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		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="125.14" stdev="7.41" mindiff="1.81" local_density="0.04" obsval="48.23"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="125.53" stdev="7.17" mindiff="6.70" local_density="0.02" obsval="-132.22"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="58.02" stdev="20.10" mindiff="8.26" local_density="0.84" obsval="-109.72"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="61.97" stdev="22.98" mindiff="11.96" local_density="0.00" obsval="70.51"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="65.67" stdev="1.96" mindiff="1.97" local_density="0.02" obsval="-109.07"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="64.52" stdev="2.93" mindiff="2.43" local_density="0.02" obsval="69.95"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="53.31" stdev="7.69" mindiff="2.80" local_density="0.07" obsval="-120.00"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="64.73" stdev="13.65" mindiff="0.16" local_density="0.54" obsval="-102.78"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="85.72" stdev="51.80" mindiff="2.58" local_density="3.04" obsval="-39.61"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="134.61" stdev="35.44" mindiff="1.67" local_density="0.06" obsval="24.02"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="31.28" stdev="19.97" mindiff="0.07" local_density="3.03" obsval="147.71"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="57.22" stdev="9.41" mindiff="0.66" local_density="0.45" obsval="112.75"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.22" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.87" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.75" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.09" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.14" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.01" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.25" Zscore="8.55" obsval="110.58"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.38" Zscore="2.07" obsval="117.33"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.23" Zscore="2.96" obsval="120.86"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.40" Zscore="2.47" obsval="122.63"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.59" Zscore="-3.21" obsval="107.67"/>
		<mog-angle-outlier atoms="CBB,CAB,C3B" numobs="151" mean="127.53" stdev="5.00" mindiff="0.92" Zscore="-2.17" obsval="116.68"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.10" Zscore="2.38" obsval="112.48"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.02" Zscore="-2.35" obsval="104.51"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.37" Zscore="-2.71" obsval="104.41"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.04" Zscore="2.50" obsval="112.60"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.90" Zscore="-2.22" obsval="102.80"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.63" Zscore="5.34" obsval="134.13"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.05" Zscore="-2.02" obsval="123.06"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.17" Zscore="2.36" obsval="137.42"/>
		<mog-angle-outlier atoms="OBD,CAD,C3D" numobs="108" mean="128.42" stdev="2.34" mindiff="0.09" Zscore="-2.56" obsval="122.43"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.15" Zscore="-2.02" obsval="120.52"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.32" Zscore="5.25" obsval="120.41"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.46" obsval="119.06"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.59" Zscore="2.88" obsval="119.20"/>
		<mog-angle-outlier atoms="C4,C3,C2" numobs="919" mean="123.63" stdev="2.57" mindiff="0.03" Zscore="-2.07" obsval="118.32"/>
		<clash atom="HMC1" dist="1.89" clashmag="0.54" cid="392"/>
		<clash atom="CBC" dist="2.47" clashmag="0.44" cid="398"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7231" Q_score="0.47" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.85" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="1" resnum="604" said="S" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="65.64" stdev="26.24" mindiff="0.95" local_density="3.64" obsval="-91.44"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="78.60" stdev="6.22" mindiff="3.75" local_density="0.15" obsval="-94.87"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="80.23" stdev="6.57" mindiff="4.13" local_density="0.15" obsval="86.87"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="69.37" stdev="29.88" mindiff="1.14" local_density="2.52" obsval="-66.13"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="68.70" stdev="27.33" mindiff="5.60" local_density="0.74" obsval="113.76"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="10552" mean="36.48" stdev="9.45" mindiff="0.15" local_density="0.23" obsval="130.62"/>
		<mog-torsion-outlier atoms="C4C,C3C,CAC,CBC" numobs="10557" mean="33.08" stdev="11.03" mindiff="0.11" local_density="0.88" obsval="-50.06"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="55.42" stdev="8.50" mindiff="2.58" local_density="0.07" obsval="114.62"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="70.74" stdev="45.73" mindiff="6.14" local_density="0.29" obsval="-21.61"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="47.99" stdev="29.15" mindiff="3.26" local_density="1.90" obsval="-144.93"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="54.61" stdev="8.57" mindiff="0.03" local_density="0.36" obsval="-116.24"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.24" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.83" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.00" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.54" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.06" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.02" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.44" Zscore="8.98" obsval="110.78"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.43" Zscore="3.00" obsval="119.85"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.49" Zscore="-3.10" obsval="107.76"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.11" Zscore="2.39" obsval="112.50"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.12" Zscore="-2.21" obsval="104.65"/>
		<mog-angle-outlier atoms="CAC,C3C,C4C" numobs="5400" mean="124.79" stdev="1.30" mindiff="0.01" Zscore="2.22" obsval="127.68"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.06" Zscore="-2.10" obsval="104.84"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.57" Zscore="5.31" obsval="134.07"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.39" Zscore="-2.21" obsval="122.62"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.38" Zscore="2.26" obsval="137.21"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.12" Zscore="-2.35" obsval="119.88"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.26" Zscore="5.95" obsval="121.62"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.75" obsval="118.50"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.75" Zscore="2.92" obsval="119.35"/>
		<clash atom="HHD" dist="1.80" clashmag="0.62" cid="341"/>
		<clash atom="HBC2" dist="1.80" clashmag="0.62" cid="341"/>
		<clash atom="HAB" dist="2.51" clashmag="0.41" cid="344"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.5385" Q_score="0.294" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.83" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="1" resnum="605" said="T" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="59.83" stdev="17.82" mindiff="0.59" local_density="0.96" obsval="-102.61"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="54.51" stdev="22.28" mindiff="0.03" local_density="4.80" obsval="-76.81"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="54.27" stdev="20.69" mindiff="0.09" local_density="4.50" obsval="102.72"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="32.02" stdev="4.60" mindiff="0.14" local_density="0.88" obsval="141.88"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="32.37" stdev="4.67" mindiff="0.63" local_density="1.10" obsval="-38.60"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="37.12" stdev="13.43" mindiff="1.28" local_density="4.21" obsval="134.16"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="66.62" stdev="21.21" mindiff="11.67" local_density="0.00" obsval="-76.67"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="67.09" stdev="19.07" mindiff="15.89" local_density="0.00" obsval="103.46"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="117.73" stdev="2.01" mindiff="50.10" local_density="0.00" obsval="-57.00"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="117.62" stdev="3.82" mindiff="6.61" local_density="0.01" obsval="123.12"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="56.47" stdev="45.63" mindiff="0.37" local_density="2.06" obsval="-35.98"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="58.82" stdev="21.80" mindiff="4.45" local_density="2.95" obsval="-135.19"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="54.11" stdev="21.56" mindiff="0.73" local_density="3.04" obsval="99.63"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.33" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.93" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.20" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.43" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.11" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.09" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.65" Zscore="9.43" obsval="110.98"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.19" Zscore="-2.21" obsval="121.38"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.39" Zscore="3.02" obsval="119.89"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.28" Zscore="2.42" obsval="122.51"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.24" Zscore="-2.82" obsval="108.01"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.01" Zscore="2.60" obsval="112.72"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.30" Zscore="-2.62" obsval="104.23"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.25" Zscore="2.21" obsval="112.32"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.84" Zscore="-2.17" obsval="102.87"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.94" Zscore="4.95" obsval="133.44"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.19" Zscore="2.35" obsval="137.40"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.86" Zscore="4.99" obsval="119.95"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.34" obsval="119.29"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="1.76" Zscore="2.15" obsval="116.37"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.11" Zscore="2.35" obsval="126.44"/>
		<clash atom="HED3" dist="1.98" clashmag="0.45" cid="519"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6923" Q_score="0.471" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="2.02" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="1" resnum="606" said="U" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="54.29" stdev="10.65" mindiff="0.29" local_density="1.11" obsval="122.82"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="64.81" stdev="29.20" mindiff="30.17" local_density="0.00" obsval="11.90"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="62.53" stdev="21.73" mindiff="0.98" local_density="1.50" obsval="-97.37"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="27.47" stdev="4.60" mindiff="0.12" local_density="1.30" obsval="146.53"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="28.51" stdev="4.55" mindiff="0.40" local_density="1.57" obsval="-34.66"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="69.43" stdev="30.08" mindiff="0.91" local_density="2.52" obsval="65.91"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="68.75" stdev="27.60" mindiff="5.28" local_density="0.74" obsval="-114.08"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="56.16" stdev="1.85" mindiff="11.48" local_density="0.00" obsval="-118.58"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="55.33" stdev="2.91" mindiff="0.92" local_density="0.05" obsval="60.75"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="51.15" stdev="9.83" mindiff="0.26" local_density="0.11" obsval="125.54"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="61.78" stdev="11.79" mindiff="0.07" local_density="0.57" obsval="106.69"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="46.65" stdev="9.48" mindiff="0.23" local_density="0.44" obsval="126.88"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="76.05" stdev="21.68" mindiff="0.08" local_density="1.90" obsval="87.95"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="47.87" stdev="30.42" mindiff="2.18" local_density="3.42" obsval="146.46"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="69.42" stdev="45.72" mindiff="7.47" local_density="0.29" obsval="22.94"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.13" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.82" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.03" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.40" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.00" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.02" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="4.19" Zscore="10.61" obsval="111.52"/>
		<mog-angle-outlier atoms="C2A,C3A,C4A" numobs="26" mean="101.87" stdev="1.62" mindiff="1.29" Zscore="2.68" obsval="106.19"/>
		<mog-angle-outlier atoms="CMA,C3A,C2A" numobs="98" mean="113.98" stdev="3.87" mindiff="0.78" Zscore="3.05" obsval="125.78"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="4.86" Zscore="4.97" obsval="125.14"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.56" obsval="119.65"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.09" Zscore="2.34" obsval="122.32"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.18" Zscore="-2.76" obsval="108.07"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.04" Zscore="2.58" obsval="112.69"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.31" Zscore="-2.63" obsval="104.22"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.08" Zscore="-2.08" obsval="104.85"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.93" Zscore="4.94" obsval="133.43"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.02" Zscore="-2.05" obsval="122.99"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.14" Zscore="2.51" obsval="137.73"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.27" Zscore="5.37" obsval="120.61"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.03" Zscore="-2.68" obsval="118.62"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.60" Zscore="2.88" obsval="119.21"/>
		<clash atom="C19" dist="2.50" clashmag="0.41" cid="525"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8000" Q_score="0.499" mogul_rmsz_numbonds="64" mogul_rmsz_numangles="76" mogul_bonds_rmsz="1.41" mogul_angles_rmsz="1.87" ligand_chirality_outlier="yes" num-H-reduce="59" model="1" chain="1" resnum="607" said="V" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="56.10" stdev="22.46" mindiff="0.01" local_density="4.72" obsval="80.70"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="56.70" stdev="21.70" mindiff="0.02" local_density="4.30" obsval="-97.92"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="111.29" stdev="7.25" mindiff="1.30" local_density="0.08" obsval="-62.08"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="112.65" stdev="7.08" mindiff="1.71" local_density="0.04" obsval="119.34"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="96.09" stdev="2.01" mindiff="28.46" local_density="0.00" obsval="-78.64"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="96.28" stdev="3.39" mindiff="1.50" local_density="0.02" obsval="101.76"/>
		<mog-torsion-outlier atoms="O2A,C1,C2,C3" numobs="153" mean="65.61" stdev="29.07" mindiff="4.53" local_density="1.96" obsval="60.85"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="38.47" stdev="16.20" mindiff="0.00" local_density="3.79" obsval="-70.10"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="40.65" stdev="14.61" mindiff="0.15" local_density="3.59" obsval="110.47"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="48.70" stdev="14.19" mindiff="0.40" local_density="0.07" obsval="-131.80"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="54.89" stdev="45.61" mindiff="1.23" local_density="2.65" obsval="37.57"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="60.95" stdev="11.28" mindiff="0.07" local_density="0.56" obsval="-107.80"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.15" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.97" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.02" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.63" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.01" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.26" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.33" Zscore="8.73" obsval="110.66"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.03" Zscore="-2.10" obsval="121.63"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.48" obsval="119.40"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.53" Zscore="-3.14" obsval="107.73"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.10" Zscore="2.19" obsval="112.28"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.34" Zscore="-2.70" obsval="104.14"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.17" Zscore="-2.44" obsval="104.60"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.07" Zscore="2.39" obsval="112.49"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.82" Zscore="-2.16" obsval="102.89"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.09" Zscore="5.03" obsval="133.59"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.23" Zscore="2.33" obsval="137.37"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.05" Zscore="5.10" obsval="120.14"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.39" obsval="119.19"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="7.00" Zscore="3.51" obsval="121.61"/>
		<clash atom="HAB" dist="1.84" clashmag="0.59" cid="352"/>
		<clash atom="HAB" dist="2.33" clashmag="0.59" cid="353"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6923" Q_score="0.425" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.79" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="1" resnum="608" said="W" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="114.19" stdev="51.64" mindiff="5.36" local_density="1.11" obsval="28.47"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="98.35" stdev="6.92" mindiff="7.58" local_density="0.04" obsval="-75.05"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="98.42" stdev="6.88" mindiff="8.24" local_density="0.02" obsval="105.10"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="59.12" stdev="17.21" mindiff="12.50" local_density="0.00" obsval="105.49"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="62.54" stdev="20.12" mindiff="15.64" local_density="0.00" obsval="-74.19"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="33.13" stdev="1.74" mindiff="1.07" local_density="0.08" obsval="-141.62"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="33.04" stdev="2.99" mindiff="0.07" local_density="0.28" obsval="38.40"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="63.70" stdev="24.34" mindiff="0.03" local_density="1.18" obsval="93.53"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="57.88" stdev="9.68" mindiff="0.54" local_density="0.42" obsval="111.88"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="48.23" stdev="27.19" mindiff="0.94" local_density="2.28" obsval="-142.61"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="40.00" stdev="22.30" mindiff="1.26" local_density="4.13" obsval="92.32"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="63.63" stdev="12.95" mindiff="0.06" local_density="0.57" obsval="104.24"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="36.62" stdev="15.78" mindiff="0.04" local_density="1.21" obsval="-140.41"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.29" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.83" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.01" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.46" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.98" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.09" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.27" Zscore="8.60" obsval="110.60"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.20" Zscore="-2.00" obsval="121.85"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.06" Zscore="2.77" obsval="119.22"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.10" Zscore="2.35" obsval="118.99"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.45" Zscore="-3.06" obsval="107.80"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.12" Zscore="2.50" obsval="112.61"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.12" Zscore="-2.45" obsval="104.41"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.29" Zscore="5.14" obsval="133.79"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.18" Zscore="-2.12" obsval="122.83"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.15" Zscore="2.37" obsval="137.44"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.64" Zscore="4.86" obsval="119.73"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.33" obsval="119.32"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.19" Zscore="2.78" obsval="118.80"/>
		<mog-angle-outlier atoms="C4,C3,C2" numobs="919" mean="123.63" stdev="2.57" mindiff="0.09" Zscore="-2.12" obsval="118.19"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.04" Zscore="2.28" obsval="126.29"/>
		<clash atom="H3A" dist="2.00" clashmag="0.44" cid="527"/>
		<clash atom="H51" dist="2.00" clashmag="0.44" cid="527"/>
		<clash atom="HHD" dist="2.00" clashmag="0.43" cid="529"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.5846" Q_score="0.361" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.38" mogul_angles_rmsz="1.77" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="1" resnum="609" said="X" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="53.69" stdev="11.45" mindiff="1.52" local_density="1.11" obsval="-124.04"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="54.75" stdev="11.24" mindiff="0.82" local_density="0.78" obsval="124.36"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="37.04" stdev="24.92" mindiff="0.68" local_density="3.86" obsval="148.00"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="77.79" stdev="6.18" mindiff="2.93" local_density="0.12" obsval="-95.69"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="78.20" stdev="6.53" mindiff="2.09" local_density="0.13" obsval="84.83"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="10552" mean="31.09" stdev="9.07" mindiff="0.06" local_density="1.64" obsval="-63.18"/>
		<mog-torsion-outlier atoms="C4C,C3C,CAC,CBC" numobs="10557" mean="35.17" stdev="10.65" mindiff="0.01" local_density="2.46" obsval="118.16"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="103.89" stdev="2.01" mindiff="36.26" local_density="0.00" obsval="-70.84"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="103.38" stdev="3.52" mindiff="5.61" local_density="0.01" obsval="108.87"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="80.47" stdev="24.77" mindiff="0.01" local_density="3.15" obsval="-82.27"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="41.72" stdev="19.36" mindiff="0.06" local_density="2.95" obsval="96.66"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="92.20" stdev="51.98" mindiff="4.03" local_density="1.14" obsval="-33.00"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="29.36" stdev="21.55" mindiff="0.06" local_density="4.55" obsval="150.39"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.36" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.92" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.21" obsval="1.35"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.07" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.19" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.17" Zscore="8.37" obsval="110.50"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.07" Zscore="-2.06" obsval="121.72"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.65" Zscore="3.78" obsval="121.93"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.09" Zscore="2.80" obsval="120.39"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.62" Zscore="-3.25" obsval="107.63"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.13" Zscore="2.41" obsval="112.51"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.11" Zscore="-2.23" obsval="104.63"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.42" Zscore="5.22" obsval="133.92"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.37" Zscore="-2.20" obsval="122.65"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.04" Zscore="2.42" obsval="137.55"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.52" Zscore="4.79" obsval="119.61"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.34" obsval="119.28"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="3.58" Zscore="2.62" obsval="118.18"/>
		<clash atom="HHC" dist="1.93" clashmag="0.50" cid="480"/>
		<clash atom="HHC" dist="2.48" clashmag="0.43" cid="483"/>
		<clash atom="HBB1" dist="1.93" clashmag="0.50" cid="480"/>
		<clash atom="HBC3" dist="2.47" clashmag="0.44" cid="482"/>
		<clash atom="CBB" dist="2.48" clashmag="0.43" cid="483"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7077" Q_score="0.448" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.91" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="1" resnum="610" said="Y" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="48.23" stdev="9.80" mindiff="1.57" local_density="0.32" obsval="-125.50"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="39.63" stdev="4.73" mindiff="0.69" local_density="0.50" obsval="134.16"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="41.11" stdev="5.16" mindiff="0.28" local_density="0.71" obsval="-47.50"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="66.31" stdev="39.14" mindiff="0.49" local_density="4.21" obsval="-67.59"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="71.52" stdev="36.59" mindiff="1.38" local_density="3.36" obsval="-58.32"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="69.99" stdev="33.99" mindiff="2.11" local_density="1.48" obsval="121.46"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="81.34" stdev="2.01" mindiff="13.70" local_density="0.00" obsval="-93.40"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="79.95" stdev="3.10" mindiff="1.99" local_density="0.01" obsval="85.40"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="47.51" stdev="16.63" mindiff="2.65" local_density="0.11" obsval="-134.86"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="56.72" stdev="45.64" mindiff="0.62" local_density="2.06" obsval="-35.73"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="66.01" stdev="14.49" mindiff="0.05" local_density="0.65" obsval="-101.10"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="54.66" stdev="17.41" mindiff="0.00" local_density="0.70" obsval="128.15"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="54.03" stdev="14.28" mindiff="1.13" local_density="0.79" obsval="-108.98"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.15" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.80" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.09" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.48" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.08" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.20" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.88" Zscore="9.93" obsval="111.21"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.24" Zscore="3.08" obsval="120.04"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.70" Zscore="3.25" obsval="124.52"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.22" Zscore="-2.80" obsval="108.03"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.11" Zscore="2.39" obsval="112.49"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.19" Zscore="-2.84" obsval="104.00"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.24" Zscore="-2.53" obsval="104.54"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.06" Zscore="2.40" obsval="112.50"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.79" Zscore="-2.14" obsval="102.91"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.52" Zscore="5.27" obsval="134.01"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.06" Zscore="-2.02" obsval="123.07"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.22" Zscore="2.34" obsval="137.37"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.06" Zscore="4.53" obsval="119.15"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.05" obsval="119.86"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.03" Zscore="3.26" obsval="120.64"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.07" Zscore="2.43" obsval="126.63"/>
		<clash atom="H102" dist="2.04" clashmag="0.40" cid="331"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6462" Q_score="0.343" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.80" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="1" resnum="611" said="Z" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="92.60" stdev="6.78" mindiff="1.82" local_density="0.12" obsval="80.81"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="91.50" stdev="6.78" mindiff="1.30" local_density="0.04" obsval="-98.16"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="102.43" stdev="39.47" mindiff="17.05" local_density="0.00" obsval="31.27"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="63.30" stdev="13.82" mindiff="24.42" local_density="0.00" obsval="-89.42"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="65.16" stdev="13.30" mindiff="28.30" local_density="0.00" obsval="91.06"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="99.78" stdev="2.01" mindiff="32.15" local_density="0.00" obsval="-74.95"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="99.01" stdev="3.45" mindiff="1.24" local_density="0.02" obsval="104.49"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="52.69" stdev="8.04" mindiff="4.21" local_density="0.07" obsval="-121.59"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="72.04" stdev="45.74" mindiff="4.84" local_density="0.29" obsval="-20.31"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="47.95" stdev="29.59" mindiff="3.18" local_density="2.66" obsval="-145.46"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="80.57" stdev="24.83" mindiff="0.04" local_density="3.16" obsval="82.15"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="85.29" stdev="27.96" mindiff="0.00" local_density="4.81" obsval="76.18"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="42.67" stdev="11.58" mindiff="0.08" local_density="0.57" obsval="-132.24"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.25" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.90" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.07" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.50" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.01" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.10" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.51" Zscore="9.12" obsval="110.84"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.05" Zscore="-2.07" obsval="121.70"/>
		<mog-angle-outlier atoms="CMB,C2B,C1B" numobs="569" mean="125.42" stdev="1.52" mindiff="0.01" Zscore="2.04" obsval="128.53"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.17" Zscore="-2.74" obsval="108.08"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.01" Zscore="2.63" obsval="112.74"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.22" Zscore="-2.54" obsval="104.31"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.47" Zscore="5.25" obsval="133.97"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.21" Zscore="-2.13" obsval="122.80"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.13" Zscore="2.38" obsval="137.47"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.40" Zscore="4.72" obsval="119.49"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.21" obsval="119.54"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.54" Zscore="3.13" obsval="120.14"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="2.18" Zscore="-3.16" obsval="121.03"/>
		<clash atom="HMB3" dist="2.48" clashmag="0.44" cid="524"/>
		<clash atom="HAB" dist="2.50" clashmag="0.41" cid="525"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8810" Q_score="0.495" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.51" mogul_angles_rmsz="2.12" ligand_chirality_outlier="yes" model="1" chain="1" resnum="612" said="AA" ent="17" seq="." icode=" " resname="C7Z" altcode=" ">
		<mog-torsion-outlier atoms="C21,C26,C27,C28" numobs="119" mean="56.39" stdev="11.74" mindiff="5.22" local_density="0.84" obsval="75.13"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="119" mean="47.16" stdev="18.39" mindiff="2.64" local_density="3.36" obsval="-91.84"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C19" numobs="316" mean="37.10" stdev="11.40" mindiff="16.73" local_density="0.00" obsval="41.20"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="37.55" stdev="11.20" mindiff="16.21" local_density="0.00" obsval="-138.24"/>
		<mog-torsion-outlier atoms="C40,C33,C34,C35" numobs="160" mean="168.04" stdev="32.00" mindiff="0.44" local_density="3.12" obsval="179.54"/>
		<mog-torsion-outlier atoms="C32,C33,C34,C35" numobs="150" mean="167.50" stdev="33.00" mindiff="0.33" local_density="3.33" obsval="-0.56"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C34" numobs="313" mean="165.79" stdev="22.47" mindiff="0.53" local_density="0.32" obsval="4.55"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C40" numobs="316" mean="165.84" stdev="22.70" mindiff="1.72" local_density="0.32" obsval="-175.55"/>
		<mog-torsion-outlier atoms="C29,C30,C31,C32" numobs="760" mean="136.76" stdev="18.92" mindiff="0.26" local_density="1.45" obsval="-34.07"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C30" numobs="313" mean="164.30" stdev="22.42" mindiff="0.96" local_density="0.32" obsval="6.04"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C39" numobs="316" mean="163.66" stdev="22.63" mindiff="3.90" local_density="0.63" obsval="-173.37"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.89" obsval="1.46"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.56" obsval="1.60"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.60" obsval="1.57"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.07" Zscore="8.44" obsval="1.67"/>
		<mog-bond-outlier atoms="C4,C5" numobs="328" mean="1.51" stdev="0.02" mindiff="0.01" Zscore="-4.19" obsval="1.44"/>
		<mog-bond-outlier atoms="C2,C3" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.49" obsval="1.37"/>
		<mog-bond-outlier atoms="C2,C1" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.71" obsval="1.65"/>
		<mog-bond-outlier atoms="C18,C5" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.36" obsval="1.54"/>
		<mog-bond-outlier atoms="C27,C26" numobs="255" mean="1.45" stdev="0.03" mindiff="0.03" Zscore="3.86" obsval="1.58"/>
		<mog-bond-outlier atoms="C21,C26" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-2.59" obsval="1.50"/>
		<mog-bond-outlier atoms="C25,C26" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.44" obsval="1.62"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.60" obsval="1.55"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.44" obsval="1.56"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.97" obsval="1.58"/>
		<mog-bond-outlier atoms="C20,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.55" obsval="1.56"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.08" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C34" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.71" obsval="1.54"/>
		<mog-bond-outlier atoms="C40,C33" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.06" obsval="1.55"/>
		<mog-bond-outlier atoms="C32,C33" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="5.09" obsval="1.56"/>
		<mog-bond-outlier atoms="C31,C30" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="4.85" obsval="1.58"/>
		<mog-bond-outlier atoms="C28,C29" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.14" obsval="1.56"/>
		<mog-bond-outlier atoms="C22,C21" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="4.01" obsval="1.66"/>
		<mog-bond-outlier atoms="C22,C23" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.98" obsval="1.36"/>
		<mog-bond-outlier atoms="C24,C23" numobs="572" mean="1.52" stdev="0.02" mindiff="0.12" Zscore="11.43" obsval="1.72"/>
		<mog-bond-outlier atoms="C24,C25" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.74" obsval="1.43"/>
		<mog-bond-outlier atoms="C38,C25" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="3.48" obsval="1.56"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="2.24" Zscore="-5.06" obsval="115.72"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="52" mean="120.76" stdev="2.05" mindiff="0.45" Zscore="-2.20" obsval="116.23"/>
		<mog-angle-outlier atoms="C18,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="1.18" Zscore="-4.15" obsval="119.95"/>
		<mog-angle-outlier atoms="C18,C5,C4" numobs="328" mean="114.42" stdev="1.84" mindiff="0.07" Zscore="2.56" obsval="119.13"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="4.08" Zscore="-4.74" obsval="119.22"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="0.47" Zscore="-3.91" obsval="121.80"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="0.68" Zscore="-3.70" obsval="122.09"/>
		<mog-angle-outlier atoms="C15,C35,C34" numobs="265" mean="123.52" stdev="2.05" mindiff="0.07" Zscore="-2.51" obsval="118.39"/>
		<mog-angle-outlier atoms="C40,C33,C34" numobs="181" mean="122.82" stdev="1.62" mindiff="0.03" Zscore="-3.38" obsval="117.34"/>
		<mog-angle-outlier atoms="C32,C33,C34" numobs="168" mean="119.01" stdev="1.57" mindiff="1.81" Zscore="4.99" obsval="126.86"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="0.72" Zscore="-2.70" obsval="123.49"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="0.29" Zscore="-2.18" obsval="123.01"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="153" mean="127.00" stdev="2.67" mindiff="3.00" Zscore="-3.18" obsval="118.50"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="2.94" Zscore="-5.76" obsval="118.20"/>
		<mog-angle-outlier atoms="C38,C25,C24" numobs="328" mean="114.42" stdev="1.84" mindiff="0.03" Zscore="2.27" obsval="118.59"/>
		<clash atom="C39" dist="2.91" clashmag="0.48" cid="481"/>
		<clash atom="C32" dist="2.91" clashmag="0.48" cid="481"/>
		<clash atom="C14" dist="2.47" clashmag="0.44" cid="482"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8537" Q_score="0.498" mogul_rmsz_numbonds="42" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.06" mogul_angles_rmsz="2.33" ligand_chirality_outlier="yes" num-H-reduce="56" model="1" chain="1" resnum="613" said="BA" ent="18" seq="." icode=" " resname="RRX" altcode=" ">
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="49.38" stdev="16.19" mindiff="1.18" local_density="0.84" obsval="-95.66"/>
		<mog-torsion-outlier atoms="C37,C22,C23,C24" numobs="316" mean="20.86" stdev="16.74" mindiff="0.62" local_density="1.58" obsval="-23.85"/>
		<mog-torsion-outlier atoms="C21,C22,C23,C24" numobs="313" mean="18.89" stdev="17.21" mindiff="4.21" local_density="4.79" obsval="158.16"/>
		<mog-torsion-outlier atoms="C20,C21,C22,C23" numobs="150" mean="165.90" stdev="33.00" mindiff="1.24" local_density="3.33" obsval="-2.16"/>
		<mog-torsion-outlier atoms="C20,C21,C22,C37" numobs="160" mean="168.29" stdev="32.00" mindiff="0.19" local_density="3.12" obsval="179.79"/>
		<mog-torsion-outlier atoms="C18,C19,C20,C21" numobs="229" mean="168.46" stdev="27.16" mindiff="0.19" local_density="2.62" obsval="-1.95"/>
		<mog-torsion-outlier atoms="C36,C18,C19,C20" numobs="316" mean="30.41" stdev="13.53" mindiff="9.58" local_density="0.32" obsval="-34.05"/>
		<mog-torsion-outlier atoms="C17,C18,C19,C20" numobs="313" mean="28.12" stdev="14.12" mindiff="14.07" local_density="0.00" obsval="148.30"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="150" mean="165.38" stdev="33.00" mindiff="0.72" local_density="3.33" obsval="-2.69"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C36" numobs="160" mean="168.11" stdev="32.00" mindiff="0.37" local_density="3.12" obsval="179.61"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="760" mean="41.57" stdev="8.80" mindiff="7.98" local_density="0.13" obsval="132.98"/>
		<mog-torsion-outlier atoms="C13,C14,C15,C16" numobs="760" mean="21.83" stdev="13.71" mindiff="0.63" local_density="2.76" obsval="153.85"/>
		<mog-torsion-outlier atoms="C35,C13,C14,C15" numobs="160" mean="166.99" stdev="32.00" mindiff="0.87" local_density="3.12" obsval="178.50"/>
		<mog-torsion-outlier atoms="C12,C13,C14,C15" numobs="150" mean="165.96" stdev="33.00" mindiff="1.21" local_density="3.33" obsval="-2.11"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="170.38" stdev="27.16" mindiff="0.97" local_density="2.62" obsval="-0.04"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="30.36" stdev="11.55" mindiff="0.07" local_density="1.58" obsval="-144.75"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="34.14" stdev="12.22" mindiff="19.86" local_density="0.00" obsval="141.88"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C34" numobs="316" mean="34.60" stdev="12.18" mindiff="14.06" local_density="0.00" obsval="-38.53"/>
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="63.61" stdev="12.45" mindiff="17.32" local_density="0.00" obsval="-63.03"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="63.73" stdev="13.51" mindiff="24.82" local_density="0.00" obsval="119.71"/>
		<mog-bond-outlier atoms="C2,C1" numobs="507" mean="1.54" stdev="0.02" mindiff="0.00" Zscore="5.12" obsval="1.65"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.04" Zscore="-6.25" obsval="1.45"/>
		<mog-bond-outlier atoms="C32,C1" numobs="4607" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="2.91" obsval="1.59"/>
		<mog-bond-outlier atoms="C2,C3" numobs="10925" mean="1.52" stdev="0.02" mindiff="0.00" Zscore="-6.80" obsval="1.36"/>
		<mog-bond-outlier atoms="C3,C4" numobs="10557" mean="1.52" stdev="0.03" mindiff="0.00" Zscore="4.32" obsval="1.66"/>
		<mog-bond-outlier atoms="C29,C30" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="3.88" obsval="1.66"/>
		<mog-bond-outlier atoms="C30,C25" numobs="158" mean="1.53" stdev="0.01" mindiff="0.02" Zscore="-5.20" obsval="1.47"/>
		<mog-bond-outlier atoms="C29,C28" numobs="383" mean="1.52" stdev="0.01" mindiff="0.08" Zscore="-9.28" obsval="1.39"/>
		<mog-bond-outlier atoms="C27,C28" numobs="572" mean="1.52" stdev="0.02" mindiff="0.06" Zscore="8.14" obsval="1.66"/>
		<mog-bond-outlier atoms="C27,C26" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.58" obsval="1.43"/>
		<mog-bond-outlier atoms="C26,C25" numobs="104" mean="1.34" stdev="0.02" mindiff="0.19" Zscore="15.29" obsval="1.60"/>
		<mog-bond-outlier atoms="C24,C25" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.61" obsval="1.57"/>
		<mog-bond-outlier atoms="C23,C22" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.79" obsval="1.56"/>
		<mog-bond-outlier atoms="C20,C21" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.50" obsval="1.57"/>
		<mog-bond-outlier atoms="C19,C18" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.56" obsval="1.57"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="3.64" obsval="1.54"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.08" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.52" obsval="1.55"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="5.09" obsval="1.56"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.92" obsval="1.55"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.25" obsval="1.57"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.01" Zscore="3.36" obsval="1.56"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.56" obsval="1.60"/>
		<mog-bond-outlier atoms="C4,C5" numobs="379" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-2.93" obsval="1.45"/>
		<mog-angle-outlier atoms="C30,C29,C28" numobs="30" mean="113.59" stdev="2.19" mindiff="2.54" Zscore="2.88" obsval="119.92"/>
		<mog-angle-outlier atoms="C38,C26,C27" numobs="328" mean="114.42" stdev="1.84" mindiff="0.05" Zscore="2.48" obsval="118.98"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="52" mean="120.76" stdev="2.05" mindiff="2.25" Zscore="-3.52" obsval="113.53"/>
		<mog-angle-outlier atoms="C38,C26,C25" numobs="104" mean="124.48" stdev="1.09" mindiff="1.64" Zscore="-4.57" obsval="119.50"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="5.11" Zscore="-7.16" obsval="112.85"/>
		<mog-angle-outlier atoms="C24,C25,C26" numobs="97" mean="121.56" stdev="2.30" mindiff="0.94" Zscore="-2.54" obsval="115.70"/>
		<mog-angle-outlier atoms="C37,C22,C23" numobs="317" mean="118.09" stdev="1.53" mindiff="0.07" Zscore="2.13" obsval="121.34"/>
		<mog-angle-outlier atoms="C37,C22,C21" numobs="181" mean="122.82" stdev="1.62" mindiff="0.15" Zscore="-2.62" obsval="118.58"/>
		<mog-angle-outlier atoms="C20,C21,C22" numobs="147" mean="127.28" stdev="1.40" mindiff="0.13" Zscore="-4.33" obsval="121.20"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.02" Zscore="-2.99" obsval="117.98"/>
		<mog-angle-outlier atoms="C16,C17,C18" numobs="147" mean="127.28" stdev="1.40" mindiff="0.21" Zscore="-3.06" obsval="122.98"/>
		<mog-angle-outlier atoms="C35,C13,C14" numobs="181" mean="122.82" stdev="1.62" mindiff="2.14" Zscore="-4.91" obsval="114.86"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.08" Zscore="2.06" obsval="122.26"/>
		<mog-angle-outlier atoms="C35,C13,C12" numobs="317" mean="118.09" stdev="1.53" mindiff="0.68" Zscore="3.14" obsval="122.89"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="0.59" Zscore="-3.63" obsval="122.18"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="3.31" Zscore="-4.22" obsval="119.99"/>
		<mog-angle-outlier atoms="C1,C6,C7" numobs="118" mean="115.65" stdev="2.71" mindiff="0.02" Zscore="2.33" obsval="121.98"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.21" Zscore="-3.26" obsval="118.17"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="1.82" Zscore="-4.73" obsval="119.32"/>
		<clash atom="H45" dist="1.87" clashmag="0.56" cid="391"/>
		<clash atom="H45" dist="2.49" clashmag="0.43" cid="399"/>
		<clash atom="H38" dist="1.89" clashmag="0.54" cid="392"/>
		<clash atom="H36" dist="2.37" clashmag="0.53" cid="393"/>
		<clash atom="H36" dist="1.92" clashmag="0.51" cid="396"/>
		<clash atom="C10" dist="2.37" clashmag="0.53" cid="393"/>
		<clash atom="H54" dist="2.43" clashmag="0.53" cid="394"/>
		<clash atom="H42" dist="1.92" clashmag="0.51" cid="396"/>
		<clash atom="H42" dist="2.56" clashmag="0.41" cid="400"/>
		<clash atom="H29" dist="1.96" clashmag="0.46" cid="397"/>
		<clash atom="H25" dist="1.96" clashmag="0.46" cid="397"/>
		<clash atom="H44" dist="2.47" clashmag="0.44" cid="398"/>
		<chiral-outlier problem="WRONG HAND" atom="C28"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8095" Q_score="0.512" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.50" mogul_angles_rmsz="2.36" ligand_chirality_outlier="yes" model="1" chain="1" resnum="614" said="CA" ent="17" seq="." icode=" " resname="C7Z" altcode=" ">
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="45.54" stdev="20.13" mindiff="4.09" local_density="3.36" obsval="89.04"/>
		<mog-torsion-outlier atoms="C21,C26,C27,C28" numobs="119" mean="47.36" stdev="19.43" mindiff="7.53" local_density="0.84" obsval="-90.43"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="119" mean="58.97" stdev="11.24" mindiff="17.26" local_density="0.00" obsval="111.73"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C19" numobs="316" mean="110.44" stdev="14.98" mindiff="11.15" local_density="0.00" obsval="-118.83"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="110.61" stdev="15.05" mindiff="9.70" local_density="0.64" obsval="60.99"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="158.64" stdev="19.31" mindiff="10.07" local_density="0.00" obsval="-12.13"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C20" numobs="316" mean="157.91" stdev="22.37" mindiff="3.80" local_density="0.63" obsval="167.58"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="157.61" stdev="22.12" mindiff="3.78" local_density="0.64" obsval="-12.78"/>
		<mog-torsion-outlier atoms="C13,C14,C15,C35" numobs="760" mean="20.34" stdev="14.11" mindiff="0.95" local_density="3.55" obsval="-155.46"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C34" numobs="313" mean="164.26" stdev="22.42" mindiff="1.01" local_density="0.32" obsval="-6.08"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C40" numobs="316" mean="164.17" stdev="22.65" mindiff="3.39" local_density="0.32" obsval="173.88"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C30" numobs="313" mean="34.42" stdev="12.13" mindiff="19.55" local_density="0.00" obsval="141.57"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C39" numobs="316" mean="33.98" stdev="12.38" mindiff="13.39" local_density="0.00" obsval="-37.86"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.76" obsval="1.46"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.80" obsval="1.61"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.40" obsval="1.56"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.06" Zscore="8.16" obsval="1.66"/>
		<mog-bond-outlier atoms="C4,C5" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.25" obsval="1.44"/>
		<mog-bond-outlier atoms="C2,C3" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.88" obsval="1.36"/>
		<mog-bond-outlier atoms="C2,C1" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.60" obsval="1.65"/>
		<mog-bond-outlier atoms="C18,C5" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.48" obsval="1.54"/>
		<mog-bond-outlier atoms="C27,C26" numobs="255" mean="1.45" stdev="0.03" mindiff="0.03" Zscore="3.79" obsval="1.58"/>
		<mog-bond-outlier atoms="C21,C26" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-3.07" obsval="1.49"/>
		<mog-bond-outlier atoms="C25,C26" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.42" obsval="1.62"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.27" obsval="1.55"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.43" obsval="1.56"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.70" obsval="1.58"/>
		<mog-bond-outlier atoms="C20,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.51" obsval="1.55"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.91" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C34" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.75" obsval="1.54"/>
		<mog-bond-outlier atoms="C40,C33" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.19" obsval="1.55"/>
		<mog-bond-outlier atoms="C32,C33" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.89" obsval="1.56"/>
		<mog-bond-outlier atoms="C31,C30" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.54" obsval="1.57"/>
		<mog-bond-outlier atoms="C28,C29" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.14" obsval="1.56"/>
		<mog-bond-outlier atoms="C22,C21" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="3.97" obsval="1.66"/>
		<mog-bond-outlier atoms="C22,C23" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.77" obsval="1.37"/>
		<mog-bond-outlier atoms="C24,C23" numobs="572" mean="1.52" stdev="0.02" mindiff="0.13" Zscore="11.64" obsval="1.72"/>
		<mog-bond-outlier atoms="C24,C25" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.61" obsval="1.43"/>
		<mog-bond-outlier atoms="C38,C25" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="3.49" obsval="1.56"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.02" Zscore="-2.00" obsval="119.90"/>
		<mog-angle-outlier atoms="C18,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="2.47" Zscore="-5.33" obsval="118.66"/>
		<mog-angle-outlier atoms="C18,C5,C4" numobs="328" mean="114.42" stdev="1.84" mindiff="0.03" Zscore="2.27" obsval="118.59"/>
		<mog-angle-outlier atoms="C21,C26,C25" numobs="97" mean="122.64" stdev="1.37" mindiff="0.67" Zscore="-3.91" obsval="117.29"/>
		<mog-angle-outlier atoms="C8,C7,C6" numobs="153" mean="127.00" stdev="2.67" mindiff="0.73" Zscore="-2.34" obsval="120.76"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="5.51" Zscore="-5.71" obsval="117.80"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="0.04" Zscore="-2.19" obsval="120.36"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="1.09" Zscore="-5.59" obsval="119.44"/>
		<mog-angle-outlier atoms="C35,C34,C33" numobs="147" mean="127.28" stdev="1.40" mindiff="1.92" Zscore="-6.18" obsval="118.61"/>
		<mog-angle-outlier atoms="C40,C33,C34" numobs="181" mean="122.82" stdev="1.62" mindiff="0.01" Zscore="-2.00" obsval="119.57"/>
		<mog-angle-outlier atoms="C31,C32,C33" numobs="117" mean="126.36" stdev="2.74" mindiff="0.07" Zscore="-2.20" obsval="120.33"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="2.20" Zscore="-6.38" obsval="118.33"/>
		<mog-angle-outlier atoms="C39,C29,C30" numobs="181" mean="122.82" stdev="1.62" mindiff="0.15" Zscore="-2.31" obsval="119.08"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="4.26" Zscore="-4.86" obsval="119.04"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="153" mean="127.00" stdev="2.67" mindiff="0.98" Zscore="-2.43" obsval="120.51"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="1.62" Zscore="-4.55" obsval="119.52"/>
		<mog-angle-outlier atoms="C38,C25,C24" numobs="328" mean="114.42" stdev="1.84" mindiff="0.04" Zscore="2.53" obsval="119.06"/>
		<clash atom="C15" dist="2.27" clashmag="0.64" cid="327"/>
		<clash atom="C12" dist="2.94" clashmag="0.45" cid="330"/>
		<clash atom="C19" dist="2.94" clashmag="0.45" cid="330"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6190" Q_score="0.352" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.47" mogul_angles_rmsz="2.49" ligand_chirality_outlier="yes" model="1" chain="1" resnum="615" said="DA" ent="17" seq="." icode=" " resname="C7Z" altcode=" ">
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="54.59" stdev="12.13" mindiff="9.91" local_density="0.84" obsval="104.39"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C19" numobs="316" mean="26.74" stdev="14.74" mindiff="5.67" local_density="0.32" obsval="30.13"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="26.84" stdev="14.54" mindiff="12.70" local_density="0.00" obsval="-149.68"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="167.80" stdev="33.00" mindiff="0.03" local_density="3.33" obsval="-0.26"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C19" numobs="160" mean="168.43" stdev="32.00" mindiff="0.05" local_density="3.12" obsval="179.93"/>
		<mog-torsion-outlier atoms="C33,C34,C35,C15" numobs="760" mean="160.43" stdev="19.35" mindiff="8.29" local_density="0.13" obsval="-10.34"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C34" numobs="313" mean="163.15" stdev="22.36" mindiff="2.12" local_density="0.64" obsval="7.20"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C40" numobs="316" mean="163.32" stdev="22.61" mindiff="4.25" local_density="0.63" obsval="-173.03"/>
		<mog-torsion-outlier atoms="C29,C30,C31,C32" numobs="760" mean="79.31" stdev="7.89" mindiff="0.88" local_density="0.39" obsval="93.46"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C30" numobs="313" mean="88.71" stdev="8.78" mindiff="26.71" local_density="0.00" obsval="-84.07"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C39" numobs="316" mean="88.30" stdev="8.90" mindiff="23.63" local_density="0.00" obsval="95.51"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-6.02" obsval="1.46"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.19" Zscore="15.37" obsval="1.60"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.40" obsval="1.56"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.07" Zscore="8.44" obsval="1.67"/>
		<mog-bond-outlier atoms="C4,C5" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.27" obsval="1.44"/>
		<mog-bond-outlier atoms="C2,C3" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.49" obsval="1.37"/>
		<mog-bond-outlier atoms="C2,C1" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.70" obsval="1.65"/>
		<mog-bond-outlier atoms="C18,C5" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.47" obsval="1.54"/>
		<mog-bond-outlier atoms="C27,C26" numobs="255" mean="1.45" stdev="0.03" mindiff="0.03" Zscore="3.73" obsval="1.57"/>
		<mog-bond-outlier atoms="C21,C26" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-3.09" obsval="1.49"/>
		<mog-bond-outlier atoms="C25,C26" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.37" obsval="1.62"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.28" obsval="1.55"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.26" obsval="1.56"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.79" obsval="1.58"/>
		<mog-bond-outlier atoms="C20,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.55" obsval="1.56"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.88" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C34" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.83" obsval="1.55"/>
		<mog-bond-outlier atoms="C40,C33" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.29" obsval="1.55"/>
		<mog-bond-outlier atoms="C32,C33" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.79" obsval="1.56"/>
		<mog-bond-outlier atoms="C31,C30" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.45" obsval="1.57"/>
		<mog-bond-outlier atoms="C28,C29" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="5.06" obsval="1.56"/>
		<mog-bond-outlier atoms="C22,C21" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="3.94" obsval="1.66"/>
		<mog-bond-outlier atoms="C22,C23" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.80" obsval="1.37"/>
		<mog-bond-outlier atoms="C24,C23" numobs="572" mean="1.52" stdev="0.02" mindiff="0.13" Zscore="11.68" obsval="1.72"/>
		<mog-bond-outlier atoms="C24,C25" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.56" obsval="1.43"/>
		<mog-bond-outlier atoms="C38,C25" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="3.56" obsval="1.56"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="2.65" Zscore="-5.36" obsval="115.32"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="97" mean="121.56" stdev="2.30" mindiff="1.53" Zscore="-2.80" obsval="115.11"/>
		<mog-angle-outlier atoms="C18,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="1.66" Zscore="-4.59" obsval="119.48"/>
		<mog-angle-outlier atoms="C18,C5,C4" numobs="328" mean="114.42" stdev="1.84" mindiff="0.12" Zscore="3.33" obsval="120.54"/>
		<mog-angle-outlier atoms="C21,C26,C25" numobs="97" mean="122.64" stdev="1.37" mindiff="0.12" Zscore="-3.34" obsval="118.08"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="8.32" Zscore="-7.61" obsval="114.98"/>
		<mog-angle-outlier atoms="C8,C9,C10" numobs="168" mean="119.01" stdev="1.57" mindiff="0.47" Zscore="3.38" obsval="124.32"/>
		<mog-angle-outlier atoms="C19,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.26" Zscore="-2.71" obsval="118.43"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="0.22" Zscore="-3.06" obsval="114.34"/>
		<mog-angle-outlier atoms="C20,C13,C12" numobs="317" mean="118.09" stdev="1.53" mindiff="0.26" Zscore="2.34" obsval="121.67"/>
		<mog-angle-outlier atoms="C35,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="2.08" Zscore="-3.93" obsval="115.47"/>
		<mog-angle-outlier atoms="C31,C32,C33" numobs="117" mean="126.36" stdev="2.74" mindiff="4.39" Zscore="-3.78" obsval="116.01"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="2.21" Zscore="-6.39" obsval="118.32"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="5.20" Zscore="-5.50" obsval="118.10"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="153" mean="127.00" stdev="2.67" mindiff="1.14" Zscore="-2.49" obsval="120.35"/>
		<mog-angle-outlier atoms="C24,C25,C26" numobs="52" mean="120.76" stdev="2.05" mindiff="0.84" Zscore="-2.01" obsval="116.62"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="2.14" Zscore="-5.02" obsval="119.00"/>
		<mog-angle-outlier atoms="C38,C25,C24" numobs="328" mean="114.42" stdev="1.84" mindiff="0.00" Zscore="2.50" obsval="119.03"/>
		<clash atom="C10" dist="2.51" clashmag="0.41" cid="344"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7857" Q_score="0.478" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.48" mogul_angles_rmsz="2.82" ligand_chirality_outlier="yes" model="1" chain="1" resnum="616" said="EA" ent="17" seq="." icode=" " resname="C7Z" altcode=" ">
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="119" mean="61.12" stdev="47.94" mindiff="9.34" local_density="0.84" obsval="-14.47"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C19" numobs="316" mean="58.06" stdev="6.70" mindiff="3.08" local_density="0.63" obsval="-63.57"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="57.84" stdev="6.73" mindiff="5.41" local_density="0.64" obsval="116.61"/>
		<mog-torsion-outlier atoms="C40,C33,C34,C35" numobs="160" mean="168.00" stdev="32.00" mindiff="0.48" local_density="3.12" obsval="179.50"/>
		<mog-torsion-outlier atoms="C32,C33,C34,C35" numobs="150" mean="167.92" stdev="33.00" mindiff="0.09" local_density="3.33" obsval="-0.14"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C30" numobs="313" mean="23.57" stdev="15.62" mindiff="9.21" local_density="0.96" obsval="153.16"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C39" numobs="316" mean="22.77" stdev="16.09" mindiff="1.43" local_density="0.63" obsval="-25.90"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.90" obsval="1.46"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.59" obsval="1.60"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.53" obsval="1.57"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.07" Zscore="8.48" obsval="1.67"/>
		<mog-bond-outlier atoms="C4,C5" numobs="328" mean="1.51" stdev="0.02" mindiff="0.01" Zscore="-4.17" obsval="1.44"/>
		<mog-bond-outlier atoms="C2,C3" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.50" obsval="1.37"/>
		<mog-bond-outlier atoms="C2,C1" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.66" obsval="1.65"/>
		<mog-bond-outlier atoms="C18,C5" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.50" obsval="1.54"/>
		<mog-bond-outlier atoms="C27,C26" numobs="255" mean="1.45" stdev="0.03" mindiff="0.03" Zscore="3.79" obsval="1.58"/>
		<mog-bond-outlier atoms="C21,C26" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-3.20" obsval="1.49"/>
		<mog-bond-outlier atoms="C25,C26" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.20" obsval="1.61"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.46" obsval="1.55"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.30" obsval="1.56"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.79" obsval="1.58"/>
		<mog-bond-outlier atoms="C20,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.52" obsval="1.55"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.97" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C34" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="3.62" obsval="1.54"/>
		<mog-bond-outlier atoms="C40,C33" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.14" obsval="1.55"/>
		<mog-bond-outlier atoms="C32,C33" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.91" obsval="1.56"/>
		<mog-bond-outlier atoms="C31,C30" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.51" obsval="1.57"/>
		<mog-bond-outlier atoms="C28,C29" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.14" obsval="1.56"/>
		<mog-bond-outlier atoms="C22,C21" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="3.98" obsval="1.66"/>
		<mog-bond-outlier atoms="C22,C23" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.60" obsval="1.37"/>
		<mog-bond-outlier atoms="C24,C23" numobs="572" mean="1.52" stdev="0.02" mindiff="0.13" Zscore="11.80" obsval="1.73"/>
		<mog-bond-outlier atoms="C24,C25" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.65" obsval="1.43"/>
		<mog-bond-outlier atoms="C38,C25" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="3.49" obsval="1.56"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.98" Zscore="-4.14" obsval="116.98"/>
		<mog-angle-outlier atoms="C18,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="1.28" Zscore="-4.24" obsval="119.86"/>
		<mog-angle-outlier atoms="C18,C5,C4" numobs="328" mean="114.42" stdev="1.84" mindiff="0.17" Zscore="2.79" obsval="119.56"/>
		<mog-angle-outlier atoms="C21,C26,C25" numobs="97" mean="122.64" stdev="1.37" mindiff="0.88" Zscore="-4.07" obsval="117.08"/>
		<mog-angle-outlier atoms="C8,C7,C6" numobs="153" mean="127.00" stdev="2.67" mindiff="2.56" Zscore="-3.02" obsval="118.93"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="1.06" Zscore="-2.70" obsval="122.24"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="1.79" Zscore="-6.09" obsval="118.74"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="3.66" Zscore="-3.51" obsval="116.74"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.04" Zscore="2.93" obsval="123.62"/>
		<mog-angle-outlier atoms="C20,C13,C14" numobs="181" mean="122.82" stdev="1.62" mindiff="0.19" Zscore="-2.75" obsval="118.36"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="5.64" Zscore="-8.83" obsval="114.89"/>
		<mog-angle-outlier atoms="C35,C34,C33" numobs="147" mean="127.28" stdev="1.40" mindiff="3.16" Zscore="-7.06" obsval="117.38"/>
		<mog-angle-outlier atoms="C31,C32,C33" numobs="117" mean="126.36" stdev="2.74" mindiff="3.48" Zscore="-3.44" obsval="116.92"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="3.79" Zscore="-7.51" obsval="116.74"/>
		<mog-angle-outlier atoms="C39,C29,C30" numobs="181" mean="122.82" stdev="1.62" mindiff="0.09" Zscore="-2.27" obsval="119.14"/>
		<mog-angle-outlier atoms="C28,C29,C30" numobs="168" mean="119.01" stdev="1.57" mindiff="0.15" Zscore="2.03" obsval="122.19"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="6.87" Zscore="-6.63" obsval="116.43"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="1.01" Zscore="-3.99" obsval="120.13"/>
		<mog-angle-outlier atoms="C38,C25,C24" numobs="328" mean="114.42" stdev="1.84" mindiff="0.29" Zscore="3.10" obsval="120.12"/>
		<clash atom="C40" dist="2.48" clashmag="0.44" cid="524"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7143" Q_score="0.417" mogul_rmsz_numbonds="48" mogul_rmsz_numangles="51" mogul_bonds_rmsz="0.42" mogul_angles_rmsz="0.96" num-H-reduce="74" model="1" chain="1" resnum="617" said="FA" ent="19" seq="." icode=" " resname="LHG" altcode=" ">
		<mog-torsion-outlier atoms="O1,C1,C2,O2" numobs="272" mean="75.30" stdev="43.55" mindiff="2.98" local_density="0.74" obsval="-7.61"/>
		<mog-torsion-outlier atoms="O1,C1,C2,C3" numobs="154" mean="55.49" stdev="13.71" mindiff="30.57" local_density="0.00" obsval="-128.00"/>
		<mog-torsion-outlier atoms="C1,C2,C3,O3" numobs="374" mean="65.70" stdev="23.86" mindiff="10.09" local_density="0.00" obsval="141.17"/>
		<mog-torsion-outlier atoms="O2,C2,C3,O3" numobs="654" mean="77.22" stdev="50.66" mindiff="17.44" local_density="0.00" obsval="20.28"/>
		<mog-torsion-outlier atoms="C2,C3,O3,P" numobs="474" mean="72.06" stdev="18.97" mindiff="0.42" local_density="1.48" obsval="84.01"/>
		<mog-torsion-outlier atoms="C3,O3,P,O4" numobs="40" mean="100.60" stdev="54.48" mindiff="30.17" local_density="0.00" obsval="0.65"/>
		<mog-torsion-outlier atoms="C3,O3,P,O5" numobs="40" mean="63.38" stdev="25.67" mindiff="14.47" local_density="0.00" obsval="132.56"/>
		<mog-torsion-outlier atoms="C3,O3,P,O6" numobs="40" mean="51.44" stdev="14.71" mindiff="23.28" local_density="0.00" obsval="-114.13"/>
		<mog-torsion-outlier atoms="O6,C4,C5,C6" numobs="265" mean="58.33" stdev="16.33" mindiff="2.45" local_density="1.13" obsval="120.22"/>
		<mog-torsion-outlier atoms="O6,C4,C5,O7" numobs="299" mean="52.15" stdev="13.38" mindiff="0.40" local_density="1.67" obsval="-120.26"/>
		<mog-torsion-outlier atoms="C4,C5,C6,O8" numobs="248" mean="47.24" stdev="24.43" mindiff="3.39" local_density="3.23" obsval="91.09"/>
		<mog-torsion-outlier atoms="O7,C5,C6,O8" numobs="291" mean="68.93" stdev="48.92" mindiff="2.43" local_density="1.72" obsval="-29.22"/>
		<mog-torsion-outlier atoms="O9,C7,O7,C5" numobs="1497" mean="67.05" stdev="5.82" mindiff="2.38" local_density="0.07" obsval="-73.88"/>
		<mog-torsion-outlier atoms="C8,C7,O7,C5" numobs="1189" mean="67.11" stdev="5.38" mindiff="19.45" local_density="0.00" obsval="105.98"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="4310" mean="41.29" stdev="22.47" mindiff="0.05" local_density="0.77" obsval="144.70"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="15585" mean="74.08" stdev="22.20" mindiff="0.02" local_density="1.51" obsval="-90.18"/>
		<mog-torsion-outlier atoms="O10,C23,O8,C6" numobs="4533" mean="58.02" stdev="5.87" mindiff="0.16" local_density="0.26" obsval="64.57"/>
		<mog-torsion-outlier atoms="C24,C23,O8,C6" numobs="2608" mean="60.70" stdev="5.40" mindiff="1.02" local_density="0.15" obsval="-112.88"/>
		<mog-torsion-outlier atoms="O8,C23,C24,C25" numobs="3091" mean="52.56" stdev="20.31" mindiff="0.15" local_density="4.46" obsval="106.21"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="4310" mean="67.18" stdev="27.10" mindiff="0.28" local_density="1.83" obsval="90.38"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="15585" mean="31.29" stdev="23.18" mindiff="0.03" local_density="3.17" obsval="151.40"/>
		<mog-torsion-outlier atoms="C13,C14,C15,C16" numobs="15585" mean="43.22" stdev="12.91" mindiff="0.06" local_density="1.21" obsval="-133.74"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="15585" mean="29.76" stdev="24.68" mindiff="0.02" local_density="3.84" obsval="-153.70"/>
		<mog-torsion-outlier atoms="C18,C19,C20,C21" numobs="15585" mean="74.87" stdev="22.84" mindiff="0.03" local_density="1.67" obsval="-89.09"/>
		<mog-torsion-outlier atoms="C19,C20,C21,C22" numobs="12796" mean="37.66" stdev="22.11" mindiff="0.02" local_density="2.79" obsval="143.98"/>
		<mog-torsion-outlier atoms="C26,C27,C28,C29" numobs="15585" mean="33.54" stdev="21.04" mindiff="0.04" local_density="2.32" obsval="-148.01"/>
		<mog-torsion-outlier atoms="C28,C29,C30,C31" numobs="15585" mean="51.56" stdev="9.13" mindiff="0.08" local_density="0.86" obsval="-121.75"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C34" numobs="15585" mean="112.08" stdev="37.62" mindiff="0.11" local_density="1.53" obsval="-45.47"/>
		<mog-torsion-outlier atoms="C35,C36,C37,C38" numobs="12796" mean="41.38" stdev="18.34" mindiff="0.00" local_density="2.16" obsval="-137.70"/>
		<mog-angle-outlier atoms="C5,O7,C7" numobs="319" mean="117.80" stdev="2.39" mindiff="0.06" Zscore="-2.48" obsval="111.85"/>
		<mog-angle-outlier atoms="O7,C7,C8" numobs="587" mean="111.48" stdev="2.16" mindiff="0.34" Zscore="4.04" obsval="120.22"/>
		<mog-angle-outlier atoms="O8,C23,C24" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.04" Zscore="2.11" obsval="118.26"/>
		<clash atom="H222" dist="2.01" clashmag="0.42" cid="550"/>
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		<mog-torsion-outlier atoms="C16,C17,C20,C21" numobs="172" mean="113.93" stdev="17.17" mindiff="1.56" local_density="1.74" obsval="-57.85"/>
		<mog-torsion-outlier atoms="C17,C20,C22,C23" numobs="325" mean="39.34" stdev="13.25" mindiff="2.10" local_density="0.92" obsval="159.63"/>
		<mog-torsion-outlier atoms="C20,C22,C23,C24" numobs="190" mean="168.87" stdev="29.89" mindiff="1.08" local_density="3.16" obsval="0.13"/>
		<mog-bond-outlier atoms="C1,C2" numobs="11083" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="4.31" obsval="1.62"/>
		<mog-bond-outlier atoms="C1,C10" numobs="4870" mean="1.54" stdev="0.02" mindiff="0.27" Zscore="-25.48" obsval="1.07"/>
		<mog-bond-outlier atoms="C2,C3" numobs="2267" mean="1.51" stdev="0.02" mindiff="0.06" Zscore="-12.17" obsval="1.23"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.15" Zscore="-13.98" obsval="1.27"/>
		<mog-bond-outlier atoms="O1,C3" numobs="5081" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="9.36" obsval="1.70"/>
		<mog-bond-outlier atoms="C4,C5" numobs="1331" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="2.28" obsval="1.56"/>
		<mog-bond-outlier atoms="C6,C5" numobs="25" mean="1.34" stdev="0.02" mindiff="0.12" Zscore="8.35" obsval="1.54"/>
		<mog-bond-outlier atoms="C10,C5" numobs="1722" mean="1.52" stdev="0.02" mindiff="0.10" Zscore="-16.08" obsval="1.22"/>
		<mog-bond-outlier atoms="C7,C6" numobs="1692" mean="1.41" stdev="0.03" mindiff="0.00" Zscore="-5.26" obsval="1.27"/>
		<mog-bond-outlier atoms="C7,C8" numobs="20" mean="1.34" stdev="0.02" mindiff="0.03" Zscore="-2.45" obsval="1.28"/>
		<mog-bond-outlier atoms="C9,C8" numobs="262" mean="1.51" stdev="0.02" mindiff="0.02" Zscore="2.76" obsval="1.58"/>
		<mog-bond-outlier atoms="C10,C9" numobs="103" mean="1.55" stdev="0.01" mindiff="0.24" Zscore="-22.58" obsval="1.27"/>
		<mog-bond-outlier atoms="C11,C9" numobs="1575" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="3.08" obsval="1.59"/>
		<mog-bond-outlier atoms="C12,C11" numobs="11083" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="-4.12" obsval="1.45"/>
		<mog-bond-outlier atoms="C12,C13" numobs="8370" mean="1.54" stdev="0.02" mindiff="0.01" Zscore="10.39" obsval="1.72"/>
		<mog-bond-outlier atoms="C13,C14" numobs="508" mean="1.56" stdev="0.02" mindiff="0.03" Zscore="-5.35" obsval="1.47"/>
		<mog-bond-outlier atoms="C13,C17" numobs="4414" mean="1.55" stdev="0.02" mindiff="0.00" Zscore="4.99" obsval="1.64"/>
		<mog-bond-outlier atoms="C16,C15" numobs="9498" mean="1.54" stdev="0.03" mindiff="0.00" Zscore="4.29" obsval="1.65"/>
		<mog-bond-outlier atoms="C16,C17" numobs="9405" mean="1.54" stdev="0.02" mindiff="0.00" Zscore="-5.83" obsval="1.42"/>
		<mog-angle-outlier atoms="C2,C3,C4" numobs="475" mean="110.29" stdev="1.41" mindiff="0.26" Zscore="3.01" obsval="114.52"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="21" mean="122.95" stdev="2.06" mindiff="0.86" Zscore="-2.02" obsval="118.79"/>
		<mog-angle-outlier atoms="C14,C8,C9" numobs="69" mean="114.46" stdev="1.59" mindiff="2.76" Zscore="-5.30" obsval="106.02"/>
		<mog-angle-outlier atoms="C1,C10,C9" numobs="32" mean="108.39" stdev="1.94" mindiff="0.02" Zscore="2.17" obsval="112.60"/>
		<mog-angle-outlier atoms="C19,C10,C1" numobs="3767" mean="109.43" stdev="1.52" mindiff="0.00" Zscore="-2.74" obsval="105.26"/>
		<mog-angle-outlier atoms="C12,C11,C9" numobs="628" mean="112.64" stdev="2.41" mindiff="0.03" Zscore="2.30" obsval="118.20"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="5918" mean="112.74" stdev="1.69" mindiff="0.00" Zscore="2.80" obsval="117.46"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="158" mean="107.19" stdev="1.51" mindiff="3.95" Zscore="6.22" obsval="116.58"/>
		<mog-angle-outlier atoms="C12,C13,C17" numobs="1505" mean="116.60" stdev="1.47" mindiff="4.01" Zscore="11.79" obsval="133.97"/>
		<mog-angle-outlier atoms="C18,C13,C12" numobs="2986" mean="110.61" stdev="1.47" mindiff="2.62" Zscore="-19.48" obsval="81.89"/>
		<mog-angle-outlier atoms="C14,C13,C17" numobs="391" mean="99.72" stdev="1.05" mindiff="5.41" Zscore="8.89" obsval="109.01"/>
		<mog-angle-outlier atoms="C18,C13,C14" numobs="508" mean="110.35" stdev="1.66" mindiff="2.09" Zscore="-6.99" obsval="98.75"/>
		<mog-angle-outlier atoms="C18,C13,C17" numobs="4412" mean="111.68" stdev="1.81" mindiff="0.24" Zscore="-14.46" obsval="85.46"/>
		<mog-angle-outlier atoms="C15,C14,C8" numobs="63" mean="120.42" stdev="1.36" mindiff="7.10" Zscore="-8.86" obsval="108.40"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="445" mean="104.21" stdev="0.90" mindiff="0.10" Zscore="2.93" obsval="106.83"/>
		<mog-angle-outlier atoms="C16,C17,C13" numobs="3729" mean="103.84" stdev="1.18" mindiff="0.01" Zscore="2.78" obsval="107.11"/>
		<mog-angle-outlier atoms="C13,C17,C20" numobs="129" mean="119.38" stdev="1.20" mindiff="5.48" Zscore="-7.76" obsval="110.08"/>
		<clash atom="C3" dist="1.70" clashmag="1.36" cid="9"/>
		<clash atom="C3" dist="2.13" clashmag="0.53" cid="12"/>
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		<clash atom="O1" dist="2.42" clashmag="0.60" cid="11"/>
		<clash atom="C2" dist="2.39" clashmag="0.67" cid="10"/>
		<clash atom="C4" dist="2.42" clashmag="0.60" cid="11"/>
		<clash atom="HO1" dist="2.13" clashmag="0.53" cid="12"/>
		<chiral-outlier problem="WRONG HAND" atom="C24"/>
		<chiral-outlier problem="WRONG HAND" atom="C14"/>
		<chiral-outlier problem="WRONG HAND" atom="C10"/>
		<chiral-outlier problem="PLANAR" atom="C13"/>
		<chiral-outlier problem="WRONG HAND" atom="C20"/>
		<chiral-outlier problem="WRONG HAND" atom="C9"/>
	</ModelledSubgroup>
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		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="36.65" stdev="4.92" mindiff="0.73" local_density="0.82" obsval="42.97"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="110.99" stdev="37.60" mindiff="31.99" local_density="0.00" obsval="176.99"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="109.29" stdev="39.49" mindiff="33.69" local_density="0.00" obsval="-3.96"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="28.52" stdev="1.73" mindiff="3.59" local_density="0.08" obsval="-146.22"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="27.52" stdev="3.04" mindiff="0.05" local_density="0.45" obsval="32.84"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="40.58" stdev="32.43" mindiff="0.01" local_density="3.68" obsval="41.87"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="43.82" stdev="24.69" mindiff="0.15" local_density="0.70" obsval="144.32"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="70.19" stdev="45.73" mindiff="6.70" local_density="0.29" obsval="-22.17"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="47.75" stdev="31.70" mindiff="0.66" local_density="3.80" obsval="-147.98"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="44.32" stdev="10.61" mindiff="0.40" local_density="0.48" obsval="130.02"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="82.74" stdev="26.26" mindiff="0.01" local_density="3.80" obsval="79.40"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="45.56" stdev="14.28" mindiff="0.71" local_density="1.77" obsval="-105.85"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="49.45" stdev="18.71" mindiff="2.53" local_density="1.52" obsval="131.48"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="43.20" stdev="11.25" mindiff="0.65" local_density="0.57" obsval="-131.52"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.27" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.91" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.13" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.14" obsval="1.35"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.02" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.11" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.43" Zscore="8.95" obsval="110.76"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="2.06" Zscore="2.40" obsval="118.22"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.04" Zscore="2.23" obsval="118.64"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.37" Zscore="-2.97" obsval="107.88"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.03" Zscore="2.59" obsval="112.70"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.31" Zscore="-2.72" obsval="104.12"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.48" Zscore="5.25" obsval="133.98"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.17" Zscore="-2.11" obsval="122.84"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.03" Zscore="2.46" obsval="137.62"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.38" Zscore="-2.48" obsval="119.62"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.35" Zscore="6.29" obsval="122.23"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.93" obsval="118.15"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.16" Zscore="3.03" obsval="119.77"/>
		<clash atom="HHC" dist="1.65" clashmag="0.79" cid="156"/>
		<clash atom="HHC" dist="2.36" clashmag="0.53" cid="162"/>
		<clash atom="HBB1" dist="1.65" clashmag="0.79" cid="156"/>
		<clash atom="CBB" dist="2.36" clashmag="0.53" cid="162"/>
		<clash atom="CBC" dist="2.49" clashmag="0.43" cid="168"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9365" Q_score="0.58" mogul_rmsz_numbonds="68" mogul_rmsz_numangles="80" mogul_bonds_rmsz="1.46" mogul_angles_rmsz="1.81" ligand_chirality_outlier="yes" num-H-reduce="67" model="1" chain="2" resnum="602" said="IA" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="105.03" stdev="51.52" mindiff="3.86" local_density="2.22" obsval="37.69"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="75.58" stdev="37.24" mindiff="3.60" local_density="5.00" obsval="-141.40"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="74.64" stdev="39.13" mindiff="1.15" local_density="5.00" obsval="38.80"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="18.77" stdev="1.67" mindiff="1.41" local_density="0.38" obsval="-155.99"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="18.95" stdev="3.17" mindiff="0.01" local_density="1.24" obsval="24.21"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="62.24" stdev="21.19" mindiff="0.18" local_density="0.77" obsval="97.21"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="34.49" stdev="17.43" mindiff="0.04" local_density="1.70" obsval="143.30"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="48.66" stdev="23.79" mindiff="1.19" local_density="1.52" obsval="-138.39"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="41.76" stdev="19.30" mindiff="0.16" local_density="2.95" obsval="96.76"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="78.19" stdev="23.29" mindiff="0.01" local_density="2.43" obsval="85.16"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="41.64" stdev="19.51" mindiff="0.15" local_density="2.95" obsval="-96.45"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.45" stdev="25.41" mindiff="0.86" local_density="2.28" obsval="140.44"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="53.70" stdev="29.48" mindiff="0.07" local_density="2.86" obsval="88.57"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="55.62" stdev="34.00" mindiff="0.67" local_density="2.24" obsval="-148.16"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.18" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.80" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.76" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.35" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.09" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="84" mean="1.42" stdev="0.02" mindiff="0.01" Zscore="3.68" obsval="1.48"/>
		<mog-bond-outlier atoms="C3C,C4C" numobs="229" mean="1.40" stdev="0.02" mindiff="0.00" Zscore="2.92" obsval="1.46"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.04" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.17" Zscore="8.38" obsval="110.50"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.21" Zscore="2.01" obsval="117.16"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.05" Zscore="2.90" obsval="120.68"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.06" Zscore="-2.62" obsval="108.19"/>
		<mog-angle-outlier atoms="CHC,C1C,C2C" numobs="67" mean="129.94" stdev="2.19" mindiff="0.12" Zscore="-2.60" obsval="124.25"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.06" Zscore="2.34" obsval="112.44"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.03" Zscore="-2.15" obsval="104.81"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.99" Zscore="5.54" obsval="134.49"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.18" Zscore="-2.38" obsval="122.23"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.11" Zscore="2.39" obsval="137.48"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.01" Zscore="5.07" obsval="120.10"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.39" obsval="119.19"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.65" Zscore="3.16" obsval="120.26"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.74" Zscore="-2.88" obsval="121.47"/>
		<clash atom="H141" dist="2.01" clashmag="0.42" cid="169"/>
		<clash atom="HMB3" dist="2.02" clashmag="0.42" cid="170"/>
		<clash atom="HBB1" dist="2.02" clashmag="0.42" cid="170"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7846" Q_score="0.566" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.79" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="2" resnum="603" said="JA" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="50.21" stdev="16.47" mindiff="8.92" local_density="1.11" obsval="-131.45"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="48.07" stdev="9.91" mindiff="7.37" local_density="0.78" obsval="116.16"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="50.03" stdev="5.03" mindiff="0.04" local_density="0.27" obsval="-123.63"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="51.80" stdev="5.61" mindiff="0.19" local_density="0.38" obsval="58.30"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="36.15" stdev="1.74" mindiff="1.95" local_density="0.02" obsval="-138.60"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="35.66" stdev="2.96" mindiff="0.86" local_density="0.19" obsval="41.02"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="41.32" stdev="30.40" mindiff="0.24" local_density="2.02" obsval="-150.83"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="44.23" stdev="10.66" mindiff="0.52" local_density="0.48" obsval="130.14"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="67.43" stdev="15.46" mindiff="0.21" local_density="0.77" obsval="-99.23"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.32" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.90" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.02" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.48" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.03" obsval="1.33"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.03" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.25" Zscore="8.54" obsval="110.58"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.21" Zscore="-2.19" obsval="121.44"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.12" Zscore="2.62" obsval="119.84"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.21" Zscore="-2.79" obsval="108.04"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.02" Zscore="2.59" obsval="112.71"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.21" Zscore="-2.53" obsval="104.32"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.87" Zscore="5.47" obsval="134.37"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.25" Zscore="-2.35" obsval="122.30"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.04" Zscore="2.43" obsval="137.55"/>
		<mog-angle-outlier atoms="OBD,CAD,C3D" numobs="108" mean="128.42" stdev="2.34" mindiff="0.31" Zscore="-2.05" obsval="123.62"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.77" Zscore="4.94" obsval="119.86"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.36" obsval="119.26"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.12" Zscore="2.76" obsval="118.72"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.07" Zscore="2.33" obsval="126.41"/>
		<clash atom="HBB2" dist="2.47" clashmag="0.44" cid="166"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8462" Q_score="0.559" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.90" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="2" resnum="604" said="KA" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="71.61" stdev="39.25" mindiff="0.42" local_density="1.05" obsval="-62.21"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="72.70" stdev="40.15" mindiff="2.95" local_density="3.36" obsval="-54.20"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="70.93" stdev="38.75" mindiff="1.18" local_density="3.70" obsval="126.82"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="44.62" stdev="27.75" mindiff="0.20" local_density="5.00" obsval="102.69"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="44.78" stdev="29.76" mindiff="1.38" local_density="5.00" obsval="-76.77"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="43.76" stdev="24.84" mindiff="0.02" local_density="0.74" obsval="-144.49"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="82.26" stdev="25.94" mindiff="0.01" local_density="3.65" obsval="-80.01"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="70.14" stdev="45.73" mindiff="6.75" local_density="0.29" obsval="-22.22"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="47.67" stdev="32.50" mindiff="0.03" local_density="4.56" obsval="-148.92"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="61.51" stdev="11.62" mindiff="0.01" local_density="0.59" obsval="-107.06"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="75.32" stdev="21.14" mindiff="0.09" local_density="1.72" obsval="88.90"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.10" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.78" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.10" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.46" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.04" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.17" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.80" Zscore="9.76" obsval="111.13"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.29" Zscore="2.68" obsval="118.99"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.26" Zscore="2.85" obsval="123.55"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.19" Zscore="-2.76" obsval="108.06"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.13" Zscore="2.16" obsval="112.25"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.16" Zscore="-2.49" obsval="104.37"/>
		<mog-angle-outlier atoms="CMC,C2C,C1C" numobs="853" mean="125.03" stdev="1.56" mindiff="0.05" Zscore="2.01" obsval="128.17"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.09" Zscore="-2.31" obsval="104.69"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.24" Zscore="2.17" obsval="112.27"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.93" Zscore="4.94" obsval="133.43"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.34" Zscore="2.28" obsval="137.25"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.08" Zscore="-2.34" obsval="119.91"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.90" Zscore="5.58" obsval="120.98"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.44" obsval="119.11"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.63" Zscore="3.41" obsval="121.24"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.89" Zscore="-2.37" obsval="122.32"/>
		<clash atom="HBC2" dist="1.68" clashmag="0.73" cid="192"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7538" Q_score="0.5" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.80" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="2" resnum="605" said="LA" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="40.69" stdev="33.10" mindiff="5.03" local_density="3.33" obsval="151.85"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="38.87" stdev="29.20" mindiff="4.23" local_density="1.55" obsval="37.83"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="46.95" stdev="10.87" mindiff="4.12" local_density="0.11" obsval="-128.05"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="66.81" stdev="28.91" mindiff="0.06" local_density="4.79" obsval="79.63"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="20.30" stdev="4.72" mindiff="0.11" local_density="2.99" obsval="-153.90"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="20.24" stdev="4.38" mindiff="0.03" local_density="3.02" obsval="26.12"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="86.42" stdev="39.44" mindiff="1.02" local_density="0.35" obsval="47.29"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="98.98" stdev="2.01" mindiff="31.35" local_density="0.00" obsval="-75.75"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="99.16" stdev="3.45" mindiff="1.38" local_density="0.02" obsval="104.64"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="57.24" stdev="11.09" mindiff="3.55" local_density="0.07" obsval="109.96"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="50.68" stdev="13.88" mindiff="1.01" local_density="1.14" obsval="-122.06"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="49.23" stdev="12.32" mindiff="2.43" local_density="1.18" obsval="114.19"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="49.48" stdev="18.56" mindiff="2.76" local_density="1.52" obsval="-131.25"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="44.26" stdev="15.71" mindiff="1.05" local_density="2.36" obsval="102.77"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="81.32" stdev="25.32" mindiff="0.01" local_density="3.34" obsval="81.20"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="81.82" stdev="25.65" mindiff="0.01" local_density="3.53" obsval="80.56"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.17" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.83" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.32" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.40" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.06" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.17" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.28" Zscore="8.61" obsval="110.61"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.13" Zscore="-2.03" obsval="121.79"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.07" Zscore="2.53" obsval="119.55"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.22" Zscore="2.21" obsval="122.00"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.53" Zscore="-3.14" obsval="107.72"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.10" Zscore="2.52" obsval="112.63"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.28" Zscore="-2.59" obsval="104.25"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.15" Zscore="-2.40" obsval="104.62"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.32" Zscore="-2.16" obsval="121.76"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.26" Zscore="2.20" obsval="112.30"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.62" Zscore="5.33" obsval="134.12"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.25" Zscore="-2.15" obsval="122.77"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.38" Zscore="2.26" obsval="137.21"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.72" Zscore="4.09" obsval="118.38"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="7.11" Zscore="3.54" obsval="121.72"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.74" Zscore="-2.27" obsval="122.47"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.05" Zscore="2.06" obsval="125.78"/>
		<clash atom="HAB" dist="2.27" clashmag="0.64" cid="327"/>
		<clash atom="HHC" dist="1.85" clashmag="0.57" cid="328"/>
		<clash atom="HHC" dist="2.43" clashmag="0.47" cid="329"/>
		<clash atom="HBB1" dist="1.85" clashmag="0.57" cid="328"/>
		<clash atom="HBB1" dist="2.04" clashmag="0.40" cid="331"/>
		<clash atom="CBB" dist="2.43" clashmag="0.47" cid="329"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8000" Q_score="0.512" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.89" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="2" resnum="606" said="MA" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="57.70" stdev="23.19" mindiff="0.07" local_density="4.82" obsval="-84.58"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="58.31" stdev="22.74" mindiff="0.02" local_density="4.24" obsval="94.77"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="30.78" stdev="4.61" mindiff="0.80" local_density="1.04" obsval="-143.15"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="30.00" stdev="4.59" mindiff="0.12" local_density="1.32" obsval="36.18"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="66.40" stdev="1.96" mindiff="1.24" local_density="0.02" obsval="-108.33"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="65.06" stdev="2.93" mindiff="2.97" local_density="0.02" obsval="70.49"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="55.48" stdev="8.58" mindiff="2.75" local_density="0.07" obsval="-114.45"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="55.28" stdev="45.62" mindiff="0.83" local_density="2.65" obsval="-37.18"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="35.67" stdev="16.51" mindiff="0.17" local_density="1.45" obsval="141.70"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="83.68" stdev="26.88" mindiff="0.05" local_density="4.38" obsval="-78.22"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="83.86" stdev="45.79" mindiff="7.02" local_density="0.29" obsval="-8.45"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="49.22" stdev="20.01" mindiff="0.70" local_density="1.90" obsval="-133.31"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="77.13" stdev="22.49" mindiff="0.01" local_density="2.11" obsval="-86.55"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="54.05" stdev="13.98" mindiff="0.50" local_density="0.70" obsval="109.64"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="54.65" stdev="17.25" mindiff="0.23" local_density="0.66" obsval="-127.91"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.16" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.91" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.13" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.64" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.09" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.02" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.89" Zscore="9.96" obsval="111.22"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.17" Zscore="-2.02" obsval="121.83"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.05" Zscore="2.78" obsval="119.23"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.04" Zscore="2.27" obsval="118.76"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.21" Zscore="-2.23" obsval="108.54"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.15" Zscore="2.76" obsval="112.88"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.34" Zscore="-2.70" obsval="104.14"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.66" Zscore="5.36" obsval="134.16"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.42" Zscore="-2.22" obsval="122.59"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.16" Zscore="2.37" obsval="137.43"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.01" Zscore="5.07" obsval="120.10"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.46" obsval="119.07"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.03" Zscore="3.00" obsval="119.64"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.06" Zscore="2.05" obsval="125.77"/>
		<clash atom="HBB1" dist="1.89" clashmag="0.53" cid="431"/>
		<clash atom="HBB1" dist="2.50" clashmag="0.42" cid="433"/>
		<clash atom="HMB3" dist="1.89" clashmag="0.53" cid="431"/>
		<clash atom="H43" dist="1.99" clashmag="0.44" cid="432"/>
		<clash atom="CMB" dist="2.50" clashmag="0.42" cid="433"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6462" Q_score="0.463" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.79" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="2" resnum="607" said="NA" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="77.93" stdev="6.18" mindiff="3.08" local_density="0.12" obsval="-95.54"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="77.11" stdev="6.49" mindiff="1.00" local_density="0.13" obsval="83.74"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="69.66" stdev="30.84" mindiff="0.04" local_density="2.52" obsval="65.03"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="68.51" stdev="26.28" mindiff="6.82" local_density="0.74" obsval="-112.53"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="72.98" stdev="2.01" mindiff="5.35" local_density="0.02" obsval="-101.75"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="72.73" stdev="3.00" mindiff="9.22" local_density="0.01" obsval="78.18"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="52.63" stdev="32.56" mindiff="7.40" local_density="0.29" obsval="148.44"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="48.79" stdev="32.47" mindiff="5.97" local_density="0.39" obsval="-33.60"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="82.46" stdev="51.70" mindiff="0.41" local_density="4.18" obsval="-42.95"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="34.03" stdev="17.79" mindiff="0.04" local_density="1.87" obsval="-143.92"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="38.75" stdev="14.21" mindiff="0.03" local_density="1.02" obsval="137.53"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="55.96" stdev="8.95" mindiff="0.15" local_density="0.41" obsval="114.43"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.14" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.94" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.11" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.69" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.13" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.07" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.53" Zscore="9.17" obsval="110.86"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.02" Zscore="2.12" obsval="118.31"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.36" Zscore="-2.95" obsval="107.90"/>
		<mog-angle-outlier atoms="CBB,CAB,C3B" numobs="151" mean="127.53" stdev="5.00" mindiff="0.14" Zscore="-2.00" obsval="117.53"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.05" Zscore="2.66" obsval="112.78"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.18" Zscore="-2.50" obsval="104.35"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.80" Zscore="4.87" obsval="133.30"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.03" Zscore="2.43" obsval="137.56"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.09" Zscore="5.12" obsval="120.18"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.44" obsval="119.10"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.05" Zscore="2.74" obsval="118.66"/>
		<clash atom="HAB" dist="2.40" clashmag="0.51" cid="451"/>
		<clash atom="HAB" dist="2.01" clashmag="0.42" cid="455"/>
		<clash atom="H93" dist="1.94" clashmag="0.49" cid="453"/>
		<clash atom="H51" dist="1.94" clashmag="0.49" cid="453"/>
		<clash atom="H62" dist="1.93" clashmag="0.41" cid="456"/>
		<clash atom="H41" dist="1.93" clashmag="0.41" cid="456"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7538" Q_score="0.403" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.39" mogul_angles_rmsz="1.91" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="2" resnum="608" said="OA" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="110.53" stdev="51.64" mindiff="1.70" local_density="1.11" obsval="32.13"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="48.33" stdev="20.77" mindiff="0.01" local_density="4.95" obsval="-115.46"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="67.35" stdev="39.18" mindiff="0.58" local_density="3.16" obsval="-66.53"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="10552" mean="66.96" stdev="9.49" mindiff="13.12" local_density="0.00" obsval="161.11"/>
		<mog-torsion-outlier atoms="C4C,C3C,CAC,CBC" numobs="10557" mean="64.32" stdev="11.08" mindiff="18.75" local_density="0.00" obsval="-18.80"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="42.87" stdev="26.79" mindiff="1.13" local_density="5.00" obsval="99.79"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="28.67" stdev="1.73" mindiff="3.73" local_density="0.08" obsval="146.08"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="27.75" stdev="3.04" mindiff="0.11" local_density="0.44" obsval="-33.08"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="40.08" stdev="33.28" mindiff="0.23" local_density="4.05" obsval="154.07"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="58.29" stdev="45.65" mindiff="2.21" local_density="1.47" obsval="34.14"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="41.62" stdev="12.24" mindiff="0.72" local_density="0.71" obsval="133.65"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="40.66" stdev="21.13" mindiff="0.21" local_density="3.83" obsval="-94.05"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.23" stdev="27.17" mindiff="0.91" local_density="2.28" obsval="142.58"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="85.49" stdev="28.10" mindiff="0.01" local_density="4.87" obsval="-75.93"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.16" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.97" obsval="1.97"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.80" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.25" obsval="1.32"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.03" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.27" Zscore="8.59" obsval="110.60"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.50" Zscore="2.11" obsval="117.45"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.09" Zscore="2.19" obsval="118.52"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.05" Zscore="2.32" obsval="122.28"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.01" Zscore="-2.48" obsval="108.32"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.10" Zscore="2.52" obsval="112.63"/>
		<mog-angle-outlier atoms="CAC,C3C,C2C" numobs="1724" mean="127.56" stdev="1.84" mindiff="0.01" Zscore="-2.65" obsval="122.69"/>
		<mog-angle-outlier atoms="CAC,C3C,C4C" numobs="5400" mean="124.79" stdev="1.30" mindiff="0.07" Zscore="4.71" obsval="130.91"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.09" Zscore="-2.05" obsval="104.87"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.51" Zscore="5.27" obsval="134.01"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.27" Zscore="-2.16" obsval="122.74"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.10" Zscore="2.39" obsval="137.49"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.21" Zscore="-2.40" obsval="119.78"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.55" Zscore="5.78" obsval="121.34"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.03" Zscore="-2.56" obsval="118.87"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.24" Zscore="3.05" obsval="119.84"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.02" Zscore="2.11" obsval="125.90"/>
		<clash atom="H43" dist="1.74" clashmag="0.69" cid="236"/>
		<clash atom="HMB2" dist="1.74" clashmag="0.69" cid="236"/>
		<clash atom="HBC2" dist="1.77" clashmag="0.67" cid="237"/>
		<clash atom="HHD" dist="1.77" clashmag="0.67" cid="237"/>
		<clash atom="HHD" dist="2.45" clashmag="0.47" cid="239"/>
		<clash atom="HAB" dist="2.41" clashmag="0.59" cid="238"/>
		<clash atom="CBC" dist="2.45" clashmag="0.47" cid="239"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7846" Q_score="0.458" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.83" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="2" resnum="609" said="PA" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="55.13" stdev="9.62" mindiff="1.43" local_density="1.11" obsval="121.09"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="68.81" stdev="29.20" mindiff="34.17" local_density="0.00" obsval="7.89"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="57.49" stdev="23.07" mindiff="0.02" local_density="4.84" obsval="-84.08"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="58.27" stdev="22.71" mindiff="0.10" local_density="4.30" obsval="94.84"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="78.38" stdev="6.21" mindiff="3.53" local_density="0.15" obsval="95.09"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="79.37" stdev="6.55" mindiff="3.27" local_density="0.13" obsval="-86.01"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="84.65" stdev="39.41" mindiff="0.76" local_density="0.35" obsval="-49.08"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="104.19" stdev="2.01" mindiff="36.56" local_density="0.00" obsval="-70.54"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="103.81" stdev="3.53" mindiff="6.04" local_density="0.01" obsval="109.30"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="50.78" stdev="10.40" mindiff="0.68" local_density="0.11" obsval="126.47"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="51.64" stdev="13.24" mindiff="2.03" local_density="1.18" obsval="-119.61"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="51.67" stdev="13.45" mindiff="0.01" local_density="1.14" obsval="115.04"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="47.78" stdev="31.30" mindiff="1.13" local_density="3.42" obsval="147.51"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.24" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.82" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.06" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.50" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.01" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.07" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.55" Zscore="9.21" obsval="110.88"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.23" Zscore="3.08" obsval="120.05"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.11" obsval="118.26"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.33" Zscore="2.44" obsval="122.56"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.08" Zscore="-2.64" obsval="108.17"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.13" Zscore="2.50" obsval="112.60"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.19" Zscore="-2.51" obsval="104.34"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.47" Zscore="5.25" obsval="133.97"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.33" Zscore="-2.18" obsval="122.68"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.16" Zscore="2.37" obsval="137.43"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.38" Zscore="4.72" obsval="119.48"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.40" obsval="119.19"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.75" Zscore="3.44" obsval="121.36"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.33" Zscore="-2.63" obsval="121.88"/>
		<clash atom="HBC1" dist="1.89" clashmag="0.54" cid="424"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.5385" Q_score="0.277" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.94" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="2" resnum="610" said="QA" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="113.05" stdev="51.64" mindiff="4.21" local_density="1.11" obsval="29.62"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="64.05" stdev="27.41" mindiff="0.02" local_density="4.94" obsval="-98.14"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="66.31" stdev="28.51" mindiff="0.09" local_density="4.92" obsval="80.48"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="93.85" stdev="6.81" mindiff="3.08" local_density="0.08" obsval="79.56"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="95.20" stdev="6.84" mindiff="5.01" local_density="0.02" obsval="-101.87"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="125.98" stdev="39.47" mindiff="40.59" local_density="0.00" obsval="-7.73"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="52.09" stdev="1.81" mindiff="15.55" local_density="0.00" obsval="-122.65"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="52.22" stdev="2.91" mindiff="2.05" local_density="0.06" obsval="57.63"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="62.23" stdev="21.16" mindiff="0.14" local_density="0.77" obsval="-97.25"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="34.67" stdev="17.29" mindiff="0.03" local_density="1.64" obsval="143.06"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="48.98" stdev="21.48" mindiff="0.56" local_density="1.90" obsval="135.29"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="82.45" stdev="45.79" mindiff="5.61" local_density="0.29" obsval="9.86"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="65.73" stdev="14.30" mindiff="0.09" local_density="0.63" obsval="-101.48"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="107.14" stdev="34.92" mindiff="0.02" local_density="4.35" obsval="-51.67"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.27" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.79" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.03" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.18" obsval="1.35"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.01" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.11" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.79" Zscore="9.74" obsval="111.12"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.17" Zscore="-2.02" obsval="121.82"/>
		<mog-angle-outlier atoms="CMA,C3A,C2A" numobs="98" mean="113.98" stdev="3.87" mindiff="1.10" Zscore="2.57" obsval="123.90"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="3.86" Zscore="4.60" obsval="124.14"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.09" obsval="118.22"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.61" Zscore="2.55" obsval="122.83"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.42" Zscore="-3.02" obsval="107.84"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.02" Zscore="2.30" obsval="112.40"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.03" Zscore="-2.36" obsval="104.50"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.09" Zscore="-2.07" obsval="104.86"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.52" Zscore="5.27" obsval="134.01"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.44" Zscore="-2.23" obsval="122.58"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.18" Zscore="2.35" obsval="137.41"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.12" Zscore="5.14" obsval="120.21"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.39" obsval="119.20"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.85" Zscore="3.21" obsval="120.46"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8154" Q_score="0.514" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.84" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="2" resnum="611" said="RA" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="72.93" stdev="26.63" mindiff="17.16" local_density="0.00" obsval="84.70"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="44.76" stdev="29.20" mindiff="10.12" local_density="0.00" obsval="-31.95"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="93.99" stdev="6.81" mindiff="3.21" local_density="0.08" obsval="-79.43"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="94.80" stdev="6.83" mindiff="4.60" local_density="0.04" obsval="101.46"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="10552" mean="39.52" stdev="9.12" mindiff="0.09" local_density="0.27" obsval="-54.72"/>
		<mog-torsion-outlier atoms="C4C,C3C,CAC,CBC" numobs="10557" mean="43.35" stdev="10.80" mindiff="0.15" local_density="0.75" obsval="126.40"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="80.45" stdev="2.01" mindiff="12.82" local_density="0.00" obsval="-94.28"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="80.42" stdev="3.11" mindiff="1.52" local_density="0.01" obsval="85.88"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="49.88" stdev="16.57" mindiff="2.13" local_density="1.52" obsval="-128.07"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="47.14" stdev="12.95" mindiff="0.03" local_density="1.47" obsval="109.44"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="78.90" stdev="23.76" mindiff="0.03" local_density="2.61" obsval="84.26"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="66.14" stdev="14.58" mindiff="0.11" local_density="0.68" obsval="100.93"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.28" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.91" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.18" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.45" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.12" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.15" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.80" Zscore="9.75" obsval="111.13"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.16" Zscore="-2.02" obsval="121.82"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.07" Zscore="3.14" obsval="120.21"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.22" obsval="118.61"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.22" Zscore="2.39" obsval="122.45"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.20" Zscore="-2.77" obsval="108.05"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.02" Zscore="2.60" obsval="112.71"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.19" Zscore="-2.52" obsval="104.33"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.11" Zscore="-2.03" obsval="104.89"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.25" Zscore="2.17" obsval="112.28"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.66" Zscore="-2.04" obsval="103.05"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.40" Zscore="5.21" obsval="133.90"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.04" Zscore="-2.02" obsval="123.05"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.14" Zscore="2.38" obsval="137.46"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.46" Zscore="4.76" obsval="119.55"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.23" obsval="119.50"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.49" Zscore="3.12" obsval="120.10"/>
		<clash atom="HAC2" dist="1.96" clashmag="0.46" cid="165"/>
		<clash atom="C3D" dist="2.51" clashmag="0.41" cid="172"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7077" Q_score="0.446" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.80" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="2" resnum="612" said="SA" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="57.27" stdev="22.94" mindiff="0.12" local_density="4.80" obsval="-83.53"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="57.56" stdev="22.24" mindiff="0.10" local_density="4.27" obsval="96.21"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="72.18" stdev="5.87" mindiff="1.66" local_density="0.08" obsval="-101.33"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="71.80" stdev="6.30" mindiff="0.63" local_density="0.13" obsval="78.41"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="10552" mean="33.40" stdev="9.08" mindiff="0.02" local_density="0.97" obsval="-60.86"/>
		<mog-torsion-outlier atoms="C4C,C3C,CAC,CBC" numobs="10557" mean="37.44" stdev="10.69" mindiff="0.14" local_density="1.75" obsval="120.45"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="95.93" stdev="37.60" mindiff="16.93" local_density="0.00" obsval="-161.93"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="94.79" stdev="39.49" mindiff="19.18" local_density="0.00" obsval="18.46"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="24.71" stdev="1.70" mindiff="0.23" local_density="0.19" obsval="-150.04"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="25.04" stdev="3.06" mindiff="0.23" local_density="0.58" obsval="30.35"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="29.59" stdev="21.36" mindiff="0.06" local_density="4.29" obsval="150.06"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="47.61" stdev="33.17" mindiff="0.80" local_density="4.18" obsval="-149.70"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.25" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.88" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.13" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.31" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.12" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.08" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.37" Zscore="8.82" obsval="110.70"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="2.00" Zscore="2.30" obsval="117.95"/>
		<mog-angle-outlier atoms="CAA,CBA,CGA" numobs="605" mean="113.21" stdev="2.84" mindiff="0.12" Zscore="-2.01" obsval="107.50"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.03" Zscore="2.29" obsval="122.20"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.38" Zscore="-2.97" obsval="107.88"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.17" Zscore="2.45" obsval="112.56"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.07" Zscore="-2.26" obsval="104.60"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.83" Zscore="5.45" obsval="134.33"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.31" Zscore="-2.32" obsval="122.36"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.03" Zscore="2.46" obsval="137.62"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.15" Zscore="-2.02" obsval="120.52"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.13" Zscore="5.14" obsval="120.22"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.36" obsval="119.25"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="1.34" Zscore="2.04" obsval="115.94"/>
		<mog-angle-outlier atoms="C4,C3,C2" numobs="919" mean="123.63" stdev="2.57" mindiff="0.06" Zscore="-2.40" obsval="117.46"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.01" Zscore="2.46" obsval="126.69"/>
		<clash atom="HBC3" dist="2.27" clashmag="0.63" cid="157"/>
		<clash atom="HMB1" dist="1.84" clashmag="0.59" cid="159"/>
		<clash atom="CMB" dist="2.36" clashmag="0.56" cid="161"/>
		<clash atom="HAB" dist="2.01" clashmag="0.42" cid="169"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6615" Q_score="0.43" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.91" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="2" resnum="613" said="TA" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="103.55" stdev="51.45" mindiff="5.37" local_density="3.33" obsval="39.21"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="57.80" stdev="23.26" mindiff="0.01" local_density="4.87" obsval="-84.83"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="58.56" stdev="22.87" mindiff="0.05" local_density="4.21" obsval="94.30"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="74.44" stdev="5.98" mindiff="0.44" local_density="0.12" obsval="99.06"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="75.21" stdev="6.42" mindiff="0.07" local_density="0.13" obsval="-81.84"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="96.51" stdev="39.47" mindiff="11.13" local_density="0.00" obsval="-37.19"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="68.59" stdev="27.33" mindiff="4.11" local_density="2.52" obsval="69.11"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="68.12" stdev="24.21" mindiff="9.28" local_density="0.74" obsval="-110.08"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="50.73" stdev="1.80" mindiff="16.54" local_density="0.00" obsval="-124.00"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="49.90" stdev="2.93" mindiff="0.53" local_density="0.06" obsval="55.31"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="62.79" stdev="22.40" mindiff="0.19" local_density="0.81" obsval="95.80"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="47.74" stdev="31.77" mindiff="0.57" local_density="4.18" obsval="148.07"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="45.99" stdev="9.77" mindiff="0.04" local_density="0.47" obsval="-127.77"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="73.29" stdev="19.66" mindiff="0.00" local_density="1.45" obsval="91.55"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="61.63" stdev="26.06" mindiff="0.07" local_density="3.83" obsval="-141.11"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="54.80" stdev="24.91" mindiff="0.23" local_density="4.18" obsval="95.42"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="47.55" stdev="33.86" mindiff="1.60" local_density="4.56" obsval="-150.50"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="35.25" stdev="16.84" mindiff="0.00" local_density="1.49" obsval="142.27"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.23" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.86" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.16" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.47" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.02" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.20" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.78" Zscore="9.71" obsval="111.11"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.24" Zscore="3.08" obsval="120.04"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.12" obsval="118.31"/>
		<mog-angle-outlier atoms="CMB,C2B,C1B" numobs="569" mean="125.42" stdev="1.52" mindiff="0.13" Zscore="2.23" obsval="128.81"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.18" Zscore="-2.76" obsval="108.07"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.00" Zscore="2.62" obsval="112.73"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.22" Zscore="-2.54" obsval="104.31"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.08" Zscore="-2.08" obsval="104.86"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.11" Zscore="2.03" obsval="112.13"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.41" Zscore="5.21" obsval="133.91"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.09" Zscore="-2.08" obsval="122.92"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.06" Zscore="2.41" obsval="137.53"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.03" Zscore="-2.28" obsval="120.03"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.86" Zscore="5.60" obsval="121.03"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.52" obsval="118.94"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.75" Zscore="3.18" obsval="120.36"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.39" Zscore="-2.06" obsval="122.82"/>
		<clash atom="HAB" dist="1.68" clashmag="0.73" cid="192"/>
		<clash atom="HMB3" dist="2.57" clashmag="0.40" cid="193"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9048" Q_score="0.532" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.48" mogul_angles_rmsz="2.36" ligand_chirality_outlier="yes" model="1" chain="2" resnum="614" said="UA" ent="17" seq="." icode=" " resname="C7Z" altcode=" ">
		<mog-torsion-outlier atoms="C21,C26,C27,C28" numobs="119" mean="51.13" stdev="15.63" mindiff="3.60" local_density="0.84" obsval="83.95"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="119" mean="46.24" stdev="19.36" mindiff="4.21" local_density="3.36" obsval="-90.26"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C19" numobs="316" mean="37.82" stdev="11.18" mindiff="17.49" local_density="0.00" obsval="41.96"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="37.12" stdev="11.32" mindiff="16.67" local_density="0.00" obsval="-138.69"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="22.15" stdev="13.62" mindiff="0.38" local_density="2.89" obsval="153.50"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C34" numobs="313" mean="168.87" stdev="22.47" mindiff="3.62" local_density="0.32" obsval="1.46"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C40" numobs="316" mean="169.39" stdev="22.70" mindiff="1.83" local_density="0.32" obsval="-179.11"/>
		<mog-torsion-outlier atoms="C29,C30,C31,C32" numobs="760" mean="70.62" stdev="6.80" mindiff="1.09" local_density="0.53" obsval="102.52"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C30" numobs="313" mean="49.00" stdev="8.33" mindiff="3.98" local_density="0.32" obsval="-126.00"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C39" numobs="316" mean="48.59" stdev="8.25" mindiff="7.03" local_density="0.32" obsval="53.46"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.89" obsval="1.46"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.57" obsval="1.60"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.50" obsval="1.57"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.07" Zscore="8.37" obsval="1.66"/>
		<mog-bond-outlier atoms="C4,C5" numobs="328" mean="1.51" stdev="0.02" mindiff="0.01" Zscore="-4.24" obsval="1.44"/>
		<mog-bond-outlier atoms="C2,C3" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.60" obsval="1.37"/>
		<mog-bond-outlier atoms="C2,C1" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.71" obsval="1.65"/>
		<mog-bond-outlier atoms="C18,C5" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.48" obsval="1.54"/>
		<mog-bond-outlier atoms="C27,C26" numobs="255" mean="1.45" stdev="0.03" mindiff="0.03" Zscore="3.78" obsval="1.58"/>
		<mog-bond-outlier atoms="C21,C26" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-2.88" obsval="1.50"/>
		<mog-bond-outlier atoms="C25,C26" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.35" obsval="1.61"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.41" obsval="1.55"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.27" obsval="1.56"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.78" obsval="1.58"/>
		<mog-bond-outlier atoms="C20,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.53" obsval="1.56"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.91" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C34" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.72" obsval="1.54"/>
		<mog-bond-outlier atoms="C40,C33" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.17" obsval="1.55"/>
		<mog-bond-outlier atoms="C32,C33" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.84" obsval="1.56"/>
		<mog-bond-outlier atoms="C31,C30" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.50" obsval="1.57"/>
		<mog-bond-outlier atoms="C28,C29" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.12" obsval="1.56"/>
		<mog-bond-outlier atoms="C22,C21" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="4.02" obsval="1.66"/>
		<mog-bond-outlier atoms="C22,C23" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.90" obsval="1.36"/>
		<mog-bond-outlier atoms="C24,C23" numobs="572" mean="1.52" stdev="0.02" mindiff="0.12" Zscore="11.48" obsval="1.72"/>
		<mog-bond-outlier atoms="C24,C25" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.74" obsval="1.43"/>
		<mog-bond-outlier atoms="C38,C25" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="3.50" obsval="1.56"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.01" Zscore="-3.41" obsval="117.98"/>
		<mog-angle-outlier atoms="C18,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="2.15" Zscore="-5.04" obsval="118.98"/>
		<mog-angle-outlier atoms="C18,C5,C4" numobs="328" mean="114.42" stdev="1.84" mindiff="0.20" Zscore="2.40" obsval="118.83"/>
		<mog-angle-outlier atoms="C8,C7,C6" numobs="153" mean="127.00" stdev="2.67" mindiff="3.14" Zscore="-3.24" obsval="118.35"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="1.05" Zscore="-2.70" obsval="122.25"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="0.41" Zscore="-3.50" obsval="122.37"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="0.68" Zscore="-2.43" obsval="116.15"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="0.04" Zscore="-3.18" obsval="122.81"/>
		<mog-angle-outlier atoms="C35,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="1.47" Zscore="-3.33" obsval="116.72"/>
		<mog-angle-outlier atoms="C35,C34,C33" numobs="147" mean="127.28" stdev="1.40" mindiff="3.39" Zscore="-7.22" obsval="117.15"/>
		<mog-angle-outlier atoms="C40,C33,C34" numobs="181" mean="122.82" stdev="1.62" mindiff="0.05" Zscore="-2.18" obsval="119.28"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="2.11" Zscore="-6.32" obsval="118.42"/>
		<mog-angle-outlier atoms="C39,C29,C30" numobs="181" mean="122.82" stdev="1.62" mindiff="0.02" Zscore="-2.05" obsval="119.50"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="4.43" Zscore="-4.98" obsval="118.87"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="153" mean="127.00" stdev="2.67" mindiff="1.07" Zscore="-2.46" obsval="120.42"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="2.59" Zscore="-5.44" obsval="118.55"/>
		<mog-angle-outlier atoms="C38,C25,C24" numobs="328" mean="114.42" stdev="1.84" mindiff="0.07" Zscore="2.47" obsval="118.96"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9524" Q_score="0.601" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.51" mogul_angles_rmsz="2.55" ligand_chirality_outlier="yes" model="1" chain="2" resnum="615" said="VA" ent="17" seq="." icode=" " resname="C7Z" altcode=" ">
		<mog-torsion-outlier atoms="C21,C26,C27,C28" numobs="119" mean="68.36" stdev="16.40" mindiff="18.64" local_density="0.00" obsval="55.07"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="119" mean="64.45" stdev="14.08" mindiff="23.62" local_density="0.00" obsval="-120.92"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C19" numobs="316" mean="24.07" stdev="15.64" mindiff="2.82" local_density="0.32" obsval="27.29"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="24.13" stdev="15.43" mindiff="9.81" local_density="0.64" obsval="-152.57"/>
		<mog-torsion-outlier atoms="C12,C13,C14,C15" numobs="150" mean="167.63" stdev="33.00" mindiff="0.20" local_density="3.33" obsval="-0.43"/>
		<mog-torsion-outlier atoms="C20,C13,C14,C15" numobs="160" mean="168.44" stdev="32.00" mindiff="0.04" local_density="3.12" obsval="-179.94"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C30" numobs="313" mean="162.49" stdev="22.33" mindiff="2.78" local_density="0.64" obsval="7.86"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C39" numobs="316" mean="161.71" stdev="22.54" mindiff="5.87" local_density="0.63" obsval="-171.40"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.91" obsval="1.46"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.63" obsval="1.60"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.61" obsval="1.57"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.07" Zscore="8.42" obsval="1.67"/>
		<mog-bond-outlier atoms="C4,C5" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.08" obsval="1.44"/>
		<mog-bond-outlier atoms="C2,C3" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.63" obsval="1.37"/>
		<mog-bond-outlier atoms="C2,C1" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.67" obsval="1.65"/>
		<mog-bond-outlier atoms="C18,C5" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.39" obsval="1.54"/>
		<mog-bond-outlier atoms="C27,C26" numobs="255" mean="1.45" stdev="0.03" mindiff="0.03" Zscore="3.86" obsval="1.58"/>
		<mog-bond-outlier atoms="C21,C26" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-3.36" obsval="1.49"/>
		<mog-bond-outlier atoms="C25,C26" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.15" obsval="1.61"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.54" obsval="1.55"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.39" obsval="1.56"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.96" obsval="1.58"/>
		<mog-bond-outlier atoms="C20,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.52" obsval="1.55"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.86" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C34" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.89" obsval="1.55"/>
		<mog-bond-outlier atoms="C40,C33" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.13" obsval="1.55"/>
		<mog-bond-outlier atoms="C32,C33" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="5.07" obsval="1.56"/>
		<mog-bond-outlier atoms="C31,C30" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.60" obsval="1.57"/>
		<mog-bond-outlier atoms="C28,C29" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.24" obsval="1.57"/>
		<mog-bond-outlier atoms="C22,C21" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="3.85" obsval="1.66"/>
		<mog-bond-outlier atoms="C22,C23" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.65" obsval="1.37"/>
		<mog-bond-outlier atoms="C24,C23" numobs="572" mean="1.52" stdev="0.02" mindiff="0.13" Zscore="11.96" obsval="1.73"/>
		<mog-bond-outlier atoms="C24,C25" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.49" obsval="1.44"/>
		<mog-bond-outlier atoms="C38,C25" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="3.47" obsval="1.56"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="1.28" Zscore="-4.36" obsval="116.68"/>
		<mog-angle-outlier atoms="C18,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="1.15" Zscore="-4.12" obsval="119.99"/>
		<mog-angle-outlier atoms="C18,C5,C4" numobs="328" mean="114.42" stdev="1.84" mindiff="0.01" Zscore="2.60" obsval="119.20"/>
		<mog-angle-outlier atoms="C21,C26,C27" numobs="118" mean="115.65" stdev="2.71" mindiff="1.29" Zscore="2.80" obsval="123.25"/>
		<mog-angle-outlier atoms="C21,C26,C25" numobs="97" mean="122.64" stdev="1.37" mindiff="0.71" Zscore="-3.94" obsval="117.25"/>
		<mog-angle-outlier atoms="C8,C7,C6" numobs="153" mean="127.00" stdev="2.67" mindiff="0.49" Zscore="-2.24" obsval="121.01"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="2.77" Zscore="-3.86" obsval="120.53"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="0.22" Zscore="-4.40" obsval="121.11"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="0.66" Zscore="-2.41" obsval="119.74"/>
		<mog-angle-outlier atoms="C20,C13,C14" numobs="181" mean="122.82" stdev="1.62" mindiff="0.04" Zscore="-2.03" obsval="119.52"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="0.16" Zscore="-4.70" obsval="120.69"/>
		<mog-angle-outlier atoms="C35,C34,C33" numobs="147" mean="127.28" stdev="1.40" mindiff="4.07" Zscore="-7.71" obsval="116.47"/>
		<mog-angle-outlier atoms="C40,C33,C34" numobs="181" mean="122.82" stdev="1.62" mindiff="0.25" Zscore="-2.71" obsval="118.42"/>
		<mog-angle-outlier atoms="C32,C33,C34" numobs="168" mean="119.01" stdev="1.57" mindiff="0.01" Zscore="2.75" obsval="123.33"/>
		<mog-angle-outlier atoms="C31,C32,C33" numobs="117" mean="126.36" stdev="2.74" mindiff="3.35" Zscore="-3.39" obsval="117.05"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="2.40" Zscore="-6.52" obsval="118.14"/>
		<mog-angle-outlier atoms="C39,C29,C30" numobs="181" mean="122.82" stdev="1.62" mindiff="0.09" Zscore="-2.16" obsval="119.32"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="2.61" Zscore="-3.74" obsval="120.70"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="153" mean="127.00" stdev="2.67" mindiff="1.11" Zscore="-2.48" obsval="120.38"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="3.78" Zscore="-6.53" obsval="117.36"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8293" Q_score="0.509" mogul_rmsz_numbonds="42" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.10" mogul_angles_rmsz="2.38" ligand_chirality_outlier="yes" num-H-reduce="56" model="1" chain="2" resnum="616" said="WA" ent="18" seq="." icode=" " resname="RRX" altcode=" ">
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="76.76" stdev="27.49" mindiff="2.99" local_density="0.84" obsval="-141.54"/>
		<mog-torsion-outlier atoms="C37,C22,C23,C24" numobs="316" mean="116.98" stdev="16.94" mindiff="4.27" local_density="1.27" obsval="-125.71"/>
		<mog-torsion-outlier atoms="C21,C22,C23,C24" numobs="313" mean="117.03" stdev="16.97" mindiff="2.95" local_density="1.28" obsval="54.24"/>
		<mog-torsion-outlier atoms="C19,C20,C21,C22" numobs="760" mean="24.66" stdev="12.95" mindiff="0.52" local_density="2.50" obsval="150.82"/>
		<mog-torsion-outlier atoms="C36,C18,C19,C20" numobs="316" mean="75.42" stdev="6.63" mindiff="10.07" local_density="0.00" obsval="81.95"/>
		<mog-torsion-outlier atoms="C17,C18,C19,C20" numobs="313" mean="75.31" stdev="6.15" mindiff="12.58" local_density="0.00" obsval="-98.20"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="150" mean="167.82" stdev="33.00" mindiff="0.01" local_density="3.33" obsval="-0.24"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C36" numobs="160" mean="168.12" stdev="32.00" mindiff="0.36" local_density="3.12" obsval="179.62"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="49.31" stdev="8.27" mindiff="3.64" local_density="0.32" obsval="-125.66"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="49.51" stdev="8.05" mindiff="6.05" local_density="0.32" obsval="54.45"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="22.08" stdev="13.65" mindiff="0.46" local_density="2.89" obsval="153.58"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="132.78" stdev="20.00" mindiff="0.35" local_density="1.28" obsval="-37.95"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C34" numobs="316" mean="132.52" stdev="20.26" mindiff="2.45" local_density="1.58" obsval="141.84"/>
		<mog-bond-outlier atoms="C2,C1" numobs="507" mean="1.54" stdev="0.02" mindiff="0.01" Zscore="5.34" obsval="1.66"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-6.06" obsval="1.46"/>
		<mog-bond-outlier atoms="C32,C1" numobs="4607" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="2.92" obsval="1.59"/>
		<mog-bond-outlier atoms="C2,C3" numobs="10925" mean="1.52" stdev="0.02" mindiff="0.00" Zscore="-6.68" obsval="1.36"/>
		<mog-bond-outlier atoms="C3,C4" numobs="10557" mean="1.52" stdev="0.03" mindiff="0.00" Zscore="4.22" obsval="1.65"/>
		<mog-bond-outlier atoms="C29,C30" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.46" obsval="1.65"/>
		<mog-bond-outlier atoms="C30,C25" numobs="158" mean="1.53" stdev="0.01" mindiff="0.02" Zscore="-5.15" obsval="1.47"/>
		<mog-bond-outlier atoms="C29,C28" numobs="383" mean="1.52" stdev="0.01" mindiff="0.09" Zscore="-10.27" obsval="1.37"/>
		<mog-bond-outlier atoms="C27,C28" numobs="572" mean="1.52" stdev="0.02" mindiff="0.06" Zscore="7.94" obsval="1.66"/>
		<mog-bond-outlier atoms="C27,C26" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-3.91" obsval="1.44"/>
		<mog-bond-outlier atoms="C26,C25" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.45" obsval="1.62"/>
		<mog-bond-outlier atoms="C24,C25" numobs="255" mean="1.45" stdev="0.03" mindiff="0.03" Zscore="3.91" obsval="1.58"/>
		<mog-bond-outlier atoms="C23,C22" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.62" obsval="1.55"/>
		<mog-bond-outlier atoms="C20,C21" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.60" obsval="1.57"/>
		<mog-bond-outlier atoms="C19,C18" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.74" obsval="1.58"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="3.49" obsval="1.54"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.36" obsval="1.56"/>
		<mog-bond-outlier atoms="C35,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.48" obsval="1.55"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.68" obsval="1.56"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.76" obsval="1.54"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="5.00" obsval="1.56"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.01" Zscore="3.19" obsval="1.56"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.19" Zscore="15.13" obsval="1.59"/>
		<mog-bond-outlier atoms="C4,C5" numobs="379" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-3.30" obsval="1.44"/>
		<mog-angle-outlier atoms="C2,C1,C6" numobs="132" mean="110.44" stdev="1.45" mindiff="0.28" Zscore="3.54" obsval="115.59"/>
		<mog-angle-outlier atoms="C38,C26,C25" numobs="104" mean="124.48" stdev="1.09" mindiff="0.16" Zscore="-3.21" obsval="120.98"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="0.97" Zscore="-4.13" obsval="116.99"/>
		<mog-angle-outlier atoms="C30,C25,C24" numobs="118" mean="115.65" stdev="2.71" mindiff="1.30" Zscore="2.81" obsval="123.26"/>
		<mog-angle-outlier atoms="C24,C23,C22" numobs="106" mean="126.23" stdev="1.48" mindiff="1.14" Zscore="-2.75" obsval="122.17"/>
		<mog-angle-outlier atoms="C23,C22,C21" numobs="168" mean="119.01" stdev="1.57" mindiff="0.07" Zscore="2.81" obsval="123.43"/>
		<mog-angle-outlier atoms="C20,C21,C22" numobs="147" mean="127.28" stdev="1.40" mindiff="0.17" Zscore="-4.69" obsval="120.71"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="0.40" Zscore="-2.03" obsval="120.79"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.12" Zscore="2.44" obsval="122.84"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.13" Zscore="-2.60" obsval="118.60"/>
		<mog-angle-outlier atoms="C16,C17,C18" numobs="147" mean="127.28" stdev="1.40" mindiff="0.15" Zscore="-4.92" obsval="120.38"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="2.06" Zscore="-6.28" obsval="118.47"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.23" Zscore="3.53" obsval="124.56"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="3.05" Zscore="-3.29" obsval="117.35"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="0.71" Zscore="-5.32" obsval="119.82"/>
		<mog-angle-outlier atoms="C8,C9,C10" numobs="168" mean="119.01" stdev="1.57" mindiff="0.06" Zscore="2.31" obsval="122.64"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="1.04" Zscore="-2.68" obsval="122.26"/>
		<mog-angle-outlier atoms="C8,C7,C6" numobs="153" mean="127.00" stdev="2.67" mindiff="1.91" Zscore="-2.78" obsval="119.58"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.81" Zscore="-2.68" obsval="118.97"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.57" Zscore="-3.59" obsval="120.56"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="0.57" Zscore="-3.68" obsval="117.73"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.03" Zscore="3.38" obsval="120.80"/>
		<clash atom="H21" dist="1.92" clashmag="0.52" cid="440"/>
		<clash atom="H11" dist="1.92" clashmag="0.52" cid="440"/>
		<clash atom="H26" dist="1.97" clashmag="0.41" cid="441"/>
		<clash atom="H22" dist="1.97" clashmag="0.41" cid="441"/>
		<chiral-outlier problem="WRONG HAND" atom="C28"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7000" Q_score="0.414" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.66" mogul_angles_rmsz="4.62" num-H-reduce="54" model="1" chain="2" resnum="617" said="XA" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="73.46" stdev="48.89" mindiff="17.19" local_density="0.00" obsval="-179.05"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="75.01" stdev="47.94" mindiff="23.24" local_density="0.00" obsval="0.58"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="18.66" stdev="22.37" mindiff="1.27" local_density="1.31" obsval="159.87"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="150" mean="155.70" stdev="30.43" mindiff="3.24" local_density="2.67" obsval="-12.89"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C36" numobs="160" mean="162.27" stdev="31.58" mindiff="1.71" local_density="3.12" obsval="173.69"/>
		<mog-torsion-outlier atoms="C18,C19,C20,C21" numobs="229" mean="167.86" stdev="27.16" mindiff="0.07" local_density="2.62" obsval="2.55"/>
		<mog-torsion-outlier atoms="C20,C21,C22,C23" numobs="150" mean="165.43" stdev="33.00" mindiff="0.77" local_density="3.33" obsval="-2.64"/>
		<mog-torsion-outlier atoms="C20,C21,C22,C37" numobs="160" mean="167.27" stdev="32.00" mindiff="1.15" local_density="3.12" obsval="178.77"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-2.25" obsval="1.50"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.00" Zscore="4.17" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-4.93" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="-4.33" obsval="1.29"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="6.13" obsval="1.51"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="0.61" Zscore="-3.71" obsval="117.69"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.22" Zscore="2.86" obsval="119.70"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.38" Zscore="-3.70" obsval="117.58"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.29" Zscore="-3.19" obsval="117.66"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="13.24" Zscore="11.47" obsval="143.36"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="37.65" Zscore="18.76" obsval="177.55"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="24.97" Zscore="11.00" obsval="156.52"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="0.15" Zscore="-2.06" obsval="124.38"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="19.38" Zscore="12.36" obsval="148.82"/>
		<mog-angle-outlier atoms="C16,C17,C18" numobs="147" mean="127.28" stdev="1.40" mindiff="1.72" Zscore="3.26" obsval="131.85"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="5.55" Zscore="7.37" obsval="130.60"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.09" Zscore="-3.42" obsval="117.28"/>
		<mog-angle-outlier atoms="C36,C18,C19" numobs="317" mean="118.09" stdev="1.53" mindiff="0.09" Zscore="-4.09" obsval="111.84"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="14.30" Zscore="7.11" obsval="145.85"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="6.18" Zscore="7.90" obsval="146.08"/>
		<mog-angle-outlier atoms="C20,C21,C22" numobs="147" mean="127.28" stdev="1.40" mindiff="1.36" Zscore="3.00" obsval="131.48"/>
		<mog-angle-outlier atoms="C23,C22,C21" numobs="168" mean="119.01" stdev="1.57" mindiff="7.72" Zscore="8.75" obsval="132.77"/>
		<mog-angle-outlier atoms="C37,C22,C21" numobs="181" mean="122.82" stdev="1.62" mindiff="1.09" Zscore="-6.91" obsval="111.62"/>
		<mog-angle-outlier atoms="C24,C25,C26" numobs="97" mean="121.56" stdev="2.30" mindiff="0.90" Zscore="-2.53" obsval="115.74"/>
		<mog-angle-outlier atoms="C30,C25,C24" numobs="118" mean="115.65" stdev="2.71" mindiff="1.09" Zscore="2.73" obsval="123.05"/>
		<clash atom="C10" dist="2.27" clashmag="0.63" cid="157"/>
		<clash atom="H362" dist="1.84" clashmag="0.59" cid="159"/>
		<clash atom="H362" dist="2.36" clashmag="0.56" cid="161"/>
		<clash atom="H24C" dist="1.80" clashmag="0.46" cid="164"/>
		<clash atom="H371" dist="1.80" clashmag="0.46" cid="164"/>
		<clash atom="H363" dist="1.96" clashmag="0.46" cid="165"/>
		<clash atom="C15" dist="2.47" clashmag="0.44" cid="166"/>
		<clash atom="H373" dist="2.47" clashmag="0.43" cid="167"/>
		<clash atom="H382" dist="2.49" clashmag="0.43" cid="168"/>
		<clash atom="H15C" dist="1.75" clashmag="0.42" cid="171"/>
		<clash atom="H351" dist="1.75" clashmag="0.42" cid="171"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6897" Q_score="0.414" mogul_rmsz_numbonds="32" mogul_rmsz_numangles="45" mogul_bonds_rmsz="8.49" mogul_angles_rmsz="3.77" ligand_chirality_outlier="yes" num-H-reduce="38" model="1" chain="2" resnum="618" said="YA" ent="20" seq="." icode=" " resname="ERG" altcode=" ">
		<mog-torsion-outlier atoms="C13,C17,C20,C21" numobs="172" mean="21.33" stdev="12.27" mindiff="2.81" local_density="2.91" obsval="80.11"/>
		<mog-torsion-outlier atoms="C13,C17,C20,C22" numobs="170" mean="17.56" stdev="12.18" mindiff="3.99" local_density="3.53" obsval="-158.44"/>
		<mog-torsion-outlier atoms="C16,C17,C20,C21" numobs="172" mean="130.23" stdev="17.82" mindiff="12.92" local_density="0.00" obsval="-41.45"/>
		<mog-torsion-outlier atoms="C16,C17,C20,C22" numobs="170" mean="25.87" stdev="11.21" mindiff="0.77" local_density="0.59" obsval="79.99"/>
		<mog-torsion-outlier atoms="C17,C20,C22,C23" numobs="325" mean="40.07" stdev="12.66" mindiff="0.37" local_density="2.15" obsval="80.48"/>
		<mog-torsion-outlier atoms="C21,C20,C22,C23" numobs="580" mean="50.94" stdev="28.34" mindiff="1.93" local_density="1.38" obsval="-155.85"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="232" mean="47.25" stdev="18.80" mindiff="14.92" local_density="0.00" obsval="97.62"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C27" numobs="232" mean="67.25" stdev="24.04" mindiff="2.28" local_density="1.29" obsval="-142.10"/>
		<mog-torsion-outlier atoms="C28,C24,C25,C26" numobs="232" mean="55.81" stdev="27.91" mindiff="8.19" local_density="0.43" obsval="-143.46"/>
		<mog-torsion-outlier atoms="C28,C24,C25,C27" numobs="232" mean="90.40" stdev="54.78" mindiff="10.96" local_density="0.00" obsval="-23.18"/>
		<mog-bond-outlier atoms="C1,C2" numobs="11083" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="4.52" obsval="1.62"/>
		<mog-bond-outlier atoms="C1,C10" numobs="4870" mean="1.54" stdev="0.02" mindiff="0.28" Zscore="-25.93" obsval="1.06"/>
		<mog-bond-outlier atoms="C2,C3" numobs="2267" mean="1.51" stdev="0.02" mindiff="0.06" Zscore="-12.11" obsval="1.23"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.15" Zscore="-14.06" obsval="1.27"/>
		<mog-bond-outlier atoms="O1,C3" numobs="5081" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="9.36" obsval="1.70"/>
		<mog-bond-outlier atoms="C4,C5" numobs="1331" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="2.17" obsval="1.56"/>
		<mog-bond-outlier atoms="C6,C5" numobs="25" mean="1.34" stdev="0.02" mindiff="0.12" Zscore="8.35" obsval="1.54"/>
		<mog-bond-outlier atoms="C10,C5" numobs="1722" mean="1.52" stdev="0.02" mindiff="0.12" Zscore="-16.67" obsval="1.21"/>
		<mog-bond-outlier atoms="C7,C6" numobs="1692" mean="1.41" stdev="0.03" mindiff="0.00" Zscore="-5.29" obsval="1.27"/>
		<mog-bond-outlier atoms="C7,C8" numobs="20" mean="1.34" stdev="0.02" mindiff="0.03" Zscore="-2.59" obsval="1.28"/>
		<mog-bond-outlier atoms="C9,C8" numobs="262" mean="1.51" stdev="0.02" mindiff="0.02" Zscore="2.74" obsval="1.58"/>
		<mog-bond-outlier atoms="C14,C8" numobs="262" mean="1.51" stdev="0.02" mindiff="0.02" Zscore="2.43" obsval="1.57"/>
		<mog-bond-outlier atoms="C10,C9" numobs="103" mean="1.55" stdev="0.01" mindiff="0.25" Zscore="-23.77" obsval="1.26"/>
		<mog-bond-outlier atoms="C12,C11" numobs="11083" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="-5.53" obsval="1.42"/>
		<mog-bond-outlier atoms="C12,C13" numobs="8370" mean="1.54" stdev="0.02" mindiff="0.00" Zscore="8.83" obsval="1.69"/>
		<mog-bond-outlier atoms="C13,C14" numobs="508" mean="1.56" stdev="0.02" mindiff="0.03" Zscore="-5.33" obsval="1.47"/>
		<mog-bond-outlier atoms="C13,C17" numobs="4414" mean="1.55" stdev="0.02" mindiff="0.00" Zscore="4.27" obsval="1.62"/>
		<mog-bond-outlier atoms="C16,C15" numobs="9498" mean="1.54" stdev="0.03" mindiff="0.00" Zscore="3.97" obsval="1.64"/>
		<mog-bond-outlier atoms="C16,C17" numobs="9405" mean="1.54" stdev="0.02" mindiff="0.00" Zscore="-6.40" obsval="1.41"/>
		<mog-angle-outlier atoms="C2,C3,C4" numobs="475" mean="110.29" stdev="1.41" mindiff="0.06" Zscore="2.78" obsval="114.20"/>
		<mog-angle-outlier atoms="C10,C5,C6" numobs="564" mean="122.60" stdev="1.68" mindiff="0.13" Zscore="-2.26" obsval="118.81"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="21" mean="122.95" stdev="2.06" mindiff="2.09" Zscore="-3.45" obsval="115.84"/>
		<mog-angle-outlier atoms="C14,C8,C9" numobs="69" mean="114.46" stdev="1.59" mindiff="0.32" Zscore="2.19" obsval="117.95"/>
		<mog-angle-outlier atoms="C1,C10,C5" numobs="1633" mean="108.74" stdev="1.72" mindiff="0.71" Zscore="3.65" obsval="115.04"/>
		<mog-angle-outlier atoms="C1,C10,C9" numobs="32" mean="108.39" stdev="1.94" mindiff="5.90" Zscore="5.20" obsval="118.49"/>
		<mog-angle-outlier atoms="C19,C10,C1" numobs="3767" mean="109.43" stdev="1.52" mindiff="0.28" Zscore="-5.00" obsval="101.83"/>
		<mog-angle-outlier atoms="C9,C10,C5" numobs="21" mean="109.66" stdev="1.59" mindiff="4.36" Zscore="4.47" obsval="116.78"/>
		<mog-angle-outlier atoms="C19,C10,C5" numobs="1722" mean="108.38" stdev="1.53" mindiff="0.14" Zscore="-4.82" obsval="101.02"/>
		<mog-angle-outlier atoms="C19,C10,C9" numobs="102" mean="110.98" stdev="1.66" mindiff="7.68" Zscore="-7.45" obsval="98.61"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="158" mean="107.19" stdev="1.51" mindiff="2.90" Zscore="5.53" obsval="115.53"/>
		<mog-angle-outlier atoms="C12,C13,C17" numobs="1505" mean="116.60" stdev="1.47" mindiff="0.02" Zscore="-3.00" obsval="112.18"/>
		<mog-angle-outlier atoms="C18,C13,C12" numobs="2986" mean="110.61" stdev="1.47" mindiff="0.01" Zscore="-4.58" obsval="103.86"/>
		<mog-angle-outlier atoms="C14,C13,C17" numobs="391" mean="99.72" stdev="1.05" mindiff="6.03" Zscore="9.48" obsval="109.63"/>
		<mog-angle-outlier atoms="C18,C13,C14" numobs="508" mean="110.35" stdev="1.66" mindiff="0.18" Zscore="-3.51" obsval="104.51"/>
		<mog-angle-outlier atoms="C13,C14,C8" numobs="58" mean="113.59" stdev="1.76" mindiff="0.37" Zscore="2.65" obsval="118.26"/>
		<mog-angle-outlier atoms="C15,C14,C8" numobs="63" mean="120.42" stdev="1.36" mindiff="15.83" Zscore="-15.30" obsval="99.66"/>
		<mog-angle-outlier atoms="C13,C17,C20" numobs="129" mean="119.38" stdev="1.20" mindiff="0.03" Zscore="-2.85" obsval="115.97"/>
		<mog-angle-outlier atoms="C17,C20,C22" numobs="174" mean="110.49" stdev="1.96" mindiff="0.23" Zscore="-2.17" obsval="106.22"/>
		<mog-angle-outlier atoms="C20,C22,C23" numobs="309" mean="125.81" stdev="3.03" mindiff="0.08" Zscore="-2.46" obsval="118.37"/>
		<clash atom="O1" dist="1.70" clashmag="1.37" cid="5"/>
		<clash atom="O1" dist="2.42" clashmag="0.56" cid="6"/>
		<clash atom="O1" dist="2.40" clashmag="0.55" cid="7"/>
		<clash atom="C3" dist="1.70" clashmag="1.37" cid="5"/>
		<clash atom="C3" dist="2.13" clashmag="0.50" cid="8"/>
		<clash atom="C4" dist="2.42" clashmag="0.56" cid="6"/>
		<clash atom="C2" dist="2.40" clashmag="0.55" cid="7"/>
		<clash atom="HO1" dist="2.13" clashmag="0.50" cid="8"/>
		<chiral-outlier problem="WRONG HAND" atom="C9"/>
		<chiral-outlier problem="WRONG HAND" atom="C24"/>
		<chiral-outlier problem="WRONG HAND" atom="C20"/>
		<chiral-outlier problem="WRONG HAND" atom="C14"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7429" Q_score="0.448" mogul_rmsz_numbonds="34" mogul_rmsz_numangles="37" mogul_bonds_rmsz="1.48" mogul_angles_rmsz="1.05" ligand_chirality_outlier="yes" num-H-reduce="40" model="1" chain="2" resnum="619" said="ZA" ent="22" seq="." icode=" " resname="PGT" altcode=" ">
		<mog-torsion-outlier atoms="C42,C43,C44,C45" numobs="15585" mean="51.95" stdev="9.10" mindiff="0.12" local_density="0.85" obsval="121.21"/>
		<mog-torsion-outlier atoms="C40,C41,C42,C43" numobs="15585" mean="61.60" stdev="12.59" mindiff="0.06" local_density="0.76" obsval="107.54"/>
		<mog-torsion-outlier atoms="C39,C40,C41,C42" numobs="15585" mean="52.75" stdev="9.08" mindiff="0.08" local_density="0.83" obsval="-120.06"/>
		<mog-torsion-outlier atoms="C37,C38,C39,C40" numobs="15585" mean="50.06" stdev="9.42" mindiff="0.09" local_density="0.89" obsval="-123.89"/>
		<mog-torsion-outlier atoms="C35,C36,C37,C38" numobs="15585" mean="76.40" stdev="24.11" mindiff="0.00" local_density="2.05" obsval="-87.00"/>
		<mog-torsion-outlier atoms="C33,C34,C35,C36" numobs="15585" mean="79.26" stdev="26.38" mindiff="0.02" local_density="3.13" obsval="83.11"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C34" numobs="4310" mean="66.09" stdev="25.34" mindiff="0.19" local_density="1.53" obsval="-92.58"/>
		<mog-torsion-outlier atoms="C32,C31,O2,C2" numobs="1189" mean="48.26" stdev="5.34" mindiff="0.57" local_density="0.25" obsval="-124.87"/>
		<mog-torsion-outlier atoms="O31,C31,O2,C2" numobs="1497" mean="48.51" stdev="5.49" mindiff="0.86" local_density="0.47" obsval="55.29"/>
		<mog-torsion-outlier atoms="O3P,C1,C2,O2" numobs="299" mean="61.10" stdev="26.23" mindiff="2.85" local_density="1.67" obsval="142.70"/>
		<mog-torsion-outlier atoms="O3P,C1,C2,C3" numobs="265" mean="50.45" stdev="19.52" mindiff="0.12" local_density="1.51" obsval="-98.77"/>
		<mog-torsion-outlier atoms="O2,C2,C3,O3" numobs="291" mean="63.51" stdev="31.22" mindiff="2.49" local_density="2.41" obsval="-149.07"/>
		<mog-torsion-outlier atoms="C1,C2,C3,O3" numobs="248" mean="48.07" stdev="22.90" mindiff="1.13" local_density="2.82" obsval="93.41"/>
		<mog-torsion-outlier atoms="C4,O4P,P,O3P" numobs="40" mean="43.11" stdev="19.89" mindiff="10.47" local_density="0.00" obsval="101.33"/>
		<mog-torsion-outlier atoms="C4,O4P,P,O1P" numobs="40" mean="64.76" stdev="33.94" mindiff="5.28" local_density="2.50" obsval="-141.76"/>
		<mog-torsion-outlier atoms="C4,O4P,P,O2P" numobs="40" mean="85.98" stdev="54.48" mindiff="15.55" local_density="0.00" obsval="-15.27"/>
		<mog-torsion-outlier atoms="C4,C5,C6,O6" numobs="154" mean="54.91" stdev="18.25" mindiff="25.58" local_density="0.00" obsval="-132.99"/>
		<mog-torsion-outlier atoms="O5,C5,C6,O6" numobs="272" mean="66.54" stdev="43.52" mindiff="2.22" local_density="1.10" obsval="-16.39"/>
		<mog-torsion-outlier atoms="O11,C11,O3,C3" numobs="5079" mean="105.23" stdev="10.14" mindiff="3.10" local_density="0.12" obsval="112.89"/>
		<mog-torsion-outlier atoms="C12,C11,O3,C3" numobs="5078" mean="106.49" stdev="9.73" mindiff="0.09" local_density="0.14" obsval="-66.47"/>
		<mog-bond-outlier atoms="O2,C31" numobs="1553" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="2.11" obsval="1.40"/>
		<mog-bond-outlier atoms="C1,C2" numobs="780" mean="1.50" stdev="0.03" mindiff="0.00" Zscore="2.84" obsval="1.59"/>
		<mog-bond-outlier atoms="C3,C2" numobs="780" mean="1.50" stdev="0.03" mindiff="0.01" Zscore="3.06" obsval="1.60"/>
		<mog-bond-outlier atoms="P,O3P" numobs="40" mean="1.59" stdev="0.04" mindiff="0.02" Zscore="3.23" obsval="1.72"/>
		<mog-bond-outlier atoms="P,O4P" numobs="40" mean="1.59" stdev="0.04" mindiff="0.01" Zscore="3.00" obsval="1.71"/>
		<mog-bond-outlier atoms="C4,C5" numobs="653" mean="1.51" stdev="0.03" mindiff="0.01" Zscore="2.14" obsval="1.58"/>
		<mog-angle-outlier atoms="O2,C31,C32" numobs="587" mean="111.48" stdev="2.16" mindiff="0.31" Zscore="4.84" obsval="121.95"/>
		<mog-angle-outlier atoms="O2,C31,O31" numobs="1542" mean="123.70" stdev="2.34" mindiff="0.03" Zscore="-2.64" obsval="117.53"/>
		<chiral-outlier problem="WRONG HAND" atom="C5"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.5000" Q_score="0.433" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="45" mogul_bonds_rmsz="1.20" mogul_angles_rmsz="1.16" num-H-reduce="76" model="1" chain="2" resnum="620" said="AB" ent="23" seq="." icode=" " resname="DGA" altcode=" ">
		<mog-torsion-outlier atoms="CA1,CA2,CA3,CA4" numobs="4310" mean="47.31" stdev="12.60" mindiff="1.50" local_density="0.39" obsval="131.81"/>
		<mog-torsion-outlier atoms="CA2,CA3,CA4,CA5" numobs="15585" mean="49.51" stdev="9.59" mindiff="0.04" local_density="0.90" obsval="124.68"/>
		<mog-torsion-outlier atoms="CA4,CA5,CA6,CA7" numobs="15585" mean="58.89" stdev="10.96" mindiff="0.03" local_density="0.72" obsval="111.35"/>
		<mog-torsion-outlier atoms="CA5,CA6,CA7,CA8" numobs="15585" mean="56.95" stdev="10.07" mindiff="0.13" local_density="0.72" obsval="114.10"/>
		<mog-torsion-outlier atoms="CA6,CA7,CA8,CA9" numobs="15585" mean="49.15" stdev="9.70" mindiff="0.03" local_density="0.91" obsval="125.19"/>
		<mog-torsion-outlier atoms="CA8,CA9,CAA,CBA" numobs="15585" mean="68.73" stdev="17.88" mindiff="0.03" local_density="0.99" obsval="-97.57"/>
		<mog-torsion-outlier atoms="CA9,CAA,CBA,CCA" numobs="15585" mean="36.86" stdev="18.03" mindiff="0.01" local_density="1.73" obsval="143.05"/>
		<mog-torsion-outlier atoms="CAA,CBA,CCA,CDA" numobs="15585" mean="55.25" stdev="9.49" mindiff="0.02" local_density="0.77" obsval="116.50"/>
		<mog-torsion-outlier atoms="CEA,CFA,CGA,CHA" numobs="15585" mean="67.61" stdev="16.99" mindiff="0.03" local_density="0.94" obsval="-99.13"/>
		<mog-torsion-outlier atoms="CFA,CGA,CHA,CIA" numobs="12796" mean="77.41" stdev="29.02" mindiff="0.01" local_density="4.24" obsval="-81.45"/>
		<mog-torsion-outlier atoms="CB2,CB1,OG2,CG2" numobs="1189" mean="107.39" stdev="6.16" mindiff="5.34" local_density="0.08" obsval="65.63"/>
		<mog-torsion-outlier atoms="OB1,CB1,OG2,CG2" numobs="1497" mean="107.92" stdev="6.15" mindiff="23.56" local_density="0.00" obsval="-114.77"/>
		<mog-torsion-outlier atoms="CB1,CB2,CB3,CB4" numobs="4310" mean="47.61" stdev="12.17" mindiff="2.14" local_density="0.44" obsval="131.17"/>
		<mog-torsion-outlier atoms="CB5,CB6,CB7,CB8" numobs="15585" mean="48.95" stdev="9.77" mindiff="0.04" local_density="0.90" obsval="-125.48"/>
		<mog-torsion-outlier atoms="CB7,CB8,CB9,CAB" numobs="15585" mean="67.19" stdev="16.65" mindiff="0.03" local_density="0.89" obsval="99.72"/>
		<mog-torsion-outlier atoms="CBB,CAB,CB9,CB8" numobs="15585" mean="81.34" stdev="27.96" mindiff="0.01" local_density="4.30" obsval="80.33"/>
		<mog-torsion-outlier atoms="CB9,CAB,CBB,CCB" numobs="15585" mean="41.56" stdev="14.13" mindiff="0.04" local_density="1.32" obsval="-136.15"/>
		<mog-torsion-outlier atoms="CAB,CBB,CCB,CDB" numobs="15585" mean="80.24" stdev="27.12" mindiff="0.01" local_density="3.61" obsval="-81.81"/>
		<mog-torsion-outlier atoms="CDB,CEB,CFB,CGB" numobs="15585" mean="72.91" stdev="21.25" mindiff="0.01" local_density="1.35" obsval="91.79"/>
		<mog-torsion-outlier atoms="CFB,CGB,CHB,CIB" numobs="12796" mean="77.41" stdev="29.01" mindiff="0.00" local_density="4.24" obsval="81.46"/>
		<mog-torsion-outlier atoms="CG1,CG2,CG3,OXT" numobs="61" mean="53.64" stdev="49.70" mindiff="4.34" local_density="4.92" obsval="37.67"/>
		<mog-torsion-outlier atoms="OG2,CG2,CG3,OXT" numobs="55" mean="74.09" stdev="30.87" mindiff="10.22" local_density="0.00" obsval="155.80"/>
		<mog-bond-outlier atoms="OG1,CA1" numobs="4555" mean="1.33" stdev="0.03" mindiff="0.00" Zscore="3.46" obsval="1.43"/>
		<mog-bond-outlier atoms="OG2,CB1" numobs="1553" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="3.43" obsval="1.44"/>
		<mog-bond-outlier atoms="OG2,CG2" numobs="2309" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="-2.23" obsval="1.41"/>
		<mog-angle-outlier atoms="OG1,CA1,CA2" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.05" Zscore="2.54" obsval="119.57"/>
		<mog-angle-outlier atoms="OG2,CB1,CB2" numobs="587" mean="111.48" stdev="2.16" mindiff="0.83" Zscore="4.32" obsval="120.82"/>
		<mog-angle-outlier atoms="CDB,CCB,CBB" numobs="14558" mean="114.37" stdev="5.05" mindiff="0.00" Zscore="-3.03" obsval="99.07"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.5862" Q_score="0.349" mogul_rmsz_numbonds="32" mogul_rmsz_numangles="45" mogul_bonds_rmsz="8.46" mogul_angles_rmsz="3.14" ligand_chirality_outlier="yes" num-H-reduce="38" model="1" chain="2" resnum="621" said="BB" ent="20" seq="." icode=" " resname="ERG" altcode=" ">
		<mog-torsion-outlier atoms="C13,C17,C20,C22" numobs="170" mean="96.27" stdev="14.46" mindiff="12.18" local_density="0.00" obsval="75.15"/>
		<mog-torsion-outlier atoms="C17,C20,C22,C23" numobs="325" mean="41.10" stdev="13.28" mindiff="3.09" local_density="0.92" obsval="161.40"/>
		<mog-torsion-outlier atoms="C22,C23,C24,C25" numobs="325" mean="39.48" stdev="13.25" mindiff="2.25" local_density="0.92" obsval="159.78"/>
		<mog-torsion-outlier atoms="C22,C23,C24,C28" numobs="580" mean="69.11" stdev="20.17" mindiff="0.36" local_density="0.69" obsval="38.95"/>
		<mog-bond-outlier atoms="C1,C2" numobs="11083" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="4.32" obsval="1.62"/>
		<mog-bond-outlier atoms="C1,C10" numobs="4870" mean="1.54" stdev="0.02" mindiff="0.28" Zscore="-25.94" obsval="1.06"/>
		<mog-bond-outlier atoms="C2,C3" numobs="2267" mean="1.51" stdev="0.02" mindiff="0.06" Zscore="-12.22" obsval="1.23"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.15" Zscore="-14.03" obsval="1.27"/>
		<mog-bond-outlier atoms="O1,C3" numobs="5081" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="9.33" obsval="1.70"/>
		<mog-bond-outlier atoms="C4,C5" numobs="1331" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="2.30" obsval="1.56"/>
		<mog-bond-outlier atoms="C6,C5" numobs="25" mean="1.34" stdev="0.02" mindiff="0.12" Zscore="8.34" obsval="1.53"/>
		<mog-bond-outlier atoms="C10,C5" numobs="1722" mean="1.52" stdev="0.02" mindiff="0.11" Zscore="-16.52" obsval="1.21"/>
		<mog-bond-outlier atoms="C7,C6" numobs="1692" mean="1.41" stdev="0.03" mindiff="0.00" Zscore="-5.43" obsval="1.27"/>
		<mog-bond-outlier atoms="C7,C8" numobs="20" mean="1.34" stdev="0.02" mindiff="0.03" Zscore="-2.46" obsval="1.28"/>
		<mog-bond-outlier atoms="C9,C8" numobs="262" mean="1.51" stdev="0.02" mindiff="0.03" Zscore="3.04" obsval="1.59"/>
		<mog-bond-outlier atoms="C14,C8" numobs="262" mean="1.51" stdev="0.02" mindiff="0.01" Zscore="2.39" obsval="1.57"/>
		<mog-bond-outlier atoms="C10,C9" numobs="103" mean="1.55" stdev="0.01" mindiff="0.24" Zscore="-23.27" obsval="1.26"/>
		<mog-bond-outlier atoms="C11,C9" numobs="1575" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="2.28" obsval="1.57"/>
		<mog-bond-outlier atoms="C12,C11" numobs="11083" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="-5.27" obsval="1.42"/>
		<mog-bond-outlier atoms="C12,C13" numobs="8370" mean="1.54" stdev="0.02" mindiff="0.00" Zscore="8.73" obsval="1.69"/>
		<mog-bond-outlier atoms="C13,C14" numobs="508" mean="1.56" stdev="0.02" mindiff="0.04" Zscore="-6.17" obsval="1.46"/>
		<mog-bond-outlier atoms="C13,C17" numobs="4414" mean="1.55" stdev="0.02" mindiff="0.00" Zscore="4.21" obsval="1.62"/>
		<mog-bond-outlier atoms="C16,C15" numobs="9498" mean="1.54" stdev="0.03" mindiff="0.00" Zscore="4.08" obsval="1.65"/>
		<mog-bond-outlier atoms="C16,C17" numobs="9405" mean="1.54" stdev="0.02" mindiff="0.00" Zscore="-6.19" obsval="1.41"/>
		<mog-angle-outlier atoms="C2,C3,C4" numobs="475" mean="110.29" stdev="1.41" mindiff="0.02" Zscore="2.45" obsval="113.74"/>
		<mog-angle-outlier atoms="C10,C5,C6" numobs="564" mean="122.60" stdev="1.68" mindiff="0.03" Zscore="-2.35" obsval="118.65"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="21" mean="122.95" stdev="2.06" mindiff="2.67" Zscore="-3.73" obsval="115.26"/>
		<mog-angle-outlier atoms="C1,C10,C5" numobs="1633" mean="108.74" stdev="1.72" mindiff="0.97" Zscore="3.80" obsval="115.30"/>
		<mog-angle-outlier atoms="C1,C10,C9" numobs="32" mean="108.39" stdev="1.94" mindiff="6.23" Zscore="5.37" obsval="118.82"/>
		<mog-angle-outlier atoms="C19,C10,C1" numobs="3767" mean="109.43" stdev="1.52" mindiff="0.04" Zscore="-6.76" obsval="99.15"/>
		<mog-angle-outlier atoms="C9,C10,C5" numobs="21" mean="109.66" stdev="1.59" mindiff="4.91" Zscore="4.81" obsval="117.33"/>
		<mog-angle-outlier atoms="C19,C10,C5" numobs="1722" mean="108.38" stdev="1.53" mindiff="0.20" Zscore="-4.43" obsval="101.62"/>
		<mog-angle-outlier atoms="C19,C10,C9" numobs="102" mean="110.98" stdev="1.66" mindiff="7.55" Zscore="-7.37" obsval="98.74"/>
		<mog-angle-outlier atoms="C12,C13,C17" numobs="1505" mean="116.60" stdev="1.47" mindiff="0.03" Zscore="2.12" obsval="119.72"/>
		<mog-angle-outlier atoms="C18,C13,C12" numobs="2986" mean="110.61" stdev="1.47" mindiff="0.12" Zscore="-3.21" obsval="105.87"/>
		<mog-angle-outlier atoms="C14,C13,C17" numobs="391" mean="99.72" stdev="1.05" mindiff="1.16" Zscore="4.83" obsval="104.77"/>
		<mog-angle-outlier atoms="C18,C13,C14" numobs="508" mean="110.35" stdev="1.66" mindiff="0.39" Zscore="-2.39" obsval="106.39"/>
		<mog-angle-outlier atoms="C15,C14,C8" numobs="63" mean="120.42" stdev="1.36" mindiff="11.72" Zscore="-12.27" obsval="103.78"/>
		<mog-angle-outlier atoms="C13,C17,C20" numobs="129" mean="119.38" stdev="1.20" mindiff="0.55" Zscore="-2.09" obsval="116.88"/>
		<mog-angle-outlier atoms="C17,C20,C22" numobs="174" mean="110.49" stdev="1.96" mindiff="0.26" Zscore="2.97" obsval="116.31"/>
		<mog-angle-outlier atoms="C20,C22,C23" numobs="309" mean="125.81" stdev="3.03" mindiff="0.10" Zscore="-2.70" obsval="117.65"/>
		<clash atom="C3" dist="1.70" clashmag="1.39" cid="0"/>
		<clash atom="C3" dist="2.13" clashmag="0.46" cid="4"/>
		<clash atom="O1" dist="1.70" clashmag="1.39" cid="0"/>
		<clash atom="O1" dist="2.38" clashmag="0.65" cid="1"/>
		<clash atom="O1" dist="2.41" clashmag="0.62" cid="2"/>
		<clash atom="C2" dist="2.38" clashmag="0.65" cid="1"/>
		<clash atom="C4" dist="2.41" clashmag="0.62" cid="2"/>
		<clash atom="H122" dist="1.88" clashmag="0.54" cid="3"/>
		<clash atom="H212" dist="1.88" clashmag="0.54" cid="3"/>
		<clash atom="HO1" dist="2.13" clashmag="0.46" cid="4"/>
		<chiral-outlier problem="PLANAR" atom="C10"/>
		<chiral-outlier problem="WRONG HAND" atom="C14"/>
		<chiral-outlier problem="WRONG HAND" atom="C20"/>
		<chiral-outlier problem="WRONG HAND" atom="C24"/>
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		<mog-angle-outlier atoms="C35,C34,C33" numobs="147" mean="127.28" stdev="1.40" mindiff="0.20" Zscore="-4.67" obsval="120.73"/>
		<mog-angle-outlier atoms="C31,C32,C33" numobs="117" mean="126.36" stdev="2.74" mindiff="0.47" Zscore="-2.01" obsval="120.86"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="0.10" Zscore="-4.74" obsval="120.63"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="3.29" Zscore="-4.21" obsval="120.01"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="153" mean="127.00" stdev="2.67" mindiff="1.07" Zscore="-2.46" obsval="120.42"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="1.12" Zscore="-4.09" obsval="120.02"/>
		<mog-angle-outlier atoms="C38,C25,C24" numobs="328" mean="114.42" stdev="1.84" mindiff="0.32" Zscore="2.87" obsval="119.70"/>
		<clash atom="C14" dist="2.28" clashmag="0.63" cid="158"/>
		<clash atom="C35" dist="2.47" clashmag="0.43" cid="167"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.5714" Q_score="0.403" mogul_rmsz_numbonds="36" mogul_rmsz_numangles="47" mogul_bonds_rmsz="0.46" mogul_angles_rmsz="0.75" num-H-reduce="46" model="1" chain="3" resnum="202" said="EB" ent="24" seq="." icode=" " resname="LMU" altcode=" ">
		<mog-torsion-outlier atoms="C2B,C1B,O1B,C4'" numobs="9212" mean="26.96" stdev="13.19" mindiff="0.01" local_density="3.90" obsval="105.95"/>
		<mog-torsion-outlier atoms="O5B,C1B,O1B,C4'" numobs="9298" mean="88.72" stdev="13.67" mindiff="1.24" local_density="0.03" obsval="-17.42"/>
		<mog-torsion-outlier atoms="C4B,C5B,C6B,O6B" numobs="8417" mean="61.83" stdev="49.80" mindiff="0.01" local_density="0.24" obsval="-23.38"/>
		<mog-torsion-outlier atoms="O5B,C5B,C6B,O6B" numobs="8455" mean="80.57" stdev="10.93" mindiff="1.70" local_density="0.15" obsval="-146.27"/>
		<mog-torsion-outlier atoms="C3',C4',O1B,C1B" numobs="10847" mean="41.28" stdev="14.64" mindiff="0.05" local_density="1.98" obsval="78.47"/>
		<mog-torsion-outlier atoms="C5',C4',O1B,C1B" numobs="10847" mean="41.70" stdev="15.06" mindiff="0.12" local_density="1.95" obsval="-161.05"/>
		<mog-torsion-outlier atoms="C2',C1',O1',C1" numobs="332" mean="90.40" stdev="14.51" mindiff="0.13" local_density="0.90" obsval="-74.34"/>
		<mog-torsion-outlier atoms="O5',C1',O1',C1" numobs="448" mean="90.35" stdev="9.99" mindiff="32.14" local_density="0.00" obsval="162.03"/>
		<mog-torsion-outlier atoms="C2,C1,O1',C1'" numobs="136" mean="35.04" stdev="8.78" mindiff="0.92" local_density="1.47" obsval="-133.10"/>
		<mog-torsion-outlier atoms="C1,C2,C3,C4" numobs="7937" mean="67.93" stdev="19.23" mindiff="0.08" local_density="1.40" obsval="96.94"/>
		<mog-torsion-outlier atoms="C3,C4,C5,C6" numobs="15585" mean="79.43" stdev="26.51" mindiff="0.04" local_density="3.21" obsval="82.88"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="15585" mean="55.80" stdev="9.66" mindiff="0.01" local_density="0.74" obsval="115.72"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="12796" mean="42.09" stdev="17.69" mindiff="0.03" local_density="2.02" obsval="-136.51"/>
		<clash atom="O5B" dist="2.16" clashmag="0.58" cid="378"/>
		<clash atom="O3'" dist="2.16" clashmag="0.58" cid="378"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.5846" Q_score="0.321" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.94" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="3" resnum="203" said="FB" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="98.36" stdev="45.47" mindiff="0.03" local_density="4.85" obsval="-36.56"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="99.01" stdev="6.94" mindiff="8.24" local_density="0.04" obsval="-74.39"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="98.54" stdev="6.89" mindiff="8.35" local_density="0.02" obsval="105.21"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="72.56" stdev="39.82" mindiff="3.37" local_density="3.36" obsval="-54.62"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="70.55" stdev="36.95" mindiff="3.22" local_density="2.96" obsval="124.78"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="10552" mean="26.04" stdev="9.37" mindiff="0.01" local_density="1.98" obsval="-120.15"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="78.65" stdev="37.56" mindiff="0.37" local_density="5.00" obsval="-144.63"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="77.09" stdev="39.37" mindiff="1.43" local_density="5.00" obsval="36.22"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="40" mean="43.01" stdev="27.41" mindiff="2.11" local_density="5.00" obsval="100.79"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O2D" numobs="41" mean="42.99" stdev="29.21" mindiff="0.21" local_density="4.88" obsval="-78.36"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="23.99" stdev="1.70" mindiff="0.17" local_density="0.19" obsval="-150.77"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="24.76" stdev="3.06" mindiff="0.09" local_density="0.59" obsval="30.07"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="51.38" stdev="45.58" mindiff="0.16" local_density="4.13" obsval="-41.13"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="62.44" stdev="12.20" mindiff="0.36" local_density="0.53" obsval="105.81"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="51.89" stdev="13.73" mindiff="1.46" local_density="1.14" obsval="113.58"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="81.30" stdev="45.79" mindiff="4.46" local_density="0.29" obsval="-11.01"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="75.49" stdev="21.27" mindiff="0.10" local_density="1.75" obsval="88.68"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="53.89" stdev="17.97" mindiff="0.36" local_density="1.01" obsval="102.77"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="54.89" stdev="21.50" mindiff="0.25" local_density="0.62" obsval="-133.68"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.35" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.91" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.19" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.58" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.40" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.04" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.14" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.84" Zscore="9.85" obsval="111.17"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.08" Zscore="-2.13" obsval="121.57"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.28" Zscore="3.64" obsval="121.56"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.12" Zscore="2.34" obsval="118.97"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.15" Zscore="-2.72" obsval="108.11"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.05" Zscore="2.57" obsval="112.68"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.28" Zscore="-2.60" obsval="104.25"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.24" Zscore="2.16" obsval="112.27"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.84" Zscore="-2.17" obsval="102.86"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.73" Zscore="5.39" obsval="134.22"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.10" Zscore="-2.08" obsval="122.91"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.11" Zscore="2.50" obsval="137.70"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.16" Zscore="-2.02" obsval="120.53"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.36" Zscore="5.27" obsval="120.45"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.48" obsval="119.02"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.18" Zscore="3.30" obsval="120.79"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.43" Zscore="-2.70" obsval="121.78"/>
		<clash atom="HBC3" dist="1.92" clashmag="0.51" cid="457"/>
		<clash atom="HHD" dist="1.92" clashmag="0.51" cid="457"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9524" Q_score="0.566" mogul_rmsz_numbonds="67" mogul_rmsz_numangles="79" mogul_bonds_rmsz="1.38" mogul_angles_rmsz="1.82" ligand_chirality_outlier="yes" num-H-reduce="65" model="1" chain="3" resnum="204" said="GB" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="62.49" stdev="21.67" mindiff="0.90" local_density="1.50" obsval="97.44"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="51.45" stdev="5.06" mindiff="0.80" local_density="0.27" obsval="122.20"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="52.40" stdev="5.63" mindiff="0.34" local_density="0.33" obsval="-58.91"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="36.79" stdev="14.80" mindiff="0.92" local_density="4.56" obsval="-137.55"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="62.70" stdev="1.92" mindiff="4.94" local_density="0.02" obsval="-112.04"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="62.47" stdev="2.93" mindiff="0.38" local_density="0.04" obsval="67.90"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="54.97" stdev="25.59" mindiff="0.18" local_density="4.18" obsval="-94.54"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="62.54" stdev="27.51" mindiff="0.88" local_density="3.83" obsval="143.02"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.03" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.91" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.78" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.16" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.05" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.06" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.40" Zscore="8.87" obsval="110.73"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.06" Zscore="2.47" obsval="119.35"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.29" Zscore="-2.88" obsval="107.96"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.16" Zscore="2.44" obsval="112.54"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.26" Zscore="-2.58" obsval="104.27"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.15" Zscore="-2.04" obsval="121.93"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="2.01" Zscore="5.56" obsval="134.51"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.07" Zscore="-2.49" obsval="121.98"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.13" Zscore="2.38" obsval="137.46"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.13" Zscore="5.14" obsval="120.22"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.46" obsval="119.06"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.37" Zscore="3.08" obsval="119.97"/>
		<clash atom="H42" dist="1.92" clashmag="0.51" cid="442"/>
		<clash atom="HAB" dist="2.57" clashmag="0.45" cid="446"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6462" Q_score="0.473" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="2.09" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="3" resnum="205" said="HB" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="76.14" stdev="32.18" mindiff="10.58" local_density="0.00" obsval="-78.11"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="76.49" stdev="21.09" mindiff="2.69" local_density="3.10" obsval="150.47"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="64.61" stdev="24.77" mindiff="0.28" local_density="3.32" obsval="-93.38"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="119.33" stdev="54.59" mindiff="0.01" local_density="4.68" obsval="-174.27"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="127.32" stdev="49.58" mindiff="0.16" local_density="2.01" obsval="5.59"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="96.58" stdev="39.47" mindiff="11.19" local_density="0.00" obsval="-37.12"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="32.45" stdev="17.32" mindiff="0.43" local_density="4.46" obsval="-99.10"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="35.46" stdev="16.67" mindiff="0.11" local_density="1.48" obsval="141.99"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="83.90" stdev="27.02" mindiff="0.04" local_density="4.44" obsval="77.94"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="52.77" stdev="45.59" mindiff="0.91" local_density="3.24" obsval="39.72"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="55.96" stdev="38.75" mindiff="0.02" local_density="4.09" obsval="-153.41"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.35" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.91" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.02" Zscore="2.26" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.68" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.21" obsval="1.32"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="4.61" Zscore="11.53" obsval="111.94"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.10" Zscore="-2.13" obsval="121.56"/>
		<mog-angle-outlier atoms="C2A,C1A,CHA" numobs="188" mean="123.87" stdev="1.74" mindiff="0.26" Zscore="3.72" obsval="130.32"/>
		<mog-angle-outlier atoms="C3A,C2A,C1A" numobs="31" mean="101.34" stdev="1.50" mindiff="2.35" Zscore="3.51" obsval="106.59"/>
		<mog-angle-outlier atoms="CAA,C2A,C1A" numobs="31" mean="111.97" stdev="3.28" mindiff="5.60" Zscore="4.37" obsval="126.30"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.83" Zscore="2.86" obsval="119.45"/>
		<mog-angle-outlier atoms="CBA,CAA,C2A" numobs="171" mean="113.79" stdev="2.98" mindiff="0.31" Zscore="2.48" obsval="121.16"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.10" Zscore="2.59" obsval="119.72"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.03" Zscore="2.65" obsval="112.77"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.06" Zscore="-2.39" obsval="104.46"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.66" Zscore="-2.04" obsval="103.04"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.61" Zscore="5.33" obsval="134.11"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.19" Zscore="-2.12" obsval="122.82"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.26" Zscore="2.57" obsval="137.85"/>
		<mog-angle-outlier atoms="OBD,CAD,C3D" numobs="108" mean="128.42" stdev="2.34" mindiff="0.26" Zscore="-2.07" obsval="123.57"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.01" Zscore="4.50" obsval="119.10"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.21" obsval="119.55"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="3.51" Zscore="2.60" obsval="118.11"/>
		<clash atom="HBB2" dist="1.67" clashmag="0.77" cid="174"/>
		<clash atom="HBB1" dist="1.91" clashmag="0.52" cid="176"/>
		<clash atom="HMB3" dist="1.91" clashmag="0.52" cid="176"/>
		<clash atom="HMC3" dist="2.03" clashmag="0.40" cid="180"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7385" Q_score="0.501" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.82" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="3" resnum="206" said="IB" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="55.91" stdev="22.41" mindiff="0.02" local_density="4.82" obsval="-80.22"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="56.19" stdev="21.43" mindiff="0.09" local_density="4.43" obsval="98.94"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="101.07" stdev="37.60" mindiff="22.07" local_density="0.00" obsval="-167.07"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="100.15" stdev="39.49" mindiff="24.55" local_density="0.00" obsval="13.10"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="44.91" stdev="22.27" mindiff="2.94" local_density="0.48" obsval="141.54"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="47.63" stdev="32.90" mindiff="0.50" local_density="4.56" obsval="-149.39"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="48.80" stdev="8.74" mindiff="0.22" local_density="0.42" obsval="124.00"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="82.34" stdev="25.99" mindiff="0.01" local_density="3.69" obsval="-79.91"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.13" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.84" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.05" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.53" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.06" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.05" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.54" Zscore="9.18" obsval="110.87"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.74" Zscore="2.20" obsval="117.69"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.04" Zscore="2.27" obsval="118.77"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.27" Zscore="2.19" obsval="121.96"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.19" Zscore="-2.76" obsval="108.07"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.16" Zscore="2.47" obsval="112.57"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.26" Zscore="-2.58" obsval="104.27"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.16" Zscore="-2.05" obsval="121.92"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.87" Zscore="5.48" obsval="134.37"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.36" Zscore="-2.30" obsval="122.41"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.25" Zscore="2.32" obsval="137.34"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.06" Zscore="-2.07" obsval="120.43"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.04" Zscore="5.09" obsval="120.13"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.27" obsval="119.44"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.07" Zscore="2.75" obsval="118.68"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.36" Zscore="-2.65" obsval="121.85"/>
		<clash atom="CGA" dist="2.93" clashmag="0.47" cid="505"/>
		<clash atom="C1A" dist="2.93" clashmag="0.47" cid="505"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8387" Q_score="0.529" mogul_rmsz_numbonds="66" mogul_rmsz_numangles="78" mogul_bonds_rmsz="1.38" mogul_angles_rmsz="1.85" ligand_chirality_outlier="yes" num-H-reduce="63" model="1" chain="3" resnum="207" said="JB" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="61.42" stdev="25.37" mindiff="0.04" local_density="4.80" obsval="-92.73"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="62.76" stdev="25.77" mindiff="0.07" local_density="4.59" obsval="86.63"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="56.73" stdev="5.26" mindiff="0.92" local_density="0.27" obsval="-116.88"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="55.93" stdev="5.77" mindiff="1.03" local_density="0.33" obsval="62.46"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="94.96" stdev="2.01" mindiff="27.33" local_density="0.00" obsval="-79.77"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="94.76" stdev="3.36" mindiff="3.01" local_density="0.02" obsval="100.24"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="77.99" stdev="32.77" mindiff="1.20" local_density="0.19" obsval="-173.94"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="76.41" stdev="32.68" mindiff="5.52" local_density="0.29" obsval="5.83"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="66.05" stdev="29.37" mindiff="0.34" local_density="2.46" obsval="87.68"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="53.82" stdev="20.25" mindiff="1.02" local_density="3.42" obsval="-101.38"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="59.11" stdev="22.22" mindiff="3.83" local_density="3.24" obsval="135.80"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="33.61" stdev="18.13" mindiff="0.09" local_density="1.90" obsval="144.49"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.22" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.78" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.02" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.28" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.42" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.07" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.02" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.01" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.29" Zscore="8.64" obsval="110.62"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.08" Zscore="-2.05" obsval="121.74"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.40" Zscore="-3.00" obsval="107.85"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.03" Zscore="2.59" obsval="112.70"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.25" Zscore="-2.57" obsval="104.28"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.11" Zscore="-2.04" obsval="104.88"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.14" Zscore="-2.04" obsval="121.93"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="2.20" Zscore="5.66" obsval="134.70"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.06" Zscore="-2.48" obsval="121.99"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.03" Zscore="2.43" obsval="137.56"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.99" Zscore="5.06" obsval="120.08"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.41" obsval="119.15"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.83" Zscore="2.94" obsval="119.44"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="2.65" Zscore="-3.44" obsval="120.56"/>
		<mog-angle-outlier atoms="C4,C3,C5" numobs="1064" mean="115.23" stdev="1.74" mindiff="0.10" Zscore="2.43" obsval="119.45"/>
		<clash atom="HAB" dist="2.28" clashmag="0.63" cid="158"/>
		<clash atom="HBB1" dist="1.84" clashmag="0.59" cid="160"/>
		<clash atom="HHC" dist="1.84" clashmag="0.59" cid="160"/>
		<clash atom="HHC" dist="2.45" clashmag="0.47" cid="163"/>
		<clash atom="CBB" dist="2.45" clashmag="0.47" cid="163"/>
		<clash atom="HMA3" dist="2.51" clashmag="0.41" cid="172"/>
		<clash atom="H41" dist="1.76" clashmag="0.41" cid="173"/>
		<clash atom="H61" dist="1.76" clashmag="0.41" cid="173"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8154" Q_score="0.49" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.85" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="3" resnum="208" said="KB" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="105.41" stdev="51.54" mindiff="3.48" local_density="2.22" obsval="37.31"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="60.31" stdev="24.54" mindiff="0.05" local_density="4.77" obsval="90.33"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="61.38" stdev="24.66" mindiff="0.14" local_density="4.21" obsval="-89.16"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="128.39" stdev="7.45" mindiff="1.45" local_density="0.04" obsval="-44.97"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="128.87" stdev="7.19" mindiff="3.36" local_density="0.02" obsval="135.56"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="76.91" stdev="2.01" mindiff="9.28" local_density="0.02" obsval="-97.82"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="76.80" stdev="3.05" mindiff="5.14" local_density="0.01" obsval="82.26"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="78.13" stdev="23.25" mindiff="0.03" local_density="2.43" obsval="85.23"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="49.19" stdev="20.19" mindiff="0.44" local_density="1.90" obsval="133.57"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="82.23" stdev="45.79" mindiff="5.39" local_density="0.29" obsval="10.08"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="63.55" stdev="12.90" mindiff="0.11" local_density="0.59" obsval="104.34"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="54.80" stdev="19.77" mindiff="2.27" local_density="0.70" obsval="131.45"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="53.94" stdev="16.32" mindiff="0.32" local_density="0.83" obsval="-105.30"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.16" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.86" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.76" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.41" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.12" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.04" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.35" Zscore="8.77" obsval="110.68"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.83" Zscore="2.24" obsval="117.78"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.18" Zscore="2.94" obsval="120.81"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.76" Zscore="2.64" obsval="123.05"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.03" Zscore="-2.50" obsval="108.30"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.09" Zscore="2.53" obsval="112.64"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.29" Zscore="-2.60" obsval="104.24"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.13" Zscore="-2.03" obsval="121.95"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.88" Zscore="5.48" obsval="134.38"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.20" Zscore="-2.37" obsval="122.25"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.21" Zscore="2.34" obsval="137.38"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.09" Zscore="5.12" obsval="120.18"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.58" obsval="118.83"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.52" Zscore="2.86" obsval="119.13"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.68" Zscore="-2.24" obsval="122.53"/>
		<clash atom="HAB" dist="2.03" clashmag="0.40" cid="180"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7538" Q_score="0.513" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.86" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="3" resnum="209" said="LB" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="42.09" stdev="30.55" mindiff="8.03" local_density="1.11" obsval="148.86"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="39.75" stdev="29.20" mindiff="5.11" local_density="1.55" obsval="36.96"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="41.95" stdev="17.26" mindiff="1.50" local_density="0.64" obsval="-138.05"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="61.48" stdev="25.43" mindiff="0.08" local_density="4.80" obsval="-92.87"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="63.00" stdev="25.97" mindiff="0.01" local_density="4.59" obsval="86.20"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="32.28" stdev="4.60" mindiff="0.40" local_density="0.88" obsval="-141.61"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="31.23" stdev="4.63" mindiff="0.09" local_density="1.24" obsval="37.43"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="72.26" stdev="39.26" mindiff="0.23" local_density="0.70" obsval="-61.56"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="70.76" stdev="34.21" mindiff="1.20" local_density="3.36" obsval="61.06"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="69.32" stdev="30.55" mindiff="1.84" local_density="0.74" obsval="-117.52"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="51.15" stdev="9.83" mindiff="0.26" local_density="0.11" obsval="-125.53"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="46.36" stdev="9.60" mindiff="0.09" local_density="0.44" obsval="-127.27"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="83.49" stdev="26.75" mindiff="0.01" local_density="4.29" obsval="-78.46"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="39.13" stdev="23.89" mindiff="0.98" local_density="4.42" obsval="-90.08"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="47.85" stdev="30.58" mindiff="1.99" local_density="3.42" obsval="146.65"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="58.98" stdev="10.20" mindiff="0.83" local_density="0.54" obsval="-110.42"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="74.39" stdev="53.69" mindiff="0.08" local_density="4.22" obsval="41.26"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.13" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.95" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.12" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.58" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.14" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.03" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.01" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.55" Zscore="9.21" obsval="110.88"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.06" Zscore="-2.12" obsval="121.60"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.70" Zscore="2.90" obsval="119.58"/>
		<mog-angle-outlier atoms="CBA,CAA,C2A" numobs="171" mean="113.79" stdev="2.98" mindiff="0.58" Zscore="2.18" obsval="120.27"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.06" Zscore="2.57" obsval="119.68"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.42" Zscore="-3.02" obsval="107.83"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.02" Zscore="2.31" obsval="112.41"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.12" Zscore="-2.18" obsval="104.69"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.28" Zscore="5.14" obsval="133.78"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.19" Zscore="-2.12" obsval="122.82"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.02" Zscore="2.43" obsval="137.57"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.59" Zscore="4.83" obsval="119.68"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.28" obsval="119.41"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.52" Zscore="2.86" obsval="119.13"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.51" Zscore="-2.13" obsval="122.70"/>
		<clash atom="HAB" dist="2.40" clashmag="0.50" cid="465"/>
		<clash atom="HAB" dist="2.48" clashmag="0.44" cid="467"/>
		<clash atom="HAB" dist="2.00" clashmag="0.42" cid="469"/>
		<clash atom="HAB" dist="2.02" clashmag="0.41" cid="471"/>
		<clash atom="HMA2" dist="1.95" clashmag="0.49" cid="466"/>
		<clash atom="HMD3" dist="2.01" clashmag="0.42" cid="468"/>
		<clash atom="HMD3" dist="2.51" clashmag="0.41" cid="470"/>
		<clash atom="CMA" dist="2.50" clashmag="0.40" cid="472"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8000" Q_score="0.487" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="2.08" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="3" resnum="210" said="MB" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="69.74" stdev="21.22" mindiff="23.69" local_density="0.00" obsval="91.22"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="56.46" stdev="29.20" mindiff="21.83" local_density="0.00" obsval="-20.24"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="86.80" stdev="6.60" mindiff="1.51" local_density="0.12" obsval="-86.63"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="88.57" stdev="6.75" mindiff="1.64" local_density="0.04" obsval="95.22"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="89.50" stdev="37.60" mindiff="10.50" local_density="0.00" obsval="-155.50"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="88.58" stdev="39.49" mindiff="12.97" local_density="0.00" obsval="24.67"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="24.00" stdev="1.70" mindiff="0.16" local_density="0.19" obsval="-150.75"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="24.11" stdev="3.07" mindiff="0.09" local_density="0.65" obsval="29.42"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="58.48" stdev="9.96" mindiff="0.17" local_density="0.50" obsval="111.08"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="52.15" stdev="45.59" mindiff="0.29" local_density="3.83" obsval="-40.35"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="47.91" stdev="30.00" mindiff="2.68" local_density="3.42" obsval="-145.96"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="77.76" stdev="22.97" mindiff="0.16" local_density="2.38" obsval="-85.72"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="67.94" stdev="15.82" mindiff="0.47" local_density="0.78" obsval="-98.56"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="36.29" stdev="16.03" mindiff="0.32" local_density="1.25" obsval="140.86"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.06" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.89" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.93" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.31" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.27" obsval="1.32"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="4.25" Zscore="10.74" obsval="111.58"/>
		<mog-angle-outlier atoms="CMA,C3A,C2A" numobs="98" mean="113.98" stdev="3.87" mindiff="0.42" Zscore="2.96" obsval="125.42"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="7.50" Zscore="5.96" obsval="127.78"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.02" Zscore="2.23" obsval="118.63"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.31" Zscore="2.18" obsval="121.92"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.02" Zscore="-2.52" obsval="108.28"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.33" Zscore="2.93" obsval="113.06"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.01" Zscore="-3.01" obsval="103.81"/>
		<mog-angle-outlier atoms="CBC,CAC,C3C" numobs="10971" mean="112.42" stdev="2.71" mindiff="0.03" Zscore="-2.07" obsval="106.82"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.08" Zscore="-2.08" obsval="104.86"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.49" Zscore="5.26" obsval="133.98"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.18" Zscore="-2.12" obsval="122.83"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.19" Zscore="2.35" obsval="137.40"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.05" Zscore="-2.07" obsval="120.43"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.36" Zscore="5.32" obsval="120.53"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.47" obsval="119.05"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.40" Zscore="2.83" obsval="119.01"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.08" Zscore="2.34" obsval="126.41"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6923" Q_score="0.452" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.91" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="3" resnum="211" said="NB" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="65.52" stdev="14.40" mindiff="22.67" local_density="0.00" obsval="99.85"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="60.01" stdev="29.20" mindiff="25.37" local_density="0.00" obsval="-16.70"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="98.30" stdev="6.92" mindiff="7.53" local_density="0.04" obsval="-75.10"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="98.03" stdev="6.88" mindiff="7.84" local_density="0.02" obsval="104.70"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="99.32" stdev="39.47" mindiff="13.93" local_density="0.00" obsval="-34.38"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="54.71" stdev="30.65" mindiff="4.77" local_density="3.36" obsval="-122.90"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="59.97" stdev="34.16" mindiff="0.90" local_density="2.22" obsval="57.66"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="79.86" stdev="37.60" mindiff="0.86" local_density="2.50" obsval="145.86"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="78.22" stdev="39.49" mindiff="2.62" local_density="2.50" obsval="-35.03"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="58.07" stdev="1.86" mindiff="9.57" local_density="0.02" obsval="-116.67"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="57.04" stdev="2.91" mindiff="2.37" local_density="0.05" obsval="62.46"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="51.09" stdev="9.92" mindiff="0.11" local_density="0.11" obsval="125.68"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="69.24" stdev="45.72" mindiff="7.66" local_density="0.29" obsval="-23.13"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="47.89" stdev="30.16" mindiff="2.48" local_density="3.42" obsval="-146.15"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="39.89" stdev="13.41" mindiff="0.09" local_density="0.90" obsval="-135.99"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="83.80" stdev="26.96" mindiff="0.02" local_density="4.44" obsval="-78.06"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="40.22" stdev="21.91" mindiff="0.95" local_density="4.13" obsval="-92.89"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.20" stdev="27.47" mindiff="1.27" local_density="2.28" obsval="142.94"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="72.49" stdev="19.08" mindiff="0.15" local_density="1.31" obsval="-92.60"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="55.95" stdev="38.57" mindiff="0.06" local_density="4.00" obsval="153.21"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.29" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.89" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.19" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.34" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.93" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.11" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.70" Zscore="9.54" obsval="111.03"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.07" Zscore="-2.06" obsval="121.72"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.37" Zscore="3.03" obsval="119.91"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.02" Zscore="2.23" obsval="118.62"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.39" Zscore="-2.99" obsval="107.86"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.17" Zscore="2.45" obsval="112.56"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.11" Zscore="-2.44" obsval="104.41"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.29" Zscore="5.15" obsval="133.79"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.19" Zscore="-2.12" obsval="122.82"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.12" Zscore="2.50" obsval="137.71"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.12" Zscore="-2.36" obsval="119.87"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.20" Zscore="5.98" obsval="121.68"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.78" obsval="118.44"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.52" Zscore="2.86" obsval="119.12"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.96" Zscore="-2.41" obsval="122.25"/>
		<clash atom="CAD" dist="2.48" clashmag="0.44" cid="478"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6897" Q_score="0.371" mogul_rmsz_numbonds="62" mogul_rmsz_numangles="73" mogul_bonds_rmsz="1.44" mogul_angles_rmsz="1.97" ligand_chirality_outlier="yes" num-H-reduce="54" model="1" chain="3" resnum="212" said="OB" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="49.19" stdev="9.25" mindiff="0.35" local_density="0.43" obsval="-123.58"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="47.99" stdev="4.96" mindiff="0.21" local_density="0.27" obsval="-125.70"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="48.31" stdev="5.50" mindiff="0.26" local_density="0.46" obsval="54.78"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="71.63" stdev="39.25" mindiff="0.41" local_density="1.05" obsval="62.20"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="79.07" stdev="2.01" mindiff="11.44" local_density="0.00" obsval="-95.66"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="79.24" stdev="3.09" mindiff="2.70" local_density="0.01" obsval="84.70"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="60.99" stdev="45.66" mindiff="4.92" local_density="0.88" obsval="-31.43"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="43.87" stdev="10.86" mindiff="1.00" local_density="0.54" obsval="130.62"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.24" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.86" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.12" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.58" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.41" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.00" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.06" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.65" Zscore="9.42" obsval="110.98"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.05" Zscore="-2.07" obsval="121.71"/>
		<mog-angle-outlier atoms="CMA,C3A,C2A" numobs="98" mean="113.98" stdev="3.87" mindiff="0.30" Zscore="2.08" obsval="122.04"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.45" Zscore="3.33" obsval="120.73"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.14" Zscore="2.42" obsval="119.22"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.01" Zscore="-2.48" obsval="108.32"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.11" Zscore="2.52" obsval="112.62"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.19" Zscore="-2.51" obsval="104.34"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.85" Zscore="5.46" obsval="134.34"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.32" Zscore="-2.32" obsval="122.37"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.09" Zscore="2.40" obsval="137.50"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.08" Zscore="-2.14" obsval="120.30"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.26" Zscore="5.37" obsval="120.62"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.45" obsval="119.08"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.47" Zscore="3.37" obsval="121.08"/>
		<clash atom="HMA3" dist="2.48" clashmag="0.44" cid="478"/>
		<clash atom="HAB" dist="2.51" clashmag="0.41" cid="479"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8478" Q_score="0.471" mogul_rmsz_numbonds="50" mogul_rmsz_numangles="59" mogul_bonds_rmsz="1.59" mogul_angles_rmsz="2.09" ligand_chirality_outlier="yes" num-H-reduce="32" model="1" chain="3" resnum="213" said="PB" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="108.54" stdev="51.64" mindiff="0.29" local_density="1.11" obsval="34.13"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="64.86" stdev="27.39" mindiff="0.19" local_density="4.69" obsval="82.96"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2948" mean="70.10" stdev="3.65" mindiff="3.06" local_density="0.10" obsval="104.42"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4275" mean="70.57" stdev="4.57" mindiff="1.49" local_density="0.07" obsval="-76.44"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="40" mean="62.00" stdev="36.09" mindiff="5.71" local_density="5.00" obsval="2.75"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="63.46" stdev="1.93" mindiff="4.18" local_density="0.02" obsval="-111.28"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="63.47" stdev="2.93" mindiff="1.38" local_density="0.04" obsval="68.91"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.26" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.82" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.13" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.60" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.09" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.12" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.66" Zscore="9.46" obsval="110.99"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.07" Zscore="-2.12" obsval="121.58"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.01" Zscore="3.17" obsval="120.29"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.00" Zscore="-2.46" obsval="108.33"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.01" Zscore="2.63" obsval="112.75"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.21" Zscore="-2.53" obsval="104.32"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.60" Zscore="-2.00" obsval="103.10"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.75" Zscore="5.40" obsval="134.24"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.36" Zscore="-2.20" obsval="122.66"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.10" Zscore="2.39" obsval="137.49"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.98" Zscore="5.06" obsval="120.08"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.33" obsval="119.32"/>
		<clash atom="HAB" dist="2.31" clashmag="0.59" cid="175"/>
		<clash atom="HED1" dist="1.78" clashmag="0.48" cid="177"/>
		<clash atom="HBC2" dist="1.99" clashmag="0.45" cid="178"/>
		<clash atom="HED2" dist="1.84" clashmag="0.42" cid="179"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7231" Q_score="0.421" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.38" mogul_angles_rmsz="1.85" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="3" resnum="214" said="QB" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="49.85" stdev="17.06" mindiff="9.70" local_density="1.11" obsval="-132.23"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="47.83" stdev="9.90" mindiff="7.67" local_density="0.78" obsval="115.86"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="43.96" stdev="4.81" mindiff="4.29" local_density="0.38" obsval="-129.78"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="43.70" stdev="5.25" mindiff="0.21" local_density="0.62" obsval="50.12"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="67.75" stdev="24.62" mindiff="7.36" local_density="0.84" obsval="72.36"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="67.57" stdev="21.37" mindiff="12.81" local_density="0.00" obsval="-106.55"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="10552" mean="34.80" stdev="9.45" mindiff="0.14" local_density="0.36" obsval="-128.94"/>
		<mog-torsion-outlier atoms="C4C,C3C,CAC,CBC" numobs="10557" mean="31.89" stdev="11.03" mindiff="0.00" local_density="1.17" obsval="51.25"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="41.73" stdev="1.75" mindiff="7.54" local_density="0.02" obsval="-133.01"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="42.27" stdev="2.93" mindiff="1.02" local_density="0.11" obsval="47.66"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="54.36" stdev="45.61" mindiff="1.76" local_density="3.24" obsval="-38.11"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="82.20" stdev="51.69" mindiff="0.68" local_density="4.18" obsval="-43.22"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="82.69" stdev="26.22" mindiff="0.03" local_density="3.78" obsval="79.47"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="71.50" stdev="45.74" mindiff="5.38" local_density="0.29" obsval="20.85"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="53.27" stdev="17.93" mindiff="4.42" local_density="2.28" obsval="-104.77"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="30.19" stdev="20.86" mindiff="0.01" local_density="3.80" obsval="-149.23"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.26" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.91" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.05" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.65" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.14" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.00" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.49" Zscore="9.08" obsval="110.82"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.47" Zscore="2.99" obsval="119.81"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.02" Zscore="2.09" obsval="118.19"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.05" Zscore="-2.61" obsval="108.20"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.06" Zscore="2.56" obsval="112.67"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.00" Zscore="-2.33" obsval="104.53"/>
		<mog-angle-outlier atoms="CAC,C3C,C4C" numobs="5400" mean="124.79" stdev="1.30" mindiff="0.02" Zscore="2.28" obsval="127.76"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.15" Zscore="-2.05" obsval="121.92"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.72" Zscore="5.39" obsval="134.22"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.46" Zscore="-2.26" obsval="122.51"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.10" Zscore="2.39" obsval="137.49"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.31" Zscore="5.24" obsval="120.40"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.53" obsval="118.92"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.87" Zscore="2.95" obsval="119.48"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.65" Zscore="-2.22" obsval="122.56"/>
		<clash atom="HBC3" dist="1.75" clashmag="0.67" cid="273"/>
		<clash atom="HHD" dist="1.75" clashmag="0.67" cid="273"/>
		<clash atom="H203" dist="1.94" clashmag="0.50" cid="275"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8333" Q_score="0.538" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.51" mogul_angles_rmsz="2.24" ligand_chirality_outlier="yes" model="1" chain="3" resnum="215" said="RB" ent="17" seq="." icode=" " resname="C7Z" altcode=" ">
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="47.85" stdev="18.90" mindiff="8.37" local_density="1.68" obsval="89.59"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="119" mean="44.27" stdev="21.57" mindiff="1.90" local_density="3.36" obsval="-86.86"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C19" numobs="316" mean="55.54" stdev="6.97" mindiff="0.39" local_density="0.32" obsval="-60.88"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="55.47" stdev="7.07" mindiff="2.89" local_density="0.64" obsval="119.13"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C20" numobs="316" mean="28.12" stdev="14.28" mindiff="7.14" local_density="0.32" obsval="-31.60"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="27.65" stdev="14.27" mindiff="13.57" local_density="0.00" obsval="148.80"/>
		<mog-torsion-outlier atoms="C29,C30,C31,C32" numobs="760" mean="25.00" stdev="12.86" mindiff="0.88" local_density="2.50" obsval="-150.46"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C30" numobs="313" mean="154.44" stdev="21.94" mindiff="0.59" local_density="0.32" obsval="-15.97"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C39" numobs="316" mean="153.78" stdev="22.13" mindiff="0.36" local_density="0.32" obsval="163.41"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.49" obsval="1.46"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.82" obsval="1.61"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.50" obsval="1.57"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.06" Zscore="8.14" obsval="1.66"/>
		<mog-bond-outlier atoms="C4,C5" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.31" obsval="1.44"/>
		<mog-bond-outlier atoms="C2,C3" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.84" obsval="1.36"/>
		<mog-bond-outlier atoms="C2,C1" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="3.76" obsval="1.66"/>
		<mog-bond-outlier atoms="C18,C5" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.49" obsval="1.54"/>
		<mog-bond-outlier atoms="C27,C26" numobs="255" mean="1.45" stdev="0.03" mindiff="0.03" Zscore="3.81" obsval="1.58"/>
		<mog-bond-outlier atoms="C21,C26" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-2.88" obsval="1.50"/>
		<mog-bond-outlier atoms="C25,C26" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.53" obsval="1.62"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.41" obsval="1.55"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.27" obsval="1.56"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.76" obsval="1.58"/>
		<mog-bond-outlier atoms="C20,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.41" obsval="1.55"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.93" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C34" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.72" obsval="1.54"/>
		<mog-bond-outlier atoms="C40,C33" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.21" obsval="1.55"/>
		<mog-bond-outlier atoms="C32,C33" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.89" obsval="1.56"/>
		<mog-bond-outlier atoms="C31,C30" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.56" obsval="1.57"/>
		<mog-bond-outlier atoms="C28,C29" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.16" obsval="1.57"/>
		<mog-bond-outlier atoms="C22,C21" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="3.90" obsval="1.66"/>
		<mog-bond-outlier atoms="C22,C23" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-11.06" obsval="1.36"/>
		<mog-bond-outlier atoms="C24,C23" numobs="572" mean="1.52" stdev="0.02" mindiff="0.12" Zscore="11.55" obsval="1.72"/>
		<mog-bond-outlier atoms="C24,C25" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.52" obsval="1.44"/>
		<mog-bond-outlier atoms="C38,C25" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="3.44" obsval="1.56"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.81" Zscore="-2.83" obsval="118.78"/>
		<mog-angle-outlier atoms="C18,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.53" Zscore="-3.56" obsval="120.60"/>
		<mog-angle-outlier atoms="C18,C5,C4" numobs="328" mean="114.42" stdev="1.84" mindiff="0.04" Zscore="3.24" obsval="120.38"/>
		<mog-angle-outlier atoms="C8,C7,C6" numobs="153" mean="127.00" stdev="2.67" mindiff="3.18" Zscore="-3.25" obsval="118.31"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="0.91" Zscore="-2.60" obsval="122.39"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="0.19" Zscore="-4.10" obsval="121.52"/>
		<mog-angle-outlier atoms="C20,C13,C14" numobs="181" mean="122.82" stdev="1.62" mindiff="0.04" Zscore="-2.03" obsval="119.52"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="1.90" Zscore="-6.16" obsval="118.63"/>
		<mog-angle-outlier atoms="C35,C34,C33" numobs="147" mean="127.28" stdev="1.40" mindiff="0.24" Zscore="-4.64" obsval="120.77"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="1.55" Zscore="-5.91" obsval="118.98"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="3.39" Zscore="-4.28" obsval="119.91"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="153" mean="127.00" stdev="2.67" mindiff="1.21" Zscore="-2.51" obsval="120.29"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="3.14" Zscore="-5.95" obsval="118.00"/>
		<clash atom="C20" dist="2.42" clashmag="0.50" cid="477"/>
		<clash atom="C39" dist="2.51" clashmag="0.41" cid="479"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8571" Q_score="0.539" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.48" mogul_angles_rmsz="3.52" ligand_chirality_outlier="yes" model="1" chain="3" resnum="216" said="SB" ent="17" seq="." icode=" " resname="C7Z" altcode=" ">
		<mog-torsion-outlier atoms="C21,C26,C27,C28" numobs="119" mean="41.68" stdev="26.08" mindiff="0.40" local_density="4.20" obsval="100.37"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="119" mean="55.15" stdev="11.85" mindiff="10.85" local_density="0.00" obsval="-105.32"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C19" numobs="316" mean="27.16" stdev="14.60" mindiff="6.12" local_density="0.32" obsval="30.58"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="27.17" stdev="14.43" mindiff="13.06" local_density="0.00" obsval="-149.32"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="37.49" stdev="9.74" mindiff="3.70" local_density="0.39" obsval="-137.26"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C20" numobs="316" mean="67.61" stdev="6.27" mindiff="1.83" local_density="0.32" obsval="-73.71"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="68.20" stdev="5.76" mindiff="5.10" local_density="0.32" obsval="105.68"/>
		<mog-torsion-outlier atoms="C12,C13,C14,C15" numobs="150" mean="167.32" stdev="33.00" mindiff="0.16" local_density="3.33" obsval="0.75"/>
		<mog-torsion-outlier atoms="C20,C13,C14,C15" numobs="160" mean="168.36" stdev="32.00" mindiff="0.12" local_density="3.12" obsval="-179.86"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.04" Zscore="-6.17" obsval="1.45"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.44" obsval="1.60"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.01" Zscore="3.33" obsval="1.56"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.07" Zscore="8.40" obsval="1.67"/>
		<mog-bond-outlier atoms="C4,C5" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.33" obsval="1.44"/>
		<mog-bond-outlier atoms="C2,C3" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.52" obsval="1.37"/>
		<mog-bond-outlier atoms="C2,C1" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.69" obsval="1.65"/>
		<mog-bond-outlier atoms="C18,C5" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.43" obsval="1.54"/>
		<mog-bond-outlier atoms="C27,C26" numobs="255" mean="1.45" stdev="0.03" mindiff="0.03" Zscore="3.86" obsval="1.58"/>
		<mog-bond-outlier atoms="C21,C26" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-2.78" obsval="1.50"/>
		<mog-bond-outlier atoms="C25,C26" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.54" obsval="1.62"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.11" obsval="1.54"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.08" obsval="1.55"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.48" obsval="1.57"/>
		<mog-bond-outlier atoms="C20,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.53" obsval="1.56"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.89" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C34" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="3.67" obsval="1.54"/>
		<mog-bond-outlier atoms="C40,C33" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.16" obsval="1.55"/>
		<mog-bond-outlier atoms="C32,C33" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.78" obsval="1.56"/>
		<mog-bond-outlier atoms="C31,C30" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.50" obsval="1.57"/>
		<mog-bond-outlier atoms="C28,C29" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.21" obsval="1.57"/>
		<mog-bond-outlier atoms="C22,C21" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="3.94" obsval="1.66"/>
		<mog-bond-outlier atoms="C22,C23" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-11.05" obsval="1.36"/>
		<mog-bond-outlier atoms="C24,C23" numobs="572" mean="1.52" stdev="0.02" mindiff="0.12" Zscore="11.51" obsval="1.72"/>
		<mog-bond-outlier atoms="C24,C25" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.63" obsval="1.43"/>
		<mog-bond-outlier atoms="C38,C25" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="3.39" obsval="1.56"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="1.46" Zscore="-4.49" obsval="116.50"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="97" mean="121.56" stdev="2.30" mindiff="0.00" Zscore="-2.14" obsval="116.63"/>
		<mog-angle-outlier atoms="C18,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="1.77" Zscore="-4.69" obsval="119.37"/>
		<mog-angle-outlier atoms="C18,C5,C4" numobs="328" mean="114.42" stdev="1.84" mindiff="0.47" Zscore="2.96" obsval="119.86"/>
		<mog-angle-outlier atoms="C21,C26,C25" numobs="97" mean="122.64" stdev="1.37" mindiff="0.60" Zscore="-2.98" obsval="118.56"/>
		<mog-angle-outlier atoms="C8,C7,C6" numobs="153" mean="127.00" stdev="2.67" mindiff="1.72" Zscore="-2.71" obsval="119.77"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="5.74" Zscore="-5.86" obsval="117.56"/>
		<mog-angle-outlier atoms="C8,C9,C10" numobs="168" mean="119.01" stdev="1.57" mindiff="0.15" Zscore="2.46" obsval="122.87"/>
		<mog-angle-outlier atoms="C19,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.22" Zscore="-2.66" obsval="118.51"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="6.84" Zscore="-9.69" obsval="113.69"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="4.15" Zscore="-3.69" obsval="116.25"/>
		<mog-angle-outlier atoms="C20,C13,C14" numobs="181" mean="122.82" stdev="1.62" mindiff="0.16" Zscore="-2.62" obsval="118.58"/>
		<mog-angle-outlier atoms="C35,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="2.03" Zscore="-5.94" obsval="111.36"/>
		<mog-angle-outlier atoms="C15,C35,C34" numobs="265" mean="123.52" stdev="2.05" mindiff="0.35" Zscore="2.58" obsval="128.80"/>
		<mog-angle-outlier atoms="C35,C34,C33" numobs="147" mean="127.28" stdev="1.40" mindiff="10.16" Zscore="-12.05" obsval="110.37"/>
		<mog-angle-outlier atoms="C40,C33,C34" numobs="181" mean="122.82" stdev="1.62" mindiff="0.50" Zscore="-3.67" obsval="116.87"/>
		<mog-angle-outlier atoms="C32,C33,C34" numobs="168" mean="119.01" stdev="1.57" mindiff="0.96" Zscore="4.45" obsval="126.01"/>
		<mog-angle-outlier atoms="C31,C32,C33" numobs="117" mean="126.36" stdev="2.74" mindiff="8.76" Zscore="-5.37" obsval="111.64"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="6.78" Zscore="-9.64" obsval="113.75"/>
		<mog-angle-outlier atoms="C39,C29,C30" numobs="181" mean="122.82" stdev="1.62" mindiff="0.20" Zscore="-3.10" obsval="117.79"/>
		<mog-angle-outlier atoms="C28,C29,C30" numobs="168" mean="119.01" stdev="1.57" mindiff="0.04" Zscore="2.83" obsval="123.46"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="6.17" Zscore="-6.15" obsval="117.14"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="2.69" Zscore="-5.53" obsval="118.45"/>
		<mog-angle-outlier atoms="C38,C25,C24" numobs="328" mean="114.42" stdev="1.84" mindiff="0.00" Zscore="2.14" obsval="118.36"/>
		<clash atom="C3" dist="2.49" clashmag="0.42" cid="448"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.5952" Q_score="0.331" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.45" mogul_angles_rmsz="2.64" ligand_chirality_outlier="yes" model="1" chain="3" resnum="217" said="TB" ent="17" seq="." icode=" " resname="C7Z" altcode=" ">
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="47.83" stdev="17.70" mindiff="1.48" local_density="3.36" obsval="92.99"/>
		<mog-torsion-outlier atoms="C21,C26,C27,C28" numobs="119" mean="50.98" stdev="15.77" mindiff="3.86" local_density="0.84" obsval="-84.20"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="119" mean="65.45" stdev="14.93" mindiff="21.96" local_density="0.00" obsval="122.58"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C19" numobs="316" mean="58.06" stdev="6.70" mindiff="3.08" local_density="0.63" obsval="63.58"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="58.37" stdev="6.67" mindiff="5.28" local_density="0.64" obsval="-116.05"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="103.42" stdev="11.97" mindiff="20.15" local_density="0.00" obsval="-68.47"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C20" numobs="316" mean="159.91" stdev="22.46" mindiff="5.82" local_density="0.63" obsval="-169.59"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="160.12" stdev="22.23" mindiff="5.17" local_density="0.64" obsval="10.25"/>
		<mog-torsion-outlier atoms="C13,C14,C15,C35" numobs="760" mean="21.52" stdev="13.80" mindiff="0.31" local_density="2.89" obsval="-154.18"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C30" numobs="313" mean="150.98" stdev="21.64" mindiff="2.92" local_density="0.32" obsval="19.47"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C39" numobs="316" mean="151.04" stdev="21.90" mindiff="3.14" local_density="0.32" obsval="-160.63"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-6.03" obsval="1.46"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.52" obsval="1.60"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.48" obsval="1.57"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.07" Zscore="8.48" obsval="1.67"/>
		<mog-bond-outlier atoms="C4,C5" numobs="328" mean="1.51" stdev="0.02" mindiff="0.01" Zscore="-4.17" obsval="1.44"/>
		<mog-bond-outlier atoms="C2,C3" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.53" obsval="1.37"/>
		<mog-bond-outlier atoms="C2,C1" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.68" obsval="1.65"/>
		<mog-bond-outlier atoms="C18,C5" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.51" obsval="1.54"/>
		<mog-bond-outlier atoms="C27,C26" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.63" obsval="1.57"/>
		<mog-bond-outlier atoms="C21,C26" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-2.89" obsval="1.50"/>
		<mog-bond-outlier atoms="C25,C26" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.07" obsval="1.61"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.40" obsval="1.55"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.24" obsval="1.56"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.70" obsval="1.58"/>
		<mog-bond-outlier atoms="C20,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.55" obsval="1.56"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.84" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C34" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="3.65" obsval="1.54"/>
		<mog-bond-outlier atoms="C40,C33" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.06" obsval="1.55"/>
		<mog-bond-outlier atoms="C32,C33" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.57" obsval="1.55"/>
		<mog-bond-outlier atoms="C31,C30" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.29" obsval="1.56"/>
		<mog-bond-outlier atoms="C28,C29" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.87" obsval="1.56"/>
		<mog-bond-outlier atoms="C22,C21" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="4.06" obsval="1.67"/>
		<mog-bond-outlier atoms="C22,C23" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-11.02" obsval="1.36"/>
		<mog-bond-outlier atoms="C24,C23" numobs="572" mean="1.52" stdev="0.02" mindiff="0.12" Zscore="11.29" obsval="1.72"/>
		<mog-bond-outlier atoms="C24,C25" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-5.07" obsval="1.43"/>
		<mog-bond-outlier atoms="C38,C25" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="3.55" obsval="1.56"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="1.63" Zscore="-4.61" obsval="116.33"/>
		<mog-angle-outlier atoms="C18,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="1.31" Zscore="-4.27" obsval="119.83"/>
		<mog-angle-outlier atoms="C18,C5,C4" numobs="328" mean="114.42" stdev="1.84" mindiff="0.38" Zscore="2.91" obsval="119.77"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="97" mean="121.56" stdev="2.30" mindiff="0.78" Zscore="-2.47" obsval="115.86"/>
		<mog-angle-outlier atoms="C21,C26,C25" numobs="97" mean="122.64" stdev="1.37" mindiff="0.86" Zscore="-2.79" obsval="118.82"/>
		<mog-angle-outlier atoms="C8,C7,C6" numobs="153" mean="127.00" stdev="2.67" mindiff="1.41" Zscore="-2.59" obsval="120.08"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="3.70" Zscore="-4.48" obsval="119.60"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="0.13" Zscore="-4.90" obsval="120.41"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="0.70" Zscore="-2.43" obsval="119.70"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="0.38" Zscore="-4.54" obsval="120.91"/>
		<mog-angle-outlier atoms="C35,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="0.90" Zscore="-3.04" obsval="117.29"/>
		<mog-angle-outlier atoms="C35,C34,C33" numobs="147" mean="127.28" stdev="1.40" mindiff="3.21" Zscore="-7.10" obsval="117.32"/>
		<mog-angle-outlier atoms="C31,C32,C33" numobs="117" mean="126.36" stdev="2.74" mindiff="4.45" Zscore="-3.80" obsval="115.95"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="1.60" Zscore="-5.95" obsval="118.94"/>
		<mog-angle-outlier atoms="C39,C29,C28" numobs="317" mean="118.09" stdev="1.53" mindiff="0.05" Zscore="2.20" obsval="121.45"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="7.30" Zscore="-6.92" obsval="116.00"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="153" mean="127.00" stdev="2.67" mindiff="0.19" Zscore="-2.13" obsval="121.31"/>
		<mog-angle-outlier atoms="C24,C25,C26" numobs="52" mean="120.76" stdev="2.05" mindiff="1.11" Zscore="-2.96" obsval="114.68"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="2.81" Zscore="-5.64" obsval="118.33"/>
		<mog-angle-outlier atoms="C38,C25,C24" numobs="328" mean="114.42" stdev="1.84" mindiff="0.07" Zscore="2.56" obsval="119.13"/>
		<clash atom="C40" dist="2.31" clashmag="0.59" cid="175"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8810" Q_score="0.488" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.47" mogul_angles_rmsz="2.52" ligand_chirality_outlier="yes" model="1" chain="3" resnum="218" said="UB" ent="17" seq="." icode=" " resname="C7Z" altcode=" ">
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="48.11" stdev="48.70" mindiff="5.60" local_density="4.20" obsval="-153.51"/>
		<mog-torsion-outlier atoms="C21,C26,C27,C28" numobs="119" mean="49.40" stdev="17.30" mindiff="6.56" local_density="0.84" obsval="-86.91"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C19" numobs="316" mean="29.81" stdev="13.72" mindiff="8.95" local_density="0.32" obsval="33.42"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="29.96" stdev="13.53" mindiff="16.03" local_density="0.00" obsval="-146.34"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="22.38" stdev="13.56" mindiff="0.14" local_density="2.89" obsval="-153.26"/>
		<mog-torsion-outlier atoms="C29,C30,C31,C32" numobs="760" mean="38.70" stdev="9.45" mindiff="4.97" local_density="0.39" obsval="-135.99"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C30" numobs="313" mean="152.65" stdev="21.78" mindiff="1.23" local_density="0.32" obsval="17.78"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C39" numobs="316" mean="152.86" stdev="22.05" mindiff="1.30" local_density="0.32" obsval="-162.48"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.99" obsval="1.46"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.48" obsval="1.60"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.50" obsval="1.57"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.07" Zscore="8.49" obsval="1.67"/>
		<mog-bond-outlier atoms="C4,C5" numobs="328" mean="1.51" stdev="0.02" mindiff="0.01" Zscore="-4.16" obsval="1.44"/>
		<mog-bond-outlier atoms="C2,C3" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.52" obsval="1.37"/>
		<mog-bond-outlier atoms="C2,C1" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.73" obsval="1.66"/>
		<mog-bond-outlier atoms="C18,C5" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.48" obsval="1.54"/>
		<mog-bond-outlier atoms="C27,C26" numobs="255" mean="1.45" stdev="0.03" mindiff="0.03" Zscore="3.82" obsval="1.58"/>
		<mog-bond-outlier atoms="C21,C26" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-3.27" obsval="1.49"/>
		<mog-bond-outlier atoms="C25,C26" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.20" obsval="1.61"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.40" obsval="1.55"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.24" obsval="1.56"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.72" obsval="1.58"/>
		<mog-bond-outlier atoms="C20,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.50" obsval="1.55"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.84" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C34" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="3.68" obsval="1.54"/>
		<mog-bond-outlier atoms="C40,C33" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.17" obsval="1.55"/>
		<mog-bond-outlier atoms="C32,C33" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.83" obsval="1.56"/>
		<mog-bond-outlier atoms="C31,C30" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.48" obsval="1.57"/>
		<mog-bond-outlier atoms="C28,C29" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.19" obsval="1.57"/>
		<mog-bond-outlier atoms="C22,C21" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="4.04" obsval="1.66"/>
		<mog-bond-outlier atoms="C22,C23" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.53" obsval="1.37"/>
		<mog-bond-outlier atoms="C24,C23" numobs="572" mean="1.52" stdev="0.02" mindiff="0.13" Zscore="11.76" obsval="1.72"/>
		<mog-bond-outlier atoms="C24,C25" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.68" obsval="1.43"/>
		<mog-bond-outlier atoms="C38,C25" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="3.50" obsval="1.56"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="1.96" Zscore="-4.85" obsval="116.00"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="52" mean="120.76" stdev="2.05" mindiff="0.59" Zscore="-2.13" obsval="116.38"/>
		<mog-angle-outlier atoms="C18,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="1.02" Zscore="-4.00" obsval="120.12"/>
		<mog-angle-outlier atoms="C18,C5,C4" numobs="328" mean="114.42" stdev="1.84" mindiff="0.22" Zscore="2.82" obsval="119.61"/>
		<mog-angle-outlier atoms="C21,C26,C25" numobs="97" mean="122.64" stdev="1.37" mindiff="2.52" Zscore="-5.27" obsval="115.44"/>
		<mog-angle-outlier atoms="C8,C7,C6" numobs="153" mean="127.00" stdev="2.67" mindiff="0.12" Zscore="-2.11" obsval="121.37"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="4.57" Zscore="-5.07" obsval="118.74"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="1.56" Zscore="-5.92" obsval="118.97"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="0.38" Zscore="-2.31" obsval="120.02"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="1.10" Zscore="-5.59" obsval="119.44"/>
		<mog-angle-outlier atoms="C15,C35,C34" numobs="265" mean="123.52" stdev="2.05" mindiff="0.11" Zscore="-2.05" obsval="119.33"/>
		<mog-angle-outlier atoms="C35,C34,C33" numobs="147" mean="127.28" stdev="1.40" mindiff="0.63" Zscore="-5.26" obsval="119.91"/>
		<mog-angle-outlier atoms="C31,C32,C33" numobs="117" mean="126.36" stdev="2.74" mindiff="0.51" Zscore="-2.36" obsval="119.89"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="2.53" Zscore="-6.62" obsval="118.00"/>
		<mog-angle-outlier atoms="C39,C29,C30" numobs="181" mean="122.82" stdev="1.62" mindiff="0.09" Zscore="-2.15" obsval="119.33"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="1.99" Zscore="-3.33" obsval="121.31"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="153" mean="127.00" stdev="2.67" mindiff="2.49" Zscore="-2.99" obsval="119.01"/>
		<mog-angle-outlier atoms="C24,C25,C26" numobs="52" mean="120.76" stdev="2.05" mindiff="0.03" Zscore="-2.44" obsval="115.75"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="1.08" Zscore="-4.06" obsval="120.06"/>
		<mog-angle-outlier atoms="C38,C25,C24" numobs="328" mean="114.42" stdev="1.84" mindiff="0.46" Zscore="3.01" obsval="119.95"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.4082" Q_score="0.346" mogul_rmsz_numbonds="48" mogul_rmsz_numangles="51" mogul_bonds_rmsz="0.41" mogul_angles_rmsz="0.95" num-H-reduce="74" model="1" chain="3" resnum="219" said="VB" ent="19" seq="." icode=" " resname="LHG" altcode=" ">
		<mog-torsion-outlier atoms="O1,C1,C2,O2" numobs="272" mean="51.40" stdev="43.20" mindiff="0.25" local_density="1.84" obsval="-31.80"/>
		<mog-torsion-outlier atoms="O2,C2,C3,O3" numobs="654" mean="54.22" stdev="50.58" mindiff="1.14" local_density="3.06" obsval="-43.37"/>
		<mog-torsion-outlier atoms="C2,C3,O3,P" numobs="474" mean="59.91" stdev="18.28" mindiff="2.38" local_density="2.53" obsval="96.38"/>
		<mog-torsion-outlier atoms="C3,O3,P,O4" numobs="40" mean="89.37" stdev="54.48" mindiff="18.95" local_density="0.00" obsval="-11.88"/>
		<mog-torsion-outlier atoms="C3,O3,P,O5" numobs="40" mean="61.54" stdev="16.09" mindiff="19.58" local_density="0.00" obsval="120.29"/>
		<mog-torsion-outlier atoms="C3,O3,P,O6" numobs="40" mean="58.95" stdev="14.74" mindiff="34.84" local_density="0.00" obsval="-125.70"/>
		<mog-torsion-outlier atoms="O6,C4,C5,C6" numobs="265" mean="54.49" stdev="15.13" mindiff="6.79" local_density="1.13" obsval="109.96"/>
		<mog-torsion-outlier atoms="O6,C4,C5,O7" numobs="299" mean="55.44" stdev="17.10" mindiff="3.67" local_density="2.68" obsval="-128.91"/>
		<mog-torsion-outlier atoms="C4,C5,C6,O8" numobs="248" mean="58.08" stdev="16.44" mindiff="1.68" local_density="1.21" obsval="119.45"/>
		<mog-torsion-outlier atoms="O7,C5,C6,O8" numobs="291" mean="96.19" stdev="49.05" mindiff="20.70" local_density="0.00" obsval="-1.87"/>
		<mog-torsion-outlier atoms="O9,C7,O7,C5" numobs="1497" mean="60.93" stdev="5.68" mindiff="8.51" local_density="0.07" obsval="67.75"/>
		<mog-torsion-outlier atoms="C8,C7,O7,C5" numobs="1189" mean="60.90" stdev="5.34" mindiff="13.23" local_density="0.00" obsval="-112.20"/>
		<mog-torsion-outlier atoms="O7,C7,C8,C9" numobs="3091" mean="55.54" stdev="21.13" mindiff="0.04" local_density="4.40" obsval="-100.21"/>
		<mog-torsion-outlier atoms="O9,C7,C8,C9" numobs="4149" mean="55.75" stdev="22.38" mindiff="0.06" local_density="4.84" obsval="79.84"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="15585" mean="113.28" stdev="37.67" mindiff="0.03" local_density="1.32" obsval="44.24"/>
		<mog-torsion-outlier atoms="O10,C23,O8,C6" numobs="4533" mean="25.78" stdev="4.38" mindiff="0.54" local_density="1.92" obsval="-31.84"/>
		<mog-torsion-outlier atoms="C24,C23,O8,C6" numobs="2608" mean="27.78" stdev="4.61" mindiff="0.20" local_density="1.30" obsval="146.21"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="4310" mean="47.02" stdev="13.02" mindiff="0.90" local_density="0.42" obsval="-132.42"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="15585" mean="34.30" stdev="20.34" mindiff="0.00" local_density="2.14" obsval="146.87"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="15585" mean="71.56" stdev="20.17" mindiff="0.08" local_density="1.19" obsval="93.65"/>
		<mog-torsion-outlier atoms="C13,C14,C15,C16" numobs="15585" mean="38.56" stdev="16.55" mindiff="0.03" local_density="1.51" obsval="140.56"/>
		<mog-torsion-outlier atoms="C19,C20,C21,C22" numobs="12796" mean="75.74" stdev="27.61" mindiff="0.00" local_density="3.35" obsval="-83.88"/>
		<mog-torsion-outlier atoms="C24,C25,C26,C27" numobs="15585" mean="32.85" stdev="21.69" mindiff="0.01" local_density="2.55" obsval="-149.05"/>
		<mog-torsion-outlier atoms="C26,C27,C28,C29" numobs="15585" mean="78.76" stdev="26.01" mindiff="0.03" local_density="2.91" obsval="-83.79"/>
		<mog-torsion-outlier atoms="C28,C29,C30,C31" numobs="15585" mean="54.34" stdev="9.26" mindiff="0.13" local_density="0.80" obsval="-117.80"/>
		<mog-torsion-outlier atoms="C30,C31,C32,C33" numobs="15585" mean="31.64" stdev="22.84" mindiff="0.03" local_density="3.04" obsval="-150.87"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C34" numobs="15585" mean="73.43" stdev="21.67" mindiff="0.00" local_density="1.42" obsval="91.07"/>
		<mog-torsion-outlier atoms="C32,C33,C34,C35" numobs="15585" mean="68.84" stdev="17.97" mindiff="0.01" local_density="0.99" obsval="97.42"/>
		<mog-torsion-outlier atoms="C34,C35,C36,C37" numobs="15585" mean="31.89" stdev="22.60" mindiff="0.02" local_density="2.91" obsval="-150.50"/>
		<mog-torsion-outlier atoms="C35,C36,C37,C38" numobs="12796" mean="38.57" stdev="21.14" mindiff="0.05" local_density="2.62" obsval="-142.44"/>
		<mog-angle-outlier atoms="C5,O7,C7" numobs="319" mean="117.80" stdev="2.39" mindiff="0.03" Zscore="-2.47" obsval="111.89"/>
		<mog-angle-outlier atoms="O7,C7,C8" numobs="587" mean="111.48" stdev="2.16" mindiff="0.24" Zscore="3.77" obsval="119.64"/>
		<mog-angle-outlier atoms="O8,C23,C24" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.12" Zscore="2.30" obsval="118.84"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6000" Q_score="0.441" mogul_rmsz_numbonds="49" mogul_rmsz_numangles="52" mogul_bonds_rmsz="0.90" mogul_angles_rmsz="1.07" num-H-reduce="79" model="1" chain="3" resnum="220" said="WB" ent="25" seq="." icode=" " resname="PTY" altcode=" ">
		<mog-torsion-outlier atoms="N1,C2,C3,O11" numobs="40" mean="47.96" stdev="10.41" mindiff="27.67" local_density="0.00" obsval="107.61"/>
		<mog-torsion-outlier atoms="C31,C30,O4,C1" numobs="2608" mean="101.56" stdev="7.01" mindiff="8.45" local_density="0.04" obsval="71.83"/>
		<mog-torsion-outlier atoms="O30,C30,O4,C1" numobs="4533" mean="102.04" stdev="6.94" mindiff="8.85" local_density="0.04" obsval="-108.71"/>
		<mog-torsion-outlier atoms="O10,C8,O7,C6" numobs="1497" mean="45.67" stdev="5.38" mindiff="0.94" local_density="0.53" obsval="-52.43"/>
		<mog-torsion-outlier atoms="C11,C8,O7,C6" numobs="1189" mean="45.38" stdev="5.27" mindiff="0.66" local_density="0.50" obsval="127.76"/>
		<mog-torsion-outlier atoms="C12,C11,C8,O7" numobs="3091" mean="121.28" stdev="49.16" mindiff="0.19" local_density="2.85" obsval="-11.80"/>
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		<mog-torsion-outlier atoms="C19,C20,C21,C22" numobs="15585" mean="104.29" stdev="37.17" mindiff="0.02" local_density="4.52" obsval="53.44"/>
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	<ModelledSubgroup residue_inclusion="1.0000" Q_score="0.587" phi="-61.0" psi="-43.4" rama="Favored" num-H-reduce="5" model="1" chain="A" resnum="746" said="D" ent="4" seq="741" icode=" " resname="ALA" altcode=" "/>
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		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="110.99" stdev="48.04" mindiff="0.03" local_density="3.62" obsval="-22.60"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="26.67" stdev="4.58" mindiff="0.29" local_density="1.34" obsval="147.35"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="27.47" stdev="4.47" mindiff="0.17" local_density="1.65" obsval="-33.58"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="14.54" stdev="1.60" mindiff="0.22" local_density="2.44" obsval="-160.24"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="15.27" stdev="3.20" mindiff="0.00" local_density="2.42" obsval="20.47"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="44.74" stdev="22.65" mindiff="2.50" local_density="0.51" obsval="141.98"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="57.08" stdev="19.30" mindiff="1.51" local_density="2.36" obsval="-131.48"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="52.89" stdev="16.44" mindiff="3.93" local_density="1.14" obsval="107.17"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="51.93" stdev="13.78" mindiff="1.67" local_density="1.14" obsval="-113.36"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="54.35" stdev="15.96" mindiff="0.39" local_density="1.47" obsval="125.65"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="73.18" stdev="19.58" mindiff="0.11" local_density="1.45" obsval="-91.70"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="76.27" stdev="45.78" mindiff="0.58" local_density="0.29" obsval="16.05"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="52.35" stdev="14.68" mindiff="0.42" local_density="0.76" obsval="-110.68"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="55.17" stdev="26.59" mindiff="0.42" local_density="1.10" obsval="139.79"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="53.76" stdev="23.06" mindiff="0.38" local_density="1.41" obsval="-96.14"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="24" mean="1.40" stdev="0.01" mindiff="0.08" Zscore="9.63" obsval="1.50"/>
		<mog-bond-outlier atoms="CHB,C4A" numobs="69" mean="1.38" stdev="0.01" mindiff="0.00" Zscore="-2.82" obsval="1.35"/>
		<mog-bond-outlier atoms="CHB,C1B" numobs="11077" mean="1.39" stdev="0.02" mindiff="0.00" Zscore="5.46" obsval="1.48"/>
		<mog-bond-outlier atoms="CHC,C4B" numobs="11077" mean="1.39" stdev="0.02" mindiff="0.00" Zscore="5.51" obsval="1.48"/>
		<mog-bond-outlier atoms="CHC,C1C" numobs="9376" mean="1.39" stdev="0.02" mindiff="0.00" Zscore="4.83" obsval="1.48"/>
		<mog-bond-outlier atoms="CHD,C4C" numobs="9376" mean="1.39" stdev="0.02" mindiff="0.00" Zscore="4.71" obsval="1.48"/>
		<mog-bond-outlier atoms="CHD,C1D" numobs="11077" mean="1.39" stdev="0.02" mindiff="0.00" Zscore="4.80" obsval="1.47"/>
		<mog-bond-outlier atoms="C3A,C2A" numobs="29" mean="1.54" stdev="0.01" mindiff="0.01" Zscore="-3.16" obsval="1.52"/>
		<mog-bond-outlier atoms="O2A,C1" numobs="398" mean="1.46" stdev="0.03" mindiff="0.02" Zscore="5.31" obsval="1.60"/>
		<mog-bond-outlier atoms="C1B,C2B" numobs="6131" mean="1.39" stdev="0.01" mindiff="0.02" Zscore="9.36" obsval="1.50"/>
		<mog-bond-outlier atoms="C3B,C2B" numobs="8279" mean="1.40" stdev="0.01" mindiff="0.00" Zscore="4.85" obsval="1.46"/>
		<mog-bond-outlier atoms="C3B,C4B" numobs="134" mean="1.41" stdev="0.01" mindiff="0.01" Zscore="7.21" obsval="1.48"/>
		<mog-bond-outlier atoms="C1D,C2D" numobs="6131" mean="1.39" stdev="0.01" mindiff="0.02" Zscore="8.78" obsval="1.49"/>
		<mog-bond-outlier atoms="C3D,C2D" numobs="124" mean="1.39" stdev="0.02" mindiff="0.02" Zscore="4.46" obsval="1.47"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="236" mean="1.41" stdev="0.02" mindiff="0.03" Zscore="-4.44" obsval="1.34"/>
		<mog-bond-outlier atoms="OBD,CAD" numobs="5881" mean="1.22" stdev="0.01" mindiff="0.00" Zscore="4.93" obsval="1.28"/>
		<mog-bond-outlier atoms="O2D,CGD" numobs="10433" mean="1.33" stdev="0.02" mindiff="0.00" Zscore="5.10" obsval="1.45"/>
		<mog-angle-outlier atoms="C1B,CHB,C4A" numobs="38" mean="121.32" stdev="0.64" mindiff="6.16" Zscore="11.48" obsval="128.71"/>
		<mog-angle-outlier atoms="C1C,CHC,C4B" numobs="50" mean="116.07" stdev="3.58" mindiff="3.83" Zscore="3.40" obsval="128.24"/>
		<mog-angle-outlier atoms="CHA,C1A,C2A" numobs="44" mean="133.31" stdev="2.35" mindiff="0.78" Zscore="-4.07" obsval="123.75"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.24" Zscore="4.44" obsval="125.37"/>
		<mog-angle-outlier atoms="O2A,CGA,O1A" numobs="4550" mean="123.63" stdev="2.50" mindiff="0.18" Zscore="-5.21" obsval="110.61"/>
		<mog-angle-outlier atoms="CMB,C2B,C3B" numobs="143" mean="124.68" stdev="2.00" mindiff="0.19" Zscore="2.30" obsval="129.28"/>
		<mog-angle-outlier atoms="CMC,C2C,C1C" numobs="1214" mean="124.73" stdev="1.80" mindiff="0.04" Zscore="2.76" obsval="129.69"/>
		<mog-angle-outlier atoms="C4C,C3C,C2C" numobs="30" mean="113.37" stdev="3.95" mindiff="2.28" Zscore="-2.16" obsval="104.82"/>
		<mog-angle-outlier atoms="CBC,CAC,C3C" numobs="299" mean="112.87" stdev="1.43" mindiff="0.08" Zscore="-3.31" obsval="108.14"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="201" mean="124.72" stdev="1.52" mindiff="0.07" Zscore="-2.45" obsval="121.02"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="112" mean="110.95" stdev="1.10" mindiff="4.04" Zscore="7.77" obsval="119.49"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.24" obsval="119.49"/>
		<mog-angle-outlier atoms="CED,O2D,CGD" numobs="10433" mean="115.92" stdev="2.27" mindiff="0.02" Zscore="2.15" obsval="120.80"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.56" Zscore="3.13" obsval="120.17"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.93" Zscore="-3.00" obsval="121.28"/>
		<mog-angle-outlier atoms="C4,C3,C5" numobs="1064" mean="115.23" stdev="1.74" mindiff="0.01" Zscore="2.37" obsval="119.34"/>
		<clash atom="H15" dist="1.81" clashmag="0.61" cid="28"/>
		<clash atom="H11" dist="1.81" clashmag="0.61" cid="28"/>
		<clash atom="H6" dist="2.38" clashmag="0.58" cid="30"/>
		<clash atom="H13" dist="2.05" clashmag="0.56" cid="32"/>
		<clash atom="CGD" dist="2.50" clashmag="0.41" cid="37"/>
		<clash atom="H8" dist="2.50" clashmag="0.41" cid="37"/>
		<chiral-outlier problem="PLANAR" atom="NC"/>
		<chiral-outlier problem="PLANAR" atom="NA"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
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		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="56.96" stdev="7.94" mindiff="5.16" local_density="1.11" obsval="-117.36"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="57.47" stdev="12.06" mindiff="4.11" local_density="0.78" obsval="127.64"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="52.36" stdev="9.47" mindiff="0.14" local_density="0.43" obsval="-117.28"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="159.20" stdev="7.45" mindiff="32.26" local_density="0.00" obsval="14.16"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="158.76" stdev="7.19" mindiff="26.53" local_density="0.00" obsval="-165.45"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="113.38" stdev="37.60" mindiff="34.38" local_density="0.00" obsval="-179.38"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="112.60" stdev="39.49" mindiff="37.00" local_density="0.00" obsval="0.65"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="28.60" stdev="1.73" mindiff="3.67" local_density="0.08" obsval="-146.15"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="28.54" stdev="3.04" mindiff="0.66" local_density="0.40" obsval="33.88"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="45.57" stdev="20.81" mindiff="4.63" local_density="0.29" obsval="-139.85"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="58.29" stdev="45.65" mindiff="2.20" local_density="1.47" obsval="-34.14"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="52.11" stdev="8.26" mindiff="0.38" local_density="0.44" obsval="119.58"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="51.89" stdev="13.43" mindiff="1.47" local_density="1.47" obsval="-120.17"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="51.67" stdev="13.45" mindiff="0.02" local_density="1.14" obsval="115.06"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="40.33" stdev="13.10" mindiff="0.08" local_density="0.86" obsval="135.38"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.26" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.90" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.15" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.42" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.24" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.03" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.73" Zscore="9.60" obsval="111.06"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.08" Zscore="-2.13" obsval="121.58"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.46" Zscore="2.99" obsval="119.82"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.14" Zscore="3.86" obsval="123.62"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="3.06" Zscore="4.22" obsval="126.87"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.41" Zscore="-3.01" obsval="107.84"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.15" Zscore="2.76" obsval="112.88"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.24" Zscore="-2.56" obsval="104.29"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.12" Zscore="2.04" obsval="112.15"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.85" Zscore="4.89" obsval="133.35"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.14" Zscore="2.38" obsval="137.45"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.02" Zscore="-2.09" obsval="120.39"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.16" Zscore="5.43" obsval="120.72"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.55" obsval="118.88"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.22" Zscore="2.78" obsval="118.82"/>
		<clash atom="HHC" dist="1.47" clashmag="0.94" cid="13"/>
		<clash atom="HHC" dist="2.26" clashmag="0.63" cid="14"/>
		<clash atom="HBB1" dist="1.47" clashmag="0.94" cid="13"/>
		<clash atom="CBB" dist="2.26" clashmag="0.63" cid="14"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
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		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="61.63" stdev="9.17" mindiff="14.73" local_density="0.00" obsval="107.80"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="71.24" stdev="29.20" mindiff="36.61" local_density="0.00" obsval="-5.46"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="84.41" stdev="6.48" mindiff="0.68" local_density="0.15" obsval="89.03"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="84.50" stdev="6.66" mindiff="0.51" local_density="0.09" obsval="-91.15"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="111.14" stdev="37.60" mindiff="32.14" local_density="0.00" obsval="-177.14"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="110.40" stdev="39.49" mindiff="34.79" local_density="0.00" obsval="2.85"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="44.12" stdev="1.76" mindiff="9.92" local_density="0.02" obsval="-130.62"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="43.98" stdev="2.92" mindiff="1.03" local_density="0.09" obsval="49.38"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="52.66" stdev="14.11" mindiff="0.27" local_density="1.47" obsval="-121.91"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="51.63" stdev="13.40" mindiff="0.30" local_density="1.14" obsval="115.33"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="36.53" stdev="15.85" mindiff="0.01" local_density="1.22" obsval="-140.53"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="55.90" stdev="37.90" mindiff="0.03" local_density="3.51" obsval="152.48"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="53.68" stdev="32.94" mindiff="0.07" local_density="4.44" obsval="-84.69"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.04" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.90" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.18" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.78" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.14" obsval="1.32"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.79" Zscore="9.73" obsval="111.12"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.15" Zscore="-2.16" obsval="121.50"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.69" Zscore="2.18" obsval="117.64"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.04" Zscore="2.76" obsval="120.25"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.07" Zscore="-2.38" obsval="108.40"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.12" Zscore="2.73" obsval="112.85"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.35" Zscore="-2.67" obsval="104.18"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.11" Zscore="-2.01" obsval="121.97"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.60" Zscore="5.32" obsval="134.10"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.40" Zscore="-2.21" obsval="122.61"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.05" Zscore="2.47" obsval="137.64"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.14" Zscore="-2.03" obsval="120.51"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.32" Zscore="5.25" obsval="120.41"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.45" obsval="119.08"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.00" Zscore="2.99" obsval="119.61"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.87" Zscore="-2.96" obsval="121.34"/>
		<clash atom="HMB1" dist="2.00" clashmag="0.43" cid="405"/>
		<clash atom="HBB1" dist="2.00" clashmag="0.43" cid="405"/>
		<clash atom="HMA1" dist="2.00" clashmag="0.42" cid="406"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8923" Q_score="0.568" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.39" mogul_angles_rmsz="1.82" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="804" said="BC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="66.58" stdev="5.61" mindiff="6.94" local_density="0.12" obsval="-106.96"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="67.21" stdev="6.16" mindiff="2.69" local_density="0.20" obsval="73.80"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="98.81" stdev="39.47" mindiff="13.42" local_density="0.00" obsval="34.89"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="40" mean="108.91" stdev="36.09" mindiff="28.66" local_density="0.00" obsval="-173.66"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O2D" numobs="41" mean="106.51" stdev="38.71" mindiff="31.11" local_density="0.00" obsval="6.54"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="44.86" stdev="1.76" mindiff="10.66" local_density="0.00" obsval="-129.89"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="44.91" stdev="2.92" mindiff="0.10" local_density="0.09" obsval="50.31"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="65.01" stdev="27.12" mindiff="0.04" local_density="1.95" obsval="90.28"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="123.56" stdev="35.39" mindiff="0.77" local_density="0.36" obsval="35.10"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="59.25" stdev="45.65" mindiff="3.17" local_density="1.47" obsval="-33.18"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="82.00" stdev="51.69" mindiff="0.87" local_density="4.56" obsval="-43.42"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="30.68" stdev="20.46" mindiff="0.07" local_density="3.50" obsval="-148.54"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="55.25" stdev="28.01" mindiff="0.37" local_density="1.23" obsval="-141.42"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="96.93" stdev="55.22" mindiff="0.14" local_density="1.71" obsval="-17.51"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.38" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.93" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.09" obsval="1.51"/>
		<mog-bond-outlier atoms="CHD,C1D" numobs="3707" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.01" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.42" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.40" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.97" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.11" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.02" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.05" Zscore="8.11" obsval="110.38"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.01" Zscore="-2.29" obsval="121.21"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.59" Zscore="2.14" obsval="117.54"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.04" Zscore="2.54" obsval="119.58"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.28" Zscore="3.07" obsval="124.09"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.34" Zscore="-2.93" obsval="107.91"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.01" Zscore="2.30" obsval="112.39"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.05" Zscore="-2.38" obsval="104.48"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="2.23" Zscore="5.68" obsval="134.73"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.15" Zscore="-2.53" obsval="121.90"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.25" Zscore="2.56" obsval="137.84"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.17" Zscore="4.60" obsval="119.26"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.40" obsval="119.18"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="7.99" Zscore="3.77" obsval="122.60"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="2.11" Zscore="-3.11" obsval="121.10"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="155" mean="113.26" stdev="2.67" mindiff="1.60" Zscore="2.40" obsval="119.65"/>
		<clash atom="HMC2" dist="2.37" clashmag="0.60" cid="351"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9231" Q_score="0.589" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.85" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="805" said="CC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="53.35" stdev="11.92" mindiff="2.22" local_density="1.11" obsval="-124.75"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="53.97" stdev="10.98" mindiff="0.13" local_density="0.78" obsval="123.40"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="66.55" stdev="27.56" mindiff="0.08" local_density="4.50" obsval="-89.72"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="66.69" stdev="28.81" mindiff="0.07" local_density="4.89" obsval="79.84"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="118.08" stdev="7.32" mindiff="5.45" local_density="0.12" obsval="55.29"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="119.00" stdev="7.12" mindiff="8.06" local_density="0.04" obsval="-125.69"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="72.19" stdev="36.91" mindiff="3.04" local_density="5.00" obsval="-137.83"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="33.40" stdev="1.74" mindiff="0.80" local_density="0.08" obsval="-141.34"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="34.49" stdev="2.97" mindiff="0.31" local_density="0.23" obsval="39.86"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="34.12" stdev="16.57" mindiff="0.03" local_density="3.59" obsval="-101.48"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="67.08" stdev="31.61" mindiff="0.02" local_density="3.60" obsval="85.11"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="47.64" stdev="32.82" mindiff="0.40" local_density="4.56" obsval="-149.30"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="38.50" stdev="25.09" mindiff="0.00" local_density="4.72" obsval="88.45"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="42.42" stdev="11.73" mindiff="0.02" local_density="0.63" obsval="-132.58"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="42.91" stdev="17.53" mindiff="0.74" local_density="2.65" obsval="-99.52"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.64" stdev="23.98" mindiff="0.94" local_density="1.52" obsval="138.63"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="82.61" stdev="54.36" mindiff="0.24" local_density="2.28" obsval="-32.45"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="53.72" stdev="26.86" mindiff="1.02" local_density="2.28" obsval="91.59"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.08" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.87" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.03" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.66" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.12" obsval="1.33"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.69" Zscore="9.51" obsval="111.02"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.04" Zscore="3.24" obsval="121.71"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.10" Zscore="2.92" obsval="123.71"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.11" Zscore="-2.34" obsval="108.44"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.06" Zscore="2.56" obsval="112.67"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.31" Zscore="-2.63" obsval="104.22"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.10" Zscore="-2.05" obsval="104.87"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.48" Zscore="5.25" obsval="133.97"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.20" Zscore="-2.13" obsval="122.81"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.12" Zscore="2.39" obsval="137.47"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.07" Zscore="5.11" obsval="120.16"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.42" obsval="119.14"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="2.31" Zscore="2.29" obsval="116.91"/>
		<clash atom="C15" dist="2.40" clashmag="0.51" cid="98"/>
		<clash atom="H152" dist="1.96" clashmag="0.47" cid="108"/>
		<clash atom="H143" dist="2.03" clashmag="0.40" cid="138"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7231" Q_score="0.501" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.86" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="806" said="DC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="48.06" stdev="4.97" mindiff="0.13" local_density="0.27" obsval="125.62"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="47.44" stdev="5.44" mindiff="0.41" local_density="0.44" obsval="-53.90"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="130.53" stdev="39.47" mindiff="45.14" local_density="0.00" obsval="3.17"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="71.32" stdev="35.97" mindiff="0.67" local_density="3.36" obsval="-59.03"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="69.61" stdev="32.05" mindiff="0.10" local_density="1.48" obsval="119.25"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="39.39" stdev="1.74" mindiff="5.19" local_density="0.02" obsval="-135.35"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="38.64" stdev="2.96" mindiff="0.15" local_density="0.15" obsval="44.02"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="44.56" stdev="23.05" mindiff="2.03" local_density="0.51" obsval="-142.44"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="42.75" stdev="11.53" mindiff="0.03" local_density="0.57" obsval="-132.13"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="50.55" stdev="8.36" mindiff="0.29" local_density="0.42" obsval="121.66"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="40.56" stdev="21.30" mindiff="0.05" local_density="4.13" obsval="-93.78"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.19" stdev="27.54" mindiff="1.35" local_density="2.28" obsval="143.02"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="78.32" stdev="23.39" mindiff="0.00" local_density="2.43" obsval="84.98"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.16" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.84" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.69" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.16" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.07" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.29" Zscore="8.63" obsval="110.62"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="2.15" Zscore="2.37" obsval="118.13"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.25" Zscore="2.85" obsval="123.56"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.29" Zscore="-2.88" obsval="107.96"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.12" Zscore="2.51" obsval="112.62"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.29" Zscore="-2.61" obsval="104.24"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.83" Zscore="5.45" obsval="134.33"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.31" Zscore="-2.32" obsval="122.36"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.31" Zscore="2.29" obsval="137.28"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.10" Zscore="-2.05" obsval="120.47"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.90" Zscore="5.58" obsval="120.98"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.72" obsval="118.54"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="7.10" Zscore="3.53" obsval="121.71"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.70" Zscore="-2.86" obsval="121.51"/>
		<clash atom="HMD1" dist="1.99" clashmag="0.44" cid="432"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8308" Q_score="0.565" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.84" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="807" said="EC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="51.40" stdev="14.64" mindiff="6.38" local_density="1.11" obsval="128.91"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="60.74" stdev="29.20" mindiff="26.10" local_density="0.00" obsval="15.96"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="65.01" stdev="25.34" mindiff="0.03" local_density="3.32" obsval="-92.63"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="51.80" stdev="5.07" mindiff="1.16" local_density="0.27" obsval="-121.85"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="52.18" stdev="5.62" mindiff="0.19" local_density="0.38" obsval="58.68"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="96.18" stdev="37.60" mindiff="17.18" local_density="0.00" obsval="-162.18"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="95.32" stdev="39.49" mindiff="19.72" local_density="0.00" obsval="17.93"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="23.78" stdev="1.70" mindiff="0.20" local_density="0.21" obsval="-150.97"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="23.84" stdev="3.07" mindiff="0.04" local_density="0.68" obsval="29.14"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="47.47" stdev="16.72" mindiff="2.75" local_density="0.11" obsval="-134.96"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="65.98" stdev="45.70" mindiff="9.94" local_density="0.29" obsval="-26.40"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="47.62" stdev="33.05" mindiff="0.67" local_density="4.56" obsval="-149.56"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="54.42" stdev="8.53" mindiff="0.15" local_density="0.36" obsval="-116.49"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="94.24" stdev="52.03" mindiff="2.46" local_density="0.76" obsval="30.92"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="106.11" stdev="34.87" mindiff="0.00" local_density="4.91" obsval="52.71"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.13" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.79" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.58" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.07" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.22" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.36" Zscore="8.79" obsval="110.69"/>
		<mog-angle-outlier atoms="CAA,C2A,C1A" numobs="31" mean="111.97" stdev="3.28" mindiff="0.72" Zscore="-2.06" obsval="105.21"/>
		<mog-angle-outlier atoms="CBA,CAA,C2A" numobs="171" mean="113.79" stdev="2.98" mindiff="0.73" Zscore="2.13" obsval="120.12"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.08" obsval="118.17"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.08" Zscore="2.34" obsval="122.31"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.07" Zscore="-2.63" obsval="108.18"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.08" Zscore="2.21" obsval="112.31"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.21" Zscore="-2.53" obsval="104.32"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.04" Zscore="-2.25" obsval="104.73"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.10" Zscore="2.02" obsval="112.12"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.07" Zscore="5.02" obsval="133.56"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.13" Zscore="2.38" obsval="137.46"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.37" Zscore="-2.48" obsval="119.63"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.12" Zscore="6.16" obsval="122.00"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.81" obsval="118.37"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.53" Zscore="3.13" obsval="120.14"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.36" Zscore="-2.04" obsval="122.85"/>
		<clash atom="HMB3" dist="1.84" clashmag="0.58" cid="374"/>
		<clash atom="HBB1" dist="1.84" clashmag="0.58" cid="374"/>
		<clash atom="HBB1" dist="2.45" clashmag="0.45" cid="375"/>
		<clash atom="CMB" dist="2.45" clashmag="0.45" cid="375"/>
		<clash atom="H122" dist="2.03" clashmag="0.41" cid="377"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8308" Q_score="0.54" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.88" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="808" said="FC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="51.74" stdev="14.13" mindiff="5.64" local_density="1.11" obsval="-128.17"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="52.32" stdev="10.53" mindiff="2.16" local_density="0.78" obsval="121.38"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="56.28" stdev="22.52" mindiff="0.06" local_density="4.75" obsval="-81.11"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="56.57" stdev="21.63" mindiff="0.27" local_density="4.37" obsval="98.18"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="37.06" stdev="4.67" mindiff="1.20" local_density="0.61" obsval="136.76"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="37.63" stdev="5.00" mindiff="1.02" local_density="0.82" obsval="-43.96"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="80.28" stdev="39.35" mindiff="5.17" local_density="0.70" obsval="53.48"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="70.49" stdev="33.38" mindiff="2.16" local_density="2.52" obsval="62.03"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="69.03" stdev="29.08" mindiff="3.56" local_density="0.74" obsval="-115.80"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="52.36" stdev="1.81" mindiff="15.28" local_density="0.00" obsval="-122.38"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="51.91" stdev="2.92" mindiff="2.36" local_density="0.05" obsval="57.33"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="32.00" stdev="17.54" mindiff="0.20" local_density="4.65" obsval="98.47"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="55.48" stdev="8.57" mindiff="2.74" local_density="0.07" obsval="-114.46"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="48.10" stdev="28.24" mindiff="2.18" local_density="2.28" obsval="-143.85"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="40.55" stdev="21.32" mindiff="0.08" local_density="4.13" obsval="93.75"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="39.66" stdev="22.90" mindiff="0.40" local_density="4.72" obsval="-91.45"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.09" stdev="28.38" mindiff="2.35" local_density="1.90" obsval="144.02"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.20" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.91" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.64" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.34" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.06" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.12" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.04" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.24" Zscore="8.53" obsval="110.57"/>
		<mog-angle-outlier atoms="CAA,C2A,C1A" numobs="31" mean="111.97" stdev="3.28" mindiff="0.17" Zscore="-2.34" obsval="104.32"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.41" Zscore="2.08" obsval="117.36"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.25" obsval="118.69"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.45" Zscore="2.77" obsval="123.37"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.71" Zscore="-3.34" obsval="107.55"/>
		<mog-angle-outlier atoms="CBB,CAB,C3B" numobs="151" mean="127.53" stdev="5.00" mindiff="0.53" Zscore="-2.08" obsval="117.15"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.12" Zscore="2.17" obsval="112.26"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.02" Zscore="-2.32" obsval="104.55"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.01" Zscore="-2.20" obsval="104.77"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.45" Zscore="5.23" obsval="133.94"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.30" Zscore="-2.17" obsval="122.71"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.25" Zscore="2.32" obsval="137.34"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.19" Zscore="-2.20" obsval="120.18"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.90" Zscore="5.58" obsval="120.99"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.58" obsval="118.83"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="7.29" Zscore="3.58" obsval="121.90"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.53" Zscore="-2.15" obsval="122.68"/>
		<clash atom="HBB1" dist="2.47" clashmag="0.45" cid="376"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8462" Q_score="0.537" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.76" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="809" said="GC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="113.06" stdev="51.64" mindiff="4.23" local_density="1.11" obsval="29.61"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="67.08" stdev="28.33" mindiff="0.67" local_density="4.72" obsval="88.72"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="89.24" stdev="6.70" mindiff="0.94" local_density="0.12" obsval="-84.18"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="88.17" stdev="6.74" mindiff="2.03" local_density="0.04" obsval="94.83"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="10552" mean="28.37" stdev="9.02" mindiff="0.00" local_density="3.02" obsval="-65.93"/>
		<mog-torsion-outlier atoms="C4C,C3C,CAC,CBC" numobs="10557" mean="32.00" stdev="10.61" mindiff="0.05" local_density="3.74" obsval="114.97"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="88.36" stdev="2.01" mindiff="20.73" local_density="0.00" obsval="-86.37"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="89.18" stdev="3.26" mindiff="1.74" local_density="0.03" obsval="94.65"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="115.00" stdev="50.05" mindiff="0.95" local_density="0.44" obsval="-24.81"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="62.97" stdev="45.68" mindiff="6.92" local_density="0.29" obsval="-29.43"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="62.40" stdev="27.29" mindiff="0.59" local_density="3.83" obsval="142.73"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="83.49" stdev="26.75" mindiff="0.01" local_density="4.29" obsval="-78.45"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="63.23" stdev="45.68" mindiff="7.18" local_density="0.29" obsval="29.17"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="54.23" stdev="22.12" mindiff="1.46" local_density="3.80" obsval="-98.89"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.16" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.80" obsval="1.98"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.35" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.00" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.30" obsval="1.49"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.03" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.34" Zscore="8.76" obsval="110.67"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.30" Zscore="2.04" obsval="117.25"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.76" Zscore="-3.40" obsval="107.50"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.20" Zscore="2.01" obsval="112.09"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.10" Zscore="-2.24" obsval="104.62"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.14" Zscore="-2.39" obsval="104.63"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.13" Zscore="2.05" obsval="112.15"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.42" Zscore="5.22" obsval="133.92"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.27" Zscore="-2.16" obsval="122.74"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.17" Zscore="2.36" obsval="137.42"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.18" Zscore="-2.01" obsval="120.55"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.17" Zscore="5.17" obsval="120.26"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.40" obsval="119.18"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="2.98" Zscore="2.46" obsval="117.59"/>
		<mog-angle-outlier atoms="C4,C3,C2" numobs="919" mean="123.63" stdev="2.57" mindiff="0.21" Zscore="-2.25" obsval="117.86"/>
		<clash atom="HHC" dist="1.71" clashmag="0.72" cid="222"/>
		<clash atom="HHC" dist="2.42" clashmag="0.47" cid="225"/>
		<clash atom="HBB1" dist="1.71" clashmag="0.72" cid="222"/>
		<clash atom="HMA1" dist="2.45" clashmag="0.50" cid="223"/>
		<clash atom="HAA2" dist="1.95" clashmag="0.48" cid="224"/>
		<clash atom="CBB" dist="2.42" clashmag="0.47" cid="225"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9231" Q_score="0.592" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.93" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="810" said="HC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="119.42" stdev="51.64" mindiff="10.59" local_density="0.00" obsval="23.25"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="27.87" stdev="16.98" mindiff="3.96" local_density="4.65" obsval="-91.26"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="33.16" stdev="4.60" mindiff="0.00" local_density="0.84" obsval="140.72"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="32.13" stdev="4.66" mindiff="0.71" local_density="1.15" obsval="-38.36"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="71.51" stdev="36.58" mindiff="1.36" local_density="3.36" obsval="58.33"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="69.64" stdev="32.18" mindiff="0.05" local_density="1.48" obsval="-119.41"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="99.59" stdev="37.60" mindiff="20.58" local_density="0.00" obsval="-165.59"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="99.01" stdev="39.49" mindiff="23.41" local_density="0.00" obsval="14.24"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="21.31" stdev="1.70" mindiff="2.28" local_density="0.23" obsval="-153.45"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="21.09" stdev="3.14" mindiff="0.01" local_density="0.84" obsval="26.37"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="41.17" stdev="30.74" mindiff="0.06" local_density="2.17" obsval="151.22"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="57.49" stdev="45.64" mindiff="1.40" local_density="2.06" obsval="-34.94"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="61.17" stdev="11.41" mindiff="0.22" local_density="0.56" obsval="-107.51"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.05" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.93" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.06" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.61" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.16" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.03" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.00" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.64" Zscore="9.40" obsval="110.97"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="2.00" Zscore="2.30" obsval="117.96"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.07" Zscore="2.58" obsval="119.70"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.39" Zscore="2.46" obsval="122.61"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.42" Zscore="-3.03" obsval="107.83"/>
		<mog-angle-outlier atoms="CBB,CAB,C3B" numobs="151" mean="127.53" stdev="5.00" mindiff="0.78" Zscore="-2.20" obsval="116.54"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.21" Zscore="2.09" obsval="112.17"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.15" Zscore="-2.48" obsval="104.37"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.05" Zscore="-2.12" obsval="104.82"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.38" Zscore="-2.21" obsval="121.70"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.63" Zscore="5.34" obsval="134.13"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.43" Zscore="-2.23" obsval="122.58"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.11" Zscore="2.39" obsval="137.48"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.71" Zscore="-2.65" obsval="119.29"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.65" Zscore="6.46" obsval="122.53"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.91" obsval="118.18"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.36" Zscore="3.34" obsval="120.97"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7231" Q_score="0.443" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.79" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="811" said="IC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="45.23" stdev="12.78" mindiff="7.56" local_density="0.32" obsval="-131.49"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="100.88" stdev="46.11" mindiff="0.20" local_density="4.95" obsval="-33.70"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="107.38" stdev="7.19" mindiff="2.62" local_density="0.08" obsval="-66.00"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="106.71" stdev="7.03" mindiff="4.17" local_density="0.04" obsval="113.39"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="45.41" stdev="1.77" mindiff="11.21" local_density="0.00" obsval="-129.34"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="45.38" stdev="2.92" mindiff="0.37" local_density="0.09" obsval="50.78"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="43.37" stdev="25.70" mindiff="0.00" local_density="0.96" obsval="145.48"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="75.11" stdev="20.99" mindiff="0.19" local_density="1.72" obsval="-89.18"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="85.12" stdev="51.78" mindiff="2.32" local_density="3.04" obsval="-40.23"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="74.08" stdev="53.66" mindiff="0.09" local_density="4.53" obsval="-41.59"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.21" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.90" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.01" obsval="1.51"/>
		<mog-bond-outlier atoms="CHD,C1D" numobs="3707" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.03" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.78" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.21" obsval="1.32"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.59" Zscore="9.30" obsval="110.92"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.28" Zscore="3.06" obsval="120.00"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.09" Zscore="2.18" obsval="118.47"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.17" Zscore="-2.10" obsval="108.66"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.20" Zscore="2.80" obsval="112.93"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.30" Zscore="-2.61" obsval="104.23"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.37" Zscore="5.19" obsval="133.87"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.30" Zscore="-2.17" obsval="122.71"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.25" Zscore="2.32" obsval="137.34"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.14" Zscore="4.41" obsval="118.95"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.25" obsval="119.47"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.11" Zscore="3.02" obsval="119.72"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="2.37" Zscore="-3.27" obsval="120.84"/>
		<clash atom="HBB1" dist="1.93" clashmag="0.50" cid="103"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9538" Q_score="0.609" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.83" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="812" said="JC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="41.23" stdev="32.12" mindiff="6.18" local_density="2.22" obsval="-150.70"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="31.77" stdev="14.86" mindiff="0.91" local_density="1.55" obsval="96.13"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="61.52" stdev="20.25" mindiff="0.78" local_density="1.18" obsval="-99.32"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="52.93" stdev="5.11" mindiff="0.64" local_density="0.27" obsval="-120.71"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="54.04" stdev="5.69" mindiff="0.39" local_density="0.31" obsval="60.55"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="37.68" stdev="12.45" mindiff="1.97" local_density="3.86" obsval="129.62"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="40" mean="86.26" stdev="36.09" mindiff="6.01" local_density="2.50" obsval="151.01"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O2D" numobs="41" mean="83.73" stdev="38.71" mindiff="8.33" local_density="2.44" obsval="-29.32"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="34.05" stdev="1.74" mindiff="0.15" local_density="0.06" obsval="-140.69"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="33.63" stdev="2.98" mindiff="0.46" local_density="0.28" obsval="38.99"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="52.55" stdev="8.15" mindiff="3.84" local_density="0.07" obsval="121.95"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="58.99" stdev="10.21" mindiff="0.85" local_density="0.54" obsval="110.40"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="40.86" stdev="12.75" mindiff="0.16" local_density="0.78" obsval="-134.67"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.03" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.89" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.14" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.76" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.35" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.04" Zscore="-3.36" obsval="1.32"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.85" Zscore="9.86" obsval="111.18"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.18" Zscore="-2.01" obsval="121.84"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.14" Zscore="2.33" obsval="118.94"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.18" Zscore="-2.27" obsval="108.51"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.01" Zscore="2.63" obsval="112.74"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.13" Zscore="-2.19" obsval="104.68"/>
		<mog-angle-outlier atoms="CAC,C3C,C4C" numobs="5400" mean="124.79" stdev="1.30" mindiff="0.01" Zscore="2.17" obsval="127.61"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.15" Zscore="2.07" obsval="112.17"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.96" Zscore="4.96" obsval="133.46"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.14" Zscore="2.37" obsval="137.45"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.03" Zscore="5.09" obsval="120.13"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.48" obsval="119.02"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="3.72" Zscore="2.66" obsval="118.33"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.19" Zscore="-2.55" obsval="122.02"/>
		<mog-angle-outlier atoms="C6,C5,C3" numobs="49" mean="113.47" stdev="2.44" mindiff="0.31" Zscore="-2.10" obsval="108.36"/>
		<clash atom="HBB1" dist="1.90" clashmag="0.54" cid="422"/>
		<clash atom="HMC1" dist="2.36" clashmag="0.41" cid="423"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7692" Q_score="0.529" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.82" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="813" said="KC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="103.12" stdev="51.43" mindiff="5.82" local_density="4.44" obsval="39.65"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="76.21" stdev="6.08" mindiff="1.34" local_density="0.12" obsval="-97.28"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="75.98" stdev="6.45" mindiff="0.13" local_density="0.13" obsval="82.61"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="70.86" stdev="34.54" mindiff="0.83" local_density="3.36" obsval="60.69"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="69.25" stdev="30.22" mindiff="2.22" local_density="0.74" obsval="-117.13"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="40" mean="72.09" stdev="35.22" mindiff="8.59" local_density="5.00" obsval="136.41"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O2D" numobs="41" mean="70.44" stdev="38.00" mindiff="5.35" local_density="4.88" obsval="-43.00"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="14.91" stdev="1.60" mindiff="0.02" local_density="2.02" obsval="-159.87"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="15.50" stdev="3.19" mindiff="0.15" local_density="2.32" obsval="20.71"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="35.40" stdev="16.09" mindiff="0.49" local_density="3.49" obsval="-103.30"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="55.03" stdev="8.14" mindiff="1.60" local_density="0.07" obsval="115.60"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="77.66" stdev="45.79" mindiff="0.81" local_density="0.29" obsval="14.66"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="52.16" stdev="14.24" mindiff="0.75" local_density="1.14" obsval="-111.85"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="50.17" stdev="8.42" mindiff="0.14" local_density="0.42" obsval="-122.16"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="48.91" stdev="12.32" mindiff="3.16" local_density="1.47" obsval="-113.45"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="50.38" stdev="14.68" mindiff="1.73" local_density="1.52" obsval="124.21"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="35.23" stdev="16.85" mindiff="0.02" local_density="1.51" obsval="-142.29"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="30.55" stdev="20.57" mindiff="0.03" local_density="3.54" obsval="-148.73"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.22" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.94" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.09" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.68" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.42" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.00" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.08" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.37" Zscore="8.80" obsval="110.69"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.15" Zscore="-2.03" obsval="121.81"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.91" Zscore="2.27" obsval="117.86"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.02" Zscore="2.00" obsval="117.94"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.55" Zscore="-3.17" obsval="107.70"/>
		<mog-angle-outlier atoms="CBB,CAB,C3B" numobs="151" mean="127.53" stdev="5.00" mindiff="0.86" Zscore="-2.18" obsval="116.62"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.16" Zscore="2.44" obsval="112.54"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.14" Zscore="-2.46" obsval="104.39"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.21" Zscore="-2.09" obsval="121.87"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.88" Zscore="5.48" obsval="134.38"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.35" Zscore="-2.31" obsval="122.40"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.05" Zscore="2.42" obsval="137.54"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.13" Zscore="-2.03" obsval="120.51"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.21" Zscore="5.19" obsval="120.30"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.39" obsval="119.19"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.78" Zscore="2.93" obsval="119.39"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.31" Zscore="-2.62" obsval="121.90"/>
		<clash atom="HMC1" dist="2.03" clashmag="0.41" cid="545"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8615" Q_score="0.519" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.88" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="A" resnum="814" said="LC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="111.35" stdev="51.64" mindiff="2.52" local_density="1.11" obsval="31.32"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="38.86" stdev="4.73" mindiff="0.09" local_density="0.54" obsval="134.93"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="38.81" stdev="5.09" mindiff="0.19" local_density="0.79" obsval="-45.18"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="40" mean="90.87" stdev="36.09" mindiff="10.61" local_density="0.00" obsval="155.62"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O2D" numobs="41" mean="88.32" stdev="38.71" mindiff="12.92" local_density="0.00" obsval="-24.73"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="31.20" stdev="1.74" mindiff="3.00" local_density="0.08" obsval="-143.55"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="30.76" stdev="3.03" mindiff="0.47" local_density="0.32" obsval="36.11"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="51.93" stdev="32.55" mindiff="6.70" local_density="0.29" obsval="-147.75"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="50.08" stdev="32.48" mindiff="7.28" local_density="0.19" obsval="32.29"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="50.10" stdev="11.55" mindiff="2.43" local_density="0.07" obsval="-128.22"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="108.92" stdev="35.00" mindiff="0.02" local_density="3.46" obsval="49.86"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="50.75" stdev="12.70" mindiff="0.98" local_density="1.18" obsval="-117.60"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="51.70" stdev="13.49" mindiff="0.22" local_density="1.14" obsval="114.81"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="49.00" stdev="21.33" mindiff="0.35" local_density="1.90" obsval="135.08"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="80.57" stdev="45.79" mindiff="3.72" local_density="0.29" obsval="11.75"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="57.17" stdev="9.38" mindiff="0.59" local_density="0.45" obsval="112.83"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="76.54" stdev="22.05" mindiff="0.03" local_density="1.96" obsval="-87.31"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.07" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.88" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.06" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.44" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.40" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.17" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.06" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.61" Zscore="9.34" obsval="110.94"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.64" Zscore="2.93" obsval="119.64"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.05" Zscore="2.65" obsval="119.91"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.41" Zscore="-3.01" obsval="107.84"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.17" Zscore="2.46" obsval="112.56"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.24" Zscore="-2.80" obsval="104.04"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.09" Zscore="-2.07" obsval="104.86"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.12" Zscore="-2.02" obsval="121.95"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.29" Zscore="5.15" obsval="133.79"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.10" Zscore="-2.08" obsval="122.91"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.31" Zscore="2.29" obsval="137.28"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.18" Zscore="-2.01" obsval="120.56"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.19" Zscore="5.41" obsval="120.69"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.62" obsval="118.75"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.76" Zscore="3.19" obsval="120.37"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.77" Zscore="-2.29" obsval="122.44"/>
		<mog-angle-outlier atoms="C4,C3,C2" numobs="919" mean="123.63" stdev="2.57" mindiff="0.04" Zscore="-2.13" obsval="118.14"/>
		<clash atom="HBC3" dist="2.00" clashmag="0.43" cid="544"/>
		<clash atom="HMB1" dist="2.03" clashmag="0.41" cid="545"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8000" Q_score="0.474" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.96" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="A" resnum="815" said="MC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="129.48" stdev="51.64" mindiff="20.65" local_density="0.00" obsval="13.18"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="38.51" stdev="11.72" mindiff="9.20" local_density="0.78" obsval="-104.41"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="43.97" stdev="14.41" mindiff="5.54" local_density="0.43" obsval="-134.01"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="119.41" stdev="54.60" mindiff="0.04" local_density="4.65" obsval="174.35"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="128.50" stdev="49.63" mindiff="0.10" local_density="1.88" obsval="-4.40"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="48.05" stdev="4.97" mindiff="0.14" local_density="0.27" obsval="-125.63"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="49.17" stdev="5.53" mindiff="0.64" local_density="0.46" obsval="55.65"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="90.78" stdev="37.60" mindiff="11.78" local_density="0.00" obsval="-156.78"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="88.39" stdev="39.49" mindiff="12.78" local_density="0.00" obsval="24.86"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="46.48" stdev="1.77" mindiff="12.29" local_density="0.00" obsval="128.26"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="44.72" stdev="2.92" mindiff="0.30" local_density="0.10" obsval="-50.11"/>
		<mog-torsion-outlier atoms="O2A,C1,C2,C3" numobs="153" mean="61.47" stdev="28.87" mindiff="1.42" local_density="3.92" obsval="65.10"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="35.99" stdev="15.90" mindiff="0.04" local_density="3.59" obsval="-104.14"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="45.02" stdev="22.01" mindiff="3.23" local_density="0.40" obsval="-141.24"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="104.30" stdev="52.23" mindiff="7.72" local_density="0.38" obsval="-20.74"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="62.99" stdev="28.23" mindiff="0.17" local_density="4.13" obsval="-143.96"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="84.75" stdev="27.60" mindiff="0.11" local_density="4.64" obsval="-76.86"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="69.76" stdev="17.13" mindiff="0.65" local_density="1.05" obsval="96.17"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="83.23" stdev="26.58" mindiff="0.02" local_density="4.13" obsval="78.78"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="54.04" stdev="14.09" mindiff="0.75" local_density="0.75" obsval="109.39"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="54.63" stdev="16.96" mindiff="0.68" local_density="0.70" obsval="-127.47"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.35" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.93" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.12" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.55" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.99" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.16" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.81" Zscore="9.78" obsval="111.14"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.22" Zscore="-2.20" obsval="121.42"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.73" Zscore="3.44" obsval="121.02"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.09" Zscore="2.86" obsval="120.54"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.37" Zscore="2.15" obsval="121.86"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.19" Zscore="-2.76" obsval="108.07"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.04" Zscore="2.58" obsval="112.69"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.24" Zscore="-2.56" obsval="104.29"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.03" Zscore="-2.15" obsval="104.80"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.10" Zscore="-2.01" obsval="121.98"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="2.18" Zscore="5.65" obsval="134.68"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.13" Zscore="-2.40" obsval="122.18"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.00" Zscore="2.45" obsval="137.60"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.04" Zscore="-2.08" obsval="120.41"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.97" Zscore="5.05" obsval="120.06"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.23" obsval="119.51"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.90" Zscore="3.22" obsval="120.50"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.72" Zscore="-2.87" obsval="121.49"/>
		<clash atom="HMD1" dist="1.90" clashmag="0.54" cid="425"/>
		<clash atom="HMD1" dist="2.42" clashmag="0.48" cid="426"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8769" Q_score="0.551" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.38" mogul_angles_rmsz="1.83" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="816" said="NC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="106.88" stdev="44.36" mindiff="2.24" local_density="0.54" obsval="-39.50"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="66.54" stdev="28.69" mindiff="0.02" local_density="4.95" obsval="-80.10"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="60.26" stdev="14.82" mindiff="16.88" local_density="0.00" obsval="101.10"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="63.31" stdev="16.76" mindiff="20.55" local_density="0.00" obsval="-79.11"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="10552" mean="36.76" stdev="9.10" mindiff="0.73" local_density="0.41" obsval="57.49"/>
		<mog-torsion-outlier atoms="C4C,C3C,CAC,CBC" numobs="10557" mean="40.56" stdev="10.77" mindiff="0.08" local_density="1.15" obsval="-123.61"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="14.01" stdev="1.60" mindiff="0.10" local_density="3.40" obsval="-160.78"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="13.80" stdev="3.25" mindiff="0.10" local_density="3.81" obsval="18.97"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="60.03" stdev="32.61" mindiff="7.38" local_density="0.10" obsval="155.89"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="58.19" stdev="32.53" mindiff="8.69" local_density="0.10" obsval="-24.14"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="61.20" stdev="18.94" mindiff="0.89" local_density="0.51" obsval="99.86"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="65.47" stdev="14.13" mindiff="0.03" local_density="0.59" obsval="101.81"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="55.64" stdev="17.43" mindiff="0.99" local_density="1.18" obsval="-128.41"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="53.12" stdev="17.31" mindiff="5.37" local_density="1.90" obsval="105.73"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="52.62" stdev="45.59" mindiff="0.76" local_density="3.24" obsval="-39.88"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="56.94" stdev="9.30" mindiff="0.29" local_density="0.44" obsval="113.12"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.29" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.81" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.03" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.62" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.33" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.28" obsval="1.32"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.01" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.32" Zscore="8.71" obsval="110.65"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.22" Zscore="2.71" obsval="119.06"/>
		<mog-angle-outlier atoms="CBA,CAA,C2A" numobs="171" mean="113.79" stdev="2.98" mindiff="0.39" Zscore="2.00" obsval="119.76"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.08" Zscore="2.58" obsval="119.70"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.35" Zscore="2.45" obsval="122.58"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.14" Zscore="-2.71" obsval="108.11"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.01" Zscore="2.28" obsval="112.37"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.00" Zscore="-2.07" obsval="104.80"/>
		<mog-angle-outlier atoms="CAC,C3C,C4C" numobs="5400" mean="124.79" stdev="1.30" mindiff="0.00" Zscore="2.01" obsval="127.41"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.09" Zscore="-2.06" obsval="104.87"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.61" Zscore="5.33" obsval="134.11"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.45" Zscore="-2.24" obsval="122.56"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.29" Zscore="2.30" obsval="137.30"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.03" Zscore="-2.09" obsval="120.40"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.18" Zscore="5.42" obsval="120.70"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.54" obsval="118.90"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="7.70" Zscore="3.69" obsval="122.31"/>
		<clash atom="HBB1" dist="2.17" clashmag="0.79" cid="152"/>
		<clash atom="HBC2" dist="1.94" clashmag="0.50" cid="153"/>
		<clash atom="HBC2" dist="2.48" clashmag="0.44" cid="154"/>
		<clash atom="HMC3" dist="2.03" clashmag="0.40" cid="155"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8923" Q_score="0.589" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.82" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="817" said="OC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="54.99" stdev="9.79" mindiff="1.15" local_density="1.11" obsval="121.38"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="70.60" stdev="29.20" mindiff="35.96" local_density="0.00" obsval="6.11"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="99.31" stdev="45.76" mindiff="0.00" local_density="4.98" obsval="-35.46"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="26.73" stdev="4.58" mindiff="0.22" local_density="1.34" obsval="147.28"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="27.24" stdev="4.46" mindiff="0.06" local_density="1.72" obsval="-33.34"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="49.48" stdev="1.79" mindiff="15.29" local_density="0.00" obsval="-125.26"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="49.93" stdev="2.93" mindiff="0.56" local_density="0.06" obsval="55.34"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="44.39" stdev="23.43" mindiff="1.60" local_density="0.51" obsval="-142.88"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="45.57" stdev="14.27" mindiff="0.69" local_density="1.77" obsval="-105.87"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="50.06" stdev="15.80" mindiff="0.70" local_density="1.52" obsval="126.64"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="49.79" stdev="16.99" mindiff="2.85" local_density="1.52" obsval="128.80"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="87.63" stdev="45.79" mindiff="10.79" local_density="0.00" obsval="4.68"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="40.65" stdev="21.15" mindiff="0.17" local_density="3.83" obsval="-94.01"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.50" stdev="25.04" mindiff="0.41" local_density="2.28" obsval="139.98"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="80.31" stdev="24.67" mindiff="0.06" local_density="3.12" obsval="82.47"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="32.28" stdev="19.18" mindiff="0.14" local_density="2.38" obsval="146.33"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.22" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.80" obsval="1.98"/>
		<mog-bond-outlier atoms="CHC,C1C" numobs="3736" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.09" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.41" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.23" obsval="1.50"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.96" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.27" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.00" Zscore="8.01" obsval="110.33"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.13" Zscore="-2.03" obsval="121.79"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.22" Zscore="3.01" obsval="121.01"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.86" Zscore="-3.52" obsval="107.39"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.12" Zscore="-2.18" obsval="104.68"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.06" Zscore="-2.28" obsval="104.71"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.28" Zscore="-2.14" obsval="121.80"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="2.06" Zscore="5.58" obsval="134.55"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.07" Zscore="-2.43" obsval="122.12"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.21" Zscore="2.34" obsval="137.38"/>
		<mog-angle-outlier atoms="OBD,CAD,C3D" numobs="108" mean="128.42" stdev="2.34" mindiff="0.35" Zscore="-2.04" obsval="123.66"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.26" Zscore="-2.43" obsval="119.73"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.55" Zscore="5.78" obsval="121.33"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.52" obsval="118.94"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="3.48" Zscore="2.59" obsval="118.09"/>
		<clash atom="HBB1" dist="2.31" clashmag="0.61" cid="81"/>
		<clash atom="HBB1" dist="1.93" clashmag="0.51" cid="97"/>
		<clash atom="HED3" dist="1.94" clashmag="0.49" cid="104"/>
		<clash atom="O2A" dist="2.18" clashmag="0.42" cid="129"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8923" Q_score="0.603" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="2.06" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="A" resnum="818" said="PC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="63.02" stdev="10.82" mindiff="17.56" local_density="0.00" obsval="104.96"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="71.77" stdev="29.20" mindiff="37.13" local_density="0.00" obsval="-4.93"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="51.14" stdev="5.06" mindiff="0.48" local_density="0.27" obsval="-122.52"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="52.22" stdev="5.62" mindiff="0.24" local_density="0.38" obsval="58.73"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="66.77" stdev="39.16" mindiff="0.01" local_density="3.86" obsval="-67.12"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="27.50" stdev="1.72" mindiff="2.56" local_density="0.08" obsval="147.25"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="27.48" stdev="3.04" mindiff="0.01" local_density="0.45" obsval="-32.81"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="82.65" stdev="29.15" mindiff="0.05" local_density="4.27" obsval="-14.67"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="84.97" stdev="29.13" mindiff="0.30" local_density="4.65" obsval="165.91"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="52.36" stdev="13.83" mindiff="0.41" local_density="1.47" obsval="-121.23"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="51.55" stdev="13.32" mindiff="0.84" local_density="1.14" obsval="115.87"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="56.20" stdev="18.14" mindiff="0.21" local_density="1.18" obsval="-129.61"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="53.19" stdev="17.59" mindiff="4.94" local_density="2.28" obsval="105.29"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="82.86" stdev="26.33" mindiff="0.03" local_density="3.89" obsval="79.25"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="5.98" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.77" obsval="1.98"/>
		<mog-bond-outlier atoms="CHD,C1D" numobs="3707" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.05" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.79" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.34" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.24" obsval="1.32"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.06" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="4.17" Zscore="10.56" obsval="111.50"/>
		<mog-angle-outlier atoms="C2A,C3A,C4A" numobs="26" mean="101.87" stdev="1.62" mindiff="0.38" Zscore="2.11" obsval="105.27"/>
		<mog-angle-outlier atoms="CMA,C3A,C2A" numobs="98" mean="113.98" stdev="3.87" mindiff="0.84" Zscore="2.63" obsval="124.16"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="7.06" Zscore="5.79" obsval="127.34"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.07" Zscore="2.17" obsval="118.45"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.41" Zscore="3.13" obsval="124.22"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.15" Zscore="-2.07" obsval="108.68"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.07" Zscore="2.68" obsval="112.80"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.29" Zscore="-2.61" obsval="104.24"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.13" Zscore="-2.00" obsval="104.91"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.32" Zscore="-2.16" obsval="121.76"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.78" Zscore="5.42" obsval="134.27"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.10" Zscore="-2.41" obsval="122.15"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.31" Zscore="2.29" obsval="137.28"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.85" Zscore="4.98" obsval="119.94"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.39" obsval="119.20"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.56" Zscore="3.39" obsval="121.17"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.36" Zscore="-2.65" obsval="121.85"/>
		<clash atom="HBB1" dist="1.76" clashmag="0.67" cid="73"/>
		<clash atom="HMB1" dist="1.76" clashmag="0.67" cid="73"/>
		<clash atom="HMA2" dist="1.94" clashmag="0.49" cid="104"/>
		<clash atom="HHD" dist="2.03" clashmag="0.40" cid="137"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8154" Q_score="0.546" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.90" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="819" said="QC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="53.89" stdev="11.18" mindiff="1.11" local_density="1.11" obsval="123.64"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="68.01" stdev="29.20" mindiff="33.37" local_density="0.00" obsval="8.70"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="92.98" stdev="6.78" mindiff="2.20" local_density="0.12" obsval="80.43"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="92.87" stdev="6.80" mindiff="2.67" local_density="0.04" obsval="-99.53"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="97.55" stdev="39.47" mindiff="12.16" local_density="0.00" obsval="-36.16"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="82.90" stdev="37.60" mindiff="3.90" local_density="2.50" obsval="-148.90"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="81.35" stdev="39.49" mindiff="5.75" local_density="2.50" obsval="31.90"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="30.42" stdev="1.74" mindiff="3.78" local_density="0.08" obsval="-144.33"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="31.10" stdev="3.02" mindiff="0.13" local_density="0.31" obsval="36.45"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="42.23" stdev="15.87" mindiff="0.74" local_density="3.50" obsval="-64.95"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="43.73" stdev="14.34" mindiff="0.08" local_density="3.10" obsval="114.64"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="56.30" stdev="9.60" mindiff="4.83" local_density="0.07" obsval="112.37"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="53.36" stdev="45.60" mindiff="1.51" local_density="3.24" obsval="-39.12"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="49.72" stdev="12.37" mindiff="1.31" local_density="1.18" obsval="-115.31"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="50.63" stdev="14.00" mindiff="1.38" local_density="1.14" obsval="122.43"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="32.74" stdev="18.81" mindiff="0.14" local_density="2.11" obsval="-145.69"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="53.72" stdev="26.86" mindiff="1.02" local_density="2.28" obsval="91.59"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="55.41" stdev="31.11" mindiff="0.13" local_density="1.71" obsval="-144.89"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.16" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-4.02" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.11" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.65" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.34" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.23" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.06" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.03" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.61" Zscore="9.34" obsval="110.94"/>
		<mog-angle-outlier atoms="CAA,C2A,C3A" numobs="78" mean="113.00" stdev="2.70" mindiff="0.67" Zscore="2.32" obsval="119.26"/>
		<mog-angle-outlier atoms="CBA,CAA,C2A" numobs="171" mean="113.79" stdev="2.98" mindiff="0.56" Zscore="2.56" obsval="121.41"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.15" obsval="118.39"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.39" Zscore="2.05" obsval="121.61"/>
		<mog-angle-outlier atoms="CHC,C4B,NB" numobs="70" mean="124.05" stdev="1.50" mindiff="0.38" Zscore="2.02" obsval="127.08"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.01" Zscore="-2.54" obsval="108.26"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.20" Zscore="2.81" obsval="112.94"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.27" Zscore="-2.77" obsval="104.07"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.86" Zscore="5.47" obsval="134.36"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.17" Zscore="-2.38" obsval="122.22"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.04" Zscore="2.42" obsval="137.55"/>
		<mog-angle-outlier atoms="OBD,CAD,C3D" numobs="108" mean="128.42" stdev="2.34" mindiff="0.18" Zscore="-2.11" obsval="123.49"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.10" Zscore="-2.24" obsval="120.09"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.58" Zscore="5.76" obsval="121.31"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.70" obsval="118.60"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.34" Zscore="2.82" obsval="118.94"/>
		<clash atom="H201" dist="1.62" clashmag="0.80" cid="69"/>
		<clash atom="HBB1" dist="1.84" clashmag="0.57" cid="85"/>
		<clash atom="HBB1" dist="2.44" clashmag="0.47" cid="112"/>
		<clash atom="HMB3" dist="1.84" clashmag="0.57" cid="85"/>
		<clash atom="H91" dist="1.93" clashmag="0.50" cid="103"/>
		<clash atom="H203" dist="1.96" clashmag="0.47" cid="109"/>
		<clash atom="CMB" dist="2.44" clashmag="0.47" cid="112"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9077" Q_score="0.573" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.83" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="820" said="RC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="47.34" stdev="10.50" mindiff="3.34" local_density="0.11" obsval="-127.26"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="109.41" stdev="7.23" mindiff="0.59" local_density="0.08" obsval="-63.97"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="109.80" stdev="7.06" mindiff="1.07" local_density="0.04" obsval="116.49"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="34.44" stdev="1.74" mindiff="0.24" local_density="0.04" obsval="-140.30"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="33.90" stdev="2.98" mindiff="0.19" local_density="0.26" obsval="39.25"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="75.56" stdev="25.67" mindiff="0.60" local_density="1.55" obsval="-23.19"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="77.95" stdev="25.49" mindiff="0.40" local_density="1.65" obsval="157.46"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="47.62" stdev="33.00" mindiff="0.61" local_density="4.56" obsval="-149.51"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="50.33" stdev="8.39" mindiff="0.00" local_density="0.42" obsval="121.94"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="92.82" stdev="52.00" mindiff="3.91" local_density="0.76" obsval="32.37"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="54.28" stdev="8.50" mindiff="0.09" local_density="0.35" obsval="-116.68"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.05" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.92" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.02" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.64" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.16" obsval="1.32"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.02" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.70" Zscore="9.53" obsval="111.03"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.04" Zscore="2.50" obsval="119.45"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.25" Zscore="2.85" obsval="123.56"/>
		<mog-angle-outlier atoms="CMB,C2B,C1B" numobs="569" mean="125.42" stdev="1.52" mindiff="0.03" Zscore="2.02" obsval="128.50"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.34" Zscore="-2.94" obsval="107.91"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.05" Zscore="2.57" obsval="112.68"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.14" Zscore="-2.46" obsval="104.39"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.37" Zscore="5.19" obsval="133.87"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.34" Zscore="-2.19" obsval="122.67"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.01" Zscore="2.44" obsval="137.58"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.19" Zscore="5.18" obsval="120.28"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.45" obsval="119.07"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="1.65" Zscore="2.12" obsval="116.26"/>
		<clash atom="HBC2" dist="1.93" clashmag="0.51" cid="452"/>
		<clash atom="HAB" dist="2.54" clashmag="0.42" cid="454"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7231" Q_score="0.503" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.89" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="821" said="SC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="48.30" stdev="19.62" mindiff="13.03" local_density="0.00" obsval="135.56"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="55.10" stdev="29.20" mindiff="20.47" local_density="0.00" obsval="21.60"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="110.69" stdev="7.24" mindiff="0.69" local_density="0.08" obsval="62.69"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="112.62" stdev="7.08" mindiff="1.68" local_density="0.04" obsval="-119.30"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="100.95" stdev="39.47" mindiff="15.56" local_density="0.00" obsval="32.75"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="64.17" stdev="1.94" mindiff="3.46" local_density="0.02" obsval="-110.56"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="63.17" stdev="2.93" mindiff="1.08" local_density="0.04" obsval="68.60"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="80.33" stdev="32.78" mindiff="1.14" local_density="0.19" obsval="-176.28"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="78.80" stdev="32.69" mindiff="3.13" local_density="0.19" obsval="3.44"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="90.22" stdev="51.94" mindiff="2.02" local_density="1.14" obsval="-35.01"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="60.70" stdev="11.13" mindiff="0.40" local_density="0.54" obsval="108.13"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="50.80" stdev="8.33" mindiff="0.62" local_density="0.44" obsval="121.33"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="85.64" stdev="28.20" mindiff="0.00" local_density="4.91" obsval="75.74"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.20" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.91" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.07" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.62" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.12" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.05" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.58" Zscore="9.28" obsval="110.92"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.95" Zscore="2.44" obsval="118.33"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.14" obsval="118.36"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.26" Zscore="2.85" obsval="123.55"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.19" Zscore="-2.26" obsval="108.52"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.06" Zscore="2.56" obsval="112.67"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.15" Zscore="-2.88" obsval="103.95"/>
		<mog-angle-outlier atoms="CBC,CAC,C3C" numobs="10971" mean="112.42" stdev="2.71" mindiff="0.00" Zscore="-2.39" obsval="105.93"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.17" Zscore="-2.43" obsval="104.61"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.09" Zscore="2.37" obsval="112.47"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.73" Zscore="-2.09" obsval="102.97"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.16" Zscore="5.07" obsval="133.66"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.39" Zscore="2.26" obsval="137.21"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.33" Zscore="4.68" obsval="119.42"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.25" obsval="119.47"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.71" Zscore="3.43" obsval="121.32"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.72" Zscore="-2.87" obsval="121.49"/>
		<mog-angle-outlier atoms="C4,C3,C5" numobs="1064" mean="115.23" stdev="1.74" mindiff="0.06" Zscore="2.13" obsval="118.92"/>
		<clash atom="HBC2" dist="1.81" clashmag="0.63" cid="291"/>
		<clash atom="HBB1" dist="1.85" clashmag="0.56" cid="294"/>
		<clash atom="HMB3" dist="1.85" clashmag="0.56" cid="294"/>
		<clash atom="HBC1" dist="2.09" clashmag="0.53" cid="296"/>
		<clash atom="CAD" dist="2.42" clashmag="0.49" cid="297"/>
		<clash atom="H62" dist="1.81" clashmag="0.40" cid="301"/>
		<clash atom="H41" dist="1.81" clashmag="0.40" cid="301"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7846" Q_score="0.516" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.82" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="822" said="TC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="108.70" stdev="51.64" mindiff="0.13" local_density="1.11" obsval="33.97"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="55.61" stdev="22.35" mindiff="0.03" local_density="4.84" obsval="-79.48"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="55.59" stdev="21.14" mindiff="0.03" local_density="4.37" obsval="100.12"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="37.28" stdev="4.67" mindiff="1.42" local_density="0.61" obsval="136.54"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="37.53" stdev="4.99" mindiff="1.13" local_density="0.82" obsval="-43.86"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="95.79" stdev="39.47" mindiff="10.40" local_density="0.00" obsval="-37.92"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="50.41" stdev="1.80" mindiff="16.22" local_density="0.00" obsval="-124.33"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="49.43" stdev="2.93" mindiff="0.06" local_density="0.06" obsval="54.84"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="62.44" stdev="21.62" mindiff="0.68" local_density="0.85" obsval="-96.71"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="60.36" stdev="10.94" mindiff="0.62" local_density="0.54" obsval="-108.58"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="94.73" stdev="52.04" mindiff="1.96" local_density="0.76" obsval="-30.42"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="55.77" stdev="36.06" mindiff="0.41" local_density="2.81" obsval="150.45"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="53.68" stdev="31.39" mindiff="0.08" local_density="3.65" obsval="-86.43"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.09" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.97" obsval="1.97"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.59" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.09" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.09" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.46" Zscore="9.02" obsval="110.79"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.44" Zscore="2.09" obsval="117.39"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.25" obsval="118.69"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.13" Zscore="-2.70" obsval="108.12"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.07" Zscore="2.35" obsval="112.45"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.10" Zscore="-2.23" obsval="104.63"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.04" Zscore="-2.24" obsval="104.74"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.09" Zscore="2.01" obsval="112.12"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.47" Zscore="5.25" obsval="133.97"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.27" Zscore="-2.16" obsval="122.74"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.23" Zscore="2.33" obsval="137.36"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.16" Zscore="-2.18" obsval="120.22"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.95" Zscore="5.55" obsval="120.94"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.03" Zscore="-2.57" obsval="118.84"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.97" Zscore="2.98" obsval="119.58"/>
		<clash atom="HMB1" dist="1.82" clashmag="0.62" cid="342"/>
		<clash atom="HBB1" dist="1.82" clashmag="0.62" cid="342"/>
		<clash atom="HBB1" dist="2.42" clashmag="0.48" cid="343"/>
		<clash atom="CMB" dist="2.42" clashmag="0.48" cid="343"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9077" Q_score="0.605" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.77" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="823" said="UC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="40.89" stdev="18.85" mindiff="0.63" local_density="0.96" obsval="140.18"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="48.27" stdev="20.79" mindiff="0.01" local_density="4.95" obsval="-115.58"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="41.74" stdev="4.76" mindiff="2.82" local_density="0.54" obsval="-132.02"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="42.02" stdev="5.19" mindiff="0.19" local_density="0.64" obsval="48.42"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="62.02" stdev="20.71" mindiff="0.38" local_density="0.77" obsval="97.77"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="53.47" stdev="14.97" mindiff="2.08" local_density="1.47" obsval="-123.72"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="51.81" stdev="13.61" mindiff="0.90" local_density="1.14" obsval="114.13"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="56.17" stdev="9.02" mindiff="0.13" local_density="0.42" obsval="114.16"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.08" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.82" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.57" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.33" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.26" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.05" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.44" Zscore="8.96" obsval="110.77"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.99" Zscore="2.30" obsval="117.94"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.13" obsval="118.34"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.08" Zscore="2.27" obsval="122.15"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.22" Zscore="-2.79" obsval="108.04"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.06" Zscore="2.23" obsval="112.32"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.13" Zscore="-2.19" obsval="104.68"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.05" Zscore="-2.25" obsval="104.73"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.74" Zscore="-2.46" obsval="121.33"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.08" Zscore="2.00" obsval="112.11"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.96" Zscore="5.52" obsval="134.46"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.36" Zscore="-2.30" obsval="122.41"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.54" Zscore="2.18" obsval="137.05"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.02" Zscore="4.49" obsval="119.07"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.08" obsval="119.79"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.00" Zscore="2.73" obsval="118.61"/>
		<clash atom="H41" dist="1.82" clashmag="0.62" cid="79"/>
		<clash atom="H71" dist="1.82" clashmag="0.62" cid="79"/>
		<clash atom="HMA1" dist="1.85" clashmag="0.58" cid="84"/>
		<clash atom="H42" dist="1.92" clashmag="0.50" cid="101"/>
		<clash atom="HMD3" dist="2.01" clashmag="0.42" cid="128"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9846" Q_score="0.613" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.84" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="A" resnum="824" said="VC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="46.79" stdev="22.20" mindiff="16.26" local_density="0.00" obsval="-138.79"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="40.63" stdev="10.98" mindiff="11.79" local_density="0.00" obsval="107.01"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="64.18" stdev="5.52" mindiff="4.53" local_density="0.15" obsval="109.38"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="65.47" stdev="6.09" mindiff="0.94" local_density="0.20" obsval="-72.05"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="91.55" stdev="39.47" mindiff="6.16" local_density="0.35" obsval="-42.15"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="91.27" stdev="37.60" mindiff="12.27" local_density="0.00" obsval="-157.27"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="90.58" stdev="39.49" mindiff="14.98" local_density="0.00" obsval="22.67"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="26.52" stdev="1.71" mindiff="1.58" local_density="0.15" obsval="148.23"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="26.51" stdev="3.04" mindiff="0.12" local_density="0.48" obsval="-31.83"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="48.93" stdev="21.86" mindiff="1.08" local_density="1.90" obsval="-135.82"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="42.79" stdev="17.71" mindiff="0.46" local_density="2.36" obsval="99.24"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="72.70" stdev="19.23" mindiff="0.14" local_density="1.36" obsval="-92.31"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="56.13" stdev="45.63" mindiff="0.03" local_density="2.36" obsval="36.32"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.30" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.92" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.03" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.60" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.34" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.03" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.02" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.02" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.40" Zscore="8.89" obsval="110.73"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.07" Zscore="-2.12" obsval="121.59"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.25" Zscore="3.63" obsval="121.53"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.05" Zscore="2.06" obsval="118.12"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.41" Zscore="2.06" obsval="121.62"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.40" Zscore="-3.00" obsval="107.85"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.08" Zscore="2.69" obsval="112.81"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.26" Zscore="-2.58" obsval="104.27"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.37" Zscore="5.19" obsval="133.87"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.37" Zscore="-2.20" obsval="122.65"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.04" Zscore="2.43" obsval="137.55"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.03" Zscore="4.51" obsval="119.12"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.14" obsval="119.69"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.39" Zscore="3.09" obsval="120.00"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.30" Zscore="-2.62" obsval="121.91"/>
		<clash atom="H203" dist="2.26" clashmag="0.50" cid="99"/>
		<clash atom="HAC1" dist="1.96" clashmag="0.48" cid="106"/>
		<clash atom="HHB" dist="1.98" clashmag="0.45" cid="115"/>
		<clash atom="HAB" dist="2.01" clashmag="0.42" cid="128"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8462" Q_score="0.542" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.82" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="825" said="WC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="103.82" stdev="46.70" mindiff="0.08" local_density="4.43" obsval="-30.44"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="76.10" stdev="6.08" mindiff="1.23" local_density="0.12" obsval="-97.39"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="76.13" stdev="6.45" mindiff="0.02" local_density="0.13" obsval="82.76"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="72.44" stdev="39.52" mindiff="3.75" local_density="3.36" obsval="55.00"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="70.33" stdev="35.77" mindiff="4.10" local_density="1.48" obsval="-123.46"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="28.74" stdev="1.73" mindiff="3.81" local_density="0.08" obsval="-146.01"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="28.20" stdev="3.04" mindiff="0.32" local_density="0.42" obsval="33.54"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="60.13" stdev="10.81" mindiff="0.32" local_density="0.57" obsval="-108.88"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="50.86" stdev="13.54" mindiff="0.25" local_density="1.52" obsval="-120.80"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="49.85" stdev="12.39" mindiff="1.04" local_density="1.18" obsval="115.58"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="132.94" stdev="35.43" mindiff="0.54" local_density="0.06" obsval="25.70"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="30.13" stdev="20.91" mindiff="0.09" local_density="3.80" obsval="149.31"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="43.74" stdev="16.38" mindiff="0.90" local_density="2.36" obsval="-101.51"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="49.11" stdev="20.69" mindiff="0.22" local_density="1.90" obsval="134.23"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="62.55" stdev="12.27" mindiff="0.22" local_density="0.53" obsval="-105.67"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="55.56" stdev="33.23" mindiff="0.20" local_density="2.11" obsval="147.30"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="53.71" stdev="28.26" mindiff="0.48" local_density="2.64" obsval="-89.97"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.22" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.95" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.10" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.62" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.35" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.99" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.05" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.43" Zscore="8.94" obsval="110.76"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.13" Zscore="-2.04" obsval="121.78"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.93" Zscore="2.27" obsval="117.88"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.08" Zscore="2.51" obsval="119.48"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.49" Zscore="2.10" obsval="121.74"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.57" Zscore="-3.19" obsval="107.68"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.13" Zscore="2.74" obsval="112.86"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.28" Zscore="-2.75" obsval="104.08"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.20" Zscore="5.09" obsval="133.69"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.07" Zscore="-2.01" obsval="123.08"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.03" Zscore="2.43" obsval="137.56"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.20" Zscore="4.61" obsval="119.29"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.31" obsval="119.36"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.55" Zscore="3.13" obsval="120.16"/>
		<mog-angle-outlier atoms="C4,C3,C2" numobs="919" mean="123.63" stdev="2.57" mindiff="0.01" Zscore="-2.34" obsval="117.62"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.07" Zscore="2.56" obsval="126.92"/>
		<clash atom="HAB" dist="1.76" clashmag="0.66" cid="74"/>
		<clash atom="HAB" dist="2.47" clashmag="0.44" cid="119"/>
		<clash atom="HAB" dist="2.48" clashmag="0.41" cid="130"/>
		<clash atom="H72" dist="1.83" clashmag="0.61" cid="82"/>
		<clash atom="C4B" dist="2.35" clashmag="0.56" cid="89"/>
		<clash atom="CHC" dist="2.36" clashmag="0.55" cid="90"/>
		<clash atom="HBC1" dist="2.49" clashmag="0.43" cid="125"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8923" Q_score="0.602" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.84" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="826" said="XC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="95.41" stdev="2.01" mindiff="27.77" local_density="0.00" obsval="-79.33"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="96.83" stdev="3.40" mindiff="0.95" local_density="0.02" obsval="102.31"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="34.78" stdev="16.31" mindiff="0.18" local_density="3.39" obsval="-102.41"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="41.79" stdev="29.31" mindiff="0.19" local_density="1.66" obsval="-149.60"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="48.43" stdev="25.56" mindiff="1.05" local_density="2.28" obsval="-140.62"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="40.42" stdev="21.56" mindiff="0.43" local_density="4.13" obsval="93.41"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="38.61" stdev="24.88" mindiff="0.29" local_density="4.72" obsval="-88.74"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="47.84" stdev="30.74" mindiff="1.80" local_density="3.42" obsval="146.84"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="56.06" stdev="45.63" mindiff="0.05" local_density="2.36" obsval="36.39"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="54.44" stdev="14.20" mindiff="0.15" local_density="0.66" obsval="122.55"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="54.17" stdev="12.73" mindiff="0.18" local_density="0.70" obsval="-114.08"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.07" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-4.01" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.05" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.84" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.34" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.04" Zscore="-3.43" obsval="1.32"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.08" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.70" Zscore="9.54" obsval="111.03"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.34" Zscore="2.17" obsval="121.89"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.02" Zscore="-2.57" obsval="108.23"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.10" Zscore="2.71" obsval="112.83"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.11" Zscore="-2.23" obsval="104.64"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.92" Zscore="4.93" obsval="133.41"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.03" Zscore="2.43" obsval="137.56"/>
		<mog-angle-outlier atoms="OBD,CAD,C3D" numobs="108" mean="128.42" stdev="2.34" mindiff="0.01" Zscore="-2.73" obsval="122.04"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.24" Zscore="5.39" obsval="120.65"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.66" obsval="118.68"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="1.88" Zscore="2.18" obsval="116.49"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.05" Zscore="-2.46" obsval="122.16"/>
		<clash atom="HAB" dist="2.39" clashmag="0.63" cid="77"/>
		<clash atom="C3B" dist="2.37" clashmag="0.54" cid="94"/>
		<clash atom="HMC2" dist="2.44" clashmag="0.47" cid="110"/>
		<clash atom="HMC2" dist="1.98" clashmag="0.44" cid="120"/>
		<clash atom="HBB2" dist="2.18" clashmag="0.42" cid="129"/>
		<clash atom="HBB1" dist="2.50" clashmag="0.41" cid="135"/>
		<clash atom="CMB" dist="2.50" clashmag="0.41" cid="135"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9538" Q_score="0.593" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.81" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="827" said="YC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="70.37" stdev="5.78" mindiff="3.48" local_density="0.08" obsval="-103.15"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="69.83" stdev="6.24" mindiff="1.35" local_density="0.15" obsval="76.43"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="93.84" stdev="39.47" mindiff="8.45" local_density="0.35" obsval="-39.86"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="52.02" stdev="1.81" mindiff="15.62" local_density="0.00" obsval="-122.72"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="50.97" stdev="2.92" mindiff="1.60" local_density="0.06" obsval="56.38"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="74.35" stdev="25.11" mindiff="0.94" local_density="1.36" obsval="24.65"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="77.48" stdev="25.25" mindiff="0.17" local_density="1.65" obsval="-156.89"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="54.71" stdev="16.34" mindiff="0.38" local_density="1.47" obsval="-126.42"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="52.12" stdev="14.13" mindiff="1.05" local_density="1.14" obsval="112.15"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="47.64" stdev="32.87" mindiff="0.46" local_density="4.56" obsval="149.35"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="63.20" stdev="12.69" mindiff="0.29" local_density="0.57" obsval="104.80"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="72.96" stdev="53.57" mindiff="0.24" local_density="4.92" obsval="-42.81"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.11" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.97" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.12" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.72" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.86" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.25" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.47" Zscore="9.03" obsval="110.80"/>
		<mog-angle-outlier atoms="CAA,C2A,C3A" numobs="78" mean="113.00" stdev="2.70" mindiff="0.92" Zscore="-2.15" obsval="107.18"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.26" obsval="118.71"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.46" Zscore="-3.07" obsval="107.79"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.09" Zscore="2.21" obsval="112.30"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.08" Zscore="-2.41" obsval="104.45"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.21" Zscore="5.10" obsval="133.71"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.06" Zscore="-2.01" obsval="123.08"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.08" Zscore="2.41" obsval="137.51"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.90" Zscore="5.01" obsval="119.99"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.31" obsval="119.35"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.23" Zscore="2.79" obsval="118.84"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="3.59" Zscore="-4.01" obsval="119.62"/>
		<clash atom="HAB" dist="2.08" clashmag="0.89" cid="26"/>
		<clash atom="H193" dist="1.82" clashmag="0.61" cid="29"/>
		<clash atom="HBB2" dist="1.85" clashmag="0.57" cid="31"/>
		<clash atom="C1A" dist="2.92" clashmag="0.48" cid="34"/>
		<clash atom="CGA" dist="2.92" clashmag="0.48" cid="34"/>
		<clash atom="HBB1" dist="1.98" clashmag="0.44" cid="35"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8769" Q_score="0.605" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.75" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="828" said="ZC" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="58.72" stdev="23.63" mindiff="0.06" local_density="4.68" obsval="-86.84"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="59.69" stdev="23.51" mindiff="0.08" local_density="4.14" obsval="92.24"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="120.08" stdev="7.35" mindiff="6.87" local_density="0.08" obsval="53.29"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="120.96" stdev="7.14" mindiff="10.03" local_density="0.00" obsval="-127.65"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="109.50" stdev="61.40" mindiff="0.66" local_density="4.20" obsval="0.63"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="51.31" stdev="9.59" mindiff="0.68" local_density="0.11" obsval="125.11"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="56.09" stdev="17.99" mindiff="0.03" local_density="1.18" obsval="-129.37"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="52.90" stdev="16.45" mindiff="3.95" local_density="1.14" obsval="107.15"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.22" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-4.02" obsval="1.97"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.62" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.10" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.04" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.06" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.07" Zscore="8.16" obsval="110.40"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.11" Zscore="-2.14" obsval="121.54"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.05" Zscore="3.21" obsval="121.63"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.69" Zscore="2.67" obsval="123.12"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.26" Zscore="-2.84" obsval="107.99"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.17" Zscore="2.46" obsval="112.56"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.18" Zscore="-2.50" obsval="104.35"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.60" Zscore="5.32" obsval="134.10"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.37" Zscore="-2.30" obsval="122.42"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.12" Zscore="2.38" obsval="137.47"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.54" Zscore="4.19" obsval="118.55"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="3.97" Zscore="2.72" obsval="118.58"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.67" Zscore="-2.23" obsval="122.54"/>
		<clash atom="HMB3" dist="1.56" clashmag="0.86" cid="68"/>
		<clash atom="HMB3" dist="2.36" clashmag="0.47" cid="111"/>
		<clash atom="HBB1" dist="1.56" clashmag="0.86" cid="68"/>
		<clash atom="HBB1" dist="2.28" clashmag="0.62" cid="78"/>
		<clash atom="CMB" dist="2.28" clashmag="0.62" cid="78"/>
		<clash atom="H43" dist="1.85" clashmag="0.59" cid="83"/>
		<clash atom="HBB2" dist="2.40" clashmag="0.51" cid="98"/>
		<clash atom="HBB2" dist="1.96" clashmag="0.47" cid="108"/>
		<clash atom="CBB" dist="2.36" clashmag="0.47" cid="111"/>
		<clash atom="C4" dist="2.47" clashmag="0.43" cid="126"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9538" Q_score="0.595" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.75" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="829" said="AD" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="44.27" stdev="4.82" mindiff="3.97" local_density="0.38" obsval="129.46"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="44.34" stdev="5.28" mindiff="0.44" local_density="0.51" obsval="-50.77"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="38.93" stdev="14.40" mindiff="0.12" local_density="4.56" obsval="-120.88"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="61.68" stdev="1.91" mindiff="5.95" local_density="0.02" obsval="-113.05"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="61.15" stdev="2.92" mindiff="0.94" local_density="0.04" obsval="66.58"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="36.30" stdev="16.02" mindiff="0.31" local_density="1.25" obsval="-140.85"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="42.26" stdev="18.51" mindiff="0.82" local_density="2.65" obsval="-97.96"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="48.80" stdev="22.78" mindiff="2.33" local_density="1.52" obsval="137.07"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="83.47" stdev="51.73" mindiff="0.63" local_density="4.18" obsval="41.92"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="82.91" stdev="26.37" mindiff="0.10" local_density="3.90" obsval="79.18"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="79.14" stdev="23.91" mindiff="0.08" local_density="2.64" obsval="83.95"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="53.70" stdev="29.04" mindiff="0.29" local_density="2.68" obsval="89.08"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="55.55" stdev="33.10" mindiff="0.05" local_density="2.11" obsval="-147.15"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.04" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.96" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.01" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.55" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.40" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.34" obsval="1.32"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.02" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.50" Zscore="9.09" obsval="110.83"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.02" Zscore="2.37" obsval="119.07"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.40" Zscore="2.14" obsval="121.83"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.19" Zscore="-2.25" obsval="108.52"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.05" Zscore="2.57" obsval="112.68"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.32" Zscore="-2.64" obsval="104.21"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.17" Zscore="5.08" obsval="133.67"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.07" Zscore="-2.01" obsval="123.08"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.23" Zscore="2.33" obsval="137.36"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.60" Zscore="4.84" obsval="119.69"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.47" obsval="119.03"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.55" Zscore="3.13" obsval="120.16"/>
		<clash atom="HBB1" dist="1.86" clashmag="0.57" cid="386"/>
		<clash atom="HBB1" dist="2.46" clashmag="0.45" cid="387"/>
		<clash atom="HMB3" dist="1.86" clashmag="0.57" cid="386"/>
		<clash atom="CMB" dist="2.46" clashmag="0.45" cid="387"/>
		<clash atom="HBC1" dist="2.00" clashmag="0.43" cid="388"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7231" Q_score="0.455" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.39" mogul_angles_rmsz="1.80" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="830" said="BD" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="74.87" stdev="29.97" mindiff="13.19" local_density="0.00" obsval="80.73"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="42.36" stdev="29.20" mindiff="7.72" local_density="1.55" obsval="-34.35"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="36.73" stdev="25.43" mindiff="0.03" local_density="4.07" obsval="-148.65"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="81.13" stdev="6.33" mindiff="2.62" local_density="0.19" obsval="92.33"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="80.28" stdev="6.57" mindiff="4.18" local_density="0.15" obsval="-86.93"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="37.31" stdev="12.92" mindiff="0.56" local_density="3.51" obsval="132.61"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="94.67" stdev="37.60" mindiff="15.67" local_density="0.00" obsval="-160.67"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="93.04" stdev="39.49" mindiff="17.44" local_density="0.00" obsval="20.21"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="49.17" stdev="13.27" mindiff="1.61" local_density="0.07" obsval="130.59"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="40.26" stdev="21.83" mindiff="0.83" local_density="4.13" obsval="-93.01"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.17" stdev="27.69" mindiff="1.53" local_density="2.28" obsval="143.21"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="81.16" stdev="25.22" mindiff="0.06" local_density="3.31" obsval="81.39"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="34.33" stdev="17.56" mindiff="0.03" local_density="1.75" obsval="-143.52"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.31" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-4.17" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.21" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.74" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.21" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.14" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.39" Zscore="8.86" obsval="110.72"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.22" Zscore="-2.19" obsval="121.43"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.36" Zscore="2.04" obsval="121.58"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.15" Zscore="-2.72" obsval="108.10"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.06" Zscore="2.68" obsval="112.80"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.27" Zscore="-2.59" obsval="104.26"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.03" Zscore="5.00" obsval="133.53"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.09" Zscore="2.48" obsval="137.68"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.06" Zscore="-2.26" obsval="120.06"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.46" Zscore="5.83" obsval="121.42"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.74" obsval="118.52"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="2.44" Zscore="2.32" obsval="117.04"/>
		<mog-angle-outlier atoms="C4,C3,C2" numobs="919" mean="123.63" stdev="2.57" mindiff="0.02" Zscore="-2.33" obsval="117.65"/>
		<clash atom="HAB" dist="2.38" clashmag="0.54" cid="92"/>
		<clash atom="HAB" dist="2.38" clashmag="0.53" cid="95"/>
		<clash atom="HAB" dist="2.03" clashmag="0.40" cid="140"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9077" Q_score="0.562" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.38" mogul_angles_rmsz="1.78" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="831" said="CD" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="54.15" stdev="10.84" mindiff="0.58" local_density="1.11" obsval="-123.11"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="53.03" stdev="10.71" mindiff="1.29" local_density="0.78" obsval="122.24"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="33.97" stdev="4.60" mindiff="0.48" local_density="0.81" obsval="139.90"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="33.23" stdev="4.71" mindiff="0.04" local_density="1.04" obsval="-39.48"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="69.04" stdev="28.79" mindiff="2.40" local_density="2.52" obsval="67.40"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="68.21" stdev="24.69" mindiff="8.70" local_density="0.74" obsval="-110.66"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="47.58" stdev="1.78" mindiff="13.38" local_density="0.00" obsval="-127.16"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="46.92" stdev="2.92" mindiff="1.91" local_density="0.08" obsval="52.32"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="47.69" stdev="32.53" mindiff="2.42" local_density="2.33" obsval="143.47"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="44.31" stdev="32.45" mindiff="1.46" local_density="1.94" obsval="-38.11"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="61.00" stdev="18.50" mindiff="1.41" local_density="0.44" obsval="100.38"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="62.79" stdev="12.42" mindiff="0.10" local_density="0.54" obsval="105.35"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="51.33" stdev="13.02" mindiff="2.29" local_density="1.18" obsval="-118.91"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="51.19" stdev="13.21" mindiff="2.63" local_density="1.52" obsval="118.42"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="51.74" stdev="45.58" mindiff="0.12" local_density="4.13" obsval="-40.76"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.32" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-4.00" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.02" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.62" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.07" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.09" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.01" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.31" Zscore="8.69" obsval="110.64"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.05" Zscore="-2.11" obsval="121.60"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.65" Zscore="2.17" obsval="117.60"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.17" Zscore="2.32" obsval="118.92"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.16" Zscore="-2.73" obsval="108.09"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.13" Zscore="2.74" obsval="112.86"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.36" Zscore="-2.67" obsval="104.17"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.63" Zscore="5.34" obsval="134.13"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.34" Zscore="-2.31" obsval="122.39"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.06" Zscore="2.42" obsval="137.53"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.16" Zscore="-2.02" obsval="120.53"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.30" Zscore="5.24" obsval="120.39"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.46" obsval="119.07"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.75" Zscore="2.92" obsval="119.36"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9692" Q_score="0.64" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.82" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="832" said="DD" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="104.91" stdev="51.51" mindiff="3.99" local_density="2.22" obsval="37.82"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="38.20" stdev="12.96" mindiff="0.31" local_density="4.21" obsval="-125.38"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="59.16" stdev="17.10" mindiff="12.67" local_density="0.00" obsval="105.31"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="62.55" stdev="20.05" mindiff="15.73" local_density="0.00" obsval="-74.28"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="109.89" stdev="37.60" mindiff="30.89" local_density="0.00" obsval="175.89"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="109.01" stdev="39.49" mindiff="33.41" local_density="0.00" obsval="-4.24"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="48.63" stdev="1.78" mindiff="14.44" local_density="0.00" obsval="-126.11"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="48.36" stdev="2.92" mindiff="1.01" local_density="0.06" obsval="53.76"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="80.83" stdev="25.00" mindiff="0.14" local_density="3.21" obsval="-81.81"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="58.18" stdev="45.65" mindiff="2.10" local_density="1.77" obsval="-34.25"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="40.91" stdev="12.71" mindiff="0.09" local_density="0.80" obsval="134.60"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="77.61" stdev="53.97" mindiff="0.06" local_density="2.99" obsval="37.78"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.01" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.82" obsval="1.98"/>
		<mog-bond-outlier atoms="CHD,C1D" numobs="3707" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.00" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.59" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.11" obsval="1.33"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.02" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.29" Zscore="8.63" obsval="110.62"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.05" Zscore="2.21" obsval="118.56"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.04" Zscore="2.94" obsval="123.77"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.64" Zscore="-3.27" obsval="107.61"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.03" Zscore="2.31" obsval="112.41"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.04" Zscore="-2.37" obsval="104.48"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.10" Zscore="-2.01" obsval="121.98"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.75" Zscore="5.41" obsval="134.25"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.39" Zscore="-2.29" obsval="122.44"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.10" Zscore="2.40" obsval="137.49"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.13" Zscore="-2.04" obsval="120.50"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.21" Zscore="5.40" obsval="120.68"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.58" obsval="118.82"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.40" Zscore="3.09" obsval="120.01"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.45" Zscore="-2.71" obsval="121.76"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.05" Zscore="2.04" obsval="125.75"/>
		<clash atom="H152" dist="1.95" clashmag="0.49" cid="258"/>
		<clash atom="H2A" dist="1.97" clashmag="0.46" cid="261"/>
		<clash atom="HED2" dist="1.97" clashmag="0.46" cid="261"/>
		<clash atom="HHD" dist="2.00" clashmag="0.44" cid="264"/>
		<clash atom="C15" dist="2.51" clashmag="0.41" cid="268"/>
		<clash atom="HMC2" dist="2.51" clashmag="0.41" cid="269"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8769" Q_score="0.562" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.83" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="833" said="ED" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="54.73" stdev="22.27" mindiff="0.05" local_density="4.77" obsval="77.35"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="54.95" stdev="20.90" mindiff="0.15" local_density="4.37" obsval="-101.37"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="131.56" stdev="7.45" mindiff="4.62" local_density="0.04" obsval="-41.81"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="132.81" stdev="7.19" mindiff="0.59" local_density="0.02" obsval="139.51"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="71.12" stdev="35.34" mindiff="0.05" local_density="3.36" obsval="-59.75"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="69.91" stdev="33.55" mindiff="1.61" local_density="1.48" obsval="120.97"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="84.45" stdev="2.01" mindiff="16.81" local_density="0.00" obsval="-90.28"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="84.62" stdev="3.18" mindiff="2.69" local_density="0.02" obsval="90.09"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="44.55" stdev="32.51" mindiff="0.74" local_density="4.17" obsval="-140.31"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="40.98" stdev="32.43" mindiff="0.40" local_density="3.59" obsval="41.46"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="45.26" stdev="21.50" mindiff="3.83" local_density="0.37" obsval="-140.65"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="59.89" stdev="23.38" mindiff="2.19" local_density="3.24" obsval="-137.44"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="54.87" stdev="25.26" mindiff="0.17" local_density="4.18" obsval="94.99"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="69.71" stdev="17.09" mindiff="0.71" local_density="1.04" obsval="96.24"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="51.08" stdev="8.30" mindiff="0.94" local_density="0.45" obsval="120.95"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="55.32" stdev="29.45" mindiff="0.34" local_density="1.45" obsval="-143.04"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="95.32" stdev="55.12" mindiff="0.20" local_density="1.67" obsval="-19.18"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.05" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.93" obsval="1.98"/>
		<mog-bond-outlier atoms="CHC,C1C" numobs="3736" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.05" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.49" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.34" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.95" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.22" obsval="1.49"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.03" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.15" Zscore="8.33" obsval="110.48"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.05" Zscore="3.56" obsval="122.69"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="2.56" Zscore="4.02" obsval="126.38"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.88" Zscore="-3.54" obsval="107.37"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.11" Zscore="-2.43" obsval="104.42"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.04" Zscore="-2.25" obsval="104.73"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.10" Zscore="-2.01" obsval="121.97"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.61" Zscore="5.33" obsval="134.11"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.26" Zscore="-2.34" obsval="122.31"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.14" Zscore="2.37" obsval="137.45"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.18" Zscore="5.17" obsval="120.27"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.50" obsval="118.99"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="7.49" Zscore="3.64" obsval="122.10"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.71" Zscore="-2.26" obsval="122.50"/>
		<clash atom="HAB" dist="1.83" clashmag="0.61" cid="82"/>
		<clash atom="HMA2" dist="2.37" clashmag="0.54" cid="94"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8615" Q_score="0.561" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.80" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="834" said="FD" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="50.32" stdev="8.96" mindiff="2.60" local_density="0.43" obsval="-121.33"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="53.61" stdev="5.13" mindiff="0.05" local_density="0.27" obsval="-120.03"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="52.12" stdev="5.62" mindiff="0.13" local_density="0.38" obsval="58.62"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="109.89" stdev="37.60" mindiff="30.89" local_density="0.00" obsval="175.89"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="108.79" stdev="39.49" mindiff="33.19" local_density="0.00" obsval="-4.46"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="32.75" stdev="1.74" mindiff="1.45" local_density="0.08" obsval="-142.00"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="32.30" stdev="3.00" mindiff="0.65" local_density="0.30" obsval="37.66"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="49.62" stdev="12.43" mindiff="2.74" local_density="0.07" obsval="-129.46"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="72.48" stdev="19.07" mindiff="0.16" local_density="1.31" obsval="-92.61"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="43.22" stdev="17.08" mindiff="0.34" local_density="2.65" obsval="-100.27"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="48.67" stdev="23.73" mindiff="1.26" local_density="1.52" obsval="138.31"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="68.29" stdev="16.07" mindiff="0.06" local_density="0.83" obsval="-98.10"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="55.67" stdev="34.65" mindiff="0.06" local_density="2.42" obsval="148.89"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="53.69" stdev="30.23" mindiff="0.26" local_density="3.08" obsval="-87.73"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.19" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.90" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.10" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.23" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.94" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.08" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.19" Zscore="8.41" obsval="110.52"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.51" Zscore="-3.12" obsval="107.74"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.06" Zscore="2.23" obsval="112.33"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.17" Zscore="-2.50" obsval="104.35"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.67" Zscore="5.36" obsval="134.17"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.47" Zscore="-2.25" obsval="122.52"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.10" Zscore="2.49" obsval="137.69"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.24" Zscore="-2.41" obsval="119.75"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.10" Zscore="6.04" obsval="121.78"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.77" obsval="118.46"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.33" Zscore="2.81" obsval="118.94"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.26" Zscore="-2.59" obsval="121.95"/>
		<clash atom="HHC" dist="1.58" clashmag="0.85" cid="141"/>
		<clash atom="HBB1" dist="1.58" clashmag="0.85" cid="141"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8462" Q_score="0.549" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.95" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="A" resnum="835" said="GD" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="54.18" stdev="10.79" mindiff="0.51" local_density="1.11" obsval="-123.04"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="54.42" stdev="11.13" mindiff="0.43" local_density="0.78" obsval="123.96"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="45.04" stdev="13.01" mindiff="7.69" local_density="0.32" obsval="-131.86"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="57.22" stdev="11.06" mindiff="3.60" local_density="0.07" obsval="110.00"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="31.89" stdev="19.49" mindiff="0.00" local_density="2.62" obsval="146.87"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="39.61" stdev="23.00" mindiff="0.27" local_density="4.72" obsval="-91.32"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="47.88" stdev="30.27" mindiff="2.36" local_density="3.42" obsval="146.28"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="48.17" stdev="27.68" mindiff="1.52" local_density="2.28" obsval="-143.19"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="40.51" stdev="21.40" mindiff="0.19" local_density="4.13" obsval="93.64"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="45.11" stdev="14.76" mindiff="0.98" local_density="2.06" obsval="-104.80"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="49.48" stdev="18.57" mindiff="2.74" local_density="1.52" obsval="131.27"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="35.45" stdev="16.67" mindiff="0.12" local_density="1.48" obsval="-141.99"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.23" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.92" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.01" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.71" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.29" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.15" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.05" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.73" Zscore="9.61" obsval="111.06"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.12" Zscore="-2.14" obsval="121.54"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.15" Zscore="3.59" obsval="121.43"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.15" obsval="118.40"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.04" Zscore="2.29" obsval="122.19"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.13" Zscore="-2.70" obsval="108.12"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.20" Zscore="2.81" obsval="112.94"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.36" Zscore="-2.68" obsval="104.17"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.21" Zscore="5.10" obsval="133.71"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.33" Zscore="2.29" obsval="137.26"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.10" Zscore="-2.34" obsval="119.90"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.43" Zscore="5.85" obsval="121.45"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.03" Zscore="-2.67" obsval="118.65"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.50" Zscore="3.38" obsval="121.10"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.97" Zscore="-3.02" obsval="121.24"/>
		<clash atom="HBB1" dist="2.51" clashmag="0.41" cid="566"/>
		<clash atom="CMB" dist="2.51" clashmag="0.41" cid="566"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9077" Q_score="0.574" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.87" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="A" resnum="836" said="HD" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="27.42" stdev="4.60" mindiff="0.17" local_density="1.30" obsval="-146.58"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="28.02" stdev="4.51" mindiff="0.08" local_density="1.59" obsval="34.15"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="39.55" stdev="1.74" mindiff="5.35" local_density="0.02" obsval="-135.20"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="40.06" stdev="2.95" mindiff="1.19" local_density="0.15" obsval="45.44"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="59.85" stdev="45.66" mindiff="3.78" local_density="1.18" obsval="-32.57"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="35.14" stdev="16.92" mindiff="0.03" local_density="1.52" obsval="142.42"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="55.99" stdev="39.16" mindiff="0.01" local_density="4.31" obsval="153.85"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.30" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.79" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.03" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.25" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.99" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.19" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.38" Zscore="8.85" obsval="110.72"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.98" Zscore="3.53" obsval="121.26"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.12" obsval="118.31"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.60" Zscore="-3.23" obsval="107.65"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.00" Zscore="2.29" obsval="112.39"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.12" Zscore="-2.45" obsval="104.40"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.05" Zscore="-2.12" obsval="104.82"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.14" Zscore="-2.03" obsval="121.94"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.74" Zscore="5.40" obsval="134.24"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.45" Zscore="-2.26" obsval="122.50"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.24" Zscore="2.33" obsval="137.35"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.29" Zscore="5.24" obsval="120.38"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.48" obsval="119.03"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.65" Zscore="3.16" obsval="120.26"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.71" Zscore="-2.25" obsval="122.50"/>
		<mog-angle-outlier atoms="C6,C5,C3" numobs="49" mean="113.47" stdev="2.44" mindiff="0.83" Zscore="-2.46" obsval="107.48"/>
		<clash atom="H42" dist="2.35" clashmag="0.62" cid="340"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8000" Q_score="0.54" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.80" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="837" said="ID" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="37.15" stdev="24.75" mindiff="0.90" local_density="3.86" obsval="-147.78"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="44.65" stdev="4.83" mindiff="3.59" local_density="0.35" obsval="-129.08"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="44.04" stdev="5.27" mindiff="0.13" local_density="0.53" obsval="50.46"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="100.62" stdev="39.47" mindiff="15.24" local_density="0.00" obsval="-33.08"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="58.83" stdev="10.13" mindiff="0.64" local_density="0.53" obsval="-110.61"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="87.27" stdev="51.84" mindiff="1.00" local_density="3.04" obsval="38.03"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="48.16" stdev="27.79" mindiff="1.66" local_density="2.28" obsval="143.33"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="71.57" stdev="45.74" mindiff="5.31" local_density="0.29" obsval="20.78"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="29.91" stdev="21.09" mindiff="0.09" local_density="4.02" obsval="149.61"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="48.29" stdev="26.73" mindiff="0.38" local_density="2.28" obsval="-142.05"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="40.55" stdev="21.33" mindiff="0.09" local_density="4.13" obsval="93.75"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="82.96" stdev="26.40" mindiff="0.16" local_density="3.98" obsval="79.12"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="54.93" stdev="8.65" mindiff="0.20" local_density="0.36" obsval="-115.80"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.30" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.91" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.09" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.59" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.33" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.91" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.23" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.14" Zscore="8.31" obsval="110.47"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.13" Zscore="-2.24" obsval="121.32"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.15" Zscore="2.60" obsval="119.77"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.33" Zscore="-2.92" obsval="107.92"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.12" Zscore="2.50" obsval="112.61"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.29" Zscore="-2.61" obsval="104.24"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.48" Zscore="5.25" obsval="133.98"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.21" Zscore="-2.13" obsval="122.81"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.14" Zscore="2.38" obsval="137.45"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.11" Zscore="-2.04" obsval="120.48"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.11" Zscore="5.13" obsval="120.21"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.33" obsval="119.31"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.87" Zscore="3.21" obsval="120.47"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="2.04" Zscore="-3.07" obsval="121.17"/>
		<clash atom="H92" dist="1.71" clashmag="0.72" cid="72"/>
		<clash atom="HBB1" dist="1.79" clashmag="0.65" cid="75"/>
		<clash atom="HBB1" dist="2.39" clashmag="0.50" cid="100"/>
		<clash atom="HMB1" dist="1.79" clashmag="0.65" cid="75"/>
		<clash atom="CBB" dist="2.38" clashmag="0.54" cid="92"/>
		<clash atom="CAB" dist="2.38" clashmag="0.53" cid="95"/>
		<clash atom="CMB" dist="2.39" clashmag="0.50" cid="100"/>
		<clash atom="HBB2" dist="1.97" clashmag="0.46" cid="114"/>
		<clash atom="H121" dist="2.03" clashmag="0.41" cid="136"/>
		<clash atom="HAB" dist="2.03" clashmag="0.40" cid="140"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9385" Q_score="0.604" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.83" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="838" said="JD" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="52.91" stdev="5.11" mindiff="0.65" local_density="0.27" obsval="-120.73"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="55.97" stdev="5.77" mindiff="0.99" local_density="0.33" obsval="62.50"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="55.53" stdev="27.84" mindiff="1.57" local_density="2.52" obsval="-119.55"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="60.49" stdev="31.16" mindiff="2.43" local_density="1.48" obsval="60.98"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="30.62" stdev="1.74" mindiff="3.58" local_density="0.08" obsval="-144.13"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="30.20" stdev="3.04" mindiff="0.01" local_density="0.35" obsval="35.54"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="57.10" stdev="10.85" mindiff="3.92" local_density="0.07" obsval="-110.33"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="61.26" stdev="11.47" mindiff="0.34" local_density="0.56" obsval="-107.39"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.12" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.80" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.30" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.06" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.17" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.40" Zscore="8.87" obsval="110.73"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="2.16" Zscore="2.36" obsval="118.12"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.33" Zscore="3.10" obsval="124.14"/>
		<mog-angle-outlier atoms="CMB,C2B,C1B" numobs="569" mean="125.42" stdev="1.52" mindiff="0.02" Zscore="2.03" obsval="128.52"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.66" Zscore="-3.29" obsval="107.60"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.21" Zscore="2.08" obsval="112.17"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.01" Zscore="-2.32" obsval="104.54"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.11" Zscore="-2.35" obsval="104.67"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.10" Zscore="-2.01" obsval="121.98"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.09" Zscore="2.01" obsval="112.11"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.30" Zscore="5.15" obsval="133.79"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.17" Zscore="-2.11" obsval="122.84"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.36" Zscore="2.27" obsval="137.24"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.11" Zscore="-2.16" obsval="120.26"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.90" Zscore="5.58" obsval="120.98"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.62" obsval="118.75"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.31" Zscore="3.33" obsval="120.92"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.13" Zscore="-2.51" obsval="122.08"/>
		<clash atom="H42" dist="1.96" clashmag="0.47" cid="56"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9231" Q_score="0.574" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.79" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="A" resnum="839" said="KD" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="63.51" stdev="23.21" mindiff="0.24" local_density="2.36" obsval="-95.46"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="51.36" stdev="5.06" mindiff="0.70" local_density="0.27" obsval="-122.30"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="52.12" stdev="5.62" mindiff="0.13" local_density="0.38" obsval="58.62"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="70.04" stdev="32.02" mindiff="1.36" local_density="2.52" obsval="63.63"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="69.26" stdev="30.25" mindiff="2.18" local_density="0.74" obsval="-117.18"/>
		<mog-torsion-outlier atoms="O2A,C1,C2,C3" numobs="153" mean="100.39" stdev="29.70" mindiff="20.89" local_density="0.00" obsval="-25.79"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="53.57" stdev="7.62" mindiff="2.15" local_density="0.07" obsval="-119.35"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="62.86" stdev="28.02" mindiff="0.45" local_density="4.13" obsval="-143.69"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="43.25" stdev="11.22" mindiff="0.71" local_density="0.57" obsval="131.45"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="53.49" stdev="45.60" mindiff="1.65" local_density="3.24" obsval="38.99"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="37.56" stdev="15.07" mindiff="0.43" local_density="1.08" obsval="-139.13"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.37" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.96" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.15" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.37" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.35" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.08" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.03" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.57" Zscore="9.25" obsval="110.90"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.21" Zscore="-2.19" obsval="121.44"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.73" Zscore="2.89" obsval="119.55"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.08" Zscore="2.40" obsval="119.17"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.14" Zscore="-2.71" obsval="108.11"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.11" Zscore="2.72" obsval="112.84"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.22" Zscore="-2.54" obsval="104.31"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.72" Zscore="4.82" obsval="133.22"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.04" Zscore="2.46" obsval="137.63"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.33" Zscore="4.69" obsval="119.42"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.17" obsval="119.63"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.99" Zscore="3.50" obsval="121.59"/>
		<clash atom="H93" dist="1.92" clashmag="0.52" cid="438"/>
		<clash atom="HBB1" dist="1.92" clashmag="0.52" cid="438"/>
		<clash atom="H141" dist="2.02" clashmag="0.42" cid="439"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9091" Q_score="0.626" mogul_rmsz_numbonds="34" mogul_rmsz_numangles="43" mogul_bonds_rmsz="0.45" mogul_angles_rmsz="1.28" num-H-reduce="46" model="1" chain="A" resnum="840" said="LD" ent="27" seq="." icode=" " resname="PQN" altcode=" ">
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="1030" mean="75.55" stdev="32.74" mindiff="3.65" local_density="0.29" obsval="171.49"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="1032" mean="74.65" stdev="32.67" mindiff="7.29" local_density="0.29" obsval="-7.60"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="2719" mean="63.79" stdev="24.53" mindiff="0.19" local_density="1.29" obsval="93.31"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="36.93" stdev="15.54" mindiff="0.25" local_density="1.16" obsval="139.99"/>
		<mog-torsion-outlier atoms="C17,C18,C20,C21" numobs="263" mean="50.26" stdev="15.07" mindiff="0.88" local_density="1.52" obsval="-125.06"/>
		<mog-torsion-outlier atoms="C19,C18,C20,C21" numobs="339" mean="47.72" stdev="12.63" mindiff="1.34" local_density="1.18" obsval="110.75"/>
		<mog-torsion-outlier atoms="C18,C20,C21,C22" numobs="6638" mean="75.73" stdev="21.45" mindiff="0.13" local_density="1.82" obsval="-88.36"/>
		<mog-torsion-outlier atoms="C21,C22,C23,C24" numobs="339" mean="60.82" stdev="24.78" mindiff="0.25" local_density="3.83" obsval="-139.39"/>
		<mog-torsion-outlier atoms="C21,C22,C23,C25" numobs="263" mean="55.09" stdev="26.02" mindiff="0.74" local_density="4.56" obsval="93.95"/>
		<mog-torsion-outlier atoms="C24,C23,C25,C26" numobs="339" mean="50.91" stdev="45.57" mindiff="0.48" local_density="4.42" obsval="-41.60"/>
		<mog-angle-outlier atoms="C2M,C2,C3" numobs="99" mean="124.45" stdev="1.65" mindiff="0.17" Zscore="-2.09" obsval="121.02"/>
		<mog-angle-outlier atoms="C12,C11,C3" numobs="88" mean="112.08" stdev="2.46" mindiff="1.66" Zscore="-2.38" obsval="106.21"/>
		<mog-angle-outlier atoms="C15,C13,C12" numobs="616" mean="121.17" stdev="2.24" mindiff="0.55" Zscore="-2.99" obsval="114.45"/>
		<mog-angle-outlier atoms="C14,C13,C15" numobs="1064" mean="115.23" stdev="1.74" mindiff="0.15" Zscore="4.83" obsval="123.61"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9388" Q_score="0.593" mogul_rmsz_numbonds="48" mogul_rmsz_numangles="51" mogul_bonds_rmsz="0.41" mogul_angles_rmsz="0.91" num-H-reduce="74" model="1" chain="A" resnum="841" said="MD" ent="19" seq="." icode=" " resname="LHG" altcode=" ">
		<mog-torsion-outlier atoms="C1,C2,C3,O3" numobs="374" mean="66.01" stdev="24.48" mindiff="9.36" local_density="0.27" obsval="141.90"/>
		<mog-torsion-outlier atoms="O2,C2,C3,O3" numobs="654" mean="76.88" stdev="50.66" mindiff="17.74" local_density="0.00" obsval="20.61"/>
		<mog-torsion-outlier atoms="C2,C3,O3,P" numobs="474" mean="48.07" stdev="17.00" mindiff="0.26" local_density="3.59" obsval="108.75"/>
		<mog-torsion-outlier atoms="C3,O3,P,O5" numobs="40" mean="55.96" stdev="36.76" mindiff="8.89" local_density="2.50" obsval="-72.14"/>
		<mog-torsion-outlier atoms="C4,O6,P,O3" numobs="40" mean="51.17" stdev="14.80" mindiff="22.86" local_density="0.00" obsval="113.72"/>
		<mog-torsion-outlier atoms="C4,O6,P,O4" numobs="40" mean="58.39" stdev="24.06" mindiff="4.27" local_density="2.50" obsval="-133.18"/>
		<mog-torsion-outlier atoms="C4,O6,P,O5" numobs="40" mean="99.88" stdev="60.53" mindiff="31.34" local_density="0.00" obsval="-0.87"/>
		<mog-torsion-outlier atoms="O6,C4,C5,C6" numobs="265" mean="74.30" stdev="53.24" mindiff="0.32" local_density="2.26" obsval="18.19"/>
		<mog-torsion-outlier atoms="O6,C4,C5,O7" numobs="299" mean="59.34" stdev="23.30" mindiff="0.84" local_density="2.01" obsval="138.56"/>
		<mog-torsion-outlier atoms="C4,C5,C6,O8" numobs="248" mean="72.20" stdev="37.88" mindiff="0.53" local_density="2.42" obsval="152.70"/>
		<mog-torsion-outlier atoms="O7,C5,C6,O8" numobs="291" mean="67.08" stdev="48.87" mindiff="2.44" local_density="1.72" obsval="31.11"/>
		<mog-torsion-outlier atoms="O9,C7,O7,C5" numobs="1497" mean="48.69" stdev="5.49" mindiff="1.05" local_density="0.47" obsval="55.47"/>
		<mog-torsion-outlier atoms="C8,C7,O7,C5" numobs="1189" mean="48.48" stdev="5.34" mindiff="0.79" local_density="0.25" obsval="-124.64"/>
		<mog-torsion-outlier atoms="O7,C7,C8,C9" numobs="3091" mean="59.59" stdev="23.45" mindiff="0.18" local_density="4.17" obsval="-92.42"/>
		<mog-torsion-outlier atoms="O9,C7,C8,C9" numobs="4149" mean="59.00" stdev="23.77" mindiff="0.01" local_density="4.68" obsval="87.46"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="4310" mean="41.98" stdev="21.25" mindiff="0.54" local_density="0.65" obsval="-143.21"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="15585" mean="29.05" stdev="25.39" mindiff="0.02" local_density="4.28" obsval="154.78"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="15585" mean="56.82" stdev="10.03" mindiff="0.01" local_density="0.73" obsval="114.28"/>
		<mog-torsion-outlier atoms="O8,C23,C24,C25" numobs="3091" mean="58.51" stdev="22.84" mindiff="0.04" local_density="4.17" obsval="94.39"/>
		<mog-torsion-outlier atoms="O10,C23,C24,C25" numobs="4149" mean="58.33" stdev="23.47" mindiff="0.02" local_density="4.70" obsval="-85.99"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="4310" mean="54.27" stdev="8.50" mindiff="0.18" local_density="0.39" obsval="-117.08"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="15585" mean="31.28" stdev="23.19" mindiff="0.03" local_density="3.17" obsval="151.41"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="15585" mean="52.56" stdev="9.08" mindiff="0.14" local_density="0.83" obsval="120.33"/>
		<mog-torsion-outlier atoms="C13,C14,C15,C16" numobs="15585" mean="31.41" stdev="23.06" mindiff="0.01" local_density="3.11" obsval="-151.21"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="15585" mean="61.71" stdev="12.67" mindiff="0.10" local_density="0.77" obsval="107.38"/>
		<mog-torsion-outlier atoms="C19,C20,C21,C22" numobs="12796" mean="42.54" stdev="17.30" mindiff="0.02" local_density="1.97" obsval="135.75"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="15585" mean="68.30" stdev="17.54" mindiff="0.06" local_density="0.96" obsval="-98.17"/>
		<mog-torsion-outlier atoms="C26,C27,C28,C29" numobs="15585" mean="46.69" stdev="10.73" mindiff="0.05" local_density="1.03" obsval="-128.74"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C30" numobs="15585" mean="33.19" stdev="21.37" mindiff="0.03" local_density="2.43" obsval="148.53"/>
		<mog-torsion-outlier atoms="C28,C29,C30,C31" numobs="15585" mean="72.74" stdev="21.11" mindiff="0.08" local_density="1.32" obsval="-92.03"/>
		<mog-torsion-outlier atoms="C30,C31,C32,C33" numobs="15585" mean="40.36" stdev="15.06" mindiff="0.02" local_density="1.36" obsval="-137.92"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C34" numobs="15585" mean="130.73" stdev="38.20" mindiff="0.40" local_density="0.33" obsval="-26.60"/>
		<mog-torsion-outlier atoms="C33,C34,C35,C36" numobs="15585" mean="29.54" stdev="24.90" mindiff="0.03" local_density="3.98" obsval="-154.03"/>
		<mog-torsion-outlier atoms="C34,C35,C36,C37" numobs="15585" mean="29.00" stdev="25.43" mindiff="0.00" local_density="4.31" obsval="-154.84"/>
		<mog-angle-outlier atoms="O7,C7,C8" numobs="587" mean="111.48" stdev="2.16" mindiff="0.00" Zscore="3.66" obsval="119.39"/>
		<mog-angle-outlier atoms="O8,C23,C24" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.04" Zscore="2.57" obsval="119.66"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6531" Q_score="0.435" mogul_rmsz_numbonds="48" mogul_rmsz_numangles="51" mogul_bonds_rmsz="0.40" mogul_angles_rmsz="0.95" num-H-reduce="74" model="1" chain="A" resnum="842" said="ND" ent="19" seq="." icode=" " resname="LHG" altcode=" ">
		<mog-torsion-outlier atoms="O1,C1,C2,O2" numobs="272" mean="80.69" stdev="43.55" mindiff="8.37" local_density="0.37" obsval="-2.21"/>
		<mog-torsion-outlier atoms="O1,C1,C2,C3" numobs="154" mean="56.07" stdev="9.65" mindiff="26.13" local_density="0.00" obsval="-123.09"/>
		<mog-torsion-outlier atoms="C1,C2,C3,O3" numobs="374" mean="58.92" stdev="11.62" mindiff="13.49" local_density="0.00" obsval="124.92"/>
		<mog-torsion-outlier atoms="O2,C2,C3,O3" numobs="654" mean="93.41" stdev="50.74" mindiff="1.21" local_density="0.15" obsval="4.04"/>
		<mog-torsion-outlier atoms="C2,C3,O3,P" numobs="474" mean="43.45" stdev="16.41" mindiff="0.05" local_density="3.16" obsval="113.68"/>
		<mog-torsion-outlier atoms="C3,O3,P,O5" numobs="40" mean="57.94" stdev="19.61" mindiff="8.77" local_density="2.50" obsval="91.94"/>
		<mog-torsion-outlier atoms="C3,O3,P,O6" numobs="40" mean="77.78" stdev="29.95" mindiff="15.83" local_density="0.00" obsval="-154.66"/>
		<mog-torsion-outlier atoms="C5,C4,O6,P" numobs="474" mean="50.07" stdev="17.30" mindiff="0.67" local_density="2.95" obsval="106.61"/>
		<mog-torsion-outlier atoms="C4,C5,C6,O8" numobs="248" mean="64.10" stdev="24.37" mindiff="1.20" local_density="1.21" obsval="134.18"/>
		<mog-torsion-outlier atoms="O7,C5,C6,O8" numobs="291" mean="84.20" stdev="49.05" mindiff="8.70" local_density="0.34" obsval="13.86"/>
		<mog-torsion-outlier atoms="O9,C7,O7,C5" numobs="1497" mean="47.54" stdev="5.46" mindiff="0.11" local_density="0.53" obsval="-54.31"/>
		<mog-torsion-outlier atoms="C8,C7,O7,C5" numobs="1189" mean="46.63" stdev="5.30" mindiff="1.07" local_density="0.34" obsval="126.51"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="15585" mean="147.46" stdev="38.46" mindiff="0.01" local_density="0.26" obsval="-9.80"/>
		<mog-torsion-outlier atoms="O8,C23,C24,C25" numobs="3091" mean="53.16" stdev="20.49" mindiff="0.02" local_density="4.50" obsval="104.91"/>
		<mog-torsion-outlier atoms="O10,C23,C24,C25" numobs="4149" mean="53.94" stdev="22.35" mindiff="0.02" local_density="4.80" obsval="-75.44"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="4310" mean="62.33" stdev="19.20" mindiff="0.22" local_density="0.81" obsval="100.29"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="15585" mean="44.71" stdev="11.89" mindiff="0.03" local_density="1.10" obsval="131.59"/>
		<mog-torsion-outlier atoms="C13,C14,C15,C16" numobs="15585" mean="47.52" stdev="10.32" mindiff="0.04" local_density="0.98" obsval="127.54"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="15585" mean="78.17" stdev="25.57" mindiff="0.05" local_density="2.64" obsval="84.57"/>
		<mog-torsion-outlier atoms="C18,C19,C20,C21" numobs="15585" mean="37.01" stdev="17.90" mindiff="0.02" local_density="1.71" obsval="-142.84"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="15585" mean="60.55" stdev="11.91" mindiff="0.05" local_density="0.73" obsval="-109.02"/>
		<mog-torsion-outlier atoms="C26,C27,C28,C29" numobs="15585" mean="61.36" stdev="12.44" mindiff="0.08" local_density="0.76" obsval="-107.88"/>
		<mog-torsion-outlier atoms="C28,C29,C30,C31" numobs="15585" mean="48.27" stdev="10.00" mindiff="0.05" local_density="0.96" obsval="-126.46"/>
		<mog-torsion-outlier atoms="C29,C30,C31,C32" numobs="15585" mean="70.80" stdev="19.58" mindiff="0.08" local_density="1.12" obsval="94.68"/>
		<mog-torsion-outlier atoms="C30,C31,C32,C33" numobs="15585" mean="40.89" stdev="14.65" mindiff="0.01" local_density="1.35" obsval="-137.15"/>
		<mog-torsion-outlier atoms="C33,C34,C35,C36" numobs="15585" mean="75.28" stdev="23.18" mindiff="0.06" local_density="1.78" obsval="-88.53"/>
		<mog-torsion-outlier atoms="C34,C35,C36,C37" numobs="15585" mean="48.12" stdev="10.07" mindiff="0.07" local_density="0.97" obsval="-126.68"/>
		<mog-torsion-outlier atoms="C35,C36,C37,C38" numobs="12796" mean="74.24" stdev="26.29" mindiff="0.02" local_density="2.75" obsval="86.08"/>
		<mog-angle-outlier atoms="C5,O7,C7" numobs="319" mean="117.80" stdev="2.39" mindiff="0.10" Zscore="-2.34" obsval="112.20"/>
		<mog-angle-outlier atoms="O7,C7,C8" numobs="587" mean="111.48" stdev="2.16" mindiff="0.09" Zscore="3.62" obsval="119.31"/>
		<mog-angle-outlier atoms="O8,C23,C24" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.08" Zscore="2.51" obsval="119.49"/>
		<clash atom="H261" dist="1.90" clashmag="0.54" cid="91"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7619" Q_score="0.46" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.50" mogul_angles_rmsz="2.27" ligand_chirality_outlier="yes" model="1" chain="A" resnum="843" said="OD" ent="17" seq="." icode=" " resname="C7Z" altcode=" ">
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="71.92" stdev="20.20" mindiff="12.67" local_density="0.00" obsval="49.11"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="61.87" stdev="12.28" mindiff="22.11" local_density="0.00" obsval="-116.58"/>
		<mog-torsion-outlier atoms="C21,C26,C27,C28" numobs="119" mean="66.96" stdev="48.89" mindiff="10.69" local_density="0.00" obsval="172.54"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="119" mean="53.48" stdev="47.94" mindiff="1.70" local_density="0.84" obsval="22.11"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C19" numobs="316" mean="105.50" stdev="13.52" mindiff="16.35" local_density="0.00" obsval="-113.63"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="105.38" stdev="13.46" mindiff="15.22" local_density="0.00" obsval="66.50"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="112.81" stdev="14.01" mindiff="10.77" local_density="0.00" obsval="-58.75"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C20" numobs="316" mean="154.03" stdev="22.15" mindiff="0.11" local_density="0.32" obsval="-163.67"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="153.86" stdev="21.89" mindiff="0.01" local_density="0.32" obsval="16.56"/>
		<mog-torsion-outlier atoms="C13,C14,C15,C35" numobs="760" mean="152.57" stdev="19.19" mindiff="13.78" local_density="0.00" obsval="-18.21"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C30" numobs="313" mean="22.39" stdev="16.02" mindiff="7.95" local_density="1.92" obsval="-154.43"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C39" numobs="316" mean="22.43" stdev="16.20" mindiff="1.06" local_density="0.63" obsval="25.53"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.96" obsval="1.46"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.51" obsval="1.60"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.55" obsval="1.57"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.07" Zscore="8.51" obsval="1.67"/>
		<mog-bond-outlier atoms="C4,C5" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.11" obsval="1.44"/>
		<mog-bond-outlier atoms="C2,C3" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.54" obsval="1.37"/>
		<mog-bond-outlier atoms="C2,C1" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.67" obsval="1.65"/>
		<mog-bond-outlier atoms="C18,C5" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.47" obsval="1.54"/>
		<mog-bond-outlier atoms="C27,C26" numobs="255" mean="1.45" stdev="0.03" mindiff="0.03" Zscore="3.83" obsval="1.58"/>
		<mog-bond-outlier atoms="C21,C26" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-3.05" obsval="1.49"/>
		<mog-bond-outlier atoms="C25,C26" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.36" obsval="1.61"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.46" obsval="1.55"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.36" obsval="1.56"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.90" obsval="1.58"/>
		<mog-bond-outlier atoms="C20,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.55" obsval="1.56"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.08" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C34" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.90" obsval="1.55"/>
		<mog-bond-outlier atoms="C40,C33" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.19" obsval="1.55"/>
		<mog-bond-outlier atoms="C32,C33" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="5.07" obsval="1.56"/>
		<mog-bond-outlier atoms="C31,C30" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.65" obsval="1.57"/>
		<mog-bond-outlier atoms="C28,C29" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.24" obsval="1.57"/>
		<mog-bond-outlier atoms="C22,C21" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="4.00" obsval="1.66"/>
		<mog-bond-outlier atoms="C22,C23" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.63" obsval="1.37"/>
		<mog-bond-outlier atoms="C24,C23" numobs="572" mean="1.52" stdev="0.02" mindiff="0.13" Zscore="11.75" obsval="1.72"/>
		<mog-bond-outlier atoms="C24,C25" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.61" obsval="1.43"/>
		<mog-bond-outlier atoms="C38,C25" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="3.49" obsval="1.56"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.63" Zscore="-3.88" obsval="117.33"/>
		<mog-angle-outlier atoms="C1,C6,C7" numobs="118" mean="115.65" stdev="2.71" mindiff="0.24" Zscore="2.18" obsval="121.56"/>
		<mog-angle-outlier atoms="C18,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="1.66" Zscore="-4.59" obsval="119.47"/>
		<mog-angle-outlier atoms="C18,C5,C4" numobs="328" mean="114.42" stdev="1.84" mindiff="0.17" Zscore="2.79" obsval="119.55"/>
		<mog-angle-outlier atoms="C21,C26,C25" numobs="97" mean="122.64" stdev="1.37" mindiff="2.45" Zscore="-5.21" obsval="115.51"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="4.70" Zscore="-5.16" obsval="118.61"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="0.53" Zscore="-3.86" obsval="121.86"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="3.65" Zscore="-3.50" obsval="116.75"/>
		<mog-angle-outlier atoms="C15,C35,C34" numobs="265" mean="123.52" stdev="2.05" mindiff="1.12" Zscore="-3.15" obsval="117.07"/>
		<mog-angle-outlier atoms="C35,C34,C33" numobs="147" mean="127.28" stdev="1.40" mindiff="0.11" Zscore="-3.13" obsval="122.89"/>
		<mog-angle-outlier atoms="C31,C32,C33" numobs="117" mean="126.36" stdev="2.74" mindiff="0.21" Zscore="-2.25" obsval="120.19"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="1.70" Zscore="-6.02" obsval="118.84"/>
		<mog-angle-outlier atoms="C39,C29,C30" numobs="181" mean="122.82" stdev="1.62" mindiff="0.03" Zscore="-2.08" obsval="119.45"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="5.12" Zscore="-5.44" obsval="118.18"/>
		<mog-angle-outlier atoms="C24,C25,C26" numobs="52" mean="120.76" stdev="2.05" mindiff="0.51" Zscore="-2.17" obsval="116.30"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="0.70" Zscore="-3.71" obsval="120.44"/>
		<mog-angle-outlier atoms="C38,C25,C24" numobs="328" mean="114.42" stdev="1.84" mindiff="0.21" Zscore="3.15" obsval="120.21"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7000" Q_score="0.459" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.62" mogul_angles_rmsz="4.42" num-H-reduce="52" model="1" chain="A" resnum="844" said="PD" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="25.98" stdev="19.91" mindiff="8.99" local_density="0.44" obsval="-152.14"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="152.20" stdev="21.74" mindiff="1.68" local_density="0.32" obsval="18.24"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="153.89" stdev="22.14" mindiff="0.25" local_density="0.32" obsval="-163.52"/>
		<mog-torsion-outlier atoms="C17,C18,C19,C20" numobs="313" mean="18.98" stdev="17.18" mindiff="4.30" local_density="4.47" obsval="-158.07"/>
		<mog-torsion-outlier atoms="C36,C18,C19,C20" numobs="316" mean="20.13" stdev="16.98" mindiff="1.40" local_density="2.53" obsval="23.07"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="52.19" stdev="47.94" mindiff="0.42" local_density="0.84" obsval="23.39"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="4.09" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.01" Zscore="-5.24" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-3.92" obsval="1.31"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="6.00" obsval="1.51"/>
		<mog-angle-outlier atoms="C2,C1,C6" numobs="132" mean="110.44" stdev="1.45" mindiff="0.09" Zscore="-2.33" obsval="107.05"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="0.48" Zscore="-2.49" obsval="119.34"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.60" Zscore="3.11" obsval="120.23"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.70" Zscore="-3.71" obsval="120.43"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.62" Zscore="-2.97" obsval="118.58"/>
		<mog-angle-outlier atoms="C1,C6,C7" numobs="118" mean="115.65" stdev="2.71" mindiff="2.29" Zscore="3.17" obsval="124.25"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.24" Zscore="2.33" obsval="121.64"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.14" Zscore="-3.27" obsval="117.51"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="7.98" Zscore="7.72" obsval="138.10"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="36.80" Zscore="18.46" obsval="176.70"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="17.21" Zscore="8.17" obsval="148.76"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.29" Zscore="-2.06" obsval="115.78"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="0.25" Zscore="-2.13" obsval="124.29"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="19.18" Zscore="12.27" obsval="148.62"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.03" Zscore="2.38" obsval="122.75"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.06" Zscore="-2.83" obsval="118.24"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="28.03" Zscore="12.11" obsval="159.58"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="18.78" Zscore="12.24" obsval="158.68"/>
		<mog-angle-outlier atoms="C37,C22,C23" numobs="317" mean="118.09" stdev="1.53" mindiff="0.67" Zscore="3.21" obsval="123.00"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="1.42" Zscore="-4.46" obsval="116.54"/>
		<mog-angle-outlier atoms="C29,C30,C25" numobs="132" mean="110.44" stdev="1.45" mindiff="0.40" Zscore="-2.55" obsval="106.74"/>
		<clash atom="H383" dist="1.69" clashmag="0.75" cid="70"/>
		<clash atom="H23C" dist="1.69" clashmag="0.75" cid="70"/>
		<clash atom="H23C" dist="2.44" clashmag="0.45" cid="116"/>
		<clash atom="H10C" dist="1.85" clashmag="0.59" cid="83"/>
		<clash atom="H10C" dist="2.47" clashmag="0.43" cid="126"/>
		<clash atom="H321" dist="1.87" clashmag="0.57" cid="87"/>
		<clash atom="HC8" dist="1.87" clashmag="0.57" cid="87"/>
		<clash atom="H382" dist="1.96" clashmag="0.47" cid="109"/>
		<clash atom="C38" dist="2.44" clashmag="0.45" cid="116"/>
		<clash atom="H351" dist="1.79" clashmag="0.41" cid="132"/>
		<clash atom="H15C" dist="1.79" clashmag="0.41" cid="132"/>
		<clash atom="H352" dist="2.03" clashmag="0.40" cid="137"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9500" Q_score="0.58" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.58" mogul_angles_rmsz="5.82" num-H-reduce="52" model="1" chain="A" resnum="845" said="QD" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="65.12" stdev="48.89" mindiff="8.85" local_density="0.84" obsval="170.71"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="67.81" stdev="47.94" mindiff="16.03" local_density="0.00" obsval="-7.78"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="26.54" stdev="24.58" mindiff="4.66" local_density="0.67" obsval="153.25"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="28.68" stdev="22.83" mindiff="8.78" local_density="0.62" obsval="-29.39"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="45.94" stdev="7.91" mindiff="12.58" local_density="0.00" obsval="-128.39"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="63.06" stdev="7.46" mindiff="48.12" local_density="0.00" obsval="-113.02"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="79.60" stdev="6.79" mindiff="17.10" local_density="0.00" obsval="93.68"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="79.27" stdev="7.12" mindiff="14.11" local_density="0.00" obsval="-85.99"/>
		<mog-torsion-outlier atoms="C21,C22,C23,C24" numobs="313" mean="18.98" stdev="17.17" mindiff="4.31" local_density="4.47" obsval="-158.07"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="54.98" stdev="47.94" mindiff="3.21" local_density="0.84" obsval="20.61"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C30" numobs="119" mean="47.83" stdev="48.70" mindiff="5.31" local_density="4.20" obsval="-153.22"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="4.09" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-5.12" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-3.92" obsval="1.31"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.01" Zscore="5.76" obsval="1.50"/>
		<mog-angle-outlier atoms="C2,C1,C6" numobs="132" mean="110.44" stdev="1.45" mindiff="8.45" Zscore="-9.15" obsval="97.14"/>
		<mog-angle-outlier atoms="C31,C1,C2" numobs="1014" mean="108.95" stdev="3.84" mindiff="0.17" Zscore="2.10" obsval="117.02"/>
		<mog-angle-outlier atoms="C32,C1,C2" numobs="1014" mean="108.95" stdev="3.84" mindiff="0.09" Zscore="2.13" obsval="117.13"/>
		<mog-angle-outlier atoms="C31,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="18.60" Zscore="-15.40" obsval="86.10"/>
		<mog-angle-outlier atoms="C32,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="19.06" Zscore="-15.69" obsval="85.63"/>
		<mog-angle-outlier atoms="C32,C1,C31" numobs="759" mean="108.63" stdev="2.86" mindiff="0.87" Zscore="6.00" obsval="125.81"/>
		<mog-angle-outlier atoms="C3,C4,C5" numobs="188" mean="114.06" stdev="1.78" mindiff="1.42" Zscore="-4.59" obsval="105.86"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="1.24" Zscore="-4.18" obsval="117.06"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.13" Zscore="3.45" obsval="120.96"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.09" Zscore="-2.32" obsval="121.95"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.26" Zscore="3.82" obsval="123.92"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.10" Zscore="-2.46" obsval="118.83"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="16.99" Zscore="14.14" obsval="147.11"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="33.70" Zscore="17.39" obsval="173.59"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="22.31" Zscore="10.03" obsval="153.86"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.06" Zscore="-3.03" obsval="114.24"/>
		<mog-angle-outlier atoms="C35,C13,C12" numobs="317" mean="118.09" stdev="1.53" mindiff="0.24" Zscore="3.49" obsval="123.43"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="0.26" Zscore="-2.14" obsval="124.28"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="18.73" Zscore="12.05" obsval="148.17"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.18" Zscore="3.10" obsval="123.88"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.14" Zscore="-2.60" obsval="118.60"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="25.55" Zscore="11.21" obsval="157.10"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="22.17" Zscore="13.41" obsval="162.07"/>
		<mog-angle-outlier atoms="C23,C24,C25" numobs="153" mean="127.00" stdev="2.67" mindiff="0.20" Zscore="-2.14" obsval="121.29"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="0.02" Zscore="-2.07" obsval="119.81"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="99" mean="122.70" stdev="1.35" mindiff="1.39" Zscore="-4.29" obsval="116.91"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="188" mean="114.06" stdev="1.78" mindiff="4.37" Zscore="-6.25" obsval="102.92"/>
		<mog-angle-outlier atoms="C29,C30,C25" numobs="132" mean="110.44" stdev="1.45" mindiff="0.19" Zscore="2.90" obsval="114.65"/>
		<mog-angle-outlier atoms="C40,C30,C25" numobs="316" mean="110.24" stdev="1.57" mindiff="0.03" Zscore="-2.69" obsval="106.02"/>
		<clash atom="H383" dist="1.71" clashmag="0.73" cid="71"/>
		<clash atom="H383" dist="2.42" clashmag="0.49" cid="105"/>
		<clash atom="H23C" dist="1.71" clashmag="0.73" cid="71"/>
		<clash atom="H10C" dist="1.71" clashmag="0.72" cid="72"/>
		<clash atom="H341" dist="1.90" clashmag="0.54" cid="91"/>
		<clash atom="H391" dist="1.90" clashmag="0.51" cid="96"/>
		<clash atom="H363" dist="1.92" clashmag="0.50" cid="101"/>
		<clash atom="C39" dist="2.41" clashmag="0.50" cid="102"/>
		<clash atom="C23" dist="2.42" clashmag="0.49" cid="105"/>
		<clash atom="H351" dist="1.74" clashmag="0.45" cid="117"/>
		<clash atom="H15C" dist="1.74" clashmag="0.45" cid="117"/>
		<clash atom="H24C" dist="1.97" clashmag="0.45" cid="118"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9500" Q_score="0.571" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.60" mogul_angles_rmsz="4.65" num-H-reduce="52" model="1" chain="A" resnum="846" said="RD" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="161.71" stdev="22.30" mindiff="3.57" local_density="0.64" obsval="-8.64"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C34" numobs="316" mean="159.66" stdev="22.45" mindiff="5.57" local_density="0.63" obsval="169.34"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="49.53" stdev="14.84" mindiff="29.65" local_density="0.00" obsval="-128.26"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="51.08" stdev="13.68" mindiff="32.99" local_density="0.00" obsval="53.60"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="32.24" stdev="11.05" mindiff="1.01" local_density="0.92" obsval="142.77"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="24.98" stdev="20.24" mindiff="7.93" local_density="0.44" obsval="153.20"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.02" Zscore="3.66" obsval="1.44"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.01" Zscore="-5.39" obsval="1.20"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="-2.01" obsval="1.41"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-4.12" obsval="1.30"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.01" Zscore="5.72" obsval="1.50"/>
		<mog-angle-outlier atoms="C3,C4,C5" numobs="188" mean="114.06" stdev="1.78" mindiff="0.10" Zscore="-3.74" obsval="107.39"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="0.14" Zscore="-2.24" obsval="119.67"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.16" Zscore="2.84" obsval="119.65"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.49" Zscore="-3.52" obsval="120.65"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.14" Zscore="-2.19" obsval="119.64"/>
		<mog-angle-outlier atoms="C1,C6,C7" numobs="118" mean="115.65" stdev="2.71" mindiff="1.98" Zscore="3.05" obsval="123.94"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="97" mean="121.56" stdev="2.30" mindiff="0.51" Zscore="-2.36" obsval="116.12"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.17" Zscore="3.54" obsval="123.50"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="1.98" Zscore="-4.58" obsval="115.39"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="6.74" Zscore="6.83" obsval="136.86"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="37.33" Zscore="18.65" obsval="177.23"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="23.45" Zscore="10.45" obsval="155.00"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.48" Zscore="-2.77" obsval="114.66"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="18.99" Zscore="12.17" obsval="148.43"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.05" Zscore="2.77" obsval="123.37"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="23.77" Zscore="10.56" obsval="155.32"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="25.09" Zscore="14.42" obsval="164.99"/>
		<mog-angle-outlier atoms="C24,C25,C26" numobs="97" mean="121.56" stdev="2.30" mindiff="0.93" Zscore="-2.54" obsval="115.71"/>
		<mog-angle-outlier atoms="C30,C25,C24" numobs="118" mean="115.65" stdev="2.71" mindiff="6.13" Zscore="4.58" obsval="128.09"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="1.89" Zscore="-4.80" obsval="116.07"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="99" mean="122.70" stdev="1.35" mindiff="0.10" Zscore="-3.18" obsval="118.41"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="188" mean="114.06" stdev="1.78" mindiff="0.89" Zscore="-3.08" obsval="108.56"/>
		<mog-angle-outlier atoms="C29,C30,C25" numobs="132" mean="110.44" stdev="1.45" mindiff="0.23" Zscore="-2.11" obsval="107.38"/>
		<mog-angle-outlier atoms="C40,C30,C25" numobs="316" mean="110.24" stdev="1.57" mindiff="0.58" Zscore="4.37" obsval="117.10"/>
		<clash atom="H311" dist="1.76" clashmag="0.66" cid="74"/>
		<clash atom="H311" dist="1.85" clashmag="0.57" cid="86"/>
		<clash atom="H311" dist="2.45" clashmag="0.46" cid="113"/>
		<clash atom="H10C" dist="1.79" clashmag="0.64" cid="76"/>
		<clash atom="H403" dist="1.81" clashmag="0.62" cid="80"/>
		<clash atom="H23C" dist="1.81" clashmag="0.62" cid="80"/>
		<clash atom="H23C" dist="2.46" clashmag="0.44" cid="121"/>
		<clash atom="HC8" dist="1.85" clashmag="0.57" cid="86"/>
		<clash atom="H342" dist="2.35" clashmag="0.56" cid="89"/>
		<clash atom="H342" dist="2.36" clashmag="0.55" cid="90"/>
		<clash atom="C8" dist="2.45" clashmag="0.46" cid="113"/>
		<clash atom="C8" dist="2.47" clashmag="0.44" cid="119"/>
		<clash atom="C40" dist="2.46" clashmag="0.44" cid="121"/>
		<clash atom="H351" dist="1.88" clashmag="0.43" cid="124"/>
		<clash atom="H15C" dist="1.88" clashmag="0.43" cid="124"/>
		<clash atom="C31" dist="2.48" clashmag="0.41" cid="130"/>
		<clash atom="H24C" dist="1.95" clashmag="0.41" cid="131"/>
		<clash atom="H371" dist="1.95" clashmag="0.41" cid="131"/>
		<clash atom="H372" dist="2.03" clashmag="0.41" cid="136"/>
		<clash atom="H343" dist="2.03" clashmag="0.40" cid="139"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8049" Q_score="0.511" mogul_rmsz_numbonds="42" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.09" mogul_angles_rmsz="2.95" ligand_chirality_outlier="yes" num-H-reduce="56" model="1" chain="A" resnum="847" said="SD" ent="18" seq="." icode=" " resname="RRX" altcode=" ">
		<mog-torsion-outlier atoms="C37,C22,C23,C24" numobs="316" mean="29.19" stdev="13.93" mindiff="8.29" local_density="0.32" obsval="32.76"/>
		<mog-torsion-outlier atoms="C21,C22,C23,C24" numobs="313" mean="29.42" stdev="13.70" mindiff="15.46" local_density="0.00" obsval="-146.91"/>
		<mog-torsion-outlier atoms="C20,C21,C22,C23" numobs="150" mean="167.23" stdev="33.00" mindiff="0.07" local_density="3.33" obsval="-0.84"/>
		<mog-torsion-outlier atoms="C20,C21,C22,C37" numobs="160" mean="168.00" stdev="32.00" mindiff="0.48" local_density="3.12" obsval="179.50"/>
		<mog-torsion-outlier atoms="C18,C19,C20,C21" numobs="229" mean="168.40" stdev="27.16" mindiff="0.12" local_density="2.62" obsval="-2.02"/>
		<mog-torsion-outlier atoms="C13,C14,C15,C16" numobs="760" mean="23.71" stdev="13.20" mindiff="0.50" local_density="2.50" obsval="151.84"/>
		<mog-torsion-outlier atoms="C35,C13,C14,C15" numobs="160" mean="168.38" stdev="32.00" mindiff="0.10" local_density="3.12" obsval="-179.88"/>
		<mog-torsion-outlier atoms="C12,C13,C14,C15" numobs="150" mean="166.82" stdev="33.00" mindiff="0.34" local_density="3.33" obsval="-1.24"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="170.28" stdev="27.16" mindiff="0.88" local_density="2.62" obsval="-0.13"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="27.56" stdev="12.22" mindiff="0.00" local_density="1.84" obsval="-147.73"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="158.72" stdev="22.16" mindiff="4.90" local_density="0.64" obsval="-11.66"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C34" numobs="316" mean="158.74" stdev="22.41" mindiff="4.64" local_density="0.63" obsval="168.41"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="48.81" stdev="16.74" mindiff="0.22" local_density="1.68" obsval="-94.69"/>
		<mog-bond-outlier atoms="C2,C1" numobs="507" mean="1.54" stdev="0.02" mindiff="0.01" Zscore="5.43" obsval="1.66"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.95" obsval="1.46"/>
		<mog-bond-outlier atoms="C32,C1" numobs="4607" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="3.02" obsval="1.59"/>
		<mog-bond-outlier atoms="C2,C3" numobs="10925" mean="1.52" stdev="0.02" mindiff="0.00" Zscore="-6.64" obsval="1.36"/>
		<mog-bond-outlier atoms="C3,C4" numobs="10557" mean="1.52" stdev="0.03" mindiff="0.00" Zscore="4.31" obsval="1.66"/>
		<mog-bond-outlier atoms="C29,C30" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.43" obsval="1.65"/>
		<mog-bond-outlier atoms="C30,C25" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.79" obsval="1.46"/>
		<mog-bond-outlier atoms="C29,C28" numobs="383" mean="1.52" stdev="0.01" mindiff="0.09" Zscore="-10.17" obsval="1.37"/>
		<mog-bond-outlier atoms="C27,C28" numobs="572" mean="1.52" stdev="0.02" mindiff="0.06" Zscore="8.10" obsval="1.66"/>
		<mog-bond-outlier atoms="C27,C26" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.02" obsval="1.44"/>
		<mog-bond-outlier atoms="C26,C25" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.07" obsval="1.61"/>
		<mog-bond-outlier atoms="C24,C25" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.59" obsval="1.57"/>
		<mog-bond-outlier atoms="C23,C22" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.51" obsval="1.55"/>
		<mog-bond-outlier atoms="C20,C21" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.17" obsval="1.56"/>
		<mog-bond-outlier atoms="C19,C18" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.36" obsval="1.57"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="3.47" obsval="1.54"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.17" obsval="1.56"/>
		<mog-bond-outlier atoms="C35,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.41" obsval="1.55"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.88" obsval="1.56"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.06" obsval="1.55"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.40" obsval="1.57"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.00" Zscore="2.96" obsval="1.55"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.19" Zscore="15.16" obsval="1.59"/>
		<mog-bond-outlier atoms="C4,C5" numobs="379" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-3.28" obsval="1.44"/>
		<mog-angle-outlier atoms="C2,C1,C6" numobs="132" mean="110.44" stdev="1.45" mindiff="0.26" Zscore="2.85" obsval="114.58"/>
		<mog-angle-outlier atoms="C38,C26,C25" numobs="104" mean="124.48" stdev="1.09" mindiff="2.60" Zscore="-5.45" obsval="118.54"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="0.85" Zscore="-2.71" obsval="118.93"/>
		<mog-angle-outlier atoms="C23,C24,C25" numobs="153" mean="127.00" stdev="2.67" mindiff="0.61" Zscore="-2.29" obsval="120.89"/>
		<mog-angle-outlier atoms="C24,C23,C22" numobs="106" mean="126.23" stdev="1.48" mindiff="2.32" Zscore="-3.55" obsval="120.98"/>
		<mog-angle-outlier atoms="C20,C21,C22" numobs="147" mean="127.28" stdev="1.40" mindiff="1.96" Zscore="-6.20" obsval="118.58"/>
		<mog-angle-outlier atoms="C36,C18,C19" numobs="317" mean="118.09" stdev="1.53" mindiff="1.41" Zscore="4.58" obsval="125.08"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="5.02" Zscore="-6.27" obsval="109.15"/>
		<mog-angle-outlier atoms="C16,C17,C18" numobs="147" mean="127.28" stdev="1.40" mindiff="4.04" Zscore="4.91" obsval="134.16"/>
		<mog-angle-outlier atoms="C15,C16,C17" numobs="265" mean="123.52" stdev="2.05" mindiff="1.50" Zscore="-4.22" obsval="114.89"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="0.01" Zscore="-4.25" obsval="121.32"/>
		<mog-angle-outlier atoms="C35,C13,C14" numobs="181" mean="122.82" stdev="1.62" mindiff="0.01" Zscore="-2.96" obsval="118.02"/>
		<mog-angle-outlier atoms="C35,C13,C12" numobs="317" mean="118.09" stdev="1.53" mindiff="0.38" Zscore="2.43" obsval="121.80"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="0.16" Zscore="2.62" obsval="130.80"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="3.41" Zscore="-7.24" obsval="117.12"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.05" Zscore="-2.55" obsval="118.68"/>
		<mog-angle-outlier atoms="C8,C9,C10" numobs="168" mean="119.01" stdev="1.57" mindiff="3.49" Zscore="6.06" obsval="128.54"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.74" Zscore="-3.47" obsval="112.78"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="1.08" Zscore="3.33" obsval="131.16"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="4.95" Zscore="-7.04" obsval="113.02"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="97" mean="121.56" stdev="2.30" mindiff="1.73" Zscore="-2.89" obsval="114.90"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.09" Zscore="-2.74" obsval="121.50"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="0.98" Zscore="-3.99" obsval="117.31"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.17" Zscore="3.31" obsval="120.66"/>
		<clash atom="H36" dist="1.86" clashmag="0.58" cid="379"/>
		<clash atom="H36" dist="2.44" clashmag="0.47" cid="381"/>
		<clash atom="H42" dist="1.86" clashmag="0.58" cid="379"/>
		<clash atom="C10" dist="2.44" clashmag="0.47" cid="381"/>
		<chiral-outlier problem="WRONG HAND" atom="C28"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="1.0000" Q_score="0.449" mogul_rmsz_numbonds="0" model="1" chain="A" resnum="848" said="TD" ent="28" seq="." icode=" " resname="SF4" altcode=" "/>
	<ModelledSubgroup residue_inclusion="0.7500" Q_score="0.531" mogul_rmsz_numbonds="47" mogul_rmsz_numangles="50" mogul_bonds_rmsz="0.87" mogul_angles_rmsz="1.09" num-H-reduce="75" model="1" chain="A" resnum="849" said="UD" ent="29" seq="." icode=" " resname="3PH" altcode=" ">
		<mog-torsion-outlier atoms="C1,O11,P,O13" numobs="52" mean="42.13" stdev="21.86" mindiff="13.67" local_density="0.00" obsval="92.02"/>
		<mog-torsion-outlier atoms="C1,O11,P,O14" numobs="52" mean="74.39" stdev="26.78" mindiff="17.93" local_density="0.00" obsval="-147.94"/>
		<mog-torsion-outlier atoms="O11,C1,C2,O21" numobs="299" mean="65.53" stdev="34.10" mindiff="2.91" local_density="3.68" obsval="-153.01"/>
		<mog-torsion-outlier atoms="O11,C1,C2,C3" numobs="265" mean="46.28" stdev="27.77" mindiff="0.15" local_density="3.77" obsval="86.61"/>
		<mog-torsion-outlier atoms="O21,C2,C3,O31" numobs="291" mean="61.07" stdev="48.69" mindiff="1.11" local_density="3.09" obsval="-37.27"/>
		<mog-torsion-outlier atoms="O22,C21,O21,C2" numobs="1497" mean="36.08" stdev="4.99" mindiff="1.83" local_density="0.87" obsval="-42.76"/>
		<mog-torsion-outlier atoms="C22,C21,O21,C2" numobs="1189" mean="35.48" stdev="4.99" mindiff="0.55" local_density="0.76" obsval="137.73"/>
		<mog-torsion-outlier atoms="O21,C21,C22,C23" numobs="3091" mean="60.28" stdev="23.88" mindiff="0.10" local_density="4.24" obsval="-91.17"/>
		<mog-torsion-outlier atoms="O22,C21,C22,C23" numobs="4149" mean="59.85" stdev="24.24" mindiff="0.09" local_density="4.77" obsval="89.32"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="15585" mean="40.97" stdev="14.58" mindiff="0.04" local_density="1.35" obsval="-137.02"/>
		<mog-torsion-outlier atoms="C24,C25,C26,C27" numobs="15585" mean="65.92" stdev="15.68" mindiff="0.02" local_density="0.84" obsval="101.48"/>
		<mog-torsion-outlier atoms="C29,C2A,C2B,C2C" numobs="15585" mean="54.89" stdev="9.39" mindiff="0.03" local_density="0.77" obsval="-117.01"/>
		<mog-torsion-outlier atoms="C2C,C2D,C2E,C2F" numobs="15585" mean="28.68" stdev="25.76" mindiff="0.01" local_density="4.58" obsval="-155.36"/>
		<mog-torsion-outlier atoms="C2D,C2E,C2F,C2G" numobs="15585" mean="79.29" stdev="26.40" mindiff="0.02" local_density="3.15" obsval="83.08"/>
		<mog-torsion-outlier atoms="O32,C31,O31,C3" numobs="4533" mean="16.88" stdev="4.36" mindiff="0.07" local_density="4.79" obsval="22.58"/>
		<mog-torsion-outlier atoms="C32,C31,O31,C3" numobs="2608" mean="17.16" stdev="4.80" mindiff="0.27" local_density="4.72" obsval="-157.17"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C34" numobs="4310" mean="55.98" stdev="10.04" mindiff="1.11" local_density="0.46" obsval="-113.48"/>
		<mog-torsion-outlier atoms="C35,C36,C37,C38" numobs="15585" mean="28.26" stdev="26.17" mindiff="0.00" local_density="4.97" obsval="156.01"/>
		<mog-torsion-outlier atoms="C39,C3A,C3B,C3C" numobs="15585" mean="76.77" stdev="24.42" mindiff="0.02" local_density="2.17" obsval="86.48"/>
		<mog-bond-outlier atoms="O21,C2" numobs="2309" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="-2.59" obsval="1.40"/>
		<mog-bond-outlier atoms="O21,C21" numobs="1553" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="2.17" obsval="1.40"/>
		<mog-bond-outlier atoms="O31,C3" numobs="4622" mean="1.45" stdev="0.02" mindiff="0.00" Zscore="-2.17" obsval="1.40"/>
		<mog-bond-outlier atoms="O31,C31" numobs="4555" mean="1.33" stdev="0.03" mindiff="0.00" Zscore="2.41" obsval="1.40"/>
		<mog-angle-outlier atoms="O21,C21,C22" numobs="587" mean="111.48" stdev="2.16" mindiff="0.03" Zscore="3.87" obsval="119.85"/>
		<mog-angle-outlier atoms="O31,C31,C32" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.02" Zscore="2.66" obsval="119.93"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6000" Q_score="0.32" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.64" mogul_angles_rmsz="5.06" num-H-reduce="52" model="1" chain="A" resnum="850" said="VD" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="69.03" stdev="48.89" mindiff="12.76" local_density="0.00" obsval="174.62"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="70.53" stdev="47.94" mindiff="18.75" local_density="0.00" obsval="-5.06"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="161.16" stdev="22.27" mindiff="4.12" local_density="0.64" obsval="-9.20"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C34" numobs="316" mean="160.64" stdev="22.49" mindiff="6.55" local_density="0.63" obsval="170.32"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="83.09" stdev="2.00" mindiff="66.13" local_density="0.00" obsval="-91.78"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="83.54" stdev="1.91" mindiff="68.08" local_density="0.00" obsval="88.69"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="47.68" stdev="7.60" mindiff="14.40" local_density="0.00" obsval="126.56"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="46.22" stdev="13.10" mindiff="30.35" local_density="0.00" obsval="130.79"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="140.56" stdev="20.81" mindiff="8.26" local_density="0.64" obsval="-30.03"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="141.99" stdev="21.19" mindiff="7.16" local_density="0.63" obsval="151.47"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="150" mean="164.30" stdev="33.00" mindiff="0.36" local_density="3.33" obsval="3.77"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C36" numobs="160" mean="165.24" stdev="32.00" mindiff="0.26" local_density="3.12" obsval="-176.75"/>
		<mog-torsion-outlier atoms="C18,C19,C20,C21" numobs="229" mean="154.40" stdev="23.45" mindiff="8.21" local_density="0.87" obsval="-16.62"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="84.46" stdev="36.64" mindiff="1.35" local_density="4.20" obsval="-154.19"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.00" Zscore="4.18" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-4.95" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-4.04" obsval="1.30"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="6.02" obsval="1.51"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="3.60" Zscore="-5.93" obsval="114.69"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.32" Zscore="3.54" obsval="121.15"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="4.46" Zscore="-6.68" obsval="113.50"/>
		<mog-angle-outlier atoms="C1,C6,C7" numobs="118" mean="115.65" stdev="2.71" mindiff="1.46" Zscore="2.86" obsval="123.42"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.23" Zscore="-2.67" obsval="118.50"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="11.44" Zscore="10.18" obsval="141.56"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="38.25" Zscore="18.96" obsval="178.14"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="23.85" Zscore="10.59" obsval="155.40"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="0.33" Zscore="-2.98" obsval="123.10"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="22.51" Zscore="13.89" obsval="151.95"/>
		<mog-angle-outlier atoms="C16,C17,C18" numobs="147" mean="127.28" stdev="1.40" mindiff="1.06" Zscore="2.78" obsval="131.18"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.21" Zscore="2.49" obsval="122.93"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.10" Zscore="-2.27" obsval="119.13"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="29.09" Zscore="12.50" obsval="160.64"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="22.69" Zscore="13.59" obsval="162.59"/>
		<mog-angle-outlier atoms="C37,C22,C21" numobs="181" mean="122.82" stdev="1.62" mindiff="0.03" Zscore="-2.23" obsval="119.20"/>
		<mog-angle-outlier atoms="C30,C25,C24" numobs="118" mean="115.65" stdev="2.71" mindiff="7.64" Zscore="5.14" obsval="129.59"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="6.01" Zscore="-7.82" obsval="111.96"/>
		<mog-angle-outlier atoms="C38,C26,C25" numobs="104" mean="124.48" stdev="1.09" mindiff="0.03" Zscore="-2.38" obsval="121.89"/>
		<mog-angle-outlier atoms="C38,C26,C27" numobs="379" mean="113.60" stdev="2.13" mindiff="0.02" Zscore="2.07" obsval="118.02"/>
		<mog-angle-outlier atoms="C29,C28,C27" numobs="920" mean="111.28" stdev="2.20" mindiff="0.09" Zscore="2.09" obsval="115.87"/>
		<mog-angle-outlier atoms="C29,C30,C25" numobs="132" mean="110.44" stdev="1.45" mindiff="2.47" Zscore="-5.03" obsval="103.13"/>
		<mog-angle-outlier atoms="C40,C30,C25" numobs="316" mean="110.24" stdev="1.57" mindiff="0.18" Zscore="3.89" obsval="116.34"/>
		<clash atom="H352" dist="1.62" clashmag="0.80" cid="69"/>
		<clash atom="H403" dist="1.87" clashmag="0.57" cid="88"/>
		<clash atom="H23C" dist="1.87" clashmag="0.57" cid="88"/>
		<clash atom="H23C" dist="2.50" clashmag="0.41" cid="134"/>
		<clash atom="H383" dist="2.48" clashmag="0.48" cid="107"/>
		<clash atom="H351" dist="1.66" clashmag="0.44" cid="122"/>
		<clash atom="H15C" dist="1.66" clashmag="0.44" cid="122"/>
		<clash atom="C40" dist="2.50" clashmag="0.41" cid="134"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6852" Q_score="0.394" mogul_rmsz_numbonds="54" mogul_rmsz_numangles="63" mogul_bonds_rmsz="0.89" mogul_angles_rmsz="1.00" model="1" chain="A" resnum="851" said="WD" ent="30" seq="." icode=" " resname="T7X" altcode=" ">
		<mog-torsion-outlier atoms="C7,O13,P1,O1" numobs="40" mean="67.66" stdev="20.28" mindiff="31.39" local_density="0.00" obsval="-139.09"/>
		<mog-torsion-outlier atoms="C7,O13,P1,O11" numobs="40" mean="58.89" stdev="14.03" mindiff="0.67" local_density="2.50" obsval="101.39"/>
		<mog-torsion-outlier atoms="C7,O13,P1,O12" numobs="40" mean="82.71" stdev="54.48" mindiff="12.29" local_density="0.00" obsval="-18.54"/>
		<mog-torsion-outlier atoms="C7,C8,O16,C10" numobs="153" mean="108.16" stdev="34.47" mindiff="2.37" local_density="0.65" obsval="-9.84"/>
		<mog-torsion-outlier atoms="O16,C10,C12,C13" numobs="3091" mean="50.46" stdev="20.15" mindiff="0.23" local_density="4.95" obsval="110.76"/>
		<mog-torsion-outlier atoms="C12,C10,O16,C8" numobs="1189" mean="68.79" stdev="5.40" mindiff="21.13" local_density="0.00" obsval="104.30"/>
		<mog-torsion-outlier atoms="O17,C10,O16,C8" numobs="1497" mean="68.87" stdev="5.86" mindiff="0.56" local_density="0.07" obsval="-75.70"/>
		<mog-torsion-outlier atoms="O19,C11,O18,C9" numobs="4533" mean="42.39" stdev="5.20" mindiff="0.06" local_density="0.66" obsval="48.79"/>
		<mog-torsion-outlier atoms="C31,C11,O18,C9" numobs="2608" mean="42.63" stdev="4.78" mindiff="3.72" local_density="0.46" obsval="-131.12"/>
		<mog-torsion-outlier atoms="C12,C13,C14,C15" numobs="1067" mean="53.82" stdev="25.53" mindiff="0.35" local_density="1.50" obsval="94.91"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="58" mean="76.26" stdev="34.29" mindiff="0.92" local_density="1.72" obsval="178.33"/>
		<mog-torsion-outlier atoms="C18,C19,C20,C21" numobs="58" mean="53.62" stdev="33.20" mindiff="1.90" local_density="3.45" obsval="155.00"/>
		<mog-torsion-outlier atoms="C34,C35,C36,C37" numobs="15585" mean="79.73" stdev="26.74" mindiff="0.01" local_density="3.36" obsval="-82.48"/>
		<mog-torsion-outlier atoms="C35,C36,C37,C38" numobs="15585" mean="58.09" stdev="10.56" mindiff="0.07" local_density="0.72" obsval="-112.49"/>
		<mog-torsion-outlier atoms="C40,C41,C42,C43" numobs="15585" mean="38.70" stdev="16.43" mindiff="0.02" local_density="1.51" obsval="140.36"/>
		<mog-torsion-outlier atoms="C41,C42,C43,C44" numobs="15585" mean="45.76" stdev="11.24" mindiff="0.02" local_density="1.05" obsval="-130.08"/>
		<mog-torsion-outlier atoms="C43,C44,C45,C46" numobs="15585" mean="107.23" stdev="37.33" mindiff="0.01" local_density="3.16" obsval="50.43"/>
		<mog-torsion-outlier atoms="C44,C45,C46,C47" numobs="12796" mean="33.13" stdev="27.26" mindiff="0.01" local_density="4.85" obsval="151.96"/>
		<mog-bond-outlier atoms="O16,C8" numobs="2309" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="-2.45" obsval="1.40"/>
		<mog-bond-outlier atoms="O18,C9" numobs="4622" mean="1.45" stdev="0.02" mindiff="0.00" Zscore="-2.20" obsval="1.40"/>
		<mog-bond-outlier atoms="O16,C10" numobs="1553" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="2.13" obsval="1.40"/>
		<mog-bond-outlier atoms="O18,C11" numobs="4555" mean="1.33" stdev="0.03" mindiff="0.00" Zscore="2.34" obsval="1.40"/>
		<mog-angle-outlier atoms="O16,C10,C12" numobs="587" mean="111.48" stdev="2.16" mindiff="0.18" Zscore="3.80" obsval="119.70"/>
		<mog-angle-outlier atoms="O18,C11,C31" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.02" Zscore="2.68" obsval="120.00"/>
		<clash atom="C23" dist="2.46" clashmag="0.46" cid="509"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.5319" Q_score="0.368" mogul_rmsz_numbonds="45" mogul_rmsz_numangles="47" mogul_bonds_rmsz="0.93" mogul_angles_rmsz="1.02" num-H-reduce="66" model="1" chain="A" resnum="852" said="XD" ent="25" seq="." icode=" " resname="PTY" altcode=" ">
		<mog-torsion-outlier atoms="C2,C3,O11,P1" numobs="49" mean="73.79" stdev="28.57" mindiff="3.58" local_density="2.04" obsval="-70.80"/>
		<mog-torsion-outlier atoms="C31,C30,O4,C1" numobs="2608" mean="29.17" stdev="4.65" mindiff="0.32" local_density="1.23" obsval="144.78"/>
		<mog-torsion-outlier atoms="O30,C30,O4,C1" numobs="4533" mean="28.97" stdev="4.58" mindiff="0.10" local_density="1.54" obsval="-35.13"/>
		<mog-torsion-outlier atoms="C6,C5,O14,P1" numobs="474" mean="50.81" stdev="17.42" mindiff="1.46" local_density="2.74" obsval="-105.82"/>
		<mog-torsion-outlier atoms="O10,C8,O7,C6" numobs="1497" mean="71.26" stdev="5.88" mindiff="1.83" local_density="0.07" obsval="-78.09"/>
		<mog-torsion-outlier atoms="C11,C8,O7,C6" numobs="1189" mean="71.53" stdev="5.43" mindiff="23.88" local_density="0.00" obsval="101.56"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="15585" mean="74.59" stdev="22.61" mindiff="0.00" local_density="1.61" obsval="-89.48"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="15585" mean="81.47" stdev="28.06" mindiff="0.00" local_density="4.38" obsval="-80.16"/>
		<mog-torsion-outlier atoms="C17,C18,C19,C20" numobs="15585" mean="80.37" stdev="27.23" mindiff="0.01" local_density="3.68" obsval="-81.63"/>
		<mog-torsion-outlier atoms="C18,C19,C20,C21" numobs="15585" mean="81.88" stdev="28.38" mindiff="0.01" local_density="4.61" obsval="-79.61"/>
		<mog-torsion-outlier atoms="C30,C31,C32,C33" numobs="4310" mean="35.83" stdev="32.38" mindiff="0.06" local_density="4.39" obsval="156.60"/>
		<mog-torsion-outlier atoms="C32,C33,C34,C35" numobs="15585" mean="103.77" stdev="37.14" mindiff="0.01" local_density="4.74" obsval="-53.97"/>
		<mog-torsion-outlier atoms="C33,C34,C35,C36" numobs="15585" mean="55.72" stdev="9.63" mindiff="0.11" local_density="0.75" obsval="115.84"/>
		<mog-torsion-outlier atoms="C34,C35,C36,C37" numobs="15585" mean="31.71" stdev="22.78" mindiff="0.00" local_density="3.01" obsval="-150.77"/>
		<mog-torsion-outlier atoms="C35,C36,C37,C38" numobs="15585" mean="105.64" stdev="37.24" mindiff="0.00" local_density="3.82" obsval="-52.06"/>
		<mog-torsion-outlier atoms="C36,C37,C38,C39" numobs="15585" mean="104.94" stdev="37.20" mindiff="0.01" local_density="4.20" obsval="-52.78"/>
		<mog-torsion-outlier atoms="C37,C38,C39,C40" numobs="15585" mean="82.21" stdev="28.64" mindiff="0.01" local_density="4.83" obsval="-79.16"/>
		<mog-torsion-outlier atoms="C38,C39,C40,C41" numobs="15585" mean="69.70" stdev="18.68" mindiff="0.00" local_density="1.04" obsval="96.22"/>
		<mog-torsion-outlier atoms="C39,C40,C41,C42" numobs="15585" mean="33.84" stdev="20.77" mindiff="0.03" local_density="2.27" obsval="147.56"/>
		<mog-torsion-outlier atoms="C3,O11,P1,O13" numobs="40" mean="58.48" stdev="16.03" mindiff="3.44" local_density="2.50" obsval="97.27"/>
		<mog-torsion-outlier atoms="C3,O11,P1,O14" numobs="40" mean="69.82" stdev="22.17" mindiff="28.08" local_density="0.00" obsval="-142.41"/>
		<mog-bond-outlier atoms="O4,C1" numobs="4622" mean="1.45" stdev="0.02" mindiff="0.00" Zscore="-2.10" obsval="1.40"/>
		<mog-bond-outlier atoms="O4,C30" numobs="4555" mean="1.33" stdev="0.03" mindiff="0.00" Zscore="2.41" obsval="1.40"/>
		<mog-bond-outlier atoms="O7,C6" numobs="2309" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="-2.67" obsval="1.40"/>
		<mog-bond-outlier atoms="O7,C8" numobs="1553" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="2.14" obsval="1.40"/>
		<mog-angle-outlier atoms="O7,C8,C11" numobs="587" mean="111.48" stdev="2.16" mindiff="0.01" Zscore="3.89" obsval="119.89"/>
		<mog-angle-outlier atoms="O4,C30,C31" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.12" Zscore="2.62" obsval="119.84"/>
		<clash atom="C24" dist="2.35" clashmag="0.56" cid="360"/>
		<clash atom="C23" dist="2.42" clashmag="0.49" cid="364"/>
		<clash atom="C26" dist="2.51" clashmag="0.41" cid="372"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6857" Q_score="0.414" mogul_rmsz_numbonds="36" mogul_rmsz_numangles="47" mogul_bonds_rmsz="0.44" mogul_angles_rmsz="0.77" num-H-reduce="46" model="1" chain="A" resnum="853" said="YD" ent="24" seq="." icode=" " resname="LMU" altcode=" ">
		<mog-torsion-outlier atoms="C4B,C5B,C6B,O6B" numobs="8417" mean="73.97" stdev="29.45" mindiff="0.12" local_density="0.63" obsval="-147.27"/>
		<mog-torsion-outlier atoms="O5B,C5B,C6B,O6B" numobs="8455" mean="28.75" stdev="9.62" mindiff="0.13" local_density="1.04" obsval="92.62"/>
		<mog-torsion-outlier atoms="C2',C1',O1',C1" numobs="332" mean="53.61" stdev="8.95" mindiff="4.67" local_density="0.30" obsval="-112.79"/>
		<mog-torsion-outlier atoms="O5',C1',O1',C1" numobs="448" mean="52.62" stdev="9.98" mindiff="5.60" local_density="0.22" obsval="124.29"/>
		<mog-torsion-outlier atoms="C4',C5',C6',O6'" numobs="8417" mean="73.00" stdev="27.92" mindiff="0.24" local_density="0.48" obsval="-145.40"/>
		<mog-torsion-outlier atoms="O5',C5',C6',O6'" numobs="8455" mean="28.78" stdev="9.62" mindiff="0.10" local_density="1.04" obsval="92.65"/>
		<mog-torsion-outlier atoms="O1',C1,C2,C3" numobs="10891" mean="96.23" stdev="54.93" mindiff="0.19" local_density="0.62" obsval="-18.21"/>
		<mog-angle-outlier atoms="C1B,O1B,C4'" numobs="8759" mean="117.98" stdev="2.37" mindiff="0.01" Zscore="-2.06" obsval="113.09"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9231" Q_score="0.591" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.34" mogul_angles_rmsz="1.73" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="854" said="ZD" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="48.27" stdev="20.79" mindiff="0.01" local_density="4.95" obsval="115.60"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="109.72" stdev="61.40" mindiff="0.88" local_density="4.20" obsval="-0.41"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="30.02" stdev="1.74" mindiff="4.18" local_density="0.08" obsval="-144.73"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="30.27" stdev="3.04" mindiff="0.08" local_density="0.35" obsval="35.61"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="59.78" stdev="15.95" mindiff="2.92" local_density="0.26" obsval="-103.48"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="74.64" stdev="20.64" mindiff="0.00" local_density="1.63" obsval="-89.79"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="48.23" stdev="27.18" mindiff="0.92" local_density="2.28" obsval="-142.59"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="40.74" stdev="21.01" mindiff="0.40" local_density="3.83" obsval="94.23"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="73.27" stdev="19.64" mindiff="0.02" local_density="1.46" obsval="91.58"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="73.56" stdev="53.62" mindiff="0.08" local_density="4.53" obsval="-42.16"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="5.81" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.87" obsval="1.98"/>
		<mog-bond-outlier atoms="CHC,C1C" numobs="3736" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.14" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.47" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.40" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.90" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.39" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.50" Zscore="9.11" obsval="110.83"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.69" Zscore="2.59" obsval="122.92"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.81" Zscore="-3.46" obsval="107.44"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.04" Zscore="-2.29" obsval="104.57"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.12" Zscore="-2.36" obsval="104.65"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.40" Zscore="-2.22" obsval="121.67"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.26" Zscore="2.18" obsval="112.28"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.09" Zscore="4.46" obsval="132.59"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.56" Zscore="2.17" obsval="137.03"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.57" Zscore="4.17" obsval="118.52"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.10" obsval="119.77"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.44" Zscore="2.84" obsval="119.05"/>
		<mog-angle-outlier atoms="C6,C5,C3" numobs="49" mean="113.47" stdev="2.44" mindiff="0.33" Zscore="-2.10" obsval="108.34"/>
		<clash atom="HBB1" dist="1.55" clashmag="0.88" cid="52"/>
		<clash atom="HBB1" dist="2.27" clashmag="0.62" cid="54"/>
		<clash atom="HMB1" dist="1.55" clashmag="0.88" cid="52"/>
		<clash atom="HMB1" dist="2.36" clashmag="0.47" cid="57"/>
		<clash atom="HBB2" dist="1.73" clashmag="0.69" cid="53"/>
		<clash atom="HBB2" dist="2.40" clashmag="0.49" cid="55"/>
		<clash atom="CMB" dist="2.27" clashmag="0.62" cid="54"/>
		<clash atom="H18" dist="1.96" clashmag="0.47" cid="56"/>
		<clash atom="CBB" dist="2.36" clashmag="0.47" cid="57"/>
		<clash atom="HAB" dist="2.15" clashmag="0.47" cid="58"/>
		<clash atom="O2A" dist="2.15" clashmag="0.47" cid="59"/>
		<clash atom="CGA" dist="2.44" clashmag="0.47" cid="60"/>
		<clash atom="CGA" dist="2.50" clashmag="0.42" cid="62"/>
		<clash atom="H3A" dist="2.44" clashmag="0.47" cid="60"/>
		<clash atom="C2" dist="2.45" clashmag="0.46" cid="61"/>
		<clash atom="HMA2" dist="2.45" clashmag="0.46" cid="61"/>
		<clash atom="HMD3" dist="2.01" clashmag="0.41" cid="63"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9538" Q_score="0.615" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.38" mogul_angles_rmsz="1.73" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="855" said="AE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="62.84" stdev="22.19" mindiff="1.55" local_density="1.93" obsval="-96.77"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="80.80" stdev="39.36" mindiff="4.65" local_density="0.70" obsval="-52.96"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="69.06" stdev="28.87" mindiff="2.31" local_density="2.52" obsval="67.30"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="68.23" stdev="24.77" mindiff="8.60" local_density="0.74" obsval="-110.75"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="52.46" stdev="1.81" mindiff="15.18" local_density="0.00" obsval="-122.28"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="52.84" stdev="2.91" mindiff="1.43" local_density="0.06" obsval="58.26"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="48.41" stdev="14.78" mindiff="0.35" local_density="0.07" obsval="132.55"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="90.34" stdev="45.79" mindiff="13.49" local_density="0.00" obsval="1.98"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="50.65" stdev="13.94" mindiff="1.20" local_density="1.14" obsval="-122.24"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="41.39" stdev="12.39" mindiff="0.41" local_density="0.75" obsval="-133.95"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="51.52" stdev="45.58" mindiff="0.02" local_density="4.13" obsval="40.99"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="78.57" stdev="54.06" mindiff="0.26" local_density="2.86" obsval="-36.74"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.26" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-4.24" obsval="1.97"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.68" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.35" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.83" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.07" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.02" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="2.80" Zscore="7.56" obsval="110.13"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.04" Zscore="-2.60" obsval="120.51"/>
		<mog-angle-outlier atoms="C2A,C1A,CHA" numobs="188" mean="123.87" stdev="1.74" mindiff="0.04" Zscore="2.06" obsval="127.43"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.21" obsval="118.58"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.28" Zscore="2.00" obsval="121.50"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.95" Zscore="-3.62" obsval="107.30"/>
		<mog-angle-outlier atoms="CBB,CAB,C3B" numobs="151" mean="127.53" stdev="5.00" mindiff="0.37" Zscore="-2.05" obsval="117.31"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.04" Zscore="2.66" obsval="112.77"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.35" Zscore="-2.66" obsval="104.18"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.38" Zscore="4.63" obsval="132.88"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.18" Zscore="2.53" obsval="137.77"/>
		<mog-angle-outlier atoms="OBD,CAD,C3D" numobs="108" mean="128.42" stdev="2.34" mindiff="0.21" Zscore="-2.28" obsval="123.09"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.10" Zscore="5.12" obsval="120.19"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.45" obsval="119.09"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.36" Zscore="2.82" obsval="118.97"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.52" Zscore="-2.14" obsval="122.69"/>
		<clash atom="CAD" dist="2.21" clashmag="0.70" cid="230"/>
		<clash atom="HAB" dist="2.30" clashmag="0.66" cid="231"/>
		<clash atom="HAB" dist="1.77" clashmag="0.48" cid="235"/>
		<clash atom="O1D" dist="2.10" clashmag="0.51" cid="234"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9692" Q_score="0.618" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.84" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="A" resnum="856" said="BE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="43.90" stdev="27.33" mindiff="1.40" local_density="5.00" obsval="101.50"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="44.13" stdev="29.30" mindiff="0.20" local_density="5.00" obsval="-77.95"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="81.66" stdev="2.01" mindiff="14.02" local_density="0.00" obsval="-93.07"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="82.01" stdev="3.13" mindiff="0.07" local_density="0.02" obsval="87.47"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="78.52" stdev="27.08" mindiff="1.44" local_density="1.94" obsval="-19.64"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="80.97" stdev="27.05" mindiff="0.15" local_density="2.03" obsval="161.10"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="40.31" stdev="13.12" mindiff="0.11" local_density="0.87" obsval="-135.41"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="74.32" stdev="20.41" mindiff="0.10" local_density="1.55" obsval="-90.21"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="45.24" stdev="14.63" mindiff="1.29" local_density="2.06" obsval="-105.11"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="49.44" stdev="18.79" mindiff="2.42" local_density="1.52" obsval="131.59"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.12" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.88" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.14" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.56" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.97" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.18" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.50" Zscore="9.09" obsval="110.83"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.56" Zscore="2.13" obsval="117.51"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.48" obsval="119.40"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.34" Zscore="-2.93" obsval="107.91"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.10" Zscore="2.19" obsval="112.28"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.35" Zscore="-2.67" obsval="104.18"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.89" Zscore="4.92" obsval="133.39"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.22" Zscore="2.34" obsval="137.37"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.10" Zscore="-2.15" obsval="120.27"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.90" Zscore="5.58" obsval="120.98"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.62" obsval="118.75"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.80" Zscore="2.94" obsval="119.41"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="2.25" Zscore="-3.20" obsval="120.96"/>
		<clash atom="HAB" dist="1.86" clashmag="0.58" cid="380"/>
		<clash atom="H111" dist="1.86" clashmag="0.58" cid="380"/>
		<clash atom="C1A" dist="2.98" clashmag="0.41" cid="382"/>
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		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
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		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="70.37" stdev="48.89" mindiff="14.10" local_density="0.00" obsval="-175.96"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="72.03" stdev="47.94" mindiff="20.26" local_density="0.00" obsval="3.56"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="51.12" stdev="14.17" mindiff="31.38" local_density="0.00" obsval="126.54"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="52.15" stdev="13.25" mindiff="34.14" local_density="0.00" obsval="-54.75"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="57.06" stdev="6.51" mindiff="4.62" local_density="0.13" obsval="116.72"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="76.77" stdev="2.98" mindiff="62.59" local_density="0.00" obsval="98.54"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="91.33" stdev="9.45" mindiff="29.47" local_density="0.00" obsval="-81.30"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="91.09" stdev="9.57" mindiff="26.57" local_density="0.00" obsval="98.45"/>
		<mog-torsion-outlier atoms="C18,C19,C20,C21" numobs="229" mean="160.32" stdev="25.44" mindiff="1.96" local_density="2.62" obsval="-10.37"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="3.85" obsval="1.44"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.01" Zscore="-5.21" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-3.93" obsval="1.31"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="5.90" obsval="1.50"/>
		<mog-angle-outlier atoms="C31,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="0.08" Zscore="-2.01" obsval="107.09"/>
		<mog-angle-outlier atoms="C3,C4,C5" numobs="188" mean="114.06" stdev="1.78" mindiff="0.74" Zscore="-3.38" obsval="108.03"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="1.70" Zscore="-4.52" obsval="116.60"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.14" Zscore="2.67" obsval="119.28"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="5.48" Zscore="-7.43" obsval="112.48"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="97" mean="121.56" stdev="2.30" mindiff="5.03" Zscore="4.57" obsval="132.09"/>
		<mog-angle-outlier atoms="C8,C7,C6" numobs="153" mean="127.00" stdev="2.67" mindiff="2.79" Zscore="4.11" obsval="137.97"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="1.34" Zscore="8.27" obsval="130.73"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="1.16" Zscore="-6.95" obsval="111.55"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="12.92" Zscore="11.24" obsval="143.05"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="34.56" Zscore="17.69" obsval="174.45"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="17.52" Zscore="8.28" obsval="149.07"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.68" Zscore="-3.50" obsval="113.50"/>
		<mog-angle-outlier atoms="C35,C13,C12" numobs="317" mean="118.09" stdev="1.53" mindiff="0.08" Zscore="2.22" obsval="121.48"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="16.71" Zscore="11.06" obsval="146.15"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.38" Zscore="3.22" obsval="124.08"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.13" Zscore="-3.05" obsval="117.87"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="27.57" Zscore="11.95" obsval="159.12"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="23.36" Zscore="13.82" obsval="163.26"/>
		<mog-angle-outlier atoms="C23,C22,C21" numobs="168" mean="119.01" stdev="1.57" mindiff="0.16" Zscore="3.08" obsval="123.86"/>
		<mog-angle-outlier atoms="C37,C22,C21" numobs="181" mean="122.82" stdev="1.62" mindiff="0.23" Zscore="-2.36" obsval="119.00"/>
		<mog-angle-outlier atoms="C24,C25,C26" numobs="97" mean="121.56" stdev="2.30" mindiff="2.28" Zscore="-3.13" obsval="114.36"/>
		<mog-angle-outlier atoms="C30,C25,C24" numobs="118" mean="115.65" stdev="2.71" mindiff="4.02" Zscore="3.81" obsval="125.98"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="0.12" Zscore="-2.18" obsval="119.66"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="99" mean="122.70" stdev="1.35" mindiff="1.68" Zscore="-4.51" obsval="116.61"/>
		<mog-angle-outlier atoms="C38,C26,C27" numobs="379" mean="113.60" stdev="2.13" mindiff="0.05" Zscore="2.14" obsval="118.16"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="188" mean="114.06" stdev="1.78" mindiff="5.50" Zscore="-6.88" obsval="101.78"/>
		<clash atom="H343" dist="2.26" clashmag="0.66" cid="290"/>
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		<clash atom="H322" dist="1.89" clashmag="0.55" cid="295"/>
		<clash atom="H393" dist="2.42" clashmag="0.49" cid="297"/>
		<clash atom="H313" dist="1.95" clashmag="0.47" cid="299"/>
		<clash atom="C11" dist="2.45" clashmag="0.46" cid="300"/>
	</ModelledSubgroup>
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		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="50.96" stdev="20.12" mindiff="0.04" local_density="4.89" obsval="109.67"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="17.02" stdev="4.36" mindiff="0.02" local_density="4.74" obsval="22.72"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="37.60" stdev="12.50" mindiff="1.77" local_density="3.51" obsval="130.28"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="99.91" stdev="2.01" mindiff="32.28" local_density="0.00" obsval="-74.82"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="99.92" stdev="3.46" mindiff="2.15" local_density="0.02" obsval="105.41"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="94.50" stdev="49.65" mindiff="0.44" local_density="4.19" obsval="-45.53"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="41.58" stdev="19.60" mindiff="0.28" local_density="2.95" obsval="-96.32"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="48.41" stdev="25.73" mindiff="0.84" local_density="2.28" obsval="140.83"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="49.78" stdev="17.05" mindiff="2.94" local_density="1.52" obsval="-128.88"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="46.77" stdev="13.20" mindiff="0.81" local_density="1.77" obsval="108.60"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="52.18" stdev="45.59" mindiff="0.32" local_density="3.83" obsval="-40.32"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="59.24" stdev="10.34" mindiff="0.86" local_density="0.54" obsval="110.06"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.14" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-4.08" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.09" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.66" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.04" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.24" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.46" Zscore="9.01" obsval="110.79"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.23" Zscore="-2.19" obsval="121.43"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.55" obsval="119.61"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.88" Zscore="-3.53" obsval="107.38"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.10" Zscore="-2.24" obsval="104.63"/>
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		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.23" Zscore="2.22" obsval="112.33"/>
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		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.53" Zscore="4.80" obsval="119.62"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.19" obsval="119.59"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="3.19" Zscore="2.52" obsval="117.80"/>
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		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="55.11" stdev="11.36" mindiff="1.28" local_density="0.78" obsval="124.81"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="75.47" stdev="6.04" mindiff="0.60" local_density="0.12" obsval="-98.02"/>
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		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="52.26" stdev="14.46" mindiff="0.14" local_density="1.14" obsval="-111.24"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="32.54" stdev="18.97" mindiff="0.13" local_density="2.17" obsval="145.96"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="52.33" stdev="45.59" mindiff="0.47" local_density="3.54" obsval="40.17"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.26" obsval="2.21"/>
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		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.02" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.69" Zscore="9.52" obsval="111.02"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.41" Zscore="3.01" obsval="119.87"/>
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		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.09" Zscore="-2.41" obsval="104.44"/>
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		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.48" Zscore="5.25" obsval="133.97"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.30" Zscore="-2.17" obsval="122.71"/>
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		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.92" Zscore="5.02" obsval="120.01"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.45" obsval="119.09"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.67" Zscore="2.90" obsval="119.28"/>
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		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.94" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.21" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.27" Zscore="8.60" obsval="110.60"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.12" Zscore="-2.35" obsval="121.08"/>
		<mog-angle-outlier atoms="C2A,C1A,CHA" numobs="188" mean="123.87" stdev="1.74" mindiff="0.05" Zscore="2.06" obsval="127.44"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.15" Zscore="2.60" obsval="119.78"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.34" Zscore="2.03" obsval="121.55"/>
		<mog-angle-outlier atoms="CMB,C2B,C1B" numobs="569" mean="125.42" stdev="1.52" mindiff="0.01" Zscore="2.01" obsval="128.48"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.85" Zscore="-3.50" obsval="107.41"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.16" Zscore="2.44" obsval="112.55"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.02" Zscore="-2.35" obsval="104.50"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.09" Zscore="2.01" obsval="112.11"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.62" Zscore="-2.02" obsval="103.08"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.42" Zscore="5.22" obsval="133.91"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.01" Zscore="-2.04" obsval="123.00"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.02" Zscore="2.45" obsval="137.61"/>
		<mog-angle-outlier atoms="OBD,CAD,C3D" numobs="108" mean="128.42" stdev="2.34" mindiff="0.20" Zscore="-2.44" obsval="122.72"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.79" Zscore="3.72" obsval="117.73"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.23" Zscore="3.31" obsval="120.84"/>
		<clash atom="HAB" dist="2.24" clashmag="0.73" cid="27"/>
		<clash atom="HAB" dist="1.75" clashmag="0.50" cid="33"/>
		<clash atom="H142" dist="1.82" clashmag="0.61" cid="29"/>
		<clash atom="OBD" dist="2.05" clashmag="0.56" cid="32"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9692" Q_score="0.594" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.89" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="804" said="GE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="39.62" stdev="20.82" mindiff="0.30" local_density="1.61" obsval="-142.74"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="115.59" stdev="48.62" mindiff="0.08" local_density="3.20" obsval="-17.73"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="77.03" stdev="6.13" mindiff="2.18" local_density="0.12" obsval="-96.44"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="77.88" stdev="6.52" mindiff="1.77" local_density="0.13" obsval="84.51"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="82.81" stdev="2.01" mindiff="15.18" local_density="0.00" obsval="-91.92"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="81.49" stdev="3.13" mindiff="0.45" local_density="0.02" obsval="86.95"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="157.09" stdev="35.47" mindiff="3.28" local_density="0.03" obsval="1.54"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="85.51" stdev="28.11" mindiff="0.01" local_density="4.85" obsval="75.89"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="36.08" stdev="16.19" mindiff="0.30" local_density="1.30" obsval="141.14"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="5.96" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-4.01" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.06" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.60" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.33" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.22" obsval="1.32"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="4.08" Zscore="10.36" obsval="111.41"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.15" Zscore="2.33" obsval="118.94"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.38" Zscore="2.80" obsval="123.43"/>
		<mog-angle-outlier atoms="CMB,C2B,C1B" numobs="569" mean="125.42" stdev="1.52" mindiff="0.08" Zscore="2.26" obsval="128.86"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.22" Zscore="-2.22" obsval="108.55"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.00" Zscore="2.62" obsval="112.74"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.33" Zscore="-2.65" obsval="104.19"/>
		<mog-angle-outlier atoms="CBC,CAC,C3C" numobs="10971" mean="112.42" stdev="2.71" mindiff="0.00" Zscore="-2.21" obsval="106.43"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.10" Zscore="-2.04" obsval="104.88"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.09" Zscore="2.01" obsval="112.11"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.68" Zscore="4.80" obsval="133.17"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.05" Zscore="2.42" obsval="137.54"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.29" Zscore="4.66" obsval="119.38"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.12" obsval="119.71"/>
		<mog-angle-outlier atoms="C6,C5,C3" numobs="49" mean="113.47" stdev="2.44" mindiff="0.84" Zscore="-3.14" obsval="105.81"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="155" mean="113.26" stdev="2.67" mindiff="0.94" Zscore="2.15" obsval="119.00"/>
		<clash atom="HMB2" dist="2.21" clashmag="0.70" cid="230"/>
		<clash atom="HMA2" dist="2.36" clashmag="0.60" cid="232"/>
		<clash atom="HED3" dist="1.88" clashmag="0.55" cid="233"/>
		<clash atom="HBB1" dist="2.10" clashmag="0.51" cid="234"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7538" Q_score="0.481" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.84" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="805" said="HE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="94.98" stdev="6.83" mindiff="4.20" local_density="0.08" obsval="78.43"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="95.03" stdev="6.83" mindiff="4.83" local_density="0.02" obsval="-101.69"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="36.75" stdev="15.06" mindiff="1.12" local_density="4.91" obsval="138.09"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="58.75" stdev="42.93" mindiff="2.67" local_density="4.44" obsval="-47.73"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="95.74" stdev="37.60" mindiff="16.74" local_density="0.00" obsval="-161.74"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="94.81" stdev="39.49" mindiff="19.21" local_density="0.00" obsval="18.44"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="26.10" stdev="1.71" mindiff="1.16" local_density="0.15" obsval="-148.65"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="26.21" stdev="3.05" mindiff="0.43" local_density="0.49" obsval="31.53"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="34.67" stdev="16.35" mindiff="0.33" local_density="3.39" obsval="102.26"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="40.48" stdev="32.34" mindiff="0.02" local_density="3.16" obsval="-153.02"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="52.21" stdev="45.59" mindiff="0.35" local_density="3.83" obsval="40.28"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="48.83" stdev="12.33" mindiff="3.34" local_density="1.47" obsval="-113.28"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="50.78" stdev="13.68" mindiff="0.31" local_density="1.14" obsval="121.36"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="68.49" stdev="16.21" mindiff="0.21" local_density="0.86" obsval="97.83"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="30.78" stdev="20.38" mindiff="0.03" local_density="3.43" obsval="-148.41"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.24" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.84" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.06" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.29" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.04" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.11" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.50" Zscore="9.09" obsval="110.83"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.64" Zscore="2.55" obsval="118.64"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.25" obsval="118.69"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.50" Zscore="-3.12" obsval="107.75"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.02" Zscore="2.31" obsval="112.41"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.12" Zscore="-2.45" obsval="104.41"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.13" Zscore="-2.00" obsval="104.91"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.64" Zscore="5.34" obsval="134.14"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.32" Zscore="-2.18" obsval="122.70"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.12" Zscore="2.39" obsval="137.47"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.22" Zscore="-2.40" obsval="119.78"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.42" Zscore="5.85" obsval="121.46"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.61" obsval="118.76"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="3.23" Zscore="2.53" obsval="117.84"/>
		<clash atom="HBC2" dist="1.99" clashmag="0.43" cid="265"/>
		<clash atom="CBC" dist="2.51" clashmag="0.40" cid="271"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9846" Q_score="0.622" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.82" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="806" said="IE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="54.65" stdev="10.20" mindiff="0.45" local_density="1.11" obsval="122.08"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="69.37" stdev="29.20" mindiff="34.73" local_density="0.00" obsval="7.34"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="49.75" stdev="5.02" mindiff="0.32" local_density="0.23" obsval="-123.92"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="50.72" stdev="5.57" mindiff="0.49" local_density="0.42" obsval="57.21"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="83.07" stdev="37.60" mindiff="4.07" local_density="2.50" obsval="-149.07"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="81.22" stdev="39.49" mindiff="5.62" local_density="2.50" obsval="32.03"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="57.80" stdev="20.32" mindiff="3.05" local_density="2.65" obsval="-133.02"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="53.48" stdev="18.78" mindiff="3.12" local_density="2.66" obsval="103.48"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="47.63" stdev="32.98" mindiff="0.59" local_density="4.56" obsval="-149.49"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="41.24" stdev="20.16" mindiff="0.30" local_density="2.95" obsval="-95.49"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.43" stdev="25.56" mindiff="1.05" local_density="2.28" obsval="140.62"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="35.67" stdev="16.51" mindiff="0.18" local_density="1.45" obsval="141.70"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.23" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.85" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.07" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.57" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.40" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.92" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.15" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.00" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.34" Zscore="8.74" obsval="110.67"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.12" Zscore="-2.04" obsval="121.77"/>
		<mog-angle-outlier atoms="CBA,CAA,C2A" numobs="171" mean="113.79" stdev="2.98" mindiff="0.72" Zscore="2.13" obsval="120.13"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.00" Zscore="2.38" obsval="119.09"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.01" Zscore="-2.54" obsval="108.26"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.13" Zscore="2.41" obsval="112.52"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.32" Zscore="-2.63" obsval="104.21"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="2.04" Zscore="5.57" obsval="134.54"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.14" Zscore="-2.40" obsval="122.19"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.07" Zscore="2.48" obsval="137.66"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.07" Zscore="-2.14" obsval="120.30"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.88" Zscore="5.59" obsval="121.00"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.65" obsval="118.69"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="2.62" Zscore="2.37" obsval="117.23"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8923" Q_score="0.591" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.34" mogul_angles_rmsz="1.80" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="807" said="JE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="46.74" stdev="11.08" mindiff="4.55" local_density="0.11" obsval="128.48"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="93.25" stdev="6.79" mindiff="2.47" local_density="0.12" obsval="80.16"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="93.39" stdev="6.81" mindiff="3.19" local_density="0.04" obsval="-100.05"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="72.14" stdev="38.55" mindiff="3.61" local_density="4.20" obsval="56.09"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="70.27" stdev="35.44" mindiff="3.73" local_density="1.48" obsval="-123.09"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="63.86" stdev="1.93" mindiff="3.77" local_density="0.02" obsval="-110.87"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="63.77" stdev="2.93" mindiff="1.68" local_density="0.04" obsval="69.20"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="36.42" stdev="16.70" mindiff="0.12" local_density="4.56" obsval="72.91"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="38.67" stdev="15.05" mindiff="0.10" local_density="3.39" obsval="-107.80"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="41.05" stdev="31.02" mindiff="0.04" local_density="2.21" obsval="-151.53"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="85.48" stdev="51.79" mindiff="2.68" local_density="3.04" obsval="-39.86"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="52.73" stdev="14.18" mindiff="0.43" local_density="1.47" obsval="-122.07"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="51.74" stdev="13.52" mindiff="0.44" local_density="1.14" obsval="114.60"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="77.43" stdev="53.95" mindiff="0.05" local_density="3.03" obsval="-37.98"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.05" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.84" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.68" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.08" obsval="1.33"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.56" Zscore="9.23" obsval="110.89"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.15" Zscore="2.43" obsval="119.24"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.21" Zscore="-2.79" obsval="108.04"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.13" Zscore="2.41" obsval="112.51"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.29" Zscore="-2.74" obsval="104.09"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.09" Zscore="-2.31" obsval="104.69"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.13" Zscore="2.06" obsval="112.16"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.38" Zscore="5.20" obsval="133.88"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.17" Zscore="-2.11" obsval="122.84"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.22" Zscore="2.33" obsval="137.37"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.07" Zscore="5.11" obsval="120.16"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.43" obsval="119.12"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.11" Zscore="3.02" obsval="119.72"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9692" Q_score="0.591" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.89" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="808" said="KE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="62.15" stdev="13.12" mindiff="24.12" local_density="0.00" obsval="93.86"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="64.25" stdev="13.91" mindiff="26.59" local_density="0.00" obsval="-85.15"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="109.63" stdev="37.60" mindiff="30.63" local_density="0.00" obsval="-175.63"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="109.38" stdev="39.49" mindiff="33.78" local_density="0.00" obsval="3.87"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="27.35" stdev="1.72" mindiff="2.42" local_density="0.08" obsval="-147.40"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="26.79" stdev="3.04" mindiff="0.16" local_density="0.48" obsval="32.11"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="42.52" stdev="15.83" mindiff="0.42" local_density="3.50" obsval="64.58"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="43.96" stdev="14.34" mindiff="0.08" local_density="3.10" obsval="-114.94"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="52.89" stdev="7.90" mindiff="3.88" local_density="0.07" obsval="-121.08"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="75.41" stdev="45.77" mindiff="1.45" local_density="0.29" obsval="16.92"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="52.59" stdev="15.41" mindiff="2.01" local_density="1.14" obsval="-109.09"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="30.03" stdev="20.99" mindiff="0.06" local_density="3.90" obsval="149.45"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.04" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.94" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.07" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.67" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.33" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.20" obsval="1.32"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.02" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.66" Zscore="9.46" obsval="111.00"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.90" Zscore="2.26" obsval="117.85"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.09" Zscore="2.63" obsval="119.86"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.27" Zscore="-2.85" obsval="107.99"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.16" Zscore="2.47" obsval="112.58"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.14" Zscore="-2.46" obsval="104.39"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.41" Zscore="5.21" obsval="133.91"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.31" Zscore="-2.17" obsval="122.70"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.06" Zscore="2.41" obsval="137.53"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.03" Zscore="-2.28" obsval="120.02"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.66" Zscore="5.72" obsval="121.22"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.62" obsval="118.75"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.28" Zscore="3.06" obsval="119.88"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="2.12" Zscore="-3.12" obsval="121.09"/>
		<clash atom="C1A" dist="2.84" clashmag="0.55" cid="253"/>
		<clash atom="CGA" dist="2.84" clashmag="0.55" cid="253"/>
		<clash atom="HAB" dist="1.88" clashmag="0.55" cid="254"/>
		<clash atom="HAB" dist="2.43" clashmag="0.48" cid="259"/>
		<clash atom="H202" dist="2.02" clashmag="0.41" cid="270"/>
		<clash atom="HAC1" dist="2.02" clashmag="0.40" cid="272"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8000" Q_score="0.571" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.97" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="B" resnum="809" said="LE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="51.91" stdev="13.88" mindiff="5.28" local_density="1.11" obsval="127.80"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="60.68" stdev="29.20" mindiff="26.05" local_density="0.00" obsval="16.02"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="53.75" stdev="10.48" mindiff="0.81" local_density="0.43" obsval="114.52"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="52.30" stdev="20.25" mindiff="0.03" local_density="4.50" obsval="106.77"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="90.56" stdev="6.73" mindiff="0.22" local_density="0.12" obsval="82.86"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="90.94" stdev="6.78" mindiff="0.74" local_density="0.04" obsval="-97.60"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="68.91" stdev="39.23" mindiff="2.17" local_density="2.81" obsval="-64.93"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="36.15" stdev="1.74" mindiff="1.95" local_density="0.02" obsval="-138.60"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="36.00" stdev="2.96" mindiff="0.58" local_density="0.19" obsval="41.37"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="59.43" stdev="15.24" mindiff="2.03" local_density="0.18" obsval="104.37"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="37.83" stdev="14.88" mindiff="0.07" local_density="1.04" obsval="138.78"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="40.76" stdev="20.97" mindiff="0.45" local_density="3.83" obsval="-94.28"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="48.09" stdev="28.37" mindiff="2.35" local_density="1.90" obsval="144.02"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="80.91" stdev="25.05" mindiff="0.08" local_density="3.24" obsval="-81.72"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="38.98" stdev="14.04" mindiff="0.34" local_density="0.98" obsval="-137.22"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.22" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.86" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.06" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.53" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.41" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.09" obsval="1.33"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="4.00" Zscore="10.21" obsval="111.33"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.02" Zscore="-2.10" obsval="121.64"/>
		<mog-angle-outlier atoms="C2A,C3A,C4A" numobs="26" mean="101.87" stdev="1.62" mindiff="0.62" Zscore="2.26" obsval="105.52"/>
		<mog-angle-outlier atoms="CMA,C3A,C2A" numobs="98" mean="113.98" stdev="3.87" mindiff="1.52" Zscore="3.24" obsval="126.52"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="5.65" Zscore="5.27" obsval="125.94"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.09" Zscore="2.35" obsval="118.99"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.29" Zscore="2.18" obsval="121.94"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.06" Zscore="-2.39" obsval="108.39"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.16" Zscore="2.44" obsval="112.54"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.19" Zscore="-2.51" obsval="104.34"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.08" Zscore="-2.08" obsval="104.85"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.09" Zscore="-2.00" obsval="121.99"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.47" Zscore="5.25" obsval="133.97"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.19" Zscore="-2.12" obsval="122.82"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.28" Zscore="2.31" obsval="137.31"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.58" Zscore="4.83" obsval="119.67"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.35" obsval="119.28"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.78" Zscore="3.19" obsval="120.39"/>
		<clash atom="HAA1" dist="1.88" clashmag="0.55" cid="254"/>
		<clash atom="CAA" dist="2.43" clashmag="0.48" cid="259"/>
		<clash atom="HBB2" dist="2.00" clashmag="0.44" cid="264"/>
		<clash atom="H43" dist="2.00" clashmag="0.43" cid="266"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8462" Q_score="0.521" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.80" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="810" said="ME" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="109.00" stdev="51.64" mindiff="0.17" local_density="1.11" obsval="33.66"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="65.14" stdev="5.55" mindiff="5.49" local_density="0.15" obsval="-108.41"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="64.32" stdev="6.06" mindiff="0.21" local_density="0.22" obsval="70.90"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="30.58" stdev="1.74" mindiff="3.62" local_density="0.08" obsval="-144.17"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="30.44" stdev="3.04" mindiff="0.25" local_density="0.33" obsval="35.78"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="59.24" stdev="10.34" mindiff="0.87" local_density="0.54" obsval="110.07"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="50.01" stdev="8.44" mindiff="0.36" local_density="0.44" obsval="-122.38"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="69.77" stdev="17.13" mindiff="0.63" local_density="1.05" obsval="-96.15"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="39.87" stdev="22.52" mindiff="0.95" local_density="4.42" obsval="-92.00"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="47.98" stdev="29.23" mindiff="3.35" local_density="2.28" obsval="145.03"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="29.72" stdev="21.25" mindiff="0.10" local_density="4.19" obsval="-149.88"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.18" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.86" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.59" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.08" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.04" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.34" Zscore="8.75" obsval="110.67"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="2.09" Zscore="2.33" obsval="118.04"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.08" Zscore="2.17" obsval="118.45"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.21" Zscore="-2.79" obsval="108.04"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.02" Zscore="2.60" obsval="112.71"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.28" Zscore="-2.76" obsval="104.08"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.06" Zscore="-2.10" obsval="104.84"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.32" Zscore="5.16" obsval="133.82"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.23" Zscore="-2.14" obsval="122.78"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.31" Zscore="2.29" obsval="137.28"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.20" Zscore="5.19" obsval="120.30"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.47" obsval="119.04"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.47" Zscore="3.37" obsval="121.08"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.12" Zscore="-2.51" obsval="122.09"/>
		<clash atom="HBC1" dist="1.93" clashmag="0.49" cid="490"/>
		<clash atom="CMB" dist="2.51" clashmag="0.41" cid="491"/>
		<clash atom="HBB1" dist="2.51" clashmag="0.41" cid="491"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7538" Q_score="0.465" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.78" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="811" said="NE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="39.73" stdev="34.86" mindiff="2.97" local_density="3.33" obsval="-153.92"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="29.85" stdev="15.88" mindiff="1.47" local_density="3.88" obsval="93.75"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="37.90" stdev="23.53" mindiff="0.09" local_density="2.89" obsval="-146.22"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="57.27" stdev="22.94" mindiff="0.12" local_density="4.80" obsval="-83.53"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="57.65" stdev="22.30" mindiff="0.07" local_density="4.30" obsval="96.05"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="99.56" stdev="6.96" mindiff="8.80" local_density="0.04" obsval="-73.83"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="99.06" stdev="6.89" mindiff="8.88" local_density="0.02" obsval="105.74"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="32.95" stdev="18.65" mindiff="0.01" local_density="2.08" obsval="145.39"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.23" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.89" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.25" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.19" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.04" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.04" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.31" Zscore="8.69" obsval="110.64"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.08" Zscore="3.14" obsval="120.20"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.02" obsval="118.01"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.43" Zscore="-3.03" obsval="107.83"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.00" Zscore="2.29" obsval="112.38"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.12" Zscore="-2.22" obsval="104.65"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.13" Zscore="-2.01" obsval="104.90"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.13" Zscore="-2.03" obsval="121.94"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.83" Zscore="5.45" obsval="134.32"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.17" Zscore="-2.38" obsval="122.22"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.17" Zscore="2.36" obsval="137.42"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.40" Zscore="4.27" obsval="118.69"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.05" obsval="119.85"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.85" Zscore="3.21" obsval="120.46"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="2.03" Zscore="-3.06" obsval="121.18"/>
		<clash atom="HHC" dist="1.51" clashmag="0.92" cid="15"/>
		<clash atom="HHC" dist="2.30" clashmag="0.57" cid="19"/>
		<clash atom="HBB1" dist="1.51" clashmag="0.92" cid="15"/>
		<clash atom="H143" dist="1.83" clashmag="0.59" cid="17"/>
		<clash atom="CBB" dist="2.30" clashmag="0.57" cid="19"/>
		<clash atom="H141" dist="1.94" clashmag="0.49" cid="20"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9538" Q_score="0.596" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.86" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="812" said="OE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="40.09" stdev="34.19" mindiff="3.75" local_density="3.33" obsval="-153.13"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="30.57" stdev="15.50" mindiff="0.57" local_density="3.10" obsval="94.65"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="121.70" stdev="54.69" mindiff="0.00" local_density="4.05" obsval="-176.67"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="128.88" stdev="49.63" mindiff="0.02" local_density="1.84" obsval="4.01"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="24.53" stdev="4.57" mindiff="0.67" local_density="1.50" obsval="-149.54"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="25.12" stdev="4.35" mindiff="0.05" local_density="1.94" obsval="31.16"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="40" mean="82.74" stdev="36.09" mindiff="2.49" local_density="2.50" obsval="147.49"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O2D" numobs="41" mean="79.77" stdev="38.71" mindiff="4.37" local_density="2.44" obsval="-33.27"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="25.87" stdev="1.71" mindiff="0.93" local_density="0.15" obsval="-148.88"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="25.06" stdev="3.06" mindiff="0.21" local_density="0.58" obsval="30.37"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="35.84" stdev="15.94" mindiff="0.14" local_density="3.59" obsval="103.93"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="56.44" stdev="9.81" mindiff="5.19" local_density="0.07" obsval="-112.01"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="46.33" stdev="13.56" mindiff="1.03" local_density="1.77" obsval="-107.58"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="49.96" stdev="16.21" mindiff="1.47" local_density="1.52" obsval="127.42"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="39.54" stdev="13.65" mindiff="0.18" local_density="0.93" obsval="-136.46"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="56.07" stdev="45.63" mindiff="0.04" local_density="2.36" obsval="36.38"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="47.95" stdev="29.53" mindiff="3.25" local_density="2.66" obsval="-145.38"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="73.31" stdev="19.67" mindiff="0.03" local_density="1.45" obsval="-91.53"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.27" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.98" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.15" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.72" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.23" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.05" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.61" Zscore="9.33" obsval="110.94"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.03" Zscore="-2.10" obsval="121.62"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.96" Zscore="2.81" obsval="119.33"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.10" Zscore="3.31" obsval="121.94"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.07" Zscore="-2.62" obsval="108.19"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.11" Zscore="2.72" obsval="112.84"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.03" Zscore="-2.36" obsval="104.50"/>
		<mog-angle-outlier atoms="CAC,C3C,C4C" numobs="5400" mean="124.79" stdev="1.30" mindiff="0.00" Zscore="2.18" obsval="127.62"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.21" Zscore="2.13" obsval="112.23"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.65" Zscore="-2.03" obsval="103.05"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.64" Zscore="4.78" obsval="133.14"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.20" Zscore="2.35" obsval="137.39"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.10" Zscore="5.12" obsval="120.19"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.42" obsval="119.13"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.20" Zscore="3.04" obsval="119.81"/>
		<mog-angle-outlier atoms="C16,C15,C13" numobs="177" mean="115.97" stdev="3.32" mindiff="0.04" Zscore="-2.24" obsval="108.51"/>
		<clash atom="HHB" dist="1.76" clashmag="0.67" cid="280"/>
		<clash atom="H12" dist="1.83" clashmag="0.60" cid="281"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7538" Q_score="0.521" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.81" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="813" said="PE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="109.49" stdev="7.23" mindiff="0.51" local_density="0.08" obsval="-63.88"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="109.95" stdev="7.07" mindiff="0.93" local_density="0.04" obsval="116.63"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="38.24" stdev="13.06" mindiff="0.00" local_density="4.21" obsval="125.06"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="40" mean="66.02" stdev="34.70" mindiff="3.36" local_density="5.00" obsval="130.03"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="46.90" stdev="1.77" mindiff="12.71" local_density="0.00" obsval="-127.84"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="46.99" stdev="2.92" mindiff="1.98" local_density="0.07" obsval="52.39"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="59.10" stdev="32.60" mindiff="8.32" local_density="0.10" obsval="-154.96"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="56.77" stdev="32.52" mindiff="10.12" local_density="0.00" obsval="25.56"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="58.01" stdev="12.46" mindiff="1.60" local_density="0.15" obsval="-108.00"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="47.61" stdev="33.16" mindiff="0.79" local_density="4.18" obsval="-149.69"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="38.40" stdev="25.28" mindiff="0.25" local_density="4.72" obsval="88.19"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="37.75" stdev="14.93" mindiff="0.18" local_density="1.05" obsval="138.88"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="56.02" stdev="39.61" mindiff="0.33" local_density="4.88" obsval="154.34"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.18" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.90" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.64" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.34" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.01" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.02" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.01" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.30" Zscore="8.66" obsval="110.63"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.08" Zscore="2.53" obsval="119.55"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.47" Zscore="2.08" obsval="121.69"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.12" Zscore="-2.69" obsval="108.13"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.11" Zscore="2.51" obsval="112.62"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.18" Zscore="-2.50" obsval="104.35"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.22" Zscore="5.10" obsval="133.72"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.31" Zscore="-2.18" obsval="122.70"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.18" Zscore="2.35" obsval="137.41"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.09" Zscore="-2.25" obsval="120.08"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.61" Zscore="5.74" obsval="121.27"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.03" Zscore="-2.67" obsval="118.65"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.03" Zscore="2.74" obsval="118.63"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.99" Zscore="-2.43" obsval="122.22"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7231" Q_score="0.494" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.81" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="814" said="QE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="121.70" stdev="51.64" mindiff="12.87" local_density="0.00" obsval="20.97"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="31.83" stdev="14.83" mindiff="0.98" local_density="1.55" obsval="-96.20"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="105.91" stdev="7.14" mindiff="4.09" local_density="0.08" obsval="-67.47"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="104.74" stdev="6.99" mindiff="6.14" local_density="0.04" obsval="111.42"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="90.43" stdev="39.47" mindiff="5.04" local_density="0.35" obsval="-43.28"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="71.44" stdev="41.22" mindiff="1.59" local_density="3.70" obsval="-129.59"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="54.35" stdev="1.83" mindiff="13.29" local_density="0.00" obsval="-120.39"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="54.53" stdev="2.91" mindiff="0.11" local_density="0.06" obsval="59.95"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="79.86" stdev="24.37" mindiff="0.09" local_density="2.97" obsval="-83.05"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="46.42" stdev="13.48" mindiff="1.24" local_density="1.77" obsval="-107.80"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="49.66" stdev="17.61" mindiff="3.86" local_density="1.90" obsval="129.81"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="43.06" stdev="17.31" mindiff="0.73" local_density="2.65" obsval="-99.88"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.85" stdev="22.44" mindiff="1.88" local_density="1.52" obsval="136.61"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.28" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.86" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.05" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.49" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.12" obsval="1.33"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.00" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.46" Zscore="9.00" obsval="110.79"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.06" Zscore="-2.07" obsval="121.71"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.89" Zscore="2.46" obsval="118.39"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.06" Zscore="-2.61" obsval="108.20"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.09" Zscore="2.53" obsval="112.64"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.19" Zscore="-2.51" obsval="104.34"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.61" Zscore="5.32" obsval="134.10"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.47" Zscore="-2.24" obsval="122.55"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.15" Zscore="2.37" obsval="137.44"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.09" Zscore="5.12" obsval="120.18"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.53" obsval="118.92"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="3.84" Zscore="2.69" obsval="118.45"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.06" Zscore="2.65" obsval="127.13"/>
		<clash atom="C1C" dist="2.43" clashmag="0.47" cid="185"/>
		<clash atom="HBC1" dist="2.00" clashmag="0.44" cid="186"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9091" Q_score="0.578" mogul_rmsz_numbonds="59" mogul_rmsz_numangles="70" mogul_bonds_rmsz="1.47" mogul_angles_rmsz="1.90" ligand_chirality_outlier="yes" num-H-reduce="49" model="1" chain="B" resnum="815" said="RE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="41.04" stdev="18.63" mindiff="0.33" local_density="0.96" obsval="-139.88"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="111.01" stdev="7.25" mindiff="1.01" local_density="0.08" obsval="-62.36"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="112.35" stdev="7.08" mindiff="1.41" local_density="0.04" obsval="119.04"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="67.49" stdev="23.82" mindiff="8.35" local_density="0.84" obsval="73.35"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="67.40" stdev="20.51" mindiff="13.93" local_density="0.00" obsval="-105.43"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="50.84" stdev="1.80" mindiff="16.65" local_density="0.00" obsval="-123.90"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="50.12" stdev="2.92" mindiff="0.75" local_density="0.06" obsval="55.53"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="43.43" stdev="25.58" mindiff="0.14" local_density="0.92" obsval="-145.34"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="82.21" stdev="25.90" mindiff="0.03" local_density="3.63" obsval="-80.07"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="2276" mean="54.54" stdev="15.66" mindiff="0.03" local_density="0.66" obsval="125.32"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="2276" mean="112.37" stdev="55.64" mindiff="0.96" local_density="0.92" obsval="1.83"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.26" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.95" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.13" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.52" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.05" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.27" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.31" Zscore="8.69" obsval="110.64"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.08" Zscore="2.58" obsval="119.70"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.66" Zscore="2.58" obsval="122.89"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.52" Zscore="-3.14" obsval="107.73"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.08" Zscore="2.21" obsval="112.30"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.12" Zscore="-2.45" obsval="104.41"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.09" Zscore="-2.06" obsval="104.87"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.18" Zscore="2.10" obsval="112.20"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.77" Zscore="4.85" obsval="133.27"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.18" Zscore="2.36" obsval="137.41"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.74" Zscore="4.92" obsval="119.83"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.41" obsval="119.16"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.64" Zscore="2.89" obsval="119.24"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.58" Zscore="-2.79" obsval="121.63"/>
		<clash atom="C1D" dist="2.37" clashmag="0.55" cid="309"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9077" Q_score="0.554" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.81" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="816" said="SE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="58.28" stdev="15.70" mindiff="2.37" local_density="0.64" obsval="105.62"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="108.22" stdev="7.22" mindiff="1.78" local_density="0.08" obsval="65.16"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="108.10" stdev="7.05" mindiff="2.78" local_density="0.04" obsval="-114.78"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="64.22" stdev="15.24" mindiff="20.91" local_density="0.00" obsval="85.91"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="65.39" stdev="13.54" mindiff="26.84" local_density="0.00" obsval="-92.52"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="22.60" stdev="1.70" mindiff="0.98" local_density="0.23" obsval="-152.15"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="22.56" stdev="3.10" mindiff="0.03" local_density="0.74" obsval="27.85"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="56.88" stdev="9.27" mindiff="0.21" local_density="0.44" obsval="113.20"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="55.09" stdev="16.78" mindiff="1.20" local_density="1.18" obsval="-127.24"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="52.57" stdev="15.34" mindiff="1.87" local_density="1.14" obsval="109.23"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="49.67" stdev="17.55" mindiff="3.77" local_density="1.90" obsval="-129.71"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="46.40" stdev="13.49" mindiff="1.20" local_density="1.77" obsval="107.75"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="82.89" stdev="26.35" mindiff="0.06" local_density="3.90" obsval="79.22"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.29" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.99" obsval="1.97"/>
		<mog-bond-outlier atoms="CHD,C1D" numobs="3707" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.10" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.76" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.31" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.12" obsval="1.33"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.09" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="2.94" Zscore="7.88" obsval="110.27"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.14" Zscore="-2.23" obsval="121.33"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.58" Zscore="2.14" obsval="117.54"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.13" Zscore="2.62" obsval="119.83"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.23" Zscore="-2.81" obsval="108.02"/>
		<mog-angle-outlier atoms="CBB,CAB,C3B" numobs="151" mean="127.53" stdev="5.00" mindiff="0.40" Zscore="-2.05" obsval="117.27"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.11" Zscore="2.72" obsval="112.84"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.26" Zscore="-2.58" obsval="104.27"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.99" Zscore="5.54" obsval="134.49"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.02" Zscore="-2.45" obsval="122.07"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.09" Zscore="2.40" obsval="137.50"/>
		<mog-angle-outlier atoms="OBD,CAD,C3D" numobs="108" mean="128.42" stdev="2.34" mindiff="0.37" Zscore="-2.37" obsval="122.89"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.14" Zscore="-2.17" obsval="120.23"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.11" Zscore="5.46" obsval="120.77"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.49" obsval="118.99"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.77" Zscore="2.93" obsval="119.38"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.77" Zscore="-2.91" obsval="121.44"/>
		<clash atom="HBB1" dist="2.39" clashmag="0.57" cid="306"/>
		<clash atom="HBB2" dist="2.37" clashmag="0.55" cid="309"/>
		<clash atom="HBA2" dist="2.00" clashmag="0.43" cid="321"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9231" Q_score="0.611" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.77" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="817" said="TE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="65.52" stdev="14.40" mindiff="22.68" local_density="0.00" obsval="99.85"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="60.81" stdev="29.20" mindiff="26.17" local_density="0.00" obsval="-15.90"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="72.10" stdev="32.72" mindiff="4.74" local_density="0.19" obsval="168.02"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="69.36" stdev="32.62" mindiff="2.53" local_density="0.10" obsval="-12.91"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="37.74" stdev="14.94" mindiff="0.20" local_density="1.05" obsval="138.90"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="68.52" stdev="16.23" mindiff="0.24" local_density="0.86" obsval="-97.80"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.21" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.93" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.19" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.57" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.09" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.07" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.53" Zscore="9.17" obsval="110.86"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.03" Zscore="-2.08" obsval="121.69"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.08" obsval="118.16"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.13" Zscore="2.25" obsval="122.10"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.00" Zscore="-2.56" obsval="108.25"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.05" Zscore="2.57" obsval="112.69"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.34" Zscore="-2.66" obsval="104.19"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.10" Zscore="5.04" obsval="133.60"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.03" Zscore="2.43" obsval="137.56"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.27" Zscore="4.34" obsval="118.82"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.13" obsval="119.70"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.14" Zscore="2.76" obsval="118.75"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.87" Zscore="-2.35" obsval="122.34"/>
		<clash atom="HBB1" dist="1.63" clashmag="0.80" cid="149"/>
		<clash atom="HBB1" dist="2.39" clashmag="0.50" cid="150"/>
		<clash atom="HMB1" dist="1.63" clashmag="0.80" cid="149"/>
		<clash atom="CMB" dist="2.39" clashmag="0.50" cid="150"/>
		<clash atom="H61" dist="1.85" clashmag="0.40" cid="151"/>
		<clash atom="H41" dist="1.85" clashmag="0.40" cid="151"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8308" Q_score="0.552" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.91" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="818" said="UE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="43.63" stdev="14.87" mindiff="4.86" local_density="0.43" obsval="-134.69"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="135.13" stdev="7.45" mindiff="8.19" local_density="0.04" obsval="-38.23"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="135.88" stdev="7.19" mindiff="3.65" local_density="0.02" obsval="142.57"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="73.76" stdev="39.27" mindiff="1.74" local_density="0.70" obsval="-60.05"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="59.33" stdev="16.70" mindiff="13.32" local_density="0.00" obsval="104.66"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="62.75" stdev="19.14" mindiff="16.97" local_density="0.00" obsval="-75.52"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="58.64" stdev="1.87" mindiff="9.00" local_density="0.02" obsval="-116.09"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="58.80" stdev="2.92" mindiff="0.60" local_density="0.05" obsval="64.23"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="47.40" stdev="16.86" mindiff="2.92" local_density="0.11" obsval="135.13"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="48.06" stdev="28.61" mindiff="2.63" local_density="2.28" obsval="-144.30"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="40.04" stdev="22.22" mindiff="1.39" local_density="4.13" obsval="92.44"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="44.45" stdev="10.54" mindiff="0.23" local_density="0.50" obsval="129.85"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="47.55" stdev="33.80" mindiff="1.53" local_density="4.56" obsval="-150.43"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="38.35" stdev="25.38" mindiff="0.38" local_density="4.72" obsval="88.07"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="34.96" stdev="17.06" mindiff="0.12" local_density="1.55" obsval="142.66"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.02" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.78" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.61" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.09" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.01" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.58" Zscore="9.27" obsval="110.91"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.04" Zscore="3.35" obsval="122.05"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="1.94" Zscore="3.76" obsval="125.75"/>
		<mog-angle-outlier atoms="CMB,C2B,C1B" numobs="569" mean="125.42" stdev="1.52" mindiff="0.06" Zscore="2.27" obsval="128.88"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.23" Zscore="-2.81" obsval="108.02"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.05" Zscore="2.57" obsval="112.69"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.30" Zscore="-2.61" obsval="104.23"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.26" Zscore="-2.12" obsval="121.82"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.98" Zscore="5.53" obsval="134.47"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.07" Zscore="-2.43" obsval="122.12"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.04" Zscore="2.42" obsval="137.55"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.18" Zscore="-2.01" obsval="120.56"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.22" Zscore="5.20" obsval="120.31"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.43" obsval="119.13"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="8.87" Zscore="3.99" obsval="123.47"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7385" Q_score="0.455" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.88" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="819" said="VE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="125.60" stdev="51.64" mindiff="16.77" local_density="0.00" obsval="17.06"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="31.44" stdev="15.04" mindiff="0.50" local_density="2.33" obsval="-95.72"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="82.75" stdev="6.40" mindiff="0.99" local_density="0.19" obsval="90.70"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="83.32" stdev="6.63" mindiff="1.69" local_density="0.13" obsval="-89.97"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="69.59" stdev="39.23" mindiff="2.46" local_density="2.11" obsval="-64.25"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="51.40" stdev="9.47" mindiff="0.91" local_density="0.11" obsval="124.89"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="85.23" stdev="27.92" mindiff="0.01" local_density="4.78" obsval="-76.25"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="47.86" stdev="30.47" mindiff="2.11" local_density="3.42" obsval="146.53"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="35.66" stdev="16.51" mindiff="0.17" local_density="1.46" obsval="141.71"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="48.96" stdev="21.60" mindiff="0.73" local_density="1.90" obsval="-135.47"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="42.58" stdev="18.03" mindiff="0.06" local_density="2.36" obsval="98.71"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="59.41" stdev="10.43" mindiff="0.64" local_density="0.54" obsval="109.84"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.20" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.93" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.41" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.16" obsval="1.32"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.11" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.39" Zscore="8.87" obsval="110.72"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.70" Zscore="2.90" obsval="119.58"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.10" Zscore="2.29" obsval="118.82"/>
		<mog-angle-outlier atoms="CMB,C2B,C1B" numobs="569" mean="125.42" stdev="1.52" mindiff="0.01" Zscore="2.08" obsval="128.58"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.37" Zscore="-2.97" obsval="107.88"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.05" Zscore="2.57" obsval="112.69"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.18" Zscore="-2.50" obsval="104.35"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="2.44" Zscore="5.80" obsval="134.94"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.67" Zscore="-2.75" obsval="121.38"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.06" Zscore="2.47" obsval="137.65"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.20" Zscore="-2.40" obsval="119.79"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.04" Zscore="6.12" obsval="121.92"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.86" obsval="118.29"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.70" Zscore="2.91" obsval="119.31"/>
		<clash atom="H91" dist="1.94" clashmag="0.49" cid="20"/>
		<clash atom="HMD1" dist="2.50" clashmag="0.47" cid="22"/>
		<clash atom="HMC3" dist="2.46" clashmag="0.46" cid="23"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8308" Q_score="0.522" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.89" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="B" resnum="820" said="WE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="116.26" stdev="51.64" mindiff="7.43" local_density="1.11" obsval="26.40"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="98.38" stdev="6.92" mindiff="7.61" local_density="0.04" obsval="75.02"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="99.02" stdev="6.89" mindiff="8.83" local_density="0.02" obsval="-105.69"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="58.63" stdev="18.44" mindiff="10.62" local_density="0.00" obsval="107.36"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="62.37" stdev="20.96" mindiff="14.52" local_density="0.00" obsval="-73.08"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="64.01" stdev="37.60" mindiff="6.47" local_density="5.00" obsval="-1.99"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="57.74" stdev="1.86" mindiff="9.90" local_density="0.02" obsval="-117.00"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="57.45" stdev="2.92" mindiff="1.95" local_density="0.05" obsval="62.88"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="64.44" stdev="25.91" mindiff="0.49" local_density="1.58" obsval="91.68"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="45.58" stdev="9.96" mindiff="0.19" local_density="0.48" obsval="-128.32"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="50.45" stdev="14.46" mindiff="2.27" local_density="1.14" obsval="-123.68"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="49.00" stdev="12.32" mindiff="2.96" local_density="1.47" obsval="113.66"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="56.89" stdev="45.64" mindiff="0.80" local_density="2.06" obsval="-35.55"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="49.13" stdev="8.64" mindiff="0.01" local_density="0.44" obsval="-123.55"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="55.29" stdev="28.88" mindiff="0.31" local_density="1.41" obsval="142.40"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="53.74" stdev="24.57" mindiff="0.59" local_density="1.71" obsval="-94.32"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.27" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.95" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.06" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.51" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.04" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.06" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.63" Zscore="9.39" obsval="110.96"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.03" Zscore="-2.08" obsval="121.69"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.44" Zscore="3.00" obsval="119.84"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.08" Zscore="2.86" obsval="120.55"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.21" Zscore="-2.78" obsval="108.05"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.13" Zscore="2.49" obsval="112.60"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.30" Zscore="-2.62" obsval="104.22"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.19" Zscore="-2.07" obsval="121.89"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.59" Zscore="5.31" obsval="134.08"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.36" Zscore="-2.20" obsval="122.65"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.23" Zscore="2.33" obsval="137.36"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.17" Zscore="5.17" obsval="120.26"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.43" obsval="119.11"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.05" Zscore="3.00" obsval="119.66"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.02" Zscore="-2.45" obsval="122.19"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8000" Q_score="0.523" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="2.03" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="B" resnum="821" said="XE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="60.34" stdev="8.02" mindiff="12.08" local_density="0.00" obsval="110.45"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="71.77" stdev="29.20" mindiff="37.13" local_density="0.00" obsval="-4.94"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="115.62" stdev="7.30" mindiff="2.98" local_density="0.08" obsval="-57.76"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="115.99" stdev="7.10" mindiff="5.05" local_density="0.04" obsval="122.67"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="93.79" stdev="39.47" mindiff="8.40" local_density="0.35" obsval="-39.92"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="51.44" stdev="1.80" mindiff="16.20" local_density="0.00" obsval="-123.30"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="50.54" stdev="2.92" mindiff="1.17" local_density="0.06" obsval="55.95"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="50.06" stdev="11.62" mindiff="2.53" local_density="0.07" obsval="128.32"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="80.31" stdev="45.79" mindiff="3.46" local_density="0.29" obsval="-12.01"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="48.96" stdev="21.66" mindiff="0.81" local_density="1.90" obsval="-135.54"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="29.41" stdev="21.51" mindiff="0.02" local_density="4.50" obsval="150.31"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="75.25" stdev="53.76" mindiff="0.20" local_density="3.78" obsval="-40.34"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.36" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.97" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.08" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.19" obsval="1.35"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.31" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.07" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.11" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.98" Zscore="10.14" obsval="111.31"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.05" Zscore="-2.27" obsval="121.24"/>
		<mog-angle-outlier atoms="C2A,C3A,C4A" numobs="26" mean="101.87" stdev="1.62" mindiff="0.36" Zscore="2.10" obsval="105.26"/>
		<mog-angle-outlier atoms="CMA,C3A,C2A" numobs="98" mean="113.98" stdev="3.87" mindiff="2.42" Zscore="3.48" obsval="127.42"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="5.48" Zscore="5.20" obsval="125.76"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.17" Zscore="2.31" obsval="118.89"/>
		<mog-angle-outlier atoms="CMB,C2B,C1B" numobs="569" mean="125.42" stdev="1.52" mindiff="0.02" Zscore="2.09" obsval="128.60"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.52" Zscore="-3.13" obsval="107.74"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.03" Zscore="2.65" obsval="112.76"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.02" Zscore="-2.35" obsval="104.51"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.23" Zscore="5.11" obsval="133.73"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.22" Zscore="-2.13" obsval="122.80"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.05" Zscore="2.47" obsval="137.65"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.03" Zscore="-2.31" obsval="119.96"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.83" Zscore="5.62" obsval="121.05"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.50" obsval="118.98"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.82" Zscore="3.20" obsval="120.43"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.92" Zscore="-2.38" obsval="122.29"/>
		<clash atom="CBB" dist="2.39" clashmag="0.52" cid="312"/>
		<clash atom="CBB" dist="2.51" clashmag="0.40" cid="326"/>
		<clash atom="HBB1" dist="1.92" clashmag="0.52" cid="313"/>
		<clash atom="HBB1" dist="2.01" clashmag="0.43" cid="318"/>
		<clash atom="HHB" dist="1.99" clashmag="0.43" cid="317"/>
		<clash atom="H43" dist="1.99" clashmag="0.43" cid="317"/>
		<clash atom="HHC" dist="2.01" clashmag="0.43" cid="318"/>
		<clash atom="H161" dist="2.01" clashmag="0.41" cid="324"/>
		<clash atom="HMC3" dist="2.01" clashmag="0.41" cid="324"/>
		<chiral-outlier problem="PLANAR" atom="C3A"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7846" Q_score="0.522" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.81" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="B" resnum="822" said="YE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="26.73" stdev="4.58" mindiff="0.23" local_density="1.34" obsval="-147.29"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="28.82" stdev="4.57" mindiff="0.27" local_density="1.54" obsval="34.97"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="70.38" stdev="33.06" mindiff="2.55" local_density="2.52" obsval="62.41"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="68.84" stdev="28.11" mindiff="4.69" local_density="0.74" obsval="-114.67"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="27.66" stdev="1.72" mindiff="2.72" local_density="0.08" obsval="147.09"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="28.59" stdev="3.04" mindiff="0.70" local_density="0.40" obsval="-33.92"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="28.71" stdev="22.09" mindiff="0.03" local_density="4.94" obsval="-151.29"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="47.86" stdev="30.46" mindiff="2.13" local_density="3.42" obsval="-146.51"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="39.39" stdev="23.40" mindiff="0.29" local_density="4.72" obsval="90.76"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.33" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.99" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.02" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.50" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.06" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.15" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.21" Zscore="8.46" obsval="110.54"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.10" Zscore="-2.14" obsval="121.55"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.07" Zscore="3.14" obsval="120.21"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.10" Zscore="2.45" obsval="119.31"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.49" Zscore="2.10" obsval="121.73"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.84" Zscore="-3.49" obsval="107.41"/>
		<mog-angle-outlier atoms="CBB,CAB,C3B" numobs="151" mean="127.53" stdev="5.00" mindiff="0.30" Zscore="-2.49" obsval="115.10"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.16" Zscore="2.46" obsval="112.57"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.01" Zscore="-2.34" obsval="104.52"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.32" Zscore="5.16" obsval="133.82"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.18" Zscore="-2.12" obsval="122.84"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.12" Zscore="2.38" obsval="137.47"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.32" Zscore="4.31" obsval="118.77"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="3.52" Zscore="2.60" obsval="118.12"/>
		<clash atom="HAB" dist="1.97" clashmag="0.46" cid="212"/>
		<clash atom="HED2" dist="2.48" clashmag="0.44" cid="214"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8615" Q_score="0.569" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.74" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="823" said="ZE" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="53.76" stdev="11.35" mindiff="1.37" local_density="1.11" obsval="-123.90"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="51.42" stdev="10.33" mindiff="3.26" local_density="0.78" obsval="120.27"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="59.63" stdev="24.11" mindiff="0.06" local_density="4.72" obsval="88.83"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="59.74" stdev="23.54" mindiff="0.00" local_density="4.14" obsval="-92.15"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="93.65" stdev="37.60" mindiff="14.65" local_density="0.00" obsval="-159.65"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="92.25" stdev="39.49" mindiff="16.65" local_density="0.00" obsval="21.00"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="20.29" stdev="1.70" mindiff="2.93" local_density="0.25" obsval="154.47"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="19.62" stdev="3.18" mindiff="0.24" local_density="1.10" obsval="-24.89"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="48.00" stdev="15.63" mindiff="1.41" local_density="0.07" obsval="133.62"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="63.23" stdev="28.61" mindiff="0.33" local_density="4.72" obsval="144.46"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="49.11" stdev="12.31" mindiff="2.71" local_density="1.18" obsval="-113.91"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="50.48" stdev="14.39" mindiff="2.44" local_density="1.14" obsval="123.51"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="47.87" stdev="30.45" mindiff="2.14" local_density="3.42" obsval="-146.50"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="39.16" stdev="23.83" mindiff="0.89" local_density="4.42" obsval="90.17"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.16" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-4.04" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.06" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.68" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.40" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.03" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.09" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.37" Zscore="8.81" obsval="110.70"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.00" Zscore="-2.30" obsval="121.19"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.07" Zscore="2.51" obsval="119.48"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.27" Zscore="-2.85" obsval="107.99"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.01" Zscore="2.29" obsval="112.39"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.06" Zscore="-2.39" obsval="104.47"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.83" Zscore="4.88" obsval="133.33"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.04" Zscore="2.42" obsval="137.55"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.15" Zscore="4.59" obsval="119.25"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.22" obsval="119.53"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.18" Zscore="3.04" obsval="119.79"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8000" Q_score="0.542" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.34" mogul_angles_rmsz="1.84" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="824" said="AF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="80.10" stdev="6.29" mindiff="3.65" local_density="0.15" obsval="-93.36"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="79.81" stdev="6.56" mindiff="3.70" local_density="0.13" obsval="86.45"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="37.00" stdev="13.83" mindiff="0.23" local_density="3.86" obsval="135.21"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="38.48" stdev="1.74" mindiff="4.28" local_density="0.02" obsval="-136.26"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="38.07" stdev="2.96" mindiff="0.42" local_density="0.15" obsval="43.45"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="36.90" stdev="16.56" mindiff="0.02" local_density="4.27" obsval="72.26"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="38.47" stdev="15.11" mindiff="0.19" local_density="3.39" obsval="-107.52"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="44.11" stdev="24.04" mindiff="0.89" local_density="0.63" obsval="-143.58"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="47.91" stdev="29.99" mindiff="2.69" local_density="3.42" obsval="-145.95"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="39.25" stdev="23.67" mindiff="0.67" local_density="4.42" obsval="90.39"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="80.63" stdev="24.87" mindiff="0.01" local_density="3.16" obsval="-82.07"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="53.68" stdev="31.56" mindiff="0.03" local_density="3.69" obsval="86.24"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="55.79" stdev="36.34" mindiff="0.10" local_density="2.90" obsval="-150.76"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="5.99" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.88" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.59" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.13" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.10" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.44" Zscore="8.98" obsval="110.77"/>
		<mog-angle-outlier atoms="CAA,C2A,C1A" numobs="31" mean="111.97" stdev="3.28" mindiff="0.66" Zscore="-2.48" obsval="103.84"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.50" Zscore="2.98" obsval="119.78"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.49" obsval="119.42"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.38" Zscore="-2.97" obsval="107.88"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.07" Zscore="-2.40" obsval="104.46"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.06" Zscore="-2.10" obsval="104.84"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.25" Zscore="-2.11" obsval="121.83"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.58" Zscore="5.31" obsval="134.08"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.37" Zscore="-2.20" obsval="122.64"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.21" Zscore="2.34" obsval="137.38"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.13" Zscore="5.14" obsval="120.22"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.52" obsval="118.94"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="1.90" Zscore="2.18" obsval="116.50"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.74" Zscore="-2.28" obsval="122.47"/>
		<clash atom="C3C" dist="2.47" clashmag="0.44" cid="526"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9231" Q_score="0.586" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.38" mogul_angles_rmsz="1.86" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="B" resnum="825" said="BF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="40.03" stdev="34.31" mindiff="3.61" local_density="3.33" obsval="-153.27"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="29.78" stdev="15.92" mindiff="1.56" local_density="3.88" obsval="93.65"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="81.74" stdev="39.37" mindiff="3.70" local_density="0.70" obsval="-52.01"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="49.02" stdev="8.67" mindiff="0.08" local_density="0.42" obsval="-123.70"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="47.66" stdev="32.67" mindiff="0.23" local_density="4.56" obsval="-149.12"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="38.62" stdev="24.86" mindiff="0.31" local_density="4.72" obsval="88.76"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="33.06" stdev="18.56" mindiff="0.10" local_density="2.08" obsval="-145.23"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="42.13" stdev="18.72" mindiff="1.03" local_density="2.65" obsval="-97.63"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.57" stdev="24.49" mindiff="0.29" local_density="2.28" obsval="139.28"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.33" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-4.01" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.19" obsval="1.52"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.76" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.31" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.32" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.00" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.85" Zscore="9.86" obsval="111.18"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.06" Zscore="-2.06" obsval="121.72"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.81" Zscore="3.84" obsval="122.10"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.10" Zscore="2.52" obsval="119.50"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.05" Zscore="-2.41" obsval="108.38"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.56" Zscore="3.15" obsval="113.29"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.35" Zscore="-2.69" obsval="104.15"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.16" Zscore="2.08" obsval="112.19"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.62" Zscore="-2.02" obsval="103.08"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.08" Zscore="4.46" obsval="132.58"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.04" Zscore="2.43" obsval="137.55"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.03" Zscore="-2.09" obsval="120.40"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.38" Zscore="5.29" obsval="120.47"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.43" obsval="119.12"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="3.42" Zscore="2.58" obsval="118.03"/>
		<clash atom="H143" dist="2.36" clashmag="0.56" cid="308"/>
		<clash atom="HMB3" dist="1.91" clashmag="0.53" cid="311"/>
		<clash atom="HBB1" dist="1.91" clashmag="0.53" cid="311"/>
		<clash atom="HBB1" dist="2.49" clashmag="0.43" cid="320"/>
		<clash atom="CMB" dist="2.49" clashmag="0.43" cid="320"/>
		<clash atom="HBB2" dist="2.00" clashmag="0.43" cid="321"/>
		<clash atom="CHC" dist="2.48" clashmag="0.42" cid="322"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8615" Q_score="0.588" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.81" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="826" said="CF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="44.08" stdev="26.96" mindiff="12.31" local_density="0.00" obsval="144.58"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="46.92" stdev="29.20" mindiff="12.29" local_density="0.00" obsval="29.78"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="64.40" stdev="24.48" mindiff="0.11" local_density="2.89" obsval="-93.77"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="122.07" stdev="54.69" mindiff="0.03" local_density="3.90" obsval="177.04"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="130.23" stdev="49.63" mindiff="0.02" local_density="1.68" obsval="-2.67"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="32.06" stdev="4.60" mindiff="0.17" local_density="0.88" obsval="141.84"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="31.64" stdev="4.64" mindiff="0.20" local_density="1.17" obsval="-37.86"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="61.08" stdev="1.90" mindiff="6.56" local_density="0.02" obsval="-113.66"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="60.52" stdev="2.92" mindiff="1.12" local_density="0.04" obsval="65.95"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="38.77" stdev="16.15" mindiff="0.42" local_density="3.59" obsval="-69.68"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="40.20" stdev="14.69" mindiff="0.26" local_density="3.68" obsval="109.87"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="37.04" stdev="15.47" mindiff="0.11" local_density="1.16" obsval="139.85"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="47.77" stdev="31.45" mindiff="0.95" local_density="3.42" obsval="147.68"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="82.94" stdev="26.39" mindiff="0.13" local_density="3.95" obsval="79.14"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="28.71" stdev="22.09" mindiff="0.03" local_density="4.94" obsval="151.29"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.11" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-4.01" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.10" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.81" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.37" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.14" obsval="1.32"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.50" Zscore="9.10" obsval="110.83"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.10" Zscore="-2.05" obsval="121.76"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.70" Zscore="2.19" obsval="117.65"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.11" Zscore="2.85" obsval="120.52"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.09" Zscore="-2.65" obsval="108.16"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.01" Zscore="2.62" obsval="112.74"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.10" Zscore="-2.43" obsval="104.43"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.74" Zscore="5.40" obsval="134.23"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.48" Zscore="-2.25" obsval="122.53"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.11" Zscore="2.39" obsval="137.48"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.04" Zscore="-2.08" obsval="120.41"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.05" Zscore="5.10" obsval="120.14"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.26" obsval="119.45"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.29" Zscore="3.06" obsval="119.90"/>
		<clash atom="HBC3" dist="1.86" clashmag="0.58" cid="250"/>
		<clash atom="HMB1" dist="1.94" clashmag="0.50" cid="256"/>
		<clash atom="H192" dist="2.02" clashmag="0.41" cid="270"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9692" Q_score="0.605" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.74" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="827" said="DF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="46.30" stdev="23.05" mindiff="17.04" local_density="0.00" obsval="139.84"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="49.91" stdev="29.20" mindiff="15.27" local_density="0.00" obsval="26.80"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="57.81" stdev="15.07" mindiff="3.29" local_density="0.75" obsval="-106.54"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="107.31" stdev="47.45" mindiff="0.10" local_density="3.82" obsval="-26.57"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="50.90" stdev="16.30" mindiff="0.74" local_density="2.43" obsval="-53.74"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="53.61" stdev="15.15" mindiff="0.36" local_density="1.94" obsval="127.34"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="44.24" stdev="23.75" mindiff="1.23" local_density="0.59" obsval="-143.25"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="55.13" stdev="45.62" mindiff="0.98" local_density="2.65" obsval="-37.33"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="79.80" stdev="24.34" mindiff="0.05" local_density="2.92" obsval="-83.11"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="39.21" stdev="13.88" mindiff="0.26" local_density="0.99" obsval="136.90"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.12" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.94" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.65" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.32" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.16" obsval="1.32"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.01" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.14" Zscore="8.31" obsval="110.47"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.09" Zscore="-2.05" obsval="121.74"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.20" Zscore="2.00" obsval="117.15"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="3.07" obsval="121.20"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.18" Zscore="2.23" obsval="122.05"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.13" Zscore="-2.70" obsval="108.12"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.03" Zscore="2.59" obsval="112.70"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.36" Zscore="-2.68" obsval="104.16"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.22" Zscore="5.10" obsval="133.72"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.34" Zscore="-2.19" obsval="122.68"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.21" Zscore="2.34" obsval="137.38"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.11" Zscore="4.44" obsval="118.98"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.11" obsval="119.75"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.10" Zscore="2.76" obsval="118.71"/>
		<clash atom="HBB1" dist="1.69" clashmag="0.74" cid="16"/>
		<clash atom="HBB1" dist="2.33" clashmag="0.58" cid="18"/>
		<clash atom="HMB1" dist="1.69" clashmag="0.74" cid="16"/>
		<clash atom="HMB1" dist="2.43" clashmag="0.43" cid="25"/>
		<clash atom="CMB" dist="2.33" clashmag="0.58" cid="18"/>
		<clash atom="H143" dist="2.44" clashmag="0.47" cid="21"/>
		<clash atom="CBB" dist="2.43" clashmag="0.43" cid="25"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8615" Q_score="0.558" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.75" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="828" said="EF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="74.06" stdev="5.96" mindiff="0.23" local_density="0.12" obsval="99.44"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="74.21" stdev="6.38" mindiff="0.07" local_density="0.13" obsval="-80.83"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="43.74" stdev="1.76" mindiff="9.54" local_density="0.02" obsval="-131.00"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="43.42" stdev="2.93" mindiff="1.60" local_density="0.09" obsval="48.81"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="41.37" stdev="30.27" mindiff="0.10" local_density="1.99" obsval="-150.69"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="81.18" stdev="25.23" mindiff="0.08" local_density="3.31" obsval="-81.38"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="31.05" stdev="20.16" mindiff="0.08" local_density="3.18" obsval="148.04"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.13" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-4.05" obsval="1.97"/>
		<mog-bond-outlier atoms="CHD,C1D" numobs="3707" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.04" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.57" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.40" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.31" obsval="1.32"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.10" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.39" Zscore="8.87" obsval="110.72"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.32" Zscore="2.05" obsval="117.28"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.10" Zscore="2.63" obsval="119.86"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.40" Zscore="2.47" obsval="122.63"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.17" Zscore="-2.10" obsval="108.65"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.36" Zscore="2.96" obsval="113.09"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.11" Zscore="-2.92" obsval="103.91"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.24" Zscore="5.12" obsval="133.74"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.46" Zscore="-2.24" obsval="122.56"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.17" Zscore="2.36" obsval="137.43"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.83" Zscore="4.97" obsval="119.92"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.51" obsval="118.96"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.28" Zscore="3.06" obsval="119.89"/>
		<clash atom="HBB1" dist="1.76" clashmag="0.66" cid="247"/>
		<clash atom="HBB1" dist="2.46" clashmag="0.45" cid="262"/>
		<clash atom="HMB3" dist="1.76" clashmag="0.66" cid="247"/>
		<clash atom="H112" dist="1.95" clashmag="0.49" cid="257"/>
		<clash atom="CMB" dist="2.46" clashmag="0.45" cid="262"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8769" Q_score="0.501" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.82" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="829" said="FF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="109.79" stdev="51.64" mindiff="0.96" local_density="1.11" obsval="32.88"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="66.74" stdev="27.84" mindiff="0.28" local_density="4.61" obsval="89.36"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="84.62" stdev="6.49" mindiff="0.90" local_density="0.15" obsval="-88.82"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="83.35" stdev="6.63" mindiff="1.65" local_density="0.13" obsval="90.00"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="72.92" stdev="40.69" mindiff="2.28" local_density="3.36" obsval="53.53"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="70.54" stdev="36.88" mindiff="3.30" local_density="2.22" obsval="-124.70"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="13.67" stdev="1.59" mindiff="0.24" local_density="4.16" obsval="-161.12"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="13.83" stdev="3.25" mindiff="0.13" local_density="3.79" obsval="19.00"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="55.29" stdev="8.38" mindiff="2.26" local_density="0.07" obsval="-114.94"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="51.03" stdev="45.58" mindiff="0.51" local_density="4.42" obsval="-41.48"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="47.70" stdev="32.19" mindiff="0.08" local_density="4.18" obsval="-148.56"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="42.33" stdev="18.40" mindiff="0.66" local_density="2.65" obsval="-98.12"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.62" stdev="24.13" mindiff="0.75" local_density="1.90" obsval="138.82"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.22" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.90" obsval="1.98"/>
		<mog-bond-outlier atoms="CHD,C1D" numobs="3707" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.11" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.67" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.03" obsval="1.33"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.04" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.12" Zscore="8.26" obsval="110.45"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.08" Zscore="-2.06" obsval="121.73"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.80" Zscore="2.23" obsval="117.76"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.18" Zscore="-2.75" obsval="108.07"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.03" Zscore="2.64" obsval="112.76"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.17" Zscore="-2.86" obsval="103.98"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.19" Zscore="-2.08" obsval="121.88"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="2.22" Zscore="5.67" obsval="134.72"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.23" Zscore="-2.56" obsval="121.82"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.02" Zscore="2.43" obsval="137.57"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.00" Zscore="-2.10" obsval="120.37"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.04" Zscore="5.50" obsval="120.84"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.60" obsval="118.79"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.56" Zscore="2.87" obsval="119.17"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.12" Zscore="2.18" obsval="126.06"/>
		<clash atom="HAB" dist="2.34" clashmag="0.58" cid="201"/>
		<clash atom="HAB" dist="1.93" clashmag="0.50" cid="206"/>
		<clash atom="HMD1" dist="1.97" clashmag="0.46" cid="212"/>
		<clash atom="HMD3" dist="2.01" clashmag="0.42" cid="217"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7846" Q_score="0.489" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.77" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="830" said="GF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="107.51" stdev="51.63" mindiff="1.33" local_density="1.11" obsval="35.16"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="43.56" stdev="4.80" mindiff="4.66" local_density="0.35" obsval="130.18"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="43.97" stdev="5.27" mindiff="0.06" local_density="0.53" obsval="-50.39"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="73.28" stdev="41.57" mindiff="1.19" local_density="3.36" obsval="-52.44"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="70.97" stdev="38.96" mindiff="0.94" local_density="3.70" obsval="127.06"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="20.74" stdev="1.70" mindiff="2.84" local_density="0.25" obsval="154.02"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="19.69" stdev="3.18" mindiff="0.31" local_density="1.10" obsval="-24.96"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="37.67" stdev="14.99" mindiff="0.28" local_density="1.07" obsval="138.99"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="52.46" stdev="15.00" mindiff="1.16" local_density="1.14" obsval="-109.94"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="54.48" stdev="16.09" mindiff="0.12" local_density="1.47" obsval="125.92"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="41.61" stdev="19.55" mindiff="0.22" local_density="2.95" obsval="-96.38"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="48.43" stdev="25.62" mindiff="0.98" local_density="2.28" obsval="140.69"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="36.86" stdev="15.60" mindiff="0.20" local_density="1.18" obsval="-140.09"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="106.51" stdev="34.89" mindiff="0.02" local_density="4.67" obsval="-52.31"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.09" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.99" obsval="1.97"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.46" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.14" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.02" obsval="1.48"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.02" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.24" Zscore="8.52" obsval="110.56"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.62" Zscore="2.56" obsval="118.66"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.08" Zscore="2.72" obsval="120.11"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.50" Zscore="-3.12" obsval="107.75"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.24" Zscore="2.06" obsval="112.14"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.07" Zscore="-2.14" obsval="104.73"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.05" Zscore="-2.11" obsval="104.83"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.26" Zscore="-2.13" obsval="121.81"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.86" Zscore="4.90" obsval="133.36"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.46" Zscore="2.22" obsval="137.13"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.41" Zscore="4.73" obsval="119.50"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.18" obsval="119.61"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="3.07" Zscore="2.49" obsval="117.67"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.47" Zscore="-2.11" obsval="122.74"/>
		<mog-angle-outlier atoms="C6,C5,C3" numobs="49" mean="113.47" stdev="2.44" mindiff="0.79" Zscore="-3.12" obsval="105.86"/>
		<clash atom="HMA1" dist="1.96" clashmag="0.48" cid="494"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9385" Q_score="0.599" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.83" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="831" said="HF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="88.70" stdev="6.69" mindiff="0.40" local_density="0.12" obsval="-84.72"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="89.27" stdev="6.75" mindiff="0.93" local_density="0.04" obsval="95.93"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="68.88" stdev="39.23" mindiff="2.14" local_density="2.81" obsval="-64.96"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="67.19" stdev="1.98" mindiff="0.45" local_density="0.02" obsval="-107.55"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="67.02" stdev="2.94" mindiff="4.93" local_density="0.02" obsval="72.46"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="49.25" stdev="16.03" mindiff="0.04" local_density="2.52" obsval="-55.85"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="50.99" stdev="14.63" mindiff="0.31" local_density="2.13" obsval="124.02"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="65.09" stdev="27.31" mindiff="0.14" local_density="1.99" obsval="90.06"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="41.61" stdev="12.25" mindiff="0.70" local_density="0.71" obsval="133.67"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="47.84" stdev="30.70" mindiff="1.84" local_density="3.42" obsval="-146.80"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="39.64" stdev="22.94" mindiff="0.35" local_density="4.72" obsval="91.41"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="55.03" stdev="23.97" mindiff="0.35" local_density="0.83" obsval="136.71"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="53.84" stdev="19.96" mindiff="0.27" local_density="0.97" obsval="-100.04"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.03" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.83" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.82" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.32" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.25" obsval="1.32"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.71" Zscore="9.55" obsval="111.04"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.18" Zscore="2.32" obsval="118.90"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.26" Zscore="2.20" obsval="121.97"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.12" Zscore="-2.33" obsval="108.45"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.04" Zscore="2.66" obsval="112.77"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.24" Zscore="-2.56" obsval="104.29"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.00" Zscore="-2.19" obsval="104.77"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.06" Zscore="5.01" obsval="133.56"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.39" Zscore="2.25" obsval="137.20"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.07" Zscore="-2.06" obsval="120.45"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.16" Zscore="5.43" obsval="120.72"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.58" obsval="118.83"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="6.38" Zscore="3.35" obsval="120.98"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.75" Zscore="-2.28" obsval="122.46"/>
		<clash atom="CHD" dist="2.27" clashmag="0.65" cid="303"/>
		<clash atom="C4C" dist="2.28" clashmag="0.63" cid="304"/>
		<clash atom="HMB3" dist="1.86" clashmag="0.56" cid="307"/>
		<clash atom="HBB1" dist="1.86" clashmag="0.56" cid="307"/>
		<clash atom="HBB1" dist="2.47" clashmag="0.44" cid="316"/>
		<clash atom="CMB" dist="2.47" clashmag="0.44" cid="316"/>
		<clash atom="HMA2" dist="2.48" clashmag="0.42" cid="322"/>
		<clash atom="C1D" dist="2.50" clashmag="0.41" cid="325"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7846" Q_score="0.497" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.85" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="832" said="IF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="59.31" stdev="7.50" mindiff="9.97" local_density="1.11" obsval="112.56"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="73.97" stdev="29.20" mindiff="39.33" local_density="0.00" obsval="-2.73"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="58.30" stdev="15.73" mindiff="2.32" local_density="0.64" obsval="-105.58"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="121.72" stdev="7.37" mindiff="5.23" local_density="0.08" obsval="51.65"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="123.15" stdev="7.15" mindiff="9.07" local_density="0.02" obsval="-129.85"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="120.40" stdev="39.47" mindiff="35.01" local_density="0.00" obsval="13.30"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="62.50" stdev="13.19" mindiff="25.46" local_density="0.00" obsval="92.52"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="64.58" stdev="13.40" mindiff="28.72" local_density="0.00" obsval="-87.28"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="45.69" stdev="1.77" mindiff="11.50" local_density="0.00" obsval="-129.05"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="45.64" stdev="2.92" mindiff="0.63" local_density="0.09" obsval="51.04"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="43.55" stdev="25.30" mindiff="0.46" local_density="0.85" obsval="-145.02"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="75.83" stdev="21.52" mindiff="0.00" local_density="1.85" obsval="-88.24"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="74.13" stdev="45.76" mindiff="2.73" local_density="0.29" obsval="-18.20"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="48.33" stdev="26.41" mindiff="0.00" local_density="2.28" obsval="-141.67"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="32.58" stdev="18.94" mindiff="0.07" local_density="2.14" obsval="145.90"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="54.28" stdev="45.61" mindiff="1.85" local_density="3.24" obsval="38.19"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.28" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.85" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.02" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.29" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.34" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.02" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.08" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.18" Zscore="8.40" obsval="110.51"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.23" Zscore="-2.19" obsval="121.43"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.18" Zscore="2.73" obsval="119.10"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.49" obsval="119.44"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.61" Zscore="3.21" obsval="124.42"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.62" Zscore="-3.25" obsval="107.63"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.08" Zscore="2.36" obsval="112.46"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.11" Zscore="-2.43" obsval="104.42"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.86" Zscore="5.47" obsval="134.35"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.31" Zscore="-2.32" obsval="122.36"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.15" Zscore="2.37" obsval="137.44"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.15" Zscore="-2.02" obsval="120.53"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.28" Zscore="5.23" obsval="120.38"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.44" obsval="119.10"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="7.72" Zscore="3.69" obsval="122.32"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="2.08" Zscore="-3.10" obsval="121.12"/>
		<clash atom="HAB" dist="2.27" clashmag="0.65" cid="303"/>
		<clash atom="HAB" dist="2.28" clashmag="0.63" cid="304"/>
		<clash atom="HAB" dist="2.50" clashmag="0.41" cid="325"/>
		<clash atom="H3A" dist="1.62" clashmag="0.46" cid="315"/>
		<clash atom="HBA2" dist="1.62" clashmag="0.46" cid="315"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8462" Q_score="0.584" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.78" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="833" said="JF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="52.82" stdev="12.62" mindiff="3.34" local_density="1.11" obsval="-125.87"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="51.87" stdev="10.42" mindiff="2.70" local_density="0.78" obsval="120.83"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="36.21" stdev="26.29" mindiff="0.61" local_density="4.39" obsval="-149.73"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="52.15" stdev="20.21" mindiff="0.23" local_density="4.53" obsval="107.11"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="78.65" stdev="39.33" mindiff="6.67" local_density="0.70" obsval="-55.12"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="92.77" stdev="37.60" mindiff="13.77" local_density="0.00" obsval="-158.77"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="91.41" stdev="39.49" mindiff="15.80" local_density="0.00" obsval="21.84"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="14.97" stdev="1.60" mindiff="0.04" local_density="1.95" obsval="159.81"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="14.39" stdev="3.23" mindiff="0.08" local_density="3.11" obsval="-19.58"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="54.88" stdev="32.57" mindiff="9.66" local_density="0.10" obsval="-150.71"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="51.80" stdev="32.48" mindiff="9.00" local_density="0.10" obsval="30.57"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="60.52" stdev="17.50" mindiff="2.62" local_density="0.40" obsval="-101.59"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="47.68" stdev="32.43" mindiff="0.05" local_density="4.56" obsval="-148.84"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="34.00" stdev="17.81" mindiff="0.07" local_density="1.87" obsval="-143.96"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.22" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.95" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.06" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.52" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.19" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.07" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.53" Zscore="9.15" obsval="110.86"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.16" Zscore="-2.16" obsval="121.50"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.38" obsval="119.09"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.15" Zscore="2.24" obsval="122.08"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.18" Zscore="-2.75" obsval="108.08"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.11" Zscore="2.51" obsval="112.62"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.24" Zscore="-2.56" obsval="104.28"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.06" Zscore="-2.10" obsval="104.84"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.23" Zscore="2.23" obsval="112.33"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.62" Zscore="-2.02" obsval="103.08"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.55" Zscore="4.72" obsval="133.05"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.15" Zscore="2.37" obsval="137.44"/>
		<mog-angle-outlier atoms="OBD,CAD,C3D" numobs="108" mean="128.42" stdev="2.34" mindiff="0.39" Zscore="-2.02" obsval="123.69"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.85" Zscore="4.99" obsval="119.95"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.28" obsval="119.41"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.91" Zscore="2.96" obsval="119.52"/>
		<mog-angle-outlier atoms="C4,C3,C2" numobs="919" mean="123.63" stdev="2.57" mindiff="0.06" Zscore="-2.31" obsval="117.69"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.01" Zscore="2.11" obsval="125.91"/>
		<clash atom="HBB1" dist="1.84" clashmag="0.59" cid="354"/>
		<clash atom="HBB1" dist="1.98" clashmag="0.45" cid="356"/>
		<clash atom="HBB1" dist="2.50" clashmag="0.42" cid="357"/>
		<clash atom="HBC2" dist="2.45" clashmag="0.51" cid="355"/>
		<clash atom="HMB1" dist="1.98" clashmag="0.45" cid="356"/>
		<clash atom="CMB" dist="2.50" clashmag="0.42" cid="357"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8769" Q_score="0.548" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.88" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="834" said="KF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="68.27" stdev="18.79" mindiff="26.68" local_density="0.00" obsval="94.21"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="53.81" stdev="29.20" mindiff="19.18" local_density="0.00" obsval="-22.89"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="120.89" stdev="54.69" mindiff="0.01" local_density="4.24" obsval="175.86"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="127.88" stdev="49.63" mindiff="0.01" local_density="1.94" obsval="-5.01"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="19.65" stdev="4.76" mindiff="0.16" local_density="3.03" obsval="154.57"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="20.45" stdev="4.37" mindiff="0.06" local_density="2.98" obsval="-26.34"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="46.72" stdev="1.77" mindiff="12.52" local_density="0.00" obsval="-128.02"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="46.60" stdev="2.92" mindiff="1.59" local_density="0.08" obsval="52.00"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="40.20" stdev="32.99" mindiff="0.07" local_density="3.86" obsval="-153.75"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="31.54" stdev="19.77" mindiff="0.03" local_density="2.91" obsval="147.36"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="40.85" stdev="12.76" mindiff="0.18" local_density="0.78" obsval="-134.69"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="79.71" stdev="24.28" mindiff="0.04" local_density="2.89" obsval="-83.23"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="54.04" stdev="14.14" mindiff="0.86" local_density="0.75" obsval="109.28"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="54.65" stdev="17.32" mindiff="0.14" local_density="0.66" obsval="-128.01"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.10" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.85" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.07" obsval="1.51"/>
		<mog-bond-outlier atoms="CHC,C1C" numobs="3736" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.04" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.48" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.40" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.88" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.44" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.52" Zscore="9.13" obsval="110.84"/>
		<mog-angle-outlier atoms="CBA,CAA,C2A" numobs="171" mean="113.79" stdev="2.98" mindiff="0.24" Zscore="2.29" obsval="120.61"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.15" Zscore="3.67" obsval="123.01"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.35" Zscore="-2.94" obsval="107.90"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.13" Zscore="-2.19" obsval="104.68"/>
		<mog-angle-outlier atoms="CMC,C2C,C1C" numobs="853" mean="125.03" stdev="1.56" mindiff="0.01" Zscore="2.55" obsval="129.02"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.14" Zscore="-2.39" obsval="104.64"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.17" Zscore="2.28" obsval="112.39"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.70" Zscore="-2.08" obsval="103.00"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.55" Zscore="5.29" obsval="134.04"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.06" Zscore="-2.07" obsval="122.95"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.30" Zscore="2.30" obsval="137.29"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.12" Zscore="-2.16" obsval="120.25"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.11" Zscore="5.46" obsval="120.78"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.50" obsval="118.97"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.76" Zscore="3.18" obsval="120.36"/>
		<mog-angle-outlier atoms="C5,C3,C2" numobs="616" mean="121.17" stdev="2.24" mindiff="0.07" Zscore="2.50" obsval="126.78"/>
		<clash atom="HMC2" dist="1.85" clashmag="0.58" cid="200"/>
		<clash atom="HMB1" dist="1.89" clashmag="0.54" cid="203"/>
		<clash atom="HBB1" dist="1.89" clashmag="0.54" cid="203"/>
		<clash atom="HBB1" dist="2.50" clashmag="0.41" cid="221"/>
		<clash atom="H93" dist="2.38" clashmag="0.53" cid="204"/>
		<clash atom="CAB" dist="2.38" clashmag="0.53" cid="204"/>
		<clash atom="H92" dist="2.00" clashmag="0.44" cid="215"/>
		<clash atom="CMB" dist="2.51" clashmag="0.41" cid="220"/>
		<clash atom="CMB" dist="2.50" clashmag="0.41" cid="221"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7538" Q_score="0.534" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.81" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="835" said="LF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="110.19" stdev="51.64" mindiff="1.36" local_density="1.11" obsval="32.47"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="54.67" stdev="22.27" mindiff="0.06" local_density="4.80" obsval="-77.21"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="54.15" stdev="20.66" mindiff="0.02" local_density="4.37" obsval="102.95"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="37.07" stdev="4.67" mindiff="1.21" local_density="0.61" obsval="136.75"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="36.76" stdev="4.93" mindiff="0.84" local_density="0.84" obsval="-43.08"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="106.81" stdev="39.47" mindiff="21.42" local_density="0.00" obsval="-26.89"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="53.11" stdev="1.82" mindiff="14.53" local_density="0.00" obsval="-121.63"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="51.84" stdev="2.92" mindiff="2.44" local_density="0.05" obsval="57.25"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="48.79" stdev="14.02" mindiff="0.62" local_density="0.07" obsval="131.58"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="81.90" stdev="25.70" mindiff="0.02" local_density="3.56" obsval="-80.46"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="52.54" stdev="8.27" mindiff="0.19" local_density="0.44" obsval="119.00"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="53.41" stdev="45.60" mindiff="1.56" local_density="3.24" obsval="39.07"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.16" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.87" obsval="1.98"/>
		<mog-bond-outlier atoms="CHC,C1C" numobs="3736" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.06" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.19" obsval="1.35"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.01" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.32" obsval="1.49"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.05" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.32" Zscore="8.70" obsval="110.65"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.02" Zscore="2.14" obsval="118.35"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.28" Zscore="2.19" obsval="121.95"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.91" Zscore="-3.58" obsval="107.34"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.19" Zscore="2.11" obsval="112.20"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.11" Zscore="-2.44" obsval="104.42"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.38" Zscore="-2.73" obsval="104.39"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.16" Zscore="-2.05" obsval="121.91"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.17" Zscore="2.28" obsval="112.39"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.94" Zscore="5.52" obsval="134.44"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.31" Zscore="-2.33" obsval="122.36"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.10" Zscore="2.40" obsval="137.50"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.10" Zscore="-2.15" obsval="120.27"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.95" Zscore="5.55" obsval="120.93"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.60" obsval="118.78"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.88" Zscore="2.96" obsval="119.49"/>
		<clash atom="H52" dist="1.80" clashmag="0.64" cid="197"/>
		<clash atom="CBB" dist="2.34" clashmag="0.58" cid="201"/>
		<clash atom="C5" dist="2.37" clashmag="0.55" cid="202"/>
		<clash atom="HBB2" dist="1.93" clashmag="0.50" cid="206"/>
		<clash atom="HAC2" dist="2.00" clashmag="0.44" cid="215"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8923" Q_score="0.59" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.82" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="B" resnum="836" said="MF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="46.35" stdev="11.49" mindiff="5.33" local_density="0.11" obsval="-129.26"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="95.61" stdev="6.85" mindiff="4.83" local_density="0.08" obsval="-77.80"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="95.60" stdev="6.84" mindiff="5.41" local_density="0.02" obsval="102.27"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="28.93" stdev="1.74" mindiff="3.99" local_density="0.08" obsval="-145.82"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="28.51" stdev="3.04" mindiff="0.62" local_density="0.39" obsval="33.84"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="53.18" stdev="7.74" mindiff="3.15" local_density="0.07" obsval="120.35"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="82.22" stdev="45.79" mindiff="5.37" local_density="0.29" obsval="-10.10"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="49.26" stdev="19.80" mindiff="0.98" local_density="1.90" obsval="-133.03"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="82.74" stdev="26.25" mindiff="0.01" local_density="3.80" obsval="-79.40"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="47.69" stdev="9.09" mindiff="0.64" local_density="0.47" obsval="125.48"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="113.71" stdev="55.64" mindiff="0.28" local_density="0.83" obsval="-0.49"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="54.50" stdev="15.00" mindiff="1.06" local_density="0.66" obsval="124.14"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.30" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.98" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.01" obsval="1.51"/>
		<mog-bond-outlier atoms="CHD,C1D" numobs="3707" mean="1.38" stdev="0.02" mindiff="0.00" Zscore="2.06" obsval="1.42"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.62" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.10" obsval="1.33"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.07" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.38" Zscore="8.82" obsval="110.70"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.09" Zscore="3.20" obsval="120.37"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.22" obsval="118.59"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.10" Zscore="-2.67" obsval="108.15"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.29" Zscore="2.89" obsval="113.02"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.31" Zscore="-2.73" obsval="104.11"/>
		<mog-angle-outlier atoms="CAC,C3C,C4C" numobs="5400" mean="124.79" stdev="1.30" mindiff="0.01" Zscore="2.12" obsval="127.54"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.37" Zscore="5.19" obsval="133.87"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.27" Zscore="-2.34" obsval="122.32"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.04" Zscore="2.42" obsval="137.55"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.25" Zscore="5.21" obsval="120.34"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.46" obsval="119.06"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.52" Zscore="2.86" obsval="119.12"/>
		<clash atom="HAB" dist="1.54" clashmag="0.89" cid="38"/>
		<clash atom="HMB1" dist="1.98" clashmag="0.46" cid="46"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8462" Q_score="0.556" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="2.01" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="B" resnum="837" said="NF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="59.43" stdev="7.54" mindiff="10.24" local_density="0.00" obsval="112.29"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="72.35" stdev="29.20" mindiff="37.71" local_density="0.00" obsval="-4.36"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="57.80" stdev="15.05" mindiff="3.31" local_density="0.75" obsval="-106.56"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="49.89" stdev="5.02" mindiff="0.18" local_density="0.27" obsval="-123.78"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="49.62" stdev="5.54" mindiff="0.19" local_density="0.46" obsval="56.10"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="10552" mean="21.83" stdev="9.33" mindiff="0.03" local_density="4.89" obsval="115.91"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="57.42" stdev="1.86" mindiff="10.22" local_density="0.00" obsval="-117.32"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="56.59" stdev="2.91" mindiff="2.18" local_density="0.05" obsval="62.01"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="71.40" stdev="23.70" mindiff="2.43" local_density="1.07" obsval="-28.24"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="74.36" stdev="23.68" mindiff="3.76" local_density="1.26" obsval="153.11"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="52.27" stdev="14.49" mindiff="0.06" local_density="1.14" obsval="-111.16"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="54.56" stdev="16.18" mindiff="0.05" local_density="1.47" obsval="126.10"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="72.18" stdev="18.86" mindiff="0.55" local_density="1.30" obsval="-93.00"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="67.62" stdev="15.60" mindiff="0.04" local_density="0.77" obsval="-98.98"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="47.52" stdev="34.13" mindiff="1.92" local_density="4.56" obsval="-150.81"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.38" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.80" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.03" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.19" obsval="1.35"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.40" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.04" obsval="1.33"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.79" Zscore="9.74" obsval="111.12"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.10" Zscore="-2.25" obsval="121.29"/>
		<mog-angle-outlier atoms="C2A,C3A,C4A" numobs="26" mean="101.87" stdev="1.62" mindiff="0.58" Zscore="2.23" obsval="105.48"/>
		<mog-angle-outlier atoms="CMA,C3A,C2A" numobs="98" mean="113.98" stdev="3.87" mindiff="1.81" Zscore="3.32" obsval="126.81"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="5.55" Zscore="5.23" obsval="125.83"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.11" Zscore="-2.68" obsval="108.14"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.27" Zscore="2.88" obsval="113.00"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.36" Zscore="-2.67" obsval="104.17"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="2.60" Zscore="5.89" obsval="135.10"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.46" Zscore="-2.66" obsval="121.59"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.12" Zscore="2.50" obsval="137.71"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.15" Zscore="-2.22" obsval="120.14"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.93" Zscore="5.56" obsval="120.95"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.54" obsval="118.90"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.01" Zscore="2.73" obsval="118.62"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.52" Zscore="-2.75" obsval="121.69"/>
		<clash atom="HBB1" dist="1.82" clashmag="0.60" cid="42"/>
		<clash atom="HHC" dist="1.82" clashmag="0.60" cid="42"/>
		<clash atom="HHC" dist="2.46" clashmag="0.46" cid="47"/>
		<clash atom="HBC3" dist="2.42" clashmag="0.48" cid="45"/>
		<clash atom="CBB" dist="2.46" clashmag="0.46" cid="47"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8769" Q_score="0.565" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.84" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="B" resnum="838" said="OF" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="108.54" stdev="51.64" mindiff="0.29" local_density="1.11" obsval="34.13"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="19.05" stdev="4.78" mindiff="0.09" local_density="3.53" obsval="155.19"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="20.55" stdev="4.37" mindiff="0.01" local_density="2.93" obsval="-26.43"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="38.93" stdev="14.41" mindiff="0.16" local_density="4.56" obsval="-120.84"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="78.10" stdev="37.50" mindiff="0.95" local_density="5.00" obsval="-144.05"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="75.91" stdev="39.25" mindiff="0.19" local_density="5.00" obsval="37.46"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="40" mean="43.03" stdev="27.41" mindiff="2.08" local_density="5.00" obsval="100.82"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O2D" numobs="41" mean="43.38" stdev="29.47" mindiff="0.48" local_density="4.88" obsval="-77.67"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="41.91" stdev="1.75" mindiff="7.72" local_density="0.02" obsval="-132.83"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="43.28" stdev="2.93" mindiff="1.74" local_density="0.09" obsval="48.67"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="67.44" stdev="15.47" mindiff="0.20" local_density="0.77" obsval="-99.22"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="39.12" stdev="23.91" mindiff="1.01" local_density="4.42" obsval="-90.05"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="47.98" stdev="29.29" mindiff="3.43" local_density="2.28" obsval="145.10"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="47.66" stdev="32.64" mindiff="0.19" local_density="4.56" obsval="-149.09"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="38.40" stdev="25.29" mindiff="0.27" local_density="4.72" obsval="88.18"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="51.74" stdev="8.26" mindiff="0.06" local_density="0.45" obsval="-120.07"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.31" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.86" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.10" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.57" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.01" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.13" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.27" Zscore="8.59" obsval="110.60"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.02" Zscore="-2.08" obsval="121.68"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="2.14" Zscore="2.35" obsval="118.09"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.14" Zscore="2.82" obsval="120.44"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.08" Zscore="-2.64" obsval="108.17"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.13" Zscore="2.50" obsval="112.60"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.24" Zscore="-2.56" obsval="104.28"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.49" Zscore="5.26" obsval="133.99"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.31" Zscore="-2.17" obsval="122.70"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.02" Zscore="2.43" obsval="137.57"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.47" Zscore="-2.53" obsval="119.53"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.03" Zscore="6.08" obsval="121.85"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.69" obsval="118.61"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.83" Zscore="3.20" obsval="120.44"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="2.31" Zscore="-3.23" obsval="120.90"/>
		<clash atom="H2A" dist="1.91" clashmag="0.53" cid="310"/>
		<clash atom="HED2" dist="1.91" clashmag="0.53" cid="310"/>
		<clash atom="HED1" dist="2.51" clashmag="0.40" cid="326"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8485" Q_score="0.599" mogul_rmsz_numbonds="34" mogul_rmsz_numangles="43" mogul_bonds_rmsz="0.47" mogul_angles_rmsz="1.01" num-H-reduce="46" model="1" chain="B" resnum="839" said="PF" ent="27" seq="." icode=" " resname="PQN" altcode=" ">
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="2719" mean="42.30" stdev="28.14" mindiff="0.80" local_density="1.36" obsval="148.27"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="339" mean="49.52" stdev="12.34" mindiff="1.77" local_density="1.18" obsval="-114.85"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="263" mean="50.63" stdev="13.99" mindiff="1.37" local_density="1.14" obsval="122.42"/>
		<mog-torsion-outlier atoms="C17,C18,C20,C21" numobs="263" mean="51.40" stdev="13.21" mindiff="1.93" local_density="1.52" obsval="-116.96"/>
		<mog-torsion-outlier atoms="C19,C18,C20,C21" numobs="339" mean="51.81" stdev="13.37" mindiff="1.64" local_density="1.47" obsval="120.00"/>
		<mog-torsion-outlier atoms="C20,C21,C22,C23" numobs="6638" mean="74.55" stdev="20.57" mindiff="0.11" local_density="1.60" obsval="89.91"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="6638" mean="85.67" stdev="28.22" mindiff="0.02" local_density="4.91" obsval="-75.70"/>
		<mog-torsion-outlier atoms="C26,C27,C28,C29" numobs="2276" mean="54.40" stdev="13.70" mindiff="0.30" local_density="0.75" obsval="121.37"/>
		<mog-torsion-outlier atoms="C26,C27,C28,C30" numobs="2276" mean="54.20" stdev="12.64" mindiff="0.86" local_density="0.66" obsval="-115.13"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="35" mean="126.83" stdev="1.72" mindiff="1.35" Zscore="-2.61" obsval="122.33"/>
		<mog-angle-outlier atoms="C14,C13,C15" numobs="1064" mean="115.23" stdev="1.74" mindiff="0.00" Zscore="2.06" obsval="118.81"/>
		<clash atom="H141" dist="1.54" clashmag="0.89" cid="38"/>
		<clash atom="H293" dist="1.98" clashmag="0.46" cid="46"/>
		<clash atom="H142" dist="2.02" clashmag="0.42" cid="49"/>
		<clash atom="H142" dist="2.51" clashmag="0.41" cid="51"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7500" Q_score="0.487" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.58" mogul_angles_rmsz="4.74" num-H-reduce="52" model="1" chain="B" resnum="840" said="QF" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="91.19" stdev="3.61" mindiff="66.85" local_density="0.00" obsval="82.98"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="93.66" stdev="4.37" mindiff="63.91" local_density="0.00" obsval="-99.63"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="47.12" stdev="7.70" mindiff="13.81" local_density="0.00" obsval="-127.16"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="67.99" stdev="5.82" mindiff="53.32" local_density="0.00" obsval="-107.81"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="31.59" stdev="13.01" mindiff="17.78" local_density="0.00" obsval="144.60"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="29.35" stdev="13.87" mindiff="8.45" local_density="0.32" obsval="-32.92"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="62.86" stdev="47.94" mindiff="11.09" local_density="0.00" obsval="12.73"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C30" numobs="119" mean="61.08" stdev="48.89" mindiff="4.81" local_density="0.84" obsval="-166.66"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.00" Zscore="4.12" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-5.13" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="-3.83" obsval="1.31"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="5.85" obsval="1.50"/>
		<mog-angle-outlier atoms="C31,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="0.01" Zscore="-2.21" obsval="106.77"/>
		<mog-angle-outlier atoms="C32,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="0.03" Zscore="2.09" obsval="113.52"/>
		<mog-angle-outlier atoms="C3,C4,C5" numobs="188" mean="114.06" stdev="1.78" mindiff="0.07" Zscore="-2.48" obsval="109.63"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.02" Zscore="2.17" obsval="118.23"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.10" Zscore="-2.97" obsval="121.24"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.72" Zscore="-2.90" obsval="118.68"/>
		<mog-angle-outlier atoms="C1,C6,C7" numobs="118" mean="115.65" stdev="2.71" mindiff="4.01" Zscore="3.80" obsval="125.97"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="97" mean="121.56" stdev="2.30" mindiff="1.33" Zscore="-2.71" obsval="115.31"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.23" Zscore="2.02" obsval="121.17"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.12" Zscore="-2.45" obsval="118.85"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="17.52" Zscore="14.52" obsval="147.64"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="36.71" Zscore="18.43" obsval="176.61"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="20.52" Zscore="9.37" obsval="152.07"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="0.19" Zscore="-2.09" obsval="124.35"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="19.26" Zscore="12.31" obsval="148.70"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.13" Zscore="3.59" obsval="124.66"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.13" Zscore="-2.79" obsval="118.30"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="24.01" Zscore="10.65" obsval="155.56"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="26.01" Zscore="14.74" obsval="165.90"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="0.13" Zscore="-2.18" obsval="119.66"/>
		<clash atom="HC8" dist="1.66" clashmag="0.77" cid="181"/>
		<clash atom="H321" dist="1.66" clashmag="0.77" cid="181"/>
		<clash atom="H383" dist="1.75" clashmag="0.69" cid="182"/>
		<clash atom="H23C" dist="1.75" clashmag="0.69" cid="182"/>
		<clash atom="H352" dist="2.21" clashmag="0.55" cid="183"/>
		<clash atom="H352" dist="2.42" clashmag="0.54" cid="184"/>
		<clash atom="H393" dist="2.43" clashmag="0.47" cid="185"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8250" Q_score="0.556" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.57" mogul_angles_rmsz="4.60" num-H-reduce="52" model="1" chain="B" resnum="841" said="RF" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="67.21" stdev="48.89" mindiff="10.94" local_density="0.00" obsval="-172.80"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="67.18" stdev="47.94" mindiff="15.41" local_density="0.00" obsval="8.41"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="49.41" stdev="14.89" mindiff="29.52" local_density="0.00" obsval="128.39"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="48.37" stdev="14.79" mindiff="30.06" local_density="0.00" obsval="-50.67"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="53.96" stdev="6.75" mindiff="7.88" local_density="0.13" obsval="-119.98"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="62.23" stdev="7.74" mindiff="47.25" local_density="0.00" obsval="-113.89"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="40.16" stdev="10.46" mindiff="13.42" local_density="0.00" obsval="135.44"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="40.70" stdev="10.33" mindiff="15.46" local_density="0.00" obsval="-45.04"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="65.70" stdev="47.94" mindiff="13.92" local_density="0.00" obsval="-9.89"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C30" numobs="119" mean="61.35" stdev="48.89" mindiff="5.08" local_density="0.84" obsval="166.94"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="3.86" obsval="1.44"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.01" Zscore="-5.19" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-3.86" obsval="1.31"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.01" Zscore="5.69" obsval="1.50"/>
		<mog-angle-outlier atoms="C31,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="0.07" Zscore="-2.08" obsval="106.99"/>
		<mog-angle-outlier atoms="C3,C4,C5" numobs="188" mean="114.06" stdev="1.78" mindiff="0.95" Zscore="-3.27" obsval="108.23"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="0.72" Zscore="-2.68" obsval="119.09"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.11" Zscore="2.31" obsval="118.52"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.38" Zscore="-2.05" obsval="122.24"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.13" Zscore="-3.52" obsval="117.83"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.12" Zscore="3.73" obsval="123.78"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.92" Zscore="-3.93" obsval="116.45"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="11.27" Zscore="10.06" obsval="141.39"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="37.71" Zscore="18.78" obsval="177.60"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="21.99" Zscore="9.91" obsval="153.54"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.55" Zscore="-2.71" obsval="114.75"/>
		<mog-angle-outlier atoms="C35,C13,C12" numobs="317" mean="118.09" stdev="1.53" mindiff="0.35" Zscore="2.40" obsval="121.75"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="17.93" Zscore="11.65" obsval="147.37"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.05" Zscore="3.02" obsval="123.75"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.03" Zscore="-2.02" obsval="119.54"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="27.01" Zscore="11.74" obsval="158.56"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="17.99" Zscore="11.97" obsval="157.88"/>
		<mog-angle-outlier atoms="C23,C22,C21" numobs="168" mean="119.01" stdev="1.57" mindiff="0.43" Zscore="-2.80" obsval="114.61"/>
		<mog-angle-outlier atoms="C37,C22,C23" numobs="317" mean="118.09" stdev="1.53" mindiff="0.43" Zscore="2.98" obsval="122.64"/>
		<mog-angle-outlier atoms="C23,C24,C25" numobs="153" mean="127.00" stdev="2.67" mindiff="2.42" Zscore="-2.96" obsval="119.08"/>
		<mog-angle-outlier atoms="C30,C25,C24" numobs="118" mean="115.65" stdev="2.71" mindiff="0.13" Zscore="2.05" obsval="121.21"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="1.49" Zscore="-4.51" obsval="116.47"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="99" mean="122.70" stdev="1.35" mindiff="2.17" Zscore="-4.87" obsval="116.12"/>
		<mog-angle-outlier atoms="C38,C26,C27" numobs="379" mean="113.60" stdev="2.13" mindiff="0.08" Zscore="2.64" obsval="119.23"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="188" mean="114.06" stdev="1.78" mindiff="1.06" Zscore="-3.17" obsval="108.40"/>
		<mog-angle-outlier atoms="C29,C30,C25" numobs="132" mean="110.44" stdev="1.45" mindiff="0.21" Zscore="-2.13" obsval="107.35"/>
		<clash atom="H322" dist="1.83" clashmag="0.59" cid="17"/>
		<clash atom="C17" dist="2.44" clashmag="0.47" cid="21"/>
		<clash atom="H351" dist="1.83" clashmag="0.44" cid="24"/>
		<clash atom="H15C" dist="1.83" clashmag="0.44" cid="24"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9000" Q_score="0.539" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.61" mogul_angles_rmsz="4.61" num-H-reduce="52" model="1" chain="B" resnum="842" said="SF" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="40.03" stdev="15.18" mindiff="23.81" local_density="0.00" obsval="137.32"/>
		<mog-torsion-outlier atoms="C12,C13,C14,C15" numobs="150" mean="167.95" stdev="33.00" mindiff="0.12" local_density="3.33" obsval="0.11"/>
		<mog-torsion-outlier atoms="C35,C13,C14,C15" numobs="160" mean="167.40" stdev="32.00" mindiff="1.08" local_density="3.12" obsval="-178.90"/>
		<mog-torsion-outlier atoms="C20,C21,C22,C23" numobs="150" mean="167.71" stdev="33.00" mindiff="0.12" local_density="3.33" obsval="0.36"/>
		<mog-torsion-outlier atoms="C20,C21,C22,C37" numobs="160" mean="165.10" stdev="32.00" mindiff="0.40" local_density="3.12" obsval="-176.60"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="49.89" stdev="47.92" mindiff="1.90" local_density="0.84" obsval="25.71"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.00" Zscore="4.22" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-4.94" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-3.93" obsval="1.31"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="6.05" obsval="1.51"/>
		<mog-angle-outlier atoms="C31,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="0.05" Zscore="-2.68" obsval="106.04"/>
		<mog-angle-outlier atoms="C32,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="0.78" Zscore="3.51" obsval="115.74"/>
		<mog-angle-outlier atoms="C3,C4,C5" numobs="188" mean="114.06" stdev="1.78" mindiff="0.90" Zscore="-3.29" obsval="108.19"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="0.33" Zscore="-3.51" obsval="117.97"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.50" Zscore="3.00" obsval="119.98"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.19" Zscore="-2.23" obsval="122.05"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="2.02" Zscore="-4.90" obsval="115.94"/>
		<mog-angle-outlier atoms="C1,C6,C7" numobs="118" mean="115.65" stdev="2.71" mindiff="7.89" Zscore="5.23" obsval="129.85"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="97" mean="121.56" stdev="2.30" mindiff="2.44" Zscore="-3.19" obsval="114.20"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.15" Zscore="-3.27" obsval="117.52"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="11.61" Zscore="10.30" obsval="141.73"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="39.42" Zscore="19.37" obsval="179.32"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="19.26" Zscore="8.92" obsval="150.81"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.17" Zscore="3.56" obsval="124.61"/>
		<mog-angle-outlier atoms="C35,C13,C14" numobs="181" mean="122.82" stdev="1.62" mindiff="0.02" Zscore="-2.85" obsval="118.20"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="21.86" Zscore="13.58" obsval="151.30"/>
		<mog-angle-outlier atoms="C16,C17,C18" numobs="147" mean="127.28" stdev="1.40" mindiff="1.12" Zscore="2.83" obsval="131.24"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="22.41" Zscore="10.07" obsval="153.96"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="14.14" Zscore="10.64" obsval="154.04"/>
		<mog-angle-outlier atoms="C23,C22,C21" numobs="168" mean="119.01" stdev="1.57" mindiff="0.73" Zscore="4.31" obsval="125.78"/>
		<mog-angle-outlier atoms="C37,C22,C21" numobs="181" mean="122.82" stdev="1.62" mindiff="0.79" Zscore="-3.85" obsval="116.58"/>
		<clash atom="H383" dist="1.78" clashmag="0.66" cid="287"/>
		<clash atom="H23C" dist="1.78" clashmag="0.66" cid="287"/>
		<clash atom="H321" dist="1.85" clashmag="0.56" cid="288"/>
		<clash atom="HC8" dist="1.85" clashmag="0.56" cid="288"/>
		<clash atom="HC8" dist="2.48" clashmag="0.44" cid="289"/>
		<clash atom="C32" dist="2.48" clashmag="0.44" cid="289"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8000" Q_score="0.457" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.61" mogul_angles_rmsz="4.96" num-H-reduce="51" model="1" chain="B" resnum="843" said="TF" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="46.76" stdev="16.01" mindiff="26.64" local_density="0.00" obsval="-131.28"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="44.53" stdev="16.35" mindiff="25.90" local_density="0.00" obsval="46.51"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="32.08" stdev="17.85" mindiff="15.43" local_density="0.00" obsval="-145.71"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="18.73" stdev="17.26" mindiff="4.04" local_density="4.79" obsval="-158.34"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="20.49" stdev="16.86" mindiff="1.02" local_density="1.90" obsval="23.45"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="150" mean="162.89" stdev="32.94" mindiff="0.85" local_density="3.33" obsval="-5.19"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C36" numobs="160" mean="165.65" stdev="32.00" mindiff="0.12" local_density="3.12" obsval="177.15"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="61.68" stdev="47.94" mindiff="9.90" local_density="0.84" obsval="13.91"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C30" numobs="119" mean="57.96" stdev="48.86" mindiff="1.67" local_density="0.84" obsval="-163.53"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="4.03" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-5.05" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-4.11" obsval="1.30"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="5.92" obsval="1.50"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="0.39" Zscore="-2.43" obsval="119.42"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.17" Zscore="2.84" obsval="119.65"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.22" Zscore="-3.26" obsval="120.92"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.29" Zscore="-3.21" obsval="118.25"/>
		<mog-angle-outlier atoms="C1,C6,C7" numobs="118" mean="115.65" stdev="2.71" mindiff="2.42" Zscore="3.22" obsval="124.37"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.08" Zscore="2.63" obsval="122.11"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="1.35" Zscore="-4.19" obsval="116.02"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="9.63" Zscore="8.89" obsval="139.75"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="38.75" Zscore="19.13" obsval="178.64"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="21.09" Zscore="9.58" obsval="152.64"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.09" Zscore="2.06" obsval="122.25"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="2.20" Zscore="-6.38" obsval="118.33"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="28.22" Zscore="16.68" obsval="157.66"/>
		<mog-angle-outlier atoms="C16,C17,C18" numobs="147" mean="127.28" stdev="1.40" mindiff="1.50" Zscore="3.10" obsval="131.62"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.77" Zscore="4.33" obsval="125.82"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.02" Zscore="-2.85" obsval="118.19"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="25.22" Zscore="11.09" obsval="156.77"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="21.45" Zscore="13.16" obsval="161.34"/>
		<mog-angle-outlier atoms="C37,C22,C21" numobs="181" mean="122.82" stdev="1.62" mindiff="0.08" Zscore="-2.26" obsval="119.15"/>
		<mog-angle-outlier atoms="C37,C22,C23" numobs="317" mean="118.09" stdev="1.53" mindiff="0.35" Zscore="3.88" obsval="124.01"/>
		<mog-angle-outlier atoms="C23,C24,C25" numobs="153" mean="127.00" stdev="2.67" mindiff="2.13" Zscore="-2.86" obsval="119.37"/>
		<mog-angle-outlier atoms="C30,C25,C24" numobs="118" mean="115.65" stdev="2.71" mindiff="0.48" Zscore="2.50" obsval="122.44"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="0.64" Zscore="-3.89" obsval="117.33"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="99" mean="122.70" stdev="1.35" mindiff="0.19" Zscore="-3.40" obsval="118.11"/>
		<mog-angle-outlier atoms="C38,C26,C27" numobs="379" mean="113.60" stdev="2.13" mindiff="0.07" Zscore="2.33" obsval="118.56"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="188" mean="114.06" stdev="1.78" mindiff="1.87" Zscore="-4.85" obsval="105.42"/>
		<clash atom="H311" dist="1.87" clashmag="0.57" cid="305"/>
		<clash atom="HC8" dist="1.87" clashmag="0.57" cid="305"/>
		<clash atom="C19" dist="2.36" clashmag="0.56" cid="308"/>
		<clash atom="H321" dist="2.39" clashmag="0.52" cid="312"/>
		<clash atom="H321" dist="1.92" clashmag="0.52" cid="313"/>
		<clash atom="H272" dist="1.94" clashmag="0.51" cid="314"/>
		<clash atom="H383" dist="2.00" clashmag="0.43" cid="319"/>
		<clash atom="H23C" dist="2.00" clashmag="0.43" cid="319"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8000" Q_score="0.522" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.59" mogul_angles_rmsz="4.66" num-H-reduce="52" model="1" chain="B" resnum="844" said="UF" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="77.14" stdev="3.54" mindiff="59.66" local_density="0.00" obsval="98.25"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="74.69" stdev="4.30" mindiff="58.51" local_density="0.00" obsval="-79.12"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="53.41" stdev="6.80" mindiff="8.45" local_density="0.13" obsval="-120.55"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="56.18" stdev="9.76" mindiff="40.86" local_density="0.00" obsval="-120.27"/>
		<mog-torsion-outlier atoms="C21,C22,C23,C24" numobs="313" mean="162.23" stdev="22.32" mindiff="3.05" local_density="0.64" obsval="-8.13"/>
		<mog-torsion-outlier atoms="C37,C22,C23,C24" numobs="316" mean="157.84" stdev="22.37" mindiff="3.73" local_density="0.63" obsval="167.50"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="46.26" stdev="47.87" mindiff="5.59" local_density="4.20" obsval="-29.40"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="3.98" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-5.10" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="-3.70" obsval="1.31"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="6.00" obsval="1.50"/>
		<mog-angle-outlier atoms="C3,C4,C5" numobs="188" mean="114.06" stdev="1.78" mindiff="0.09" Zscore="-3.85" obsval="107.19"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.05" Zscore="2.38" obsval="118.68"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.17" Zscore="-3.23" obsval="120.96"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.00" Zscore="-2.03" obsval="119.86"/>
		<mog-angle-outlier atoms="C1,C6,C7" numobs="118" mean="115.65" stdev="2.71" mindiff="3.13" Zscore="3.48" obsval="125.09"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="97" mean="121.56" stdev="2.30" mindiff="1.72" Zscore="-2.88" obsval="114.91"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.14" Zscore="2.26" obsval="121.55"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.05" Zscore="-2.84" obsval="118.22"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="11.54" Zscore="10.25" obsval="141.66"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="38.72" Zscore="19.13" obsval="178.62"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="23.01" Zscore="10.28" obsval="154.56"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="0.64" Zscore="-2.41" obsval="123.90"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="20.67" Zscore="13.00" obsval="150.11"/>
		<mog-angle-outlier atoms="C16,C17,C18" numobs="147" mean="127.28" stdev="1.40" mindiff="0.43" Zscore="2.34" obsval="130.55"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.03" Zscore="2.32" obsval="122.67"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="26.07" Zscore="11.40" obsval="157.62"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="22.51" Zscore="13.53" obsval="162.41"/>
		<mog-angle-outlier atoms="C37,C22,C21" numobs="181" mean="122.82" stdev="1.62" mindiff="0.14" Zscore="-2.60" obsval="118.60"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="0.24" Zscore="-2.26" obsval="119.55"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="99" mean="122.70" stdev="1.35" mindiff="0.58" Zscore="-2.57" obsval="119.23"/>
		<mog-angle-outlier atoms="C38,C26,C25" numobs="104" mean="124.48" stdev="1.09" mindiff="0.13" Zscore="3.03" obsval="127.79"/>
		<mog-angle-outlier atoms="C39,C30,C25" numobs="316" mean="110.24" stdev="1.57" mindiff="0.23" Zscore="-2.86" obsval="105.76"/>
		<clash atom="H321" dist="1.75" clashmag="0.69" cid="196"/>
		<clash atom="H321" dist="2.44" clashmag="0.45" cid="213"/>
		<clash atom="HC8" dist="1.75" clashmag="0.69" cid="196"/>
		<clash atom="H10C" dist="1.80" clashmag="0.64" cid="197"/>
		<clash atom="H10C" dist="2.37" clashmag="0.55" cid="202"/>
		<clash atom="H362" dist="2.28" clashmag="0.64" cid="198"/>
		<clash atom="H362" dist="1.94" clashmag="0.49" cid="207"/>
		<clash atom="H23C" dist="2.41" clashmag="0.51" cid="205"/>
		<clash atom="C38" dist="2.41" clashmag="0.51" cid="205"/>
		<clash atom="C8" dist="2.44" clashmag="0.45" cid="213"/>
		<clash atom="H351" dist="1.72" clashmag="0.43" cid="216"/>
		<clash atom="H15C" dist="1.72" clashmag="0.43" cid="216"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8750" Q_score="0.555" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.60" mogul_angles_rmsz="4.58" num-H-reduce="52" model="1" chain="B" resnum="845" said="VF" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="55.20" stdev="48.81" mindiff="1.14" local_density="0.84" obsval="-160.71"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="58.10" stdev="47.94" mindiff="6.33" local_density="0.84" obsval="17.49"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="25.59" stdev="24.99" mindiff="3.62" local_density="0.67" obsval="154.29"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="22.28" stdev="25.44" mindiff="1.82" local_density="0.62" obsval="-22.43"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="25.62" stdev="12.70" mindiff="0.26" local_density="2.37" obsval="-149.80"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="36.69" stdev="16.30" mindiff="20.30" local_density="0.00" obsval="-140.84"/>
		<mog-torsion-outlier atoms="C12,C13,C14,C15" numobs="150" mean="167.44" stdev="33.00" mindiff="0.28" local_density="3.33" obsval="0.62"/>
		<mog-torsion-outlier atoms="C35,C13,C14,C15" numobs="160" mean="168.36" stdev="32.00" mindiff="0.12" local_density="3.12" obsval="-179.86"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="150" mean="163.58" stdev="33.00" mindiff="0.15" local_density="3.33" obsval="-4.49"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C36" numobs="160" mean="166.16" stdev="32.00" mindiff="0.04" local_density="3.12" obsval="177.66"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="57.92" stdev="47.94" mindiff="6.15" local_density="0.84" obsval="-17.67"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C30" numobs="119" mean="52.59" stdev="48.77" mindiff="3.79" local_density="0.84" obsval="158.06"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="4.04" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-4.95" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-3.89" obsval="1.31"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="6.02" obsval="1.51"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.14" Zscore="2.30" obsval="118.49"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.84" Zscore="-3.83" obsval="120.30"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.38" Zscore="-2.36" obsval="119.41"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.35" Zscore="2.45" obsval="121.84"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.10" Zscore="-3.42" obsval="117.27"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="11.24" Zscore="10.04" obsval="141.36"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="38.67" Zscore="19.11" obsval="178.57"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="13.85" Zscore="6.94" obsval="145.40"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="4.79" Zscore="6.88" obsval="129.84"/>
		<mog-angle-outlier atoms="C35,C13,C14" numobs="181" mean="122.82" stdev="1.62" mindiff="2.18" Zscore="-4.89" obsval="114.89"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="15.49" Zscore="10.46" obsval="144.93"/>
		<mog-angle-outlier atoms="C16,C17,C18" numobs="147" mean="127.28" stdev="1.40" mindiff="0.32" Zscore="2.25" obsval="130.44"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.26" Zscore="3.15" obsval="123.96"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="24.21" Zscore="10.72" obsval="155.75"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="26.05" Zscore="14.75" obsval="165.94"/>
		<mog-angle-outlier atoms="C37,C22,C21" numobs="181" mean="122.82" stdev="1.62" mindiff="0.29" Zscore="-3.54" obsval="117.08"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="0.41" Zscore="-3.72" obsval="117.55"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="99" mean="122.70" stdev="1.35" mindiff="0.16" Zscore="-3.38" obsval="118.14"/>
		<clash atom="H10C" dist="2.29" clashmag="0.67" cid="40"/>
		<clash atom="H382" dist="1.88" clashmag="0.55" cid="43"/>
		<clash atom="H23C" dist="1.88" clashmag="0.55" cid="43"/>
		<clash atom="H362" dist="1.92" clashmag="0.51" cid="44"/>
		<clash atom="C23" dist="2.42" clashmag="0.48" cid="45"/>
		<clash atom="H272" dist="2.02" clashmag="0.42" cid="49"/>
		<clash atom="H402" dist="2.02" clashmag="0.41" cid="50"/>
		<clash atom="C27" dist="2.51" clashmag="0.41" cid="51"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9091" Q_score="0.591" mogul_rmsz_numbonds="67" mogul_rmsz_numangles="81" mogul_bonds_rmsz="1.30" mogul_angles_rmsz="1.03" num-H-reduce="96" model="1" chain="B" resnum="846" said="WF" ent="31" seq="." icode=" " resname="DGD" altcode=" ">
		<mog-torsion-outlier atoms="C2A,C1A,O1G,C1G" numobs="2608" mean="38.90" stdev="4.73" mindiff="0.04" local_density="0.54" obsval="-134.89"/>
		<mog-torsion-outlier atoms="O1A,C1A,O1G,C1G" numobs="4533" mean="38.85" stdev="5.09" mindiff="0.23" local_density="0.79" obsval="45.22"/>
		<mog-torsion-outlier atoms="C3A,C4A,C5A,C6A" numobs="15585" mean="52.79" stdev="9.08" mindiff="0.02" local_density="0.82" obsval="120.01"/>
		<mog-torsion-outlier atoms="C6A,C7A,C8A,C9A" numobs="15585" mean="69.54" stdev="18.54" mindiff="0.09" local_density="1.03" obsval="-96.45"/>
		<mog-torsion-outlier atoms="C7A,C8A,C9A,CAA" numobs="15585" mean="33.05" stdev="21.50" mindiff="0.05" local_density="2.49" obsval="-148.75"/>
		<mog-torsion-outlier atoms="CAA,CBA,CCA,CDA" numobs="15585" mean="38.24" stdev="16.82" mindiff="0.04" local_density="1.56" obsval="-141.03"/>
		<mog-torsion-outlier atoms="CBA,CCA,CDA,CEA" numobs="15585" mean="156.76" stdev="38.50" mindiff="0.04" local_density="0.14" obsval="0.49"/>
		<mog-torsion-outlier atoms="CDA,CEA,CFA,CGA" numobs="15585" mean="81.23" stdev="27.88" mindiff="0.01" local_density="4.23" obsval="80.48"/>
		<mog-torsion-outlier atoms="CEA,CFA,CGA,CHA" numobs="15585" mean="157.15" stdev="38.50" mindiff="0.09" local_density="0.12" obsval="-0.09"/>
		<mog-torsion-outlier atoms="C2B,C3B,C4B,C5B" numobs="15585" mean="72.70" stdev="21.08" mindiff="0.04" local_density="1.31" obsval="-92.07"/>
		<mog-torsion-outlier atoms="CBB,CCB,CDB,CEB" numobs="15585" mean="156.81" stdev="38.50" mindiff="0.09" local_density="0.14" obsval="0.44"/>
		<mog-torsion-outlier atoms="CDB,CEB,CFB,CGB" numobs="15585" mean="28.46" stdev="25.97" mindiff="0.01" local_density="4.75" obsval="155.70"/>
		<mog-torsion-outlier atoms="CFB,CGB,CHB,CIB" numobs="12796" mean="33.39" stdev="26.95" mindiff="0.01" local_density="4.67" obsval="-151.50"/>
		<mog-torsion-outlier atoms="C2G,C1G,O1G,C1A" numobs="2678" mean="80.29" stdev="31.31" mindiff="0.79" local_density="0.93" obsval="62.52"/>
		<mog-torsion-outlier atoms="O1G,C1G,C2G,O2G" numobs="291" mean="41.73" stdev="27.27" mindiff="2.47" local_density="3.09" obsval="89.17"/>
		<mog-torsion-outlier atoms="O1G,C1G,C2G,C3G" numobs="248" mean="70.68" stdev="35.21" mindiff="1.75" local_density="1.61" obsval="-149.25"/>
		<mog-torsion-outlier atoms="C1G,C2G,C3G,O3G" numobs="248" mean="46.35" stdev="26.18" mindiff="0.87" local_density="3.63" obsval="-88.57"/>
		<mog-torsion-outlier atoms="O2G,C2G,C3G,O3G" numobs="291" mean="66.19" stdev="48.85" mindiff="1.54" local_density="2.06" obsval="32.01"/>
		<mog-torsion-outlier atoms="O6D,C5D,C6D,O5D" numobs="3285" mean="89.93" stdev="24.02" mindiff="0.04" local_density="3.53" obsval="-165.30"/>
		<mog-torsion-outlier atoms="O6E,C5E,C6E,O5E" numobs="8455" mean="25.58" stdev="14.96" mindiff="0.40" local_density="2.35" obsval="40.98"/>
		<mog-bond-outlier atoms="O1G,C1A" numobs="4555" mean="1.33" stdev="0.03" mindiff="0.00" Zscore="4.43" obsval="1.46"/>
		<mog-bond-outlier atoms="CAA,C9A" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.64" obsval="1.33"/>
		<mog-bond-outlier atoms="CDA,CCA" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.56" obsval="1.34"/>
		<mog-bond-outlier atoms="CGA,CFA" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.59" obsval="1.33"/>
		<mog-bond-outlier atoms="CAB,C9B" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.70" obsval="1.33"/>
		<mog-bond-outlier atoms="CDB,CCB" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.63" obsval="1.33"/>
		<mog-bond-outlier atoms="CGB,CFB" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.68" obsval="1.33"/>
		<mog-angle-outlier atoms="O1G,C1A,C2A" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.56" obsval="119.65"/>
		<mog-angle-outlier atoms="O2G,C1B,C2B" numobs="587" mean="111.48" stdev="2.16" mindiff="0.12" Zscore="3.48" obsval="119.01"/>
		<mog-angle-outlier atoms="O5D,C1E,C2E" numobs="170" mean="108.27" stdev="1.52" mindiff="0.03" Zscore="2.05" obsval="111.39"/>
		<clash atom="HBS1" dist="1.86" clashmag="0.58" cid="250"/>
		<clash atom="HBH2" dist="1.95" clashmag="0.49" cid="257"/>
		<clash atom="HAH2" dist="1.99" clashmag="0.43" cid="265"/>
		<clash atom="HAH2" dist="2.51" clashmag="0.40" cid="271"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.5250" Q_score="0.282" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.65" mogul_angles_rmsz="5.04" num-H-reduce="52" model="1" chain="B" resnum="847" said="XF" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="66.92" stdev="48.89" mindiff="10.65" local_density="0.00" obsval="-172.51"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="69.11" stdev="47.94" mindiff="17.33" local_density="0.00" obsval="6.48"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="162.42" stdev="22.33" mindiff="2.85" local_density="0.64" obsval="-7.93"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C34" numobs="316" mean="164.03" stdev="22.65" mindiff="3.53" local_density="0.63" obsval="173.74"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="120.34" stdev="15.58" mindiff="35.16" local_density="0.00" obsval="-51.29"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="119.01" stdev="14.48" mindiff="36.51" local_density="0.00" obsval="127.04"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="52.33" stdev="6.92" mindiff="9.58" local_density="0.13" obsval="-121.68"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="64.29" stdev="7.05" mindiff="49.41" local_density="0.00" obsval="-111.72"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="96.35" stdev="10.82" mindiff="24.73" local_density="0.00" obsval="76.02"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="97.70" stdev="11.30" mindiff="24.57" local_density="0.00" obsval="-105.41"/>
		<mog-torsion-outlier atoms="C12,C13,C14,C15" numobs="150" mean="166.27" stdev="33.00" mindiff="0.90" local_density="3.33" obsval="-1.80"/>
		<mog-torsion-outlier atoms="C35,C13,C14,C15" numobs="160" mean="168.09" stdev="32.00" mindiff="0.39" local_density="3.12" obsval="179.59"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="150" mean="162.13" stdev="32.67" mindiff="1.67" local_density="3.33" obsval="6.01"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C36" numobs="160" mean="163.29" stdev="31.93" mindiff="0.63" local_density="3.12" obsval="-174.78"/>
		<mog-torsion-outlier atoms="C18,C19,C20,C21" numobs="229" mean="163.12" stdev="26.38" mindiff="0.05" local_density="2.62" obsval="-7.42"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="4.04" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-5.13" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="-4.27" obsval="1.29"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="5.87" obsval="1.50"/>
		<mog-angle-outlier atoms="C2,C1,C6" numobs="132" mean="110.44" stdev="1.45" mindiff="0.02" Zscore="2.02" obsval="113.38"/>
		<mog-angle-outlier atoms="C31,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="0.03" Zscore="-2.70" obsval="106.01"/>
		<mog-angle-outlier atoms="C8,C7,C6" numobs="153" mean="127.00" stdev="2.67" mindiff="24.12" Zscore="12.09" obsval="159.30"/>
		<mog-angle-outlier atoms="C8,C9,C10" numobs="168" mean="119.01" stdev="1.57" mindiff="0.20" Zscore="2.49" obsval="122.92"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.08" Zscore="-2.57" obsval="118.65"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="15.44" Zscore="13.04" obsval="145.56"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="32.56" Zscore="17.00" obsval="172.45"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="23.94" Zscore="10.62" obsval="155.49"/>
		<mog-angle-outlier atoms="C35,C13,C12" numobs="317" mean="118.09" stdev="1.53" mindiff="0.20" Zscore="2.55" obsval="121.99"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="0.18" Zscore="-4.37" obsval="121.15"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="23.34" Zscore="14.30" obsval="152.78"/>
		<mog-angle-outlier atoms="C16,C17,C18" numobs="147" mean="127.28" stdev="1.40" mindiff="0.95" Zscore="2.70" obsval="131.07"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.14" Zscore="3.93" obsval="125.18"/>
		<mog-angle-outlier atoms="C36,C18,C19" numobs="317" mean="118.09" stdev="1.53" mindiff="0.12" Zscore="-2.08" obsval="114.91"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="21.38" Zscore="9.69" obsval="152.93"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="10.51" Zscore="9.39" obsval="150.40"/>
		<mog-angle-outlier atoms="C23,C22,C21" numobs="168" mean="119.01" stdev="1.57" mindiff="0.52" Zscore="-3.40" obsval="113.66"/>
		<mog-angle-outlier atoms="C37,C22,C23" numobs="317" mean="118.09" stdev="1.53" mindiff="0.94" Zscore="4.27" obsval="124.61"/>
		<mog-angle-outlier atoms="C24,C25,C26" numobs="97" mean="121.56" stdev="2.30" mindiff="0.03" Zscore="-2.00" obsval="116.94"/>
		<mog-angle-outlier atoms="C30,C25,C24" numobs="118" mean="115.65" stdev="2.71" mindiff="6.94" Zscore="4.88" obsval="128.90"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="4.61" Zscore="-6.79" obsval="113.35"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="99" mean="122.70" stdev="1.35" mindiff="5.78" Zscore="-7.54" obsval="112.52"/>
		<mog-angle-outlier atoms="C38,C26,C27" numobs="379" mean="113.60" stdev="2.13" mindiff="0.67" Zscore="3.92" obsval="121.96"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="188" mean="114.06" stdev="1.78" mindiff="0.11" Zscore="-2.51" obsval="109.59"/>
		<mog-angle-outlier atoms="C29,C30,C25" numobs="132" mean="110.44" stdev="1.45" mindiff="1.84" Zscore="-4.60" obsval="103.75"/>
		<mog-angle-outlier atoms="C39,C30,C25" numobs="316" mean="110.24" stdev="1.57" mindiff="0.05" Zscore="2.29" obsval="113.83"/>
		<clash atom="H393" dist="1.70" clashmag="0.74" cid="188"/>
		<clash atom="H23C" dist="1.70" clashmag="0.74" cid="188"/>
		<clash atom="H333" dist="1.76" clashmag="0.68" cid="189"/>
		<clash atom="H333" dist="2.45" clashmag="0.43" cid="191"/>
		<clash atom="H332" dist="1.79" clashmag="0.65" cid="190"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7429" Q_score="0.476" mogul_rmsz_numbonds="34" mogul_rmsz_numangles="37" mogul_bonds_rmsz="1.58" mogul_angles_rmsz="1.07" ligand_chirality_outlier="yes" num-H-reduce="40" model="1" chain="B" resnum="848" said="YF" ent="22" seq="." icode=" " resname="PGT" altcode=" ">
		<mog-torsion-outlier atoms="C43,C44,C45,C46" numobs="12796" mean="54.75" stdev="12.30" mindiff="0.02" local_density="1.42" obsval="-115.95"/>
		<mog-torsion-outlier atoms="C42,C43,C44,C45" numobs="15585" mean="42.90" stdev="13.15" mindiff="0.05" local_density="1.23" obsval="134.21"/>
		<mog-torsion-outlier atoms="C39,C40,C41,C42" numobs="15585" mean="41.48" stdev="14.20" mindiff="0.00" local_density="1.32" obsval="-136.28"/>
		<mog-torsion-outlier atoms="C38,C39,C40,C41" numobs="15585" mean="61.49" stdev="12.52" mindiff="0.11" local_density="0.76" obsval="107.69"/>
		<mog-torsion-outlier atoms="C36,C37,C38,C39" numobs="15585" mean="122.22" stdev="37.99" mindiff="0.02" local_density="0.53" obsval="35.19"/>
		<mog-torsion-outlier atoms="C34,C35,C36,C37" numobs="15585" mean="130.85" stdev="38.20" mindiff="0.47" local_density="0.32" obsval="26.49"/>
		<mog-torsion-outlier atoms="C32,C33,C34,C35" numobs="15585" mean="61.88" stdev="12.78" mindiff="0.01" local_density="0.78" obsval="107.14"/>
		<mog-torsion-outlier atoms="O2,C31,C32,C33" numobs="3091" mean="117.18" stdev="48.83" mindiff="0.01" local_density="2.94" obsval="-16.05"/>
		<mog-torsion-outlier atoms="O3P,C1,C2,O2" numobs="299" mean="56.35" stdev="18.48" mindiff="1.35" local_density="2.01" obsval="131.24"/>
		<mog-torsion-outlier atoms="O3P,C1,C2,C3" numobs="265" mean="54.79" stdev="15.03" mindiff="5.97" local_density="1.13" obsval="-110.78"/>
		<mog-torsion-outlier atoms="C1,O3P,P,O1P" numobs="40" mean="64.44" stdev="31.95" mindiff="7.44" local_density="2.50" obsval="139.59"/>
		<mog-torsion-outlier atoms="C1,O3P,P,O2P" numobs="40" mean="86.81" stdev="54.48" mindiff="16.39" local_density="0.00" obsval="14.44"/>
		<mog-torsion-outlier atoms="C1,O3P,P,O4P" numobs="40" mean="44.98" stdev="18.41" mindiff="13.34" local_density="0.00" obsval="-104.20"/>
		<mog-torsion-outlier atoms="C4,O4P,P,O3P" numobs="40" mean="56.46" stdev="43.36" mindiff="9.08" local_density="2.50" obsval="-28.20"/>
		<mog-torsion-outlier atoms="C4,O4P,P,O1P" numobs="40" mean="57.66" stdev="21.78" mindiff="11.58" local_density="0.00" obsval="89.13"/>
		<mog-torsion-outlier atoms="C4,O4P,P,O2P" numobs="40" mean="61.25" stdev="33.64" mindiff="7.56" local_density="2.50" obsval="-145.01"/>
		<mog-torsion-outlier atoms="C5,C4,O4P,P" numobs="474" mean="64.03" stdev="18.56" mindiff="0.82" local_density="1.90" obsval="-92.17"/>
		<mog-torsion-outlier atoms="O4P,C4,C5,O5" numobs="654" mean="66.28" stdev="29.80" mindiff="0.91" local_density="0.61" obsval="149.47"/>
		<mog-torsion-outlier atoms="O4P,C4,C5,C6" numobs="374" mean="46.07" stdev="22.57" mindiff="2.13" local_density="0.27" obsval="-93.66"/>
		<mog-torsion-outlier atoms="O11,C11,O3,C3" numobs="5079" mean="32.47" stdev="13.15" mindiff="0.38" local_density="1.46" obsval="37.23"/>
		<mog-torsion-outlier atoms="C12,C11,O3,C3" numobs="5078" mean="33.20" stdev="11.79" mindiff="0.75" local_density="0.79" obsval="-142.37"/>
		<mog-bond-outlier atoms="C32,C31" numobs="4894" mean="1.50" stdev="0.03" mindiff="0.00" Zscore="2.07" obsval="1.56"/>
		<mog-bond-outlier atoms="O2,C31" numobs="1553" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="2.44" obsval="1.41"/>
		<mog-bond-outlier atoms="C1,C2" numobs="780" mean="1.50" stdev="0.03" mindiff="0.00" Zscore="2.91" obsval="1.59"/>
		<mog-bond-outlier atoms="C3,C2" numobs="780" mean="1.50" stdev="0.03" mindiff="0.00" Zscore="2.89" obsval="1.59"/>
		<mog-bond-outlier atoms="P,O3P" numobs="40" mean="1.59" stdev="0.04" mindiff="0.02" Zscore="3.26" obsval="1.72"/>
		<mog-bond-outlier atoms="P,O4P" numobs="40" mean="1.59" stdev="0.04" mindiff="0.02" Zscore="3.05" obsval="1.71"/>
		<mog-bond-outlier atoms="C4,C5" numobs="653" mean="1.51" stdev="0.03" mindiff="0.00" Zscore="2.24" obsval="1.58"/>
		<mog-angle-outlier atoms="O2,C31,C32" numobs="587" mean="111.48" stdev="2.16" mindiff="0.45" Zscore="4.91" obsval="122.09"/>
		<mog-angle-outlier atoms="O2,C31,O31" numobs="1542" mean="123.70" stdev="2.34" mindiff="0.05" Zscore="-2.60" obsval="117.63"/>
		<chiral-outlier problem="WRONG HAND" atom="C5"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.5909" Q_score="0.436" mogul_rmsz_numbonds="67" mogul_rmsz_numangles="81" mogul_bonds_rmsz="1.32" mogul_angles_rmsz="1.04" num-H-reduce="96" model="1" chain="B" resnum="849" said="ZF" ent="31" seq="." icode=" " resname="DGD" altcode=" ">
		<mog-torsion-outlier atoms="C2A,C1A,O1G,C1G" numobs="2608" mean="34.26" stdev="4.61" mindiff="0.19" local_density="0.81" obsval="139.61"/>
		<mog-torsion-outlier atoms="O1A,C1A,O1G,C1G" numobs="4533" mean="35.71" stdev="4.86" mindiff="0.11" local_density="0.86" obsval="-42.00"/>
		<mog-torsion-outlier atoms="C1A,C2A,C3A,C4A" numobs="4310" mean="37.13" stdev="29.97" mindiff="0.01" local_density="2.55" obsval="-153.72"/>
		<mog-torsion-outlier atoms="C2A,C3A,C4A,C5A" numobs="15585" mean="34.37" stdev="20.27" mindiff="0.02" local_density="2.11" obsval="-146.76"/>
		<mog-torsion-outlier atoms="C6A,C7A,C8A,C9A" numobs="15585" mean="71.99" stdev="20.51" mindiff="0.02" local_density="1.23" obsval="93.05"/>
		<mog-torsion-outlier atoms="C2B,C1B,O2G,C2G" numobs="1189" mean="101.19" stdev="5.99" mindiff="11.55" local_density="0.00" obsval="71.84"/>
		<mog-torsion-outlier atoms="O1B,C1B,O2G,C2G" numobs="1497" mean="101.74" stdev="6.15" mindiff="17.38" local_density="0.00" obsval="-108.60"/>
		<mog-torsion-outlier atoms="C3B,C4B,C5B,C6B" numobs="15585" mean="38.62" stdev="16.50" mindiff="0.03" local_density="1.51" obsval="-140.47"/>
		<mog-torsion-outlier atoms="C1G,C2G,C3G,O3G" numobs="248" mean="52.37" stdev="16.77" mindiff="1.75" local_density="1.21" obsval="104.87"/>
		<mog-torsion-outlier atoms="O2G,C2G,C3G,O3G" numobs="291" mean="57.74" stdev="21.36" mindiff="0.46" local_density="1.72" obsval="-135.27"/>
		<mog-torsion-outlier atoms="C2G,C3G,O3G,C1D" numobs="104" mean="79.79" stdev="27.17" mindiff="2.32" local_density="0.96" obsval="71.51"/>
		<mog-torsion-outlier atoms="C2D,C1D,O3G,C3G" numobs="332" mean="93.87" stdev="15.06" mindiff="0.43" local_density="0.90" obsval="70.76"/>
		<mog-torsion-outlier atoms="O6D,C1D,O3G,C3G" numobs="448" mean="96.99" stdev="9.99" mindiff="38.78" local_density="0.00" obsval="-168.67"/>
		<mog-torsion-outlier atoms="C2E,C1E,O5D,C6D" numobs="332" mean="41.45" stdev="9.31" mindiff="6.53" local_density="0.60" obsval="-125.56"/>
		<mog-torsion-outlier atoms="O6E,C1E,O5D,C6D" numobs="448" mean="42.72" stdev="9.78" mindiff="3.41" local_density="0.45" obsval="114.34"/>
		<mog-torsion-outlier atoms="O6E,C5E,C6E,O5E" numobs="8455" mean="110.41" stdev="15.22" mindiff="0.04" local_density="1.10" obsval="-176.81"/>
		<mog-bond-outlier atoms="O1G,C1A" numobs="4555" mean="1.33" stdev="0.03" mindiff="0.00" Zscore="4.30" obsval="1.45"/>
		<mog-bond-outlier atoms="CAA,C9A" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.69" obsval="1.33"/>
		<mog-bond-outlier atoms="CDA,CCA" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.69" obsval="1.33"/>
		<mog-bond-outlier atoms="CGA,CFA" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.68" obsval="1.33"/>
		<mog-bond-outlier atoms="CAB,C9B" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.69" obsval="1.33"/>
		<mog-bond-outlier atoms="CDB,CCB" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.68" obsval="1.33"/>
		<mog-bond-outlier atoms="CGB,CFB" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.68" obsval="1.33"/>
		<mog-bond-outlier atoms="O3G,C1D" numobs="572" mean="1.40" stdev="0.02" mindiff="0.00" Zscore="2.24" obsval="1.43"/>
		<mog-angle-outlier atoms="O1G,C1A,C2A" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.69" obsval="120.04"/>
		<mog-angle-outlier atoms="O2G,C1B,C2B" numobs="587" mean="111.48" stdev="2.16" mindiff="0.79" Zscore="4.34" obsval="120.86"/>
		<mog-angle-outlier atoms="O2G,C1B,O1B" numobs="1542" mean="123.70" stdev="2.34" mindiff="0.05" Zscore="-2.03" obsval="118.96"/>
		<mog-angle-outlier atoms="C3G,O3G,C1D" numobs="137" mean="113.80" stdev="2.14" mindiff="0.68" Zscore="2.19" obsval="118.50"/>
		<mog-angle-outlier atoms="O3G,C1D,C2D" numobs="170" mean="108.27" stdev="1.52" mindiff="0.02" Zscore="2.45" obsval="112.00"/>
		<mog-angle-outlier atoms="O6D,C5D,C6D" numobs="3320" mean="106.69" stdev="1.98" mindiff="0.02" Zscore="2.10" obsval="110.86"/>
		<clash atom="HAT1" dist="1.89" clashmag="0.53" cid="65"/>
		<clash atom="HA51" dist="2.02" clashmag="0.40" cid="67"/>
		<clash atom="HA92" dist="2.02" clashmag="0.40" cid="67"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.4545" Q_score="0.303" mogul_rmsz_numbonds="67" mogul_rmsz_numangles="81" mogul_bonds_rmsz="1.29" mogul_angles_rmsz="1.05" num-H-reduce="96" model="1" chain="B" resnum="850" said="AG" ent="31" seq="." icode=" " resname="DGD" altcode=" ">
		<mog-torsion-outlier atoms="O1G,C1A,C2A,C3A" numobs="3091" mean="51.15" stdev="20.12" mindiff="0.04" local_density="4.92" obsval="-109.27"/>
		<mog-torsion-outlier atoms="C2A,C1A,O1G,C1G" numobs="2608" mean="39.34" stdev="4.73" mindiff="0.40" local_density="0.50" obsval="-134.44"/>
		<mog-torsion-outlier atoms="O1A,C1A,O1G,C1G" numobs="4533" mean="39.98" stdev="5.12" mindiff="0.03" local_density="0.73" obsval="46.35"/>
		<mog-torsion-outlier atoms="C2A,C3A,C4A,C5A" numobs="15585" mean="59.75" stdev="11.44" mindiff="0.08" local_density="0.74" obsval="-110.14"/>
		<mog-torsion-outlier atoms="C5A,C6A,C7A,C8A" numobs="15585" mean="29.58" stdev="24.86" mindiff="0.02" local_density="3.96" obsval="153.97"/>
		<mog-torsion-outlier atoms="CBA,CCA,CDA,CEA" numobs="15585" mean="156.18" stdev="38.50" mindiff="0.38" local_density="0.15" obsval="-1.07"/>
		<mog-torsion-outlier atoms="CEA,CFA,CGA,CHA" numobs="15585" mean="156.96" stdev="38.50" mindiff="0.24" local_density="0.14" obsval="-0.29"/>
		<mog-torsion-outlier atoms="C2B,C1B,O2G,C2G" numobs="1189" mean="106.73" stdev="6.15" mindiff="6.00" local_density="0.08" obsval="-66.29"/>
		<mog-torsion-outlier atoms="O1B,C1B,O2G,C2G" numobs="1497" mean="107.67" stdev="6.15" mindiff="23.32" local_density="0.00" obsval="114.53"/>
		<mog-torsion-outlier atoms="C3B,C4B,C5B,C6B" numobs="15585" mean="76.21" stdev="23.95" mindiff="0.01" local_density="2.01" obsval="-87.25"/>
		<mog-torsion-outlier atoms="CBB,CCB,CDB,CEB" numobs="15585" mean="156.96" stdev="38.50" mindiff="0.24" local_density="0.14" obsval="0.29"/>
		<mog-torsion-outlier atoms="C2D,C1D,O3G,C3G" numobs="332" mean="68.99" stdev="10.42" mindiff="11.44" local_density="0.00" obsval="96.68"/>
		<mog-torsion-outlier atoms="O6D,C1D,O3G,C3G" numobs="448" mean="70.25" stdev="9.99" mindiff="12.04" local_density="0.00" obsval="-141.92"/>
		<mog-torsion-outlier atoms="C4D,C5D,C6D,O5D" numobs="3245" mean="55.70" stdev="22.54" mindiff="0.27" local_density="0.68" obsval="-90.40"/>
		<mog-torsion-outlier atoms="O6D,C5D,C6D,O5D" numobs="3285" mean="74.57" stdev="16.67" mindiff="0.11" local_density="0.52" obsval="147.68"/>
		<mog-torsion-outlier atoms="O6E,C5E,C6E,O5E" numobs="8455" mean="106.57" stdev="14.93" mindiff="0.09" local_density="1.23" obsval="-172.94"/>
		<mog-bond-outlier atoms="O1G,C1A" numobs="4555" mean="1.33" stdev="0.03" mindiff="0.00" Zscore="4.30" obsval="1.45"/>
		<mog-bond-outlier atoms="CAA,C9A" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.65" obsval="1.33"/>
		<mog-bond-outlier atoms="CDA,CCA" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.59" obsval="1.33"/>
		<mog-bond-outlier atoms="CGA,CFA" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.62" obsval="1.33"/>
		<mog-bond-outlier atoms="CAB,C9B" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.68" obsval="1.33"/>
		<mog-bond-outlier atoms="CDB,CCB" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.63" obsval="1.33"/>
		<mog-bond-outlier atoms="CGB,CFB" numobs="17191" mean="1.51" stdev="0.05" mindiff="0.00" Zscore="-3.69" obsval="1.33"/>
		<mog-angle-outlier atoms="O1G,C1A,C2A" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.65" obsval="119.93"/>
		<mog-angle-outlier atoms="O2G,C1B,C2B" numobs="587" mean="111.48" stdev="2.16" mindiff="0.85" Zscore="4.31" obsval="120.80"/>
		<mog-angle-outlier atoms="O2G,C1B,O1B" numobs="1542" mean="123.70" stdev="2.34" mindiff="0.04" Zscore="-2.28" obsval="118.38"/>
		<clash atom="HAF1" dist="1.90" clashmag="0.54" cid="419"/>
		<clash atom="HAT1" dist="1.90" clashmag="0.54" cid="419"/>
		<clash atom="HD2" dist="2.03" clashmag="0.41" cid="420"/>
		<clash atom="HAH1" dist="2.03" clashmag="0.41" cid="420"/>
		<clash atom="HAH2" dist="2.03" clashmag="0.40" cid="421"/>
		<clash atom="HAV1" dist="2.03" clashmag="0.40" cid="421"/>
	</ModelledSubgroup>
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		<mog-torsion-outlier atoms="O1,C1,C2,C3" numobs="154" mean="53.95" stdev="26.08" mindiff="17.34" local_density="0.00" obsval="-141.23"/>
		<mog-torsion-outlier atoms="C4,O6,P,O3" numobs="40" mean="80.88" stdev="33.20" mindiff="11.06" local_density="0.00" obsval="-159.43"/>
		<mog-torsion-outlier atoms="C4,O6,P,O4" numobs="40" mean="49.00" stdev="28.16" mindiff="12.05" local_density="0.00" obsval="86.24"/>
		<mog-torsion-outlier atoms="O6,C4,C5,C6" numobs="265" mean="46.86" stdev="26.48" mindiff="0.64" local_density="3.77" obsval="-88.33"/>
		<mog-torsion-outlier atoms="O6,C4,C5,O7" numobs="299" mean="65.53" stdev="48.64" mindiff="1.35" local_density="2.01" obsval="32.19"/>
		<mog-torsion-outlier atoms="C4,C5,C6,O8" numobs="248" mean="58.78" stdev="17.05" mindiff="1.76" local_density="1.61" obsval="121.18"/>
		<mog-torsion-outlier atoms="O7,C5,C6,O8" numobs="291" mean="97.51" stdev="49.05" mindiff="22.02" local_density="0.00" obsval="0.54"/>
		<mog-torsion-outlier atoms="O9,C7,O7,C5" numobs="1497" mean="82.96" stdev="6.06" mindiff="1.41" local_density="0.07" obsval="89.81"/>
		<mog-torsion-outlier atoms="C8,C7,O7,C5" numobs="1189" mean="83.37" stdev="5.60" mindiff="29.39" local_density="0.00" obsval="-89.69"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="4310" mean="51.98" stdev="8.02" mindiff="0.38" local_density="0.32" obsval="121.91"/>
		<mog-torsion-outlier atoms="O10,C23,O8,C6" numobs="4533" mean="39.23" stdev="5.10" mindiff="0.61" local_density="0.77" obsval="45.60"/>
		<mog-torsion-outlier atoms="C24,C23,O8,C6" numobs="2608" mean="41.31" stdev="4.75" mindiff="2.39" local_density="0.54" obsval="-132.46"/>
		<mog-torsion-outlier atoms="O8,C23,C24,C25" numobs="3091" mean="56.97" stdev="21.86" mindiff="0.03" local_density="4.34" obsval="97.38"/>
		<mog-torsion-outlier atoms="O10,C23,C24,C25" numobs="4149" mean="56.08" stdev="22.46" mindiff="0.05" local_density="4.72" obsval="-80.65"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="4310" mean="46.50" stdev="13.79" mindiff="0.20" local_density="0.42" obsval="-133.52"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="12796" mean="77.02" stdev="28.68" mindiff="0.03" local_density="4.03" obsval="82.03"/>
		<mog-torsion-outlier atoms="C24,C25,C26,C27" numobs="15585" mean="65.46" stdev="15.33" mindiff="0.08" local_density="0.81" obsval="102.13"/>
		<mog-torsion-outlier atoms="C26,C27,C28,C29" numobs="15585" mean="77.25" stdev="24.83" mindiff="0.00" local_density="2.32" obsval="-85.82"/>
		<mog-torsion-outlier atoms="C28,C29,C30,C31" numobs="15585" mean="72.21" stdev="20.68" mindiff="0.05" local_density="1.23" obsval="-92.76"/>
		<mog-torsion-outlier atoms="C29,C30,C31,C32" numobs="15585" mean="75.44" stdev="23.31" mindiff="0.03" local_density="1.83" obsval="-88.31"/>
		<mog-torsion-outlier atoms="C31,C32,C33,C34" numobs="15585" mean="34.52" stdev="20.14" mindiff="0.07" local_density="2.08" obsval="-146.53"/>
		<mog-torsion-outlier atoms="C33,C34,C35,C36" numobs="15585" mean="53.08" stdev="9.10" mindiff="0.01" local_density="0.81" obsval="119.59"/>
		<mog-torsion-outlier atoms="C35,C36,C37,C38" numobs="12796" mean="32.94" stdev="27.49" mindiff="0.01" local_density="4.99" obsval="-152.30"/>
		<mog-angle-outlier atoms="C5,O7,C7" numobs="319" mean="117.80" stdev="2.39" mindiff="0.02" Zscore="-2.56" obsval="111.67"/>
		<mog-angle-outlier atoms="O7,C7,C8" numobs="587" mean="111.48" stdev="2.16" mindiff="0.16" Zscore="3.59" obsval="119.24"/>
		<mog-angle-outlier atoms="O8,C23,C24" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.07" Zscore="2.36" obsval="119.02"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="1.0000" Q_score="0.648" mogul-ignore="yes" model="1" chain="B" resnum="852" said="CG" ent="32" seq="." icode=" " resname="CA" altcode=" "/>
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	<ModelledSubgroup residue_inclusion="0.6250" Q_score="0.385" mogul_rmsz_numbonds="47" mogul_rmsz_numangles="50" mogul_bonds_rmsz="0.88" mogul_angles_rmsz="1.04" num-H-reduce="75" model="1" chain="B" resnum="854" said="EG" ent="29" seq="." icode=" " resname="3PH" altcode=" ">
		<mog-torsion-outlier atoms="O11,C1,C2,O21" numobs="299" mean="41.75" stdev="26.38" mindiff="2.33" local_density="2.68" obsval="-90.19"/>
		<mog-torsion-outlier atoms="O11,C1,C2,C3" numobs="265" mean="70.34" stdev="36.12" mindiff="1.04" local_density="2.26" obsval="150.22"/>
		<mog-torsion-outlier atoms="O22,C21,O21,C2" numobs="1497" mean="42.15" stdev="5.26" mindiff="0.88" local_density="0.60" obsval="-48.89"/>
		<mog-torsion-outlier atoms="C22,C21,O21,C2" numobs="1189" mean="41.27" stdev="5.20" mindiff="2.14" local_density="0.59" obsval="131.89"/>
		<mog-torsion-outlier atoms="C21,C22,C23,C24" numobs="4310" mean="68.11" stdev="28.61" mindiff="0.08" local_density="2.46" obsval="88.51"/>
		<mog-torsion-outlier atoms="C22,C23,C24,C25" numobs="15585" mean="32.51" stdev="22.01" mindiff="0.03" local_density="2.64" obsval="-149.56"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="15585" mean="33.18" stdev="21.38" mindiff="0.02" local_density="2.43" obsval="-148.55"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C2A" numobs="15585" mean="70.02" stdev="18.94" mindiff="0.00" local_density="1.07" obsval="95.77"/>
		<mog-torsion-outlier atoms="C28,C29,C2A,C2B" numobs="15585" mean="78.92" stdev="26.13" mindiff="0.02" local_density="3.02" obsval="83.56"/>
		<mog-torsion-outlier atoms="C29,C2A,C2B,C2C" numobs="15585" mean="64.59" stdev="14.70" mindiff="0.05" local_density="0.82" obsval="103.35"/>
		<mog-torsion-outlier atoms="C2A,C2B,C2C,C2D" numobs="15585" mean="81.45" stdev="28.05" mindiff="0.02" local_density="4.37" obsval="80.19"/>
		<mog-torsion-outlier atoms="C2B,C2C,C2D,C2E" numobs="15585" mean="77.84" stdev="25.33" mindiff="0.04" local_density="2.52" obsval="85.00"/>
		<mog-torsion-outlier atoms="C2C,C2D,C2E,C2F" numobs="15585" mean="74.43" stdev="22.48" mindiff="0.00" local_density="1.59" obsval="89.70"/>
		<mog-torsion-outlier atoms="C2D,C2E,C2F,C2G" numobs="15585" mean="32.00" stdev="22.49" mindiff="0.04" local_density="2.87" obsval="-150.32"/>
		<mog-torsion-outlier atoms="O32,C31,O31,C3" numobs="4533" mean="79.60" stdev="6.56" mindiff="3.49" local_density="0.13" obsval="-86.24"/>
		<mog-torsion-outlier atoms="C32,C31,O31,C3" numobs="2608" mean="80.01" stdev="6.28" mindiff="3.73" local_density="0.15" obsval="93.45"/>
		<mog-torsion-outlier atoms="O31,C31,C32,C33" numobs="3091" mean="53.43" stdev="20.52" mindiff="0.04" local_density="4.46" obsval="104.39"/>
		<mog-torsion-outlier atoms="O32,C31,C32,C33" numobs="4149" mean="54.14" stdev="22.32" mindiff="0.08" local_density="4.77" obsval="-75.93"/>
		<mog-torsion-outlier atoms="C32,C33,C34,C35" numobs="15585" mean="33.04" stdev="21.51" mindiff="0.04" local_density="2.49" obsval="148.76"/>
		<mog-torsion-outlier atoms="C33,C34,C35,C36" numobs="15585" mean="80.26" stdev="27.14" mindiff="0.01" local_density="3.62" obsval="-81.77"/>
		<mog-torsion-outlier atoms="C34,C35,C36,C37" numobs="15585" mean="39.05" stdev="16.14" mindiff="0.05" local_density="1.48" obsval="139.84"/>
		<mog-torsion-outlier atoms="C37,C38,C39,C3A" numobs="15585" mean="40.52" stdev="14.93" mindiff="0.01" local_density="1.37" obsval="-137.68"/>
		<mog-torsion-outlier atoms="C38,C39,C3A,C3B" numobs="15585" mean="29.39" stdev="25.04" mindiff="0.00" local_density="4.06" obsval="154.25"/>
		<mog-torsion-outlier atoms="C3B,C3C,C3D,C3E" numobs="15585" mean="63.97" stdev="14.26" mindiff="0.10" local_density="0.81" obsval="104.20"/>
		<mog-torsion-outlier atoms="C3D,C3E,C3F,C3G" numobs="15585" mean="69.51" stdev="18.52" mindiff="0.05" local_density="1.03" obsval="96.48"/>
		<mog-torsion-outlier atoms="C3E,C3F,C3G,C3H" numobs="15585" mean="74.50" stdev="22.54" mindiff="0.02" local_density="1.59" obsval="-89.60"/>
		<mog-bond-outlier atoms="O21,C2" numobs="2309" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="-2.67" obsval="1.40"/>
		<mog-bond-outlier atoms="O21,C21" numobs="1553" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="2.15" obsval="1.40"/>
		<mog-bond-outlier atoms="O31,C3" numobs="4622" mean="1.45" stdev="0.02" mindiff="0.00" Zscore="-2.11" obsval="1.40"/>
		<mog-bond-outlier atoms="O31,C31" numobs="4555" mean="1.33" stdev="0.03" mindiff="0.00" Zscore="2.46" obsval="1.40"/>
		<mog-angle-outlier atoms="O21,C21,C22" numobs="587" mean="111.48" stdev="2.16" mindiff="0.02" Zscore="3.89" obsval="119.90"/>
		<mog-angle-outlier atoms="O31,C31,C32" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.17" Zscore="2.61" obsval="119.79"/>
	</ModelledSubgroup>
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		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="141.75" stdev="24.65" mindiff="11.90" local_density="0.00" obsval="-28.03"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="141.90" stdev="23.83" mindiff="11.76" local_density="0.00" obsval="151.79"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="50.44" stdev="7.17" mindiff="11.57" local_density="0.00" obsval="123.67"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="45.92" stdev="13.20" mindiff="30.03" local_density="0.00" obsval="131.10"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="31.36" stdev="13.08" mindiff="17.53" local_density="0.00" obsval="-144.84"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="30.25" stdev="13.58" mindiff="9.41" local_density="0.32" obsval="33.88"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="150" mean="160.24" stdev="32.01" mindiff="3.70" local_density="4.00" obsval="8.03"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C36" numobs="160" mean="163.15" stdev="31.88" mindiff="0.78" local_density="3.12" obsval="-174.63"/>
		<mog-torsion-outlier atoms="C18,C19,C20,C21" numobs="229" mean="161.45" stdev="25.82" mindiff="0.77" local_density="2.62" obsval="-9.19"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="3.98" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-5.09" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="-4.17" obsval="1.30"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="6.03" obsval="1.51"/>
		<mog-angle-outlier atoms="C31,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="0.17" Zscore="-2.34" obsval="106.57"/>
		<mog-angle-outlier atoms="C32,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="0.52" Zscore="3.17" obsval="115.21"/>
		<mog-angle-outlier atoms="C3,C4,C5" numobs="188" mean="114.06" stdev="1.78" mindiff="0.18" Zscore="-3.70" obsval="107.46"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="0.12" Zscore="-3.17" obsval="118.42"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.24" Zscore="3.28" obsval="120.58"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.16" Zscore="-3.21" obsval="120.98"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="1.11" Zscore="-4.23" obsval="116.85"/>
		<mog-angle-outlier atoms="C1,C6,C7" numobs="118" mean="115.65" stdev="2.71" mindiff="6.89" Zscore="4.87" obsval="128.85"/>
		<mog-angle-outlier atoms="C7,C6,C5" numobs="97" mean="121.56" stdev="2.30" mindiff="2.40" Zscore="-3.18" obsval="114.23"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.16" Zscore="2.58" obsval="122.02"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="14.27" Zscore="12.20" obsval="144.39"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="38.37" Zscore="19.00" obsval="178.26"/>
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		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.31" Zscore="2.29" obsval="137.28"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.55" Zscore="4.81" obsval="119.64"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.32" obsval="119.34"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="1.81" Zscore="2.16" obsval="116.41"/>
		<clash atom="HHC" dist="1.86" clashmag="0.55" cid="408"/>
		<clash atom="HHC" dist="2.45" clashmag="0.47" cid="413"/>
		<clash atom="HBB1" dist="1.86" clashmag="0.55" cid="408"/>
		<clash atom="HMC1" dist="1.90" clashmag="0.54" cid="409"/>
		<clash atom="CBB" dist="2.45" clashmag="0.47" cid="413"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8769" Q_score="0.568" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="2.08" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="F" resnum="202" said="JG" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="75.99" stdev="31.91" mindiff="10.90" local_density="0.00" obsval="78.43"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="41.47" stdev="29.20" mindiff="6.83" local_density="1.55" obsval="-35.24"/>
		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="48.98" stdev="9.35" mindiff="0.08" local_density="0.43" obsval="-124.00"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="81.71" stdev="39.37" mindiff="3.73" local_density="0.70" obsval="-52.04"/>
		<mog-torsion-outlier atoms="C2C,C3C,CAC,CBC" numobs="10552" mean="28.99" stdev="9.41" mindiff="0.27" local_density="1.08" obsval="123.12"/>
		<mog-torsion-outlier atoms="C4C,C3C,CAC,CBC" numobs="10557" mean="25.58" stdev="10.91" mindiff="0.02" local_density="4.19" obsval="-57.62"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="31.14" stdev="1.74" mindiff="3.06" local_density="0.08" obsval="-143.60"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="30.76" stdev="3.03" mindiff="0.48" local_density="0.32" obsval="36.10"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="28.88" stdev="21.95" mindiff="0.05" local_density="4.85" obsval="151.04"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="106.58" stdev="34.89" mindiff="0.05" local_density="4.67" obsval="52.24"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="31.06" stdev="20.15" mindiff="0.10" local_density="3.16" obsval="-148.02"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="83.90" stdev="27.03" mindiff="0.04" local_density="4.44" obsval="-77.94"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="53.73" stdev="25.46" mindiff="0.04" local_density="1.85" obsval="93.24"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="55.34" stdev="29.88" mindiff="0.41" local_density="1.63" obsval="-143.51"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.27" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.84" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.06" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.51" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.32" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.10" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.20" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.89" Zscore="9.95" obsval="111.22"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.08" Zscore="-2.26" obsval="121.27"/>
		<mog-angle-outlier atoms="CMA,C3A,C2A" numobs="98" mean="113.98" stdev="3.87" mindiff="1.15" Zscore="3.15" obsval="126.16"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="6.87" Zscore="5.72" obsval="127.15"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.01" Zscore="2.15" obsval="118.39"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.93" Zscore="-3.59" obsval="107.33"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.09" Zscore="2.53" obsval="112.64"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.02" Zscore="-2.35" obsval="104.51"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.00" Zscore="-2.18" obsval="104.78"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.25" Zscore="2.21" obsval="112.31"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.67" Zscore="-2.05" obsval="103.03"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.08" Zscore="5.03" obsval="133.58"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.26" Zscore="2.32" obsval="137.33"/>
		<mog-angle-outlier atoms="OBD,CAD,C3D" numobs="108" mean="128.42" stdev="2.34" mindiff="0.26" Zscore="-2.07" obsval="123.57"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.22" Zscore="-2.41" obsval="119.77"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.69" Zscore="5.70" obsval="121.19"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.47" obsval="119.04"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.72" Zscore="2.92" obsval="119.33"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="2.66" Zscore="-3.45" obsval="120.55"/>
		<clash atom="CBB" dist="2.42" clashmag="0.49" cid="410"/>
		<clash atom="HHC" dist="2.42" clashmag="0.49" cid="410"/>
		<clash atom="HHC" dist="1.97" clashmag="0.46" cid="414"/>
		<clash atom="HBC2" dist="1.95" clashmag="0.49" cid="411"/>
		<clash atom="HHD" dist="1.95" clashmag="0.49" cid="411"/>
		<clash atom="HBB2" dist="1.95" clashmag="0.48" cid="412"/>
		<clash atom="HBB2" dist="2.00" clashmag="0.44" cid="415"/>
		<clash atom="HBB1" dist="1.97" clashmag="0.46" cid="414"/>
		<chiral-outlier problem="PLANAR" atom="C3A"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9000" Q_score="0.6" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.60" mogul_angles_rmsz="4.89" num-H-reduce="53" model="1" chain="F" resnum="203" said="KG" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="58.62" stdev="48.88" mindiff="2.34" local_density="0.84" obsval="-164.20"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="60.29" stdev="47.94" mindiff="8.51" local_density="0.84" obsval="15.30"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="20.44" stdev="14.09" mindiff="0.83" local_density="3.42" obsval="155.34"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="27.38" stdev="19.44" mindiff="10.46" local_density="0.00" obsval="150.67"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="57.44" stdev="6.78" mindiff="4.98" local_density="0.64" obsval="-117.04"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="59.38" stdev="6.61" mindiff="4.49" local_density="0.63" obsval="64.98"/>
		<mog-torsion-outlier atoms="C21,C22,C23,C24" numobs="313" mean="164.86" stdev="22.44" mindiff="0.40" local_density="0.32" obsval="-5.48"/>
		<mog-torsion-outlier atoms="C37,C22,C23,C24" numobs="316" mean="163.44" stdev="22.62" mindiff="4.12" local_density="0.63" obsval="173.15"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="4.02" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-5.05" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-3.85" obsval="1.31"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.01" Zscore="5.82" obsval="1.50"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.05" Zscore="2.40" obsval="118.72"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.79" Zscore="-3.80" obsval="120.34"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.50" Zscore="-2.45" obsval="119.29"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.06" Zscore="2.13" obsval="121.34"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="18.56" Zscore="15.27" obsval="148.69"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="34.05" Zscore="17.51" obsval="173.94"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="25.06" Zscore="11.03" obsval="156.61"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.51" Zscore="-3.40" obsval="113.67"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="15.45" Zscore="10.45" obsval="144.89"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="3.53" Zscore="6.09" obsval="128.58"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.44" Zscore="-3.63" obsval="116.93"/>
		<mog-angle-outlier atoms="C36,C18,C19" numobs="317" mean="118.09" stdev="1.53" mindiff="0.01" Zscore="-2.38" obsval="114.45"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="20.44" Zscore="9.35" obsval="151.99"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="29.50" Zscore="15.94" obsval="169.40"/>
		<mog-angle-outlier atoms="C23,C22,C21" numobs="168" mean="119.01" stdev="1.57" mindiff="0.01" Zscore="2.86" obsval="123.51"/>
		<mog-angle-outlier atoms="C24,C25,C26" numobs="97" mean="121.56" stdev="2.30" mindiff="0.48" Zscore="-2.34" obsval="116.16"/>
		<mog-angle-outlier atoms="C30,C25,C24" numobs="118" mean="115.65" stdev="2.71" mindiff="2.50" Zscore="3.25" obsval="124.46"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="0.47" Zscore="-2.43" obsval="119.32"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="99" mean="122.70" stdev="1.35" mindiff="0.66" Zscore="-3.75" obsval="117.64"/>
		<mog-angle-outlier atoms="C38,C26,C27" numobs="379" mean="113.60" stdev="2.13" mindiff="0.07" Zscore="2.46" obsval="118.84"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="188" mean="114.06" stdev="1.78" mindiff="3.01" Zscore="-5.49" obsval="104.28"/>
		<clash atom="H381" dist="1.90" clashmag="0.54" cid="409"/>
		<clash atom="HC41" dist="1.95" clashmag="0.48" cid="412"/>
		<clash atom="HC31" dist="2.00" clashmag="0.44" cid="415"/>
		<clash atom="H23C" dist="2.01" clashmag="0.43" cid="416"/>
		<clash atom="H392" dist="2.01" clashmag="0.43" cid="416"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8000" Q_score="0.54" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.37" mogul_angles_rmsz="1.76" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="F" resnum="204" said="LG" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="89.81" stdev="6.71" mindiff="0.98" local_density="0.12" obsval="-83.61"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="89.09" stdev="6.75" mindiff="1.11" local_density="0.04" obsval="95.75"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="67.05" stdev="39.17" mindiff="0.27" local_density="3.86" obsval="-66.83"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="52.16" stdev="1.81" mindiff="15.48" local_density="0.00" obsval="-122.58"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="51.38" stdev="2.92" mindiff="2.01" local_density="0.05" obsval="56.79"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="29.63" stdev="21.32" mindiff="0.00" local_density="4.29" obsval="150.00"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="55.74" stdev="45.62" mindiff="0.37" local_density="2.65" obsval="36.71"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="62.52" stdev="12.25" mindiff="0.26" local_density="0.53" obsval="-105.71"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="60.36" stdev="45.66" mindiff="4.29" local_density="0.88" obsval="-32.05"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="72.16" stdev="18.84" mindiff="0.58" local_density="1.30" obsval="93.03"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.27" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.98" obsval="1.97"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.13" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.51" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.10" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.23" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.49" Zscore="9.09" obsval="110.82"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.11" Zscore="-2.25" obsval="121.31"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.80" Zscore="2.23" obsval="117.76"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.10" Zscore="2.19" obsval="118.51"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.07" Zscore="-2.63" obsval="108.18"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.05" Zscore="2.57" obsval="112.68"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.25" Zscore="-2.57" obsval="104.28"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.18" Zscore="2.27" obsval="112.38"/>
		<mog-angle-outlier atoms="C3D,C2D,C1D" numobs="32" mean="105.83" stdev="1.36" mindiff="0.69" Zscore="-2.06" obsval="103.01"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="0.02" Zscore="4.40" obsval="132.47"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.34" Zscore="2.28" obsval="137.25"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.16" Zscore="-2.02" obsval="120.53"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.18" Zscore="5.17" obsval="120.27"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.39" obsval="119.19"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.97" Zscore="2.98" obsval="119.58"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.67" Zscore="-2.84" obsval="121.54"/>
		<clash atom="HMB3" dist="1.66" clashmag="0.76" cid="187"/>
		<clash atom="HBB1" dist="1.66" clashmag="0.76" cid="187"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
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		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="39.39" stdev="35.48" mindiff="2.24" local_density="3.33" obsval="-154.65"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="29.75" stdev="15.93" mindiff="1.60" local_density="3.88" obsval="93.62"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="26.34" stdev="4.57" mindiff="0.36" local_density="1.46" obsval="147.69"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="26.42" stdev="4.41" mindiff="0.27" local_density="1.88" obsval="-32.50"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="89.42" stdev="39.47" mindiff="4.03" local_density="0.35" obsval="-44.28"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="71.22" stdev="35.66" mindiff="0.32" local_density="3.36" obsval="59.38"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="69.82" stdev="33.09" mindiff="1.08" local_density="1.48" obsval="-120.44"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="23.47" stdev="1.70" mindiff="0.10" local_density="0.21" obsval="-151.28"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="23.29" stdev="3.08" mindiff="0.51" local_density="0.70" obsval="28.59"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="43.25" stdev="25.98" mindiff="0.32" local_density="0.96" obsval="145.81"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="81.95" stdev="25.73" mindiff="0.03" local_density="3.59" obsval="-80.40"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="75.29" stdev="45.77" mindiff="1.57" local_density="0.29" obsval="-17.04"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="48.55" stdev="24.64" mindiff="0.11" local_density="2.28" obsval="-139.47"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="77.21" stdev="22.55" mindiff="0.01" local_density="2.11" obsval="-86.43"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="29.93" stdev="21.07" mindiff="0.07" local_density="3.99" obsval="149.59"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="38.47" stdev="25.15" mindiff="0.08" local_density="4.72" obsval="-88.37"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="47.77" stdev="31.48" mindiff="0.91" local_density="3.42" obsval="147.73"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.16" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.86" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.09" obsval="1.51"/>
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		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.20" obsval="1.32"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.69" Zscore="9.52" obsval="111.02"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.79" Zscore="2.87" obsval="119.49"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.39" obsval="119.11"/>
		<mog-angle-outlier atoms="CMB,C2B,C1B" numobs="569" mean="125.42" stdev="1.52" mindiff="0.02" Zscore="2.07" obsval="128.57"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.01" Zscore="-2.48" obsval="108.32"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.01" Zscore="2.61" obsval="112.72"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.14" Zscore="-2.46" obsval="104.39"/>
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		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.11" Zscore="-2.09" obsval="122.90"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.28" Zscore="2.31" obsval="137.31"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.12" Zscore="-2.04" obsval="120.49"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.24" Zscore="5.38" obsval="120.64"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.04" Zscore="-2.56" obsval="118.87"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.61" Zscore="2.89" obsval="119.22"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
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		<mog-torsion-outlier atoms="C7,C8,C9,C34" numobs="316" mean="163.40" stdev="22.62" mindiff="4.17" local_density="0.63" obsval="173.10"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="18.93" stdev="27.79" mindiff="3.71" local_density="2.67" obsval="-161.62"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="19.04" stdev="26.76" mindiff="1.73" local_density="1.88" obsval="18.88"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="28.61" stdev="19.02" mindiff="11.76" local_density="0.00" obsval="149.37"/>
		<mog-torsion-outlier atoms="C12,C13,C14,C15" numobs="150" mean="166.27" stdev="33.00" mindiff="0.89" local_density="3.33" obsval="-1.80"/>
		<mog-torsion-outlier atoms="C35,C13,C14,C15" numobs="160" mean="167.97" stdev="32.00" mindiff="0.51" local_density="3.12" obsval="179.47"/>
		<mog-torsion-outlier atoms="C21,C22,C23,C24" numobs="313" mean="165.34" stdev="22.47" mindiff="0.08" local_density="0.32" obsval="5.00"/>
		<mog-torsion-outlier atoms="C37,C22,C23,C24" numobs="316" mean="160.25" stdev="22.48" mindiff="6.16" local_density="0.63" obsval="-169.94"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="83.88" stdev="35.95" mindiff="2.31" local_density="4.20" obsval="-153.24"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.00" Zscore="4.32" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-4.86" obsval="1.22"/>
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		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="5.95" obsval="1.50"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.60" Zscore="3.11" obsval="120.22"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="2.14" Zscore="-5.03" obsval="119.00"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.13" Zscore="-3.33" obsval="118.09"/>
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		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="1.33" Zscore="-4.18" obsval="116.04"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="2.03" Zscore="3.48" obsval="132.15"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="32.87" Zscore="17.10" obsval="172.76"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="10.53" Zscore="5.73" obsval="142.09"/>
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		<mog-angle-outlier atoms="C28,C27,C26" numobs="188" mean="114.06" stdev="1.78" mindiff="0.07" Zscore="-3.83" obsval="107.22"/>
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		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="58.13" stdev="15.49" mindiff="2.67" local_density="0.64" obsval="-105.92"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O1A" numobs="4149" mean="56.91" stdev="22.76" mindiff="0.03" local_density="4.70" obsval="-82.65"/>
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="57.14" stdev="21.97" mindiff="0.04" local_density="4.34" obsval="97.05"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="69.99" stdev="5.76" mindiff="3.86" local_density="0.08" obsval="103.53"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="70.17" stdev="6.25" mindiff="1.00" local_density="0.15" obsval="-76.78"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="37.02" stdev="13.77" mindiff="0.42" local_density="4.56" obsval="-135.01"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="43.41" stdev="11.13" mindiff="0.93" local_density="0.54" obsval="131.24"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="56.88" stdev="9.27" mindiff="0.21" local_density="0.44" obsval="-113.20"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="48.35" stdev="12.41" mindiff="2.78" local_density="1.47" obsval="-112.19"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="50.25" stdev="15.09" mindiff="0.82" local_density="1.52" obsval="125.12"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.11" Zscore="6.03" obsval="2.20"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.75" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.66" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.40" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.21" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.09" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.51" Zscore="9.12" obsval="110.84"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.08" Zscore="2.71" obsval="120.11"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.20" Zscore="-2.78" obsval="108.05"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.09" Zscore="2.54" obsval="112.65"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.11" Zscore="-2.92" obsval="103.91"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.26" Zscore="-2.56" obsval="104.52"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.26" Zscore="-2.12" obsval="121.81"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.25" Zscore="2.17" obsval="112.28"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.63" Zscore="5.34" obsval="134.13"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.28" Zscore="-2.16" obsval="122.73"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.47" Zscore="2.22" obsval="137.12"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.11" Zscore="-2.04" obsval="120.48"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.16" Zscore="5.16" obsval="120.25"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.35" obsval="119.27"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.35" Zscore="3.08" obsval="119.96"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.42" Zscore="-2.69" obsval="121.79"/>
		<clash atom="HBC3" dist="1.86" clashmag="0.58" cid="383"/>
		<clash atom="H93" dist="1.86" clashmag="0.57" cid="384"/>
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		<mog-torsion-outlier atoms="C2A,CAA,CBA,CGA" numobs="933" mean="39.62" stdev="20.81" mindiff="0.29" local_density="1.61" obsval="142.73"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="115.08" stdev="7.29" mindiff="2.45" local_density="0.08" obsval="58.29"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="114.13" stdev="7.09" mindiff="3.19" local_density="0.04" obsval="-120.82"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="40" mean="65.76" stdev="34.68" mindiff="3.08" local_density="5.00" obsval="129.75"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="17.32" stdev="1.63" mindiff="0.04" local_density="0.63" obsval="-157.45"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="17.13" stdev="3.17" mindiff="0.06" local_density="1.68" obsval="22.36"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="50.76" stdev="10.43" mindiff="0.73" local_density="0.11" obsval="-126.52"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="52.47" stdev="15.03" mindiff="1.22" local_density="1.14" obsval="-109.88"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="54.96" stdev="16.63" mindiff="0.92" local_density="1.18" obsval="126.97"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="74.81" stdev="20.77" mindiff="0.17" local_density="1.63" obsval="-89.57"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="51.74" stdev="13.52" mindiff="0.44" local_density="1.14" obsval="-114.60"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="52.96" stdev="14.41" mindiff="0.94" local_density="1.47" obsval="122.58"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.27" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.89" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.32" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.41" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.14" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.05" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.11" Zscore="8.23" obsval="110.44"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.17" Zscore="-2.01" obsval="121.83"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.80" Zscore="2.22" obsval="117.75"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.11" Zscore="2.34" obsval="118.98"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.49" Zscore="-3.09" obsval="107.77"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.01" Zscore="2.30" obsval="112.39"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.05" Zscore="-2.38" obsval="104.48"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.12" Zscore="5.05" obsval="133.62"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.01" Zscore="-2.05" obsval="123.00"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.22" Zscore="2.34" obsval="137.37"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.31" Zscore="5.25" obsval="120.40"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.51" obsval="118.97"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.69" Zscore="3.17" obsval="120.29"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="2.58" Zscore="-3.40" obsval="120.63"/>
		<clash atom="HHC" dist="1.56" clashmag="0.87" cid="64"/>
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		<clash atom="HBB1" dist="1.56" clashmag="0.87" cid="64"/>
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		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="62.92" stdev="48.89" mindiff="6.65" local_density="0.84" obsval="168.51"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="64.17" stdev="47.94" mindiff="12.40" local_density="0.00" obsval="-11.42"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="56.34" stdev="11.97" mindiff="37.05" local_density="0.00" obsval="-120.86"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="53.29" stdev="12.79" mindiff="35.38" local_density="0.00" obsval="55.99"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="38.05" stdev="9.61" mindiff="4.29" local_density="0.39" obsval="136.68"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="37.54" stdev="16.02" mindiff="21.19" local_density="0.00" obsval="139.95"/>
		<mog-torsion-outlier atoms="C17,C18,C19,C20" numobs="313" mean="24.90" stdev="15.18" mindiff="10.63" local_density="0.00" obsval="151.75"/>
		<mog-torsion-outlier atoms="C36,C18,C19,C20" numobs="316" mean="23.58" stdev="15.81" mindiff="2.29" local_density="0.32" obsval="-26.76"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="60.91" stdev="47.94" mindiff="9.14" local_density="0.84" obsval="-14.68"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C30" numobs="119" mean="56.29" stdev="48.83" mindiff="0.03" local_density="0.84" obsval="161.82"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="3.97" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-5.09" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-3.86" obsval="1.31"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="5.92" obsval="1.50"/>
		<mog-angle-outlier atoms="C2,C1,C6" numobs="132" mean="110.44" stdev="1.45" mindiff="8.79" Zscore="-9.39" obsval="96.80"/>
		<mog-angle-outlier atoms="C31,C1,C2" numobs="1014" mean="108.95" stdev="3.84" mindiff="0.11" Zscore="2.13" obsval="117.11"/>
		<mog-angle-outlier atoms="C32,C1,C2" numobs="1014" mean="108.95" stdev="3.84" mindiff="0.00" Zscore="2.23" obsval="117.50"/>
		<mog-angle-outlier atoms="C31,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="18.02" Zscore="-15.03" obsval="86.67"/>
		<mog-angle-outlier atoms="C32,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="18.45" Zscore="-15.30" obsval="86.24"/>
		<mog-angle-outlier atoms="C32,C1,C31" numobs="759" mean="108.63" stdev="2.86" mindiff="0.44" Zscore="5.85" obsval="125.38"/>
		<mog-angle-outlier atoms="C3,C4,C5" numobs="188" mean="114.06" stdev="1.78" mindiff="0.10" Zscore="-3.74" obsval="107.39"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="0.08" Zscore="-2.08" obsval="119.89"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.01" Zscore="2.58" obsval="119.10"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.17" Zscore="-3.22" obsval="120.97"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.19" Zscore="-3.48" obsval="117.18"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="10.14" Zscore="9.26" obsval="140.26"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="38.07" Zscore="18.90" obsval="177.96"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="25.86" Zscore="11.32" obsval="157.41"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.28" Zscore="-2.05" obsval="115.78"/>
		<mog-angle-outlier atoms="C35,C13,C12" numobs="317" mean="118.09" stdev="1.53" mindiff="0.08" Zscore="2.23" obsval="121.49"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="18.47" Zscore="11.92" obsval="147.91"/>
		<mog-angle-outlier atoms="C16,C17,C18" numobs="147" mean="127.28" stdev="1.40" mindiff="0.02" Zscore="2.01" obsval="130.10"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.08" Zscore="-2.15" obsval="119.34"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="13.93" Zscore="6.97" obsval="145.48"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="24.69" Zscore="14.28" obsval="164.58"/>
		<mog-angle-outlier atoms="C37,C22,C21" numobs="181" mean="122.82" stdev="1.62" mindiff="0.19" Zscore="-3.48" obsval="117.18"/>
		<mog-angle-outlier atoms="C37,C22,C23" numobs="317" mean="118.09" stdev="1.53" mindiff="0.16" Zscore="2.27" obsval="121.56"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="0.35" Zscore="-3.67" obsval="117.62"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="99" mean="122.70" stdev="1.35" mindiff="0.56" Zscore="-3.68" obsval="117.73"/>
		<mog-angle-outlier atoms="C38,C26,C27" numobs="379" mean="113.60" stdev="2.13" mindiff="0.17" Zscore="2.68" obsval="119.31"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="188" mean="114.06" stdev="1.78" mindiff="0.09" Zscore="-2.49" obsval="109.61"/>
		<clash atom="H402" dist="1.80" clashmag="0.64" cid="248"/>
		<clash atom="H402" dist="2.46" clashmag="0.44" cid="263"/>
		<clash atom="H342" dist="2.00" clashmag="0.43" cid="266"/>
	</ModelledSubgroup>
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		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.38" Zscore="-2.66" obsval="121.83"/>
		<clash atom="HHC" dist="1.96" clashmag="0.48" cid="495"/>
		<clash atom="HHC" dist="2.49" clashmag="0.42" cid="496"/>
		<clash atom="HBB1" dist="1.96" clashmag="0.48" cid="495"/>
		<clash atom="CBB" dist="2.49" clashmag="0.42" cid="496"/>
		<chiral-outlier problem="PLANAR" atom="C3A"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8780" Q_score="0.529" mogul_rmsz_numbonds="42" ligand_geometry_outlier="yes" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.04" mogul_angles_rmsz="3.12" ligand_chirality_outlier="yes" num-H-reduce="56" model="1" chain="J" resnum="103" said="TG" ent="18" seq="." icode=" " resname="RRX" altcode=" ">
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="44.40" stdev="21.42" mindiff="2.13" local_density="3.36" obsval="87.08"/>
		<mog-torsion-outlier atoms="C37,C22,C23,C24" numobs="316" mean="40.80" stdev="10.30" mindiff="15.35" local_density="0.00" obsval="-45.14"/>
		<mog-torsion-outlier atoms="C21,C22,C23,C24" numobs="313" mean="40.95" stdev="10.24" mindiff="12.58" local_density="0.00" obsval="134.60"/>
		<mog-torsion-outlier atoms="C19,C20,C21,C22" numobs="760" mean="151.02" stdev="19.16" mindiff="12.23" local_density="0.00" obsval="19.77"/>
		<mog-torsion-outlier atoms="C36,C18,C19,C20" numobs="316" mean="111.16" stdev="15.20" mindiff="10.39" local_density="0.00" obsval="119.59"/>
		<mog-torsion-outlier atoms="C17,C18,C19,C20" numobs="313" mean="111.61" stdev="15.36" mindiff="8.65" local_density="0.64" obsval="-59.94"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="760" mean="157.52" stdev="19.29" mindiff="11.20" local_density="0.00" obsval="13.25"/>
		<mog-torsion-outlier atoms="C35,C13,C14,C15" numobs="160" mean="168.16" stdev="32.00" mindiff="0.32" local_density="3.12" obsval="-179.66"/>
		<mog-torsion-outlier atoms="C12,C13,C14,C15" numobs="150" mean="167.52" stdev="33.00" mindiff="0.31" local_density="3.33" obsval="-0.55"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="32.51" stdev="12.72" mindiff="18.76" local_density="0.00" obsval="143.62"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="33.46" stdev="12.54" mindiff="12.84" local_density="0.00" obsval="-37.31"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="52.43" stdev="6.91" mindiff="9.48" local_density="0.13" obsval="-121.58"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="34.72" stdev="12.04" mindiff="19.23" local_density="0.00" obsval="141.26"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C34" numobs="316" mean="34.89" stdev="12.09" mindiff="14.37" local_density="0.00" obsval="-38.84"/>
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="67.94" stdev="15.99" mindiff="19.35" local_density="0.00" obsval="-55.78"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="73.51" stdev="23.56" mindiff="8.45" local_density="0.84" obsval="136.09"/>
		<mog-bond-outlier atoms="C2,C1" numobs="507" mean="1.54" stdev="0.02" mindiff="0.01" Zscore="5.36" obsval="1.66"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-6.06" obsval="1.46"/>
		<mog-bond-outlier atoms="C32,C1" numobs="4607" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="2.89" obsval="1.59"/>
		<mog-bond-outlier atoms="C2,C3" numobs="10925" mean="1.52" stdev="0.02" mindiff="0.00" Zscore="-6.71" obsval="1.36"/>
		<mog-bond-outlier atoms="C3,C4" numobs="10557" mean="1.52" stdev="0.03" mindiff="0.01" Zscore="4.20" obsval="1.65"/>
		<mog-bond-outlier atoms="C29,C30" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.71" obsval="1.65"/>
		<mog-bond-outlier atoms="C30,C25" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.92" obsval="1.46"/>
		<mog-bond-outlier atoms="C29,C28" numobs="383" mean="1.52" stdev="0.01" mindiff="0.08" Zscore="-9.53" obsval="1.38"/>
		<mog-bond-outlier atoms="C27,C28" numobs="572" mean="1.52" stdev="0.02" mindiff="0.07" Zscore="8.20" obsval="1.66"/>
		<mog-bond-outlier atoms="C27,C26" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.42" obsval="1.44"/>
		<mog-bond-outlier atoms="C26,C25" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.48" obsval="1.60"/>
		<mog-bond-outlier atoms="C24,C25" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.61" obsval="1.57"/>
		<mog-bond-outlier atoms="C23,C22" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="4.44" obsval="1.55"/>
		<mog-bond-outlier atoms="C20,C21" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.43" obsval="1.56"/>
		<mog-bond-outlier atoms="C19,C18" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.83" obsval="1.58"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="3.67" obsval="1.54"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.35" obsval="1.56"/>
		<mog-bond-outlier atoms="C35,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.64" obsval="1.56"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.64" obsval="1.55"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.00" Zscore="3.60" obsval="1.54"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.97" obsval="1.56"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.01" Zscore="3.19" obsval="1.56"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.19" Zscore="15.29" obsval="1.60"/>
		<mog-bond-outlier atoms="C4,C5" numobs="379" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-3.37" obsval="1.44"/>
		<mog-angle-outlier atoms="C2,C1,C6" numobs="132" mean="110.44" stdev="1.45" mindiff="0.52" Zscore="2.67" obsval="114.32"/>
		<mog-angle-outlier atoms="C38,C26,C27" numobs="328" mean="114.42" stdev="1.84" mindiff="0.22" Zscore="2.38" obsval="118.80"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="52" mean="120.76" stdev="2.05" mindiff="0.18" Zscore="-2.33" obsval="115.96"/>
		<mog-angle-outlier atoms="C38,C26,C25" numobs="104" mean="124.48" stdev="1.09" mindiff="2.56" Zscore="-5.41" obsval="118.58"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="2.37" Zscore="-5.16" obsval="115.59"/>
		<mog-angle-outlier atoms="C30,C25,C24" numobs="118" mean="115.65" stdev="2.71" mindiff="2.04" Zscore="3.08" obsval="123.99"/>
		<mog-angle-outlier atoms="C23,C24,C25" numobs="153" mean="127.00" stdev="2.67" mindiff="2.93" Zscore="-3.16" obsval="118.56"/>
		<mog-angle-outlier atoms="C37,C22,C23" numobs="317" mean="118.09" stdev="1.53" mindiff="0.51" Zscore="3.03" obsval="122.72"/>
		<mog-angle-outlier atoms="C23,C22,C21" numobs="168" mean="119.01" stdev="1.57" mindiff="2.16" Zscore="-4.44" obsval="112.02"/>
		<mog-angle-outlier atoms="C20,C21,C22" numobs="147" mean="127.28" stdev="1.40" mindiff="1.67" Zscore="3.22" obsval="131.79"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="0.15" Zscore="2.63" obsval="130.81"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="6.87" Zscore="-4.68" obsval="113.53"/>
		<mog-angle-outlier atoms="C36,C18,C19" numobs="317" mean="118.09" stdev="1.53" mindiff="0.36" Zscore="3.88" obsval="124.02"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="3.07" Zscore="-5.03" obsval="111.10"/>
		<mog-angle-outlier atoms="C16,C17,C18" numobs="147" mean="127.28" stdev="1.40" mindiff="3.39" Zscore="4.45" obsval="133.51"/>
		<mog-angle-outlier atoms="C15,C16,C17" numobs="265" mean="123.52" stdev="2.05" mindiff="5.01" Zscore="5.34" obsval="134.45"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="3.67" Zscore="-6.74" obsval="109.72"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="2.51" Zscore="3.82" obsval="132.63"/>
		<mog-angle-outlier atoms="C35,C13,C14" numobs="181" mean="122.82" stdev="1.62" mindiff="0.02" Zscore="-6.25" obsval="112.69"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="4.55" Zscore="6.73" obsval="129.60"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="3.63" Zscore="-3.50" obsval="116.77"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="1.63" Zscore="-5.97" obsval="118.91"/>
		<mog-angle-outlier atoms="C7,C8,C9" numobs="106" mean="126.23" stdev="1.48" mindiff="4.18" Zscore="-4.81" obsval="119.12"/>
		<mog-angle-outlier atoms="C1,C6,C7" numobs="118" mean="115.65" stdev="2.71" mindiff="0.05" Zscore="2.34" obsval="122.00"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.17" Zscore="-3.30" obsval="118.13"/>
		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.52" Zscore="-3.55" obsval="120.61"/>
		<mog-angle-outlier atoms="C4,C5,C6" numobs="99" mean="122.70" stdev="1.35" mindiff="0.81" Zscore="-3.86" obsval="117.48"/>
		<mog-angle-outlier atoms="C33,C5,C4" numobs="379" mean="113.60" stdev="2.13" mindiff="0.07" Zscore="2.79" obsval="119.55"/>
		<clash atom="C8" dist="2.47" clashmag="0.45" cid="376"/>
		<clash atom="H30" dist="2.03" clashmag="0.41" cid="377"/>
		<chiral-outlier problem="WRONG HAND" atom="C28"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8095" Q_score="0.523" mogul_rmsz_numbonds="43" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.50" mogul_angles_rmsz="2.56" ligand_chirality_outlier="yes" model="1" chain="J" resnum="104" said="UG" ent="17" seq="." icode=" " resname="C7Z" altcode=" ">
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="45.96" stdev="19.67" mindiff="4.70" local_density="3.36" obsval="-89.77"/>
		<mog-torsion-outlier atoms="C25,C26,C27,C28" numobs="119" mean="46.85" stdev="18.71" mindiff="3.17" local_density="3.36" obsval="91.30"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="156.02" stdev="19.26" mindiff="12.70" local_density="0.00" obsval="14.76"/>
		<mog-torsion-outlier atoms="C29,C30,C31,C32" numobs="760" mean="85.30" stdev="8.73" mindiff="1.38" local_density="0.26" obsval="87.24"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C30" numobs="313" mean="31.26" stdev="13.11" mindiff="17.43" local_density="0.00" obsval="144.95"/>
		<mog-torsion-outlier atoms="C27,C28,C29,C39" numobs="316" mean="31.54" stdev="13.16" mindiff="10.79" local_density="0.00" obsval="-35.26"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.87" obsval="1.46"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.46" obsval="1.60"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.44" obsval="1.56"/>
		<mog-bond-outlier atoms="C4,C3" numobs="572" mean="1.52" stdev="0.02" mindiff="0.07" Zscore="8.47" obsval="1.67"/>
		<mog-bond-outlier atoms="C4,C5" numobs="328" mean="1.51" stdev="0.02" mindiff="0.01" Zscore="-4.18" obsval="1.44"/>
		<mog-bond-outlier atoms="C2,C3" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.56" obsval="1.37"/>
		<mog-bond-outlier atoms="C2,C1" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.69" obsval="1.65"/>
		<mog-bond-outlier atoms="C18,C5" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.48" obsval="1.54"/>
		<mog-bond-outlier atoms="C27,C26" numobs="255" mean="1.45" stdev="0.03" mindiff="0.03" Zscore="3.80" obsval="1.58"/>
		<mog-bond-outlier atoms="C21,C26" numobs="158" mean="1.53" stdev="0.01" mindiff="0.00" Zscore="-3.28" obsval="1.49"/>
		<mog-bond-outlier atoms="C25,C26" numobs="104" mean="1.34" stdev="0.02" mindiff="0.21" Zscore="16.12" obsval="1.61"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.77" obsval="1.56"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.48" obsval="1.57"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="6.05" obsval="1.58"/>
		<mog-bond-outlier atoms="C20,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.53" obsval="1.56"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.06" obsval="1.55"/>
		<mog-bond-outlier atoms="C35,C34" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.89" obsval="1.55"/>
		<mog-bond-outlier atoms="C40,C33" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.21" obsval="1.55"/>
		<mog-bond-outlier atoms="C32,C33" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="5.01" obsval="1.56"/>
		<mog-bond-outlier atoms="C31,C30" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.59" obsval="1.57"/>
		<mog-bond-outlier atoms="C28,C29" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.13" obsval="1.56"/>
		<mog-bond-outlier atoms="C22,C21" numobs="62" mean="1.54" stdev="0.03" mindiff="0.02" Zscore="3.95" obsval="1.66"/>
		<mog-bond-outlier atoms="C22,C23" numobs="383" mean="1.52" stdev="0.01" mindiff="0.10" Zscore="-10.68" obsval="1.37"/>
		<mog-bond-outlier atoms="C24,C23" numobs="572" mean="1.52" stdev="0.02" mindiff="0.13" Zscore="11.80" obsval="1.73"/>
		<mog-bond-outlier atoms="C24,C25" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.66" obsval="1.43"/>
		<mog-bond-outlier atoms="C38,C25" numobs="2462" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="3.47" obsval="1.56"/>
		<mog-angle-outlier atoms="C1,C6,C5" numobs="97" mean="122.64" stdev="1.37" mindiff="0.53" Zscore="-3.81" obsval="117.43"/>
		<mog-angle-outlier atoms="C18,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="1.83" Zscore="-4.75" obsval="119.30"/>
		<mog-angle-outlier atoms="C18,C5,C4" numobs="328" mean="114.42" stdev="1.84" mindiff="0.19" Zscore="2.80" obsval="119.57"/>
		<mog-angle-outlier atoms="C21,C26,C25" numobs="97" mean="122.64" stdev="1.37" mindiff="2.34" Zscore="-5.13" obsval="115.62"/>
		<mog-angle-outlier atoms="C19,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.60" Zscore="3.09" obsval="122.81"/>
		<mog-angle-outlier atoms="C8,C9,C10" numobs="168" mean="119.01" stdev="1.57" mindiff="0.38" Zscore="-2.59" obsval="114.93"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="0.39" Zscore="2.03" obsval="129.07"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="6.77" Zscore="-4.64" obsval="113.63"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.53" Zscore="3.32" obsval="124.23"/>
		<mog-angle-outlier atoms="C20,C13,C14" numobs="181" mean="122.82" stdev="1.62" mindiff="0.04" Zscore="-3.00" obsval="117.96"/>
		<mog-angle-outlier atoms="C15,C14,C13" numobs="147" mean="127.28" stdev="1.40" mindiff="4.09" Zscore="-7.73" obsval="116.44"/>
		<mog-angle-outlier atoms="C15,C35,C34" numobs="265" mean="123.52" stdev="2.05" mindiff="0.15" Zscore="-2.22" obsval="118.98"/>
		<mog-angle-outlier atoms="C35,C34,C33" numobs="147" mean="127.28" stdev="1.40" mindiff="0.26" Zscore="-4.43" obsval="121.07"/>
		<mog-angle-outlier atoms="C31,C32,C33" numobs="117" mean="126.36" stdev="2.74" mindiff="0.67" Zscore="-2.42" obsval="119.73"/>
		<mog-angle-outlier atoms="C31,C30,C29" numobs="147" mean="127.28" stdev="1.40" mindiff="2.63" Zscore="-6.68" obsval="117.91"/>
		<mog-angle-outlier atoms="C39,C29,C30" numobs="181" mean="122.82" stdev="1.62" mindiff="0.09" Zscore="-2.27" obsval="119.14"/>
		<mog-angle-outlier atoms="C27,C28,C29" numobs="106" mean="126.23" stdev="1.48" mindiff="5.10" Zscore="-5.43" obsval="118.20"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="153" mean="127.00" stdev="2.67" mindiff="0.20" Zscore="-2.14" obsval="121.29"/>
		<mog-angle-outlier atoms="C24,C25,C26" numobs="52" mean="120.76" stdev="2.05" mindiff="0.30" Zscore="-2.28" obsval="116.08"/>
		<mog-angle-outlier atoms="C38,C25,C26" numobs="104" mean="124.48" stdev="1.09" mindiff="0.79" Zscore="-3.79" obsval="120.35"/>
		<mog-angle-outlier atoms="C38,C25,C24" numobs="328" mean="114.42" stdev="1.84" mindiff="0.27" Zscore="3.11" obsval="120.14"/>
		<chiral-outlier problem="WRONG HAND" atom="C3"/>
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		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="59.72" stdev="35.62" mindiff="2.50" local_density="2.22" obsval="-56.06"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="48.96" stdev="1.79" mindiff="14.77" local_density="0.00" obsval="-125.78"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="48.99" stdev="2.92" mindiff="0.38" local_density="0.05" obsval="54.40"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="46.13" stdev="19.59" mindiff="6.07" local_density="0.15" obsval="-138.41"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="55.71" stdev="45.62" mindiff="0.40" local_density="2.65" obsval="-36.75"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="57.52" stdev="45.64" mindiff="1.43" local_density="2.06" obsval="-34.91"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="72.41" stdev="45.75" mindiff="4.46" local_density="0.29" obsval="19.93"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="53.32" stdev="18.12" mindiff="4.11" local_density="2.66" obsval="-104.47"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.26" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.89" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.02" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.37" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.38" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.02" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.19" obsval="1.49"/>
		<mog-bond-outlier atoms="C3D,C4D" numobs="158" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="-2.02" obsval="1.39"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.48" Zscore="9.05" obsval="110.81"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.13" Zscore="-2.03" obsval="121.78"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.72" Zscore="2.90" obsval="119.56"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.12" Zscore="2.81" obsval="120.42"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.54" Zscore="-3.16" obsval="107.71"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.15" Zscore="2.43" obsval="112.53"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.12" Zscore="-2.45" obsval="104.40"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.05" Zscore="-2.12" obsval="104.82"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.37" Zscore="5.19" obsval="133.87"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.28" Zscore="-2.16" obsval="122.73"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.10" Zscore="2.40" obsval="137.49"/>
		<mog-angle-outlier atoms="O1D,CGD,CBD" numobs="235" mean="124.52" stdev="1.97" mindiff="0.05" Zscore="-2.13" obsval="120.32"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="1.33" Zscore="5.33" obsval="120.55"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.43" obsval="119.13"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.23" Zscore="2.79" obsval="118.83"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.06" Zscore="-2.47" obsval="122.15"/>
		<clash atom="HMD1" dist="1.94" clashmag="0.50" cid="153"/>
		<clash atom="CMD" dist="2.48" clashmag="0.44" cid="154"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6769" Q_score="0.478" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.81" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="K" resnum="102" said="XG" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="44.80" stdev="25.70" mindiff="13.83" local_density="0.00" obsval="143.06"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="48.12" stdev="29.20" mindiff="13.49" local_density="0.00" obsval="28.58"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="77.48" stdev="6.16" mindiff="2.63" local_density="0.12" obsval="-95.99"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="77.41" stdev="6.50" mindiff="1.30" local_density="0.13" obsval="84.04"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="38.26" stdev="13.09" mindiff="0.12" local_density="4.21" obsval="-124.91"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="63.01" stdev="13.52" mindiff="25.56" local_density="0.00" obsval="90.56"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="64.88" stdev="13.22" mindiff="30.13" local_density="0.00" obsval="-89.23"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O1D" numobs="40" mean="80.22" stdev="37.60" mindiff="1.22" local_density="2.50" obsval="-146.22"/>
		<mog-torsion-outlier atoms="CHA,CBD,CGD,O2D" numobs="40" mean="78.65" stdev="39.49" mindiff="3.05" local_density="2.50" obsval="34.60"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="40" mean="42.70" stdev="27.27" mindiff="1.65" local_density="5.00" obsval="100.31"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O2D" numobs="41" mean="42.71" stdev="29.03" mindiff="0.18" local_density="4.88" obsval="-78.87"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="16.40" stdev="1.62" mindiff="0.59" local_density="0.95" obsval="-158.38"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="17.20" stdev="3.17" mindiff="0.12" local_density="1.67" obsval="22.43"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="41.81" stdev="29.28" mindiff="0.16" local_density="1.66" obsval="-149.56"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="80.05" stdev="24.50" mindiff="0.13" local_density="3.01" obsval="82.80"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C7" numobs="263" mean="49.96" stdev="16.22" mindiff="1.49" local_density="1.52" obsval="-127.44"/>
		<mog-torsion-outlier atoms="C11,C10,C8,C9" numobs="339" mean="47.02" stdev="13.03" mindiff="0.25" local_density="1.47" obsval="109.17"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="84.62" stdev="45.79" mindiff="7.77" local_density="0.29" obsval="7.70"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="51.29" stdev="13.19" mindiff="2.67" local_density="1.52" obsval="-117.70"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="50.89" stdev="8.32" mindiff="0.74" local_density="0.45" obsval="-121.20"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.19" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.87" obsval="1.98"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.66" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.01" Zscore="4.33" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.12" obsval="1.33"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.38" Zscore="8.83" obsval="110.71"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="2.05" Zscore="2.40" obsval="118.23"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.33" Zscore="-2.92" obsval="107.92"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.02" Zscore="2.60" obsval="112.71"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.19" Zscore="-2.51" obsval="104.34"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.41" Zscore="5.21" obsval="133.91"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.34" Zscore="-2.19" obsval="122.68"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.08" Zscore="2.40" obsval="137.51"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.96" Zscore="5.05" obsval="120.05"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.40" obsval="119.17"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.32" Zscore="2.81" obsval="118.93"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.92" Zscore="-2.39" obsval="122.29"/>
		<clash atom="HAB" dist="1.94" clashmag="0.50" cid="275"/>
		<clash atom="H72" dist="2.02" clashmag="0.40" cid="279"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.6829" Q_score="0.465" mogul_rmsz_numbonds="42" mogul_rmsz_numangles="56" mogul_bonds_rmsz="5.08" mogul_angles_rmsz="2.38" ligand_chirality_outlier="yes" num-H-reduce="56" model="1" chain="K" resnum="103" said="YG" ent="18" seq="." icode=" " resname="RRX" altcode=" ">
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="52.03" stdev="13.83" mindiff="5.62" local_density="0.84" obsval="-100.09"/>
		<mog-torsion-outlier atoms="C20,C21,C22,C23" numobs="150" mean="166.62" stdev="33.00" mindiff="0.54" local_density="3.33" obsval="-1.44"/>
		<mog-torsion-outlier atoms="C20,C21,C22,C37" numobs="160" mean="168.35" stdev="32.00" mindiff="0.13" local_density="3.12" obsval="-179.85"/>
		<mog-torsion-outlier atoms="C18,C19,C20,C21" numobs="229" mean="169.81" stdev="27.16" mindiff="0.40" local_density="2.62" obsval="-0.61"/>
		<mog-torsion-outlier atoms="C13,C14,C15,C16" numobs="760" mean="20.58" stdev="14.06" mindiff="0.68" local_density="3.16" obsval="-155.19"/>
		<mog-torsion-outlier atoms="C35,C13,C14,C15" numobs="160" mean="168.41" stdev="32.00" mindiff="0.07" local_density="3.12" obsval="179.91"/>
		<mog-torsion-outlier atoms="C12,C13,C14,C15" numobs="150" mean="167.42" stdev="33.00" mindiff="0.26" local_density="3.33" obsval="0.65"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="22.08" stdev="16.12" mindiff="7.62" local_density="1.92" obsval="-154.76"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="22.87" stdev="16.05" mindiff="1.54" local_density="0.63" obsval="26.01"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="169.08" stdev="27.16" mindiff="0.33" local_density="2.62" obsval="-1.33"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="43.90" stdev="8.31" mindiff="10.43" local_density="0.00" obsval="130.53"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="167.92" stdev="32.00" mindiff="0.56" local_density="3.12" obsval="179.42"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="164.84" stdev="33.00" mindiff="0.18" local_density="3.33" obsval="-3.23"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C10" numobs="313" mean="47.97" stdev="8.54" mindiff="5.08" local_density="0.32" obsval="127.10"/>
		<mog-torsion-outlier atoms="C7,C8,C9,C34" numobs="316" mean="50.55" stdev="7.83" mindiff="4.94" local_density="0.32" obsval="-55.55"/>
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="54.10" stdev="48.79" mindiff="2.26" local_density="0.84" obsval="159.59"/>
		<mog-bond-outlier atoms="C2,C1" numobs="507" mean="1.54" stdev="0.02" mindiff="0.01" Zscore="5.29" obsval="1.66"/>
		<mog-bond-outlier atoms="C1,C6" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.79" obsval="1.46"/>
		<mog-bond-outlier atoms="C32,C1" numobs="4607" mean="1.53" stdev="0.02" mindiff="0.00" Zscore="2.97" obsval="1.59"/>
		<mog-bond-outlier atoms="C2,C3" numobs="10925" mean="1.52" stdev="0.02" mindiff="0.00" Zscore="-6.69" obsval="1.36"/>
		<mog-bond-outlier atoms="C3,C4" numobs="10557" mean="1.52" stdev="0.03" mindiff="0.00" Zscore="4.29" obsval="1.65"/>
		<mog-bond-outlier atoms="C29,C30" numobs="62" mean="1.54" stdev="0.03" mindiff="0.01" Zscore="3.68" obsval="1.65"/>
		<mog-bond-outlier atoms="C30,C25" numobs="158" mean="1.53" stdev="0.01" mindiff="0.03" Zscore="-5.51" obsval="1.46"/>
		<mog-bond-outlier atoms="C29,C28" numobs="383" mean="1.52" stdev="0.01" mindiff="0.09" Zscore="-9.93" obsval="1.38"/>
		<mog-bond-outlier atoms="C27,C28" numobs="572" mean="1.52" stdev="0.02" mindiff="0.06" Zscore="8.10" obsval="1.66"/>
		<mog-bond-outlier atoms="C27,C26" numobs="328" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-4.11" obsval="1.44"/>
		<mog-bond-outlier atoms="C26,C25" numobs="104" mean="1.34" stdev="0.02" mindiff="0.20" Zscore="15.71" obsval="1.60"/>
		<mog-bond-outlier atoms="C24,C25" numobs="255" mean="1.45" stdev="0.03" mindiff="0.02" Zscore="3.67" obsval="1.57"/>
		<mog-bond-outlier atoms="C23,C22" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="5.07" obsval="1.56"/>
		<mog-bond-outlier atoms="C20,C21" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="4.57" obsval="1.57"/>
		<mog-bond-outlier atoms="C19,C18" numobs="317" mean="1.46" stdev="0.02" mindiff="0.02" Zscore="5.88" obsval="1.58"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.74" obsval="1.54"/>
		<mog-bond-outlier atoms="C15,C14" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.02" Zscore="4.23" obsval="1.56"/>
		<mog-bond-outlier atoms="C35,C13" numobs="1360" mean="1.50" stdev="0.02" mindiff="0.00" Zscore="2.60" obsval="1.56"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="4.89" obsval="1.56"/>
		<mog-bond-outlier atoms="C11,C10" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="3.75" obsval="1.54"/>
		<mog-bond-outlier atoms="C8,C9" numobs="317" mean="1.46" stdev="0.02" mindiff="0.01" Zscore="5.01" obsval="1.56"/>
		<mog-bond-outlier atoms="C7,C6" numobs="255" mean="1.45" stdev="0.03" mindiff="0.01" Zscore="3.21" obsval="1.56"/>
		<mog-bond-outlier atoms="C5,C6" numobs="104" mean="1.34" stdev="0.02" mindiff="0.19" Zscore="15.15" obsval="1.59"/>
		<mog-bond-outlier atoms="C4,C5" numobs="379" mean="1.51" stdev="0.02" mindiff="0.00" Zscore="-3.21" obsval="1.45"/>
		<mog-angle-outlier atoms="C2,C1,C6" numobs="132" mean="110.44" stdev="1.45" mindiff="0.59" Zscore="2.44" obsval="113.99"/>
		<mog-angle-outlier atoms="C39,C30,C25" numobs="316" mean="110.24" stdev="1.57" mindiff="0.00" Zscore="-2.22" obsval="106.76"/>
		<mog-angle-outlier atoms="C38,C26,C27" numobs="328" mean="114.42" stdev="1.84" mindiff="0.05" Zscore="3.43" obsval="120.73"/>
		<mog-angle-outlier atoms="C38,C26,C25" numobs="104" mean="124.48" stdev="1.09" mindiff="0.68" Zscore="-3.69" obsval="120.45"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="4.65" Zscore="-6.82" obsval="113.32"/>
		<mog-angle-outlier atoms="C30,C25,C24" numobs="118" mean="115.65" stdev="2.71" mindiff="0.01" Zscore="2.33" obsval="121.97"/>
		<mog-angle-outlier atoms="C37,C22,C21" numobs="181" mean="122.82" stdev="1.62" mindiff="0.17" Zscore="-3.08" obsval="117.82"/>
		<mog-angle-outlier atoms="C20,C21,C22" numobs="147" mean="127.28" stdev="1.40" mindiff="0.17" Zscore="-4.12" obsval="121.50"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="0.26" Zscore="2.43" obsval="130.24"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="0.70" Zscore="2.15" obsval="132.25"/>
		<mog-angle-outlier atoms="C36,C18,C19" numobs="317" mean="118.09" stdev="1.53" mindiff="0.33" Zscore="3.87" obsval="123.99"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.36" Zscore="-2.10" obsval="115.71"/>
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		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="108.08" stdev="51.64" mindiff="0.75" local_density="1.11" obsval="34.59"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="109.50" stdev="7.23" mindiff="0.50" local_density="0.08" obsval="-63.88"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="109.75" stdev="7.06" mindiff="1.12" local_density="0.04" obsval="116.44"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="37.06" stdev="13.61" mindiff="0.79" local_density="4.56" obsval="-134.65"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="59.05" stdev="14.48" mindiff="1.07" local_density="0.18" obsval="-105.34"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="39.77" stdev="13.49" mindiff="0.24" local_density="0.90" obsval="136.15"/>
		<mog-torsion-outlier atoms="C12,C13,C15,C16" numobs="263" mean="49.12" stdev="20.63" mindiff="0.15" local_density="1.90" obsval="-134.16"/>
		<mog-torsion-outlier atoms="C14,C13,C15,C16" numobs="339" mean="43.96" stdev="16.10" mindiff="1.42" local_density="2.36" obsval="102.03"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.27" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.91" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.02" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.59" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.39" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.15" obsval="1.32"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.24" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.23" Zscore="8.51" obsval="110.56"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.91" Zscore="2.45" obsval="118.37"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.14" obsval="118.34"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.46" Zscore="2.11" obsval="121.77"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.49" Zscore="-3.10" obsval="107.76"/>
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		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.00" Zscore="-2.33" obsval="104.53"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.11" Zscore="-2.03" obsval="104.89"/>
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		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.69" Zscore="5.37" obsval="134.19"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.35" Zscore="-2.19" obsval="122.67"/>
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		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.70" Zscore="4.90" obsval="119.79"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.17" obsval="119.62"/>
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		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="77.54" stdev="3.29" mindiff="61.59" local_density="0.00" obsval="-82.20"/>
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		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="17.26" stdev="22.84" mindiff="0.22" local_density="3.93" obsval="161.35"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="21.71" stdev="16.25" mindiff="7.23" local_density="1.92" obsval="155.15"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="21.12" stdev="16.65" mindiff="0.34" local_density="1.27" obsval="-24.13"/>
		<mog-torsion-outlier atoms="C21,C22,C23,C24" numobs="313" mean="168.42" stdev="22.47" mindiff="3.17" local_density="0.32" obsval="1.91"/>
		<mog-torsion-outlier atoms="C37,C22,C23,C24" numobs="316" mean="167.66" stdev="22.70" mindiff="0.11" local_density="0.32" obsval="-177.38"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.02" Zscore="3.66" obsval="1.44"/>
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		<mog-angle-outlier atoms="C33,C5,C6" numobs="104" mean="124.48" stdev="1.09" mindiff="0.18" Zscore="-2.82" obsval="121.40"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.21" Zscore="3.51" obsval="123.45"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="1.13" Zscore="-4.06" obsval="116.24"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="4.90" Zscore="5.52" obsval="135.02"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="38.81" Zscore="19.16" obsval="178.71"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="28.51" Zscore="12.29" obsval="160.06"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="0.36" Zscore="-2.10" obsval="115.71"/>
		<mog-angle-outlier atoms="C35,C13,C12" numobs="317" mean="118.09" stdev="1.53" mindiff="0.13" Zscore="2.25" obsval="121.53"/>
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		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="0.84" Zscore="-2.70" obsval="118.94"/>
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		<mog-angle-outlier atoms="C28,C27,C26" numobs="188" mean="114.06" stdev="1.78" mindiff="1.40" Zscore="-4.58" obsval="105.88"/>
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		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.10" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.36" Zscore="8.80" obsval="110.69"/>
		<mog-angle-outlier atoms="CHA,C1A,NA" numobs="46" mean="126.39" stdev="2.26" mindiff="0.06" Zscore="-2.07" obsval="121.71"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="2.04" Zscore="2.31" obsval="117.99"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.04" Zscore="2.47" obsval="119.37"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.40" Zscore="-3.00" obsval="107.85"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.03" Zscore="2.65" obsval="112.76"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.23" Zscore="-2.55" obsval="104.29"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.71" Zscore="5.39" obsval="134.21"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.45" Zscore="-2.23" obsval="122.57"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.03" Zscore="2.43" obsval="137.56"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.55" Zscore="4.81" obsval="119.65"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.30" obsval="119.36"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.31" Zscore="3.07" obsval="119.92"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.87" Zscore="-2.35" obsval="122.34"/>
		<clash atom="HHC" dist="1.76" clashmag="0.67" cid="282"/>
		<clash atom="HHC" dist="2.40" clashmag="0.51" cid="283"/>
		<clash atom="HBB1" dist="1.76" clashmag="0.67" cid="282"/>
		<clash atom="CBB" dist="2.40" clashmag="0.51" cid="283"/>
		<clash atom="CGA" dist="2.97" clashmag="0.42" cid="284"/>
		<clash atom="C1A" dist="2.97" clashmag="0.42" cid="284"/>
		<clash atom="HMB2" dist="2.02" clashmag="0.41" cid="285"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.8154" Q_score="0.507" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.78" ligand_chirality_outlier="yes" num-H-reduce="72" model="1" chain="L" resnum="204" said="DH" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="CAA,CBA,CGA,O2A" numobs="3091" mean="50.05" stdev="20.22" mindiff="0.07" local_density="4.98" obsval="-111.67"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="105.95" stdev="7.15" mindiff="4.05" local_density="0.08" obsval="-67.43"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="106.36" stdev="7.02" mindiff="4.52" local_density="0.04" obsval="113.04"/>
		<mog-torsion-outlier atoms="C2,C1,O2A,CGA" numobs="285" mean="102.06" stdev="39.47" mindiff="16.67" local_density="0.00" obsval="-31.65"/>
		<mog-torsion-outlier atoms="CAD,CBD,CGD,O1D" numobs="40" mean="64.81" stdev="34.61" mindiff="2.08" local_density="5.00" obsval="128.75"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="50.20" stdev="1.80" mindiff="16.01" local_density="0.00" obsval="-124.53"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="49.91" stdev="2.93" mindiff="0.54" local_density="0.06" obsval="55.31"/>
		<mog-torsion-outlier atoms="C2,C3,C5,C6" numobs="1030" mean="62.55" stdev="19.88" mindiff="0.59" local_density="1.36" obsval="39.09"/>
		<mog-torsion-outlier atoms="C4,C3,C5,C6" numobs="1032" mean="65.35" stdev="19.45" mindiff="1.06" local_density="1.45" obsval="-142.08"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="48.75" stdev="14.10" mindiff="0.52" local_density="0.07" obsval="131.69"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="6638" mean="79.12" stdev="23.90" mindiff="0.11" local_density="2.64" obsval="-83.98"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="54.92" stdev="16.59" mindiff="0.84" local_density="1.18" obsval="126.88"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C10" numobs="263" mean="123.10" stdev="52.47" mindiff="3.51" local_density="0.38" obsval="1.82"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="64.54" stdev="13.52" mindiff="0.09" local_density="0.54" obsval="-103.04"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="29.10" stdev="21.76" mindiff="0.01" local_density="4.69" obsval="150.74"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="339" mean="45.88" stdev="13.96" mindiff="0.02" local_density="1.77" obsval="-106.58"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C15" numobs="263" mean="49.40" stdev="19.03" mindiff="2.07" local_density="1.90" obsval="131.94"/>
		<mog-torsion-outlier atoms="C13,C15,C16,C17" numobs="6638" mean="38.75" stdev="14.21" mindiff="0.03" local_density="1.02" obsval="-137.53"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="54.29" stdev="12.74" mindiff="0.03" local_density="0.75" obsval="117.81"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="54.34" stdev="13.05" mindiff="0.41" local_density="0.79" obsval="-119.36"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.18" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.87" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.02" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.50" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.36" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.09" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.13" obsval="1.48"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.34" Zscore="8.74" obsval="110.67"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="2.07" Zscore="2.40" obsval="118.21"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.03" Zscore="2.39" obsval="119.12"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.36" Zscore="-2.96" obsval="107.89"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.10" Zscore="2.38" obsval="112.48"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.23" Zscore="-2.55" obsval="104.30"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.11" Zscore="-2.03" obsval="104.89"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.20" Zscore="-2.08" obsval="121.87"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.87" Zscore="5.48" obsval="134.37"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.36" Zscore="-2.30" obsval="122.42"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.24" Zscore="2.33" obsval="137.35"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.28" Zscore="4.66" obsval="119.37"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.01" Zscore="-2.23" obsval="119.50"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.93" Zscore="2.97" obsval="119.54"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="1.08" Zscore="-2.48" obsval="122.13"/>
		<clash atom="HED1" dist="1.85" clashmag="0.59" cid="358"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7692" Q_score="0.514" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.35" mogul_angles_rmsz="1.88" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="L" resnum="205" said="EH" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="49.28" stdev="17.98" mindiff="10.92" local_density="0.00" obsval="-133.45"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="45.98" stdev="9.94" mindiff="9.95" local_density="0.78" obsval="113.58"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="110.83" stdev="7.25" mindiff="0.83" local_density="0.08" obsval="62.55"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="111.01" stdev="7.07" mindiff="0.07" local_density="0.04" obsval="-117.70"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="53.68" stdev="1.82" mindiff="13.96" local_density="0.00" obsval="-121.06"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="54.51" stdev="2.91" mindiff="0.09" local_density="0.06" obsval="59.92"/>
		<mog-torsion-outlier atoms="C3,C5,C6,C7" numobs="2719" mean="48.01" stdev="15.59" mindiff="1.36" local_density="0.07" obsval="-133.57"/>
		<mog-torsion-outlier atoms="C8,C10,C11,C12" numobs="6638" mean="36.80" stdev="15.64" mindiff="0.12" local_density="1.18" obsval="140.17"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="6638" mean="38.95" stdev="14.07" mindiff="0.29" local_density="0.98" obsval="-137.26"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="85.41" stdev="28.04" mindiff="0.01" local_density="4.82" obsval="-76.02"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C19" numobs="2276" mean="53.95" stdev="15.97" mindiff="0.88" local_density="0.83" obsval="105.86"/>
		<mog-torsion-outlier atoms="C16,C17,C18,C20" numobs="2276" mean="54.77" stdev="19.34" mindiff="1.70" local_density="0.70" obsval="-130.88"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.20" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.03" Zscore="-3.86" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.06" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.01" Zscore="-2.56" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.34" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-3.02" obsval="1.33"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.71" Zscore="9.57" obsval="111.04"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.48" Zscore="2.99" obsval="119.80"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.16" Zscore="2.83" obsval="120.46"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.01" Zscore="-2.46" obsval="108.34"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.02" Zscore="2.64" obsval="112.75"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.24" Zscore="-2.56" obsval="104.28"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.13" Zscore="-2.03" obsval="121.95"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.86" Zscore="5.47" obsval="134.35"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.26" Zscore="-2.35" obsval="122.31"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.12" Zscore="2.38" obsval="137.47"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.87" Zscore="5.00" obsval="119.96"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.38" obsval="119.22"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="4.87" Zscore="2.95" obsval="119.47"/>
		<mog-angle-outlier atoms="C1,C2,C3" numobs="34" mean="126.20" stdev="1.64" mindiff="0.84" Zscore="-2.34" obsval="122.37"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.9000" Q_score="0.564" mogul_rmsz_numbonds="41" mogul_rmsz_numangles="56" mogul_bonds_rmsz="1.62" mogul_angles_rmsz="4.66" num-H-reduce="52" model="1" chain="L" resnum="206" said="FH" ent="21" seq="." icode=" " resname="BCR" altcode=" ">
		<mog-torsion-outlier atoms="C1,C6,C7,C8" numobs="119" mean="56.91" stdev="48.84" mindiff="0.60" local_density="0.84" obsval="162.46"/>
		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="60.27" stdev="47.94" mindiff="8.49" local_density="0.84" obsval="-15.32"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C8" numobs="150" mean="48.88" stdev="15.12" mindiff="28.94" local_density="0.00" obsval="128.98"/>
		<mog-torsion-outlier atoms="C11,C10,C9,C34" numobs="160" mean="50.79" stdev="13.80" mindiff="32.67" local_density="0.00" obsval="-53.28"/>
		<mog-torsion-outlier atoms="C9,C10,C11,C12" numobs="760" mean="39.75" stdev="9.21" mindiff="6.07" local_density="0.39" obsval="-134.89"/>
		<mog-torsion-outlier atoms="C10,C11,C12,C13" numobs="229" mean="50.71" stdev="11.60" mindiff="35.08" local_density="0.00" obsval="-126.05"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C14" numobs="313" mean="35.47" stdev="11.81" mindiff="18.43" local_density="0.00" obsval="140.46"/>
		<mog-torsion-outlier atoms="C11,C12,C13,C35" numobs="316" mean="33.65" stdev="12.48" mindiff="13.04" local_density="0.00" obsval="-37.51"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="3.73" obsval="1.44"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.01" Zscore="-5.50" obsval="1.20"/>
		<mog-bond-outlier atoms="C12,C13" numobs="317" mean="1.46" stdev="0.02" mindiff="0.00" Zscore="-2.05" obsval="1.41"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-3.99" obsval="1.30"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.01" Zscore="5.72" obsval="1.50"/>
		<mog-angle-outlier atoms="C31,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="0.10" Zscore="-2.30" obsval="106.64"/>
		<mog-angle-outlier atoms="C34,C9,C8" numobs="317" mean="118.09" stdev="1.53" mindiff="0.16" Zscore="3.55" obsval="123.51"/>
		<mog-angle-outlier atoms="C34,C9,C10" numobs="181" mean="122.82" stdev="1.62" mindiff="0.17" Zscore="-2.32" obsval="119.06"/>
		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="16.42" Zscore="13.73" obsval="146.54"/>
		<mog-angle-outlier atoms="C10,C11,C12" numobs="302" mean="123.20" stdev="2.90" mindiff="35.43" Zscore="17.99" obsval="175.32"/>
		<mog-angle-outlier atoms="C11,C12,C13" numobs="117" mean="126.36" stdev="2.74" mindiff="25.27" Zscore="11.11" obsval="156.82"/>
		<mog-angle-outlier atoms="C12,C13,C14" numobs="168" mean="119.01" stdev="1.57" mindiff="1.97" Zscore="-4.33" obsval="112.20"/>
		<mog-angle-outlier atoms="C35,C13,C12" numobs="317" mean="118.09" stdev="1.53" mindiff="0.05" Zscore="2.65" obsval="122.14"/>
		<mog-angle-outlier atoms="C16,C15,C14" numobs="265" mean="123.52" stdev="2.05" mindiff="17.56" Zscore="11.47" obsval="147.00"/>
		<mog-angle-outlier atoms="C19,C18,C17" numobs="168" mean="119.01" stdev="1.57" mindiff="0.22" Zscore="2.50" obsval="122.94"/>
		<mog-angle-outlier atoms="C36,C18,C17" numobs="181" mean="122.82" stdev="1.62" mindiff="0.15" Zscore="-2.30" obsval="119.08"/>
		<mog-angle-outlier atoms="C20,C19,C18" numobs="117" mean="126.36" stdev="2.74" mindiff="26.71" Zscore="11.63" obsval="158.26"/>
		<mog-angle-outlier atoms="C21,C20,C19" numobs="302" mean="123.20" stdev="2.90" mindiff="21.18" Zscore="13.07" obsval="161.08"/>
		<mog-angle-outlier atoms="C24,C25,C26" numobs="97" mean="121.56" stdev="2.30" mindiff="1.01" Zscore="-2.57" obsval="115.63"/>
		<mog-angle-outlier atoms="C30,C25,C24" numobs="118" mean="115.65" stdev="2.71" mindiff="3.68" Zscore="3.68" obsval="125.63"/>
		<mog-angle-outlier atoms="C30,C25,C26" numobs="97" mean="122.64" stdev="1.37" mindiff="0.77" Zscore="-2.85" obsval="118.74"/>
		<mog-angle-outlier atoms="C27,C26,C25" numobs="99" mean="122.70" stdev="1.35" mindiff="0.03" Zscore="-3.23" obsval="118.34"/>
		<mog-angle-outlier atoms="C28,C27,C26" numobs="188" mean="114.06" stdev="1.78" mindiff="0.75" Zscore="-2.02" obsval="110.45"/>
		<mog-angle-outlier atoms="C40,C30,C25" numobs="316" mean="110.24" stdev="1.57" mindiff="0.05" Zscore="2.27" obsval="113.81"/>
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		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.31" obsval="1.49"/>
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		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.11" obsval="1.48"/>
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		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.39" Zscore="8.85" obsval="110.72"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="1.39" Zscore="3.68" obsval="121.67"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.17" Zscore="2.31" obsval="118.89"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.65" Zscore="-3.28" obsval="107.60"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.14" Zscore="2.42" obsval="112.53"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.18" Zscore="-2.50" obsval="104.35"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.06" Zscore="-2.10" obsval="104.84"/>
		<mog-angle-outlier atoms="CHD,C1D,ND" numobs="73" mean="124.80" stdev="1.41" mindiff="0.13" Zscore="-2.03" obsval="121.95"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="2.37" Zscore="5.76" obsval="134.86"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.40" Zscore="-2.63" obsval="121.65"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.13" Zscore="2.51" obsval="137.72"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.78" Zscore="4.94" obsval="119.87"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.00" Zscore="-2.31" obsval="119.34"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.06" Zscore="3.00" obsval="119.67"/>
		<clash atom="O1A" dist="2.08" clashmag="0.54" cid="361"/>
		<clash atom="H43" dist="2.08" clashmag="0.54" cid="361"/>
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		<clash atom="H93" dist="1.99" clashmag="0.45" cid="369"/>
		<clash atom="H141" dist="2.51" clashmag="0.41" cid="372"/>
		<chiral-outlier problem="PLANAR" atom="ND"/>
	</ModelledSubgroup>
	<ModelledSubgroup residue_inclusion="0.7846" Q_score="0.513" mogul_rmsz_numbonds="69" mogul_rmsz_numangles="82" mogul_bonds_rmsz="1.36" mogul_angles_rmsz="1.86" ligand_chirality_outlier="yes" num-H-reduce="71" model="1" chain="O" resnum="204" said="LH" ent="16" seq="." icode=" " resname="CLA" altcode=" ">
		<mog-torsion-outlier atoms="C1A,C2A,CAA,CBA" numobs="90" mean="57.88" stdev="7.50" mindiff="7.06" local_density="1.11" obsval="115.47"/>
		<mog-torsion-outlier atoms="C3A,C2A,CAA,CBA" numobs="129" mean="74.79" stdev="29.20" mindiff="40.15" local_density="0.00" obsval="1.91"/>
		<mog-torsion-outlier atoms="CBA,CGA,O2A,C1" numobs="2608" mean="96.89" stdev="6.88" mindiff="6.12" local_density="0.08" obsval="-76.51"/>
		<mog-torsion-outlier atoms="O1A,CGA,O2A,C1" numobs="4533" mean="98.26" stdev="6.88" mindiff="8.07" local_density="0.02" obsval="104.94"/>
		<mog-torsion-outlier atoms="C2B,C3B,CAB,CBB" numobs="119" mean="73.00" stdev="40.89" mindiff="2.04" local_density="3.36" obsval="53.28"/>
		<mog-torsion-outlier atoms="C4B,C3B,CAB,CBB" numobs="135" mean="70.69" stdev="37.59" mindiff="2.50" local_density="2.96" obsval="-125.50"/>
		<mog-torsion-outlier atoms="CBD,CGD,O2D,CED" numobs="4758" mean="83.16" stdev="2.01" mindiff="15.53" local_density="0.00" obsval="-91.57"/>
		<mog-torsion-outlier atoms="O1D,CGD,O2D,CED" numobs="10433" mean="83.67" stdev="3.16" mindiff="1.74" local_density="0.02" obsval="89.14"/>
		<mog-torsion-outlier atoms="C6,C7,C8,C9" numobs="339" mean="53.58" stdev="45.60" mindiff="1.74" local_density="3.24" obsval="-38.90"/>
		<mog-torsion-outlier atoms="C15,C16,C17,C18" numobs="6638" mean="79.86" stdev="24.37" mindiff="0.09" local_density="2.97" obsval="-83.04"/>
		<mog-bond-outlier atoms="MG,NA" numobs="26" mean="2.06" stdev="0.02" mindiff="0.12" Zscore="6.26" obsval="2.21"/>
		<mog-bond-outlier atoms="MG,ND" numobs="26" mean="2.05" stdev="0.02" mindiff="0.02" Zscore="-3.81" obsval="1.98"/>
		<mog-bond-outlier atoms="C1A,CHA" numobs="188" mean="1.43" stdev="0.04" mindiff="0.01" Zscore="2.03" obsval="1.51"/>
		<mog-bond-outlier atoms="C4B,NB" numobs="42" mean="1.37" stdev="0.01" mindiff="0.00" Zscore="-2.47" obsval="1.34"/>
		<mog-bond-outlier atoms="CBB,CAB" numobs="915" mean="1.30" stdev="0.05" mindiff="0.00" Zscore="4.41" obsval="1.51"/>
		<mog-bond-outlier atoms="C1C,NC" numobs="22" mean="1.37" stdev="0.02" mindiff="0.03" Zscore="-2.97" obsval="1.33"/>
		<mog-bond-outlier atoms="C1C,C2C" numobs="853" mean="1.44" stdev="0.02" mindiff="0.00" Zscore="2.20" obsval="1.49"/>
		<mog-angle-outlier atoms="C4A,NA,C1A" numobs="22" mean="106.68" stdev="0.46" mindiff="3.44" Zscore="8.97" obsval="110.77"/>
		<mog-angle-outlier atoms="CMA,C3A,C4A" numobs="26" mean="111.77" stdev="2.69" mindiff="0.29" Zscore="3.27" obsval="120.57"/>
		<mog-angle-outlier atoms="O2A,CGA,CBA" numobs="1155" mean="111.83" stdev="3.05" mindiff="0.17" Zscore="2.94" obsval="120.80"/>
		<mog-angle-outlier atoms="C1,O2A,CGA" numobs="50" mean="116.65" stdev="2.42" mindiff="0.97" Zscore="3.36" obsval="124.78"/>
		<mog-angle-outlier atoms="C3B,C4B,NB" numobs="44" mean="110.53" stdev="0.89" mindiff="0.33" Zscore="-2.92" obsval="107.92"/>
		<mog-angle-outlier atoms="C2C,C1C,NC" numobs="81" mean="109.98" stdev="1.05" mindiff="0.02" Zscore="2.27" obsval="112.36"/>
		<mog-angle-outlier atoms="C1C,C2C,C3C" numobs="620" mean="106.98" stdev="1.05" mindiff="0.04" Zscore="-2.37" obsval="104.49"/>
		<mog-angle-outlier atoms="C1D,ND,C4D" numobs="22" mean="106.31" stdev="0.70" mindiff="0.18" Zscore="-2.44" obsval="104.60"/>
		<mog-angle-outlier atoms="C2D,C1D,ND" numobs="62" mean="110.13" stdev="0.99" mindiff="0.14" Zscore="2.06" obsval="112.16"/>
		<mog-angle-outlier atoms="CMD,C2D,C1D" numobs="284" mean="124.73" stdev="1.76" mindiff="1.76" Zscore="5.41" obsval="134.25"/>
		<mog-angle-outlier atoms="CMD,C2D,C3D" numobs="92" mean="127.69" stdev="2.29" mindiff="0.48" Zscore="-2.25" obsval="122.53"/>
		<mog-angle-outlier atoms="CHA,C4D,ND" numobs="25" mean="132.55" stdev="2.06" mindiff="0.40" Zscore="2.25" obsval="137.19"/>
		<mog-angle-outlier atoms="O2D,CGD,CBD" numobs="147" mean="111.23" stdev="1.75" mindiff="0.08" Zscore="4.45" obsval="119.01"/>
		<mog-angle-outlier atoms="O2D,CGD,O1D" numobs="10433" mean="123.85" stdev="1.95" mindiff="0.02" Zscore="-2.16" obsval="119.65"/>
		<mog-angle-outlier atoms="O2A,C1,C2" numobs="46" mean="108.11" stdev="3.85" mindiff="5.87" Zscore="3.21" obsval="120.48"/>
		<clash atom="C3A" dist="2.92" clashmag="0.47" cid="504"/>
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		<chiral-outlier problem="PLANAR" atom="ND"/>
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		<mog-torsion-outlier atoms="C5,C6,C7,C8" numobs="119" mean="61.62" stdev="47.94" mindiff="9.85" local_density="0.84" obsval="13.96"/>
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		<mog-torsion-outlier atoms="C16,C17,C18,C36" numobs="160" mean="168.18" stdev="32.00" mindiff="0.30" local_density="3.12" obsval="179.68"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C26" numobs="119" mean="58.14" stdev="47.94" mindiff="6.36" local_density="0.84" obsval="17.45"/>
		<mog-torsion-outlier atoms="C23,C24,C25,C30" numobs="119" mean="53.72" stdev="48.78" mindiff="2.65" local_density="0.84" obsval="-159.21"/>
		<mog-bond-outlier atoms="C10,C9" numobs="181" mean="1.35" stdev="0.02" mindiff="0.01" Zscore="3.97" obsval="1.45"/>
		<mog-bond-outlier atoms="C11,C12" numobs="1217" mean="1.34" stdev="0.03" mindiff="0.00" Zscore="-5.00" obsval="1.21"/>
		<mog-bond-outlier atoms="C16,C17" numobs="1102" mean="1.43" stdev="0.03" mindiff="0.01" Zscore="-4.13" obsval="1.30"/>
		<mog-bond-outlier atoms="C24,C23" numobs="3645" mean="1.33" stdev="0.03" mindiff="0.02" Zscore="5.94" obsval="1.50"/>
		<mog-angle-outlier atoms="C32,C1,C6" numobs="316" mean="110.24" stdev="1.57" mindiff="0.36" Zscore="-2.46" obsval="106.38"/>
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		<mog-angle-outlier atoms="C11,C10,C9" numobs="147" mean="127.28" stdev="1.40" mindiff="9.83" Zscore="9.04" obsval="139.95"/>
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	</EM_validation>
	<programs>
		<program name="validation-pipeline" version="2.49" properties="PDB-Rfree,pdbid,PDB-R,PDB-deposition-date,percentilebins,PDB-resolution,PDB-revision-number,XMLcreationDate,attemptedValidationSteps,emdb_id,protein-DNA-RNA-entities,PDB-resolution-low,extended_pdbid,PDB-revision-date"/>
		<program name="visualanalysis" version="0.0.1.dev132" properties="EMDB-deposition-date,average_residue_inclusion,residue_inclusion,atom_inclusion_by_level,atom_inclusion_backbone,raw_map_rotationally_averaged_power_spectrum,map_value_distribution,atom_inclusion_all_atoms,fsc_generation,fsc_analysis,volume_estimate,EMDB-resolution,rotationally_averaged_power_spectrum"/>
		<program name="em-percentile" version="202505.v01 (Using data in the EMDB archive up until May 2025)" properties="low-resol-relative-percentile-qrelative,numEMDBids-absolute-percentile-qrelative,relative-percentile-qrelative,low-resol-absolute-percentile-qrelative,high-resol-relative-percentile-qrelative,absolute-percentile-qrelative,high-resol-absolute-percentile-qrelative,numEMDBids-relative-percentile-qrelative"/>
		<program name="chimera" version="1.16" properties="Q_score"/>
		<program name="mogul" version="2022.3.0, CSD as543be (2022)" properties="mogul-torsion-outlier,mogul_rmsz_numbonds,mogul-angle-outlier,mogul-ring-outlier,mogul-ignore,mogul_bonds_rmsz,mogul_angles_rmsz,mogul-bond-outlier,ligand_geometry_outlier,mogul_rmsz_numangles"/>
		<program name="buster-report" version="wwPDB partial adaption of 1.1.7 (2018)" properties="ligands-for-buster-report"/>
		<program name="molprobity" version="4-5-2 with Phenix2.0" properties="absolute_sidechain_percentile,relative_sidechain_percentile,bonds_rmsz,RestypesNotcheckedForBondAngleGeometry,angle-outlier,flippable-sidechain,cis_peptide,num-H-reduce,clash,angles_rmsz,percent-rota-outliers,percent-rama-outliers,relative_rama_percentile,rama,ligand_chirality_outlier,num_angles_rmsz,phi,rota,num_bonds_rmsz,clashscore,absolute_rama_percentile,bond-outlier,psi"/>
		<program name="validation-pack" version="unknown" properties="chiral-outlier"/>
		<program name="percentiles" version="20250101.v01 (using entries in the PDB archive January 1st 2025)" properties="absolute-percentile-clashscore,absolute-percentile-percent-rota-outliers,absolute-percentile-percent-rama-outliers,numPDBids-absolute-percentile-percent-rota-outliers,relative-percentile-percent-rota-outliers,numPDBids-absolute-percentile-clashscore,relative-percentile-percent-rama-outliers,numPDBids-relative-percentile-percent-rama-outliers,numPDBids-relative-percentile-percent-rota-outliers,numPDBids-relative-percentile-clashscore,numPDBids-absolute-percentile-percent-rama-outliers,relative-percentile-clashscore"/>
	</programs>
</wwPDB-validation-information>
