentile-percent-rama-outliers="100.0" absolute-percentile-percent-rota-outliers="5.2" acentric_outliers="8" angles_rmsz="0.81" attemptedValidationSteps="mogul,molprobity,validation-pack,xtriage,eds,percentiles,writexml" babinet_b="10.000" babinet_k="0.006" bonds_rmsz="0.77" bulk_solvent_b="61.315" bulk_solvent_k="0.322" centric_outliers="5" clashscore="21.49" high-resol-relative-percentile-DCC_Rfree="2.5" high-resol-relative-percentile-clashscore="2.5" high-resol-relative-percentile-percent-RSRZ-outliers="2.5" high-resol-relative-percentile-percent-rama-outliers="2.5" high-resol-relative-percentile-percent-rota-outliers="2.5" low-resol-relative-percentile-DCC_Rfree="2.5" low-resol-relative-percentile-clashscore="2.5" low-resol-relative-percentile-percent-RSRZ-outliers="2.5" low-resol-relative-percentile-percent-rama-outliers="2.5" low-resol-relative-percentile-percent-rota-outliers="2.5" num-H-reduce="1371" num-free-reflections="314" numMillerIndices="6616" 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="4155" numPDBids-relative-percentile-clashscore="4827" numPDBids-relative-percentile-percent-RSRZ-outliers="4058" numPDBids-relative-percentile-percent-rama-outliers="4735" numPDBids-relative-percentile-percent-rota-outliers="4737" num_angles_rmsz="1879" num_bonds_rmsz="1392" pdbid="3ECT" percent-RSRZ-outliers="5.78" percent-free-reflections="4.75" percent-rama-outliers="0.00" percent-rota-outliers="12.16" percentilebins="all,2.51,xray" protein-DNA-RNA-entities="1" relative-percentile-DCC_Rfree="34.3" relative-percentile-clashscore="14.8" relative-percentile-percent-RSRZ-outliers="24.1" relative-percentile-percent-rama-outliers="100.0" relative-percentile-percent-rota-outliers="9.8" resol-high-from-reflectionsfile="2.50" resol-low-from-reflectionsfile="59.87" xtriage_input_columns="F_meas_au,F_meas_sigma_au"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="10" owab="97.410" resname="LEU" resnum="6" rota="OUTLIER" rscc="0.750" rsr="0.322" rsrz="2.514" said="A" seq="9"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="98.650" phi="-89.7" psi="-32.6" rama="Favored" resname="GLU" resnum="7" rota="mm-40" rscc="0.864" rsr="0.360" rsrz="2.128" said="A" seq="10"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="97.490" phi="-64.1" psi="-18.9" rama="Favored" resname="LYS" resnum="8" rota="mttt" rscc="0.832" rsr="0.231" rsrz="0.403" said="A" seq="11"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="100.650" phi="-93.7" psi="-45.2" rama="Favored" resname="MSE" resnum="9" rota="ttp" rscc="0.638" rsr="0.338" said="A" seq="12">
		<clash atom="CE" cid="45" clashmag="0.47" dist="2.45"/>
		<clash atom="HE3" cid="48" clashmag="0.45" dist="1.98"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="97.530" phi="-63.6" psi="-24.4" rama="Favored" resname="LEU" resnum="10" rota="mt" rscc="0.713" rsr="0.235" rsrz="1.095" said="A" seq="13">
		<clash atom="HD23" cid="45" clashmag="0.47" dist="2.45"/>
		<clash atom="HD23" cid="48" clashmag="0.45" dist="1.98"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="97.160" phi="-85.7" psi="20.6" rama="Favored" resname="LYS" resnum="11" rota="OUTLIER" rscc="0.853" rsr="0.156" rsrz="-0.527" said="A" seq="14">
		<clash atom="HE3" cid="53" clashmag="0.43" dist="2.00"/>
		<clash atom="HA" cid="53" clashmag="0.43" dist="2.00"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="98.610" resname="GLY" resnum="12" rscc="0.540" rsr="0.538" rsrz="5.775" said="A" seq="15">
		<clash atom="CA" cid="49" clashmag="0.45" dist="2.62"/>
		<clash atom="HA2" cid="24" clashmag="0.60" dist="2.02"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="111.910" resname="HIS" resnum="14" rota="t-80" rscc="0.378" rsr="0.446" rsrz="4.359" said="A" seq="17"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="71.480" resname="ALA" resnum="18" rscc="0.661" rsr="0.497" rsrz="5.645" said="A" seq="21"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="71.060" phi="-79.1" psi="174.4" rama="Favored" resname="SER" resnum="19" rota="t" rscc="0.808" rsr="0.337" rsrz="2.896" said="A" seq="22">
		<clash atom="O" cid="13" clashmag="0.79" dist="1.83"/>
		<clash atom="CB" cid="10" clashmag="0.84" dist="2.06"/>
		<clash atom="HB3" cid="0" clashmag="1.08" dist="1.36"/>
		<clash atom="HB3" cid="52" clashmag="0.44" dist="2.25"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="70.600" phi="-75.2" psi="-63.0" rama="Allowed" resname="ALA" resnum="20" rscc="0.882" rsr="0.321" rsrz="2.793" said="A" seq="23"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="70.800" phi="-43.7" psi="-61.1" rama="Allowed" resname="GLU" resnum="21" rota="mt-10" rscc="0.802" rsr="0.424" rsrz="2.923" said="A" seq="24"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="66.940" phi="-50.5" psi="-45.9" rama="Favored" resname="ILE" resnum="22" rota="mt" rscc="0.952" rsr="0.275" rsrz="1.824" said="A" seq="25">
		<clash atom="CD1" cid="52" clashmag="0.44" dist="2.25"/>
		<clash atom="HD12" cid="0" clashmag="1.08" dist="1.36"/>
		<clash atom="HD12" cid="10" clashmag="0.84" dist="2.06"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="66.020" phi="-72.3" psi="-23.6" rama="Favored" resname="GLU" resnum="23" rota="mt-10" rscc="0.852" rsr="0.214" rsrz="0.314" said="A" seq="26">
		<clash atom="O" cid="43" clashmag="0.47" dist="2.13"/>
		<clash atom="HG3" cid="13" clashmag="0.79" dist="1.83"/>
		<clash atom="HG2" cid="20" clashmag="0.70" dist="1.55"/>
		<clash atom="HG2" cid="51" clashmag="0.44" dist="2.27"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="59.130" phi="-74.0" psi="-49.8" rama="Favored" resname="ALA" resnum="24" rscc="0.953" rsr="0.239" rsrz="1.464" said="A" seq="27"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="55.040" phi="-62.8" psi="-38.6" rama="Favored" resname="LEU" resnum="25" rota="tp" rscc="0.945" rsr="0.191" rsrz="0.377" said="A" seq="28"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="59.310" phi="-65.7" psi="-34.1" rama="Favored" resname="ARG" resnum="26" rota="ttp85" rscc="0.876" rsr="0.184" rsrz="0.008" said="A" seq="29">
		<clash atom="HH22" cid="20" clashmag="0.70" dist="1.55"/>
		<clash atom="NH2" cid="51" clashmag="0.44" dist="2.27"/>
		<clash atom="HG3" cid="27" clashmag="0.59" dist="2.01"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="51.800" phi="-81.6" psi="-33.2" rama="Favored" resname="SER" resnum="27" rota="OUTLIER" rscc="0.968" rsr="0.126" rsrz="-0.380" said="A" seq="30">
		<clash atom="O" cid="32" clashmag="0.54" dist="2.18"/>
		<clash atom="HB2" cid="43" clashmag="0.47" dist="2.13"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" flippable-sidechain="1" icode=" " model="1" num-H-reduce="8" owab="52.220" phi="-58.8" psi="-42.1" rama="Favored" resname="GLN" resnum="28" rota="tt0" rscc="0.908" rsr="0.207" rsrz="0.422" said="A" seq="31"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="48.460" phi="-68.0" psi="-39.2" rama="Favored" resname="ALA" resnum="29" rscc="0.982" rsr="0.150" rsrz="0.021" said="A" seq="32">
		<clash atom="O" cid="44" clashmag="0.47" dist="2.13"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="48.500" phi="-55.5" psi="-46.3" rama="Favored" resname="GLY" resnum="30" rscc="0.881" rsr="0.125" rsrz="-0.299" said="A" seq="33"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="51.240" phi="-54.6" psi="-58.5" rama="Favored" resname="ARG" resnum="31" rota="mtm105" rscc="0.875" rsr="0.204" rsrz="0.273" said="A" seq="34"/>
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	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="44.960" phi="-56.8" psi="-56.5" rama="Favored" resname="LYS" resnum="33" rota="OUTLIER" rscc="0.952" rsr="0.135" rsrz="-0.787" said="A" seq="36">
		<clash atom="HB2" cid="44" clashmag="0.47" dist="2.13"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="48.740" phi="-55.5" psi="-34.9" rama="Favored" resname="LEU" resnum="34" rota="tt" rscc="0.891" rsr="0.253" rsrz="1.388" said="A" seq="37"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="45.030" phi="-66.6" psi="-51.6" rama="Favored" resname="ILE" resnum="36" rota="mt" rscc="0.981" rsr="0.133" rsrz="-0.550" said="A" seq="39"/>
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	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="51.120" phi="-67.4" psi="124.2" rama="Favored" resname="SER" resnum="39" rota="t" rscc="0.928" rsr="0.239" rsrz="1.374" said="A" seq="42">
		<clash atom="HB3" cid="29" clashmag="0.57" dist="1.85"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="51.280" phi="-91.6" psi="6.9" rama="Favored" resname="LEU" resnum="40" rota="mt" rscc="0.956" rsr="0.192" rsrz="0.393" said="A" seq="43"/>
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		<clash atom="O" cid="38" clashmag="0.51" dist="2.09"/>
		<clash atom="HG2" cid="29" clashmag="0.57" dist="1.85"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="51.300" phi="-52.8" psi="-45.5" rama="Favored" resname="TYR" resnum="46" rota="t80" rscc="0.924" rsr="0.128" rsrz="-0.436" said="A" seq="49"/>
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		<clash atom="HG3" cid="38" clashmag="0.51" dist="2.09"/>
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	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="54.390" phi="-65.8" psi="-16.8" rama="Favored" resname="ARG" resnum="50" rota="OUTLIER" rscc="0.941" rsr="0.127" rsrz="-0.748" said="A" seq="53"/>
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	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="51.450" phi="-78.6" psi="137.1" rama="Favored" resname="HIS" resnum="58" rota="t-80" rscc="0.855" rsr="0.305" rsrz="2.239" said="A" seq="61">
		<clash atom="NE2" cid="36" clashmag="0.52" dist="2.24"/>
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	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="48.060" phi="60.3" psi="20.0" rama="Favored" resname="LYS" resnum="59" rota="OUTLIER" rscc="0.935" rsr="0.283" rsrz="1.047" said="A" seq="62">
		<clash atom="HD2" cid="36" clashmag="0.52" dist="2.24"/>
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	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="43.580" phi="-96.8" psi="155.9" rama="Favored" resname="SER" resnum="60" rota="OUTLIER" rscc="0.938" rsr="0.138" rsrz="-0.194" said="A" seq="63"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="44.320" phi="-147.7" psi="125.4" rama="Favored" resname="CYS" resnum="61" rota="t" rscc="0.931" rsr="0.151" rsrz="0.370" said="A" seq="64"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="39.080" phi="-119.0" psi="115.9" rama="Favored" resname="VAL" resnum="62" rota="t" rscc="0.961" rsr="0.205" rsrz="0.755" said="A" seq="65"/>
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		<clash atom="HE21" cid="42" clashmag="0.48" dist="1.62"/>
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	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" cis_peptide="yes" ent="1" icode=" " model="1" num-H-reduce="7" owab="36.620" phi="-77.9" psi="160.9" rama="Favored" resname="PRO" resnum="64" rota="Cg_endo" rscc="0.989" rsr="0.116" rsrz="-0.500" said="A" seq="67"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="36.490" phi="-76.6" psi="142.9" rama="Favored" resname="PRO" resnum="65" rota="Cg_endo" rscc="0.955" rsr="0.135" rsrz="-0.203" said="A" seq="68"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="37.730" phi="-124.1" psi="138.1" rama="Favored" resname="PHE" resnum="66" rota="t80" rscc="0.977" rsr="0.147" rsrz="-0.188" said="A" seq="69">
		<clash atom="CZ" cid="5" clashmag="0.93" dist="2.04"/>
		<clash atom="HZ" cid="2" clashmag="0.98" dist="1.25"/>
		<clash atom="HZ" cid="30" clashmag="0.56" dist="2.10"/>
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	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="37.800" phi="-122.6" psi="130.5" rama="Favored" resname="HIS" resnum="67" rota="m-70" rscc="0.962" rsr="0.147" rsrz="-0.137" said="A" seq="70"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="5" owab="40.530" phi="-154.2" psi="176.0" rama="Favored" resname="CYS" resnum="68" rota="p" rscc="0.965" rsr="0.196" rsrz="1.261" said="A" seq="71"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="48.100" phi="-98.7" psi="-50.1" rama="Favored" resname="GLU" resnum="69" rota="tt0" rscc="0.851" rsr="0.217" rsrz="0.352" said="A" seq="72"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="42.370" phi="-107.2" psi="-37.1" rama="Favored" resname="PHE" resnum="70" rota="m-85" rscc="0.958" rsr="0.203" rsrz="0.750" said="A" seq="73"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="40.600" phi="83.7" psi="-54.7" rama="Favored" resname="GLY" resnum="71" rscc="0.987" rsr="0.105" rsrz="-0.593" said="A" seq="74"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="38.530" phi="-70.2" psi="-13.3" rama="Favored" resname="LYS" resnum="72" rota="mmtt" rscc="0.943" rsr="0.208" rsrz="0.118" said="A" seq="75">
		<clash atom="HA" cid="58" clashmag="0.40" dist="1.95"/>
		<clash atom="HD3" cid="58" clashmag="0.40" dist="1.95"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="36.070" phi="-86.6" psi="-1.6" rama="Favored" resname="THR" resnum="73" rota="p" rscc="0.979" rsr="0.116" rsrz="-0.584" said="A" seq="76"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="33.340" phi="-101.6" psi="120.5" rama="Favored" resname="ILE" resnum="74" rota="mt" rscc="0.978" rsr="0.121" rsrz="-0.751" said="A" seq="77">
		<clash atom="HG21" cid="12" clashmag="0.79" dist="1.65"/>
		<clash atom="HD13" cid="3" clashmag="0.97" dist="1.46"/>
		<clash atom="HD13" cid="15" clashmag="0.74" dist="2.17"/>
		<clash atom="HD11" cid="14" clashmag="0.75" dist="1.85"/>
		<clash atom="CG2" cid="40" clashmag="0.50" dist="2.38"/>
		<clash atom="CD1" cid="9" clashmag="0.85" dist="2.05"/>
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	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="13" owab="39.740" phi="-118.4" psi="123.0" rama="Favored" resname="ARG" resnum="75" rota="mtp85" rscc="0.889" rsr="0.202" rsrz="0.247" said="A" seq="78">
		<clash atom="HD2" cid="26" clashmag="0.59" dist="2.02"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="33.080" phi="-117.4" psi="128.1" rama="Favored" resname="ILE" resnum="76" rota="mt" rscc="0.971" rsr="0.102" rsrz="-1.069" said="A" seq="79"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="34.160" phi="-73.3" psi="-151.7" rama="Allowed" resname="GLY" resnum="77" rscc="0.977" rsr="0.067" rsrz="-1.151" said="A" seq="80"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="37.050" phi="-103.8" psi="145.3" rama="Favored" resname="ASP" resnum="78" rota="m-20" rscc="0.955" rsr="0.112" rsrz="-0.714" said="A" seq="81"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="34.540" phi="50.6" psi="39.3" rama="Favored" resname="HIS" resnum="79" rota="m-70" rscc="0.935" rsr="0.175" rsrz="0.284" said="A" seq="82"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="33.580" phi="-107.4" psi="146.7" rama="Favored" resname="THR" resnum="80" rota="p" rscc="0.964" rsr="0.119" rsrz="-0.536" said="A" seq="83">
		<clash atom="HG21" cid="19" clashmag="0.70" dist="1.91"/>
		<clash atom="HG22" cid="17" clashmag="0.70" dist="1.56"/>
		<clash atom="HG22" cid="47" clashmag="0.46" dist="2.30"/>
		<clash atom="CG2" cid="39" clashmag="0.50" dist="2.24"/>
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	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="37.010" phi="-120.6" psi="128.5" rama="Favored" resname="PHE" resnum="81" rota="t80" rscc="0.950" rsr="0.150" rsrz="-0.137" said="A" seq="84">
		<clash atom="HE2" cid="42" clashmag="0.48" dist="1.62"/>
		<clash atom="HB3" cid="54" clashmag="0.42" 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="32.890" phi="-115.1" psi="118.9" rama="Favored" resname="ILE" resnum="82" rota="mt" rscc="0.965" rsr="0.217" rsrz="0.855" said="A" seq="85"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" flippable-sidechain="1" icode=" " model="1" num-H-reduce="6" owab="36.150" phi="-74.2" psi="177.5" rama="Favored" resname="ASN" resnum="83" rota="OUTLIER" rscc="0.981" rsr="0.159" rsrz="-0.015" said="A" seq="86">
		<clash atom="ND2" cid="41" clashmag="0.50" dist="2.07"/>
		<clash atom="HD22" cid="21" clashmag="0.68" dist="1.40"/>
		<clash atom="HD22" cid="35" clashmag="0.53" dist="2.07"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="0.988" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="38.130" phi="-72.2" psi="161.1" rama="Favored" resname="MSE" resnum="84" rota="ptt?" rscc="0.961" rsr="0.135" said="A" seq="87">
		<clash atom="N" cid="35" clashmag="0.53" dist="2.07"/>
		<clash atom="H" cid="21" clashmag="0.68" dist="1.40"/>
		<clash atom="H" cid="41" clashmag="0.50" dist="2.07"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="6" owab="38.260" phi="66.4" psi="25.8" rama="Favored" resname="ASN" resnum="85" rota="t30" rscc="0.961" rsr="0.213" rsrz="0.778" said="A" seq="88"/>
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	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="34.630" phi="-113.5" psi="128.7" rama="Favored" resname="VAL" resnum="87" rota="t" rscc="0.975" rsr="0.221" rsrz="1.023" said="A" seq="90"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="0.988" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="36.630" phi="-127.8" psi="109.3" rama="Favored" resname="MSE" resnum="88" rota="mtm" rscc="0.938" rsr="0.146" said="A" seq="91">
		<clash atom="HB2" cid="18" clashmag="0.70" dist="1.90"/>
		<clash atom="HE3" cid="3" clashmag="0.97" dist="1.46"/>
		<clash atom="HE3" cid="9" clashmag="0.85" dist="2.05"/>
		<clash atom="HB3" cid="34" clashmag="0.53" dist="2.05"/>
		<clash atom="HE2" cid="2" clashmag="0.98" dist="1.25"/>
		<clash atom="HE2" cid="5" clashmag="0.93" dist="2.04"/>
		<clash atom="CB" cid="16" clashmag="0.71" dist="2.38"/>
		<clash atom="CE" cid="15" clashmag="0.74" dist="2.17"/>
		<clash atom="CE" cid="30" clashmag="0.56" dist="2.10"/>
		<clash atom="HE1" cid="12" clashmag="0.79" dist="1.65"/>
		<clash atom="HE1" cid="40" clashmag="0.50" dist="2.38"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="36.780" phi="-78.1" psi="98.7" rama="Favored" resname="LEU" resnum="89" rota="mt" rscc="0.988" rsr="0.144" rsrz="-0.390" said="A" seq="92">
		<clash atom="O" cid="1" clashmag="1.02" dist="1.60"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="36.640" phi="-107.0" psi="55.2" rama="Allowed" resname="ASP" resnum="90" rota="p-10" rscc="0.957" rsr="0.125" rsrz="-0.531" said="A" seq="93">
		<clash atom="HB3" cid="6" clashmag="0.90" dist="1.70"/>
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	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="37.550" phi="-79.5" psi="-24.9" rama="Favored" resname="GLY" resnum="91" rscc="0.949" rsr="0.121" rsrz="-0.357" said="A" seq="94"/>
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		<clash atom="N" cid="23" clashmag="0.61" dist="2.10"/>
		<clash atom="H" cid="4" clashmag="0.94" dist="1.29"/>
		<clash atom="HB2" cid="33" clashmag="0.54" dist="1.89"/>
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	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="33.220" phi="-50.9" psi="139.6" rama="Favored" resname="PRO" resnum="93" rota="Cg_exo" rscc="0.980" rsr="0.124" rsrz="-0.375" said="A" seq="96"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="28.860" phi="-119.3" psi="115.4" rama="Favored" resname="ILE" resnum="94" rota="mt" rscc="0.975" rsr="0.140" rsrz="-0.433" said="A" seq="97"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="32.640" phi="-116.9" psi="121.5" rama="Favored" resname="ILE" resnum="96" rota="mt" rscc="0.981" rsr="0.112" rsrz="-0.901" said="A" seq="99"/>
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		<clash atom="O" cid="19" clashmag="0.70" dist="1.91"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="36.650" phi="-97.4" psi="154.6" rama="Favored" resname="ASP" resnum="98" rota="m-20" rscc="0.919" rsr="0.110" rsrz="-0.742" said="A" seq="101"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="36.630" phi="52.0" psi="34.4" rama="Favored" resname="HIS" resnum="99" rota="m80" rscc="0.940" rsr="0.130" rsrz="-0.392" said="A" seq="102">
		<clash atom="N" cid="47" clashmag="0.46" dist="2.30"/>
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	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="34.030" phi="-90.5" psi="139.0" rama="Favored" resname="VAL" resnum="100" rota="t" rscc="0.948" rsr="0.148" rsrz="-0.199" said="A" seq="103">
		<clash atom="H" cid="17" clashmag="0.70" dist="1.56"/>
		<clash atom="H" cid="39" clashmag="0.50" dist="2.24"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="33.770" phi="-116.9" psi="126.3" rama="Favored" resname="LEU" resnum="101" rota="mt" rscc="0.963" rsr="0.205" rsrz="0.605" said="A" seq="104">
		<clash atom="HD23" cid="54" clashmag="0.42" 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="32.410" phi="-119.8" psi="121.4" rama="Favored" resname="ILE" resnum="102" rota="mt" rscc="0.980" rsr="0.228" rsrz="1.038" said="A" seq="105"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="32.580" phi="-76.4" psi="168.0" rama="Favored" resname="GLY" resnum="103" rscc="0.990" rsr="0.252" rsrz="1.569" said="A" seq="106"/>
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		<clash atom="O" cid="46" clashmag="0.46" dist="2.49"/>
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		<clash atom="NH2" cid="46" clashmag="0.46" dist="2.49"/>
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		<clash atom="O" cid="24" clashmag="0.60" dist="2.02"/>
		<clash atom="O" cid="49" clashmag="0.45" dist="2.62"/>
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		<clash atom="CD1" cid="22" clashmag="0.65" dist="2.76"/>
		<clash atom="HD11" cid="7" clashmag="0.87" dist="1.39"/>
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		<clash atom="C" cid="55" clashmag="0.41" dist="2.94"/>
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		<clash atom="HG2" cid="57" clashmag="0.41" dist="2.20"/>
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	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="31.490" phi="-98.4" psi="112.7" rama="Favored" resname="VAL" resnum="162" rota="t" rscc="0.987" rsr="0.150" rsrz="-0.166" said="A" seq="165"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" flippable-sidechain="1" icode=" " model="1" num-H-reduce="6" owab="35.480" phi="-101.2" psi="-25.9" rama="Favored" resname="ASN" resnum="163" rota="m120" rscc="0.924" rsr="0.128" rsrz="-0.470" said="A" seq="166"/>
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	<ModelledSubgroup NatomsEDS="18" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="8" owab="32.550" phi="-120.9" psi="165.2" rama="Favored" resname="GLN" resnum="164" rota="pt20" rscc="0.936" rsr="0.179" rsrz="0.041" said="A" seq="167"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="31.730" phi="-60.7" psi="143.1" rama="Favored" resname="ASP" resnum="165" rota="m-20" rscc="0.966" rsr="0.097" rsrz="-0.925" said="A" seq="168"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="28.840" phi="-110.5" psi="121.8" rama="Favored" resname="VAL" resnum="166" rota="t" rscc="0.985" rsr="0.131" rsrz="-0.484" said="A" seq="169"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="29.640" phi="-60.1" psi="160.5" rama="Favored" resname="PRO" resnum="167" rota="Cg_exo" rscc="0.972" rsr="0.093" rsrz="-0.859" said="A" seq="170"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="31.200" phi="-63.8" psi="167.1" rama="Favored" resname="PRO" resnum="168" rota="Cg_exo" rscc="0.981" rsr="0.085" rsrz="-0.984" said="A" seq="171"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="33.200" phi="44.4" psi="54.0" rama="Favored" resname="ASP" resnum="169" rota="m-20" rscc="0.956" rsr="0.134" rsrz="-0.404" said="A" seq="172"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="32.140" phi="-142.1" psi="143.2" rama="Favored" resname="THR" resnum="170" rota="m" rscc="0.977" rsr="0.123" rsrz="-0.471" said="A" seq="173"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="32.140" phi="-108.8" psi="131.5" rama="Favored" resname="LEU" resnum="171" rota="tp" rscc="0.971" rsr="0.141" rsrz="-0.439" said="A" seq="174"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="36.200" phi="-134.7" psi="149.8" rama="Favored" resname="VAL" resnum="172" rota="m" rscc="0.967" rsr="0.112" rsrz="-0.802" said="A" seq="175">
		<clash atom="HG12" cid="31" clashmag="0.55" dist="1.87"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="3" owab="43.590" phi="-163.9" psi="168.7" rama="Favored" resname="GLY" resnum="173" rscc="0.969" rsr="0.124" rsrz="-0.313" said="A" seq="176"/>
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	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="7" owab="57.850" phi="-55.8" psi="158.5" rama="Favored" resname="PRO" resnum="176" rota="Cg_exo" rscc="0.903" rsr="0.207" rsrz="0.922" said="A" seq="179"/>
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		<clash atom="HA" cid="31" clashmag="0.55" dist="1.87"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="54.740" phi="-90.2" psi="-28.6" rama="Favored" resname="LEU" resnum="180" rota="mt" rscc="0.939" rsr="0.242" rsrz="1.209" said="A" seq="183"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="2" icode=" " model="1" mogul-ignore="yes" owab="42.650" resname="CA" resnum="193" rscc="0.973" rsr="0.085" said="B" seq="."/>
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		<clash atom="O" cid="28" clashmag="0.58" dist="2.03"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.330" chain="A" ent="3" icode=" " model="1" owab="73.870" resname="HOH" resnum="206" rscc="0.596" rsr="0.349" said="D" seq="."/>
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		<clash atom="O" cid="14" clashmag="0.75" dist="1.85"/>
		<clash atom="O" cid="16" clashmag="0.71" dist="2.38"/>
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		<clash atom="O" cid="32" clashmag="0.54" dist="2.18"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="61.820" resname="HOH" resnum="223" rscc="0.441" rsr="0.313" said="D" seq=".">
		<clash atom="O" cid="56" clashmag="0.41" dist="2.58"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="110.020" resname="HOH" resnum="224" rscc="-0.634" rsr="0.397" said="D" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="106.790" resname="HOH" resnum="226" rscc="0.936" rsr="0.994" said="D" seq=".">
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="31.990" resname="HOH" resnum="241" rscc="0.955" rsr="0.098" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="38.650" resname="HOH" resnum="242" rscc="0.816" rsr="0.120" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="47.390" resname="HOH" resnum="243" rscc="0.574" rsr="0.338" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="46.840" resname="HOH" resnum="244" rscc="0.725" rsr="0.212" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="43.220" resname="HOH" resnum="245" rscc="0.689" rsr="0.619" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="40.630" resname="HOH" resnum="246" rscc="0.914" rsr="0.411" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="25.930" resname="HOH" resnum="247" rscc="0.855" rsr="0.480" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="32.890" resname="HOH" resnum="248" rscc="0.645" rsr="0.659" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="39.080" resname="HOH" resnum="249" rscc="0.821" rsr="0.142" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="48.960" resname="HOH" resnum="250" rscc="0.367" rsr="0.565" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="39.800" resname="HOH" resnum="251" rscc="0.876" rsr="0.343" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="50.660" resname="HOH" resnum="252" rscc="0.671" rsr="0.888" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="31.070" resname="HOH" resnum="253" rscc="0.837" rsr="0.657" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="48.830" resname="HOH" resnum="254" rscc="0.462" rsr="0.391" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="33.860" resname="HOH" resnum="255" rscc="0.902" rsr="0.654" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="33.070" resname="HOH" resnum="256" rscc="0.808" rsr="0.175" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="50.490" resname="HOH" resnum="257" rscc="0.373" rsr="0.780" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="31.270" resname="HOH" resnum="258" rscc="0.857" rsr="0.331" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="39.370" resname="HOH" resnum="259" rscc="0.902" rsr="0.298" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.330" chain="A" ent="3" icode=" " model="1" owab="46.370" resname="HOH" resnum="260" rscc="0.360" rsr="1.588" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.330" chain="A" ent="3" icode=" " model="1" owab="31.620" resname="HOH" resnum="261" rscc="0.842" rsr="1.028" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " model="1" owab="39.520" resname="HOH" resnum="262" rscc="0.841" rsr="0.242" said="D" seq="."/>
	<ModelledEntityInstance absolute_RSRZ_percentile="22.83" absolute_rama_percentile="100.00" absolute_sidechain_percentile="5.27" angles_rmsz="0.81" bonds_rmsz="0.77" chain="A" ent="1" model="1" num_angles_rmsz="1879" num_bonds_rmsz="1392" relative_RSRZ_percentile="24.08" relative_rama_percentile="100.00" relative_sidechain_percentile="10.05" 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,PDB-revision-number,pdbid,resol-high-from-reflectionsfile,attemptedValidationSteps,XMLcreationDate,resol-low-from-reflectionsfile,PDB-deposition-date" version="trunk30967"/>
		<program name="mogul" properties="mogul-ignore" version="unknown"/>
		<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="trunk30967"/>
		<program name="xtriage" properties="xtriage_input_columns,numMillerIndices,TwinFraction,DataAnisotropy,TransNCS,centric_outliers,TwinL,acentric_outliers,WilsonBestimate,TwinL2,IoverSigma,WilsonBaniso" version="1.13"/>
		<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"/>
		<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>
