<?xml version="1.0" ?>
<wwPDB-validation-information xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:noNamespaceSchemaLocation="http://www.wwpdb.org/validation/schema/wwpdb_validation_v1.xsd http://www.wwpdb.org/validation/schema/wwpdb_validation_v1.xsd">
	<Entry B_factor_type="FULL" CCP4version="6.1.3" DCC_R="0.16" DCC_Rfree="0.18" DCC_refinement_program="REFMAC" DataAnisotropy="0.146" DataCompleteness="99.96" EDS_R="0.17" EDS_resolution="1.50" EDS_resolution_low="29.67" Fo_Fc_correlation="0.959" IoverSigma="12.54(1.50A)" PDB-revision-number="1" RefmacVersion="5.8.0122" RestypesNotcheckedForBondAngleGeometry="GOL,59E" TransNCS="The largest off-origin peak in the Patterson function is 10.73% of the height of the origin peak. No significant pseudotranslation is detected." TwinL="0.481" TwinL2="0.314" WilsonBaniso="[13.498,11.670,12.463,0.000,0.000,0.000]" WilsonBestimate="12.532" XMLcreationDate="Nov  2, 2015 -- 07:20 AM EST" absolute-percentile-DCC_Rfree="95.4" absolute-percentile-clashscore="99.2" absolute-percentile-percent-RSRZ-outliers="83.4" absolute-percentile-percent-calpha-angle-outliers="100.0" absolute-percentile-percent-rama-outliers="100.0" absolute-percentile-percent-rota-outliers="100.0" acentric_outliers="0" angles_rmsz="0.65" attemptedValidationSteps="mogul,xtriage,molprobity,validation-pack,eds,percentiles,writexml" babinet_b="35.429" babinet_k="0.167" bonds_rmsz="0.46" bulk_solvent_b="38.938" bulk_solvent_k="0.385" centric_outliers="0" clashscore="0.55" high-resol-relative-percentile-DCC_Rfree="1.5" high-resol-relative-percentile-clashscore="1.5" high-resol-relative-percentile-percent-RSRZ-outliers="1.5" high-resol-relative-percentile-percent-calpha-angle-outliers="1.5" high-resol-relative-percentile-percent-rama-outliers="1.5" high-resol-relative-percentile-percent-rota-outliers="1.5" low-resol-relative-percentile-DCC_Rfree="1.5" low-resol-relative-percentile-clashscore="1.5" low-resol-relative-percentile-percent-RSRZ-outliers="1.5" low-resol-relative-percentile-percent-calpha-angle-outliers="1.5" low-resol-relative-percentile-percent-rama-outliers="1.5" low-resol-relative-percentile-percent-rota-outliers="1.5" num-H-reduce="883" num-free-reflections="1025" numMillerIndices="20134" numPDBids-absolute-percentile-DCC_Rfree="83175" numPDBids-absolute-percentile-clashscore="93826" numPDBids-absolute-percentile-percent-RSRZ-outliers="83181" numPDBids-absolute-percentile-percent-calpha-angle-outliers="92159" numPDBids-absolute-percentile-percent-rama-outliers="92073" numPDBids-absolute-percentile-percent-rota-outliers="92050" numPDBids-relative-percentile-DCC_Rfree="1879" numPDBids-relative-percentile-clashscore="2076" numPDBids-relative-percentile-percent-RSRZ-outliers="1880" numPDBids-relative-percentile-percent-calpha-angle-outliers="2022" numPDBids-relative-percentile-percent-rama-outliers="2023" numPDBids-relative-percentile-percent-rota-outliers="2021" num_angles_rmsz="1242" num_bonds_rmsz="923" pdbid="5DFD" percent-RSRZ-outliers="0.93" percent-calpha-angle-outliers="0.00" percent-free-reflections="5.36" percent-rama-outliers="0.00" percent-rota-outliers="0.00" percentilebins="all,1.5,xray" relative-percentile-DCC_Rfree="89.2" relative-percentile-clashscore="98.4" relative-percentile-percent-RSRZ-outliers="86.5" relative-percentile-percent-calpha-angle-outliers="100.0" relative-percentile-percent-rama-outliers="100.0" relative-percentile-percent-rota-outliers="100.0" xtriage_input_columns="F_meas_au,F_meas_sigma_au"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="4" owab="21.110" resname="SER" resnum="347" rota="p" rscc="0.901" rsr="0.113" rsrz="0.499" said="A" seq="6"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="48.6" ent="1" gamma="91.5" icode=" " model="1" num-H-reduce="6" owab="23.020" phi="-58.1" psi="-44.2" rama="Favored" resname="GLU" resnum="348" rota="tt0" rscc="0.883" rsr="0.156" rsrz="0.583" said="A" seq="7"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="51.6" ent="1" gamma="90.9" icode=" " model="1" num-H-reduce="8" owab="19.940" phi="-66.9" psi="-37.7" rama="Favored" resname="GLN" resnum="349" rota="mt-30" rscc="0.904" rsr="0.136" rsrz="0.534" said="A" seq="8"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="54.9" ent="1" gamma="89.4" icode=" " model="1" num-H-reduce="11" owab="14.910" phi="-68.9" psi="-30.8" rama="Favored" resname="LEU" resnum="350" rota="mt" rscc="0.974" rsr="0.076" rsrz="-0.386" said="A" seq="9"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="50.1" ent="1" gamma="87.9" icode=" " model="1" num-H-reduce="13" owab="15.830" phi="-64.8" psi="-40.3" rama="Favored" resname="LYS" resnum="351" rota="mmtt" rscc="0.936" rsr="0.118" rsrz="-0.048" said="A" seq="10"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="49.4" ent="1" gamma="88.4" icode=" " model="1" num-H-reduce="7" owab="12.440" phi="-60.6" psi="-43.8" rama="Favored" resname="HIS" resnum="352" rota="t60" rscc="0.965" rsr="0.068" rsrz="-0.418" said="A" seq="11"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="51.1" ent="1" gamma="91.0" icode=" " model="1" num-H-reduce="5" owab="9.830" phi="-60.9" psi="-43.6" rama="Favored" resname="CYS" resnum="353" rota="m" rscc="0.988" rsr="0.066" rsrz="-0.256" said="A" seq="12"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="52.9" ent="1" gamma="89.2" icode=" " model="1" num-H-reduce="6" owab="9.830" phi="-61.7" psi="-39.7" rama="Favored" resname="ASN" resnum="354" rota="t30" rscc="0.979" rsr="0.055" rsrz="-0.721" said="A" seq="13"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="48.8" ent="1" gamma="90.0" icode=" " model="1" num-H-reduce="3" owab="8.530" phi="-58.6" psi="-45.1" rama="Favored" resname="GLY" resnum="355" rscc="0.984" rsr="0.070" rsrz="-0.246" said="A" seq="14"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="52.1" ent="1" gamma="90.4" icode=" " model="1" num-H-reduce="11" owab="9.660" phi="-57.4" psi="-49.1" rama="Favored" resname="ILE" resnum="356" rota="mt" rscc="0.970" rsr="0.077" rsrz="-0.356" said="A" seq="15"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="49.9" ent="1" gamma="91.4" icode=" " model="1" num-H-reduce="11" owab="10.700" phi="-53.7" psi="-48.5" rama="Favored" resname="LEU" resnum="357" rota="tp" rscc="0.968" rsr="0.074" rsrz="-0.446" said="A" seq="16"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="50.0" ent="1" gamma="90.1" icode=" " model="1" num-H-reduce="13" owab="15.670" phi="-60.6" psi="-42.5" rama="Favored" resname="LYS" resnum="358" rota="mmtt" rscc="0.947" rsr="0.107" rsrz="-0.231" said="A" seq="17"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="53.0" ent="1" gamma="92.6" icode=" " model="1" num-H-reduce="6" owab="11.290" phi="-61.5" psi="-44.5" rama="Favored" resname="GLU" resnum="359" rota="tt0" rscc="0.982" rsr="0.052" rsrz="-1.029" said="A" seq="18"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="44.7" ent="1" gamma="88.7" icode=" " model="1" num-H-reduce="11" owab="10.720" phi="-61.4" psi="-28.9" rama="Favored" resname="LEU" resnum="360" rota="mt" rscc="0.966" rsr="0.097" rsrz="0.247" said="A" seq="19"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="108.2" ent="1" gamma="94.7" icode=" " model="1" num-H-reduce="11" owab="12.770" phi="-89.1" psi="-2.7" rama="Favored" resname="LEU" resnum="361" rota="mt" rscc="0.962" rsr="0.070" rsrz="-0.566" said="A" seq="20"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="248.3" ent="1" gamma="127.6" icode=" " model="1" num-H-reduce="5" owab="13.600" phi="-82.3" psi="160.2" rama="Favored" resname="SER" resnum="362" rota="p" rscc="0.960" rsr="0.064" rsrz="-0.483" said="A" seq="21"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="76.1" ent="1" gamma="88.8" icode=" " model="1" num-H-reduce="13" owab="24.070" phi="-59.2" psi="-29.2" rama="Favored" resname="LYS" resnum="363" rota="mmmt" rscc="0.872" rsr="0.259" rsrz="2.290" said="A" seq="22"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="26.4" ent="1" gamma="90.6" icode=" " model="1" num-H-reduce="13" owab="23.390" phi="-46.0" psi="-39.2" rama="Favored" resname="LYS" resnum="364" rota="tttt" rscc="0.920" rsr="0.199" rsrz="1.295" said="A" seq="23"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" calpha_angle_status="Allowed" chain="A" delta="112.3" ent="1" gamma="102.2" icode=" " model="1" num-H-reduce="7" owab="11.380" phi="-114.0" psi="9.1" rama="Favored" resname="HIS" resnum="365" rota="m-70" rscc="0.973" rsr="0.055" rsrz="-0.671" said="A" seq="24"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="70.4" ent="1" gamma="95.4" icode=" " model="1" num-H-reduce="5" owab="11.580" phi="-62.5" psi="-27.5" rama="Favored" resname="ALA" resnum="366" rscc="0.977" rsr="0.052" rsrz="-0.741" said="A" seq="25"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" calpha_angle_status="Allowed" chain="A" delta="14.9" ent="1" gamma="90.3" icode=" " lig_rsrz_nbr_id="1" model="1" num-H-reduce="5" owab="12.150" phi="-63.0" psi="-27.2" rama="Favored" resname="ALA" resnum="367" rscc="0.945" rsr="0.066" rsrz="-0.399" said="A" seq="26"/>
	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" calpha_angle_status="Allowed" chain="A" delta="63.1" ent="1" gamma="103.0" icode=" " lig_rsrz_nbr_id="1" model="1" num-H-reduce="9" owab="11.220" phi="-122.5" psi="-9.8" rama="Favored" resname="TYR" resnum="368" rota="p90" rscc="0.979" rsr="0.052" rsrz="-0.883" said="A" seq="27"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="89.0" ent="1" gamma="97.4" icode=" " model="1" num-H-reduce="5" owab="9.420" phi="-86.1" psi="-21.3" rama="Favored" resname="ALA" resnum="369" rscc="0.983" rsr="0.062" rsrz="-0.496" said="A" seq="28"/>
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	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="92.2" ent="1" gamma="99.2" icode=" " lig_rsrz_nbr_id="0" model="1" num-H-reduce="9" owab="9.490" phi="-101.6" psi="4.7" rama="Favored" resname="PHE" resnum="372" rota="m-85" rscc="0.970" rsr="0.069" rsrz="-0.389" said="A" seq="31"/>
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	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="48.6" ent="1" gamma="96.6" icode=" " model="1" num-H-reduce="5" owab="16.190" phi="-64.2" psi="-44.5" rama="Favored" resname="ALA" resnum="378" rscc="0.952" rsr="0.066" rsrz="-0.399" said="A" seq="37"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="51.1" ent="1" gamma="91.4" icode=" " model="1" num-H-reduce="5" owab="23.760" phi="-57.8" psi="-49.7" rama="Favored" resname="SER" resnum="379" rota="m" rscc="0.860" rsr="0.160" rsrz="1.441" said="A" seq="38"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="53.9" ent="1" gamma="100.9" icode=" " model="1" num-H-reduce="11" owab="12.000" phi="-95.6" psi="-38.9" rama="Favored" resname="ILE" resnum="389" rota="mt" rscc="0.959" rsr="0.073" rsrz="-0.483" said="A" seq="48"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="175.2" ent="1" gamma="111.0" icode=" " model="1" num-H-reduce="11" owab="11.220" phi="-104.7" psi="108.1" rama="Favored" resname="ILE" resnum="390" rota="mm" rscc="0.964" rsr="0.089" rsrz="0.022" said="A" seq="49"/>
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		<clash atom="HA" cid="0" clashmag="0.41" dist="2.01"/>
		<clash atom="HE2" cid="0" clashmag="0.41" dist="2.01"/>
	</ModelledSubgroup>
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	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="48.9" ent="1" gamma="91.2" icode=" " model="1" num-H-reduce="9" owab="9.980" phi="-69.1" psi="-27.5" rama="Favored" resname="TYR" resnum="426" rota="m-85" rscc="0.954" rsr="0.090" rsrz="0.282" said="A" seq="85"/>
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	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="58.1" ent="1" gamma="101.9" icode=" " lig_rsrz_nbr_id="0" model="1" num-H-reduce="9" owab="10.590" phi="-77.2" psi="-39.6" rama="Favored" resname="TYR" resnum="428" rota="t80" rscc="0.953" rsr="0.079" rsrz="-0.055" said="A" seq="87"/>
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	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="247.0" ent="1" gamma="110.3" icode=" " model="1" num-H-reduce="7" owab="18.420" phi="-60.3" psi="150.1" rama="Favored" resname="PRO" resnum="430" rota="Cg_exo" rscc="0.953" rsr="0.108" rsrz="0.478" said="A" seq="89"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="55.3" ent="1" gamma="94.3" icode=" " model="1" num-H-reduce="7" owab="19.810" phi="-66.7" psi="-17.6" rama="Favored" resname="PRO" resnum="431" rota="Cg_endo" rscc="0.945" rsr="0.075" rsrz="-0.249" said="A" seq="90"/>
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	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="236.1" ent="1" gamma="118.5" icode=" " lig_rsrz_nbr_id="0" model="1" num-H-reduce="7" owab="21.650" phi="-73.8" psi="144.1" rama="Favored" resname="HIS" resnum="433" rota="t-80" rscc="0.789" rsr="0.163" rsrz="1.430" said="A" seq="92"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="56.5" ent="1" gamma="91.3" icode=" " lig_rsrz_nbr_id="0,1" model="1" num-H-reduce="4" owab="20.760" phi="-54.7" psi="-37.8" rama="Favored" resname="ASP" resnum="434" rota="m-20" rscc="0.876" rsr="0.160" rsrz="1.088" said="A" seq="93"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="53.8" ent="1" gamma="90.0" icode=" " lig_rsrz_nbr_id="0" model="1" num-H-reduce="9" owab="11.580" phi="-66.4" psi="-31.2" rama="Favored" resname="VAL" resnum="435" rota="p" rscc="0.970" rsr="0.061" rsrz="-0.746" said="A" seq="94"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="52.5" ent="1" gamma="90.2" icode=" " model="1" num-H-reduce="9" owab="10.680" phi="-68.8" psi="-39.0" rama="Favored" resname="VAL" resnum="436" rota="t" rscc="0.982" rsr="0.058" rsrz="-0.836" said="A" seq="95"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="11" owab="9.890" phi="-68.9" psi="-35.2" rama="Favored" resname="LEU" resnum="442" rota="tp" rscc="0.970" rsr="0.080" rsrz="-0.265" said="A" seq="101"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="8" owab="11.240" phi="-66.0" psi="-34.9" rama="Favored" resname="GLN" resnum="443" rota="tt0" rscc="0.962" rsr="0.111" rsrz="0.099" said="A" seq="102"/>
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	<ModelledSubgroup NatomsEDS="12" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="2" owab="12.410" phi="-61.5" psi="-44.2" rama="Favored" resname="ASP" resnum="444" rota="t70" rscc="0.968" rsr="0.112" rsrz="0.247" said="A" seq="103"/>
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	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="47.4" ent="1" gamma="98.6" icode=" " model="1" num-H-reduce="9" owab="8.780" phi="-61.1" psi="-52.4" rama="Favored" resname="PHE" resnum="446" rota="t80" rscc="0.966" rsr="0.117" rsrz="1.140" said="A" seq="105"/>
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	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="40.2" ent="1" gamma="93.1" icode=" " model="1" num-H-reduce="9" owab="11.560" phi="-65.8" psi="-38.1" rama="Favored" resname="PHE" resnum="448" rota="m-85" rscc="0.944" rsr="0.095" rsrz="0.439" said="A" seq="107"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="55.4" ent="1" gamma="94.4" icode=" " model="1" num-H-reduce="13" owab="10.270" phi="-79.2" psi="-34.7" rama="Favored" resname="ARG" resnum="449" rota="ttt180" rscc="0.971" rsr="0.073" rsrz="-0.591" said="A" seq="108"/>
	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" calpha_angle_status="Favoured" chain="A" delta="62.0" ent="1" gamma="87.9" icode=" " model="1" num-H-reduce="9" owab="10.530" phi="-62.4" psi="-34.9" rama="Favored" resname="TYR" resnum="450" rota="t80" rscc="0.973" rsr="0.098" rsrz="0.528" said="A" seq="109"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" num-H-reduce="9" owab="24.910" phi="-48.5" psi="126.8" rama="Favored" resname="MET" resnum="453" rota="tpp" rscc="0.907" rsr="0.111" rsrz="0.453" said="A" seq="112"/>
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	<ModelledSubgroup NatomsEDS="31" altcode=" " avgoccu="1.000" chain="A" ent="2" icode=" " ligRSRZ="2.85" ligRSRnbrMean="0.08" ligRSRnbrStdev="0.03" ligRSRnumnbrs="14" lig_rsrz_nbr_id="0" ligand_density_outlier="yes" model="1" mogul_angles_rmsz="1.99" mogul_bonds_rmsz="1.95" mogul_rmsz_numangles="35" mogul_rmsz_numbonds="28" owab="17.560" resname="59E" resnum="501" rscc="0.891" rsr="0.176" said="B" seq=".">
		<mog-angle-outlier Zscore="2.09" atoms="OAU,CAT,CAS" mean="111.58" mindiff="0.12" numobs="423" obsval="117.00" stdev="2.59"/>
		<mog-angle-outlier Zscore="6.32" atoms="CAI,NAH,CAG" mean="117.62" mindiff="3.51" numobs="24" obsval="123.89" stdev="0.99"/>
		<mog-angle-outlier Zscore="-2.05" atoms="NAN,CAJ,NAK" mean="111.00" mindiff="0.39" numobs="20" obsval="109.49" stdev="0.74"/>
		<mog-angle-outlier Zscore="-3.64" atoms="CAF,CAE,NAK" mean="119.49" mindiff="0.04" numobs="246" obsval="115.67" stdev="1.05"/>
		<mog-angle-outlier Zscore="-3.95" atoms="CAF,CAE,CAD" mean="122.83" mindiff="0.61" numobs="21" obsval="119.76" stdev="0.78"/>
		<mog-angle-outlier Zscore="2.39" atoms="CAE,CAD,CAG" mean="122.71" mindiff="0.05" numobs="152" obsval="126.18" stdev="1.45"/>
		<mog-angle-outlier Zscore="-2.46" atoms="CAC,CAD,CAG" mean="118.87" mindiff="0.06" numobs="196" obsval="115.06" stdev="1.55"/>
		<mog-angle-outlier Zscore="-3.01" atoms="CAD,CAG,NAH" mean="124.46" mindiff="0.10" numobs="76" obsval="120.28" stdev="1.39"/>
		<mog-angle-outlier Zscore="4.03" atoms="CAD,CAG,CAQ" mean="117.66" mindiff="1.55" numobs="52" obsval="123.92" stdev="1.55"/>
		<mog-bond-outlier Zscore="3.30" atoms="CAI,NAH" mean="1.47" mindiff="0.01" numobs="24" obsval="1.50" stdev="0.01"/>
		<mog-bond-outlier Zscore="4.64" atoms="CAG,NAH" mean="1.28" mindiff="0.03" numobs="87" obsval="1.34" stdev="0.01"/>
		<mog-bond-outlier Zscore="-2.50" atoms="CBB,CBA" mean="1.42" mindiff="0.03" numobs="27" obsval="1.35" stdev="0.03"/>
		<mog-bond-outlier Zscore="-3.03" atoms="CAQ,CBB" mean="1.43" mindiff="0.00" numobs="1148" obsval="1.37" stdev="0.02"/>
		<mog-bond-outlier Zscore="-4.45" atoms="CAD,CAG" mean="1.49" mindiff="0.00" numobs="258" obsval="1.42" stdev="0.02"/>
		<mog-bond-outlier Zscore="-3.93" atoms="CAZ,CBA" mean="1.41" mindiff="0.00" numobs="7037" obsval="1.34" stdev="0.02"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " ligRSRZ="6.46" ligRSRnbrMean="0.09" ligRSRnbrStdev="0.03" ligRSRnumnbrs="10" lig_rsrz_nbr_id="1" ligand_density_outlier="yes" model="1" mogul_angles_rmsz="0.41" mogul_bonds_rmsz="0.41" mogul_rmsz_numangles="5" mogul_rmsz_numbonds="5" num-H-reduce="8" owab="30.820" resname="GOL" resnum="502" rscc="0.753" rsr="0.301" said="C" seq="."/>
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		<symm-clash atom="O" clashmag="1.28" dist="0.92" scid="0" symop="1_555"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="20.960" resname="HOH" resnum="602" rscc="0.915" rsr="0.083" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="22.170" resname="HOH" resnum="603" rscc="0.980" rsr="0.191" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="25.740" resname="HOH" resnum="604" rscc="0.985" rsr="0.065" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="13.460" resname="HOH" resnum="605" rscc="0.975" rsr="0.125" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="10.910" resname="HOH" resnum="606" rscc="0.985" rsr="0.092" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="11.290" resname="HOH" resnum="607" rscc="0.996" rsr="0.115" said="D" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="21.920" resname="HOH" resnum="611" rscc="0.903" rsr="0.100" said="D" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="31.800" resname="HOH" resnum="613" rscc="0.859" rsr="0.175" said="D" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="23.570" resname="HOH" resnum="616" rscc="0.972" rsr="0.067" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="13.000" resname="HOH" resnum="617" rscc="0.984" rsr="0.116" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="12.640" resname="HOH" resnum="618" rscc="0.978" rsr="0.084" said="D" seq="."/>
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		<symm-clash atom="O" clashmag="1.28" dist="0.92" scid="0" symop="2_545"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="13.630" resname="HOH" resnum="636" rscc="0.994" rsr="0.074" said="D" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="32.960" resname="HOH" resnum="658" rscc="0.781" rsr="0.118" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="27.710" resname="HOH" resnum="659" rscc="0.859" rsr="0.125" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="29.180" resname="HOH" resnum="660" rscc="0.970" rsr="0.076" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="30.720" resname="HOH" resnum="661" rscc="0.896" rsr="0.151" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="24.000" resname="HOH" resnum="662" rscc="0.924" rsr="0.172" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="34.100" resname="HOH" resnum="663" rscc="0.910" rsr="0.219" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="22.750" resname="HOH" resnum="664" rscc="0.979" rsr="0.088" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="33.830" resname="HOH" resnum="665" rscc="0.789" rsr="0.161" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="11.990" resname="HOH" resnum="666" rscc="0.993" rsr="0.123" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="26.980" resname="HOH" resnum="667" rscc="0.959" rsr="0.092" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="24.150" resname="HOH" resnum="668" rscc="0.930" rsr="0.067" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="16.360" resname="HOH" resnum="669" rscc="0.925" rsr="0.100" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="22.130" resname="HOH" resnum="670" rscc="0.972" rsr="0.088" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="21.050" resname="HOH" resnum="671" rscc="0.955" rsr="0.075" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="34.080" resname="HOH" resnum="672" rscc="0.840" rsr="0.159" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="25.530" resname="HOH" resnum="673" rscc="0.982" rsr="0.052" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="4" icode=" " model="1" owab="6.790" resname="HOH" resnum="674" rscc="0.985" rsr="0.229" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="21.990" resname="HOH" resnum="675" rscc="0.979" rsr="0.097" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="43.850" resname="HOH" resnum="676" rscc="0.857" rsr="0.296" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="35.120" resname="HOH" resnum="677" rscc="0.808" rsr="0.129" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="45.030" resname="HOH" resnum="678" rscc="0.886" rsr="0.117" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="22.990" resname="HOH" resnum="679" rscc="0.941" rsr="0.122" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="32.030" resname="HOH" resnum="680" rscc="0.851" rsr="0.181" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="29.030" resname="HOH" resnum="681" rscc="0.962" rsr="0.111" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="19.130" resname="HOH" resnum="682" rscc="0.923" rsr="0.168" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="30.160" resname="HOH" resnum="683" rscc="0.919" rsr="0.117" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="33.210" resname="HOH" resnum="684" rscc="0.845" rsr="0.135" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="34.410" resname="HOH" resnum="685" rscc="0.901" rsr="0.081" said="D" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " model="1" owab="22.690" resname="HOH" resnum="686" rscc="0.930" rsr="0.070" said="D" seq="."/>
	<ModelledEntityInstance absolute_RSRZ_percentile="83.39" absolute_rama_percentile="100.00" absolute_sidechain_percentile="100.00" angles_rmsz="0.65" bonds_rmsz="0.46" chain="A" ent="1" model="1" num_angles_rmsz="1242" num_bonds_rmsz="923" relative_RSRZ_percentile="86.49" relative_rama_percentile="100.00" relative_sidechain_percentile="100.00" said="A"/>
	<programs>
		<program name="validation-pipeline" properties="pdbid,PDB-revision-number,attemptedValidationSteps,XMLcreationDate,percentilebins" version="rb-20025774"/>
		<program name="percentiles" properties="numPDBids-absolute-percentile-percent-rota-outliers,high-resol-relative-percentile-percent-rota-outliers,absolute-percentile-percent-RSRZ-outliers,absolute-percentile-percent-calpha-angle-outliers,relative-percentile-percent-calpha-angle-outliers,relative-percentile-percent-rama-outliers,numPDBids-absolute-percentile-percent-calpha-angle-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,low-resol-relative-percentile-percent-calpha-angle-outliers,numPDBids-relative-percentile-percent-calpha-angle-outliers,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-percent-calpha-angle-outliers,high-resol-relative-percentile-DCC_Rfree" version="25063"/>
		<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="xtriage" properties="xtriage_input_columns,numMillerIndices,DataAnisotropy,TransNCS,centric_outliers,TwinL,acentric_outliers,WilsonBestimate,TwinL2,IoverSigma,WilsonBaniso" version="1.9-1692"/>
		<program name="eds" properties="rscc,ligRSRZ,owab,EDS_R,ligRSRnumnbrs,avgoccu,EDS_resolution_low,ligRSRnbrStdev,babinet_b,relative_RSRZ_percentile,rsrz,DataCompleteness,percent-RSRZ-outliers,bulk_solvent_b,RefmacVersion,bulk_solvent_k,Fo_Fc_correlation,EDS_resolution,CCP4version,rsr,ligand_density_outlier,NatomsEDS,babinet_k,lig_rsrz_nbr_id,absolute_RSRZ_percentile,ligRSRnbrMean" version="rb-20025774"/>
		<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="1.17 November 2013 2014 2015"/>
		<program name="validation-pack" properties="symm-clash" version="unknown"/>
		<program name="molprobity" properties="relative_rama_percentile,CAangleStatus,absolute_sidechain_percentile,angles_rmsz,score,absolute_rama_percentile,phi,psi,num-H-reduce,clash,relative_sidechain_percentile,clashscore,bonds_rmsz,percent-rama-outliers,delta,percent-rota-outliers,bond-outlier,angle-outlier,percent-calpha-angle-outliers,num_bonds_rmsz,RestypesNotcheckedForBondAngleGeometry,rota,num_angles_rmsz,rama,gamma" version="4.02b-467"/>
	</programs>
</wwPDB-validation-information>
