<?xml version="1.0" ?>
<wwPDB-validation-information xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:noNamespaceSchemaLocation="http://wwpdb.org/validation/schema/wwpdb_validation_v6.06.xsd">
	<Entry percentilebins="all,nmr" attemptedValidationSteps="mogul,buster-report,molprobity,validation-pack,coreclust,chemicalshiftanalysis,percentiles,writexml" PDB-deposition-date="2002-04-26" PDB-revision-date="2024-05-01" PDB-revision-number="5" protein-DNA-RNA-entities="1" PDB-resolution="NotAvailable" PDB-resolution-low="NotAvailable" PDB-R="NotAvailable" PDB-Rfree="NotAvailable" pdbid="1LL8" extended_pdbid="1LL8" no-ligands-for-mogul="yes" no-ligands-for-buster-report="yes" clashscore-full-length="31.67" num_bonds_rmsz="17920" num-H-reduce="17780" angles_rmsz="0.65" percent-rama-outliers-full-length="7.81" bonds_rmsz="0.30" num_angles_rmsz="24140" percent-rota-outliers-full-length="43.67" nmrclust_number_of_models="20" nmr_models_consistency_flag="True" shiftchecker_version="v1.2" nmrclust_representative_model="6" chemical_shift_completeness="93.29" nmrclust_number_of_clusters="3" chemical_shift_completeness_full_length="92.50" cyrange_error="success" nmrclust_version="Kelley et al. (1996)" panav_version="Wang et al. (2010)" medoid_model="6" nmrclust_error="success" cyrange_number_of_domains="1" nmrclust_number_of_outliers="0" cyrange_version="Kirchner and G\&quot;{u}ntert (2011)" rci_version="v_1n_11_5_13_A (Berjanski et al., 2005)" clashscore="34.66" percent-rama-outliers="5.90" percent-rota-outliers="45.38" absolute-percentile-clashscore="3.6" numPDBids-absolute-percentile-clashscore="229148" relative-percentile-clashscore="19.8" numPDBids-relative-percentile-clashscore="14424" absolute-percentile-percent-rama-outliers="2.1" numPDBids-absolute-percentile-percent-rama-outliers="224038" relative-percentile-percent-rama-outliers="19.8" numPDBids-relative-percentile-percent-rama-outliers="12848" absolute-percentile-percent-rota-outliers="0.1" numPDBids-absolute-percentile-percent-rota-outliers="223484" relative-percentile-percent-rota-outliers="2.3" numPDBids-relative-percentile-percent-rota-outliers="12823" XMLcreationDate="Mar  5, 2026 -- 06:44 PM UTC" bmrb_id="5354">
		<chemical_shift_list file_id="3" block_name="assigned_chem_shift_list_1" list_id="1" file_name="working_cs.cif" type="full" total_number_of_shifts="1430" number_of_parsed_shifts="1430" number_of_unparsed_shifts="0" number_of_mapped_shifts="1430" number_of_errors_while_mapping="0" number_of_warnings_while_mapping="0">
			<random_coil_index chain="A" resnum="10" rescode="ALA" value="0.033"/>
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			<random_coil_index chain="A" resnum="101" rescode="ARG" value="0.047"/>
			<random_coil_index chain="A" resnum="102" rescode="ARG" value="0.046"/>
			<random_coil_index chain="A" resnum="103" rescode="LEU" value="0.041"/>
			<random_coil_index chain="A" resnum="104" rescode="CYS" value="0.028"/>
			<random_coil_index chain="A" resnum="105" rescode="CYS" value="0.023"/>
			<random_coil_index chain="A" resnum="106" rescode="VAL" value="0.020"/>
			<random_coil_index chain="A" resnum="107" rescode="VAL" value="0.018"/>
			<random_coil_index chain="A" resnum="108" rescode="VAL" value="0.017"/>
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			<random_coil_index chain="A" resnum="11" rescode="ILE" value="0.024"/>
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			<random_coil_index chain="A" resnum="114" rescode="ARG" value="0.102"/>
			<random_coil_index chain="A" resnum="12" rescode="PHE" value="0.020"/>
			<random_coil_index chain="A" resnum="13" rescode="THR" value="0.015"/>
			<random_coil_index chain="A" resnum="14" rescode="VAL" value="0.013"/>
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			<random_coil_index chain="A" resnum="2" rescode="ALA" value="0.207"/>
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			<random_coil_index chain="A" resnum="3" rescode="MET" value="0.179"/>
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			<random_coil_index chain="A" resnum="34" rescode="TYR" value="0.037"/>
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			<random_coil_index chain="A" resnum="48" rescode="PHE" value="0.045"/>
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			<random_coil_index chain="A" resnum="5" rescode="PRO" value="0.101"/>
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			<random_coil_index chain="A" resnum="51" rescode="SER" value="0.093"/>
			<random_coil_index chain="A" resnum="52" rescode="ASP" value="0.055"/>
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			<random_coil_index chain="A" resnum="55" rescode="VAL" value="0.020"/>
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			<random_coil_index chain="A" resnum="62" rescode="GLU" value="0.131"/>
			<random_coil_index chain="A" resnum="63" rescode="HIS" value="0.177"/>
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			<random_coil_index chain="A" resnum="77" rescode="VAL" value="0.041"/>
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			<random_coil_index chain="A" resnum="93" rescode="TRP" value="0.018"/>
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			<random_coil_index chain="A" resnum="95" rescode="LYS" value="0.022"/>
			<random_coil_index chain="A" resnum="96" rescode="ARG" value="0.029"/>
			<random_coil_index chain="A" resnum="97" rescode="MET" value="0.038"/>
			<random_coil_index chain="A" resnum="98" rescode="ARG" value="0.040"/>
			<random_coil_index chain="A" resnum="99" rescode="GLN" value="0.041"/>
			<referencing_offset atom="C" number_of_measurements="105" value="-0.18" uncertainty="0.50" precision="0.09"/>
			<referencing_offset atom="CA" number_of_measurements="112" value="-0.46" uncertainty="0.50" precision="0.14"/>
			<referencing_offset atom="CB" number_of_measurements="106" value="0.08" uncertainty="0.50" precision="0.13"/>
			<referencing_offset atom="N" number_of_measurements="108" value="0.17" uncertainty="0.50" precision="0.26"/>
			<assignment_completeness_well_defined type="stereomethyl" element="stereomethyl" number_of_assigned_shifts="0" number_of_unassigned_shifts="20" number_of_shifts="20"/>
			<assignment_completeness_well_defined element="Total" type="overall" number_of_assigned_shifts="1154" number_of_unassigned_shifts="83" number_of_shifts="1237"/>
			<assignment_completeness_well_defined element="Total" type="backbone" number_of_assigned_shifts="435" number_of_unassigned_shifts="11" number_of_shifts="446"/>
			<assignment_completeness_well_defined element="Total" type="sidechain" number_of_assigned_shifts="660" number_of_unassigned_shifts="70" number_of_shifts="730"/>
			<assignment_completeness_well_defined element="Total" type="aromatic" number_of_assigned_shifts="59" number_of_unassigned_shifts="2" number_of_shifts="61"/>
			<assignment_completeness_well_defined element="H" type="overall" number_of_assigned_shifts="654" number_of_unassigned_shifts="34" number_of_shifts="688"/>
			<assignment_completeness_well_defined element="H" type="backbone" number_of_assigned_shifts="178" number_of_unassigned_shifts="3" number_of_shifts="181"/>
			<assignment_completeness_well_defined element="H" type="sidechain" number_of_assigned_shifts="446" number_of_unassigned_shifts="31" number_of_shifts="477"/>
			<assignment_completeness_well_defined element="H" type="aromatic" number_of_assigned_shifts="30" number_of_unassigned_shifts="0" number_of_shifts="30"/>
			<assignment_completeness_well_defined element="C" type="overall" number_of_assigned_shifts="405" number_of_unassigned_shifts="27" number_of_shifts="432"/>
			<assignment_completeness_well_defined element="C" type="backbone" number_of_assigned_shifts="172" number_of_unassigned_shifts="6" number_of_shifts="178"/>
			<assignment_completeness_well_defined element="C" type="sidechain" number_of_assigned_shifts="205" number_of_unassigned_shifts="19" number_of_shifts="224"/>
			<assignment_completeness_well_defined element="C" type="aromatic" number_of_assigned_shifts="28" number_of_unassigned_shifts="2" number_of_shifts="30"/>
			<assignment_completeness_well_defined element="N" type="overall" number_of_assigned_shifts="95" number_of_unassigned_shifts="22" number_of_shifts="117"/>
			<assignment_completeness_well_defined element="N" type="backbone" number_of_assigned_shifts="85" number_of_unassigned_shifts="2" number_of_shifts="87"/>
			<assignment_completeness_well_defined element="N" type="sidechain" number_of_assigned_shifts="9" number_of_unassigned_shifts="20" number_of_shifts="29"/>
			<assignment_completeness_well_defined element="N" type="aromatic" number_of_assigned_shifts="1" number_of_unassigned_shifts="0" number_of_shifts="1"/>
			<assignment_completeness_full_length type="stereomethyl" element="stereomethyl" number_of_assigned_shifts="0" number_of_unassigned_shifts="23" number_of_shifts="23"/>
			<assignment_completeness_full_length element="Total" type="overall" number_of_assigned_shifts="1430" number_of_unassigned_shifts="116" number_of_shifts="1546"/>
			<assignment_completeness_full_length element="Total" type="backbone" number_of_assigned_shifts="551" number_of_unassigned_shifts="20" number_of_shifts="571"/>
			<assignment_completeness_full_length element="Total" type="sidechain" number_of_assigned_shifts="804" number_of_unassigned_shifts="84" number_of_shifts="888"/>
			<assignment_completeness_full_length element="Total" type="aromatic" number_of_assigned_shifts="75" number_of_unassigned_shifts="12" number_of_shifts="87"/>
			<assignment_completeness_full_length element="H" type="overall" number_of_assigned_shifts="808" number_of_unassigned_shifts="46" number_of_shifts="854"/>
			<assignment_completeness_full_length element="H" type="backbone" number_of_assigned_shifts="226" number_of_unassigned_shifts="6" number_of_shifts="232"/>
			<assignment_completeness_full_length element="H" type="sidechain" number_of_assigned_shifts="544" number_of_unassigned_shifts="35" number_of_shifts="579"/>
			<assignment_completeness_full_length element="H" type="aromatic" number_of_assigned_shifts="38" number_of_unassigned_shifts="5" number_of_shifts="43"/>
			<assignment_completeness_full_length element="C" type="overall" number_of_assigned_shifts="502" number_of_unassigned_shifts="41" number_of_shifts="543"/>
			<assignment_completeness_full_length element="C" type="backbone" number_of_assigned_shifts="217" number_of_unassigned_shifts="11" number_of_shifts="228"/>
			<assignment_completeness_full_length element="C" type="sidechain" number_of_assigned_shifts="249" number_of_unassigned_shifts="27" number_of_shifts="276"/>
			<assignment_completeness_full_length element="C" type="aromatic" number_of_assigned_shifts="36" number_of_unassigned_shifts="3" number_of_shifts="39"/>
			<assignment_completeness_full_length element="N" type="overall" number_of_assigned_shifts="120" number_of_unassigned_shifts="29" number_of_shifts="149"/>
			<assignment_completeness_full_length element="N" type="backbone" number_of_assigned_shifts="108" number_of_unassigned_shifts="3" number_of_shifts="111"/>
			<assignment_completeness_full_length element="N" type="sidechain" number_of_assigned_shifts="11" number_of_unassigned_shifts="22" number_of_shifts="33"/>
			<assignment_completeness_full_length element="N" type="aromatic" number_of_assigned_shifts="1" number_of_unassigned_shifts="4" number_of_shifts="5"/>
		</chemical_shift_list>
	</Entry>
	<Model nmrclust_cluster_id="1" model="1"/>
	<ModelledSubgroup num-H-reduce="5" validate="False" model="1" chain="A" resnum="1" said="A" ent="1" seq="1" icode=" " resname="GLY" altcode=" "/>
	<ModelledSubgroup num-H-reduce="5" phi="-142.8" psi="25.7" rama="Allowed" validate="False" model="1" chain="A" resnum="2" said="A" ent="1" seq="2" icode=" " resname="ALA" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-140.7" psi="-104.8" rama="Allowed" rota="OUTLIER" validate="False" model="1" chain="A" resnum="3" said="A" ent="1" seq="3" icode=" " resname="MET" altcode=" ">
		<clash atom="HB3" dist="1.59" clashmag="0.41" cid="992"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="4" phi="-151.7" psi="-51.4" rama="OUTLIER" rota="OUTLIER" validate="False" model="1" chain="A" resnum="4" said="A" ent="1" seq="4" icode=" " resname="ASP" altcode=" ">
		<clash atom="H" dist="1.70" clashmag="0.47" cid="991"/>
		<clash atom="H" dist="1.59" clashmag="0.41" cid="992"/>
		<clash atom="H" dist="2.28" clashmag="0.41" cid="993"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="7" phi="-47.9" psi="-24.3" rama="Favored" rota="Cg_exo" validate="False" model="1" chain="A" resnum="5" said="A" ent="1" seq="5" icode=" " resname="PRO" altcode=" ">
		<clash atom="HD2" dist="1.70" clashmag="0.47" cid="991"/>
		<clash atom="CD" dist="2.28" clashmag="0.41" cid="993"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="6" phi="-124.6" psi="-12.6" rama="Favored" rota="OUTLIER" validate="False" model="1" chain="A" resnum="6" said="A" ent="1" seq="6" icode=" " resname="GLU" altcode=" "/>
	<ModelledSubgroup num-H-reduce="9" phi="-77.2" psi="-51.9" rama="Favored" rota="t80" validate="False" model="1" chain="A" resnum="7" said="A" ent="1" seq="7" icode=" " resname="PHE" altcode=" "/>
	<ModelledSubgroup num-H-reduce="6" phi="-171.8" psi="45.7" rama="OUTLIER" rota="p0" validate="False" model="1" chain="A" resnum="8" said="A" ent="1" seq="8" icode=" " resname="ASN" altcode=" "/>
	<ModelledSubgroup num-H-reduce="13" phi="-67.7" psi="109.0" rama="Favored" rota="OUTLIER" validate="True" cyrange_domain_id="1" model="1" chain="A" resnum="9" said="A" ent="1" seq="9" icode=" " resname="LYS" altcode=" ">
		<clash atom="HD3" dist="1.69" clashmag="0.63" cid="942"/>
		<clash atom="O" dist="2.07" clashmag="0.49" cid="948"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="5" phi="-75.5" psi="87.8" rama="Favored" validate="True" cyrange_domain_id="1" model="1" chain="A" resnum="10" said="A" ent="1" seq="10" icode=" " resname="ALA" altcode=" ">
		<clash atom="HA" dist="1.75" clashmag="0.58" cid="943"/>
		<clash atom="HA" dist="2.34" clashmag="0.52" cid="946"/>
		<clash atom="O" dist="1.99" clashmag="0.57" cid="944"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="11" phi="-104.0" psi="114.7" rama="Favored" rota="mt" validate="True" cyrange_domain_id="1" model="1" chain="A" resnum="11" said="A" ent="1" seq="11" icode=" " resname="ILE" altcode=" ">
		<clash atom="N" dist="2.02" clashmag="0.70" cid="941"/>
		<clash atom="HD11" dist="1.69" clashmag="0.63" cid="942"/>
		<clash atom="H" dist="1.62" clashmag="0.55" cid="945"/>
		<clash atom="HD12" dist="2.31" clashmag="0.41" cid="951"/>
	</ModelledSubgroup>
	<ModelledSubgroup num-H-reduce="9" phi="-118.5" psi="109.4" rama="Favored" rota="m-80" validate="True" cyrange_domain_id="1" model="1" chain="A" resnum="12" said="A" ent="1" seq="12" icode=" " resname="PHE" altcode=" ">
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	<ModelledEntityInstance bonds_rmsz="0.31" num_bonds_rmsz="896" angles_rmsz="0.65" num_angles_rmsz="1207" absolute_sidechain_percentile="0.03" relative_sidechain_percentile="0.03" absolute_rama_percentile="3.72" relative_rama_percentile="3.72" said="A" model="8" chain="A" ent="1"/>
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	<ModelledEntityInstance bonds_rmsz="0.30" num_bonds_rmsz="896" angles_rmsz="0.64" num_angles_rmsz="1207" absolute_sidechain_percentile="0.07" relative_sidechain_percentile="0.07" absolute_rama_percentile="0.27" relative_rama_percentile="0.27" said="A" model="10" chain="A" ent="1"/>
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	<ModelledEntityInstance bonds_rmsz="0.30" num_bonds_rmsz="896" angles_rmsz="0.64" num_angles_rmsz="1207" absolute_sidechain_percentile="0.01" relative_sidechain_percentile="0.01" absolute_rama_percentile="0.27" relative_rama_percentile="0.27" said="A" model="17" chain="A" ent="1"/>
	<ModelledEntityInstance bonds_rmsz="0.32" num_bonds_rmsz="896" angles_rmsz="0.66" num_angles_rmsz="1207" absolute_sidechain_percentile="0.00" relative_sidechain_percentile="0.00" absolute_rama_percentile="0.89" relative_rama_percentile="0.89" said="A" model="18" chain="A" ent="1"/>
	<ModelledEntityInstance bonds_rmsz="0.30" num_bonds_rmsz="896" angles_rmsz="0.64" num_angles_rmsz="1207" absolute_sidechain_percentile="0.05" relative_sidechain_percentile="0.05" absolute_rama_percentile="2.44" relative_rama_percentile="2.44" said="A" model="19" chain="A" ent="1"/>
	<ModelledEntityInstance bonds_rmsz="0.30" num_bonds_rmsz="896" angles_rmsz="0.64" num_angles_rmsz="1207" absolute_sidechain_percentile="0.09" relative_sidechain_percentile="0.09" absolute_rama_percentile="0.89" relative_rama_percentile="0.89" said="A" model="20" chain="A" ent="1"/>
	<programs>
		<program name="validation-pipeline" version="2.49" properties="extended_pdbid,protein-DNA-RNA-entities,PDB-Rfree,PDB-revision-date,PDB-revision-number,PDB-resolution,PDB-deposition-date,PDB-R,percentilebins,pdbid,XMLcreationDate,PDB-resolution-low,attemptedValidationSteps"/>
		<program name="mogul" version="unknown" properties="no-ligands-for-mogul"/>
		<program name="buster-report" version="unknown" properties="no-ligands-for-buster-report"/>
		<program name="molprobity" version="4-5-2 with Phenix2.0" properties="relative_rama_percentile,angle-outlier,clashscore-full-length,rota,num_bonds_rmsz,num-H-reduce,bond-outlier,angles_rmsz,relative_sidechain_percentile,absolute_sidechain_percentile,absolute_rama_percentile,percent-rama-outliers-full-length,psi,bonds_rmsz,rama,num_angles_rmsz,percent-rota-outliers-full-length,clash,phi"/>
		<program name="coreclust" version="2.49" properties="nmrclust_representative,medoid_model,nmrclust_version,cyrange_number_of_domains,nmrclust_representative_model,nmrclust_number_of_models,nmrclust_error,nmrclust_number_of_outliers,nmrclust_number_of_clusters,cyrange_domain_id,cyrange_version,nmrclust_cluster_id,validate,cyrange_error"/>
		<program name="chemicalshiftanalysis" version="v1.2" properties="shiftchecker_version,panav_version,chemical_shift_completeness_full_length,chemical_shift_completeness,rci_version"/>
		<program name="coreclust" version="unknown" properties="nmr_models_consistency_flag"/>
		<program name="nmrwriter" version="2.49" properties="percent-rota-outliers,clashscore,percent-rama-outliers"/>
		<program name="percentiles" version="20250101.v01 (using entries in the PDB archive January 1st 2025)" properties="numPDBids-relative-percentile-clashscore,numPDBids-absolute-percentile-percent-rota-outliers,numPDBids-relative-percentile-percent-rota-outliers,relative-percentile-percent-rota-outliers,absolute-percentile-clashscore,numPDBids-absolute-percentile-clashscore,numPDBids-absolute-percentile-percent-rama-outliers,relative-percentile-percent-rama-outliers,relative-percentile-clashscore,absolute-percentile-percent-rota-outliers,numPDBids-relative-percentile-percent-rama-outliers,absolute-percentile-percent-rama-outliers"/>
	</programs>
</wwPDB-validation-information>
