<?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="6.3.0 (Settle)" DCC_R="0.13" DCC_Rfree="NotAvailable" DCC_refinement_program="REFMAC" DataAnisotropy="0.226" DataCompleteness="92.76" EDS_R="0.12" EDS_resolution="1.26" EDS_resolution_low="9.99" Fo_Fc_correlation="0.977" IoverSigma="6.06(1.26A)" PDB-revision-number="1" RefmacVersion="5.8.0049" RestypesNotcheckedForBondAngleGeometry="CL,IPA,ACT" TransNCS="The largest off-origin peak in the Patterson function is 9.50% of the height of the origin peak. No significant pseudotranslation is detected." TwinL="0.495" TwinL2="0.327" WilsonBaniso="[7.346,6.502,8.157,0.671,1.444,-0.134]" WilsonBestimate="7.268" XMLcreationDate="Feb 28, 2014 -- 01:50 AM GMT" absolute-percentile-clashscore="74.9" absolute-percentile-percent-RSRZ-outliers="91.3" absolute-percentile-percent-rama-outliers="100.0" absolute-percentile-percent-rota-outliers="81.6" acentric_outliers="0" angles_rmsz="1.14" attemptedValidationSteps="mogul,xtriage,molprobity,eds,percentiles,writexml,writepdf" bonds_rmsz="0.64" bulk_solvent_b="57.379" bulk_solvent_k="0.378" centric_outliers="0" clashscore="3.99" high-resol-relative-percentile-clashscore="1.22" high-resol-relative-percentile-percent-RSRZ-outliers="1.22" high-resol-relative-percentile-percent-rama-outliers="1.22" high-resol-relative-percentile-percent-rota-outliers="1.22" low-resol-relative-percentile-clashscore="1.3" low-resol-relative-percentile-percent-RSRZ-outliers="1.3" low-resol-relative-percentile-percent-rama-outliers="1.3" low-resol-relative-percentile-percent-rota-outliers="1.3" num-H-reduce="0" num-free-reflections="0" numMillerIndices="69524" numPDBids-absolute-percentile-clashscore="79885" numPDBids-absolute-percentile-percent-RSRZ-outliers="66119" numPDBids-absolute-percentile-percent-rama-outliers="78287" numPDBids-absolute-percentile-percent-rota-outliers="78261" numPDBids-relative-percentile-clashscore="1125" numPDBids-relative-percentile-percent-RSRZ-outliers="1021" numPDBids-relative-percentile-percent-rama-outliers="1075" numPDBids-relative-percentile-percent-rota-outliers="1073" num_angles_rmsz="3651" num_bonds_rmsz="2673" pdbid="4E46" percent-RSRZ-outliers="0.34" percent-free-reflections="0.00" percent-rama-outliers="0.00" percent-rota-outliers="1.20" relative-percentile-clashscore="51.5" relative-percentile-percent-RSRZ-outliers="92.5" relative-percentile-percent-rama-outliers="100.0" relative-percentile-percent-rota-outliers="48.3" xtriage_input_columns="F_meas_au,F_meas_sigma_au"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.300" resname="ILE" resnum="4" rota="mt" rscc="0.969" rsr="0.064" rsrz="-0.461" said="A" seq="4"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.570" phi="-71.5" psi="144.4" rama="Favored" resname="GLY" resnum="5" rscc="0.985" rsr="0.047" rsrz="-0.510" said="A" seq="5"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.560" phi="-104.9" psi="-14.4" rama="Favored" resname="THR" resnum="6" rota="p" rscc="0.981" rsr="0.048" rsrz="-0.627" said="A" seq="6"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.920" phi="-80.8" psi="169.2" rama="Favored" resname="GLY" resnum="7" rscc="0.991" rsr="0.042" rsrz="-0.620" said="A" seq="7"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.670" phi="-131.4" psi="77.4" rama="Favored" resname="PHE" resnum="8" rota="t80" rscc="0.979" rsr="0.058" rsrz="-0.387" said="A" seq="8"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.020" phi="-88.7" psi="58.9" rama="Favored" resname="PRO" resnum="9" rota="Cg_endo" rscc="0.981" rsr="0.055" rsrz="-0.458" said="A" seq="9"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.440" phi="-127.7" psi="126.9" rama="Favored" resname="PHE" resnum="10" rota="m-85" rscc="0.984" rsr="0.054" rsrz="-0.514" said="A" seq="10"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.030" phi="-66.8" psi="142.5" rama="Favored" resname="ASP" resnum="11" rota="m-20" rscc="0.984" rsr="0.049" rsrz="-0.687" said="A" seq="11"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.960" phi="-74.5" psi="137.4" rama="Favored" resname="PRO" resnum="12" rota="Cg_endo" rscc="0.972" rsr="0.066" rsrz="-0.206" said="A" seq="12"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.440" phi="-121.7" psi="147.7" rama="Favored" resname="HIS" resnum="13" rota="m80" rscc="0.972" rsr="0.073" rsrz="-0.141" said="A" seq="13"/>
	<ModelledSubgroup NatomsEDS="21" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.650" phi="-132.0" psi="142.8" rama="Favored" resname="TYR" resnum="14" rota="m-85" rscc="0.984" rsr="0.062" rsrz="-0.223" said="A" seq="14"/>
	<ModelledSubgroup NatomsEDS="21" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.650" phi="-132.0" psi="142.8" rama="Favored" resname="TYR" resnum="14" rota="m-85" rscc="0.984" rsr="0.062" rsrz="-0.223" said="A" seq="14"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.740" phi="-137.4" psi="141.2" rama="Favored" resname="VAL" resnum="15" rota="p" rscc="0.989" rsr="0.046" rsrz="-0.936" said="A" seq="15"/>
	<ModelledSubgroup NatomsEDS="15" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.560" phi="-95.5" psi="123.7" rama="Favored" resname="GLU" resnum="16" rota="mm-40" rscc="0.967" rsr="0.098" rsrz="-0.158" said="A" seq="16"/>
	<ModelledSubgroup NatomsEDS="15" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.560" phi="-95.5" psi="123.7" rama="Favored" resname="GLU" resnum="16" rota="mm-40" rscc="0.967" rsr="0.098" rsrz="-0.158" said="A" seq="16"/>
	<ModelledSubgroup NatomsEDS="11" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.120" phi="-140.7" psi="135.7" rama="Favored" resname="VAL" resnum="17" rota="t" rscc="0.988" rsr="0.058" rsrz="-0.559" said="A" seq="17"/>
	<ModelledSubgroup NatomsEDS="11" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.120" phi="-140.7" psi="135.7" rama="Favored" resname="VAL" resnum="17" rota="t" rscc="0.988" rsr="0.058" rsrz="-0.559" said="A" seq="17"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.500" phi="52.7" psi="43.7" rama="Favored" resname="LEU" resnum="18" rota="mt" rscc="0.976" rsr="0.065" rsrz="-0.385" said="A" seq="18"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.280" phi="79.3" psi="1.6" rama="Favored" resname="GLY" resnum="19" rscc="0.988" rsr="0.042" rsrz="-0.620" said="A" seq="19"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.240" phi="-139.0" psi="148.3" rama="Favored" resname="GLU" resnum="20" rota="mm-40" rscc="0.985" rsr="0.049" rsrz="-0.961" said="A" seq="20"/>
	<ModelledSubgroup NatomsEDS="25" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.680" phi="-87.3" psi="132.1" rama="Favored" resname="ARG" resnum="21" rota="mtm180" rscc="0.948" rsr="0.142" rsrz="0.839" said="A" seq="21"/>
	<ModelledSubgroup NatomsEDS="25" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.680" phi="-87.3" psi="132.1" rama="Favored" resname="ARG" resnum="21" rota="mtm180" rscc="0.948" rsr="0.142" rsrz="0.839" said="A" seq="21"/>
	<ModelledSubgroup NatomsEDS="25" altcode="C" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.680" phi="-87.3" psi="132.1" rama="Favored" resname="ARG" resnum="21" rota="mtm180" rscc="0.948" rsr="0.142" rsrz="0.839" said="A" seq="21">
		<clash atom="NE" cid="9" clashmag="0.42" dist="2.51"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.690" phi="-110.2" psi="134.1" rama="Favored" resname="MET" resnum="22" rota="mtp" rscc="0.992" rsr="0.044" rsrz="-0.814" said="A" seq="22"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.120" phi="-87.8" psi="147.1" rama="Favored" resname="HIS" resnum="23" rota="t-80" rscc="0.989" rsr="0.043" rsrz="-0.705" said="A" seq="23"/>
	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.760" phi="-152.7" psi="148.3" rama="Favored" resname="TYR" resnum="24" rota="p90" rscc="0.988" rsr="0.046" rsrz="-0.737" said="A" seq="24"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.270" phi="-75.5" psi="139.1" rama="Favored" resname="VAL" resnum="25" rota="t" rscc="0.987" rsr="0.051" rsrz="-0.779" said="A" seq="25"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.580" phi="-148.1" psi="102.7" rama="Favored" resname="ASP" resnum="26" rota="t0" rscc="0.985" rsr="0.052" rsrz="-0.634" said="A" seq="26"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.410" phi="-132.8" psi="162.1" rama="Favored" resname="VAL" resnum="27" rota="m" rscc="0.985" rsr="0.053" rsrz="-0.716" said="A" seq="27"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.740" phi="94.7" psi="174.6" rama="Favored" resname="GLY" resnum="28" rscc="0.992" rsr="0.038" rsrz="-0.708" said="A" seq="28"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.310" phi="-65.6" psi="150.3" rama="Favored" resname="PRO" resnum="29" rota="Cg_endo" rscc="0.986" rsr="0.051" rsrz="-0.549" said="A" seq="29"/>
	<ModelledSubgroup NatomsEDS="27" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="14.760" phi="-95.1" psi="-4.9" rama="Favored" resname="ARG" resnum="30" rota="mmt85" rscc="0.941" rsr="0.147" rsrz="0.932" said="A" seq="30">
		<angle-outlier atom0="NE" atom1="CZ" atom2="NH2" mean="120.300" obs="115.223" stdev="0.500" z="-10.15"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="27" altcode="C" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="14.760" phi="-95.1" psi="-4.9" rama="Favored" resname="ARG" resnum="30" rota="mmt85" rscc="0.941" rsr="0.147" rsrz="0.932" said="A" seq="30">
		<angle-outlier atom0="NE" atom1="CZ" atom2="NH2" mean="120.300" obs="115.223" stdev="0.500" z="-10.15"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="27" altcode="D" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="14.760" phi="-95.1" psi="-4.9" rama="Favored" resname="ARG" resnum="30" rota="mmt85" rscc="0.941" rsr="0.147" rsrz="0.932" said="A" seq="30">
		<angle-outlier atom0="NE" atom1="CZ" atom2="NH2" mean="120.300" obs="115.223" stdev="0.500" z="-10.15"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="17.570" phi="-102.8" psi="20.8" rama="Favored" resname="ASP" resnum="31" rota="p-10" rscc="0.964" rsr="0.103" rsrz="0.277" said="A" seq="31"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.750" phi="-134.1" psi="-152.6" rama="Favored" resname="GLY" resnum="32" rscc="0.991" rsr="0.040" rsrz="-0.664" said="A" seq="32"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.660" phi="-95.6" psi="121.1" rama="Favored" resname="THR" resnum="33" rota="m" rscc="0.977" rsr="0.057" rsrz="-0.402" said="A" seq="33"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.460" phi="-78.1" psi="157.4" rama="Favored" resname="PRO" resnum="34" rota="Cg_endo" rscc="0.990" rsr="0.047" rsrz="-0.640" said="A" seq="34"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.040" phi="-108.3" psi="119.3" rama="Favored" resname="VAL" resnum="35" rota="t" rscc="0.980" rsr="0.058" rsrz="-0.559" said="A" seq="35"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.860" phi="-105.4" psi="117.4" rama="Favored" resname="LEU" resnum="36" rota="tp" rscc="0.989" rsr="0.046" rsrz="-0.995" said="A" seq="36"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.730" phi="-102.1" psi="122.9" rama="Favored" resname="PHE" resnum="37" rota="m-85" rscc="0.990" rsr="0.043" rsrz="-0.863" said="A" seq="37"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.660" phi="-122.0" psi="111.5" rama="Favored" resname="LEU" resnum="38" rota="mt" rscc="0.982" rsr="0.055" rsrz="-0.706" said="A" seq="38"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.560" phi="-78.5" psi="172.0" rama="Favored" resname="HIS" resnum="39" rota="p80" rscc="0.990" rsr="0.041" rsrz="-0.742" said="A" seq="39"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.470" phi="-127.3" psi="-144.4" rama="Favored" resname="GLY" resnum="40" rscc="0.988" rsr="0.045" rsrz="-0.554" said="A" seq="40"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.740" phi="-96.3" psi="135.7" rama="Favored" resname="ASN" resnum="41" rota="t30" rscc="0.989" rsr="0.044" rsrz="-0.748" said="A" seq="41"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.360" phi="-104.5" psi="48.0" rama="Allowed" resname="PRO" resnum="42" rota="OUTLIER" rscc="0.983" rsr="0.050" rsrz="-0.572" said="A" seq="42"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.680" phi="-101.9" psi="-159.7" rama="Allowed" resname="THR" resnum="43" rota="p" rscc="0.990" rsr="0.046" rsrz="-0.677" said="A" seq="43"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.300" phi="-162.3" psi="-174.1" rama="Favored" resname="SER" resnum="44" rota="p" rscc="0.986" rsr="0.056" rsrz="-0.459" said="A" seq="44"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.520" phi="-54.7" psi="-20.7" rama="Favored" resname="SER" resnum="45" rota="p" rscc="0.989" rsr="0.051" rsrz="-0.567" said="A" seq="45"/>
	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.990" phi="-52.9" psi="-33.9" rama="Favored" resname="TYR" resnum="46" rota="t80" rscc="0.985" rsr="0.055" rsrz="-0.448" said="A" seq="46"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.620" phi="-61.1" psi="-25.5" rama="Favored" resname="LEU" resnum="47" rota="tp" rscc="0.982" rsr="0.061" rsrz="-0.513" said="A" seq="47"/>
	<ModelledSubgroup NatomsEDS="14" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.400" phi="-96.8" psi="2.9" rama="Favored" resname="TRP" resnum="48" rota="m95" rscc="0.989" rsr="0.043" rsrz="-0.809" said="A" seq="48"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.940" phi="-58.1" psi="-32.6" rama="Favored" resname="ARG" resnum="49" rota="ptt-85" rscc="0.987" rsr="0.050" rsrz="-0.874" said="A" seq="49"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.280" phi="-98.8" psi="-2.9" rama="Favored" resname="ASN" resnum="50" rota="m-20" rscc="0.987" rsr="0.057" rsrz="-0.497" said="A" seq="50"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.090" phi="-96.7" psi="-46.5" rama="Favored" resname="ILE" resnum="51" rota="mt" rscc="0.984" rsr="0.055" rsrz="-0.774" said="A" seq="51"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.420" phi="-49.2" psi="-43.2" rama="Favored" resname="ILE" resnum="52" rota="mt" rscc="0.982" rsr="0.056" rsrz="-0.739" said="A" seq="52"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.830" phi="-58.5" psi="-24.0" rama="Favored" resname="PRO" resnum="53" rota="Cg_exo" rscc="0.984" rsr="0.055" rsrz="-0.458" said="A" seq="53"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.240" phi="-75.2" psi="-27.1" rama="Favored" resname="HIS" resnum="54" rota="m-70" rscc="0.992" rsr="0.038" rsrz="-0.799" said="A" seq="54"/>
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	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.670" phi="-118.9" psi="120.8" rama="Favored" resname="CYS" resnum="61" rota="m" rscc="0.995" rsr="0.039" rsrz="-0.803" said="A" seq="61"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.690" phi="-117.6" psi="121.6" rama="Favored" resname="ILE" resnum="62" rota="mt" rscc="0.988" rsr="0.051" rsrz="-0.912" said="A" seq="62"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.990" phi="-57.7" psi="153.8" rama="Favored" resname="LEU" resnum="66" rota="mt" rscc="0.982" rsr="0.054" rsrz="-0.738" said="A" seq="66"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.380" phi="-54.9" psi="139.0" rama="Favored" resname="ILE" resnum="67" rota="tp" rscc="0.987" rsr="0.051" rsrz="-0.912" said="A" seq="67"/>
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	<ModelledSubgroup NatomsEDS="12" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.270" phi="-129.9" psi="163.6" rama="Favored" resname="MET" resnum="69" rota="mtp" rscc="0.988" rsr="0.073" rsrz="-0.147" said="A" seq="69"/>
	<ModelledSubgroup NatomsEDS="12" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.270" phi="-129.9" psi="163.6" rama="Favored" resname="MET" resnum="69" rota="mtp" rscc="0.988" rsr="0.073" rsrz="-0.147" said="A" seq="69"/>
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	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.700" phi="-72.8" psi="161.8" rama="Favored" resname="SER" resnum="72" rota="m" rscc="0.991" rsr="0.040" rsrz="-0.806" said="A" seq="72"/>
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	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.270" phi="-125.6" psi="67.5" rama="Favored" resname="LYS" resnum="74" rota="mttm" rscc="0.967" rsr="0.077" rsrz="-0.546" said="A" seq="74"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.500" phi="-59.9" psi="154.1" rama="Favored" resname="PRO" resnum="75" rota="Cg_endo" rscc="0.982" rsr="0.058" rsrz="-0.389" said="A" seq="75"/>
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	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.130" phi="-60.7" psi="159.8" rama="Favored" resname="PHE" resnum="80" rota="m-85" rscc="0.986" rsr="0.048" rsrz="-0.705" said="A" seq="80"/>
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	<ModelledSubgroup NatomsEDS="12" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.500" phi="-59.3" psi="-33.6" rama="Favored" resname="ASP" resnum="82" rota="t70" rscc="0.971" rsr="0.097" rsrz="0.170" said="A" seq="82">
		<clash atom="OD1" cid="1" clashmag="1.06" dist="1.70"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="12" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.500" phi="-59.3" psi="-33.6" rama="Favored" resname="ASP" resnum="82" rota="t70" rscc="0.971" rsr="0.097" rsrz="0.170" said="A" seq="82">
		<clash atom="OD1" cid="2" clashmag="0.74" dist="2.05"/>
		<clash atom="OD2" cid="0" clashmag="1.19" dist="1.57"/>
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		<angle-outlier atom0="NE" atom1="CZ" atom2="NH1" mean="120.300" obs="115.754" stdev="0.500" z="-9.09"/>
		<angle-outlier atom0="CD" atom1="NE" atom2="CZ" mean="123.600" obs="134.220" stdev="1.400" z="7.59"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.100" phi="-66.5" psi="-44.7" rama="Favored" resname="TYR" resnum="87" rota="m-85" rscc="0.981" rsr="0.053" rsrz="-0.512" said="A" seq="87">
		<angle-outlier atom0="CB" atom1="CG" atom2="CD1" mean="121.000" obs="124.157" stdev="0.600" z="5.26"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.690" phi="-68.1" psi="-38.7" rama="Favored" resname="LEU" resnum="88" rota="tp" rscc="0.985" rsr="0.057" rsrz="-0.642" said="A" seq="88"/>
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	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.580" phi="-68.3" psi="-39.3" rama="Favored" resname="ALA" resnum="90" rscc="0.988" rsr="0.051" rsrz="-0.481" said="A" seq="90"/>
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	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.850" phi="-61.5" psi="-32.9" rama="Favored" resname="ALA" resnum="94" rscc="0.986" rsr="0.054" rsrz="-0.404" said="A" seq="94"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.790" phi="-84.2" psi="-2.7" rama="Favored" resname="LEU" resnum="95" rota="mp" rscc="0.976" rsr="0.067" rsrz="-0.320" said="A" seq="95"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.000" phi="69.8" psi="27.1" rama="Favored" resname="GLY" resnum="96" rscc="0.988" rsr="0.059" rsrz="-0.245" said="A" seq="96"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.220" phi="-70.7" psi="140.3" rama="Favored" resname="LEU" resnum="97" rota="mt" rscc="0.976" rsr="0.055" rsrz="-0.706" said="A" seq="97"/>
	<ModelledSubgroup NatomsEDS="13" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="15.310" phi="-110.1" psi="-94.9" rama="Allowed" resname="GLU" resnum="98" rota="mt-10" rscc="0.954" rsr="0.115" rsrz="0.121" said="A" seq="98"/>
	<ModelledSubgroup NatomsEDS="13" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="15.310" phi="-110.1" psi="-94.9" rama="Allowed" resname="GLU" resnum="98" rota="mt-10" rscc="0.954" rsr="0.115" rsrz="0.121" said="A" seq="98"/>
	<ModelledSubgroup NatomsEDS="15" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="15.290" phi="-80.0" psi="143.9" rama="Favored" resname="GLU" resnum="99" rota="mt-10" rscc="0.964" rsr="0.105" rsrz="-0.043" said="A" seq="99"/>
	<ModelledSubgroup NatomsEDS="15" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="15.290" phi="-80.0" psi="143.9" rama="Favored" resname="GLU" resnum="99" rota="mt-10" rscc="0.964" rsr="0.105" rsrz="-0.043" said="A" seq="99"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.180" phi="-140.2" psi="162.0" rama="Favored" resname="VAL" resnum="100" rota="m" rscc="0.981" rsr="0.054" rsrz="-0.685" said="A" seq="100"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.820" phi="-106.0" psi="133.9" rama="Favored" resname="VAL" resnum="101" rota="t" rscc="0.981" rsr="0.063" rsrz="-0.402" said="A" seq="101"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.530" phi="-99.3" psi="140.8" rama="Favored" resname="LEU" resnum="102" rota="mt" rscc="0.977" rsr="0.068" rsrz="-0.288" said="A" seq="102"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.500" phi="-129.3" psi="109.3" rama="Favored" resname="VAL" resnum="103" rota="t" rscc="0.987" rsr="0.058" rsrz="-0.559" said="A" seq="103"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.010" phi="-136.8" psi="151.0" rama="Favored" resname="ILE" resnum="104" rota="pt" rscc="0.983" rsr="0.063" rsrz="-0.496" said="A" seq="104"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.020" phi="-144.9" psi="137.3" rama="Favored" resname="HIS" resnum="105" rota="t-80" rscc="0.988" rsr="0.050" rsrz="-0.573" said="A" seq="105"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.180" phi="53.0" psi="-125.4" rama="Favored" resname="ASP" resnum="106" rota="t70" rscc="0.981" rsr="0.084" rsrz="-0.062" said="A" seq="106"/>
	<ModelledSubgroup NatomsEDS="14" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.950" phi="-66.9" psi="-24.1" rama="Favored" resname="TRP" resnum="107" rota="m95" rscc="0.987" rsr="0.045" rsrz="-0.744" said="A" seq="107"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.830" phi="-64.1" psi="-30.4" rama="Favored" resname="GLY" resnum="108" rscc="0.989" rsr="0.050" rsrz="-0.443" said="A" seq="108"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.220" phi="-73.2" psi="-38.5" rama="Favored" resname="SER" resnum="109" rota="p" rscc="0.988" rsr="0.050" rsrz="-0.589" said="A" seq="109"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.270" phi="-61.7" psi="-45.2" rama="Favored" resname="ALA" resnum="110" rscc="0.986" rsr="0.055" rsrz="-0.379" said="A" seq="110"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.660" phi="-62.0" psi="-46.7" rama="Favored" resname="LEU" resnum="111" rota="mt" rscc="0.987" rsr="0.051" rsrz="-0.834" said="A" seq="111"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.310" phi="-66.3" psi="-44.0" rama="Favored" resname="GLY" resnum="112" rscc="0.993" rsr="0.033" rsrz="-0.819" said="A" seq="112"/>
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	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.380" phi="-66.4" psi="-39.0" rama="Favored" resname="HIS" resnum="114" rota="t60" rscc="0.985" rsr="0.050" rsrz="-0.573" said="A" seq="114"/>
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	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="15.980" phi="-71.6" psi="-11.3" rama="Favored" resname="GLU" resnum="121" rota="pm0" rscc="0.956" rsr="0.093" rsrz="-0.240" said="A" seq="121"/>
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	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.860" phi="-116.4" psi="114.7" rama="Favored" resname="VAL" resnum="123" rota="t" rscc="0.981" rsr="0.055" rsrz="-0.653" said="A" seq="123"/>
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	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.080" phi="-176.2" psi="156.1" rama="Favored" resname="GLY" resnum="125" rscc="0.991" rsr="0.036" rsrz="-0.752" said="A" seq="125"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.620" phi="-131.6" psi="116.8" rama="Favored" resname="ILE" resnum="126" rota="mt" rscc="0.978" rsr="0.065" rsrz="-0.427" said="A" seq="126"/>
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	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.150" phi="-139.3" psi="162.6" rama="Favored" resname="CYS" resnum="128" rota="p" rscc="0.996" rsr="0.032" rsrz="-1.036" said="A" seq="128"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.440" phi="-163.1" psi="137.0" rama="Favored" resname="MET" resnum="129" rota="ptp" rscc="0.990" rsr="0.051" rsrz="-0.653" said="A" seq="129"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.990" phi="-89.9" psi="124.1" rama="Favored" resname="ILE" resnum="132" rota="mt" rscc="0.978" rsr="0.068" rsrz="-0.322" said="A" seq="132"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.140" phi="-133.2" psi="171.6" rama="Favored" resname="ARG" resnum="133" rota="ptt180" rscc="0.983" rsr="0.061" rsrz="-0.669" said="A" seq="133">
		<angle-outlier atom0="NE" atom1="CZ" atom2="NH1" mean="120.300" obs="117.007" stdev="0.500" z="-6.58"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.060" phi="-63.7" psi="141.7" rama="Favored" resname="PRO" resnum="134" rota="Cg_exo" rscc="0.981" rsr="0.061" rsrz="-0.320" said="A" seq="134"/>
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	<ModelledSubgroup NatomsEDS="14" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.870" phi="-62.8" psi="-27.7" rama="Favored" resname="TRP" resnum="138" rota="m95" rscc="0.980" rsr="0.060" rsrz="-0.251" said="A" seq="138"/>
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	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="14.190" phi="-87.0" psi="-1.5" rama="Favored" resname="GLU" resnum="140" rota="mt-10" rscc="0.960" rsr="0.085" rsrz="-0.371" said="A" seq="140"/>
	<ModelledSubgroup NatomsEDS="14" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.310" phi="-88.0" psi="140.6" rama="Favored" resname="TRP" resnum="141" rota="t-105" rscc="0.974" rsr="0.060" rsrz="-0.251" said="A" seq="141"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.460" phi="-59.0" psi="132.0" rama="Favored" resname="PRO" resnum="142" rota="Cg_exo" rscc="0.981" rsr="0.056" rsrz="-0.435" said="A" seq="142"/>
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	<ModelledSubgroup NatomsEDS="15" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="21.860" phi="-54.9" psi="-43.3" rama="Favored" resname="GLU" resnum="147" rota="mt-10" rscc="0.962" rsr="0.132" rsrz="0.399" said="A" seq="147"/>
	<ModelledSubgroup NatomsEDS="15" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="21.860" phi="-54.9" psi="-43.3" rama="Favored" resname="GLU" resnum="147" rota="mt-10" rscc="0.962" rsr="0.132" rsrz="0.399" said="A" seq="147"/>
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	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="12.570" phi="-63.3" psi="-38.9" rama="Favored" resname="GLN" resnum="150" rota="mt-30" rscc="0.977" rsr="0.061" rsrz="-0.600" said="A" seq="150"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.590" phi="-71.4" psi="-37.2" rama="Favored" resname="ALA" resnum="151" rscc="0.983" rsr="0.070" rsrz="0.005" said="A" seq="151"/>
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	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.950" phi="-87.5" psi="47.1" rama="Allowed" resname="ARG" resnum="153" rota="mtp85" rscc="0.981" rsr="0.059" rsrz="-0.706" said="A" seq="153">
		<angle-outlier atom0="CG" atom1="CD" atom2="NE" mean="111.800" obs="122.486" stdev="2.100" z="5.09"/>
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	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.830" phi="-138.7" psi="156.7" rama="Favored" resname="THR" resnum="154" rota="p" rscc="0.974" rsr="0.077" rsrz="0.099" said="A" seq="154"/>
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	<ModelledSubgroup NatomsEDS="15" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="12.700" phi="-113.6" psi="1.9" rama="Favored" resname="GLN" resnum="165" rota="mt-30" rscc="0.978" rsr="0.085" rsrz="-0.169" said="A" seq="165">
		<clash atom="NE2" cid="6" clashmag="0.45" dist="2.49"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="15" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="12.700" phi="-113.6" psi="1.9" rama="Favored" resname="GLN" resnum="165" rota="mt-30" rscc="0.978" rsr="0.085" rsrz="-0.169" said="A" seq="165"/>
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	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.920" phi="-117.1" psi="-70.5" rama="Allowed" resname="GLY" resnum="171" rscc="0.992" rsr="0.048" rsrz="-0.487" said="A" seq="171"/>
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	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="26.140" phi="-66.5" psi="-19.1" rama="Favored" resname="LYS" resnum="175" rota="mttt" rscc="0.978" rsr="0.103" rsrz="-0.072" said="A" seq="175"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.190" phi="-109.1" psi="25.4" rama="Favored" resname="CYS" resnum="176" rota="m" rscc="0.994" rsr="0.040" rsrz="-0.769" said="A" seq="176"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.870" phi="-120.6" psi="131.8" rama="Favored" resname="VAL" resnum="177" rota="t" rscc="0.982" rsr="0.070" rsrz="-0.181" said="A" seq="177"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.180" phi="-70.7" psi="-50.7" rama="Favored" resname="VAL" resnum="178" rota="t" rscc="0.978" rsr="0.061" rsrz="-0.464" said="A" seq="178"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.610" phi="-73.9" psi="154.8" rama="Favored" resname="ARG" resnum="179" rota="ptt180" rscc="0.971" rsr="0.069" rsrz="-0.520" said="A" seq="179">
		<angle-outlier atom0="NE" atom1="CZ" atom2="NH2" mean="120.300" obs="117.751" stdev="0.500" z="-5.10"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.560" phi="-72.9" psi="131.8" rama="Favored" resname="PRO" resnum="180" rota="Cg_endo" rscc="0.975" rsr="0.067" rsrz="-0.183" said="A" seq="180"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.420" phi="-71.3" psi="139.5" rama="Favored" resname="LEU" resnum="181" rota="mt" rscc="0.978" rsr="0.056" rsrz="-0.674" said="A" seq="181"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.220" phi="-81.2" psi="165.6" rama="Favored" resname="THR" resnum="182" rota="p" rscc="0.985" rsr="0.061" rsrz="-0.301" said="A" seq="182"/>
	<ModelledSubgroup NatomsEDS="15" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="12.640" phi="-60.4" psi="-39.1" rama="Favored" resname="GLU" resnum="183" rota="mm-40" rscc="0.956" rsr="0.113" rsrz="0.088" said="A" seq="183"/>
	<ModelledSubgroup NatomsEDS="15" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="12.640" phi="-60.4" psi="-39.1" rama="Favored" resname="GLU" resnum="183" rota="mm-40" rscc="0.956" rsr="0.113" rsrz="0.088" said="A" seq="183"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.960" phi="-64.3" psi="-44.3" rama="Favored" resname="VAL" resnum="184" rota="t" rscc="0.978" rsr="0.061" rsrz="-0.464" said="A" seq="184"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.640" phi="-61.7" psi="-45.5" rama="Favored" resname="GLU" resnum="185" rota="mt-10" rscc="0.984" rsr="0.058" rsrz="-0.813" said="A" seq="185"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.090" phi="-58.2" psi="-41.8" rama="Favored" resname="MET" resnum="186" rota="mmm" rscc="0.994" rsr="0.045" rsrz="-0.791" said="A" seq="186"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.210" phi="-63.8" psi="-35.0" rama="Favored" resname="ASP" resnum="187" rota="m-20" rscc="0.991" rsr="0.046" rsrz="-0.741" said="A" seq="187"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.520" phi="-62.4" psi="-40.5" rama="Favored" resname="HIS" resnum="188" rota="m-70" rscc="0.989" rsr="0.047" rsrz="-0.630" said="A" seq="188"/>
	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.140" phi="-72.7" psi="-31.8" rama="Favored" resname="TYR" resnum="189" rota="m-85" rscc="0.987" rsr="0.041" rsrz="-0.898" said="A" seq="189"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.010" phi="-70.8" psi="-31.1" rama="Favored" resname="ARG" resnum="190" rota="mtt180" rscc="0.990" rsr="0.042" rsrz="-1.023" said="A" seq="190">
		<angle-outlier atom0="NE" atom1="CZ" atom2="NH2" mean="120.300" obs="117.090" stdev="0.500" z="-6.42"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="12.890" phi="-54.2" psi="-45.0" rama="Favored" resname="GLU" resnum="191" rota="tt0" rscc="0.965" rsr="0.090" rsrz="-0.289" said="A" seq="191"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.880" phi="-62.5" psi="-20.8" rama="Favored" resname="PRO" resnum="192" rota="Cg_exo" rscc="0.988" rsr="0.049" rsrz="-0.595" said="A" seq="192"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.660" phi="-119.9" psi="20.1" rama="Favored" resname="PHE" resnum="193" rota="m-85" rscc="0.977" rsr="0.069" rsrz="-0.038" said="A" seq="193"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.730" phi="-55.8" psi="-32.7" rama="Favored" resname="LEU" resnum="194" rota="mt" rscc="0.968" rsr="0.073" rsrz="-0.127" said="A" seq="194"/>
	<ModelledSubgroup NatomsEDS="12" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="14.810" phi="-96.5" psi="119.5" rama="Favored" resname="LYS" resnum="195" rota="mttm" rscc="0.973" rsr="0.119" rsrz="0.219" said="A" seq="195"/>
	<ModelledSubgroup NatomsEDS="12" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="14.810" phi="-96.5" psi="119.5" rama="Favored" resname="LYS" resnum="195" rota="mttm" rscc="0.973" rsr="0.119" rsrz="0.219" said="A" seq="195"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.880" phi="-49.8" psi="-41.5" rama="Favored" resname="PRO" resnum="196" rota="Cg_exo" rscc="0.978" rsr="0.062" rsrz="-0.298" said="A" seq="196"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.850" phi="-60.0" psi="-25.0" rama="Favored" resname="VAL" resnum="197" rota="p" rscc="0.984" rsr="0.051" rsrz="-0.779" said="A" seq="197"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.580" phi="-75.7" psi="2.9" rama="Favored" resname="ASP" resnum="198" rota="m-20" rscc="0.980" rsr="0.059" rsrz="-0.508" said="A" seq="198"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.420" phi="-89.8" psi="8.2" rama="Favored" resname="ARG" resnum="199" rota="mtt180" rscc="0.988" rsr="0.045" rsrz="-0.967" said="A" seq="199"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.430" phi="-50.2" psi="-46.4" rama="Favored" resname="GLU" resnum="200" rota="tp10" rscc="0.988" rsr="0.049" rsrz="-0.961" said="A" seq="200"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.220" phi="-61.5" psi="-29.6" rama="Favored" resname="PRO" resnum="201" rota="Cg_endo" rscc="0.989" rsr="0.046" rsrz="-0.663" said="A" seq="201"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.870" phi="-69.5" psi="-26.9" rama="Favored" resname="LEU" resnum="202" rota="mt" rscc="0.986" rsr="0.057" rsrz="-0.642" said="A" seq="202"/>
	<ModelledSubgroup NatomsEDS="14" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.240" phi="-86.9" psi="-42.4" rama="Favored" resname="TRP" resnum="203" rota="t90" rscc="0.990" rsr="0.042" rsrz="-0.842" said="A" seq="203"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.980" phi="-65.2" psi="-37.0" rama="Favored" resname="ARG" resnum="204" rota="tpp180" rscc="0.980" rsr="0.062" rsrz="-0.650" said="A" seq="204"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.500" phi="-56.9" psi="-52.4" rama="Favored" resname="PHE" resnum="205" rota="m-85" rscc="0.987" rsr="0.047" rsrz="-0.736" said="A" seq="205"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.370" phi="-63.2" psi="-28.4" rama="Favored" resname="PRO" resnum="206" rota="Cg_endo" rscc="0.980" rsr="0.059" rsrz="-0.366" said="A" seq="206"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.440" phi="-69.9" psi="-18.6" rama="Favored" resname="ASN" resnum="207" rota="m-80" rscc="0.990" rsr="0.042" rsrz="-0.787" said="A" seq="207"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.770" phi="-90.5" psi="-12.1" rama="Favored" resname="GLU" resnum="208" rota="mm-40" rscc="0.986" rsr="0.047" rsrz="-0.993" said="A" seq="208"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.720" phi="-59.9" psi="140.1" rama="Favored" resname="LEU" resnum="209" rota="mt" rscc="0.989" rsr="0.048" rsrz="-0.931" said="A" seq="209"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.860" phi="-81.7" psi="77.1" rama="Favored" resname="PRO" resnum="210" rota="Cg_endo" rscc="0.988" rsr="0.040" rsrz="-0.801" said="A" seq="210"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.030" phi="-115.8" psi="128.2" rama="Favored" resname="ILE" resnum="211" rota="mt" rscc="0.982" rsr="0.057" rsrz="-0.704" said="A" seq="211"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.950" phi="57.9" psi="39.9" rama="Favored" resname="ALA" resnum="212" rscc="0.983" rsr="0.053" rsrz="-0.430" said="A" seq="212"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.490" phi="81.0" psi="-1.9" rama="Favored" resname="GLY" resnum="213" rscc="0.989" rsr="0.040" rsrz="-0.664" said="A" seq="213"/>
	<ModelledSubgroup NatomsEDS="15" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.680" phi="-136.7" psi="144.4" rama="Favored" resname="GLU" resnum="214" rota="tp10" rscc="0.978" rsr="0.084" rsrz="-0.387" said="A" seq="214"/>
	<ModelledSubgroup NatomsEDS="15" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.680" phi="-136.7" psi="144.4" rama="Favored" resname="GLU" resnum="214" rota="tp10" rscc="0.978" rsr="0.084" rsrz="-0.387" said="A" seq="214"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.260" phi="-76.2" psi="144.8" rama="Favored" resname="PRO" resnum="215" rota="Cg_endo" rscc="0.987" rsr="0.049" rsrz="-0.595" said="A" seq="215"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.640" phi="-62.4" psi="-35.3" rama="Favored" resname="ALA" resnum="216" rscc="0.982" rsr="0.052" rsrz="-0.455" said="A" seq="216"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.080" phi="-64.5" psi="-40.3" rama="Favored" resname="ASN" resnum="217" rota="p-10" rscc="0.986" rsr="0.055" rsrz="-0.536" said="A" seq="217"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.260" phi="-71.7" psi="-42.2" rama="Favored" resname="ILE" resnum="218" rota="mm" rscc="0.985" rsr="0.058" rsrz="-0.669" said="A" seq="218"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.060" phi="-53.8" psi="-44.6" rama="Favored" resname="VAL" resnum="219" rota="t" rscc="0.986" rsr="0.051" rsrz="-0.779" said="A" seq="219"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.040" phi="-67.3" psi="-40.0" rama="Favored" resname="ALA" resnum="220" rscc="0.993" rsr="0.041" rsrz="-0.737" said="A" seq="220"/>
	<ModelledSubgroup NatomsEDS="13" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.250" phi="-78.2" psi="-29.3" rama="Favored" resname="LEU" resnum="221" rota="tt" rscc="0.978" rsr="0.071" rsrz="-0.192" said="A" seq="221"/>
	<ModelledSubgroup NatomsEDS="13" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.250" phi="-78.2" psi="-29.3" rama="Favored" resname="LEU" resnum="221" rota="tt" rscc="0.978" rsr="0.071" rsrz="-0.192" said="A" seq="221"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.740" phi="-70.3" psi="-40.7" rama="Favored" resname="VAL" resnum="222" rota="t" rscc="0.991" rsr="0.043" rsrz="-1.031" said="A" seq="222"/>
	<ModelledSubgroup NatomsEDS="13" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.850" phi="-55.7" psi="-40.7" rama="Favored" resname="GLU" resnum="223" rota="mt-10" rscc="0.977" rsr="0.079" rsrz="-0.469" said="A" seq="223"/>
	<ModelledSubgroup NatomsEDS="13" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.850" phi="-55.7" psi="-40.7" rama="Favored" resname="GLU" resnum="223" rota="mt-10" rscc="0.977" rsr="0.079" rsrz="-0.469" said="A" seq="223"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.270" phi="-66.1" psi="-43.1" rama="Favored" resname="ALA" resnum="224" rscc="0.987" rsr="0.050" rsrz="-0.507" said="A" seq="224"/>
	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.050" phi="-72.2" psi="-29.0" rama="Favored" resname="TYR" resnum="225" rota="OUTLIER" rscc="0.986" rsr="0.050" rsrz="-0.608" said="A" seq="225">
		<angle-outlier atom0="CB" atom1="CG" atom2="CD1" mean="121.000" obs="124.886" stdev="0.600" z="6.48"/>
		<angle-outlier atom0="CA" atom1="CB" atom2="CG" mean="113.400" obs="125.322" stdev="1.900" z="6.28"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.390" phi="-70.8" psi="-37.3" rama="Favored" resname="MET" resnum="226" rota="mmm" rscc="0.996" rsr="0.040" rsrz="-0.906" said="A" seq="226"/>
	<ModelledSubgroup NatomsEDS="11" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.080" phi="-59.0" psi="-44.0" rama="Favored" resname="ASN" resnum="227" rota="t30" rscc="0.971" rsr="0.090" rsrz="0.141" said="A" seq="227"/>
	<ModelledSubgroup NatomsEDS="11" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.080" phi="-59.0" psi="-44.0" rama="Favored" resname="ASN" resnum="227" rota="t30" rscc="0.971" rsr="0.090" rsrz="0.141" said="A" seq="227"/>
	<ModelledSubgroup NatomsEDS="14" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.820" phi="-59.0" psi="-49.1" rama="Favored" resname="TRP" resnum="228" rota="t90" rscc="0.981" rsr="0.055" rsrz="-0.415" said="A" seq="228"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.210" phi="-61.5" psi="-40.0" rama="Favored" resname="LEU" resnum="229" rota="tp" rscc="0.975" rsr="0.058" rsrz="-0.609" said="A" seq="229"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.940" phi="-67.3" psi="-21.9" rama="Favored" resname="HIS" resnum="230" rota="m80" rscc="0.967" rsr="0.072" rsrz="-0.160" said="A" seq="230"/>
	<ModelledSubgroup NatomsEDS="14" altcode="A" avgoccu="0.989" chain="A" ent="1" icode=" " model="1" owab="19.190" phi="-106.5" psi="-3.3" rama="Favored" resname="GLN" resnum="231" rota="mt-30" rscc="0.959" rsr="0.117" rsrz="0.405" said="A" seq="231"/>
	<ModelledSubgroup NatomsEDS="14" altcode="B" avgoccu="0.989" chain="A" ent="1" icode=" " model="1" owab="19.190" phi="-106.5" psi="-3.3" rama="Favored" resname="GLN" resnum="231" rota="mt-30" rscc="0.959" rsr="0.117" rsrz="0.405" said="A" seq="231">
		<clash atom="NE2" cid="7" clashmag="0.45" dist="2.49"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="7" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.730" phi="-82.5" psi="136.1" rama="Favored" resname="SER" resnum="232" rota="t" rscc="0.984" rsr="0.069" rsrz="-0.176" said="A" seq="232"/>
	<ModelledSubgroup NatomsEDS="7" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.730" phi="-82.5" psi="136.1" rama="Favored" resname="SER" resnum="232" rota="t" rscc="0.984" rsr="0.069" rsrz="-0.176" said="A" seq="232"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.630" phi="-77.6" psi="-1.2" rama="Favored" resname="PRO" resnum="233" rota="Cg_endo" rscc="0.979" rsr="0.060" rsrz="-0.343" said="A" seq="233"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.480" phi="-55.7" psi="138.0" rama="Favored" resname="VAL" resnum="234" rota="p" rscc="0.983" rsr="0.057" rsrz="-0.590" said="A" seq="234"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.330" phi="-59.6" psi="135.4" rama="Favored" resname="PRO" resnum="235" rota="Cg_exo" rscc="0.985" rsr="0.050" rsrz="-0.572" said="A" seq="235"/>
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	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.830" phi="-128.4" psi="113.8" rama="Favored" resname="LEU" resnum="237" rota="tp" rscc="0.989" rsr="0.052" rsrz="-0.802" said="A" seq="237"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.460" phi="-114.5" psi="114.8" rama="Favored" resname="LEU" resnum="238" rota="tp" rscc="0.984" rsr="0.053" rsrz="-0.770" said="A" seq="238"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.950" phi="-91.5" psi="139.7" rama="Favored" resname="PHE" resnum="239" rota="m-85" rscc="0.985" rsr="0.047" rsrz="-0.736" said="A" seq="239"/>
	<ModelledSubgroup NatomsEDS="14" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.440" phi="-141.1" psi="155.6" rama="Favored" resname="TRP" resnum="240" rota="p-90" rscc="0.985" rsr="0.053" rsrz="-0.481" said="A" seq="240"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.680" phi="-129.1" psi="176.5" rama="Favored" resname="GLY" resnum="241" rscc="0.992" rsr="0.039" rsrz="-0.686" said="A" seq="241"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.230" phi="-119.6" psi="125.1" rama="Favored" resname="THR" resnum="242" rota="m" rscc="0.987" rsr="0.049" rsrz="-0.602" said="A" seq="242"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.900" phi="-84.2" psi="-4.0" rama="Favored" resname="PRO" resnum="243" rota="Cg_endo" rscc="0.975" rsr="0.064" rsrz="-0.252" said="A" seq="243"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.570" phi="70.5" psi="179.2" rama="Favored" resname="GLY" resnum="244" rscc="0.991" rsr="0.040" rsrz="-0.664" said="A" seq="244"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.190" phi="-133.3" psi="-78.6" rama="Allowed" resname="VAL" resnum="245" rota="t" rscc="0.983" rsr="0.049" rsrz="-0.842" said="A" seq="245"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.450" phi="-73.5" psi="-28.3" rama="Favored" resname="LEU" resnum="246" rota="mt" rscc="0.971" rsr="0.064" rsrz="-0.417" said="A" seq="246"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.130" phi="-130.9" psi="83.3" rama="Favored" resname="ILE" resnum="247" rota="mm" rscc="0.976" rsr="0.056" rsrz="-0.739" said="A" seq="247"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.630" phi="-66.3" psi="161.2" rama="Favored" resname="PRO" resnum="248" rota="Cg_exo" rscc="0.981" rsr="0.065" rsrz="-0.229" said="A" seq="248"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.740" phi="-46.9" psi="-47.0" rama="Favored" resname="PRO" resnum="249" rota="Cg_exo" rscc="0.986" rsr="0.049" rsrz="-0.595" said="A" seq="249"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.180" phi="-66.7" psi="-31.9" rama="Favored" resname="ALA" resnum="250" rscc="0.990" rsr="0.052" rsrz="-0.455" said="A" seq="250"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.540" phi="-74.7" psi="-35.4" rama="Favored" resname="GLU" resnum="251" rota="mm-40" rscc="0.970" rsr="0.079" rsrz="-0.469" said="A" seq="251"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.460" phi="-58.8" psi="-41.4" rama="Favored" resname="ALA" resnum="252" rscc="0.979" rsr="0.060" rsrz="-0.251" said="A" seq="252"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.070" phi="-65.9" psi="-38.3" rama="Favored" resname="ALA" resnum="253" rscc="0.985" rsr="0.048" rsrz="-0.558" said="A" seq="253"/>
	<ModelledSubgroup NatomsEDS="11" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.560" phi="-62.5" psi="-43.2" rama="Favored" resname="ARG" resnum="254" rota="mtt180" rscc="0.972" rsr="0.063" rsrz="-0.632" said="A" seq="254"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.230" phi="-63.5" psi="-35.4" rama="Favored" resname="LEU" resnum="255" rota="mt" rscc="0.977" rsr="0.061" rsrz="-0.513" said="A" seq="255"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.170" phi="-54.7" psi="-35.4" rama="Favored" resname="ALA" resnum="256" rscc="0.975" rsr="0.062" rsrz="-0.199" said="A" seq="256"/>
	<ModelledSubgroup NatomsEDS="13" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="12.530" phi="-86.7" psi="-36.6" rama="Favored" resname="GLU" resnum="257" rota="mm-40" rscc="0.936" rsr="0.111" rsrz="0.055" said="A" seq="257"/>
	<ModelledSubgroup NatomsEDS="13" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="12.530" phi="-86.7" psi="-36.6" rama="Favored" resname="GLU" resnum="257" rota="mm-40" rscc="0.936" rsr="0.111" rsrz="0.055" said="A" seq="257"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="11.360" phi="-93.2" psi="-15.3" rama="Favored" resname="SER" resnum="258" rota="p" rscc="0.980" rsr="0.051" rsrz="-0.567" said="A" seq="258"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.560" phi="-99.5" psi="126.4" rama="Favored" resname="LEU" resnum="259" rota="mt" rscc="0.980" rsr="0.057" rsrz="-0.642" said="A" seq="259"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.070" phi="-62.3" psi="146.5" rama="Favored" resname="PRO" resnum="260" rota="Cg_exo" rscc="0.984" rsr="0.052" rsrz="-0.526" said="A" seq="260"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.460" phi="48.4" psi="50.0" rama="Favored" resname="ASN" resnum="261" rota="m-20" rscc="0.983" rsr="0.055" rsrz="-0.536" said="A" seq="261"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="8.930" phi="-113.3" psi="125.4" rama="Favored" resname="CYS" resnum="262" rota="t" rscc="0.994" rsr="0.039" rsrz="-0.803" said="A" seq="262"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="9.410" phi="-106.8" psi="126.1" rama="Favored" resname="LYS" resnum="263" rota="tttp" rscc="0.983" rsr="0.051" rsrz="-1.019" said="A" seq="263">
		<clash atom="NZ" cid="8" clashmag="0.44" dist="2.50"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.000" phi="-103.7" psi="147.5" rama="Favored" resname="THR" resnum="264" rota="p" rscc="0.979" rsr="0.059" rsrz="-0.351" said="A" seq="264"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.310" phi="-131.0" psi="119.9" rama="Favored" resname="VAL" resnum="265" rota="t" rscc="0.973" rsr="0.069" rsrz="-0.213" said="A" seq="265"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.670" phi="-76.7" psi="114.3" rama="Favored" resname="ASP" resnum="266" rota="t0" rscc="0.990" rsr="0.040" rsrz="-0.848" said="A" seq="266"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.260" phi="-92.5" psi="-0.4" rama="Favored" resname="ILE" resnum="267" rota="pt" rscc="0.972" rsr="0.071" rsrz="-0.218" said="A" seq="267"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.500" phi="86.8" psi="-145.7" rama="Favored" resname="GLY" resnum="268" rscc="0.988" rsr="0.046" rsrz="-0.532" said="A" seq="268"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.020" phi="-58.2" psi="135.7" rama="Favored" resname="PRO" resnum="269" rota="Cg_exo" rscc="0.976" rsr="0.064" rsrz="-0.252" said="A" seq="269"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.800" phi="-174.9" psi="151.8" rama="Favored" resname="GLY" resnum="270" rscc="0.987" rsr="0.056" rsrz="-0.311" said="A" seq="270"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.990" phi="-117.1" psi="-97.7" rama="Allowed" resname="LEU" resnum="271" rota="mt" rscc="0.982" rsr="0.057" rsrz="-0.642" said="A" seq="271"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.900" phi="-108.2" psi="-49.5" rama="Favored" resname="HIS" resnum="272" rota="t60" rscc="0.990" rsr="0.046" rsrz="-0.648" said="A" seq="272"/>
	<ModelledSubgroup NatomsEDS="12" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.170" phi="-84.9" psi="67.4" rama="Favored" resname="TYR" resnum="273" rota="m-85" rscc="0.989" rsr="0.046" rsrz="-0.737" said="A" seq="273"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.220" phi="-56.4" psi="-29.1" rama="Favored" resname="LEU" resnum="274" rota="mt" rscc="0.978" rsr="0.058" rsrz="-0.609" said="A" seq="274"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.420" phi="-61.1" psi="-21.8" rama="Favored" resname="GLN" resnum="275" rota="mp0" rscc="0.988" rsr="0.046" rsrz="-0.869" said="A" seq="275"/>
	<ModelledSubgroup NatomsEDS="9" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.710" phi="-89.2" psi="-18.3" rama="Favored" resname="GLU" resnum="276" rota="mm-40" rscc="0.987" rsr="0.055" rsrz="-0.862" said="A" seq="276"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.870" phi="-92.6" psi="-38.9" rama="Favored" resname="ASP" resnum="277" rota="m-20" rscc="0.991" rsr="0.039" rsrz="-0.866" said="A" seq="277"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.700" phi="-145.3" psi="65.3" rama="Favored" resname="ASN" resnum="278" rota="t-20" rscc="0.992" rsr="0.043" rsrz="-0.768" said="A" seq="278"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.720" phi="-65.0" psi="-32.3" rama="Favored" resname="PRO" resnum="279" rota="Cg_endo" rscc="0.987" rsr="0.057" rsrz="-0.412" said="A" seq="279"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.360" phi="-69.3" psi="-38.4" rama="Favored" resname="ASP" resnum="280" rota="m-20" rscc="0.965" rsr="0.091" rsrz="0.063" said="A" seq="280">
		<angle-outlier atom0="CB" atom1="CG" atom2="OD1" mean="118.300" obs="122.834" stdev="0.900" z="5.04"/>
		<angle-outlier atom0="CB" atom1="CG" atom2="OD2" mean="118.300" obs="113.724" stdev="0.900" z="-5.08"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.610" phi="-71.0" psi="-38.9" rama="Favored" resname="LEU" resnum="281" rota="tp" rscc="0.983" rsr="0.061" rsrz="-0.513" said="A" seq="281"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.110" phi="-59.8" psi="-51.8" rama="Favored" resname="ILE" resnum="282" rota="mt" rscc="0.981" rsr="0.056" rsrz="-0.739" said="A" seq="282"/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="4.880" phi="-62.2" psi="-45.7" rama="Favored" resname="GLY" resnum="283" rscc="0.992" rsr="0.043" rsrz="-0.598" said="A" seq="283"/>
	<ModelledSubgroup NatomsEDS="6" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.690" phi="-65.7" psi="-37.0" rama="Favored" resname="SER" resnum="284" rota="p" rscc="0.987" rsr="0.057" rsrz="-0.437" said="A" seq="284"/>
	<ModelledSubgroup NatomsEDS="13" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.900" phi="-72.3" psi="-37.8" rama="Favored" resname="GLU" resnum="285" rota="mm-40" rscc="0.980" rsr="0.070" rsrz="-0.617" said="A" seq="285"/>
	<ModelledSubgroup NatomsEDS="13" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="7.900" phi="-72.3" psi="-37.8" rama="Favored" resname="GLU" resnum="285" rota="mm-40" rscc="0.980" rsr="0.070" rsrz="-0.617" said="A" seq="285"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.070" phi="-59.5" psi="-48.0" rama="Favored" resname="ILE" resnum="286" rota="mt" rscc="0.989" rsr="0.042" rsrz="-1.225" said="A" seq="286"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.760" phi="-58.2" psi="-42.6" rama="Favored" resname="ALA" resnum="287" rscc="0.979" rsr="0.069" rsrz="-0.020" said="A" seq="287"/>
	<ModelledSubgroup NatomsEDS="17" altcode="A" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="21.970" phi="-67.8" psi="-30.1" rama="Favored" resname="ARG" resnum="288" rota="ttp180" rscc="0.971" rsr="0.135" rsrz="0.709" said="A" seq="288">
		<angle-outlier atom0="NE" atom1="CZ" atom2="NH1" mean="120.300" obs="116.851" stdev="0.500" z="-6.90"/>
		<clash atom="NH2" cid="3" clashmag="0.46" dist="2.48"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="17" altcode="B" avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="21.970" phi="-67.8" psi="-30.1" rama="Favored" resname="ARG" resnum="288" rota="ttp180" rscc="0.971" rsr="0.135" rsrz="0.709" said="A" seq="288">
		<angle-outlier atom0="NE" atom1="CZ" atom2="NH1" mean="120.300" obs="116.851" stdev="0.500" z="-6.90"/>
		<clash atom="NE" cid="5" clashmag="0.45" dist="2.50"/>
		<clash atom="NH1" cid="4" clashmag="0.46" dist="2.49"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="14" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.660" phi="-80.6" psi="-23.9" rama="Favored" resname="TRP" resnum="289" rota="t90" rscc="0.983" rsr="0.052" rsrz="-0.513" said="A" seq="289">
		<angle-outlier atom0="CA" atom1="CB" atom2="CG" mean="113.700" obs="124.615" stdev="1.900" z="5.75"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="5.500" phi="-64.0" psi="-41.4" rama="Favored" resname="LEU" resnum="290" rota="mt" rscc="0.985" rsr="0.053" rsrz="-0.770" said="A" seq="290"/>
	<ModelledSubgroup NatomsEDS="7" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.010" phi="-59.3" psi="-39.1" rama="Favored" resname="PRO" resnum="291" rota="Cg_exo" rscc="0.978" rsr="0.068" rsrz="-0.160" said="A" seq="291"/>
	<ModelledSubgroup NatomsEDS="5" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.270" phi="-72.7" psi="-8.5" rama="Favored" resname="ALA" resnum="292" rscc="0.990" rsr="0.043" rsrz="-0.686" said="A" seq="292"/>
	<ModelledSubgroup NatomsEDS="8" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="6.880" phi="-79.4" psi="-16.3" rama="Favored" resname="LEU" resnum="293" rota="mt" rscc="0.977" rsr="0.063" rsrz="-0.449" said="A" seq="293"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.750" phi="-63.5" psi="-48.5" rama="Favored" resname="HIS" resnum="294" rota="t-80" rscc="0.965" rsr="0.071" rsrz="-0.179" said="A" seq="294"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="10.090" phi="-63.3" psi="138.7" rama="Favored" resname="HIS" resnum="295" rota="t60" rscc="0.977" rsr="0.054" rsrz="-0.498" said="A" seq="295"/>
	<ModelledSubgroup NatomsEDS="10" altcode=" " avgoccu="1.000" chain="A" ent="1" icode=" " model="1" owab="42.120" resname="HIS" resnum="296" rota="t-80" rscc="0.819" rsr="0.202" rsrz="2.282" said="A" seq="296">
		<bond-outlier atom0="C" atom1="O" mean="1.229" obs="1.443" stdev="0.019" z="11.24"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="2" icode=" " ligRSRZ="0.85" ligRSRnbrMean="0.05" ligRSRnbrStdev="0.01" ligRSRnumnbrs="11" model="1" mogul_angles_rmsz="0.57" mogul_bonds_rmsz="0.77" mogul_rmsz_numangles="3" mogul_rmsz_numbonds="3" owab="11.790" resname="IPA" resnum="1001" rscc="0.983" rsr="0.063" rsrz="-1.576" said="B" seq="."/>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " ligRSRZ="4.46" ligRSRnbrMean="0.06" ligRSRnbrStdev="0.01" ligRSRnumnbrs="7" ligand_density_outlier="yes" model="1" mogul_angles_rmsz="0.00" mogul_bonds_rmsz="3.37" mogul_rmsz_numangles="0" mogul_rmsz_numbonds="1" owab="9.860" resname="ACT" resnum="1002" rscc="0.960" rsr="0.091" rsrz="-0.784" said="C" seq=".">
		<mog-bond-outlier Zscore="3.37" atoms="CH3,C" mean="1.48" mindiff="0.02" numobs="41" obsval="1.53" stdev="0.01"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="4" altcode=" " avgoccu="1.000" chain="A" ent="3" icode=" " ligRSRZ="0.05" ligRSRnbrMean="0.07" ligRSRnbrStdev="0.02" ligRSRnumnbrs="9" model="1" mogul_angles_rmsz="0.00" mogul_bonds_rmsz="7.00" mogul_rmsz_numangles="0" mogul_rmsz_numbonds="1" owab="19.160" resname="ACT" resnum="1003" rscc="0.964" rsr="0.074" rsrz="-0.983" said="D" seq=".">
		<mog-bond-outlier Zscore="-7.00" atoms="CH3,C" mean="1.48" mindiff="0.05" numobs="41" obsval="1.39" stdev="0.01"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="4" icode=" " ligRSRZ="-0.75" ligRSRnbrMean="0.05" ligRSRnbrStdev="0.01" ligRSRnumnbrs="8" model="1" mogul-ignore="yes" owab="8.330" resname="CL" resnum="1004" rscc="1.000" rsr="0.044" rsrz="-0.452" said="E" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="5.200" resname="HOH" resnum="2001" rscc="0.994" rsr="0.040" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="5.890" resname="HOH" resnum="2002" rscc="0.997" rsr="0.036" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="5.830" resname="HOH" resnum="2003" rscc="0.993" rsr="0.067" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="5.680" resname="HOH" resnum="2004" rscc="0.997" rsr="0.076" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="5.150" resname="HOH" resnum="2005" rscc="0.997" rsr="0.036" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.380" resname="HOH" resnum="2006" rscc="0.997" rsr="0.075" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="6.300" resname="HOH" resnum="2007" rscc="0.993" rsr="0.070" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="7.130" resname="HOH" resnum="2008" rscc="0.988" rsr="0.059" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.730" resname="HOH" resnum="2009" rscc="0.996" rsr="0.036" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="6.060" resname="HOH" resnum="2010" rscc="0.995" rsr="0.047" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="7.040" resname="HOH" resnum="2011" rscc="0.995" rsr="0.036" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="7.440" resname="HOH" resnum="2012" rscc="0.991" rsr="0.082" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="5.710" resname="HOH" resnum="2013" rscc="0.996" rsr="0.035" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.440" resname="HOH" resnum="2014" rscc="0.986" rsr="0.057" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="7.950" resname="HOH" resnum="2015" rscc="0.984" rsr="0.056" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.950" resname="HOH" resnum="2016" rscc="0.992" rsr="0.052" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="7.920" resname="HOH" resnum="2017" rscc="0.989" rsr="0.068" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.740" resname="HOH" resnum="2018" rscc="0.986" rsr="0.059" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="7.300" resname="HOH" resnum="2019" rscc="0.994" rsr="0.045" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.270" resname="HOH" resnum="2020" rscc="0.992" rsr="0.073" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="7.660" resname="HOH" resnum="2021" rscc="0.987" rsr="0.062" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.450" resname="HOH" resnum="2022" rscc="0.973" rsr="0.055" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="5.910" resname="HOH" resnum="2023" rscc="0.996" rsr="0.060" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.080" resname="HOH" resnum="2024" rscc="0.964" rsr="0.087" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.260" resname="HOH" resnum="2025" rscc="0.988" rsr="0.068" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.660" resname="HOH" resnum="2026" rscc="0.989" rsr="0.082" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.560" resname="HOH" resnum="2027" rscc="0.995" rsr="0.073" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="7.840" resname="HOH" resnum="2028" rscc="0.996" rsr="0.053" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="6.790" resname="HOH" resnum="2029" rscc="0.995" rsr="0.056" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="7.010" resname="HOH" resnum="2030" rscc="0.992" rsr="0.051" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="7.370" resname="HOH" resnum="2031" rscc="0.995" rsr="0.033" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.570" resname="HOH" resnum="2032" rscc="0.983" rsr="0.046" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.340" resname="HOH" resnum="2033" rscc="0.994" rsr="0.057" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.110" resname="HOH" resnum="2034" rscc="0.997" rsr="0.030" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.790" resname="HOH" resnum="2035" rscc="0.976" rsr="0.062" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.610" resname="HOH" resnum="2036" rscc="0.993" rsr="0.030" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.700" chain="A" ent="5" icode=" " model="1" owab="4.760" resname="HOH" resnum="2037" rscc="0.992" rsr="0.113" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.110" resname="HOH" resnum="2038" rscc="0.985" rsr="0.061" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.810" resname="HOH" resnum="2039" rscc="0.984" rsr="0.081" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.150" resname="HOH" resnum="2040" rscc="0.993" rsr="0.046" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.690" resname="HOH" resnum="2041" rscc="0.986" rsr="0.051" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.250" resname="HOH" resnum="2042" rscc="0.986" rsr="0.043" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.740" resname="HOH" resnum="2043" rscc="0.991" rsr="0.046" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="6.840" resname="HOH" resnum="2044" rscc="0.997" rsr="0.028" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.920" resname="HOH" resnum="2045" rscc="0.994" rsr="0.047" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.020" resname="HOH" resnum="2046" rscc="0.974" rsr="0.070" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="7.260" resname="HOH" resnum="2047" rscc="0.995" rsr="0.041" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.880" resname="HOH" resnum="2048" rscc="0.978" rsr="0.067" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.310" resname="HOH" resnum="2049" rscc="0.985" rsr="0.082" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.470" resname="HOH" resnum="2050" rscc="0.989" rsr="0.042" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.140" resname="HOH" resnum="2051" rscc="0.968" rsr="0.084" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.330" resname="HOH" resnum="2052" rscc="0.995" rsr="0.040" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.370" resname="HOH" resnum="2053" rscc="0.968" rsr="0.099" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.280" resname="HOH" resnum="2054" rscc="0.993" rsr="0.054" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.640" resname="HOH" resnum="2055" rscc="0.995" rsr="0.054" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.990" resname="HOH" resnum="2056" rscc="0.988" rsr="0.054" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.980" resname="HOH" resnum="2057" rscc="0.982" rsr="0.050" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.580" resname="HOH" resnum="2058" rscc="0.989" rsr="0.078" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.490" resname="HOH" resnum="2059" rscc="0.984" rsr="0.047" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="7.980" resname="HOH" resnum="2060" rscc="0.991" rsr="0.068" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.270" resname="HOH" resnum="2061" rscc="0.977" rsr="0.055" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.940" resname="HOH" resnum="2062" rscc="0.984" rsr="0.044" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.670" resname="HOH" resnum="2063" rscc="0.978" rsr="0.054" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.970" resname="HOH" resnum="2064" rscc="0.987" rsr="0.046" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.320" resname="HOH" resnum="2065" rscc="0.980" rsr="0.068" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.880" resname="HOH" resnum="2066" rscc="0.968" rsr="0.078" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.020" resname="HOH" resnum="2067" rscc="0.970" rsr="0.074" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.650" resname="HOH" resnum="2068" rscc="0.994" rsr="0.036" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="11.180" resname="HOH" resnum="2069" rscc="0.983" rsr="0.115" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.240" resname="HOH" resnum="2070" rscc="0.963" rsr="0.089" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.960" resname="HOH" resnum="2071" rscc="0.987" rsr="0.049" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.330" resname="HOH" resnum="2072" rscc="0.961" rsr="0.087" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.200" resname="HOH" resnum="2073" rscc="0.983" rsr="0.079" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.190" resname="HOH" resnum="2074" rscc="0.992" rsr="0.034" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.880" resname="HOH" resnum="2075" rscc="0.932" rsr="0.100" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.710" resname="HOH" resnum="2076" rscc="0.947" rsr="0.099" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="6.810" resname="HOH" resnum="2077" rscc="0.993" rsr="0.100" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="6.810" resname="HOH" resnum="2077" rscc="0.993" rsr="0.100" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.720" resname="HOH" resnum="2078" rscc="0.996" rsr="0.032" said="F" seq="."/>
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		<clash atom="O" cid="5" clashmag="0.45" dist="2.50"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.490" resname="HOH" resnum="2173" rscc="0.988" rsr="0.033" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.860" resname="HOH" resnum="2174" rscc="0.942" rsr="0.072" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.430" resname="HOH" resnum="2176" rscc="0.967" rsr="0.083" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.770" resname="HOH" resnum="2177" rscc="0.948" rsr="0.089" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.320" resname="HOH" resnum="2178" rscc="0.987" rsr="0.045" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.240" resname="HOH" resnum="2179" rscc="0.979" rsr="0.046" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.760" resname="HOH" resnum="2180" rscc="0.971" rsr="0.097" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.410" resname="HOH" resnum="2181" rscc="0.977" rsr="0.072" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.070" resname="HOH" resnum="2182" rscc="0.960" rsr="0.069" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.140" resname="HOH" resnum="2183" rscc="0.975" rsr="0.088" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.480" resname="HOH" resnum="2184" rscc="0.960" rsr="0.100" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="9.480" resname="HOH" resnum="2184" rscc="0.960" rsr="0.100" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.050" resname="HOH" resnum="2185" rscc="0.923" rsr="0.095" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.050" resname="HOH" resnum="2185" rscc="0.923" rsr="0.095" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.870" resname="HOH" resnum="2186" rscc="0.983" rsr="0.048" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.940" resname="HOH" resnum="2187" rscc="0.990" rsr="0.038" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.780" resname="HOH" resnum="2188" rscc="0.977" rsr="0.054" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.770" resname="HOH" resnum="2189" rscc="0.941" rsr="0.163" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.620" resname="HOH" resnum="2190" rscc="0.975" rsr="0.061" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.270" resname="HOH" resnum="2191" rscc="0.991" rsr="0.051" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.990" resname="HOH" resnum="2192" rscc="0.977" rsr="0.072" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.210" resname="HOH" resnum="2193" rscc="0.939" rsr="0.098" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.800" resname="HOH" resnum="2194" rscc="0.945" rsr="0.112" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.980" resname="HOH" resnum="2195" rscc="0.978" rsr="0.102" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.810" resname="HOH" resnum="2196" rscc="0.908" rsr="0.089" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.600" resname="HOH" resnum="2197" rscc="0.971" rsr="0.125" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.840" resname="HOH" resnum="2198" rscc="0.978" rsr="0.066" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.780" resname="HOH" resnum="2199" rscc="0.958" rsr="0.062" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.620" resname="HOH" resnum="2200" rscc="0.976" rsr="0.058" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.660" resname="HOH" resnum="2201" rscc="0.928" rsr="0.105" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.130" resname="HOH" resnum="2202" rscc="0.973" rsr="0.076" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.350" resname="HOH" resnum="2203" rscc="0.921" rsr="0.122" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.350" resname="HOH" resnum="2203" rscc="0.921" rsr="0.122" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.090" resname="HOH" resnum="2204" rscc="0.948" rsr="0.062" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.510" resname="HOH" resnum="2205" rscc="0.942" rsr="0.080" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.490" resname="HOH" resnum="2206" rscc="0.946" rsr="0.076" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.000" resname="HOH" resnum="2207" rscc="0.940" rsr="0.083" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.270" resname="HOH" resnum="2208" rscc="0.989" rsr="0.068" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.720" resname="HOH" resnum="2209" rscc="0.874" rsr="0.101" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.810" resname="HOH" resnum="2210" rscc="0.915" rsr="0.080" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.570" resname="HOH" resnum="2211" rscc="0.969" rsr="0.060" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.150" resname="HOH" resnum="2212" rscc="0.921" rsr="0.063" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.400" resname="HOH" resnum="2213" rscc="0.984" rsr="0.061" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.910" resname="HOH" resnum="2214" rscc="0.963" rsr="0.093" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="3" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.530" resname="HOH" resnum="2215" rscc="0.888" rsr="0.223" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="3" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.530" resname="HOH" resnum="2215" rscc="0.888" rsr="0.223" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="3" altcode="C" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="8.530" resname="HOH" resnum="2215" rscc="0.888" rsr="0.223" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.360" resname="HOH" resnum="2216" rscc="0.963" rsr="0.076" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.860" resname="HOH" resnum="2217" rscc="0.950" rsr="0.156" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.860" resname="HOH" resnum="2217" rscc="0.950" rsr="0.156" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.060" resname="HOH" resnum="2218" rscc="0.981" rsr="0.106" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.390" resname="HOH" resnum="2219" rscc="0.953" rsr="0.073" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.620" resname="HOH" resnum="2220" rscc="0.918" rsr="0.138" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.970" resname="HOH" resnum="2221" rscc="0.945" rsr="0.097" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.550" resname="HOH" resnum="2222" rscc="0.917" rsr="0.104" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.450" resname="HOH" resnum="2223" rscc="0.900" rsr="0.146" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.450" resname="HOH" resnum="2223" rscc="0.900" rsr="0.146" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="25.320" resname="HOH" resnum="2224" rscc="0.901" rsr="0.175" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.260" resname="HOH" resnum="2225" rscc="0.973" rsr="0.187" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.070" resname="HOH" resnum="2226" rscc="0.973" rsr="0.112" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.330" resname="HOH" resnum="2227" rscc="0.957" rsr="0.084" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.810" resname="HOH" resnum="2228" rscc="0.969" rsr="0.069" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="25.340" resname="HOH" resnum="2229" rscc="0.980" rsr="0.059" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.320" resname="HOH" resnum="2230" rscc="0.944" rsr="0.098" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.160" resname="HOH" resnum="2231" rscc="0.950" rsr="0.082" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.250" resname="HOH" resnum="2232" rscc="0.948" rsr="0.094" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.020" resname="HOH" resnum="2233" rscc="0.872" rsr="0.093" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.000" resname="HOH" resnum="2234" rscc="0.862" rsr="0.129" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.610" resname="HOH" resnum="2235" rscc="0.958" rsr="0.077" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.490" resname="HOH" resnum="2236" rscc="0.980" rsr="0.181" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.850" resname="HOH" resnum="2237" rscc="0.975" rsr="0.079" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.430" resname="HOH" resnum="2238" rscc="0.909" rsr="0.132" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.530" resname="HOH" resnum="2239" rscc="0.974" rsr="0.168" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.940" resname="HOH" resnum="2240" rscc="0.976" rsr="0.057" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.480" resname="HOH" resnum="2241" rscc="0.980" rsr="0.111" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.870" resname="HOH" resnum="2242" rscc="0.960" rsr="0.100" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="10.800" resname="HOH" resnum="2244" rscc="0.950" rsr="0.085" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.310" resname="HOH" resnum="2245" rscc="0.931" rsr="0.105" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.960" resname="HOH" resnum="2246" rscc="0.936" rsr="0.084" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.110" resname="HOH" resnum="2247" rscc="0.916" rsr="0.203" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.280" resname="HOH" resnum="2249" rscc="0.977" rsr="0.068" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.020" resname="HOH" resnum="2250" rscc="0.946" rsr="0.085" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.190" resname="HOH" resnum="2251" rscc="0.795" rsr="0.138" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.980" resname="HOH" resnum="2253" rscc="0.956" rsr="0.064" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.270" resname="HOH" resnum="2254" rscc="0.958" rsr="0.081" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.450" resname="HOH" resnum="2256" rscc="0.939" rsr="0.079" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.890" resname="HOH" resnum="2257" rscc="0.968" rsr="0.049" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.060" resname="HOH" resnum="2258" rscc="0.935" rsr="0.099" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.660" resname="HOH" resnum="2259" rscc="0.762" rsr="0.151" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.150" resname="HOH" resnum="2260" rscc="0.968" rsr="0.120" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.040" resname="HOH" resnum="2261" rscc="0.975" rsr="0.085" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.400" resname="HOH" resnum="2262" rscc="0.960" rsr="0.123" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.400" resname="HOH" resnum="2262" rscc="0.960" rsr="0.123" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="16.490" resname="HOH" resnum="2263" rscc="0.983" rsr="0.048" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.890" resname="HOH" resnum="2264" rscc="0.936" rsr="0.089" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="25.880" resname="HOH" resnum="2265" rscc="0.888" rsr="0.113" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.530" resname="HOH" resnum="2266" rscc="0.937" rsr="0.185" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.480" resname="HOH" resnum="2267" rscc="0.900" rsr="0.106" said="F" seq=".">
		<clash atom="O" cid="4" clashmag="0.46" dist="2.49"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.910" resname="HOH" resnum="2268" rscc="0.910" rsr="0.119" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.960" resname="HOH" resnum="2269" rscc="0.956" rsr="0.088" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.700" resname="HOH" resnum="2270" rscc="0.896" rsr="0.083" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.970" resname="HOH" resnum="2271" rscc="0.909" rsr="0.132" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.900" resname="HOH" resnum="2272" rscc="0.949" rsr="0.071" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.970" resname="HOH" resnum="2273" rscc="0.905" rsr="0.120" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="25.370" resname="HOH" resnum="2274" rscc="0.903" rsr="0.138" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.490" resname="HOH" resnum="2275" rscc="0.945" rsr="0.148" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.410" resname="HOH" resnum="2276" rscc="0.938" rsr="0.146" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.210" resname="HOH" resnum="2277" rscc="0.853" rsr="0.152" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.020" resname="HOH" resnum="2278" rscc="0.906" rsr="0.125" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.940" resname="HOH" resnum="2279" rscc="0.936" rsr="0.074" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.080" resname="HOH" resnum="2280" rscc="0.969" rsr="0.132" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.160" resname="HOH" resnum="2281" rscc="0.902" rsr="0.123" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.490" resname="HOH" resnum="2282" rscc="0.882" rsr="0.121" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.820" resname="HOH" resnum="2283" rscc="0.884" rsr="0.157" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="13.820" resname="HOH" resnum="2283" rscc="0.884" rsr="0.157" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.900" resname="HOH" resnum="2284" rscc="0.976" rsr="0.094" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.620" resname="HOH" resnum="2285" rscc="0.913" rsr="0.112" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="9.680" resname="HOH" resnum="2286" rscc="0.930" rsr="0.203" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.520" resname="HOH" resnum="2287" rscc="0.956" rsr="0.106" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.520" resname="HOH" resnum="2287" rscc="0.956" rsr="0.106" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="25.680" resname="HOH" resnum="2288" rscc="0.920" rsr="0.115" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.340" resname="HOH" resnum="2289" rscc="0.890" rsr="0.100" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.090" resname="HOH" resnum="2290" rscc="0.841" rsr="0.136" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.610" resname="HOH" resnum="2291" rscc="0.948" rsr="0.115" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="11.510" resname="HOH" resnum="2292" rscc="0.949" rsr="0.118" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.020" resname="HOH" resnum="2293" rscc="0.926" rsr="0.142" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.110" resname="HOH" resnum="2294" rscc="0.927" rsr="0.077" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="21.900" resname="HOH" resnum="2295" rscc="0.941" rsr="0.152" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.100" resname="HOH" resnum="2296" rscc="0.911" rsr="0.092" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="12.720" resname="HOH" resnum="2297" rscc="0.992" rsr="0.035" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.860" resname="HOH" resnum="2298" rscc="0.968" rsr="0.063" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.700" chain="A" ent="5" icode=" " model="1" owab="10.620" resname="HOH" resnum="2299" rscc="0.989" rsr="0.046" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="17.030" resname="HOH" resnum="2300" rscc="0.978" rsr="0.106" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.790" resname="HOH" resnum="2301" rscc="0.955" rsr="0.058" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.360" resname="HOH" resnum="2302" rscc="0.926" rsr="0.080" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.820" resname="HOH" resnum="2303" rscc="0.850" rsr="0.102" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.540" resname="HOH" resnum="2304" rscc="0.918" rsr="0.090" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="14.770" resname="HOH" resnum="2305" rscc="0.977" rsr="0.065" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.170" resname="HOH" resnum="2306" rscc="0.957" rsr="0.070" said="F" seq=".">
		<clash atom="O" cid="6" clashmag="0.45" dist="2.49"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="12.140" resname="HOH" resnum="2307" rscc="0.899" rsr="0.218" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="18.020" resname="HOH" resnum="2309" rscc="0.970" rsr="0.055" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="14.370" resname="HOH" resnum="2319" rscc="0.904" rsr="0.193" said="F" seq=".">
		<clash atom="O" cid="2" clashmag="0.74" dist="2.05"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.870" resname="HOH" resnum="2320" rscc="0.921" rsr="0.111" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.890" resname="HOH" resnum="2321" rscc="0.873" rsr="0.115" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="15.680" resname="HOH" resnum="2322" rscc="0.949" rsr="0.111" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.070" resname="HOH" resnum="2342" rscc="0.862" rsr="0.164" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.160" resname="HOH" resnum="2343" rscc="0.852" rsr="0.212" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="34.820" resname="HOH" resnum="2344" rscc="0.897" rsr="0.179" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="33.230" resname="HOH" resnum="2347" rscc="0.779" rsr="0.197" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.140" resname="HOH" resnum="2348" rscc="0.954" rsr="0.127" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="31.250" resname="HOH" resnum="2349" rscc="0.778" rsr="0.222" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.250" resname="HOH" resnum="2350" rscc="0.821" rsr="0.098" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.430" resname="HOH" resnum="2351" rscc="0.927" rsr="0.131" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.390" resname="HOH" resnum="2352" rscc="0.869" rsr="0.095" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.990" resname="HOH" resnum="2353" rscc="0.750" rsr="0.125" said="F" seq=".">
		<clash atom="O" cid="7" clashmag="0.45" dist="2.49"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.600" resname="HOH" resnum="2354" rscc="0.932" rsr="0.148" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.470" resname="HOH" resnum="2357" rscc="0.915" rsr="0.130" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.270" resname="HOH" resnum="2358" rscc="0.921" rsr="0.121" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.770" resname="HOH" resnum="2359" rscc="0.941" rsr="0.081" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="35.130" resname="HOH" resnum="2360" rscc="0.771" rsr="0.101" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="35.820" resname="HOH" resnum="2361" rscc="0.833" rsr="0.104" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.110" resname="HOH" resnum="2362" rscc="0.959" rsr="0.110" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.740" resname="HOH" resnum="2363" rscc="0.880" rsr="0.119" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.400" resname="HOH" resnum="2364" rscc="0.897" rsr="0.197" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.430" resname="HOH" resnum="2365" rscc="0.818" rsr="0.180" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.430" resname="HOH" resnum="2365" rscc="0.818" rsr="0.180" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.660" resname="HOH" resnum="2366" rscc="0.930" rsr="0.140" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="22.570" resname="HOH" resnum="2367" rscc="0.893" rsr="0.105" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.750" resname="HOH" resnum="2368" rscc="0.949" rsr="0.091" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.470" resname="HOH" resnum="2369" rscc="0.930" rsr="0.127" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="12.630" resname="HOH" resnum="2370" rscc="0.958" rsr="0.102" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.720" resname="HOH" resnum="2371" rscc="0.829" rsr="0.100" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.070" resname="HOH" resnum="2372" rscc="0.848" rsr="0.092" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.970" resname="HOH" resnum="2373" rscc="0.890" rsr="0.181" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="32.180" resname="HOH" resnum="2374" rscc="0.786" rsr="0.254" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="27.260" resname="HOH" resnum="2375" rscc="0.924" rsr="0.162" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.480" resname="HOH" resnum="2376" rscc="0.890" rsr="0.072" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.430" resname="HOH" resnum="2377" rscc="0.728" rsr="0.214" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="39.980" resname="HOH" resnum="2378" rscc="0.669" rsr="0.192" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.480" resname="HOH" resnum="2381" rscc="0.948" rsr="0.066" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="38.030" resname="HOH" resnum="2382" rscc="0.910" rsr="0.111" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.370" resname="HOH" resnum="2383" rscc="0.924" rsr="0.154" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="31.780" resname="HOH" resnum="2384" rscc="0.909" rsr="0.076" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="32.910" resname="HOH" resnum="2385" rscc="0.853" rsr="0.132" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.430" resname="HOH" resnum="2386" rscc="0.887" rsr="0.109" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.750" resname="HOH" resnum="2387" rscc="0.881" rsr="0.166" said="F" seq=".">
		<clash atom="O" cid="9" clashmag="0.42" dist="2.51"/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="31.200" resname="HOH" resnum="2388" rscc="0.920" rsr="0.076" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="20.440" resname="HOH" resnum="2389" rscc="0.788" rsr="0.172" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.200" resname="HOH" resnum="2390" rscc="0.903" rsr="0.136" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.200" resname="HOH" resnum="2394" rscc="0.860" rsr="0.149" said="F" seq=".">
		<clash atom="O" cid="3" clashmag="0.46" dist="2.48"/>
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	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="19.200" resname="HOH" resnum="2394" rscc="0.860" rsr="0.149" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.090" resname="HOH" resnum="2410" rscc="0.865" rsr="0.083" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="36.190" resname="HOH" resnum="2426" rscc="0.836" rsr="0.382" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.620" resname="HOH" resnum="2427" rscc="0.843" rsr="0.334" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.190" resname="HOH" resnum="2428" rscc="0.830" rsr="0.116" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="26.150" resname="HOH" resnum="2429" rscc="0.966" rsr="0.056" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.190" resname="HOH" resnum="2430" rscc="0.905" rsr="0.117" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.420" resname="HOH" resnum="2431" rscc="0.766" rsr="0.123" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="30.850" resname="HOH" resnum="2432" rscc="0.747" rsr="0.105" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="33.580" resname="HOH" resnum="2433" rscc="0.770" rsr="0.121" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="25.800" resname="HOH" resnum="2434" rscc="0.899" rsr="0.109" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.610" resname="HOH" resnum="2435" rscc="0.860" rsr="0.163" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="33.180" resname="HOH" resnum="2436" rscc="0.620" rsr="0.359" said="F" seq=".">
		<clash atom="O" cid="8" clashmag="0.44" dist="2.50"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="38.650" resname="HOH" resnum="2437" rscc="0.632" rsr="0.134" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.330" resname="HOH" resnum="2439" rscc="0.797" rsr="0.099" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="32.610" resname="HOH" resnum="2440" rscc="0.712" rsr="0.145" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="34.990" resname="HOH" resnum="2442" rscc="0.706" rsr="0.162" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="31.990" resname="HOH" resnum="2443" rscc="0.731" rsr="0.203" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="34.880" resname="HOH" resnum="2444" rscc="0.743" rsr="0.137" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="35.180" resname="HOH" resnum="2445" rscc="0.833" rsr="0.147" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="33.930" resname="HOH" resnum="2446" rscc="0.840" rsr="0.103" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="39.930" resname="HOH" resnum="2447" rscc="0.859" rsr="0.180" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="45.070" resname="HOH" resnum="2448" rscc="0.742" rsr="0.128" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="33.270" resname="HOH" resnum="2449" rscc="0.722" rsr="0.302" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="37.680" resname="HOH" resnum="2450" rscc="0.711" rsr="0.157" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="34.590" resname="HOH" resnum="2451" rscc="0.689" rsr="0.226" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="37.820" resname="HOH" resnum="2452" rscc="0.843" rsr="0.180" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.070" resname="HOH" resnum="2453" rscc="0.918" rsr="0.189" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="40.780" resname="HOH" resnum="2454" rscc="0.687" rsr="0.118" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="24.450" resname="HOH" resnum="2456" rscc="0.928" rsr="0.074" said="F" seq="."/>
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	<ModelledSubgroup NatomsEDS="2" altcode="A" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.600" resname="HOH" resnum="2517" rscc="0.702" rsr="0.181" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="2" altcode="B" avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="23.600" resname="HOH" resnum="2517" rscc="0.702" rsr="0.181" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="38.230" resname="HOH" resnum="2518" rscc="0.912" rsr="0.146" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="38.770" resname="HOH" resnum="2519" rscc="0.834" rsr="0.282" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="35.160" resname="HOH" resnum="2520" rscc="0.839" rsr="0.233" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="34.160" resname="HOH" resnum="2521" rscc="0.826" rsr="0.207" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="46.980" resname="HOH" resnum="2522" rscc="0.821" rsr="0.310" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="99.510" resname="HOH" resnum="2523" rscc="0.133" rsr="0.897" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="29.120" resname="HOH" resnum="2524" rscc="0.835" rsr="0.088" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="16.800" resname="HOH" resnum="2525" rscc="0.894" rsr="0.209" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="40.270" resname="HOH" resnum="2526" rscc="0.775" rsr="0.265" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="34.560" resname="HOH" resnum="2527" rscc="0.826" rsr="0.247" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="43.620" resname="HOH" resnum="2528" rscc="0.732" rsr="0.182" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="45.110" resname="HOH" resnum="2529" rscc="0.589" rsr="0.181" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="50.680" resname="HOH" resnum="2530" rscc="0.384" rsr="0.188" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="39.110" resname="HOH" resnum="2531" rscc="0.561" rsr="0.301" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="28.520" resname="HOH" resnum="2532" rscc="0.544" rsr="0.259" said="F" seq=".">
		<clash atom="O" cid="0" clashmag="1.19" dist="1.57"/>
	</ModelledSubgroup>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="42.600" resname="HOH" resnum="2533" rscc="0.538" rsr="0.144" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="35.650" resname="HOH" resnum="2534" rscc="0.866" rsr="0.140" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="34.350" resname="HOH" resnum="2535" rscc="0.651" rsr="0.255" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="37.700" resname="HOH" resnum="2536" rscc="0.826" rsr="0.231" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="0.500" chain="A" ent="5" icode=" " model="1" owab="13.080" resname="HOH" resnum="2537" rscc="0.944" rsr="0.138" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="38.530" resname="HOH" resnum="2538" rscc="0.708" rsr="0.143" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="37.200" resname="HOH" resnum="2539" rscc="0.788" rsr="0.298" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="34.760" resname="HOH" resnum="2540" rscc="0.775" rsr="0.250" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="28.540" resname="HOH" resnum="2541" rscc="0.936" rsr="0.312" said="F" seq="."/>
	<ModelledSubgroup NatomsEDS="1" altcode=" " avgoccu="1.000" chain="A" ent="5" icode=" " model="1" owab="35.650" resname="HOH" resnum="2542" rscc="0.914" rsr="0.143" said="F" seq="."/>
	<ModelledEntityInstance absolute_RSRZ_percentile="91.35" absolute_rama_percentile="100.00" absolute_sidechain_percentile="83.54" angles_rmsz="1.14" bonds_rmsz="0.64" chain="A" ent="1" model="1" num_angles_rmsz="3651" num_bonds_rmsz="2673" relative_RSRZ_percentile="92.46" relative_rama_percentile="100.00" relative_sidechain_percentile="52.66" said="A"/>
	<programs>
		<program name="dcc" properties="DCC_refinement_program,num-free-reflections,DCC_R,B_factor_type,percent-free-reflections,DCC_Rfree" version="2.03"/>
		<program name="validation-pipeline" properties="pdbid,PDB-revision-number,attemptedValidationSteps,XMLcreationDate" version="stable22683"/>
		<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,low-resol-relative-percentile-percent-RSRZ-outliers,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,high-resol-relative-percentile-percent-RSRZ-outliers,relative-percentile-percent-rota-outliers" version="21963"/>
		<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="1.15 2013"/>
		<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,ligand_density_outlier,NatomsEDS,absolute_RSRZ_percentile,ligRSRnbrMean" version="stable22639"/>
		<program name="xtriage" properties="xtriage_input_columns,DataAnisotropy,TransNCS,centric_outliers,TwinL,acentric_outliers,WilsonBestimate,WilsonBaniso,IoverSigma,numMillerIndices,TwinL2" version="dev-1323"/>
		<program name="molprobity" properties="bond-outlier,relative_rama_percentile,phi,psi,RestypesNotcheckedForBondAngleGeometry,clash,angle-outlier,num_bonds_rmsz,absolute_sidechain_percentile,relative_sidechain_percentile,clashscore,bonds_rmsz,percent-rama-outliers,num-H-reduce,rota,num_angles_rmsz,angles_rmsz,percent-rota-outliers,rama,absolute_rama_percentile" version="4.02b-467"/>
	</programs>
</wwPDB-validation-information>
